A0A5K4F6S8_SCHMA Loading...

Alcohol dehydrogenase transcription factor myb/sant-like protein

AlphaFold DB , UniProt , Accession A0A5K4F6S8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 335 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	36.2	Very low	74.7	Confident	234 Å²	234	120.1 Å²	120.1	100%	1.153	61%	0.605	S	S	*	*				0	103.7	0	-113.4	167.6	174.7	0	0	108.3	M3	M1-M3 PolarHBondContact O-N 2.74Å
2	N	51.1	Low	76.1	Confident	161 Å²	161	111.2 Å²	111.2	86%	0.861	56%	0.563	S	S	*	*			trans	-75.8	103.5	171.1	-81.9	-13.9	0	0	0	107.3	V4	N2-V4 PolarHBondContact O-N 3.48Å
3	M	55.6	Low	77.4	Confident	176 Å²	176	109.6 Å²	109.6	87%	0.867	56%	0.558	S	S	*	*			trans	-61.2	105.8	171.2	-65.5	-169.9	91.3	0	0	107.5	M1 T5	M1-M3 PolarHBondContact O-N 2.74Å; M3-T5 VanDerWaalsContact C-N 3.27Å; M3-T5 PolarHBondContact O-N 2.95Å; M3-T5 PolarHBondContact O-OG1 3.37Å
4	V	62	Low	78.5	Confident	121 Å²	121	105.2 Å²	105.2	73%	0.733	53%	0.534	S	S	*	.			trans	-70.9	91.1	174.5	-179.9	0	0	0	0	107	N2 R6	N2-V4 PolarHBondContact O-N 3.48Å; V4-R6 PolarHBondContact O-N 3.48Å
5	T	75.8	Confident	79.5	Confident	81 Å²	81	98.2 Å²	98.2	50%	0.497	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-63.4	124.7	175.4	-22.9	0	0	0	0	108	M3 R56	M3-T5 VanDerWaalsContact C-N 3.27Å; M3-T5 PolarHBondContact O-N 2.95Å; M3-T5 PolarHBondContact O-OG1 3.37Å; T5-R56 PolarHBondContact O-NH1 2.99Å; T5-R56 PolarHBondContact O-NH2 3Å
6	R	85.2	Confident	80.3	Confident	230 Å²	230	92.4 Å²	92.4	87%	0.868	47%	0.47	S	S	*	.	P	Polyproline II helix	trans	-60.3	150.9	174.5	-67.9	-173.9	176	-141.8	0.2	109.4	V4 T8 R56	V4-R6 PolarHBondContact O-N 3.48Å; R6-T8 PolarHBondContact O-N 2.94Å; R6-R56 PolarHBondContact O-NH2 3.24Å
7	Y	88.3	Confident	81	Confident	50 Å²	50	94.4 Å²	94.4	20%	0.196	48%	0.475	C	S	.	.	P	Polyproline II helix	trans	-69.7	128.2	171.8	-72.8	-93.3	0	0	0	108.5	E11 L15 R56 Q60 L61 K64	Y7-E11 HydrophobicContact CD1-CG 4.02Å; Y7-L15 HydrophobicContact CE1-CD2 4.37Å; Y7-R56 VanDerWaalsContact CA-NH2 3.3Å; Y7-R56 VanDerWaalsContact CD1-CZ 3.44Å; Y7-R56 VanDerWaalsContact CD2-NH1 3.31Å; Y7-R56 VanDerWaalsContact OH-CD 3.3Å; Y7-R56 WeakPolarHBondContact OH-CD 3.46Å; Y7-Q60 PolarHBondContact OH-O 2.94Å; Y7-L61 HydrophobicContact CE1-CD1 4.14Å; Y7-K64 HydrophobicContact CD1-CG 4.25Å; Y7-K64 HydrophobicContact CD2-CD 3.94Å; Y7-K64 HydrophobicContact CD2-CG 4Å; Y7-K64 HydrophobicContact CE1-CB 4.33Å; Y7-K64 HydrophobicContact CE1-CG 4.04Å; Y7-K64 HydrophobicContact CE2-CB 3.85Å; Y7-K64 HydrophobicContact CE2-CD 4.05Å; Y7-K64 HydrophobicContact CE2-CG 3.78Å; Y7-K64 HydrophobicContact CG-CD 4.36Å; Y7-K64 HydrophobicContact CG-CG 4.23Å
8	T	91	Very high	81.7	Confident	58 Å²	58	90.3 Å²	90.3	36%	0.356	45%	0.454	S	S	.	.	P	Polyproline II helix	trans	-69	161.2	167.3	64.1	0	0	0	0	109.3	R6 E10 E11 A12 W53	R6-T8 PolarHBondContact O-N 2.94Å; T8-E10 VanDerWaalsContact C-N 3.27Å; T8-E10 WeakPolarHBondContact CB-OE2 3.4Å; T8-E10 PolarHBondContact O-N 3.39Å; T8-E11 PolarHBondContact O-N 3.2Å; T8-E11 WeakPolarHBondContact OG1-CB 3.33Å; T8-E11 PolarHBondContact OG1-N 2.91Å; T8-A12 WeakPolarHBondContact O-CB 3.36Å; T8-A12 PolarHBondContact O-N 3.17Å; T8-W53 HydrophobicContact CG2-CZ3 4.33Å; T8-W53 WeakPolarHBondContact OG1-CZ3 3.32Å
9	T	90.7	Very high	82.2	Confident	97 Å²	97	85.6 Å²	85.6	60%	0.595	43%	0.431	S	S	*	.	H	α-helix	trans	-63	-39.7	179.6	-57.6	0	0	0	0	110.5	A12 N13	T9-A12 PolarHBondContact O-N 3.23Å; T9-N13 WeakPolarHBondContact O-CB 3.43Å; T9-N13 PolarHBondContact O-N 2.91Å; T9-N13 PolarHBondContact O-ND2 3.09Å
10	E	92.4	Very high	82.6	Confident	111 Å²	111	84.9 Å²	84.9	52%	0.519	43%	0.428	S	S	.	.	H	α-helix	trans	-67	-45.1	-179.7	-59.1	66.9	-138.6	0	0	110.8	T8 A12 N13 E14 W53	T8-E10 VanDerWaalsContact C-N 3.27Å; T8-E10 WeakPolarHBondContact CB-OE2 3.4Å; T8-E10 PolarHBondContact O-N 3.39Å; E10-A12 PolarHBondContact O-N 3.04Å; E10-N13 PolarHBondContact O-N 3.45Å; E10-E14 PolarHBondContact O-N 3.19Å; E10-W53 HydrophobicContact CB-CH2 3.74Å; E10-W53 HydrophobicContact CB-CZ2 3.83Å
11	E	93.1	Very high	82.9	Confident	2 Å²	2	88.1 Å²	88.1	1%	0.009	44%	0.435	C	S	.	.	H	α-helix	trans	-62.5	-43.3	175.7	-176.7	-175.4	-168.2	0	0	111.4	Y7 T8 N13 E14 L15 W53 R56	Y7-E11 HydrophobicContact CD1-CG 4.02Å; T8-E11 PolarHBondContact O-N 3.2Å; T8-E11 WeakPolarHBondContact OG1-CB 3.33Å; T8-E11 PolarHBondContact OG1-N 2.91Å; E11-N13 VanDerWaalsContact C-N 3.33Å; E11-N13 PolarHBondContact O-N 2.98Å; E11-E14 PolarHBondContact O-N 2.94Å; E11-L15 WeakPolarHBondContact O-CB 3.48Å; E11-L15 PolarHBondContact O-N 3.39Å; E11-W53 HydrophobicContact CB-CD2 3.82Å; E11-W53 HydrophobicContact CB-CE3 4.01Å; E11-W53 HydrophobicContact CB-CG 4.26Å; E11-W53 HydrophobicContact CB-CZ2 4.35Å; E11-W53 HydrophobicContact CB-CZ3 4.36Å; E11-W53 HydrophobicContact CG-CB 4.28Å; E11-W53 HydrophobicContact CG-CD2 4.03Å; E11-W53 HydrophobicContact CG-CE3 4.46Å; E11-W53 HydrophobicContact CG-CG 3.92Å; E11-R56 VanDerWaalsContact CD-NE 3.35Å; E11-R56 WeakPolarHBondContact OE1-CD 3.25Å; E11-R56 IonicContact OE1-CZ 2.66Å; E11-R56 IonicContact OE1-NE 3.56Å; E11-R56 PolarHBondContact OE1-NE 3.47Å; E11-R56 IonicContact OE1-NH2 2.72Å; E11-R56 IonicContact OE2-CZ 3.33Å; E11-R56 IonicContact OE2-NE 3.5Å; E11-R56 PolarHBondContact OE2-NE 3.42Å; E11-R56 IonicContact OE2-NH2 3.34Å; E11-R56 PolarHBondContact OE2-NH2 2.93Å
12	A	92.4	Very high	85.3	Confident	13 Å²	13	77.7 Å²	77.7	11%	0.107	38%	0.383	C	S	.	.	H	α-helix	trans	-65.1	-37.1	177.3	0	0	0	0	0	112.1	T8 T9 E10 L15 A16	T8-A12 WeakPolarHBondContact O-CB 3.36Å; T8-A12 PolarHBondContact O-N 3.17Å; T9-A12 PolarHBondContact O-N 3.23Å; E10-A12 PolarHBondContact O-N 3.04Å; A12-L15 PolarHBondContact O-N 3.41Å; A12-A16 WeakPolarHBondContact O-CB 3.43Å; A12-A16 PolarHBondContact O-N 3.24Å
13	N	92.3	Very high	86.9	Confident	91 Å²	91	74.9 Å²	74.9	49%	0.487	36%	0.36	S	S	.	.	H	α-helix	trans	-67.4	-41.7	175.8	-77.4	-18.8	0	0	0	111.9	T9 E10 E11 A16 K17	T9-N13 WeakPolarHBondContact O-CB 3.43Å; T9-N13 PolarHBondContact O-N 2.91Å; T9-N13 PolarHBondContact O-ND2 3.09Å; E10-N13 PolarHBondContact O-N 3.45Å; E11-N13 VanDerWaalsContact C-N 3.33Å; E11-N13 PolarHBondContact O-N 2.98Å; N13-A16 WeakPolarHBondContact O-CB 3.42Å; N13-A16 PolarHBondContact O-N 3.32Å; N13-K17 WeakPolarHBondContact O-CG 3.48Å; N13-K17 PolarHBondContact O-N 3.38Å
14	E	92.7	Very high	88.1	Confident	48 Å²	48	71.5 Å²	71.5	22%	0.224	35%	0.346	C	S	.	.	H	α-helix	trans	-64.7	-42.7	174.2	-74.8	-54.9	131.6	0	0	111.9	E10 E11 A16 K17 L18 L48	E10-E14 PolarHBondContact O-N 3.19Å; E11-E14 PolarHBondContact O-N 2.94Å; E14-A16 VanDerWaalsContact C-N 3.31Å; E14-A16 PolarHBondContact O-N 2.91Å; E14-K17 PolarHBondContact O-N 2.94Å; E14-K17 IonicContact OE1-NZ 3.55Å; E14-K17 PolarHBondContact OE1-NZ 3.27Å; E14-L18 WeakPolarHBondContact O-CG 3.46Å; E14-L18 PolarHBondContact O-N 2.94Å; E14-L48 HydrophobicContact CB-CD2 3.97Å
15	L	94.2	Very high	89.1	Confident	0 Å²	0	68.6 Å²	68.6	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-60.1	-42.1	172.4	179.6	59.1	0	0	0	111.7	Y7 E11 A12 L18 V19 W41 F44 L48 L61 K64 L68	Y7-L15 HydrophobicContact CE1-CD2 4.37Å; E11-L15 WeakPolarHBondContact O-CB 3.48Å; E11-L15 PolarHBondContact O-N 3.39Å; A12-L15 PolarHBondContact O-N 3.41Å; L15-L18 PolarHBondContact O-N 2.86Å; L15-V19 HydrophobicContact CD1-CG2 4.03Å; L15-V19 HydrophobicContact CG-CG2 4.36Å; L15-V19 VanDerWaalsContact O-CG2 3.28Å; L15-V19 WeakPolarHBondContact O-CG2 3.33Å; L15-V19 PolarHBondContact O-N 3.25Å; L15-W41 HydrophobicContact CD1-CZ3 4.25Å; L15-F44 HydrophobicContact CD1-CD2 4.44Å; L15-L48 HydrophobicContact CB-CD1 4.35Å; L15-L48 HydrophobicContact CD1-CD1 4.21Å; L15-L61 HydrophobicContact CD1-CD1 4.07Å; L15-L61 HydrophobicContact CD1-CD2 3.86Å; L15-L61 HydrophobicContact CD1-CG 3.68Å; L15-L61 HydrophobicContact CD2-CD1 3.93Å; L15-L61 HydrophobicContact CD2-CG 4.05Å; L15-K64 HydrophobicContact CD2-CB 3.96Å; L15-K64 HydrophobicContact CD2-CG 3.78Å; L15-L68 HydrophobicContact CB-CD1 4.45Å; L15-L68 HydrophobicContact CD2-CD1 4.18Å; L15-L68 HydrophobicContact CG-CD1 4.21Å
16	A	92.7	Very high	89.2	Confident	6 Å²	6	66.5 Å²	66.5	5%	0.05	31%	0.308	C	S	.	.	H	α-helix	trans	-60.4	-45.4	176.2	0	0	0	0	0	112	A12 N13 E14 L18 V19 L20 L68 F72	A12-A16 WeakPolarHBondContact O-CB 3.43Å; A12-A16 PolarHBondContact O-N 3.24Å; N13-A16 WeakPolarHBondContact O-CB 3.42Å; N13-A16 PolarHBondContact O-N 3.32Å; E14-A16 VanDerWaalsContact C-N 3.31Å; E14-A16 PolarHBondContact O-N 2.91Å; A16-L18 VanDerWaalsContact C-N 3.33Å; A16-L18 PolarHBondContact O-N 3.09Å; A16-V19 PolarHBondContact O-N 3.49Å; A16-L20 WeakPolarHBondContact O-CB 3.36Å; A16-L20 VanDerWaalsContact O-CG 3.31Å; A16-L20 WeakPolarHBondContact O-CG 3.42Å; A16-L20 PolarHBondContact O-N 2.86Å; A16-L68 HydrophobicContact CB-CD1 4.22Å; A16-F72 HydrophobicContact CB-CE2 3.74Å; A16-F72 HydrophobicContact CB-CZ 3.68Å
17	K	92.2	Very high	88.7	Confident	126 Å²	126	61.4 Å²	61.4	55%	0.548	29%	0.292	S	S	.	.	H	α-helix	trans	-57.8	-45.2	175.9	-71.4	173	-171.2	172.2	0	111.6	N13 E14 R21	N13-K17 WeakPolarHBondContact O-CG 3.48Å; N13-K17 PolarHBondContact O-N 3.38Å; E14-K17 PolarHBondContact O-N 2.94Å; E14-K17 IonicContact OE1-NZ 3.55Å; E14-K17 PolarHBondContact OE1-NZ 3.27Å; K17-R21 VanDerWaalsContact O-CB 3.25Å; K17-R21 WeakPolarHBondContact O-CB 3.48Å; K17-R21 PolarHBondContact O-N 3.28Å
18	L	92.9	Very high	87.8	Confident	20 Å²	20	61.9 Å²	61.9	11%	0.105	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-49.5	177	-69.2	167.3	0	0	0	111.5	E14 L15 A16 L20 R21 Y22 F44 Y47 L48	E14-L18 WeakPolarHBondContact O-CG 3.46Å; E14-L18 PolarHBondContact O-N 2.94Å; L15-L18 PolarHBondContact O-N 2.86Å; A16-L18 VanDerWaalsContact C-N 3.33Å; A16-L18 PolarHBondContact O-N 3.09Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L20 PolarHBondContact O-N 3.48Å; L18-R21 PolarHBondContact O-N 3.45Å; L18-Y22 VanDerWaalsContact O-CD2 3.29Å; L18-Y22 WeakPolarHBondContact O-CD2 3.34Å; L18-Y22 PolarHBondContact O-N 2.69Å; L18-Y22 VanDerWaalsContact O-N 3.09Å; L18-F44 HydrophobicContact CB-CD1 4.49Å; L18-F44 HydrophobicContact CB-CD2 4.18Å; L18-F44 HydrophobicContact CB-CE1 4.26Å; L18-F44 HydrophobicContact CB-CE2 3.94Å; L18-F44 HydrophobicContact CB-CG 4.47Å; L18-F44 HydrophobicContact CB-CZ 4Å; L18-F44 HydrophobicContact CD1-CB 4.49Å; L18-F44 HydrophobicContact CD1-CD1 4.43Å; L18-F44 HydrophobicContact CD1-CG 4.28Å; L18-F44 HydrophobicContact CD2-CE1 4.43Å; L18-Y47 HydrophobicContact CD1-CD1 3.58Å; L18-Y47 HydrophobicContact CD1-CE1 3.89Å; L18-Y47 HydrophobicContact CD2-CD1 4.14Å; L18-Y47 HydrophobicContact CD2-CE1 4.08Å; L18-Y47 HydrophobicContact CG-CD1 4.4Å; L18-Y47 HydrophobicContact CG-CE1 4.34Å; L18-L48 HydrophobicContact CD1-CD2 4.21Å; L18-L48 HydrophobicContact CD1-CG 4.26Å
19	V	91.7	Very high	86.5	Confident	2 Å²	2	68.9 Å²	68.9	1%	0.012	32%	0.324	C	S	.	.	H	α-helix	trans	-61.9	-40.4	-178.6	172.5	0	0	0	0	111.4	L15 A16 Y22 R23 W26 W41 F44 L69	L15-V19 HydrophobicContact CD1-CG2 4.03Å; L15-V19 HydrophobicContact CG-CG2 4.36Å; L15-V19 VanDerWaalsContact O-CG2 3.28Å; L15-V19 WeakPolarHBondContact O-CG2 3.33Å; L15-V19 PolarHBondContact O-N 3.25Å; A16-V19 PolarHBondContact O-N 3.49Å; V19-Y22 CarbonylContact O-C 3.51Å; V19-Y22 PolarHBondContact O-N 2.93Å; V19-R23 PolarHBondContact O-N 3.45Å; V19-R23 VanDerWaalsContact O-N 3.11Å; V19-W26 PolarHBondContact O-NE1 2.71Å; V19-W41 HydrophobicContact CG2-CH2 3.72Å; V19-W41 HydrophobicContact CG2-CZ3 4.03Å; V19-F44 HydrophobicContact CG2-CE2 4.25Å; V19-L69 HydrophobicContact CG1-CB 4.18Å; V19-L69 HydrophobicContact CG1-CD1 4.2Å
20	L	88.8	Confident	85.1	Confident	71 Å²	71	73.2 Å²	73.2	37%	0.372	33%	0.334	S	S	.	.	H	α-helix	trans	-68.9	-40.7	176.1	-72.1	173.4	0	0	0	112.4	A16 L18 Y22 R23 L69 F72	A16-L20 WeakPolarHBondContact O-CB 3.36Å; A16-L20 VanDerWaalsContact O-CG 3.31Å; A16-L20 WeakPolarHBondContact O-CG 3.42Å; A16-L20 PolarHBondContact O-N 2.86Å; L18-L20 VanDerWaalsContact C-N 3.31Å; L18-L20 PolarHBondContact O-N 3.48Å; L20-Y22 PolarHBondContact O-N 2.95Å; L20-R23 WeakPolarHBondContact O-CB 3.45Å; L20-R23 PolarHBondContact O-N 3.09Å; L20-R23 VanDerWaalsContact O-N 3.14Å; L20-L69 HydrophobicContact CD2-CD1 4.48Å; L20-F72 HydrophobicContact CD1-CD2 4.23Å; L20-F72 HydrophobicContact CD1-CE2 4.01Å; L20-F72 HydrophobicContact CD1-CZ 4.18Å; L20-F72 HydrophobicContact CD2-CD2 3.95Å; L20-F72 HydrophobicContact CD2-CE2 4.47Å; L20-F72 HydrophobicContact CD2-CG 4.31Å; L20-F72 HydrophobicContact CG-CD2 4.19Å; L20-F72 HydrophobicContact CG-CE2 4.21Å
21	R	89.3	Confident	83.2	Confident	153 Å²	153	75.1 Å²	75.1	58%	0.577	34%	0.343	S	S	*	.	H	α-helix	trans	-59.8	-35.2	176.5	179.8	177.7	-80.2	-161.5	-1.7	112.2	K17 L18 P125	K17-R21 VanDerWaalsContact O-CB 3.25Å; K17-R21 WeakPolarHBondContact O-CB 3.48Å; K17-R21 PolarHBondContact O-N 3.28Å; L18-R21 PolarHBondContact O-N 3.45Å; R21-P125 HydrophobicContact CG-CB 3.71Å; R21-P125 HydrophobicContact CG-CG 4.45Å
22	Y	86.9	Confident	81.9	Confident	15 Å²	15	75.8 Å²	75.8	6%	0.059	35%	0.348	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.1	20.6	178.4	-64.8	-79.9	0	0	0	113.2	L18 V19 L20 D24 I25 W26 L40 F44 P125 L127	L18-Y22 VanDerWaalsContact O-CD2 3.29Å; L18-Y22 WeakPolarHBondContact O-CD2 3.34Å; L18-Y22 PolarHBondContact O-N 2.69Å; L18-Y22 VanDerWaalsContact O-N 3.09Å; V19-Y22 CarbonylContact O-C 3.51Å; V19-Y22 PolarHBondContact O-N 2.93Å; L20-Y22 PolarHBondContact O-N 2.95Å; Y22-D24 PolarHBondContact O-N 3.07Å; Y22-D24 VanDerWaalsContact O-N 3.15Å; Y22-I25 HydrophobicContact CD1-CD1 3.56Å; Y22-I25 HydrophobicContact CD1-CG1 4.47Å; Y22-I25 HydrophobicContact CE1-CD1 4.41Å; Y22-I25 HydrophobicContact CG-CD1 4.37Å; Y22-I25 WeakPolarHBondContact O-CB 3.35Å; Y22-I25 PolarHBondContact O-N 3.32Å; Y22-I25 VanDerWaalsContact O-N 3.1Å; Y22-W26 PolarHBondContact O-NE1 3.36Å; Y22-L40 HydrophobicContact CD1-CD1 4.47Å; Y22-L40 HydrophobicContact CD1-CD2 4.34Å; Y22-L40 HydrophobicContact CG-CD1 4.49Å; Y22-L40 HydrophobicContact CG-CD2 4.2Å; Y22-F44 AromaticContact CD2-CE1 3.6Å; Y22-F44 HydrophobicContact CD2-CE1 3.6Å; Y22-F44 AromaticContact CD2-CZ 3.41Å; Y22-F44 HydrophobicContact CD2-CZ 3.41Å; Y22-F44 VanDerWaalsContact CD2-CZ 3.41Å; Y22-F44 AromaticContact CE2-CE1 3.79Å; Y22-F44 HydrophobicContact CE2-CE1 3.79Å; Y22-F44 HydrophobicContact CE2-CZ 4.1Å; Y22-F44 HydrophobicContact CG-CE1 4.4Å; Y22-F44 HydrophobicContact CG-CZ 4.03Å; Y22-P125 HydrophobicContact CE1-CB 4.29Å; Y22-P125 HydrophobicContact CE1-CG 4.1Å; Y22-L127 HydrophobicContact CE1-CD1 3.95Å; Y22-L127 WeakPolarHBondContact OH-CD1 3.47Å; Y22-L127 VanDerWaalsContact OH-CG 3.27Å; Y22-L127 WeakPolarHBondContact OH-CG 3.39Å
