A0A087XZN8_POEFO Loading...

RasGEF domain family member 1B

AlphaFold DB , UniProt , Accession A0A087XZN8, Species POEFO (Poecilia formosa, Amazon molly), Gene RASGEF1B, Length 557 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	24.1	Very low	33.6	Very low	242 Å²	242	84.1 Å²	84.1	100%	1.192	40%	0.4	S	S	*	.				0	99.7	0	-171.7	173.1	-175	0	0	105
2	F	28.2	Very low	33.7	Very low	33 Å²	33	82 Å²	82	15%	0.145	40%	0.397	C	S	.	.			trans	-62.1	137.2	-172.9	-68.4	-77.6	0	0	0	110.8	W408 F416	F2-W408 HydrophobicContact CE1-CH2 4.45Å; F2-W408 HydrophobicContact CE1-CZ3 4.38Å; F2-W408 AromaticContact CE2-CD2 3.88Å; F2-W408 HydrophobicContact CE2-CD2 3.88Å; F2-W408 HydrophobicContact CE2-CE3 4.23Å; F2-W408 HydrophobicContact CE2-CG 4.07Å; F2-W408 AromaticContact CZ-CD2 3.67Å; F2-W408 HydrophobicContact CZ-CD2 3.67Å; F2-W408 AromaticContact CZ-CE2 3.89Å; F2-W408 AromaticContact CZ-CE3 3.58Å; F2-W408 HydrophobicContact CZ-CE3 3.58Å; F2-W408 HydrophobicContact CZ-CG 4.32Å; F2-W408 AromaticContact CZ-CH2 3.89Å; F2-W408 HydrophobicContact CZ-CH2 3.89Å; F2-W408 HydrophobicContact CZ-CZ2 4Å; F2-W408 AromaticContact CZ-CZ3 3.69Å; F2-W408 HydrophobicContact CZ-CZ3 3.69Å; F2-F416 HydrophobicContact CD1-CE1 4.21Å; F2-F416 AromaticContact CE1-CD1 3.82Å; F2-F416 HydrophobicContact CE1-CD1 3.82Å; F2-F416 AromaticContact CE1-CE1 3.56Å; F2-F416 HydrophobicContact CE1-CE1 3.56Å; F2-F416 HydrophobicContact CZ-CE1 4.47Å
3	K	32.5	Very low	34	Very low	120 Å²	120	79.1 Å²	79.1	52%	0.522	38%	0.382	S	S	.	.			trans	-58.6	126.4	-177.1	-77.9	-177.3	169.1	-166.4	0	110.6	E5 F6	K3-E5 PolarHBondContact O-N 3.26Å; K3-E5 VanDerWaalsContact O-N 3.16Å; K3-F6 PolarHBondContact O-N 3.46Å
4	P	31.7	Very low	34.3	Very low	101 Å²	101	75.5 Å²	75.5	66%	0.656	37%	0.365	S	S	*	.	H	α-helix	trans	-55.2	-28.8	175	-24.8	33.6	0	0	0	113.2	S8	P4-S8 VanDerWaalsContact O-CB 3.24Å; P4-S8 WeakPolarHBondContact O-CB 3.28Å; P4-S8 PolarHBondContact O-N 2.8Å
5	E	32.3	Very low	34.3	Very low	113 Å²	113	72.3 Å²	72.3	53%	0.528	35%	0.353	S	S	.	.	H	α-helix	trans	-62.3	-40.6	-179.8	-64.6	123.9	-152.6	0	0	113.2	K3 S8 F9	K3-E5 PolarHBondContact O-N 3.26Å; K3-E5 VanDerWaalsContact O-N 3.16Å; E5-S8 CarbonylContact O-C 3.57Å; E5-S8 WeakPolarHBondContact O-CB 3.33Å; E5-S8 PolarHBondContact O-N 3.16Å; E5-F9 PolarHBondContact O-N 3.23Å