23	R	85.4	Confident	81.1	Confident	102 Å²	102	78 Å²	78	39%	0.385	36%	0.362	S	S	.	.	H	α-helix	trans	-51.9	-40	-177.1	-173.3	-170.5	70.3	-166.1	-5.3	113.2	V19 L20 I25 W26 K27 L69	V19-R23 PolarHBondContact O-N 3.45Å; V19-R23 VanDerWaalsContact O-N 3.11Å; L20-R23 WeakPolarHBondContact O-CB 3.45Å; L20-R23 PolarHBondContact O-N 3.09Å; L20-R23 VanDerWaalsContact O-N 3.14Å; R23-I25 VanDerWaalsContact C-N 3.3Å; R23-I25 PolarHBondContact O-N 3.07Å; R23-W26 PolarHBondContact O-N 3.33Å; R23-W26 VanDerWaalsContact O-N 3.11Å; R23-K27 HydrophobicContact CG-CD 4.29Å; R23-K27 HydrophobicContact CG-CG 4.45Å; R23-K27 PolarHBondContact O-N 3.22Å; R23-K27 VanDerWaalsContact O-N 3.08Å; R23-L69 HydrophobicContact CG-CD1 4.37Å
24	D	80.9	Confident	80.6	Confident	105 Å²	105	78 Å²	78	56%	0.561	37%	0.37	S	S	*	.	H	α-helix	trans	-70	-31.1	-174	-56.4	-26.6	0	0	0	111.6	Y22 W26 K27 D28	Y22-D24 PolarHBondContact O-N 3.07Å; Y22-D24 VanDerWaalsContact O-N 3.15Å; D24-W26 VanDerWaalsContact C-N 3.28Å; D24-W26 PolarHBondContact O-N 3.02Å; D24-K27 PolarHBondContact O-N 3.16Å; D24-D28 WeakPolarHBondContact O-CB 3.3Å; D24-D28 PolarHBondContact O-N 3.08Å; D24-D28 VanDerWaalsContact O-N 3.16Å
25	I	81.6	Confident	80.2	Confident	60 Å²	60	81.6 Å²	81.6	31%	0.308	39%	0.39	S	S	.	.	H	α-helix	trans	-63.7	-36.6	172.4	-56.8	-174.9	0	0	0	110.6	Y22 R23 S32 L40	Y22-I25 HydrophobicContact CD1-CD1 3.56Å; Y22-I25 HydrophobicContact CD1-CG1 4.47Å; Y22-I25 HydrophobicContact CE1-CD1 4.41Å; Y22-I25 HydrophobicContact CG-CD1 4.37Å; Y22-I25 WeakPolarHBondContact O-CB 3.35Å; Y22-I25 PolarHBondContact O-N 3.32Å; Y22-I25 VanDerWaalsContact O-N 3.1Å; R23-I25 VanDerWaalsContact C-N 3.3Å; R23-I25 PolarHBondContact O-N 3.07Å; I25-S32 WeakPolarHBondContact O-CB 3.48Å; I25-S32 PolarHBondContact O-OG 2.96Å; I25-S32 VanDerWaalsContact O-OG 3.08Å; I25-L40 HydrophobicContact CB-CD2 4.49Å; I25-L40 HydrophobicContact CD1-CD2 3.93Å; I25-L40 HydrophobicContact CG2-CD2 4.15Å
26	W	78.3	Confident	79.8	Confident	37 Å²	37	85.2 Å²	85.2	14%	0.14	41%	0.412	C	S	.	.	H	α-helix	trans	-77.8	-32	-178.9	-47.8	127.2	0	0	0	113.2	V19 Y22 R23 D24 Q37 L40 W41 F44	V19-W26 PolarHBondContact O-NE1 2.71Å; Y22-W26 PolarHBondContact O-NE1 3.36Å; R23-W26 PolarHBondContact O-N 3.33Å; R23-W26 VanDerWaalsContact O-N 3.11Å; D24-W26 VanDerWaalsContact C-N 3.28Å; D24-W26 PolarHBondContact O-N 3.02Å; W26-Q37 HydrophobicContact CE3-CG 4.05Å; W26-Q37 HydrophobicContact CZ3-CB 3.82Å; W26-Q37 HydrophobicContact CZ3-CG 3.82Å; W26-L40 HydrophobicContact CH2-CB 3.93Å; W26-L40 HydrophobicContact CH2-CD2 3.44Å; W26-L40 VanDerWaalsContact CH2-CD2 3.44Å; W26-L40 HydrophobicContact CH2-CG 3.74Å; W26-L40 HydrophobicContact CZ2-CD2 3.42Å; W26-L40 VanDerWaalsContact CZ2-CD2 3.42Å; W26-L40 HydrophobicContact CZ2-CG 3.9Å; W26-L40 HydrophobicContact CZ3-CD2 4.17Å; W26-W41 AromaticContact CH2-CD1 3.87Å; W26-W41 HydrophobicContact CH2-CD2 4.01Å; W26-W41 AromaticContact CH2-CE2 3.46Å; W26-W41 VanDerWaalsContact CH2-CE2 3.46Å; W26-W41 HydrophobicContact CH2-CG 4.23Å; W26-W41 AromaticContact CH2-CZ2 3.84Å; W26-W41 HydrophobicContact CH2-CZ2 3.84Å; W26-W41 AromaticContact CH2-NE1 3.35Å; W26-W41 VanDerWaalsContact CH2-NE1 3.35Å; W26-W41 AromaticContact CZ2-CE2 3.98Å; W26-W41 HydrophobicContact CZ2-CH2 4.39Å; W26-W41 AromaticContact CZ2-CZ2 3.91Å; W26-W41 HydrophobicContact CZ2-CZ2 3.91Å; W26-W41 AromaticContact CZ3-CE2 3.87Å; W26-W41 HydrophobicContact CZ3-CZ2 4.24Å; W26-W41 AromaticContact CZ3-NE1 3.36Å; W26-F44 AromaticContact CZ2-CE2 3.83Å; W26-F44 HydrophobicContact CZ2-CE2 3.83Å; W26-F44 HydrophobicContact CZ2-CZ 4.06Å
27	K	75.2	Confident	79.5	Confident	122 Å²	122	86.8 Å²	86.8	53%	0.53	42%	0.418	S	S	.	.	H	α-helix	trans	-77.1	-28.4	-179.8	-74.6	-171.5	174.2	-171.5	0	112.6	R23 D24 K29	R23-K27 HydrophobicContact CG-CD 4.29Å; R23-K27 HydrophobicContact CG-CG 4.45Å; R23-K27 PolarHBondContact O-N 3.22Å; R23-K27 VanDerWaalsContact O-N 3.08Å; D24-K27 PolarHBondContact O-N 3.16Å; K27-K29 PolarHBondContact O-N 3.18Å
28	D	69.3	Low	79.4	Confident	61 Å²	61	85.1 Å²	85.1	33%	0.326	41%	0.411	S	S	.	.			trans	-76.6	89.9	-178.4	-163.7	-23.7	0	0	0	111.8	D24 K30 H31 S32	D24-D28 WeakPolarHBondContact O-CB 3.3Å; D24-D28 PolarHBondContact O-N 3.08Å; D24-D28 VanDerWaalsContact O-N 3.16Å; D28-K30 PolarHBondContact O-N 2.84Å; D28-K30 PolarHBondContact OD1-N 3.02Å; D28-H31 IonicContact OD1-CD2 2.74Å; D28-H31 PolarHBondContact OD1-CD2 3.38Å; D28-H31 VanDerWaalsContact OD1-CD2 3.32Å; D28-H31 IonicContact OD1-CG 3.72Å; D28-H31 PolarHBondContact OD1-N 2.96Å; D28-H31 WeakPolarHBondContact OD2-CB 3.26Å; D28-H31 IonicContact OD2-CD2 3.86Å; D28-H31 PolarHBondContact OD2-CD2 3.05Å; D28-H31 IonicContact OD2-CG 3.32Å; D28-S32 PolarHBondContact O-N 3.49Å; D28-S32 PolarHBondContact O-OG 3.37Å
29	K	64.4	Low	79.2	Confident	204 Å²	204	89.1 Å²	89.1	89%	0.887	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62	-20.3	175.2	-68.4	-174.3	178.9	-177.2	0	113.1	K27	K27-K29 PolarHBondContact O-N 3.18Å
30	K	60.1	Low	79.2	Confident	188 Å²	188	89.7 Å²	89.7	82%	0.817	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.3	-31.2	-174.1	-65.1	-173.3	179.6	-176.3	0	112.3	D28	D28-K30 PolarHBondContact O-N 2.84Å; D28-K30 PolarHBondContact OD1-N 3.02Å
31	H	53.1	Low	79.5	Confident	151 Å²	151	86.6 Å²	86.6	70%	0.699	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-112	-16.9	-171.2	-63.8	-73.8	0	0	0	114.9	D28 S33	D28-H31 IonicContact OD1-CD2 2.74Å; D28-H31 PolarHBondContact OD1-CD2 3.38Å; D28-H31 VanDerWaalsContact OD1-CD2 3.32Å; D28-H31 IonicContact OD1-CG 3.72Å; D28-H31 PolarHBondContact OD1-N 2.96Å; D28-H31 WeakPolarHBondContact OD2-CB 3.26Å; D28-H31 IonicContact OD2-CD2 3.86Å; D28-H31 PolarHBondContact OD2-CD2 3.05Å; D28-H31 IonicContact OD2-CG 3.32Å; H31-S33 PolarHBondContact O-N 3.42Å
32	S	65.7	Low	79.7	Confident	17 Å²	17	82.3 Å²	82.3	12%	0.119	40%	0.403	C	S	.	.			trans	-88.7	86.9	178	63.8	0	0	0	0	111.7	I25 D28 S34 Q37	I25-S32 WeakPolarHBondContact O-CB 3.48Å; I25-S32 PolarHBondContact O-OG 2.96Å; I25-S32 VanDerWaalsContact O-OG 3.08Å; D28-S32 PolarHBondContact O-N 3.49Å; D28-S32 PolarHBondContact O-OG 3.37Å; S32-S34 PolarHBondContact O-N 2.91Å; S32-Q37 PolarHBondContact OG-NE2 2.89Å
33	S	76.2	Confident	79.9	Confident	58 Å²	58	84.1 Å²	84.1	41%	0.406	41%	0.411	S	S	.	.			trans	-51.5	139.7	167.8	172	0	0	0	0	109.9	H31 L35 V36 Q37	H31-S33 PolarHBondContact O-N 3.42Å; S33-L35 PolarHBondContact O-N 3.34Å; S33-L35 PolarHBondContact OG-N 3.41Å; S33-V36 WeakPolarHBondContact O-CA 3.36Å; S33-V36 WeakPolarHBondContact O-CB 3.47Å; S33-V36 PolarHBondContact O-N 3.16Å; S33-Q37 PolarHBondContact O-N 2.93Å
34	S	81.5	Confident	80.3	Confident	92 Å²	92	79.5 Å²	79.5	64%	0.643	39%	0.394	S	S	*	.	H	α-helix	trans	-52	-29.6	175.7	59.3	0	0	0	0	112.2	S32 K38	S32-S34 PolarHBondContact O-N 2.91Å; S34-K38 WeakPolarHBondContact O-CB 3.41Å; S34-K38 PolarHBondContact O-N 2.98Å
35	L	83.7	Confident	81	Confident	124 Å²	124	75.4 Å²	75.4	65%	0.649	37%	0.374	S	S	*	.	H	α-helix	trans	-67.4	-42.2	173.8	-65.4	176.6	0	0	0	112.8	S33 Q37 K38 H39	S33-L35 PolarHBondContact O-N 3.34Å; S33-L35 PolarHBondContact OG-N 3.41Å; L35-Q37 VanDerWaalsContact C-N 3.34Å; L35-K38 PolarHBondContact O-N 3Å; L35-H39 WeakPolarHBondContact O-CB 3.38Å; L35-H39 PolarHBondContact O-N 3.45Å
36	V	85.1	Confident	81.5	Confident	75 Å²	75	77.7 Å²	77.7	46%	0.455	38%	0.383	S	S	.	.	H	α-helix	trans	-64.2	-44.1	175.9	175.3	0	0	0	0	109.6	S33 H39 L40	S33-V36 WeakPolarHBondContact O-CA 3.36Å; S33-V36 WeakPolarHBondContact O-CB 3.47Å; S33-V36 PolarHBondContact O-N 3.16Å; V36-H39 PolarHBondContact O-N 2.93Å; V36-L40 WeakPolarHBondContact O-CB 3.36Å; V36-L40 PolarHBondContact O-N 3.47Å
37	Q	87.2	Confident	82.2	Confident	40 Å²	40	78.3 Å²	78.3	19%	0.187	39%	0.386	C	S	.	.	H	α-helix	trans	-60.9	-47.6	175.9	-65.3	-170.3	8.8	0	0	111.6	W26 S32 S33 L35 H39 L40 W41	W26-Q37 HydrophobicContact CE3-CG 4.05Å; W26-Q37 HydrophobicContact CZ3-CB 3.82Å; W26-Q37 HydrophobicContact CZ3-CG 3.82Å; S32-Q37 PolarHBondContact OG-NE2 2.89Å; S33-Q37 PolarHBondContact O-N 2.93Å; L35-Q37 VanDerWaalsContact C-N 3.34Å; Q37-H39 VanDerWaalsContact C-N 3.34Å; Q37-H39 PolarHBondContact O-N 3.01Å; Q37-L40 PolarHBondContact O-N 3.37Å; Q37-W41 PolarHBondContact O-N 3.3Å
38	K	89.9	Confident	83.1	Confident	90 Å²	90	72.7 Å²	72.7	39%	0.391	36%	0.362	S	S	.	.	H	α-helix	trans	-56.8	-48.1	175.5	180	179.2	178	176.2	0	111.1	S34 L35 L40 W41 M42 W58	S34-K38 WeakPolarHBondContact O-CB 3.41Å; S34-K38 PolarHBondContact O-N 2.98Å; L35-K38 PolarHBondContact O-N 3Å; K38-L40 VanDerWaalsContact C-N 3.33Å; K38-L40 PolarHBondContact O-N 3.2Å; K38-W41 PolarHBondContact O-N 3.28Å; K38-M42 HydrophobicContact CG-CE 4.33Å; K38-M42 WeakPolarHBondContact O-CG 3.46Å; K38-M42 PolarHBondContact O-N 3.48Å; K38-W58 HydrophobicContact CD-CZ2 4.42Å; K38-W58 HydrophobicContact CG-CH2 4.24Å; K38-W58 HydrophobicContact CG-CZ2 4.2Å
39	H	89.9	Confident	84.2	Confident	105 Å²	105	74.1 Å²	74.1	49%	0.486	37%	0.366	S	S	.	.	H	α-helix	trans	-60	-43.9	178.9	-171.2	76.9	0	0	0	112	L35 V36 Q37 W41 M42 Q43	L35-H39 WeakPolarHBondContact O-CB 3.38Å; L35-H39 PolarHBondContact O-N 3.45Å; V36-H39 PolarHBondContact O-N 2.93Å; Q37-H39 VanDerWaalsContact C-N 3.34Å; Q37-H39 PolarHBondContact O-N 3.01Å; H39-W41 PolarHBondContact O-N 3.46Å; H39-M42 HydrophobicContact CB-CE 4.35Å; H39-M42 WeakPolarHBondContact O-CB 3.1Å; H39-M42 PolarHBondContact O-N 3.3Å; H39-Q43 WeakPolarHBondContact O-CG 3.44Å; H39-Q43 PolarHBondContact O-N 3.17Å
40	L	91.4	Very high	85.5	Confident	13 Å²	13	67.4 Å²	67.4	7%	0.068	35%	0.345	C	S	.	.	H	α-helix	trans	-64	-41.6	178.7	-172.2	56.7	0	0	0	112.4	Y22 I25 W26 V36 Q37 K38 M42 Q43 F44	Y22-L40 HydrophobicContact CD1-CD1 4.47Å; Y22-L40 HydrophobicContact CD1-CD2 4.34Å; Y22-L40 HydrophobicContact CG-CD1 4.49Å; Y22-L40 HydrophobicContact CG-CD2 4.2Å; I25-L40 HydrophobicContact CB-CD2 4.49Å; I25-L40 HydrophobicContact CD1-CD2 3.93Å; I25-L40 HydrophobicContact CG2-CD2 4.15Å; W26-L40 HydrophobicContact CH2-CB 3.93Å; W26-L40 HydrophobicContact CH2-CD2 3.44Å; W26-L40 VanDerWaalsContact CH2-CD2 3.44Å; W26-L40 HydrophobicContact CH2-CG 3.74Å; W26-L40 HydrophobicContact CZ2-CD2 3.42Å; W26-L40 VanDerWaalsContact CZ2-CD2 3.42Å; W26-L40 HydrophobicContact CZ2-CG 3.9Å; W26-L40 HydrophobicContact CZ3-CD2 4.17Å; V36-L40 WeakPolarHBondContact O-CB 3.36Å; V36-L40 PolarHBondContact O-N 3.47Å; Q37-L40 PolarHBondContact O-N 3.37Å; K38-L40 VanDerWaalsContact C-N 3.33Å; K38-L40 PolarHBondContact O-N 3.2Å; L40-M42 VanDerWaalsContact C-N 3.33Å; L40-M42 PolarHBondContact O-N 3.43Å; L40-Q43 WeakPolarHBondContact O-CB 3.44Å; L40-Q43 PolarHBondContact O-N 3.14Å; L40-F44 HydrophobicContact CD1-CD1 4.17Å; L40-F44 HydrophobicContact CD1-CE1 3.5Å; L40-F44 VanDerWaalsContact CD1-CE1 3.5Å; L40-F44 HydrophobicContact CD1-CZ 4Å; L40-F44 HydrophobicContact CD2-CZ 4.3Å; L40-F44 HydrophobicContact CG-CD1 4.47Å; L40-F44 HydrophobicContact CG-CE1 3.84Å; L40-F44 HydrophobicContact CG-CZ 3.88Å; L40-F44 WeakPolarHBondContact O-CD1 3.41Å; L40-F44 WeakPolarHBondContact O-CG 3.5Å; L40-F44 PolarHBondContact O-N 3.03Å
41	W	94.1	Very high	87	Confident	6 Å²	6	64.4 Å²	64.4	2%	0.023	33%	0.332	C	S	.	.	H	α-helix	trans	-64.3	-36.7	174.3	-73.1	116.3	0	0	0	113	L15 V19 W26 Q37 K38 H39 F44 S45 W58 L61 R62	L15-W41 HydrophobicContact CD1-CZ3 4.25Å; V19-W41 HydrophobicContact CG2-CH2 3.72Å; V19-W41 HydrophobicContact CG2-CZ3 4.03Å; W26-W41 AromaticContact CH2-CD1 3.87Å; W26-W41 HydrophobicContact CH2-CD2 4.01Å; W26-W41 AromaticContact CH2-CE2 3.46Å; W26-W41 VanDerWaalsContact CH2-CE2 3.46Å; W26-W41 HydrophobicContact CH2-CG 4.23Å; W26-W41 AromaticContact CH2-CZ2 3.84Å; W26-W41 HydrophobicContact CH2-CZ2 3.84Å; W26-W41 AromaticContact CH2-NE1 3.35Å; W26-W41 VanDerWaalsContact CH2-NE1 3.35Å; W26-W41 AromaticContact CZ2-CE2 3.98Å; W26-W41 HydrophobicContact CZ2-CH2 4.39Å; W26-W41 AromaticContact CZ2-CZ2 3.91Å; W26-W41 HydrophobicContact CZ2-CZ2 3.91Å; W26-W41 AromaticContact CZ3-CE2 3.87Å; W26-W41 HydrophobicContact CZ3-CZ2 4.24Å; W26-W41 AromaticContact CZ3-NE1 3.36Å; Q37-W41 PolarHBondContact O-N 3.3Å; K38-W41 PolarHBondContact O-N 3.28Å; H39-W41 PolarHBondContact O-N 3.46Å; W41-F44 AromaticContact CE3-CD2 3.78Å; W41-F44 HydrophobicContact CE3-CD2 3.78Å; W41-F44 HydrophobicContact CE3-CE2 4.4Å; W41-F44 AromaticContact CZ3-CD2 3.79Å; W41-F44 HydrophobicContact CZ3-CD2 3.79Å; W41-F44 HydrophobicContact CZ3-CE2 4.19Å; W41-F44 PolarHBondContact O-N 3.2Å; W41-S45 PolarHBondContact O-N 3Å; W41-W58 HydrophobicContact CB-CB 4.09Å; W41-W58 HydrophobicContact CB-CE3 3.82Å; W41-W58 HydrophobicContact CG-CE3 4.39Å; W41-L61 HydrophobicContact CE3-CD2 4.24Å; W41-R62 HydrophobicContact CD2-CB 3.74Å; W41-R62 HydrophobicContact CD2-CG 4.15Å; W41-R62 HydrophobicContact CE3-CB 4.14Å; W41-R62 HydrophobicContact CG-CB 4.04Å; W41-R62 HydrophobicContact CG-CG 4.41Å; W41-R62 HydrophobicContact CZ2-CB 4.23Å; W41-R62 HydrophobicContact CZ2-CG 4Å
42	M	93.2	Very high	88.8	Confident	64 Å²	64	60.4 Å²	60.4	32%	0.315	33%	0.331	S	S	.	.	H	α-helix	trans	-64	-42.1	172.9	-69.1	-172.5	-59.5	0	0	111.3	K38 H39 L40 F44 S45 Q46 W58	K38-M42 HydrophobicContact CG-CE 4.33Å; K38-M42 WeakPolarHBondContact O-CG 3.46Å; K38-M42 PolarHBondContact O-N 3.48Å; H39-M42 HydrophobicContact CB-CE 4.35Å; H39-M42 WeakPolarHBondContact O-CB 3.1Å; H39-M42 PolarHBondContact O-N 3.3Å; L40-M42 VanDerWaalsContact C-N 3.33Å; L40-M42 PolarHBondContact O-N 3.43Å; M42-F44 VanDerWaalsContact C-N 3.34Å; M42-F44 PolarHBondContact O-N 3.23Å; M42-S45 WeakPolarHBondContact O-CB 3.32Å; M42-S45 PolarHBondContact O-N 3.39Å; M42-Q46 WeakPolarHBondContact O-CG 3.38Å; M42-Q46 PolarHBondContact O-N 3.28Å; M42-W58 HydrophobicContact CG-CB 4.15Å; M42-W58 HydrophobicContact CG-CG 3.91Å
43	Q	92.7	Very high	90.1	Very high	52 Å²	52	62.6 Å²	62.6	24%	0.243	34%	0.337	C	S	.	.	H	α-helix	trans	-61.9	-40.7	175.1	-70.1	-59.3	-56	0	0	111.7	H39 L40 S45 Q46 Y47 L127	H39-Q43 WeakPolarHBondContact O-CG 3.44Å; H39-Q43 PolarHBondContact O-N 3.17Å; L40-Q43 WeakPolarHBondContact O-CB 3.44Å; L40-Q43 PolarHBondContact O-N 3.14Å; Q43-S45 PolarHBondContact O-N 3.07Å; Q43-Q46 VanDerWaalsContact NE2-OE1 3.08Å; Q43-Q46 PolarHBondContact O-N 3.04Å; Q43-Y47 WeakPolarHBondContact O-CB 3.39Å; Q43-Y47 PolarHBondContact O-N 3.34Å; Q43-L127 HydrophobicContact CB-CD2 4.34Å; Q43-L127 HydrophobicContact CG-CD2 4.45Å
44	F	94	Very high	90.7	Very high	5 Å²	5	62.5 Å²	62.5	2%	0.022	34%	0.335	C	S	.	.	H	α-helix	trans	-64	-41.2	175.6	-70.3	2.9	0	0	0	112.4	L15 L18 V19 Y22 W26 L40 W41 M42 Q46 Y47 L48 L61	L15-F44 HydrophobicContact CD1-CD2 4.44Å; L18-F44 HydrophobicContact CB-CD1 4.49Å; L18-F44 HydrophobicContact CB-CD2 4.18Å; L18-F44 HydrophobicContact CB-CE1 4.26Å; L18-F44 HydrophobicContact CB-CE2 3.94Å; L18-F44 HydrophobicContact CB-CG 4.47Å; L18-F44 HydrophobicContact CB-CZ 4Å; L18-F44 HydrophobicContact CD1-CB 4.49Å; L18-F44 HydrophobicContact CD1-CD1 4.43Å; L18-F44 HydrophobicContact CD1-CG 4.28Å; L18-F44 HydrophobicContact CD2-CE1 4.43Å; V19-F44 HydrophobicContact CG2-CE2 4.25Å; Y22-F44 AromaticContact CD2-CE1 3.6Å; Y22-F44 HydrophobicContact CD2-CE1 3.6Å; Y22-F44 AromaticContact CD2-CZ 3.41Å; Y22-F44 HydrophobicContact CD2-CZ 3.41Å; Y22-F44 VanDerWaalsContact CD2-CZ 3.41Å; Y22-F44 AromaticContact CE2-CE1 3.79Å; Y22-F44 HydrophobicContact CE2-CE1 3.79Å; Y22-F44 HydrophobicContact CE2-CZ 4.1Å; Y22-F44 HydrophobicContact CG-CE1 4.4Å; Y22-F44 HydrophobicContact CG-CZ 4.03Å; W26-F44 AromaticContact CZ2-CE2 3.83Å; W26-F44 HydrophobicContact CZ2-CE2 3.83Å; W26-F44 HydrophobicContact CZ2-CZ 4.06Å; L40-F44 HydrophobicContact CD1-CD1 4.17Å; L40-F44 HydrophobicContact CD1-CE1 3.5Å; L40-F44 VanDerWaalsContact CD1-CE1 3.5Å; L40-F44 HydrophobicContact CD1-CZ 4Å; L40-F44 HydrophobicContact CD2-CZ 4.3Å; L40-F44 HydrophobicContact CG-CD1 4.47Å; L40-F44 HydrophobicContact CG-CE1 3.84Å; L40-F44 HydrophobicContact CG-CZ 3.88Å; L40-F44 WeakPolarHBondContact O-CD1 3.41Å; L40-F44 WeakPolarHBondContact O-CG 3.5Å; L40-F44 PolarHBondContact O-N 3.03Å; W41-F44 AromaticContact CE3-CD2 3.78Å; W41-F44 HydrophobicContact CE3-CD2 3.78Å; W41-F44 HydrophobicContact CE3-CE2 4.4Å; W41-F44 AromaticContact CZ3-CD2 3.79Å; W41-F44 HydrophobicContact CZ3-CD2 3.79Å; W41-F44 HydrophobicContact CZ3-CE2 4.19Å; W41-F44 PolarHBondContact O-N 3.2Å; M42-F44 VanDerWaalsContact C-N 3.34Å; M42-F44 PolarHBondContact O-N 3.23Å; F44-Q46 VanDerWaalsContact C-N 3.34Å; F44-Q46 PolarHBondContact O-N 3.27Å; F44-Y47 PolarHBondContact O-N 3.4Å; F44-L48 WeakPolarHBondContact O-CB 3.48Å; F44-L48 WeakPolarHBondContact O-CG 3.33Å; F44-L48 PolarHBondContact O-N 3.46Å; F44-L61 HydrophobicContact CB-CD2 3.45Å; F44-L61 VanDerWaalsContact CB-CD2 3.45Å
45	S	93.6	Very high	91.1	Very high	19 Å²	19	68.4 Å²	68.4	13%	0.133	34%	0.343	C	S	.	.	H	α-helix	trans	-59.7	-45.5	175.8	168.9	0	0	0	0	111.3	W41 M42 Q43 H49 R56	W41-S45 PolarHBondContact O-N 3Å; M42-S45 WeakPolarHBondContact O-CB 3.32Å; M42-S45 PolarHBondContact O-N 3.39Å; Q43-S45 PolarHBondContact O-N 3.07Å; S45-H49 WeakPolarHBondContact O-CB 3.43Å; S45-H49 PolarHBondContact O-N 3.41Å; S45-R56 PolarHBondContact OG-O 2.79Å
46	Q	93	Very high	91.3	Very high	109 Å²	109	63.4 Å²	63.4	51%	0.509	32%	0.316	S	S	.	.	H	α-helix	trans	-64.2	-43.5	176.2	-70.4	174.2	-12.1	0	0	112	M42 Q43 F44 H49 S50	M42-Q46 WeakPolarHBondContact O-CG 3.38Å; M42-Q46 PolarHBondContact O-N 3.28Å; Q43-Q46 VanDerWaalsContact NE2-OE1 3.08Å; Q43-Q46 PolarHBondContact O-N 3.04Å; F44-Q46 VanDerWaalsContact C-N 3.34Å; F44-Q46 PolarHBondContact O-N 3.27Å; Q46-H49 PolarHBondContact O-N 3.07Å; Q46-S50 WeakPolarHBondContact O-CB 3.39Å; Q46-S50 PolarHBondContact O-N 3.42Å
47	Y	93.8	Very high	91.5	Very high	50 Å²	50	63.8 Å²	63.8	20%	0.196	32%	0.315	C	S	.	.	H	α-helix	trans	-62.5	-48.5	178.6	173.4	-99.8	0	0	0	112.3	L18 Q43 F44 H49 S50 K51 P128	L18-Y47 HydrophobicContact CD1-CD1 3.58Å; L18-Y47 HydrophobicContact CD1-CE1 3.89Å; L18-Y47 HydrophobicContact CD2-CD1 4.14Å; L18-Y47 HydrophobicContact CD2-CE1 4.08Å; L18-Y47 HydrophobicContact CG-CD1 4.4Å; L18-Y47 HydrophobicContact CG-CE1 4.34Å; Q43-Y47 WeakPolarHBondContact O-CB 3.39Å; Q43-Y47 PolarHBondContact O-N 3.34Å; F44-Y47 PolarHBondContact O-N 3.4Å; Y47-H49 VanDerWaalsContact C-N 3.3Å; Y47-H49 PolarHBondContact O-N 3.3Å; Y47-S50 WeakPolarHBondContact O-CB 3.47Å; Y47-S50 PolarHBondContact O-N 3.4Å; Y47-S50 VanDerWaalsContact O-N 3.1Å; Y47-S50 PolarHBondContact O-OG 3.08Å; Y47-K51 HydrophobicContact CE1-CG 4.21Å; Y47-K51 HydrophobicContact CE2-CG 4.47Å; Y47-K51 PolarHBondContact O-N 3.1Å; Y47-K51 VanDerWaalsContact O-N 3.1Å; Y47-K51 WeakPolarHBondContact OH-CE 3.39Å; Y47-P128 HydrophobicContact CD2-CG 3.46Å; Y47-P128 VanDerWaalsContact CD2-CG 3.46Å; Y47-P128 HydrophobicContact CE2-CG 3.62Å
48	L	92.8	Very high	91.8	Very high	4 Å²	4	65 Å²	65	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-64	-38.9	178.6	-71.1	171.9	0	0	0	111.4	E14 L15 L18 F44 S50 K51 W53 L61	E14-L48 HydrophobicContact CB-CD2 3.97Å; L15-L48 HydrophobicContact CB-CD1 4.35Å; L15-L48 HydrophobicContact CD1-CD1 4.21Å; L18-L48 HydrophobicContact CD1-CD2 4.21Å; L18-L48 HydrophobicContact CD1-CG 4.26Å; F44-L48 WeakPolarHBondContact O-CB 3.48Å; F44-L48 WeakPolarHBondContact O-CG 3.33Å; F44-L48 PolarHBondContact O-N 3.46Å; L48-S50 VanDerWaalsContact C-N 3.32Å; L48-S50 PolarHBondContact O-N 3.08Å; L48-K51 WeakPolarHBondContact O-CB 3.44Å; L48-K51 PolarHBondContact O-N 3.11Å; L48-K51 VanDerWaalsContact O-N 3.13Å; L48-W53 WeakPolarHBondContact O-CB 3.5Å; L48-W53 VanDerWaalsContact O-CD1 3.32Å; L48-W53 PolarHBondContact O-N 3.08Å; L48-L61 HydrophobicContact CD1-CD1 3.43Å; L48-L61 VanDerWaalsContact CD1-CD1 3.43Å; L48-L61 HydrophobicContact CD1-CD2 3.86Å; L48-L61 HydrophobicContact CD1-CG 4.19Å
49	H	92.6	Very high	91.9	Very high	91 Å²	91	62.6 Å²	62.6	42%	0.421	31%	0.311	S	S	.	.	H	α-helix	trans	-60.4	-42.4	172.4	-172.7	100.2	0	0	0	111.8	S45 Q46 Y47 K51 G52 R55	S45-H49 WeakPolarHBondContact O-CB 3.43Å; S45-H49 PolarHBondContact O-N 3.41Å; Q46-H49 PolarHBondContact O-N 3.07Å; Y47-H49 VanDerWaalsContact C-N 3.3Å; Y47-H49 PolarHBondContact O-N 3.3Å; H49-K51 PolarHBondContact O-N 3.44Å; H49-G52 PolarHBondContact O-N 3.4Å; H49-R55 WeakPolarHBondContact ND1-CA 3.46Å; H49-R55 VanDerWaalsContact ND1-CB 3.26Å; H49-R55 WeakPolarHBondContact ND1-CB 3.24Å
50	S	92.9	Very high	91.9	Very high	63 Å²	63	61.3 Å²	61.3	44%	0.441	31%	0.305	S	S	.	.	H	α-helix	trans	-64.5	-21.6	177	76.9	0	0	0	0	113.6	Q46 Y47 L48 G52	Q46-S50 WeakPolarHBondContact O-CB 3.39Å; Q46-S50 PolarHBondContact O-N 3.42Å; Y47-S50 WeakPolarHBondContact O-CB 3.47Å; Y47-S50 PolarHBondContact O-N 3.4Å; Y47-S50 VanDerWaalsContact O-N 3.1Å; Y47-S50 PolarHBondContact O-OG 3.08Å; L48-S50 VanDerWaalsContact C-N 3.32Å; L48-S50 PolarHBondContact O-N 3.08Å; S50-G52 PolarHBondContact O-N 3.15Å
51	K	91.1	Very high	92	Very high	124 Å²	124	60.8 Å²	60.8	54%	0.539	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.6	0.1	172.5	-74.6	-72.1	-170.4	175.3	0	113.6	Y47 L48 H49	Y47-K51 HydrophobicContact CE1-CG 4.21Å; Y47-K51 HydrophobicContact CE2-CG 4.47Å; Y47-K51 PolarHBondContact O-N 3.1Å; Y47-K51 VanDerWaalsContact O-N 3.1Å; Y47-K51 WeakPolarHBondContact OH-CE 3.39Å; L48-K51 WeakPolarHBondContact O-CB 3.44Å; L48-K51 PolarHBondContact O-N 3.11Å; L48-K51 VanDerWaalsContact O-N 3.13Å; H49-K51 PolarHBondContact O-N 3.44Å
52	G	91.1	Very high	91.9	Very high	67 Å²	67	64.7 Å²	64.7	69%	0.691	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	93.7	2.7	-179.1	0	0	0	0	0	114.3	H49 S50	H49-G52 PolarHBondContact O-N 3.4Å; S50-G52 PolarHBondContact O-N 3.15Å
53	W	91.6	Very high	91.8	Very high	64 Å²	64	69.4 Å²	69.4	24%	0.242	33%	0.331	C	S	.	.			trans	-76.4	152.1	177.1	-57.5	117.3	0	0	0	111.7	T8 E10 E11 L48	T8-W53 HydrophobicContact CG2-CZ3 4.33Å; T8-W53 WeakPolarHBondContact OG1-CZ3 3.32Å; E10-W53 HydrophobicContact CB-CH2 3.74Å; E10-W53 HydrophobicContact CB-CZ2 3.83Å; E11-W53 HydrophobicContact CB-CD2 3.82Å; E11-W53 HydrophobicContact CB-CE3 4.01Å; E11-W53 HydrophobicContact CB-CG 4.26Å; E11-W53 HydrophobicContact CB-CZ2 4.35Å; E11-W53 HydrophobicContact CB-CZ3 4.36Å; E11-W53 HydrophobicContact CG-CB 4.28Å; E11-W53 HydrophobicContact CG-CD2 4.03Å; E11-W53 HydrophobicContact CG-CE3 4.46Å; E11-W53 HydrophobicContact CG-CG 3.92Å; L48-W53 WeakPolarHBondContact O-CB 3.5Å; L48-W53 VanDerWaalsContact O-CD1 3.32Å; L48-W53 PolarHBondContact O-N 3.08Å
54	P	89.8	Confident	91.8	Very high	55 Å²	55	70.1 Å²	70.1	36%	0.357	33%	0.334	S	S	.	.			trans	-52.7	144.4	177.7	-26.8	34.9	0	0	0	112.3	R56	P54-R56 WeakPolarHBondContact O-CG 3.41Å; P54-R56 PolarHBondContact O-N 3.1Å
55	R	89.2	Confident	91.7	Very high	216 Å²	216	69.9 Å²	69.9	82%	0.815	33%	0.333	S	S	*	.			trans	-65.2	101.2	177.9	-163.5	172.2	176	-171.9	-2.2	110.4	H49	H49-R55 WeakPolarHBondContact ND1-CA 3.46Å; H49-R55 VanDerWaalsContact ND1-CB 3.26Å; H49-R55 WeakPolarHBondContact ND1-CB 3.24Å
56	R	88.5	Confident	91.5	Very high	20 Å²	20	73.4 Å²	73.4	8%	0.075	35%	0.347	C	S	.	.			trans	-95.6	140.5	175.3	-60	-164.4	-172.3	-110.5	-3.1	111.5	T5 R6 Y7 E11 S45 P54 W58 L61	T5-R56 PolarHBondContact O-NH1 2.99Å; T5-R56 PolarHBondContact O-NH2 3Å; R6-R56 PolarHBondContact O-NH2 3.24Å; Y7-R56 VanDerWaalsContact CA-NH2 3.3Å; Y7-R56 VanDerWaalsContact CD1-CZ 3.44Å; Y7-R56 VanDerWaalsContact CD2-NH1 3.31Å; Y7-R56 VanDerWaalsContact OH-CD 3.3Å; Y7-R56 WeakPolarHBondContact OH-CD 3.46Å; E11-R56 VanDerWaalsContact CD-NE 3.35Å; E11-R56 WeakPolarHBondContact OE1-CD 3.25Å; E11-R56 IonicContact OE1-CZ 2.66Å; E11-R56 IonicContact OE1-NE 3.56Å; E11-R56 PolarHBondContact OE1-NE 3.47Å; E11-R56 IonicContact OE1-NH2 2.72Å; E11-R56 IonicContact OE2-CZ 3.33Å; E11-R56 IonicContact OE2-NE 3.5Å; E11-R56 PolarHBondContact OE2-NE 3.42Å; E11-R56 IonicContact OE2-NH2 3.34Å; E11-R56 PolarHBondContact OE2-NH2 2.93Å; S45-R56 PolarHBondContact OG-O 2.79Å; P54-R56 WeakPolarHBondContact O-CG 3.41Å; P54-R56 PolarHBondContact O-N 3.1Å; R56-W58 PolarHBondContact O-N 3.25Å; R56-L61 HydrophobicContact CB-CD1 4.5Å
57	N	90	Very high	91.5	Very high	82 Å²	82	70.8 Å²	70.8	44%	0.439	34%	0.341	S	S	.	.			trans	-62.6	136.7	171.8	-175	-33.2	0	0	0	109.1	T59 Q60 L61	N57-T59 PolarHBondContact O-N 2.98Å; N57-T59 VanDerWaalsContact O-N 3.1Å; N57-T59 PolarHBondContact OD1-N 3.49Å; N57-T59 PolarHBondContact OD1-OG1 2.93Å; N57-Q60 HydrophobicContact CB-CG 4.26Å; N57-Q60 WeakPolarHBondContact O-CB 3.4Å; N57-Q60 PolarHBondContact O-N 3.15Å; N57-L61 PolarHBondContact O-N 3.23Å
58	W	92.2	Very high	91.3	Very high	65 Å²	65	69.4 Å²	69.4	25%	0.246	34%	0.337	C	S	.	.	H	α-helix	trans	-54.1	-30.9	178.4	71.8	-93.5	0	0	0	112.4	K38 W41 M42 R56 L61 R62	K38-W58 HydrophobicContact CD-CZ2 4.42Å; K38-W58 HydrophobicContact CG-CH2 4.24Å; K38-W58 HydrophobicContact CG-CZ2 4.2Å; W41-W58 HydrophobicContact CB-CB 4.09Å; W41-W58 HydrophobicContact CB-CE3 3.82Å; W41-W58 HydrophobicContact CG-CE3 4.39Å; M42-W58 HydrophobicContact CG-CB 4.15Å; M42-W58 HydrophobicContact CG-CG 3.91Å; R56-W58 PolarHBondContact O-N 3.25Å; W58-L61 WeakPolarHBondContact O-CB 3.49Å; W58-L61 PolarHBondContact O-N 3.35Å; W58-R62 WeakPolarHBondContact O-CB 3.18Å; W58-R62 PolarHBondContact O-N 3.41Å
59	T	92	Very high	91	Very high	40 Å²	40	70.6 Å²	70.6	25%	0.245	34%	0.343	C	S	.	.	H	α-helix	trans	-66.4	-42.7	175.4	-53.2	0	0	0	0	112	N57 L61 R62 R63	N57-T59 PolarHBondContact O-N 2.98Å; N57-T59 VanDerWaalsContact O-N 3.1Å; N57-T59 PolarHBondContact OD1-N 3.49Å; N57-T59 PolarHBondContact OD1-OG1 2.93Å; T59-L61 VanDerWaalsContact C-N 3.31Å; T59-R62 PolarHBondContact O-N 3.03Å; T59-R63 WeakPolarHBondContact O-CG 3.45Å; T59-R63 PolarHBondContact O-N 3.23Å; T59-R63 VanDerWaalsContact O-N 3.08Å
60	Q	91.7	Very high	90.7	Very high	79 Å²	79	74.6 Å²	74.6	37%	0.369	35%	0.354	S	S	.	.	H	α-helix	trans	-65.7	-39.7	175.8	-67.3	172.7	-24.6	0	0	110.8	Y7 N57 R63 K64	Y7-Q60 PolarHBondContact OH-O 2.94Å; N57-Q60 HydrophobicContact CB-CG 4.26Å; N57-Q60 WeakPolarHBondContact O-CB 3.4Å; N57-Q60 PolarHBondContact O-N 3.15Å; Q60-R63 PolarHBondContact O-N 2.9Å; Q60-K64 PolarHBondContact O-N 3.31Å; Q60-K64 VanDerWaalsContact O-N 3.12Å
61	L	92.3	Very high	90.4	Very high	1 Å²	1	77.8 Å²	77.8	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-63.4	-42.9	176.7	-155	80.5	0	0	0	111.3	Y7 L15 W41 F44 L48 R56 N57 W58 T59 K64 G65	Y7-L61 HydrophobicContact CE1-CD1 4.14Å; L15-L61 HydrophobicContact CD1-CD1 4.07Å; L15-L61 HydrophobicContact CD1-CD2 3.86Å; L15-L61 HydrophobicContact CD1-CG 3.68Å; L15-L61 HydrophobicContact CD2-CD1 3.93Å; L15-L61 HydrophobicContact CD2-CG 4.05Å; W41-L61 HydrophobicContact CE3-CD2 4.24Å; F44-L61 HydrophobicContact CB-CD2 3.45Å; F44-L61 VanDerWaalsContact CB-CD2 3.45Å; L48-L61 HydrophobicContact CD1-CD1 3.43Å; L48-L61 VanDerWaalsContact CD1-CD1 3.43Å; L48-L61 HydrophobicContact CD1-CD2 3.86Å; L48-L61 HydrophobicContact CD1-CG 4.19Å; R56-L61 HydrophobicContact CB-CD1 4.5Å; N57-L61 PolarHBondContact O-N 3.23Å; W58-L61 WeakPolarHBondContact O-CB 3.49Å; W58-L61 PolarHBondContact O-N 3.35Å; T59-L61 VanDerWaalsContact C-N 3.31Å; L61-K64 PolarHBondContact O-N 3.19Å; L61-G65 PolarHBondContact O-N 3.01Å