6	F	34.6	Very low	34.4	Very low	7 Å²	7	75.7 Å²	75.7	3%	0.031	36%	0.361	C	S	.	.	H	α-helix	trans	-74.5	-36	-176.9	-143.9	-86.2	0	0	0	112	K3 F9 Y10 I393 N397 E420	K3-F6 PolarHBondContact O-N 3.46Å; F6-F9 PolarHBondContact O-N 3.06Å; F6-Y10 HydrophobicContact CD1-CD2 4.49Å; F6-Y10 HydrophobicContact CD1-CE2 4.14Å; F6-Y10 AromaticContact CE1-CE2 3.8Å; F6-Y10 HydrophobicContact CE1-CE2 3.8Å; F6-I393 HydrophobicContact CE1-CG2 3.68Å; F6-I393 HydrophobicContact CZ-CG2 3.91Å; F6-N397 WeakPolarHBondContact CD1-ND2 3.3Å; F6-N397 VanDerWaalsContact CE1-ND2 3.31Å; F6-N397 WeakPolarHBondContact CE1-ND2 3.46Å; F6-E420 HydrophobicContact CE2-CB 4.35Å; F6-E420 WeakPolarHBondContact CE2-O 3.29Å
7	R	37.7	Very low	34.6	Very low	61 Å²	61	73.8 Å²	73.8	23%	0.23	35%	0.351	C	S	.	.	H	α-helix	trans	-72.4	-32.5	172.1	-67.2	-177.3	-174.9	-165.2	-0.1	112.2	F9 R11 S402	R7-F9 VanDerWaalsContact C-N 3.31Å; R7-R11 WeakPolarHBondContact O-CB 3.45Å; R7-R11 PolarHBondContact O-N 3.25Å; R7-S402 PolarHBondContact NH2-O 2.92Å; R7-S402 PolarHBondContact NH2-OG 2.7Å; R7-S402 VanDerWaalsContact NH2-OG 3.09Å
8	S	34.6	Very low	34.6	Very low	44 Å²	44	70.2 Å²	70.2	31%	0.308	34%	0.335	S	S	.	.	H	α-helix	trans	-65.8	-36.1	169.5	-179.7	0	0	0	0	110.6	P4 E5 Y10 R11 T12 E13	P4-S8 VanDerWaalsContact O-CB 3.24Å; P4-S8 WeakPolarHBondContact O-CB 3.28Å; P4-S8 PolarHBondContact O-N 2.8Å; E5-S8 CarbonylContact O-C 3.57Å; E5-S8 WeakPolarHBondContact O-CB 3.33Å; E5-S8 PolarHBondContact O-N 3.16Å; S8-Y10 PolarHBondContact O-N 3.06Å; S8-R11 PolarHBondContact O-N 2.86Å; S8-T12 VanDerWaalsContact C-OG1 3.29Å; S8-T12 WeakPolarHBondContact CA-OG1 3.35Å; S8-T12 WeakPolarHBondContact CB-OG1 3.41Å; S8-T12 CarbonylContact O-C 3.43Å; S8-T12 VanDerWaalsContact O-CA 3.23Å; S8-T12 WeakPolarHBondContact O-CA 3.43Å; S8-T12 VanDerWaalsContact O-CB 3.31Å; S8-T12 WeakPolarHBondContact O-CB 3.44Å; S8-T12 PolarHBondContact O-N 2.99Å; S8-T12 PolarHBondContact O-OG1 3.04Å; S8-T12 PolarHBondContact OG-OG1 3.48Å; S8-E13 PolarHBondContact O-N 3.25Å
9	F	37.4	Very low	34.5	Very low	11 Å²	11	73.8 Å²	73.8	5%	0.048	35%	0.345	C	S	.	.	