62	R	92.4	Very high	90.1	Very high	89 Å²	89	75.3 Å²	75.3	34%	0.336	35%	0.35	S	S	.	.	H	α-helix	trans	-58.3	-49.5	175	177.7	178.2	-178.7	-160.6	4.6	111.9	W41 W58 T59 K64 G65 Q66	W41-R62 HydrophobicContact CD2-CB 3.74Å; W41-R62 HydrophobicContact CD2-CG 4.15Å; W41-R62 HydrophobicContact CE3-CB 4.14Å; W41-R62 HydrophobicContact CG-CB 4.04Å; W41-R62 HydrophobicContact CG-CG 4.41Å; W41-R62 HydrophobicContact CZ2-CB 4.23Å; W41-R62 HydrophobicContact CZ2-CG 4Å; W58-R62 WeakPolarHBondContact O-CB 3.18Å; W58-R62 PolarHBondContact O-N 3.41Å; T59-R62 PolarHBondContact O-N 3.03Å; R62-K64 VanDerWaalsContact C-N 3.34Å; R62-K64 PolarHBondContact O-N 3.4Å; R62-G65 PolarHBondContact O-N 3.11Å; R62-Q66 HydrophobicContact CG-CG 4.42Å; R62-Q66 WeakPolarHBondContact O-CB 3.42Å; R62-Q66 WeakPolarHBondContact O-CG 3Å; R62-Q66 PolarHBondContact O-N 3.44Å
63	R	91.9	Very high	89.6	Confident	163 Å²	163	75.3 Å²	75.3	62%	0.615	33%	0.334	S	S	*	.	H	α-helix	trans	-58.7	-45.9	178.3	-67.5	-175.9	-145.3	141.2	-0.3	111.5	T59 Q60 S67	T59-R63 WeakPolarHBondContact O-CG 3.45Å; T59-R63 PolarHBondContact O-N 3.23Å; T59-R63 VanDerWaalsContact O-N 3.08Å; Q60-R63 PolarHBondContact O-N 2.9Å; R63-S67 PolarHBondContact O-N 3.4Å
64	K	92.4	Very high	89	Confident	66 Å²	66	76.3 Å²	76.3	29%	0.287	34%	0.344	S	S	.	.	H	α-helix	trans	-65.1	-45.4	178.2	-175.4	66	174.2	-175.6	0	111.7	Y7 L15 Q60 L61 R62 Q66 S67 L68	Y7-K64 HydrophobicContact CD1-CG 4.25Å; Y7-K64 HydrophobicContact CD2-CD 3.94Å; Y7-K64 HydrophobicContact CD2-CG 4Å; Y7-K64 HydrophobicContact CE1-CB 4.33Å; Y7-K64 HydrophobicContact CE1-CG 4.04Å; Y7-K64 HydrophobicContact CE2-CB 3.85Å; Y7-K64 HydrophobicContact CE2-CD 4.05Å; Y7-K64 HydrophobicContact CE2-CG 3.78Å; Y7-K64 HydrophobicContact CG-CD 4.36Å; Y7-K64 HydrophobicContact CG-CG 4.23Å; L15-K64 HydrophobicContact CD2-CB 3.96Å; L15-K64 HydrophobicContact CD2-CG 3.78Å; Q60-K64 PolarHBondContact O-N 3.31Å; Q60-K64 VanDerWaalsContact O-N 3.12Å; L61-K64 PolarHBondContact O-N 3.19Å; R62-K64 VanDerWaalsContact C-N 3.34Å; R62-K64 PolarHBondContact O-N 3.4Å; K64-Q66 PolarHBondContact O-N 2.89Å; K64-S67 WeakPolarHBondContact O-CB 3.49Å; K64-S67 PolarHBondContact O-N 2.9Å; K64-L68 HydrophobicContact CG-CD1 4.34Å; K64-L68 WeakPolarHBondContact O-CG 3.41Å; K64-L68 PolarHBondContact O-N 3.26Å
65	G	92	Very high	88.4	Confident	0 Å²	0	79.6 Å²	79.6	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-63	-40.4	179	0	0	0	0	0	113	L61 R62 L68 L69	L61-G65 PolarHBondContact O-N 3.01Å; R62-G65 PolarHBondContact O-N 3.11Å; G65-L68 PolarHBondContact O-N 2.99Å; G65-L69 PolarHBondContact O-N 3.12Å
66	Q	89.4	Confident	87.4	Confident	93 Å²	93	73.9 Å²	73.9	44%	0.435	35%	0.345	S	S	.	.	H	α-helix	trans	-65.6	-39.5	173.7	-73.9	179.3	-19.4	0	0	112.3	R62 K64 L68 L69 R70	R62-Q66 HydrophobicContact CG-CG 4.42Å; R62-Q66 WeakPolarHBondContact O-CB 3.42Å; R62-Q66 WeakPolarHBondContact O-CG 3Å; R62-Q66 PolarHBondContact O-N 3.44Å; K64-Q66 PolarHBondContact O-N 2.89Å; Q66-L68 VanDerWaalsContact C-N 3.34Å; Q66-L69 PolarHBondContact O-N 3.35Å; Q66-R70 PolarHBondContact O-N 3.34Å
67	S	91.3	Very high	86.3	Confident	55 Å²	55	76.7 Å²	76.7	39%	0.385	37%	0.365	S	S	.	.	H	α-helix	trans	-61.1	-42.4	173.2	176.4	0	0	0	0	111.8	R63 K64 R70 K71	R63-S67 PolarHBondContact O-N 3.4Å; K64-S67 WeakPolarHBondContact O-CB 3.49Å; K64-S67 PolarHBondContact O-N 2.9Å; S67-R70 PolarHBondContact O-N 2.75Å; S67-K71 WeakPolarHBondContact O-CG 3.28Å; S67-K71 PolarHBondContact O-N 3.15Å
68	L	90.4	Very high	85	Confident	21 Å²	21	77.8 Å²	77.8	11%	0.11	37%	0.37	C	S	.	.	H	α-helix	trans	-63.3	-44.4	174.9	-69.3	167.8	0	0	0	111.6	L15 A16 K64 G65 Q66 R70 K71 F72	L15-L68 HydrophobicContact CB-CD1 4.45Å; L15-L68 HydrophobicContact CD2-CD1 4.18Å; L15-L68 HydrophobicContact CG-CD1 4.21Å; A16-L68 HydrophobicContact CB-CD1 4.22Å; K64-L68 HydrophobicContact CG-CD1 4.34Å; K64-L68 WeakPolarHBondContact O-CG 3.41Å; K64-L68 PolarHBondContact O-N 3.26Å; G65-L68 PolarHBondContact O-N 2.99Å; Q66-L68 VanDerWaalsContact C-N 3.34Å; L68-R70 VanDerWaalsContact C-N 3.3Å; L68-R70 PolarHBondContact O-N 3.44Å; L68-K71 WeakPolarHBondContact O-CB 3.47Å; L68-K71 PolarHBondContact O-N 3.21Å; L68-F72 HydrophobicContact CB-CE2 4.04Å; L68-F72 WeakPolarHBondContact O-CD2 3.43Å; L68-F72 WeakPolarHBondContact O-CG 3.45Å; L68-F72 PolarHBondContact O-N 3.22Å
69	L	86.9	Confident	83.2	Confident	28 Å²	28	80.5 Å²	80.5	15%	0.147	39%	0.386	C	S	.	.	H	α-helix	trans	-61.1	-37.9	178.6	-168.8	64.2	0	0	0	112.5	V19 L20 R23 G65 Q66 F72 N73	V19-L69 HydrophobicContact CG1-CB 4.18Å; V19-L69 HydrophobicContact CG1-CD1 4.2Å; L20-L69 HydrophobicContact CD2-CD1 4.48Å; R23-L69 HydrophobicContact CG-CD1 4.37Å; G65-L69 PolarHBondContact O-N 3.12Å; Q66-L69 PolarHBondContact O-N 3.35Å; L69-F72 PolarHBondContact O-N 3.11Å; L69-N73 PolarHBondContact O-N 3.13Å; L69-N73 VanDerWaalsContact O-N 3.1Å; L69-N73 PolarHBondContact O-ND2 2.81Å
70	R	85.9	Confident	81.3	Confident	176 Å²	176	83.2 Å²	83.2	66%	0.664	40%	0.398	S	S	*	.	H	α-helix	trans	-61.2	-50.2	173.5	-167	-178.9	-59.2	-176.9	-0.1	111	Q66 S67 L68 F72 N73 D74	Q66-R70 PolarHBondContact O-N 3.34Å; S67-R70 PolarHBondContact O-N 2.75Å; L68-R70 VanDerWaalsContact C-N 3.3Å; L68-R70 PolarHBondContact O-N 3.44Å; R70-F72 VanDerWaalsContact C-N 3.26Å; R70-F72 PolarHBondContact O-N 2.64Å; R70-N73 PolarHBondContact O-N 2.96Å; R70-N73 VanDerWaalsContact O-N 3.08Å; R70-D74 PolarHBondContact O-N 3.08Å
71	K	87.5	Confident	79.3	Confident	130 Å²	130	86.3 Å²	86.3	57%	0.565	41%	0.413	S	S	*	.	H	α-helix	trans	-55.9	-38.7	177.1	-67.9	-177.7	178.8	-159.5	0	112.9	S67 L68 M75	S67-K71 WeakPolarHBondContact O-CG 3.28Å; S67-K71 PolarHBondContact O-N 3.15Å; L68-K71 WeakPolarHBondContact O-CB 3.47Å; L68-K71 PolarHBondContact O-N 3.21Å; K71-M75 WeakPolarHBondContact O-CB 3.38Å; K71-M75 PolarHBondContact O-N 3.43Å
72	F	83.4	Confident	77.6	Confident	71 Å²	71	91.4 Å²	91.4	31%	0.311	44%	0.444	S	S	.	.	H	α-helix	trans	-69.5	-39.5	177.1	-66.2	-54.5	0	0	0	113.1	A16 L20 L68 L69 R70 T76	A16-F72 HydrophobicContact CB-CE2 3.74Å; A16-F72 HydrophobicContact CB-CZ 3.68Å; L20-F72 HydrophobicContact CD1-CD2 4.23Å; L20-F72 HydrophobicContact CD1-CE2 4.01Å; L20-F72 HydrophobicContact CD1-CZ 4.18Å; L20-F72 HydrophobicContact CD2-CD2 3.95Å; L20-F72 HydrophobicContact CD2-CE2 4.47Å; L20-F72 HydrophobicContact CD2-CG 4.31Å; L20-F72 HydrophobicContact CG-CD2 4.19Å; L20-F72 HydrophobicContact CG-CE2 4.21Å; L68-F72 HydrophobicContact CB-CE2 4.04Å; L68-F72 WeakPolarHBondContact O-CD2 3.43Å; L68-F72 WeakPolarHBondContact O-CG 3.45Å; L68-F72 PolarHBondContact O-N 3.22Å; L69-F72 PolarHBondContact O-N 3.11Å; R70-F72 VanDerWaalsContact C-N 3.26Å; R70-F72 PolarHBondContact O-N 2.64Å; F72-T76 PolarHBondContact O-N 3.2Å; F72-T76 VanDerWaalsContact O-N 3.08Å; F72-T76 PolarHBondContact O-OG1 2.96Å
73	N	80.7	Confident	75.6	Confident	68 Å²	68	91.7 Å²	91.7	36%	0.364	46%	0.459	S	S	.	.	H	α-helix	trans	-67.6	-39.3	176.7	-67.7	-31	0	0	0	111.4	L69 R70 T76 T77	L69-N73 PolarHBondContact O-N 3.13Å; L69-N73 VanDerWaalsContact O-N 3.1Å; L69-N73 PolarHBondContact O-ND2 2.81Å; R70-N73 PolarHBondContact O-N 2.96Å; R70-N73 VanDerWaalsContact O-N 3.08Å; N73-T76 PolarHBondContact O-N 2.81Å; N73-T77 PolarHBondContact O-N 3.1Å; N73-T77 PolarHBondContact O-OG1 3.43Å
74	D	80.3	Confident	73.7	Confident	84 Å²	84	91.1 Å²	91.1	45%	0.449	46%	0.462	S	S	.	.	H	α-helix	trans	-65.5	-43.9	177.5	-59.8	-19.3	0	0	0	110.7	R70 T76 T77 N78	R70-D74 PolarHBondContact O-N 3.08Å; D74-T76 VanDerWaalsContact C-N 3.35Å; D74-T76 PolarHBondContact O-N 2.94Å; D74-T77 PolarHBondContact O-N 3.41Å; D74-N78 VanDerWaalsContact O-CG 3.31Å; D74-N78 PolarHBondContact O-N 3.04Å; D74-N78 VanDerWaalsContact O-N 3.07Å; D74-N78 PolarHBondContact O-ND2 3.31Å
75	M	76.2	Confident	71.7	Confident	125 Å²	125	92.3 Å²	92.3	62%	0.616	48%	0.478	S	S	*	.	H	α-helix	trans	-61.1	-41.3	176.4	-172.2	68.5	79.7	0	0	112.5	K71 T77 Q79	K71-M75 WeakPolarHBondContact O-CB 3.38Å; K71-M75 PolarHBondContact O-N 3.43Å; M75-T77 VanDerWaalsContact C-N 3.34Å; M75-Q79 WeakPolarHBondContact O-CG 3.49Å; M75-Q79 PolarHBondContact O-N 2.96Å
76	T	67.8	Low	69.1	Low	96 Å²	96	99.4 Å²	99.4	59%	0.589	52%	0.516	S	S	*	.	H	α-helix	trans	-69.2	-34.7	-180	-50.2	0	0	0	0	111.6	F72 N73 D74 L80	F72-T76 PolarHBondContact O-N 3.2Å; F72-T76 VanDerWaalsContact O-N 3.08Å; F72-T76 PolarHBondContact O-OG1 2.96Å; N73-T76 PolarHBondContact O-N 2.81Å; D74-T76 VanDerWaalsContact C-N 3.35Å; D74-T76 PolarHBondContact O-N 2.94Å; T76-L80 PolarHBondContact O-N 3.08Å
77	T	66.3	Low	66.7	Low	79 Å²	79	99.8 Å²	99.8	49%	0.485	53%	0.527	S	S	.	.	H	α-helix	trans	-69.3	-44.4	178.6	-52.8	0	0	0	0	110.8	N73 D74 M75 Q79 L80 E81	N73-T77 PolarHBondContact O-N 3.1Å; N73-T77 PolarHBondContact O-OG1 3.43Å; D74-T77 PolarHBondContact O-N 3.41Å; M75-T77 VanDerWaalsContact C-N 3.34Å; T77-Q79 VanDerWaalsContact C-N 3.35Å; T77-Q79 PolarHBondContact O-N 3.13Å; T77-L80 PolarHBondContact O-N 3.05Å; T77-E81 PolarHBondContact O-N 2.78Å
78	N	61.4	Low	64.1	Low	104 Å²	104	104.2 Å²	104.2	56%	0.556	55%	0.546	S	S	*	.	H	α-helix	trans	-65	-35.4	179	-65.3	-23.4	0	0	0	112.8	D74 V82	D74-N78 VanDerWaalsContact O-CG 3.31Å; D74-N78 PolarHBondContact O-N 3.04Å; D74-N78 VanDerWaalsContact O-N 3.07Å; D74-N78 PolarHBondContact O-ND2 3.31Å; N78-V82 WeakPolarHBondContact O-CG2 3.46Å; N78-V82 PolarHBondContact O-N 3.14Å
79	Q	54.5	Low	61.7	Low	122 Å²	122	108.9 Å²	108.9	57%	0.57	58%	0.58	S	S	*	*	H	α-helix	trans	-69.5	-33.6	176.1	-74.4	-84.8	46.8	0	0	112.8	M75 T77 S83	M75-Q79 WeakPolarHBondContact O-CG 3.49Å; M75-Q79 PolarHBondContact O-N 2.96Å; T77-Q79 VanDerWaalsContact C-N 3.35Å; T77-Q79 PolarHBondContact O-N 3.13Å; Q79-S83 PolarHBondContact O-N 3.11Å; Q79-S83 PolarHBondContact O-OG 3.49Å
80	L	53.5	Low	59.7	Low	97 Å²	97	115 Å²	115	51%	0.508	61%	0.612	S	S	.	*	H	α-helix	trans	-74.3	-32.3	179.9	-168.7	67.7	0	0	0	112.3	T76 T77 S83 K84	T76-L80 PolarHBondContact O-N 3.08Å; T77-L80 PolarHBondContact O-N 3.05Å; L80-S83 PolarHBondContact O-N 3.31Å; L80-K84 HydrophobicContact CG-CD 4.4Å; L80-K84 PolarHBondContact O-N 3.23Å
81	E	50	Low	57.7	Low	144 Å²	144	114.9 Å²	114.9	67%	0.673	62%	0.619	S	S	*	*	H	α-helix	trans	-74.1	-35.3	177.3	-64.2	-131.5	139	0	0	112.7	T77 S83 K84 S85	T77-E81 PolarHBondContact O-N 2.78Å; E81-S83 VanDerWaalsContact C-N 3.27Å; E81-S83 PolarHBondContact O-N 3.09Å; E81-K84 PolarHBondContact O-N 3.04Å; E81-S85 PolarHBondContact O-OG 3.19Å
82	V	55.3	Low	55.3	Low	109 Å²	109	115.9 Å²	115.9	66%	0.661	63%	0.63	S	S	*	*	H	α-helix	trans	-67.7	-30.4	173.8	177.2	0	0	0	0	111.4	N78	N78-V82 WeakPolarHBondContact O-CG2 3.46Å; N78-V82 PolarHBondContact O-N 3.14Å
83	S	51.3	Low	53.4	Low	94 Å²	94	118.1 Å²	118.1	66%	0.657	65%	0.652	S	S	*	*	H	α-helix	trans	-85.8	-12.7	-179	-55.5	0	0	0	0	114.4	Q79 L80 E81	Q79-S83 PolarHBondContact O-N 3.11Å; Q79-S83 PolarHBondContact O-OG 3.49Å; L80-S83 PolarHBondContact O-N 3.31Å; E81-S83 VanDerWaalsContact C-N 3.27Å; E81-S83 PolarHBondContact O-N 3.09Å
84	K	52.2	Low	51.7	Low	152 Å²	152	120 Å²	120	66%	0.661	67%	0.67	S	S	*	*	H	α-helix	trans	-99.2	-10.6	180	-81.4	-178.9	176.6	179	0	114.5	L80 E81 N86	L80-K84 HydrophobicContact CG-CD 4.4Å; L80-K84 PolarHBondContact O-N 3.23Å; E81-K84 PolarHBondContact O-N 3.04Å; K84-N86 VanDerWaalsContact C-N 3.34Å; K84-N86 PolarHBondContact O-N 3.17Å
85	S	49	Very low	49.8	Very low	91 Å²	91	122.5 Å²	122.5	64%	0.636	68%	0.684	S	S	*	*	S	Bend	trans	-95.4	53.1	179.4	45.5	0	0	0	0	111.7	E81	E81-S85 PolarHBondContact O-OG 3.19Å
86	N	37	Very low	48.3	Very low	148 Å²	148	125.4 Å²	125.4	79%	0.791	70%	0.695	S	S	*	*			trans	-155.1	87.1	157.8	-157.3	4.8	0	0	0	112.6	K84	K84-N86 VanDerWaalsContact C-N 3.34Å; K84-N86 PolarHBondContact O-N 3.17Å
87	P	40.5	Very low	46.9	Very low	102 Å²	102	126.6 Å²	126.6	66%	0.662	70%	0.703	S	S	*	*	S	Bend	trans	-128.4	117.7	146.7	32.1	-17.2	0	0	0	109.6
88	N	36.6	Very low	45.6	Very low	148 Å²	148	128.8 Å²	128.8	79%	0.791	72%	0.718	S	S	*	*			trans	57.9	86.8	160.8	-59.8	-18	0	0	0	116.6
89	S	39.8	Very low	44.7	Very low	119 Å²	119	131.3 Å²	131.3	83%	0.832	73%	0.731	S	S	*	*			trans	-122.6	84.4	145.4	-166.8	0	0	0	0	108.6
90	I	44.1	Very low	43.8	Very low	156 Å²	156	130.9 Å²	130.9	80%	0.8	74%	0.741	S	S	*	*			trans	-80.9	107.6	157.4	-66.3	168.7	0	0	0	104.2
91	E	45.3	Very low	43.1	Very low	174 Å²	174	131.3 Å²	131.3	81%	0.813	75%	0.752	S	S	*	*			trans	-169.1	119.3	142.6	-110.4	172.2	-175.2	0	0	112.3
92	N	37	Very low	42.5	Very low	151 Å²	151	129.3 Å²	129.3	81%	0.807	75%	0.754	S	S	*	*			trans	77	114.6	155.4	-93.9	-28	0	0	0	121.9
93	P	42.8	Very low	41.7	Very low	117 Å²	117	131.5 Å²	131.5	76%	0.76	76%	0.762	S	S	*	*			trans	-89.7	141.6	170.9	36.8	-29.3	0	0	0	111
94	S	45.3	Very low	41	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	77%	0.77	S	S	*	*			trans	-144.9	92.3	167.8	165	0	0	0	0	109.2
95	N	39.9	Very low	40.2	Very low	138 Å²	138	132.8 Å²	132.8	74%	0.738	78%	0.783	S	S	*	*			trans	30.3	104	145.1	-60.3	-21.8	0	0	0	117.6
96	H	45.4	Very low	39.7	Very low	185 Å²	185	133.1 Å²	133.1	86%	0.856	79%	0.791	S	S	*	*			trans	-157.3	104.9	131.8	-83.7	-59.3	0	0	0	109.7
97	T	38.1	Very low	39.6	Very low	122 Å²	122	133.6 Å²	133.6	75%	0.748	79%	0.788	S	S	*	*			trans	45.2	110.5	145.2	3.1	0	0	0	0	119.9
98	P	38.1	Very low	39.7	Very low	125 Å²	125	135.4 Å²	135.4	81%	0.812	80%	0.797	S	S	*	*			trans	-100	138	164	35.4	-25.3	0	0	0	111.1
99	L	42.7	Very low	39.6	Very low	157 Å²	157	135.1 Å²	135.1	82%	0.822	80%	0.795	S	S	*	*			trans	-140.8	118	166.4	-92.3	158.5	0	0	0	109.3
100	S	35.5	Very low	39.4	Very low	112 Å²	112	132.5 Å²	132.5	78%	0.783	79%	0.787	S	S	*	*			trans	60.4	130.1	153.4	-68.4	0	0	0	0	118.1
101	S	40	Very low	38.8	Very low	106 Å²	106	134.2 Å²	134.2	74%	0.741	79%	0.791	S	S	*	*			cis	-176.9	141	15.1	43.4	0	0	0	0	109.3
102	S	37.8	Very low	38.3	Very low	103 Å²	103	133.6 Å²	133.6	72%	0.72	79%	0.792	S	S	*	*			trans	71	108.2	135.9	-151.5	0	0	0	0	121.2
103	N	36.6	Very low	38.2	Very low	155 Å²	155	129.6 Å²	129.6	83%	0.829	79%	0.786	S	S	*	*			trans	56.5	113	130.6	-68.8	-2.5	0	0	0	120.6
104	A	36.9	Very low	37.7	Very low	98 Å²	98	129 Å²	129	81%	0.81	79%	0.785	S	S	*	*				-173.6	111.4	96.6	0	0	0	0	0	110.5
105	N	36.5	Very low	37.3	Very low	174 Å²	174	130.6 Å²	130.6	93%	0.93	79%	0.79	S	S	*	*			trans	-77.2	123.8	162.3	-77.3	-31.7	0	0	0	108.6
106	A	37.2	Very low	37.1	Very low	98 Å²	98	129 Å²	129	81%	0.81	79%	0.786	S	S	*	*			trans	-121.8	92.6	157.8	0	0	0	0	0	108.1
107	H	35.4	Very low	36.5	Very low	159 Å²	159	128 Å²	128	74%	0.736	78%	0.781	S	S	*	*			trans	-75	112.4	167.6	172.2	-82	0	0	0	108.5	N109	H107-N109 VanDerWaalsContact CE1-CB 3.45Å; H107-N109 WeakPolarHBondContact CE1-CB 3.4Å
108	V	42.4	Very low	36.2	Very low	139 Å²	139	128.6 Å²	128.6	84%	0.842	78%	0.78	S	S	*	*			trans	-123.3	87.5	159.7	-176.5	0	0	0	0	107.6
109	N	34.1	Very low	36.2	Very low	143 Å²	143	131 Å²	131	77%	0.765	78%	0.78	S	S	*	*			trans	-89.5	117.4	160.3	-148.1	34.5	0	0	0	105.6	H107	H107-N109 VanDerWaalsContact CE1-CB 3.45Å; H107-N109 WeakPolarHBondContact CE1-CB 3.4Å
110	G	35.7	Very low	35.5	Very low	64 Å²	64	129 Å²	129	66%	0.66	78%	0.779	S	S	*	*			trans	-173.9	94.9	-171.9	0	0	0	0	0	115.4
111	H	31.4	Very low	35.3	Very low	191 Å²	191	128.2 Å²	128.2	88%	0.884	77%	0.774	S	S	*	*			trans	91	101.1	140.5	-142.6	53.8	0	0	0	119.4
112	I	35.6	Very low	35.1	Very low	161 Å²	161	128.9 Å²	128.9	83%	0.826	77%	0.773	S	S	*	*			trans	-50.8	125.3	153.8	-63	158.7	0	0	0	109.6
113	G	34.8	Very low	34.9	Very low	67 Å²	67	132.6 Å²	132.6	69%	0.691	78%	0.779	S	S	*	*			trans	-148.5	90.1	173.7	0	0	0	0	0	110.3	V115	G113-V115 PolarHBondContact O-N 2.92Å
114	S	32.1	Very low	34.9	Very low	104 Å²	104	131.7 Å²	131.7	73%	0.727	76%	0.764	S	S	*	*			trans	-50.8	122.9	170.9	167.3	0	0	0	0	112.1
115	V	37.8	Very low	35.2	Very low	141 Å²	141	129.8 Å²	129.8	86%	0.855	74%	0.743	S	S	*	*			trans	-125.8	110.8	151.1	-176.7	0	0	0	0	108.1	G113	G113-V115 PolarHBondContact O-N 2.92Å
116	T	36	Very low	35.3	Very low	106 Å²	106	126.3 Å²	126.3	65%	0.65	73%	0.725	S	S	*	*			trans	-53.5	140.8	174.3	26.4	0	0	0	0	114.2
117	E	32.4	Very low	36.1	Very low	164 Å²	164	125.1 Å²	125.1	77%	0.766	70%	0.704	S	S	*	*			trans	60.5	105.8	130.3	-154.6	171.6	-153.2	0	0	117.3
118	N	32.2	Very low	36.5	Very low	133 Å²	133	121.1 Å²	121.1	71%	0.711	69%	0.692	S	S	*	*				-178.7	120.4	121.7	-93.7	-53.2	0	0	0	113.2
119	Q	37	Very low	36.6	Very low	175 Å²	175	119.4 Å²	119.4	82%	0.818	68%	0.682	S	S	*	*			trans	74.7	101.5	145.3	-54.7	-171.3	29.5	0	0	120	S121	Q119-S121 PolarHBondContact O-N 3.32Å; Q119-S121 VanDerWaalsContact O-N 3.15Å
120	S	27.7	Very low	37	Very low	116 Å²	116	118.8 Å²	118.8	81%	0.811	68%	0.678	S	S	*	*			trans	-36.1	107.5	148.1	153.8	0	0	0	0	112.6
121	S	32.4	Very low	37.7	Very low	96 Å²	96	120.6 Å²	120.6	67%	0.671	68%	0.676	S	S	*	*			trans	-114.4	103.7	164.2	-172.3	0	0	0	0	109	Q119 H123	Q119-S121 PolarHBondContact O-N 3.32Å; Q119-S121 VanDerWaalsContact O-N 3.15Å; S121-H123 PolarHBondContact O-N 3.41Å
122	V	34.9	Very low	38.1	Very low	120 Å²	120	117.3 Å²	117.3	73%	0.727	67%	0.672	S	S	*	*			trans	-64.1	102.5	169.7	175.8	0	0	0	0	107.3	R124	V122-R124 VanDerWaalsContact C-N 3.3Å; V122-R124 PolarHBondContact O-N 3.32Å
123	H	33.5	Very low	38.3	Very low	180 Å²	180	114 Å²	114	83%	0.833	66%	0.664	S	S	*	*			trans	-62.5	88.3	172.8	-86.4	-58.5	0	0	0	110.4	S121	S121-H123 PolarHBondContact O-N 3.41Å
124	R	36.6	Very low	38.7	Very low	137 Å²	137	116.4 Å²	116.4	52%	0.517	67%	0.667	S	S	.	*			trans	-72.9	124.2	163.9	-94.3	-172.2	176	162.3	5	108.7	V122 N126 E301	V122-R124 VanDerWaalsContact C-N 3.3Å; V122-R124 PolarHBondContact O-N 3.32Å; R124-N126 PolarHBondContact O-N 2.97Å; R124-N126 VanDerWaalsContact O-N 3.14Å; R124-E301 IonicContact CZ-OE1 2.81Å; R124-E301 IonicContact NH1-OE1 2.67Å; R124-E301 IonicContact NH2-OE1 3.72Å; R124-E301 PolarHBondContact NH2-OE1 3.28Å
125	P	42.6	Very low	39.2	Very low	57 Å²	57	117.8 Å²	117.8	37%	0.37	67%	0.67	S	S	.	*			trans	-72.4	107.1	175.8	25.9	-29.8	0	0	0	110.4	R21 Y22	R21-P125 HydrophobicContact CG-CB 3.71Å; R21-P125 HydrophobicContact CG-CG 4.45Å; Y22-P125 HydrophobicContact CE1-CB 4.29Å; Y22-P125 HydrophobicContact CE1-CG 4.1Å
126	N	38.9	Very low	39.3	Very low	102 Å²	102	116.7 Å²	116.7	55%	0.545	66%	0.664	S	S	.	*			trans	-74.2	128.5	169.6	-71.2	-36.6	0	0	0	110	R124	R124-N126 PolarHBondContact O-N 2.97Å; R124-N126 VanDerWaalsContact O-N 3.14Å
127	L	54.5	Low	39.1	Very low	73 Å²	73	116.2 Å²	116.2	38%	0.382	67%	0.665	S	S	.	*			trans	-78.9	143.2	169.6	-88.2	90.9	0	0	0	110.6	Y22 Q43 T129	Y22-L127 HydrophobicContact CE1-CD1 3.95Å; Y22-L127 WeakPolarHBondContact OH-CD1 3.47Å; Y22-L127 VanDerWaalsContact OH-CG 3.27Å; Y22-L127 WeakPolarHBondContact OH-CG 3.39Å; Q43-L127 HydrophobicContact CB-CD2 4.34Å; Q43-L127 HydrophobicContact CG-CD2 4.45Å; L127-T129 PolarHBondContact O-N 3.24Å
128	P	44.5	Very low	39.4	Very low	74 Å²	74	116 Å²	116	48%	0.481	67%	0.667	S	S	.	*			trans	-68.4	113.2	163.8	27.6	-29	0	0	0	109.3	Y47	Y47-P128 HydrophobicContact CD2-CG 3.46Å; Y47-P128 VanDerWaalsContact CD2-CG 3.46Å; Y47-P128 HydrophobicContact CE2-CG 3.62Å
129	T	44.2	Very low	39.7	Very low	104 Å²	104	115.6 Å²	115.6	64%	0.638	67%	0.67	S	S	*	*			trans	-92.7	112.7	176	-59.5	0	0	0	0	108.9	L127 T131	L127-T129 PolarHBondContact O-N 3.24Å; T129-T131 VanDerWaalsContact C-N 3.3Å; T129-T131 WeakPolarHBondContact CG2-OG1 3.37Å; T129-T131 PolarHBondContact O-N 3.07Å
130	L	42.4	Very low	39.7	Very low	129 Å²	129	112.6 Å²	112.6	68%	0.675	67%	0.668	S	S	*	*			trans	-90	27.8	-178.4	-70.2	174.1	0	0	0	114
131	T	51.2	Low	40.2	Very low	102 Å²	102	116.5 Å²	116.5	63%	0.626	67%	0.671	S	S	*	*			trans	-111.6	114.9	175.6	59.7	0	0	0	0	109.6	T129 S133	T129-T131 VanDerWaalsContact C-N 3.3Å; T129-T131 WeakPolarHBondContact CG2-OG1 3.37Å; T129-T131 PolarHBondContact O-N 3.07Å; T131-S133 PolarHBondContact O-N 3.5Å
132	P	38.5	Very low	40.1	Very low	123 Å²	123	119.6 Å²	119.6	80%	0.799	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-63.3	118.7	166.3	25.4	-29.9	0	0	0	108.2
133	S	39.5	Very low	40.3	Very low	92 Å²	92	118.5 Å²	118.5	64%	0.643	68%	0.682	S	S	*	*	P	Polyproline II helix	trans	-59.9	132.4	166.5	-85.6	0	0	0	0	108.3	T131 V135	T131-S133 PolarHBondContact O-N 3.5Å; S133-V135 PolarHBondContact O-N 2.88Å; S133-V135 VanDerWaalsContact O-N 3.12Å
134	P	43.7	Very low	40.2	Very low	116 Å²	116	116.1 Å²	116.1	75%	0.753	68%	0.681	S	S	*	*	P	Polyproline II helix	trans	-64.3	116.7	176.6	25.4	-31.7	0	0	0	109.7	V136	P134-V136 PolarHBondContact O-N 2.81Å
135	V	42.1	Very low	40.4	Very low	133 Å²	133	115.4 Å²	115.4	81%	0.806	69%	0.694	S	S	*	*			trans	-79.4	109.3	167.6	-179.9	0	0	0	0	106.7	S133	S133-V135 PolarHBondContact O-N 2.88Å; S133-V135 VanDerWaalsContact O-N 3.12Å
136	V	40	Very low	39.8	Very low	118 Å²	118	117.6 Å²	117.6	72%	0.715	71%	0.711	S	S	*	*			trans	-97.7	105.7	171.2	-166.9	0	0	0	0	107.7	P134 I138	P134-V136 PolarHBondContact O-N 2.81Å; V136-I138 PolarHBondContact O-N 3.33Å
137	S	33	Very low	39.8	Very low	97 Å²	97	120.9 Å²	120.9	68%	0.678	73%	0.727	S	S	*	*			trans	-71.4	106.3	171.4	-62.6	0	0	0	0	109.3	T139	S137-T139 PolarHBondContact O-N 3.43Å
138	I	39.1	Very low	39	Very low	158 Å²	158	122.5 Å²	122.5	81%	0.81	75%	0.745	S	S	*	*			trans	-85.7	85.6	174.8	-38.9	174.1	0	0	0	107.9	V136 S140	V136-I138 PolarHBondContact O-N 3.33Å; I138-S140 PolarHBondContact O-N 3.34Å
139	T	37.6	Very low	39.2	Very low	125 Å²	125	124.7 Å²	124.7	77%	0.767	76%	0.759	S	S	*	*			trans	-89.4	91.5	167.3	59	0	0	0	0	108.7	S137 K141	S137-T139 PolarHBondContact O-N 3.43Å; T139-K141 PolarHBondContact O-N 3.49Å
140	S	37.2	Very low	39	Very low	112 Å²	112	125.1 Å²	125.1	78%	0.783	76%	0.763	S	S	*	*			trans	-83.3	106.4	171	-166.4	0	0	0	0	109	I138	I138-S140 PolarHBondContact O-N 3.34Å
141	K	38.6	Very low	39	Very low	199 Å²	199	125.4 Å²	125.4	87%	0.865	77%	0.771	S	S	*	*			trans	-111.4	121.6	163.3	-77.5	-171.1	178.4	-178.2	0	108.9	T139	T139-K141 PolarHBondContact O-N 3.49Å
142	L	30.6	Very low	38.3	Very low	160 Å²	160	127.5 Å²	127.5	84%	0.838	78%	0.778	S	S	*	*			trans	-33.9	135.8	170.9	-122.8	71.1	0	0	0	114.8
143	A	38.4	Very low	38.2	Very low	97 Å²	97	130 Å²	130	80%	0.802	78%	0.779	S	S	*	*			trans	-150.1	96.3	149.6	0	0	0	0	0	109.7
144	T	31.8	Very low	38.2	Very low	130 Å²	130	132 Å²	132	80%	0.798	79%	0.787	S	S	*	*			trans	-70.1	135	164.6	16.1	0	0	0	0	110.7
145	P	39.8	Very low	38	Very low	123 Å²	123	132.7 Å²	132.7	80%	0.799	78%	0.78	S	S	*	*			trans	-120	116.8	148.5	16.9	3.1	0	0	0	110.8
146	S	30.3	Very low	38.1	Very low	103 Å²	103	132.1 Å²	132.1	72%	0.72	78%	0.779	S	S	*	*			trans	-51.5	139.8	161.8	156.6	0	0	0	0	111.7
147	L	38.3	Very low	38.1	Very low	170 Å²	170	132.5 Å²	132.5	89%	0.89	78%	0.777	S	S	*	*			trans	-168.7	103.1	149.3	-98.5	151.3	0	0	0	109.5
148	S	37.8	Very low	38.8	Very low	108 Å²	108	133 Å²	133	76%	0.755	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-88.4	138.5	171.6	-34.4	0	0	0	0	110.1
149	P	48.7	Very low	39.1	Very low	120 Å²	120	130.4 Å²	130.4	78%	0.779	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-103.4	136.9	159.4	33.4	-24.5	0	0	0	111
150	P	41.3	Very low	38.9	Very low	112 Å²	112	131.5 Å²	131.5	73%	0.727	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-84.6	140.9	154.8	36	-27.5	0	0	0	107.1
151	T	41.5	Very low	39	Very low	136 Å²	136	133.1 Å²	133.1	83%	0.834	78%	0.778	S	S	*	*				-168.2	138.6	69.5	16.9	0	0	0	0	111
152	N	37	Very low	38.9	Very low	146 Å²	146	130.5 Å²	130.5	78%	0.781	78%	0.779	S	S	*	*			trans	-56.8	144	156.8	-63.7	-61.5	0	0	0	109.7
153	H	35.3	Very low	39.3	Very low	175 Å²	175	125.8 Å²	125.8	81%	0.81	77%	0.769	S	S	*	*				168.8	130.7	78.6	-113.4	-80.5	0	0	0	103.1
154	V	39.7	Very low	39.2	Very low	134 Å²	134	127.4 Å²	127.4	81%	0.812	77%	0.771	S	S	*	*				-175.7	134.6	70.3	169.3	0	0	0	0	108.2
155	Q	40.1	Very low	39.6	Very low	131 Å²	131	130.7 Å²	130.7	61%	0.612	77%	0.774	S	S	*	*			trans	-73.8	167.4	173.8	-136	-171.5	-103.9	0	0	112.2	N157	Q155-N157 PolarHBondContact NE2-ND2 3.45Å
156	P	43.5	Very low	39.7	Very low	121 Å²	121	132.6 Å²	132.6	79%	0.786	78%	0.776	S	S	*	*				-149.4	121.9	66.8	32.5	-8.8	0	0	0	117.6
157	N	39.8	Very low	40.1	Very low	126 Å²	126	135.5 Å²	135.5	67%	0.674	78%	0.783	S	S	*	*				45.8	157	125.3	-85.7	4.3	0	0	0	126.3	Q155	Q155-N157 PolarHBondContact NE2-ND2 3.45Å
158	P	49.3	Very low	39.8	Very low	107 Å²	107	133.6 Å²	133.6	70%	0.695	77%	0.773	S	S	*	*			trans	-121.6	-156	-140.2	45.9	-28.3	0	0	0	113.3
159	P	44.4	Very low	39.8	Very low	103 Å²	103	133.2 Å²	133.2	67%	0.669	78%	0.777	S	S	*	*				-157.4	169.1	65.9	40.4	-16.3	0	0	0	119.8
160	N	34.3	Very low	39	Very low	149 Å²	149	135.4 Å²	135.4	80%	0.797	77%	0.774	S	S	*	*			trans	67.9	117.1	149	-64.2	-15.5	0	0	0	122.6
161	T	38.8	Very low	38.5	Very low	145 Å²	145	136 Å²	136	89%	0.89	78%	0.781	S	S	*	*				-173.1	129.8	109.6	-64.8	0	0	0	0	111
162	T	36.9	Very low	38.1	Very low	144 Å²	144	135.5 Å²	135.5	88%	0.883	78%	0.778	S	S	*	*			trans	-85.7	140.3	-170.6	-53.7	0	0	0	0	113.2
163	G	38	Very low	38	Very low	61 Å²	61	133.5 Å²	133.5	63%	0.629	78%	0.782	S	S	*	*			trans	-173.3	129	162.3	0	0	0	0	0	111.7	K165	G163-K165 PolarHBondContact O-N 3.23Å
164	P	37.5	Very low	37.9	Very low	131 Å²	131	132.2 Å²	132.2	85%	0.851	78%	0.776	S	S	*	*			trans	-79.2	117.9	-174.2	31.3	-30.6	0	0	0	110.7
165	K	39.4	Very low	37.8	Very low	200 Å²	200	133.9 Å²	133.9	87%	0.87	78%	0.777	S	S	*	*			trans	-81.2	112.8	168.5	-111.8	174.3	179.4	173.3	0	109	G163 L167	G163-K165 PolarHBondContact O-N 3.23Å; K165-L167 PolarHBondContact O-N 3.02Å; K165-L167 VanDerWaalsContact O-N 3.15Å
166	I	41.4	Very low	37.3	Very low	163 Å²	163	132 Å²	132	84%	0.836	78%	0.779	S	S	*	*			trans	-65.1	109.6	168	-61.4	172.9	0	0	0	107.5	N168	I166-N168 PolarHBondContact O-N 3.2Å
167	L	39.5	Very low	37	Very low	164 Å²	164	135.8 Å²	135.8	86%	0.859	79%	0.785	S	S	*	*			trans	-73.6	112.2	173.1	-101.7	148.1	0	0	0	109.3	K165 A169	K165-L167 PolarHBondContact O-N 3.02Å; K165-L167 VanDerWaalsContact O-N 3.15Å; L167-A169 PolarHBondContact O-N 2.93Å; L167-A169 VanDerWaalsContact O-N 3.11Å
168	N	32.3	Very low	36.4	Very low	129 Å²	129	138.9 Å²	138.9	69%	0.69	80%	0.796	S	S	*	*			trans	-66.1	101.3	168.1	-119.4	-6	0	0	0	108.6	I166 F170	I166-N168 PolarHBondContact O-N 3.2Å; N168-F170 HydrophobicContact CB-CD2 4.3Å; N168-F170 HydrophobicContact CB-CE2 4.2Å; N168-F170 PolarHBondContact O-N 3.44Å; N168-F170 VanDerWaalsContact O-N 3.12Å
169	A	36.3	Very low	35.7	Very low	100 Å²	100	141.8 Å²	141.8	83%	0.826	81%	0.805	S	S	*	*			trans	-78.7	89.4	171.4	0	0	0	0	0	109.7	L167	L167-A169 PolarHBondContact O-N 2.93Å; L167-A169 VanDerWaalsContact O-N 3.11Å
170	F	32.1	Very low	35.1	Very low	167 Å²	167	141.4 Å²	141.4	73%	0.732	81%	0.81	S	S	*	*			trans	-80.6	108.6	155.5	-72.8	-83.5	0	0	0	107.3	N168 T172	N168-F170 HydrophobicContact CB-CD2 4.3Å; N168-F170 HydrophobicContact CB-CE2 4.2Å; N168-F170 PolarHBondContact O-N 3.44Å; N168-F170 VanDerWaalsContact O-N 3.12Å; F170-T172 PolarHBondContact O-N 2.95Å
171	S	31	Very low	34.9	Very low	124 Å²	124	141 Å²	141	87%	0.867	81%	0.807	S	S	*	*			trans	-84.6	93.5	173.2	-151	0	0	0	0	108.9
172	T	33.5	Very low	34.7	Very low	125 Å²	125	139.9 Å²	139.9	77%	0.767	80%	0.802	S	S	*	*			trans	-68.3	118.8	165.8	-27.6	0	0	0	0	108.4	F170	F170-T172 PolarHBondContact O-N 2.95Å
173	A	35.1	Very low	34.4	Very low	105 Å²	105	141.3 Å²	141.3	87%	0.868	80%	0.798	S	S	*	*			trans	-127.9	79.6	164.1	0	0	0	0	0	108.3