I	π-helix	trans	-61.2	-45.7	-179.3	-175.7	-96	0	0	0	112.6	E5 F6 R7 E13 L14 F17 P425 F429	E5-F9 PolarHBondContact O-N 3.23Å; F6-F9 PolarHBondContact O-N 3.06Å; R7-F9 VanDerWaalsContact C-N 3.31Å; F9-E13 HydrophobicContact CB-CB 4.47Å; F9-E13 HydrophobicContact CD2-CB 3.65Å; F9-E13 HydrophobicContact CD2-CG 4.26Å; F9-E13 HydrophobicContact CE2-CB 4.23Å; F9-E13 HydrophobicContact CG-CB 4.23Å; F9-E13 CarbonylContact O-C 3.51Å; F9-E13 WeakPolarHBondContact O-CA 3.26Å; F9-E13 PolarHBondContact O-N 3.11Å; F9-E13 VanDerWaalsContact O-N 3.12Å; F9-L14 HydrophobicContact CD1-CD1 3.97Å; F9-L14 HydrophobicContact CE1-CD1 3.31Å; F9-L14 HydrophobicContact CZ-CD1 3.81Å; F9-L14 PolarHBondContact O-N 3.49Å; F9-F17 AromaticContact CD2-CE2 3.89Å; F9-F17 HydrophobicContact CD2-CE2 3.89Å; F9-F17 HydrophobicContact CD2-CZ 4.34Å; F9-F17 HydrophobicContact CE2-CD2 4.3Å; F9-F17 AromaticContact CE2-CE2 3.16Å; F9-F17 HydrophobicContact CE2-CE2 3.16Å; F9-F17 AromaticContact CE2-CZ 3.62Å; F9-F17 HydrophobicContact CE2-CZ 3.62Å; F9-F17 HydrophobicContact CZ-CD2 4.41Å; F9-F17 AromaticContact CZ-CE2 3.62Å; F9-F17 HydrophobicContact CZ-CE2 3.62Å; F9-F17 HydrophobicContact CZ-CZ 4.36Å; F9-P425 HydrophobicContact CB-CG 3.96Å; F9-P425 HydrophobicContact CD1-CB 4.36Å; F9-P425 HydrophobicContact CD1-CG 4.29Å; F9-P425 HydrophobicContact CD2-CB 3.25Å; F9-P425 HydrophobicContact CD2-CG 3.33Å; F9-P425 HydrophobicContact CE1-CB 4.3Å; F9-P425 HydrophobicContact CE2-CB 3.11Å; F9-P425 HydrophobicContact CE2-CG 3.79Å; F9-P425 HydrophobicContact CG-CB 3.89Å; F9-P425 HydrophobicContact CG-CG 3.61Å; F9-P425 HydrophobicContact CZ-CB 3.74Å; F9-F429 AromaticContact CE1-CZ 3.9Å; F9-F429 HydrophobicContact CE1-CZ 3.9Å; F9-F429 HydrophobicContact CE2-CE2 4.14Å; F9-F429 HydrophobicContact CE2-CZ 4.03Å; F9-F429 HydrophobicContact CZ-CE1 4.48Å; F9-F429 AromaticContact CZ-CE2 3.75Å; F9-F429 HydrophobicContact CZ-CE2 3.75Å; F9-F429 AromaticContact CZ-CZ 3.36Å; F9-F429 HydrophobicContact CZ-CZ 3.36Å
10	Y	40.4	Very low	34.7	Very low	57 Å²	57	77 Å²	77	22%	0.224	36%	0.36	C	S	.	.	I	π-helix	trans	-78.5	-28.8	179.3	-74.5	-93.5	0	0	0	114.9	F6 S8 L14 M390 S394	F6-Y10 HydrophobicContact CD1-CD2 4.49Å; F6-Y10 HydrophobicContact CD1-CE2 4.14Å; F6-Y10 AromaticContact CE1-CE2 3.8Å; F6-Y10 HydrophobicContact CE1-CE2 3.8Å; S8-Y10 PolarHBondContact O-N 3.06Å; Y10-L14 HydrophobicContact CD1-CD2 4.41Å; Y10-M390 HydrophobicContact CE2-CE 4.42Å; Y10-M390 WeakPolarHBondContact OH-CE 3.11Å; Y10-M390 PolarHBondContact OH-SD 2.91Å; Y10-M390 VanDerWaalsContact OH-SD 3.37Å; Y10-S394 PolarHBondContact OH-OG 3.29Å