174	H	33.5	Very low	34.2	Very low	147 Å²	147	145.5 Å²	145.5	68%	0.681	81%	0.806	S	S	*	*			trans	-104.4	113.3	161.2	174.7	-79.4	0	0	0	105.8
175	M	36.5	Very low	34.1	Very low	169 Å²	169	145.2 Å²	145.2	83%	0.833	80%	0.802	S	S	*	*			trans	-154.8	109.2	154.8	-79.2	-47.5	154.4	0	0	111
176	S	31.1	Very low	33.7	Very low	93 Å²	93	139.6 Å²	139.6	65%	0.65	79%	0.793	S	S	*	*			trans	56.4	103.5	134.1	-54.4	0	0	0	0	120.2
177	Q	35.7	Very low	33.2	Very low	199 Å²	199	137.9 Å²	137.9	93%	0.93	79%	0.79	S	S	*	*			trans	-126.9	110.4	134.7	-70.8	-169.1	22.3	0	0	109.2
178	Q	28.6	Very low	32.9	Very low	191 Å²	191	138 Å²	138	89%	0.893	79%	0.79	S	S	*	*			trans	-80.2	112.5	175.1	-170.4	173.8	-0	0	0	106.6
179	L	33.3	Very low	32.9	Very low	168 Å²	168	140.8 Å²	140.8	88%	0.88	80%	0.799	S	S	*	*			trans	-130.2	110	167.2	-150.6	76.1	0	0	0	108.6
180	A	32.7	Very low	32.8	Very low	95 Å²	95	142 Å²	142	79%	0.785	80%	0.798	S	S	*	*			trans	-68.3	135	-179.7	0	0	0	0	0	110.8
181	I	30.1	Very low	32.9	Very low	142 Å²	142	140.4 Å²	140.4	73%	0.728	80%	0.802	S	S	*	*			trans	-96	139.3	168	-59.1	167.2	0	0	0	107.1
182	P	35.2	Very low	32.7	Very low	120 Å²	120	140.4 Å²	140.4	78%	0.779	80%	0.797	S	S	*	*			trans	-119.2	132.9	138.3	25.9	-11.7	0	0	0	110.9
183	H	29.8	Very low	32.5	Very low	174 Å²	174	140.6 Å²	140.6	81%	0.806	80%	0.798	S	S	*	*			trans	-63.2	137.8	170.4	-75.8	-102.7	0	0	0	110.8
184	D	33.5	Very low	32.1	Very low	149 Å²	149	140.7 Å²	140.7	80%	0.797	79%	0.789	S	S	*	*				-163.5	120.6	128.8	-128.6	-4.2	0	0	0	113.8
185	V	35.2	Very low	32.1	Very low	126 Å²	126	140.8 Å²	140.8	76%	0.764	79%	0.794	S	S	*	*			trans	54.3	132.2	134.5	174.5	0	0	0	0	123.4
186	A	31.8	Very low	31.7	Very low	82 Å²	82	140 Å²	140	68%	0.678	79%	0.793	S	S	*	*			trans	80.1	103.2	152.4	0	0	0	0	0	118.2
187	V	29.8	Very low	31.7	Very low	127 Å²	127	144.5 Å²	144.5	77%	0.77	81%	0.806	S	S	*	*				70.6	98.4	75	176.5	0	0	0	0	111.5
188	L	34.5	Very low	31.4	Very low	166 Å²	166	142.2 Å²	142.2	87%	0.869	81%	0.806	S	S	*	*				168.2	135.5	117.1	-82.9	169.6	0	0	0	110.7
189	Q	31.3	Very low	31.5	Very low	188 Å²	188	136.2 Å²	136.2	88%	0.879	80%	0.795	S	S	*	*			trans	-61.6	167.9	-179	-65.9	172.9	-38.9	0	0	113.1
190	P	34.2	Very low	31.1	Very low	124 Å²	124	137.7 Å²	137.7	81%	0.805	80%	0.797	S	S	*	*			trans	-135.4	142.2	130.7	22.1	-2.2	0	0	0	115.6
191	T	34	Very low	31	Very low	134 Å²	134	138.4 Å²	138.4	82%	0.822	79%	0.791	S	S	*	*			trans	-48.8	149.9	164.5	7.9	0	0	0	0	114.8
192	T	28.1	Very low	30.8	Very low	124 Å²	124	136.6 Å²	136.6	76%	0.761	80%	0.798	S	S	*	*			trans	-46.8	141.5	165.9	48.6	0	0	0	0	114.2
193	T	29.4	Very low	30.7	Very low	129 Å²	129	137 Å²	137	79%	0.791	79%	0.792	S	S	*	*				175.1	142	126.9	-71.9	0	0	0	0	111.9
194	T	26.8	Very low	30.6	Very low	108 Å²	108	136 Å²	136	66%	0.663	79%	0.793	S	S	*	*			trans	-44	141.1	176	46	0	0	0	0	118.1
195	N	31.5	Very low	30.5	Very low	148 Å²	148	139.7 Å²	139.7	79%	0.791	80%	0.796	S	S	*	*				171.6	142.6	112.8	-86.7	-26.6	0	0	0	113
196	N	28.8	Very low	30.1	Very low	154 Å²	154	139.5 Å²	139.5	82%	0.824	79%	0.794	S	S	*	*			trans	-15.1	127.1	165.5	-66.3	-16.7	0	0	0	116.6
197	M	31.5	Very low	30.1	Very low	187 Å²	187	139.2 Å²	139.2	92%	0.921	79%	0.792	S	S	*	*				-157.1	140.8	128.5	-74.2	-153.4	80.2	0	0	110.4
198	V	28.9	Very low	30	Very low	151 Å²	151	140.5 Å²	140.5	92%	0.915	79%	0.794	S	S	*	*			trans	-42.5	130	170.7	171.4	0	0	0	0	111.7
199	G	30.6	Very low	29.9	Very low	64 Å²	64	139.6 Å²	139.6	66%	0.66	79%	0.789	S	S	*	*			trans	-170.3	91.2	178.5	0	0	0	0	0	110.8	V201	G199-V201 PolarHBondContact O-N 3.21Å; G199-V201 VanDerWaalsContact O-N 3.11Å
200	E	25.7	Very low	29.9	Very low	199 Å²	199	136.3 Å²	136.3	93%	0.93	78%	0.782	S	S	*	*			trans	-58	104.7	167.8	-172.2	178.4	-177.5	0	0	109.4
201	V	29.9	Very low	30	Very low	110 Å²	110	136.3 Å²	136.3	67%	0.667	78%	0.782	S	S	*	*			trans	-138.5	111.7	166.2	-178.4	0	0	0	0	107.9	G199 I203	G199-V201 PolarHBondContact O-N 3.21Å; G199-V201 VanDerWaalsContact O-N 3.11Å; V201-I203 HydrophobicContact CB-CG1 4.48Å; V201-I203 HydrophobicContact CG1-CG1 3.91Å; V201-I203 PolarHBondContact O-N 3.35Å
202	A	26.5	Very low	29.8	Very low	104 Å²	104	135.6 Å²	135.6	86%	0.86	78%	0.777	S	S	*	*			trans	-60.9	110.9	167.6	0	0	0	0	0	109.2
203	I	33	Very low	30.1	Very low	128 Å²	128	134.4 Å²	134.4	66%	0.656	77%	0.774	S	S	*	*			trans	-116.1	99.6	172.7	-42.6	174.2	0	0	0	108.3	V201 R205	V201-I203 HydrophobicContact CB-CG1 4.48Å; V201-I203 HydrophobicContact CG1-CG1 3.91Å; V201-I203 PolarHBondContact O-N 3.35Å; I203-R205 PolarHBondContact O-N 3.12Å; I203-R205 VanDerWaalsContact O-N 3.09Å
204	N	27.6	Very low	30.1	Very low	155 Å²	155	133.6 Å²	133.6	83%	0.829	77%	0.772	S	S	*	*			trans	-40.4	110.8	156.8	-90.2	-46.8	0	0	0	110.4
205	R	30.7	Very low	30.6	Very low	226 Å²	226	135.8 Å²	135.8	85%	0.853	78%	0.778	S	S	*	*			trans	-127.4	82.2	160.3	-77.6	-168	173.9	-173.6	-0.2	108.9	I203 A207	I203-R205 PolarHBondContact O-N 3.12Å; I203-R205 VanDerWaalsContact O-N 3.09Å; R205-A207 PolarHBondContact O-N 3.43Å
206	V	28.5	Very low	30.5	Very low	121 Å²	121	133.1 Å²	133.1	73%	0.733	77%	0.771	S	S	*	*			trans	-64.2	90.8	158.5	179.3	0	0	0	0	106.8	L208	V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 HydrophobicContact CG1-CG 4.19Å; V206-L208 PolarHBondContact O-N 3.08Å
207	A	30.1	Very low	30.7	Very low	76 Å²	76	133 Å²	133	63%	0.628	76%	0.764	S	S	*	*			trans	-77.2	87.7	169.5	0	0	0	0	0	108.3	R205 L209	R205-A207 PolarHBondContact O-N 3.43Å; A207-L209 HydrophobicContact CB-CD1 4.37Å; A207-L209 HydrophobicContact CB-CG 4.33Å; A207-L209 PolarHBondContact O-N 3.37Å
208	L	28.8	Very low	30.7	Very low	155 Å²	155	127.9 Å²	127.9	81%	0.812	76%	0.758	S	S	*	*			trans	-63.3	83.8	158	-76.8	166.4	0	0	0	108	V206	V206-L208 VanDerWaalsContact C-N 3.31Å; V206-L208 HydrophobicContact CG1-CG 4.19Å; V206-L208 PolarHBondContact O-N 3.08Å
209	L	31.7	Very low	31	Very low	147 Å²	147	126.9 Å²	126.9	77%	0.77	75%	0.752	S	S	*	*			trans	-106.2	88	169.8	-71.6	174.6	0	0	0	108.8	A207 P211	A207-L209 HydrophobicContact CB-CD1 4.37Å; A207-L209 HydrophobicContact CB-CG 4.33Å; A207-L209 PolarHBondContact O-N 3.37Å; L209-P211 WeakPolarHBondContact O-CD 3.35Å
210	T	30.7	Very low	31.1	Very low	119 Å²	119	128.6 Å²	128.6	73%	0.73	76%	0.76	S	S	*	*			trans	-44.8	118	154.6	-25.3	0	0	0	0	108.8	V212	T210-V212 VanDerWaalsContact C-N 3.31Å; T210-V212 PolarHBondContact O-N 2.85Å
211	P	36.6	Very low	31.6	Very low	124 Å²	124	130.1 Å²	130.1	81%	0.805	76%	0.758	S	S	*	*			trans	-78.6	90.3	172.9	29.1	-29	0	0	0	108.6	L209 S213	L209-P211 WeakPolarHBondContact O-CD 3.35Å; P211-S213 PolarHBondContact O-N 3.04Å
212	V	31	Very low	31.9	Very low	119 Å²	119	131.2 Å²	131.2	72%	0.721	76%	0.764	S	S	*	*			trans	-67.9	110.3	151.3	-171.6	0	0	0	0	105.5	T210	T210-V212 VanDerWaalsContact C-N 3.31Å; T210-V212 PolarHBondContact O-N 2.85Å
213	S	34.3	Very low	32	Very low	99 Å²	99	135.2 Å²	135.2	69%	0.692	77%	0.765	S	S	*	*			trans	-134.6	85.3	163.9	-158.6	0	0	0	0	109.5	P211	P211-S213 PolarHBondContact O-N 3.04Å
214	C	29.3	Very low	32	Very low	111 Å²	111	135.6 Å²	135.6	75%	0.75	77%	0.773	S	S	*	*			trans	-69.1	123	158.2	-49.4	0	0	0	0	107.6
215	I	37.4	Very low	32.3	Very low	154 Å²	154	132.8 Å²	132.8	79%	0.79	77%	0.772	S	S	*	*			trans	-144.8	121.7	153.8	-26.5	172	0	0	0	108.4
216	S	28.7	Very low	32.2	Very low	93 Å²	93	127.4 Å²	127.4	65%	0.65	77%	0.769	S	S	*	*			trans	-108	134.4	-176.6	-106.4	0	0	0	0	110.8
217	F	32.4	Very low	32.5	Very low	152 Å²	152	128.5 Å²	128.5	67%	0.667	78%	0.775	S	S	*	*			trans	50.8	129.9	147.9	-51.8	-62.5	0	0	0	123.5	K322	F217-K322 HydrophobicContact CE1-CD 4.32Å; F217-K322 HydrophobicContact CE2-CD 4.44Å; F217-K322 HydrophobicContact CZ-CD 3.71Å
218	G	32.9	Very low	32.6	Very low	78 Å²	78	130 Å²	130	80%	0.804	78%	0.781	S	S	*	*			trans	-159.2	93.9	145.3	0	0	0	0	0	109.7
219	V	34.5	Very low	32.8	Very low	131 Å²	131	128.5 Å²	128.5	79%	0.794	78%	0.781	S	S	*	*			trans	-112.9	101	165.2	173.1	0	0	0	0	106.6	R221	V219-R221 PolarHBondContact O-N 3.39Å
220	A	33.8	Very low	33	Very low	100 Å²	100	128.2 Å²	128.2	83%	0.826	79%	0.785	S	S	*	*			trans	-71.6	118.3	161.9	0	0	0	0	0	107.7
221	R	34.4	Very low	33.2	Very low	231 Å²	231	133.8 Å²	133.8	87%	0.872	79%	0.793	S	S	*	*			trans	-102.8	107.2	173.4	-161	178	-161	164	3.4	107.4	V219	V219-R221 PolarHBondContact O-N 3.39Å
222	T	36.7	Very low	33.1	Very low	132 Å²	132	136 Å²	136	81%	0.81	79%	0.792	S	S	*	*			trans	-71.6	142.2	169.2	41.3	0	0	0	0	110.2
223	H	28.4	Very low	33.3	Very low	188 Å²	188	137.1 Å²	137.1	87%	0.87	80%	0.799	S	S	*	*			trans	-67.2	137.1	-172.7	-71.9	-107.7	0	0	0	113.2
224	T	33.4	Very low	33.3	Very low	136 Å²	136	138.7 Å²	138.7	83%	0.834	80%	0.8	S	S	*	*			trans	-163.9	100.1	137.5	50.5	0	0	0	0	106.4
225	A	33.2	Very low	33.7	Very low	96 Å²	96	141.7 Å²	141.7	79%	0.793	81%	0.805	S	S	*	*				89.9	121.7	96.5	0	0	0	0	0	113.5
226	S	30.2	Very low	33.6	Very low	114 Å²	114	139.6 Å²	139.6	80%	0.797	80%	0.804	S	S	*	*			trans	71.7	104.2	155.7	-165.1	0	0	0	0	118.2
227	V	35	Very low	34	Very low	143 Å²	143	145 Å²	145	87%	0.867	82%	0.816	S	S	*	*				-163.4	131.5	108.4	175.1	0	0	0	0	108.3
228	S	32.1	Very low	34.8	Very low	108 Å²	108	142.9 Å²	142.9	76%	0.755	82%	0.817	S	S	*	*			trans	-59.8	160.8	-172.2	-68.9	0	0	0	0	117.3
229	P	31.9	Very low	35	Very low	124 Å²	124	145 Å²	145	81%	0.805	82%	0.817	S	S	*	*			trans	-96.3	147.9	-171.5	37.4	-30.8	0	0	0	113.1
230	V	35.1	Very low	35.4	Very low	141 Å²	141	143.5 Å²	143.5	86%	0.855	81%	0.812	S	S	*	*			trans	-108.7	106.4	169.4	178.6	0	0	0	0	110.4
231	R	36.5	Very low	35.7	Very low	235 Å²	235	145.6 Å²	145.6	89%	0.887	81%	0.809	S	S	*	*			trans	48.8	115.6	144.3	-72.1	-177	167.1	162.9	-3.3	121.1
232	E	33.4	Very low	36	Very low	170 Å²	170	143.3 Å²	143.3	79%	0.794	81%	0.809	S	S	*	*			trans	-54.1	143.7	155.3	-64.3	168.4	141.1	0	0	113
233	V	36.7	Very low	35.9	Very low	143 Å²	143	141.9 Å²	141.9	87%	0.867	80%	0.802	S	S	*	*			trans	-124.6	107.7	145.9	174.4	0	0	0	0	107.1
234	N	34.2	Very low	36	Very low	132 Å²	132	138.2 Å²	138.2	71%	0.706	80%	0.798	S	S	*	*			trans	-55.5	140.5	164.2	-88.7	-51.2	0	0	0	110.8
235	M	35.9	Very low	36.1	Very low	175 Å²	175	143.2 Å²	143.2	86%	0.862	80%	0.801	S	S	*	*			trans	-155.5	107.7	133.7	-83.1	-127.8	-160.5	0	0	110.4
236	S	36.5	Very low	36	Very low	110 Å²	110	146.1 Å²	146.1	77%	0.769	80%	0.803	S	S	*	*				74.5	112.2	128	-41.2	0	0	0	0	119.8
237	K	37.4	Very low	36.4	Very low	205 Å²	205	146.2 Å²	146.2	89%	0.891	80%	0.801	S	S	*	*			trans	-82.1	159.2	176.4	-171	165.7	-176.3	177.7	0	112
238	P	48.2	Very low	36.4	Very low	108 Å²	108	146.1 Å²	146.1	70%	0.701	80%	0.8	S	S	*	*			trans	-99.5	-167.8	-163.6	40.6	-31.7	0	0	0	113
239	P	37.5	Very low	36.4	Very low	123 Å²	123	146.8 Å²	146.8	80%	0.799	80%	0.8	S	S	*	*				-152.8	176.4	120.4	36.5	-18	0	0	0	116.4
240	S	42.8	Very low	36.5	Very low	100 Å²	100	145 Å²	145	70%	0.699	80%	0.796	S	S	*	*			trans	93.2	134.2	154	-160.8	0	0	0	0	116.3
241	D	39.3	Very low	36.5	Very low	143 Å²	143	144.4 Å²	144.4	77%	0.765	79%	0.793	S	S	*	*			cis	-170.8	159.1	-16.4	-99.9	-46.6	0	0	0	106.3
242	Q	40.5	Very low	36.8	Very low	183 Å²	183	139.9 Å²	139.9	86%	0.855	79%	0.785	S	S	*	*			trans	89	155.9	149.1	-97.3	-162.4	4.1	0	0	122.3
243	P	34.7	Very low	36.9	Very low	102 Å²	102	137.7 Å²	137.7	66%	0.662	78%	0.779	S	S	*	*				-128.1	171.4	-104.2	39.5	-21.7	0	0	0	116.2
244	S	32.2	Very low	37.1	Very low	112 Å²	112	137.5 Å²	137.5	78%	0.783	77%	0.772	S	S	*	*			trans	49	103.2	152.7	67.6	0	0	0	0	120.4
245	R	34.2	Very low	37.2	Very low	240 Å²	240	135.8 Å²	135.8	91%	0.906	77%	0.77	S	S	*	*			trans	-151.8	108	139	-151.5	171.5	-169.4	168.7	3	110.8	P247	R245-P247 WeakPolarHBondContact O-CD 3.5Å
246	N	31.9	Very low	37.3	Very low	158 Å²	158	133 Å²	133	85%	0.845	76%	0.763	S	S	*	*			trans	-55.7	131.6	172.5	-70.4	-16.6	0	0	0	110.9
247	P	38.8	Very low	37.2	Very low	116 Å²	116	132.5 Å²	132.5	75%	0.753	76%	0.759	S	S	*	*			trans	-104.8	124.1	150	22.2	-4.8	0	0	0	109.2	R245 T249	R245-P247 WeakPolarHBondContact O-CD 3.5Å; P247-T249 PolarHBondContact O-N 3.25Å; P247-T249 VanDerWaalsContact O-N 3.14Å
248	V	33.8	Very low	37.1	Very low	140 Å²	140	127.5 Å²	127.5	85%	0.848	75%	0.75	S	S	*	*			trans	-43.2	111.5	171.7	174.6	0	0	0	0	110.6	A250	V248-A250 PolarHBondContact O-N 3.1Å
249	T	33.2	Very low	37	Very low	123 Å²	123	130.4 Å²	130.4	76%	0.755	75%	0.754	S	S	*	*			trans	-72	104.5	165.8	28.6	0	0	0	0	108.8	P247 T251	P247-T249 PolarHBondContact O-N 3.25Å; P247-T249 VanDerWaalsContact O-N 3.14Å; T249-T251 PolarHBondContact O-N 2.95Å; T249-T251 VanDerWaalsContact O-N 3.17Å
250	A	34.3	Very low	37.3	Very low	87 Å²	87	131 Å²	131	72%	0.719	75%	0.751	S	S	*	*			trans	-70.6	101	160	0	0	0	0	0	107.8	V248 I252	V248-A250 PolarHBondContact O-N 3.1Å; A250-I252 PolarHBondContact O-N 3.49Å; A250-I252 VanDerWaalsContact O-N 3.13Å
251	T	35	Very low	37.2	Very low	128 Å²	128	136 Å²	136	79%	0.785	76%	0.763	S	S	*	*			trans	-66.7	106.4	171.9	-47.8	0	0	0	0	108.1	T249 D253	T249-T251 PolarHBondContact O-N 2.95Å; T249-T251 VanDerWaalsContact O-N 3.17Å; T251-D253 PolarHBondContact O-N 3.36Å
252	I	41.4	Very low	37.4	Very low	140 Å²	140	138 Å²	138	72%	0.718	77%	0.768	S	S	*	*			trans	-77	103.7	166	-59.3	173.9	0	0	0	105.8	A250 L254	A250-I252 PolarHBondContact O-N 3.49Å; A250-I252 VanDerWaalsContact O-N 3.13Å; I252-L254 HydrophobicContact CG2-CD2 3.75Å; I252-L254 HydrophobicContact CG2-CG 4.08Å; I252-L254 PolarHBondContact O-N 2.97Å
253	D	36.7	Very low	37.1	Very low	124 Å²	124	133.8 Å²	133.8	66%	0.663	76%	0.759	S	S	*	*			trans	-67.3	96.8	170.6	-173.4	1.8	0	0	0	108.7	T251 S255	T251-D253 PolarHBondContact O-N 3.36Å; D253-S255 PolarHBondContact O-N 2.93Å; D253-S255 WeakPolarHBondContact OD1-CB 3.43Å; D253-S255 PolarHBondContact OD1-N 3.02Å; D253-S255 VanDerWaalsContact OD1-N 3.15Å; D253-S255 PolarHBondContact OD1-OG 2.8Å; D253-S255 PolarHBondContact OD2-OG 3.27Å
254	L	40.5	Very low	36.9	Very low	139 Å²	139	134.9 Å²	134.9	73%	0.728	77%	0.768	S	S	*	*			trans	-86.3	58.6	169.6	-62.5	177.4	0	0	0	108.9	I252 V256	I252-L254 HydrophobicContact CG2-CD2 3.75Å; I252-L254 HydrophobicContact CG2-CG 4.08Å; I252-L254 PolarHBondContact O-N 2.97Å; L254-V256 PolarHBondContact O-N 2.7Å
255	S	35.3	Very low	37.2	Very low	96 Å²	96	136.2 Å²	136.2	67%	0.671	77%	0.765	S	S	*	*			trans	-67.7	75.2	164.4	-74.5	0	0	0	0	109	D253 S257	D253-S255 PolarHBondContact O-N 2.93Å; D253-S255 WeakPolarHBondContact OD1-CB 3.43Å; D253-S255 PolarHBondContact OD1-N 3.02Å; D253-S255 VanDerWaalsContact OD1-N 3.15Å; D253-S255 PolarHBondContact OD1-OG 2.8Å; D253-S255 PolarHBondContact OD2-OG 3.27Å; S255-S257 PolarHBondContact O-N 3.11Å
256	V	38.7	Very low	37.2	Very low	117 Å²	117	133.8 Å²	133.8	71%	0.709	76%	0.764	S	S	*	*			trans	-66.3	115.1	164.2	176	0	0	0	0	105.8	L254 S258	L254-V256 PolarHBondContact O-N 2.7Å; V256-S258 PolarHBondContact O-N 3.14Å
257	S	33.9	Very low	37.5	Very low	98 Å²	98	133.6 Å²	133.6	69%	0.685	76%	0.762	S	S	*	*			trans	-58.9	95.5	164.3	-172.5	0	0	0	0	107.7	S255 E259	S255-S257 PolarHBondContact O-N 3.11Å; S257-E259 PolarHBondContact O-N 2.83Å; S257-E259 VanDerWaalsContact O-N 3.11Å
258	S	36.9	Very low	37.2	Very low	101 Å²	101	133.9 Å²	133.9	71%	0.706	77%	0.767	S	S	*	*			trans	-70.1	91.8	173.2	171.1	0	0	0	0	108.1	V256 D260	V256-S258 PolarHBondContact O-N 3.14Å; S258-D260 PolarHBondContact O-N 2.9Å
259	E	44.8	Very low	37	Very low	168 Å²	168	130.6 Å²	130.6	79%	0.785	76%	0.761	S	S	*	*			trans	-92.9	88.3	168.6	-40.1	177.9	148	0	0	108.4	S257	S257-E259 PolarHBondContact O-N 2.83Å; S257-E259 VanDerWaalsContact O-N 3.11Å
260	D	43.7	Very low	37.1	Very low	137 Å²	137	131.9 Å²	131.9	73%	0.733	77%	0.769	S	S	*	*			trans	27.4	111	155.1	-60.7	-47.6	0	0	0	120	S258 E262	S258-D260 PolarHBondContact O-N 2.9Å; D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact O-N 3.23Å
261	E	41.2	Very low	37	Very low	204 Å²	204	137.8 Å²	137.8	95%	0.953	77%	0.773	S	S	*	*			trans	-66	83.9	157.7	-59.6	-101.2	118.1	0	0	109.2	S263	E261-S263 PolarHBondContact O-N 2.94Å; E261-S263 VanDerWaalsContact O-N 3.07Å
262	E	43	Very low	37	Very low	185 Å²	185	138.8 Å²	138.8	86%	0.864	77%	0.773	S	S	*	*			trans	-75.6	105.1	177.3	-149.9	168.9	168.2	0	0	110.6	D260	D260-E262 VanDerWaalsContact C-N 3.31Å; D260-E262 PolarHBondContact O-N 3.23Å
263	S	36.2	Very low	36.7	Very low	94 Å²	94	140.3 Å²	140.3	66%	0.657	78%	0.778	S	S	*	*			trans	-41.6	131.3	170.8	-178.3	0	0	0	0	112.8	E261 L265	E261-S263 PolarHBondContact O-N 2.94Å; E261-S263 VanDerWaalsContact O-N 3.07Å; S263-L265 PolarHBondContact O-N 3.28Å; S263-L265 VanDerWaalsContact O-N 3.09Å
264	C	30.4	Very low	36.6	Very low	126 Å²	126	139.6 Å²	139.6	85%	0.851	79%	0.789	S	S	*	*			trans	-66.3	103.9	170.6	-70.5	0	0	0	0	109.8
265	L	37.5	Very low	36.2	Very low	140 Å²	140	139.1 Å²	139.1	73%	0.733	79%	0.787	S	S	*	*			trans	-97	103.8	160.1	-71.4	173.7	0	0	0	109	S263 L267	S263-L265 PolarHBondContact O-N 3.28Å; S263-L265 VanDerWaalsContact O-N 3.09Å; L265-L267 PolarHBondContact O-N 2.9Å
266	E	33.3	Very low	36.4	Very low	189 Å²	189	141.3 Å²	141.3	88%	0.883	80%	0.797	S	S	*	*			trans	-56.7	114.3	152.5	-71.3	-172.2	125	0	0	107.6
267	L	38.8	Very low	36.1	Very low	154 Å²	154	142.8 Å²	142.8	81%	0.806	80%	0.8	S	S	*	*			trans	-126.3	113.6	164.6	-74.7	176.6	0	0	0	109.5	L265	L265-L267 PolarHBondContact O-N 2.9Å
268	S	33.5	Very low	36.2	Very low	121 Å²	121	146.4 Å²	146.4	85%	0.846	81%	0.806	S	S	*	*			trans	-46.3	149	170.4	-57.4	0	0	0	0	112.6
269	G	29.6	Very low	36.4	Very low	71 Å²	71	146.9 Å²	146.9	73%	0.732	81%	0.805	S	S	*	*			trans	-69.3	164.8	-168.3	0	0	0	0	0	116.1
270	T	34.1	Very low	35.9	Very low	151 Å²	151	146.7 Å²	146.7	93%	0.926	81%	0.809	S	S	*	*			trans	-153	137.7	140.7	-18.1	0	0	0	0	109.3
271	R	31.9	Very low	35.4	Very low	210 Å²	210	143.4 Å²	143.4	79%	0.792	81%	0.807	S	S	*	*			trans	-69.3	143.3	-179.4	178.6	-175.2	-178.8	122.8	-3.2	110
272	D	36.6	Very low	35.1	Very low	149 Å²	149	140.9 Å²	140.9	80%	0.797	81%	0.806	S	S	*	*				-176.4	156.3	125.7	-87.6	-27.3	0	0	0	114.3
273	Q	34.1	Very low	34.7	Very low	173 Å²	173	135.7 Å²	135.7	81%	0.808	80%	0.802	S	S	*	*			trans	-70.8	150.3	-157.3	-58.6	172.6	19.9	0	0	116
274	A	35.9	Very low	34.7	Very low	109 Å²	109	140 Å²	140	90%	0.901	81%	0.811	S	S	*	*			trans	-156.4	118.1	137	0	0	0	0	0	110.8
275	N	31.4	Very low	34.9	Very low	129 Å²	129	140.8 Å²	140.8	69%	0.69	81%	0.812	S	S	*	*			trans	-90	131.4	175.7	163.2	26.2	0	0	0	109.6
276	T	39.2	Very low	34.8	Very low	142 Å²	142	138.1 Å²	138.1	87%	0.871	81%	0.806	S	S	*	*			trans	-155.1	124.2	144	46.9	0	0	0	0	111.3
277	N	32.5	Very low	35	Very low	147 Å²	147	136.8 Å²	136.8	79%	0.786	80%	0.799	S	S	*	*			trans	-89	140.8	168.6	-72	-50.5	0	0	0	110.7
278	H	35.9	Very low	34.9	Very low	174 Å²	174	137.2 Å²	137.2	81%	0.806	80%	0.802	S	S	*	*			trans	-165.2	100.2	149.1	-140.7	-101.8	0	0	0	109.7
279	V	41.7	Very low	34.7	Very low	112 Å²	112	136.2 Å²	136.2	68%	0.679	80%	0.795	S	S	*	*				78	112.1	92.9	-180	0	0	0	0	115.5
280	N	33.1	Very low	35	Very low	163 Å²	163	141 Å²	141	87%	0.872	80%	0.801	S	S	*	*			trans	28.4	145.4	143.9	-78.9	9.2	0	0	0	124.7
281	G	34.1	Very low	34.8	Very low	68 Å²	68	139.6 Å²	139.6	70%	0.701	79%	0.793	S	S	*	*			trans	155.9	86.5	151.5	0	0	0	0	0	110.9
282	V	34.5	Very low	35	Very low	152 Å²	152	135.4 Å²	135.4	92%	0.921	80%	0.796	S	S	*	*				63.4	125.1	93.2	173.5	0	0	0	0	113.9
283	G	34.2	Very low	34.8	Very low	75 Å²	75	137.3 Å²	137.3	77%	0.773	80%	0.8	S	S	*	*			trans	155.7	85.7	161.7	0	0	0	0	0	114.3
284	E	36	Very low	34.7	Very low	184 Å²	184	135.4 Å²	135.4	86%	0.86	80%	0.804	S	S	*	*			trans	-73	177.8	172.1	-62.8	171.5	141.5	0	0	112.6
285	T	35.9	Very low	34.8	Very low	143 Å²	143	139.6 Å²	139.6	88%	0.877	81%	0.805	S	S	*	*			trans	106.8	136	171.8	70.8	0	0	0	0	112.9
286	S	35.1	Very low	35.5	Very low	84 Å²	84	136.6 Å²	136.6	59%	0.587	80%	0.804	S	S	*	*			cis	-163.3	143.6	-8.5	-138.5	0	0	0	0	105.6
287	E	36.7	Very low	35.9	Very low	162 Å²	162	136.2 Å²	136.2	76%	0.757	80%	0.802	S	S	*	*			trans	38.5	120.6	131.3	-55.2	161.9	156.6	0	0	117
288	D	36.6	Very low	36.9	Very low	162 Å²	162	133.2 Å²	133.2	87%	0.866	79%	0.791	S	S	*	*				-169.1	152.5	72.9	-98.4	-43.7	0	0	0	114.4
289	C	29.3	Very low	38.1	Very low	101 Å²	101	128.5 Å²	128.5	68%	0.682	77%	0.771	S	S	*	*			trans	-71.5	134.4	-179.2	178.2	0	0	0	0	113.9
290	I	36.4	Very low	39.6	Very low	171 Å²	171	125.6 Å²	125.6	88%	0.877	76%	0.756	S	S	*	*			trans	-151.7	110.9	136.9	-26.7	168	0	0	0	110.8
291	T	30.4	Very low	41.5	Very low	121 Å²	121	123.8 Å²	123.8	74%	0.742	74%	0.742	S	S	*	*			trans	-58.4	133.2	163.4	36	0	0	0	0	112.1
292	S	36.2	Very low	43.6	Very low	122 Å²	122	124.9 Å²	124.9	85%	0.853	74%	0.735	S	S	*	*			trans	-145.8	133.5	145.3	92.4	0	0	0	0	111.6
293	E	31.4	Very low	45.7	Very low	189 Å²	189	121.4 Å²	121.4	88%	0.883	71%	0.711	S	S	*	*			trans	-81.9	137.7	-165.1	-58.5	165.5	128.8	0	0	110.6
294	C	32.6	Very low	47.8	Very low	133 Å²	133	121.1 Å²	121.1	90%	0.899	69%	0.691	S	S	*	*			trans	-153.9	77.5	159	-139.9	0	0	0	0	109.2	G296	C294-G296 PolarHBondContact O-N 3.31Å
295	E	37.2	Very low	49.9	Very low	197 Å²	197	118.6 Å²	118.6	92%	0.921	68%	0.679	S	S	*	*			trans	-67.6	94.9	170.5	-74.7	-152.8	143.5	0	0	110.1	T297	E295-T297 PolarHBondContact O-N 3.43Å
296	G	46.7	Very low	52.3	Low	66 Å²	66	118.9 Å²	118.9	68%	0.68	67%	0.668	S	S	*	*			trans	-71.6	112.6	167.4	0	0	0	0	0	110.2	C294	C294-G296 PolarHBondContact O-N 3.31Å
297	T	47.4	Very low	54.7	Low	134 Å²	134	121.7 Å²	121.7	82%	0.822	67%	0.666	S	S	*	*	P	Polyproline II helix	trans	-51.7	124.8	178.7	-35.1	0	0	0	0	110.7	E295 L299	E295-T297 PolarHBondContact O-N 3.43Å; T297-L299 PolarHBondContact O-N 3.26Å
298	P	53.6	Low	57.1	Low	85 Å²	85	118.1 Å²	118.1	55%	0.552	65%	0.651	S	S	*	*	P	Polyproline II helix	trans	-62.7	131.1	179.7	23.1	-31.4	0	0	0	110.5	S300	P298-S300 PolarHBondContact O-N 2.87Å; P298-S300 VanDerWaalsContact O-N 3.11Å
299	L	60.1	Low	59.6	Low	75 Å²	75	116.7 Å²	116.7	39%	0.393	64%	0.637	S	S	.	*	P	Polyproline II helix	trans	-51.9	119.1	171.4	-94.9	140.6	0	0	0	108.8	T297 L303 I304	T297-L299 PolarHBondContact O-N 3.26Å; L299-L303 HydrophobicContact CD2-CB 3.5Å; L299-L303 HydrophobicContact CD2-CD1 3.99Å; L299-L303 HydrophobicContact CD2-CD2 3.97Å; L299-L303 HydrophobicContact CD2-CG 4.02Å; L299-I304 HydrophobicContact CB-CG1 4.38Å
300	S	73.2	Confident	62.5	Low	50 Å²	50	114.7 Å²	114.7	35%	0.35	62%	0.624	S	S	.	*	P	Polyproline II helix	trans	-54.3	147.6	178.2	65.5	0	0	0	0	110.4	P298 T302 L303 I304	P298-S300 PolarHBondContact O-N 2.87Å; P298-S300 VanDerWaalsContact O-N 3.11Å; S300-T302 WeakPolarHBondContact CB-OG1 3.47Å; S300-T302 PolarHBondContact O-N 3.49Å; S300-T302 VanDerWaalsContact O-N 3.08Å; S300-T302 PolarHBondContact OG-OG1 3.37Å; S300-L303 WeakPolarHBondContact O-CA 3.47Å; S300-L303 WeakPolarHBondContact O-CB 3.37Å; S300-L303 PolarHBondContact O-N 3.42Å; S300-L303 WeakPolarHBondContact OG-CD1 3.45Å; S300-L303 PolarHBondContact OG-N 2.93Å; S300-I304 PolarHBondContact O-N 3.32Å; S300-I304 VanDerWaalsContact O-N 3.13Å
301	E	73.7	Confident	65	Low	125 Å²	125	111.5 Å²	111.5	58%	0.584	61%	0.608	S	S	*	*	H	α-helix	trans	-52	-34.4	174.5	178.5	157.2	-123.8	0	0	112.2	R124 L303 I304 H305	R124-E301 IonicContact CZ-OE1 2.81Å; R124-E301 IonicContact NH1-OE1 2.67Å; R124-E301 IonicContact NH2-OE1 3.72Å; R124-E301 PolarHBondContact NH2-OE1 3.28Å; E301-L303 VanDerWaalsContact C-N 3.34Å; E301-L303 PolarHBondContact O-N 3.32Å; E301-I304 PolarHBondContact O-N 3.05Å; E301-H305 WeakPolarHBondContact O-CB 3.31Å; E301-H305 PolarHBondContact O-N 3.03Å
302	T	78.4	Confident	67.8	Low	91 Å²	91	110.1 Å²	110.1	56%	0.558	60%	0.596	S	S	*	*	H	α-helix	trans	-61.7	-37.5	173.8	57.3	0	0	0	0	113.1	S300 K306	S300-T302 WeakPolarHBondContact CB-OG1 3.47Å; S300-T302 PolarHBondContact O-N 3.49Å; S300-T302 VanDerWaalsContact O-N 3.08Å; S300-T302 PolarHBondContact OG-OG1 3.37Å; T302-K306 WeakPolarHBondContact O-CB 2.97Å; T302-K306 VanDerWaalsContact O-CG 3.24Å; T302-K306 WeakPolarHBondContact O-CG 3.27Å; T302-K306 PolarHBondContact O-N 3.03Å
303	L	78.4	Confident	70.5	Confident	80 Å²	80	108.5 Å²	108.5	42%	0.419	58%	0.577	S	S	.	*	H	α-helix	trans	-72	-39.1	176	-94.2	150.8	0	0	0	112.1	L299 S300 E301 K306 R307	L299-L303 HydrophobicContact CD2-CB 3.5Å; L299-L303 HydrophobicContact CD2-CD1 3.99Å; L299-L303 HydrophobicContact CD2-CD2 3.97Å; L299-L303 HydrophobicContact CD2-CG 4.02Å; S300-L303 WeakPolarHBondContact O-CA 3.47Å; S300-L303 WeakPolarHBondContact O-CB 3.37Å; S300-L303 PolarHBondContact O-N 3.42Å; S300-L303 WeakPolarHBondContact OG-CD1 3.45Å; S300-L303 PolarHBondContact OG-N 2.93Å; E301-L303 VanDerWaalsContact C-N 3.34Å; E301-L303 PolarHBondContact O-N 3.32Å; L303-K306 PolarHBondContact O-N 2.79Å; L303-R307 WeakPolarHBondContact O-CG 3.38Å; L303-R307 PolarHBondContact O-N 2.91Å
304	I	77.5	Confident	73.4	Confident	69 Å²	69	105.3 Å²	105.3	35%	0.354	56%	0.56	S	S	.	*	H	α-helix	trans	-62.5	-48.5	175.1	-63	173.3	0	0	0	109.8	L299 S300 E301 K306 R307 I308	L299-I304 HydrophobicContact CB-CG1 4.38Å; S300-I304 PolarHBondContact O-N 3.32Å; S300-I304 VanDerWaalsContact O-N 3.13Å; E301-I304 PolarHBondContact O-N 3.05Å; I304-K306 VanDerWaalsContact C-N 3.34Å; I304-K306 PolarHBondContact O-N 3.49Å; I304-R307 WeakPolarHBondContact O-CB 3.25Å; I304-R307 PolarHBondContact O-N 3.37Å; I304-R307 VanDerWaalsContact O-N 3.1Å; I304-I308 HydrophobicContact CG2-CD1 4Å; I304-I308 WeakPolarHBondContact O-CG1 3.29Å; I304-I308 PolarHBondContact O-N 3.48Å
305	H	80.4	Confident	76.2	Confident	131 Å²	131	103.1 Å²	103.1	61%	0.606	54%	0.539	S	S	*	.	H	α-helix	trans	-61.7	-41.1	178.9	-165.5	82.6	0	0	0	112	E301 R307 I308 K309	E301-H305 WeakPolarHBondContact O-CB 3.31Å; E301-H305 PolarHBondContact O-N 3.03Å; H305-R307 PolarHBondContact O-N 2.87Å; H305-I308 PolarHBondContact O-N 3.35Å; H305-K309 WeakPolarHBondContact O-CB 3.43Å; H305-K309 PolarHBondContact O-N 2.7Å
306	K	86.8	Confident	78.9	Confident	148 Å²	148	98.9 Å²	98.9	64%	0.643	52%	0.519	S	S	*	.	H	α-helix	trans	-60.4	-41.1	172.6	-78.7	175.9	-179.6	-177.9	0	112.5	T302 L303 I304 C310	T302-K306 WeakPolarHBondContact O-CB 2.97Å; T302-K306 VanDerWaalsContact O-CG 3.24Å; T302-K306 WeakPolarHBondContact O-CG 3.27Å; T302-K306 PolarHBondContact O-N 3.03Å; L303-K306 PolarHBondContact O-N 2.79Å; I304-K306 VanDerWaalsContact C-N 3.34Å; I304-K306 PolarHBondContact O-N 3.49Å; K306-C310 WeakPolarHBondContact O-CB 3.45Å; K306-C310 PolarHBondContact O-N 3.21Å
307	R	85.1	Confident	81.1	Confident	144 Å²	144	100 Å²	100	54%	0.543	51%	0.508	S	S	.	.	H	α-helix	trans	-65.5	-44.3	177.3	-79.9	-175.2	177.6	-172.1	0.6	112	L303 I304 H305 C310 L311	L303-R307 WeakPolarHBondContact O-CG 3.38Å; L303-R307 PolarHBondContact O-N 2.91Å; I304-R307 WeakPolarHBondContact O-CB 3.25Å; I304-R307 PolarHBondContact O-N 3.37Å; I304-R307 VanDerWaalsContact O-N 3.1Å; H305-R307 PolarHBondContact O-N 2.87Å; R307-C310 WeakPolarHBondContact O-CB 3.41Å; R307-C310 PolarHBondContact O-N 3.39Å; R307-L311 WeakPolarHBondContact O-CG 3.43Å; R307-L311 PolarHBondContact O-N 3.37Å
308	I	88.4	Confident	83.4	Confident	87 Å²	87	99 Å²	99	45%	0.446	50%	0.498	S	S	.	.	H	α-helix	trans	-59.4	-50.4	176.4	-66.9	169.8	0	0	0	109.9	I304 H305 C310 L311 D312	I304-I308 HydrophobicContact CG2-CD1 4Å; I304-I308 WeakPolarHBondContact O-CG1 3.29Å; I304-I308 PolarHBondContact O-N 3.48Å; H305-I308 PolarHBondContact O-N 3.35Å; I308-C310 VanDerWaalsContact C-N 3.27Å; I308-C310 PolarHBondContact O-N 2.94Å; I308-L311 WeakPolarHBondContact O-CA 3.37Å; I308-L311 WeakPolarHBondContact O-CB 3.38Å; I308-L311 PolarHBondContact O-N 3.49Å; I308-D312 PolarHBondContact O-N 3.15Å
309	K	89	Confident	85.3	Confident	132 Å²	132	101.8 Å²	101.8	57%	0.574	50%	0.501	S	S	*	.	H	α-helix	trans	-57.8	-38.3	177.2	-170.8	173.6	-176.7	175.1	0	112.8	H305 D312 L313	H305-K309 WeakPolarHBondContact O-CB 3.43Å; H305-K309 PolarHBondContact O-N 2.7Å; K309-D312 PolarHBondContact O-N 3.36Å; K309-L313 HydrophobicContact CG-CD1 4.47Å; K309-L313 WeakPolarHBondContact O-CG 3.36Å; K309-L313 PolarHBondContact O-N 3.49Å; K309-L313 VanDerWaalsContact O-N 3.08Å