11	R	36.6	Very low	34.9	Very low	136 Å²	136	73.8 Å²	73.8	51%	0.513	35%	0.347	S	S	.	.	I	π-helix	trans	-93.5	-28	-179.2	-69.9	-172.4	-151.3	-162.6	3.3	114.4	R7 S8 P15 S399	R7-R11 WeakPolarHBondContact O-CB 3.45Å; R7-R11 PolarHBondContact O-N 3.25Å; S8-R11 PolarHBondContact O-N 2.86Å; R11-P15 WeakPolarHBondContact O-CG 3.49Å; R11-S399 PolarHBondContact NH2-OG 2.96Å
12	T	34.5	Very low	35.6	Very low	59 Å²	59	64.2 Å²	64.2	36%	0.362	31%	0.31	S	S	.	.	I	π-helix	trans	-121.5	-45.5	-172.2	12.5	0	0	0	0	111.3	S8 R16	S8-T12 VanDerWaalsContact C-OG1 3.29Å; S8-T12 WeakPolarHBondContact CA-OG1 3.35Å; S8-T12 WeakPolarHBondContact CB-OG1 3.41Å; S8-T12 CarbonylContact O-C 3.43Å; S8-T12 VanDerWaalsContact O-CA 3.23Å; S8-T12 WeakPolarHBondContact O-CA 3.43Å; S8-T12 VanDerWaalsContact O-CB 3.31Å; S8-T12 WeakPolarHBondContact O-CB 3.44Å; S8-T12 PolarHBondContact O-N 2.99Å; S8-T12 PolarHBondContact O-OG1 3.04Å; S8-T12 PolarHBondContact OG-OG1 3.48Å; T12-R16 WeakPolarHBondContact O-CB 3.42Å; T12-R16 PolarHBondContact O-N 2.93Å
13	E	37.4	Very low	35.9	Very low	44 Å²	44	68.8 Å²	68.8	21%	0.206	34%	0.336	C	S	.	.	I	π-helix	trans	-81.4	-44.3	-177.7	-56.7	-67.3	139.1	0	0	114	S8 F9 P15 R16 F17	S8-E13 PolarHBondContact O-N 3.25Å; F9-E13 HydrophobicContact CB-CB 4.47Å; F9-E13 HydrophobicContact CD2-CB 3.65Å; F9-E13 HydrophobicContact CD2-CG 4.26Å; F9-E13 HydrophobicContact CE2-CB 4.23Å; F9-E13 HydrophobicContact CG-CB 4.23Å; F9-E13 CarbonylContact O-C 3.51Å; F9-E13 WeakPolarHBondContact O-CA 3.26Å; F9-E13 PolarHBondContact O-N 3.11Å; F9-E13 VanDerWaalsContact O-N 3.12Å; E13-P15 VanDerWaalsContact C-N 3.33Å; E13-R16 CarbonylContact O-C 3.5Å; E13-R16 WeakPolarHBondContact O-CA 3.39Å; E13-R16 PolarHBondContact O-N 2.67Å; E13-R16 WeakPolarHBondContact OE1-CD 3.41Å; E13-R16 IonicContact OE1-CZ 3.22Å; E13-R16 IonicContact OE1-NH1 3.43Å; E13-R16 PolarHBondContact OE1-NH1 3.39Å; E13-F17 HydrophobicContact CB-CD2 4.17Å; E13-F17 HydrophobicContact CB-CE2 3.48Å; E13-F17 VanDerWaalsContact CB-CE2 3.48Å; E13-F17 HydrophobicContact CB-CZ 3.96Å; E13-F17 WeakPolarHBondContact O-CB 3.35Å; E13-F17 WeakPolarHBondContact O-CD2 3.44Å; E13-F17 WeakPolarHBondContact O-CE2 3.32Å; E13-F17 VanDerWaalsContact O-CG 3.28Å; E13-F17 WeakPolarHBondContact O-CG 3.49Å; E13-F17 PolarHBondContact O-N 3.39Å