310	C	89	Confident	86.9	Confident	59 Å²	59	104 Å²	104	40%	0.399	51%	0.511	S	S	.	.	H	α-helix	trans	-65.1	-40.5	175.2	-175.4	0	0	0	0	112.1	K306 R307 I308 K314	K306-C310 WeakPolarHBondContact O-CB 3.45Å; K306-C310 PolarHBondContact O-N 3.21Å; R307-C310 WeakPolarHBondContact O-CB 3.41Å; R307-C310 PolarHBondContact O-N 3.39Å; I308-C310 VanDerWaalsContact C-N 3.27Å; I308-C310 PolarHBondContact O-N 2.94Å; C310-K314 WeakPolarHBondContact O-CG 3.5Å; C310-K314 PolarHBondContact O-N 3.4Å
311	L	88.9	Confident	88	Confident	103 Å²	103	107.4 Å²	107.4	54%	0.539	52%	0.519	S	S	.	.	H	α-helix	trans	-66.3	-42.3	176.5	-70	171.5	0	0	0	111.6	R307 I308 L313 K314 I315	R307-L311 WeakPolarHBondContact O-CG 3.43Å; R307-L311 PolarHBondContact O-N 3.37Å; I308-L311 WeakPolarHBondContact O-CA 3.37Å; I308-L311 WeakPolarHBondContact O-CB 3.38Å; I308-L311 PolarHBondContact O-N 3.49Å; L311-L313 PolarHBondContact O-N 3.38Å; L311-K314 WeakPolarHBondContact O-CB 3.3Å; L311-K314 PolarHBondContact O-N 2.89Å; L311-I315 WeakPolarHBondContact O-CG1 3.42Å; L311-I315 PolarHBondContact O-N 3.48Å
312	D	88.8	Confident	89	Confident	92 Å²	92	106.3 Å²	106.3	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-60.3	-46.5	176.8	-67.9	-28.6	0	0	0	111.5	I308 K309 K314 I315 E316	I308-D312 PolarHBondContact O-N 3.15Å; K309-D312 PolarHBondContact O-N 3.36Å; D312-K314 VanDerWaalsContact C-N 3.33Å; D312-K314 PolarHBondContact O-N 3.27Å; D312-I315 WeakPolarHBondContact O-CB 3.49Å; D312-I315 PolarHBondContact O-N 2.99Å; D312-I315 VanDerWaalsContact O-N 3.16Å; D312-E316 PolarHBondContact O-N 3.1Å
313	L	92.9	Very high	89.7	Confident	88 Å²	88	108.2 Å²	108.2	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-61.5	-39.5	175.1	-73.4	170	0	0	0	112.4	K309 L311 I315 E316 I317	K309-L313 HydrophobicContact CG-CD1 4.47Å; K309-L313 WeakPolarHBondContact O-CG 3.36Å; K309-L313 PolarHBondContact O-N 3.49Å; K309-L313 VanDerWaalsContact O-N 3.08Å; L311-L313 PolarHBondContact O-N 3.38Å; L313-I315 VanDerWaalsContact C-N 3.34Å; L313-E316 PolarHBondContact O-N 3.42Å; L313-I317 VanDerWaalsContact O-CG1 3.3Å; L313-I317 WeakPolarHBondContact O-CG1 3.37Å; L313-I317 PolarHBondContact O-N 3.39Å
314	K	92.7	Very high	90.5	Very high	122 Å²	122	110.7 Å²	110.7	53%	0.53	52%	0.52	S	S	.	.	H	α-helix	trans	-63.1	-41.5	175	-77.6	177.1	178.5	-177.6	0	111.4	C310 L311 D312 E316 I317 L318	C310-K314 WeakPolarHBondContact O-CG 3.5Å; C310-K314 PolarHBondContact O-N 3.4Å; L311-K314 WeakPolarHBondContact O-CB 3.3Å; L311-K314 PolarHBondContact O-N 2.89Å; D312-K314 VanDerWaalsContact C-N 3.33Å; D312-K314 PolarHBondContact O-N 3.27Å; K314-E316 VanDerWaalsContact C-N 3.35Å; K314-I317 PolarHBondContact O-N 2.67Å; K314-L318 WeakPolarHBondContact O-CB 3.38Å; K314-L318 VanDerWaalsContact O-CG 3.26Å; K314-L318 WeakPolarHBondContact O-CG 3.5Å; K314-L318 PolarHBondContact O-N 3.33Å
315	I	92.7	Very high	91.4	Very high	87 Å²	87	114.2 Å²	114.2	45%	0.446	53%	0.529	S	S	.	.	H	α-helix	trans	-63.7	-42.5	176.4	-69.6	166.4	0	0	0	110.5	L311 D312 L313 L318 K319	L311-I315 WeakPolarHBondContact O-CG1 3.42Å; L311-I315 PolarHBondContact O-N 3.48Å; D312-I315 WeakPolarHBondContact O-CB 3.49Å; D312-I315 PolarHBondContact O-N 2.99Å; D312-I315 VanDerWaalsContact O-N 3.16Å; L313-I315 VanDerWaalsContact C-N 3.34Å; I315-L318 PolarHBondContact O-N 2.95Å; I315-K319 HydrophobicContact CG2-CD 4.42Å; I315-K319 WeakPolarHBondContact O-CG 3.39Å; I315-K319 PolarHBondContact O-N 2.66Å
316	E	92.5	Very high	92	Very high	109 Å²	109	110.2 Å²	110.2	51%	0.509	52%	0.515	S	S	.	.	H	α-helix	trans	-60.9	-48.9	176.3	-171.1	179.3	171.5	0	0	111.9	D312 L313 K314 L318 K319 M320	D312-E316 PolarHBondContact O-N 3.1Å; L313-E316 PolarHBondContact O-N 3.42Å; K314-E316 VanDerWaalsContact C-N 3.35Å; E316-L318 VanDerWaalsContact C-N 3.28Å; E316-L318 PolarHBondContact O-N 2.63Å; E316-K319 WeakPolarHBondContact O-CB 3.4Å; E316-K319 PolarHBondContact O-N 3.1Å; E316-K319 VanDerWaalsContact O-N 3.09Å; E316-M320 WeakPolarHBondContact O-CG 3.47Å; E316-M320 PolarHBondContact O-N 2.89Å
317	I	94	Very high	92.2	Very high	88 Å²	88	107.2 Å²	107.2	45%	0.451	50%	0.504	S	S	.	.	H	α-helix	trans	-58.2	-41.7	175.5	-69.4	166.7	0	0	0	110.9	L313 K314 M320 K321	L313-I317 VanDerWaalsContact O-CG1 3.3Å; L313-I317 WeakPolarHBondContact O-CG1 3.37Å; L313-I317 PolarHBondContact O-N 3.39Å; K314-I317 PolarHBondContact O-N 2.67Å; I317-M320 PolarHBondContact O-N 3.27Å; I317-K321 HydrophobicContact CG2-CD 4.21Å; I317-K321 HydrophobicContact CG2-CG 4.41Å; I317-K321 WeakPolarHBondContact O-CB 3.36Å; I317-K321 WeakPolarHBondContact O-CG 3.37Å; I317-K321 PolarHBondContact O-N 2.87Å
318	L	95	Very high	92.6	Very high	115 Å²	115	105.1 Å²	105.1	60%	0.602	50%	0.499	S	S	*	.	H	α-helix	trans	-65.1	-38.5	177.4	-73.4	172.2	0	0	0	112	K314 I315 E316 K321 K322	K314-L318 WeakPolarHBondContact O-CB 3.38Å; K314-L318 VanDerWaalsContact O-CG 3.26Å; K314-L318 WeakPolarHBondContact O-CG 3.5Å; K314-L318 PolarHBondContact O-N 3.33Å; I315-L318 PolarHBondContact O-N 2.95Å; E316-L318 VanDerWaalsContact C-N 3.28Å; E316-L318 PolarHBondContact O-N 2.63Å; L318-K321 PolarHBondContact O-N 2.95Å; L318-K322 WeakPolarHBondContact O-CB 3.49Å; L318-K322 PolarHBondContact O-N 3.49Å
319	K	93.5	Very high	92.7	Very high	143 Å²	143	106.3 Å²	106.3	62%	0.622	51%	0.505	S	S	*	.	H	α-helix	trans	-63.6	-45.7	173.4	-73.4	175.7	179.1	177.5	0	111.6	I315 E316 K322 Q323	I315-K319 HydrophobicContact CG2-CD 4.42Å; I315-K319 WeakPolarHBondContact O-CG 3.39Å; I315-K319 PolarHBondContact O-N 2.66Å; E316-K319 WeakPolarHBondContact O-CB 3.4Å; E316-K319 PolarHBondContact O-N 3.1Å; E316-K319 VanDerWaalsContact O-N 3.09Å; K319-K322 WeakPolarHBondContact O-CB 3.19Å; K319-K322 PolarHBondContact O-N 3.04Å; K319-Q323 PolarHBondContact O-N 2.92Å
320	M	94.2	Very high	92.7	Very high	120 Å²	120	105.6 Å²	105.6	59%	0.591	50%	0.502	S	S	*	.	H	α-helix	trans	-61.9	-44.9	176.5	-68.9	-178.4	74.7	0	0	111.7	E316 I317 K322 Q323 Y324	E316-M320 WeakPolarHBondContact O-CG 3.47Å; E316-M320 PolarHBondContact O-N 2.89Å; I317-M320 PolarHBondContact O-N 3.27Å; M320-K322 PolarHBondContact O-N 3.3Å; M320-Q323 PolarHBondContact O-N 2.89Å; M320-Y324 WeakPolarHBondContact O-CB 3.35Å; M320-Y324 PolarHBondContact O-N 2.89Å
321	K	96.1	Very high	92.6	Very high	123 Å²	123	108.5 Å²	108.5	54%	0.535	51%	0.513	S	S	.	.	H	α-helix	trans	-60.6	-44.3	175	-77.8	-175.9	175.9	-174.7	0	111.5	I317 L318 Q323 Y324 W325	I317-K321 HydrophobicContact CG2-CD 4.21Å; I317-K321 HydrophobicContact CG2-CG 4.41Å; I317-K321 WeakPolarHBondContact O-CB 3.36Å; I317-K321 WeakPolarHBondContact O-CG 3.37Å; I317-K321 PolarHBondContact O-N 2.87Å; L318-K321 PolarHBondContact O-N 2.95Å; K321-Q323 VanDerWaalsContact C-N 3.33Å; K321-Q323 PolarHBondContact O-N 3.43Å; K321-Y324 PolarHBondContact O-N 2.72Å; K321-W325 PolarHBondContact O-N 3.45Å
322	K	94.5	Very high	92.3	Very high	102 Å²	102	107.7 Å²	107.7	44%	0.443	52%	0.516	S	S	.	.	H	α-helix	trans	-58	-46.1	175.8	-176.5	-172.8	176.2	-176.5	0	111	F217 L318 K319 M320 S326	F217-K322 HydrophobicContact CE1-CD 4.32Å; F217-K322 HydrophobicContact CE2-CD 4.44Å; F217-K322 HydrophobicContact CZ-CD 3.71Å; L318-K322 WeakPolarHBondContact O-CB 3.49Å; L318-K322 PolarHBondContact O-N 3.49Å; K319-K322 WeakPolarHBondContact O-CB 3.19Å; K319-K322 PolarHBondContact O-N 3.04Å; M320-K322 PolarHBondContact O-N 3.3Å; K322-S326 WeakPolarHBondContact O-CB 3.26Å; K322-S326 PolarHBondContact O-N 3.43Å; K322-S326 PolarHBondContact O-OG 3.18Å
323	Q	93.7	Very high	91.7	Very high	130 Å²	130	108.2 Å²	108.2	61%	0.607	53%	0.527	S	S	*	.	H	α-helix	trans	-63.6	-47.8	178	-175.5	176.6	-9	0	0	111.6	K319 M320 K321 W325 S326 E327	K319-Q323 PolarHBondContact O-N 2.92Å; M320-Q323 PolarHBondContact O-N 2.89Å; K321-Q323 VanDerWaalsContact C-N 3.33Å; K321-Q323 PolarHBondContact O-N 3.43Å; Q323-W325 PolarHBondContact O-N 3.33Å; Q323-S326 PolarHBondContact O-N 3.01Å; Q323-S326 VanDerWaalsContact O-N 3.17Å; Q323-E327 PolarHBondContact O-N 3.24Å
324	Y	95.6	Very high	90.6	Very high	132 Å²	132	112.8 Å²	112.8	52%	0.518	54%	0.543	S	S	.	.	H	α-helix	trans	-54.5	-50.8	176.4	172	-93.9	0	0	0	111.9	M320 K321 S326 E327 K328	M320-Y324 WeakPolarHBondContact O-CB 3.35Å; M320-Y324 PolarHBondContact O-N 2.89Å; K321-Y324 PolarHBondContact O-N 2.72Å; Y324-S326 VanDerWaalsContact C-N 3.34Å; Y324-S326 PolarHBondContact O-N 3.17Å; Y324-E327 PolarHBondContact O-N 3.12Å; Y324-K328 HydrophobicContact CE1-CD 3.91Å; Y324-K328 WeakPolarHBondContact O-CB 3.43Å; Y324-K328 PolarHBondContact O-N 3.42Å; Y324-K328 PolarHBondContact OH-NZ 3.18Å
325	W	95.3	Very high	88.9	Confident	143 Å²	143	114.5 Å²	114.5	54%	0.542	57%	0.571	S	S	.	*	H	α-helix	trans	-66.4	-35.9	179.1	-75.1	115.4	0	0	0	112.3	K321 Q323 K328 L329	K321-W325 PolarHBondContact O-N 3.45Å; Q323-W325 PolarHBondContact O-N 3.33Å; W325-K328 HydrophobicContact CE3-CD 4.1Å; W325-K328 HydrophobicContact CZ3-CD 3.93Å; W325-K328 PolarHBondContact O-N 3.23Å; W325-L329 WeakPolarHBondContact O-CB 3.45Å; W325-L329 VanDerWaalsContact O-CG 3.25Å; W325-L329 WeakPolarHBondContact O-CG 3.17Å; W325-L329 PolarHBondContact O-N 3.48Å
326	S	92.4	Very high	88.8	Confident	47 Å²	47	115.9 Å²	115.9	33%	0.329	58%	0.577	S	S	.	*	H	α-helix	trans	-63.6	-44.3	176	-58.5	0	0	0	0	111.8	K322 Q323 Y324 K330	K322-S326 WeakPolarHBondContact O-CB 3.26Å; K322-S326 PolarHBondContact O-N 3.43Å; K322-S326 PolarHBondContact O-OG 3.18Å; Q323-S326 PolarHBondContact O-N 3.01Å; Q323-S326 VanDerWaalsContact O-N 3.17Å; Y324-S326 VanDerWaalsContact C-N 3.34Å; Y324-S326 PolarHBondContact O-N 3.17Å; S326-K330 VanDerWaalsContact O-CG 3.32Å; S326-K330 WeakPolarHBondContact O-CG 3.42Å; S326-K330 PolarHBondContact O-N 3.45Å
327	E	92.8	Very high	88.6	Confident	86 Å²	86	116.3 Å²	116.3	40%	0.402	58%	0.58	S	S	.	*	H	α-helix	trans	-68.8	-41.1	176.6	-67.7	-54.5	125.5	0	0	111.9	Q323 Y324 L329 K330 L331	Q323-E327 PolarHBondContact O-N 3.24Å; Y324-E327 PolarHBondContact O-N 3.12Å; E327-L329 VanDerWaalsContact C-N 3.32Å; E327-L329 PolarHBondContact O-N 3.2Å; E327-K330 PolarHBondContact O-N 2.95Å; E327-K330 IonicContact OE1-NZ 3.07Å; E327-K330 PolarHBondContact OE1-NZ 3.44Å; E327-L331 WeakPolarHBondContact O-CG 3.35Å; E327-L331 PolarHBondContact O-N 3.07Å
328	K	92.1	Very high	88.3	Confident	99 Å²	99	117.8 Å²	117.8	43%	0.43	59%	0.588	S	S	.	*	H	α-helix	trans	-60.9	-40.5	175.7	-168.4	173	-174.2	174.9	0	112.2	Y324 W325 L331 S332	Y324-K328 HydrophobicContact CE1-CD 3.91Å; Y324-K328 WeakPolarHBondContact O-CB 3.43Å; Y324-K328 PolarHBondContact O-N 3.42Å; Y324-K328 PolarHBondContact OH-NZ 3.18Å; W325-K328 HydrophobicContact CE3-CD 4.1Å; W325-K328 HydrophobicContact CZ3-CD 3.93Å; W325-K328 PolarHBondContact O-N 3.23Å; K328-L331 PolarHBondContact O-N 3.43Å; K328-S332 WeakPolarHBondContact O-CB 3.48Å; K328-S332 PolarHBondContact O-N 3.13Å
329	L	90.6	Very high	87.9	Confident	113 Å²	113	118 Å²	118	59%	0.592	59%	0.587	S	S	*	*	H	α-helix	trans	-66.1	-44.1	174.4	-74.6	169.5	0	0	0	111.7	W325 E327 L331 S332 S333	W325-L329 WeakPolarHBondContact O-CB 3.45Å; W325-L329 VanDerWaalsContact O-CG 3.25Å; W325-L329 WeakPolarHBondContact O-CG 3.17Å; W325-L329 PolarHBondContact O-N 3.48Å; E327-L329 VanDerWaalsContact C-N 3.32Å; E327-L329 PolarHBondContact O-N 3.2Å; L329-L331 VanDerWaalsContact C-N 3.3Å; L329-L331 PolarHBondContact O-N 3.43Å; L329-S332 PolarHBondContact O-N 2.96Å; L329-S333 PolarHBondContact O-N 3.19Å; L329-S333 PolarHBondContact O-OG 3.18Å; L329-S333 VanDerWaalsContact O-OG 3.09Å
330	K	90.2	Very high	87.5	Confident	116 Å²	116	116.4 Å²	116.4	50%	0.504	59%	0.585	S	S	.	*	H	α-helix	trans	-59.5	-38.9	175.4	-73.5	172.8	-172.7	172.3	0	113	S326 E327 K334	S326-K330 VanDerWaalsContact O-CG 3.32Å; S326-K330 WeakPolarHBondContact O-CG 3.42Å; S326-K330 PolarHBondContact O-N 3.45Å; E327-K330 PolarHBondContact O-N 2.95Å; E327-K330 IonicContact OE1-NZ 3.07Å; E327-K330 PolarHBondContact OE1-NZ 3.44Å; K330-K334 WeakPolarHBondContact O-CG 3.37Å
331	L	86.6	Confident	87.1	Confident	121 Å²	121	116.2 Å²	116.2	63%	0.634	58%	0.584	S	S	*	*	H	α-helix	trans	-69.9	-40.6	176.1	-70.4	170.1	0	0	0	111.4	E327 K328 L329 S333 K334	E327-L331 WeakPolarHBondContact O-CG 3.35Å; E327-L331 PolarHBondContact O-N 3.07Å; K328-L331 PolarHBondContact O-N 3.43Å; L329-L331 VanDerWaalsContact C-N 3.3Å; L329-L331 PolarHBondContact O-N 3.43Å; L331-S333 VanDerWaalsContact C-N 3.27Å; L331-S333 PolarHBondContact O-N 3.09Å; L331-K334 PolarHBondContact O-N 3.11Å
332	S	81.6	Confident	86.4	Confident	85 Å²	85	115.7 Å²	115.7	59%	0.594	59%	0.588	S	S	*	*	H	α-helix	trans	-66.2	-26.5	175.8	-172.4	0	0	0	0	113.3	K328 L329 K334	K328-S332 WeakPolarHBondContact O-CB 3.48Å; K328-S332 PolarHBondContact O-N 3.13Å; L329-S332 PolarHBondContact O-N 2.96Å; S332-K334 VanDerWaalsContact C-N 3.32Å
333	S	77.5	Confident	85.8	Confident	103 Å²	103	116.8 Å²	116.8	72%	0.72	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.7	-6.4	175.9	-58	0	0	0	0	114	L329 L331	L329-S333 PolarHBondContact O-N 3.19Å; L329-S333 PolarHBondContact O-OG 3.18Å; L329-S333 VanDerWaalsContact O-OG 3.09Å; L331-S333 VanDerWaalsContact C-N 3.27Å; L331-S333 PolarHBondContact O-N 3.09Å
334	K	70	Confident	85.1	Confident	184 Å²	184	115.7 Å²	115.7	80%	0.8	60%	0.598	S	S	*	*			trans	-103.4	-4.5	178.8	-74.4	-179.2	177.7	-175.2	0	113.7	K330 L331 S332	K330-K334 WeakPolarHBondContact O-CG 3.37Å; L331-K334 PolarHBondContact O-N 3.11Å; S332-K334 VanDerWaalsContact C-N 3.32Å
335	S	56.9	Low	84.2	Confident	159 Å²	159	114.2 Å²	114.2	100%	1.112	61%	0.605	S	S	*	*			trans	-102.1	0	171.4	-175.5	0	0	0	0	110.4

Retrieved 335 of 335 residues in 66.4 ms (Link to these results)

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