14	L	37.8	Very low	36.1	Very low	29 Å²	29	69.9 Å²	69.9	15%	0.152	34%	0.343	C	S	.	.	H	α-helix	trans	-52.7	-46.9	170.5	-120.4	77.9	0	0	0	111.3	F9 Y10 R16 A18 C35	F9-L14 HydrophobicContact CD1-CD1 3.97Å; F9-L14 HydrophobicContact CE1-CD1 3.31Å; F9-L14 HydrophobicContact CZ-CD1 3.81Å; F9-L14 PolarHBondContact O-N 3.49Å; Y10-L14 HydrophobicContact CD1-CD2 4.41Å; L14-R16 VanDerWaalsContact C-N 3.33Å; L14-R16 PolarHBondContact O-N 3.15Å; L14-A18 PolarHBondContact O-N 3.45Å; L14-C35 WeakPolarHBondContact CD2-SG 3.43Å
15	P	35	Very low	36.6	Very low	28 Å²	28	66.3 Å²	66.3	18%	0.182	32%	0.318	C	S	.	.	H	α-helix	trans	-77.1	-5.1	172.1	-19.8	36.3	0	0	0	115.7	R11 E13 R19	R11-P15 WeakPolarHBondContact O-CG 3.49Å; E13-P15 VanDerWaalsContact C-N 3.33Å; P15-R19 WeakPolarHBondContact O-CG 3.38Å; P15-R19 PolarHBondContact O-NE 3.04Å
16	R	35	Very low	36.9	Very low	126 Å²	126	65 Å²	65	48%	0.475	31%	0.309	S	S	.	.	H	α-helix	trans	-104.4	-26.9	175.3	-175.4	-171.4	-162.3	-174.4	0.9	112.2	T12 E13 L14 A18 R19 E20	T12-R16 WeakPolarHBondContact O-CB 3.42Å; T12-R16 PolarHBondContact O-N 2.93Å; E13-R16 CarbonylContact O-C 3.5Å; E13-R16 WeakPolarHBondContact O-CA 3.39Å; E13-R16 PolarHBondContact O-N 2.67Å; E13-R16 WeakPolarHBondContact OE1-CD 3.41Å; E13-R16 IonicContact OE1-CZ 3.22Å; E13-R16 IonicContact OE1-NH1 3.43Å; E13-R16 PolarHBondContact OE1-NH1 3.39Å; L14-R16 VanDerWaalsContact C-N 3.33Å; L14-R16 PolarHBondContact O-N 3.15Å; R16-A18 PolarHBondContact O-N 3.36Å; R16-R19 VanDerWaalsContact C-N 3.3Å; R16-R19 CarbonylContact O-C 3.59Å; R16-R19 VanDerWaalsContact O-CA 3.29Å; R16-R19 WeakPolarHBondContact O-CA 3.45Å; R16-R19 WeakPolarHBondContact O-CB 3.45Å; R16-R19 PolarHBondContact O-N 3Å; R16-E20 PolarHBondContact O-N 3.38Å
17	F	39	Very low	37.2	Very low	44 Å²	44	70.8 Å²	70.8	19%	0.193	33%	0.334	C	S	.	.	H	α-helix	trans	-60.7	-36.2	158.7	-65.4	-54.7	0	0	0	110	F9 E13 R19	F9-F17 AromaticContact CD2-CE2 3.89Å; F9-F17 HydrophobicContact CD2-CE2 3.89Å; F9-F17 HydrophobicContact CD2-CZ 4.34Å; F9-F17 HydrophobicContact CE2-CD2 4.3Å; F9-F17 AromaticContact CE2-CE2 3.16Å; F9-F17 HydrophobicContact CE2-CE2 3.16Å; F9-F17 AromaticContact CE2-CZ 3.62Å; F9-F17 HydrophobicContact CE2-CZ 3.62Å; F9-F17 HydrophobicContact CZ-CD2 4.41Å; F9-F17 AromaticContact CZ-CE2 3.62Å; F9-F17 HydrophobicContact CZ-CE2 3.62Å; F9-F17 HydrophobicContact CZ-CZ 4.36Å; E13-F17 HydrophobicContact CB-CD2 4.17Å; E13-F17 HydrophobicContact CB-CE2 3.48Å; E13-F17 VanDerWaalsContact CB-CE2 3.48Å; E13-F17 HydrophobicContact CB-CZ 3.96Å; E13-F17 WeakPolarHBondContact O-CB 3.35Å; E13-F17 WeakPolarHBondContact O-CD2 3.44Å; E13-F17 WeakPolarHBondContact O-CE2 3.32Å; E13-F17 VanDerWaalsContact O-CG 3.28Å; E13-F17 WeakPolarHBondContact O-CG 3.49Å; E13-F17 PolarHBondContact O-N 3.39Å; F17-R19 PolarHBondContact O-N 2.89Å
18	A	33.5	Very low	37.3	Very low	8 Å²	8	71.1 Å²	71.1	7%	0.066	34%	0.337	C	S	.	.	T	Hydrogen-bonded Turn	trans	-70.3	-10.8	165.7	0	0	0	0	0	113.6	L14 R16 R26	L14-A18 PolarHBondContact O-N 3.45Å; R16-A18 PolarHBondContact O-N 3.36Å; A18-R26 WeakPolarHBondContact O-CA 3.4Å; A18-R26 WeakPolarHBondContact O-CB 3.37Å; A18-R26 WeakPolarHBondContact O-CD 3.47Å; A18-R26 WeakPolarHBondContact O-CG 3.48Å; A18-R26 PolarHBondContact O-NE 3.47Å
19	R	33.2	Very low	37.7	Very low	139 Å²	139	69.5 Å²	69.5	53%	0.525	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	-19.8	175.7	-73.6	174	-129.9	-174.6	-0.6	113.7	P15 R16 F17 A21 R26	P15-R19 WeakPolarHBondContact O-CG 3.38Å; P15-R19 PolarHBondContact O-NE 3.04Å; R16-R19 VanDerWaalsContact C-N 3.3Å; R16-R19 CarbonylContact O-C 3.59Å; R16-R19 VanDerWaalsContact O-CA 3.29Å; R16-R19 WeakPolarHBondContact O-CA 3.45Å; R16-R19 WeakPolarHBondContact O-CB 3.45Å; R16-R19 PolarHBondContact O-N 3Å; F17-R19 PolarHBondContact O-N 2.89Å; R19-A21 VanDerWaalsContact C-N 3.3Å; R19-R26 PolarHBondContact O-NE 3.2Å; R19-R26 PolarHBondContact O-NH2 3.33Å
20	E	38	Very low	38.1	Very low	137 Å²	137	69.2 Å²	69.2	64%	0.64	33%	0.325	S	S	*	.	S	Bend	trans	-82.5	-9.6	179.2	-71.7	173	178.3	0	0	113	R16	R16-E20 PolarHBondContact O-N 3.38Å
21	A	39	Very low	38.2	Very low	11 Å²	11	72 Å²	72	9%	0.091	34%	0.34	C	S	.	.	S	Bend	trans	-95.6	159.2	169	0	0	0	0	0	111.9	R19 D25 R26 L29	R19-A21 VanDerWaalsContact C-N 3.3Å; A21-D25 HydrophobicContact CB-CB 3.62Å; A21-R26 WeakPolarHBondContact O-CG 3.26Å; A21-R26 PolarHBondContact O-NE 3.34Å; A21-L29 HydrophobicContact CB-CD1 4.41Å
22	G	38.5	Very low	38.4	Very low	41 Å²	41	66.6 Å²	66.6	42%	0.423	32%	0.321	S	S	.	.			trans	-58.2	156.1	178	0	0	0	0	0	112.9	E24 D25 R26	G22-E24 PolarHBondContact O-N 3.16Å; G22-D25 WeakPolarHBondContact O-CB 3.32Å; G22-D25 PolarHBondContact O-N 3.15Å; G22-R26 WeakPolarHBondContact O-CG 3.3Å; G22-R26 PolarHBondContact O-N 2.87Å; G22-R26 VanDerWaalsContact O-N 3.16Å
23	D	34.8	Very low	38.7	Very low	129 Å²	129	65.4 Å²	65.4	69%	0.69	31%	0.312	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	-25.4	-166.3	-109.1	-10.3	0	0	0	115.4	R26	D23-R26 WeakPolarHBondContact OD1-CD 3.42Å; D23-R26 IonicContact OD1-CZ 3Å; D23-R26 IonicContact OD1-NE 2.8Å; D23-R26 IonicContact OD1-NH1 3Å; D23-R26 PolarHBondContact OD1-NH1 3.05Å
24	E	38.3	Very low	38.7	Very low	142 Å²	142	64.8 Å²	64.8	66%	0.664	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	-36.3	174.8	-65.1	-129.4	145.8	0	0	113	G22 R26 K27	G22-E24 PolarHBondContact O-N 3.16Å; E24-R26 VanDerWaalsContact C-N 3.27Å; E24-R26 PolarHBondContact O-N 3.21Å; E24-K27 PolarHBondContact O-N 2.84Å
25	D	40.5	Very low	38.5	Very low	26 Å²	26	64.8 Å²	64.8	14%	0.139	32%	0.32	C	S	.	.	H	α-helix	trans	-65.5	-29.7	175.7	-64.4	-61.4	0	0	0	113	A21 G22 K27 F28 L29 H319 Y466	A21-D25 HydrophobicContact CB-CB 3.62Å; G22-D25 WeakPolarHBondContact O-CB 3.32Å; G22-D25 PolarHBondContact O-N 3.15Å; D25-K27 VanDerWaalsContact C-N 3.28Å; D25-K27 PolarHBondContact O-N 3.17Å; D25-F28 PolarHBondContact O-N 2.99Å; D25-L29 PolarHBondContact O-N 3.19Å; D25-H319 IonicContact OD1-CD2 2.76Å; D25-H319 PolarHBondContact OD1-CD2 3.42Å; D25-H319 IonicContact OD1-CE1 3.72Å; D25-H319 IonicContact OD1-NE2 3.51Å; D25-H319 PolarHBondContact OD1-NE2 3.24Å; D25-H319 IonicContact OD2-NE2 3.23Å; D25-Y466 WeakPolarHBondContact CB-OH 3.46Å; D25-Y466 PolarHBondContact OD1-OH 3.27Å
26	R	39.2	Very low	38.2	Very low	86 Å²	86	67.7 Å²	67.7	33%	0.325	35%	0.346	S	S	.	.	H	α-helix	trans	-58.9	-40.3	178	-50.1	-159.6	165.4	158.4	-11.5	112.4	A18 R19 A21 G22 D23 E24 A30	A18-R26 WeakPolarHBondContact O-CA 3.4Å; A18-R26 WeakPolarHBondContact O-CB 3.37Å; A18-R26 WeakPolarHBondContact O-CD 3.47Å; A18-R26 WeakPolarHBondContact O-CG 3.48Å; A18-R26 PolarHBondContact O-NE 3.47Å; R19-R26 PolarHBondContact O-NE 3.2Å; R19-R26 PolarHBondContact O-NH2 3.33Å; A21-R26 WeakPolarHBondContact O-CG 3.26Å; A21-R26 PolarHBondContact O-NE 3.34Å; G22-R26 WeakPolarHBondContact O-CG 3.3Å; G22-R26 PolarHBondContact O-N 2.87Å; G22-R26 VanDerWaalsContact O-N 3.16Å; D23-R26 WeakPolarHBondContact OD1-CD 3.42Å; D23-R26 IonicContact OD1-CZ 3Å; D23-R26 IonicContact OD1-NE 2.8Å; D23-R26 IonicContact OD1-NH1 3Å; D23-R26 PolarHBondContact OD1-NH1 3.05Å; E24-R26 VanDerWaalsContact C-N 3.27Å; E24-R26 PolarHBondContact O-N 3.21Å; R26-A30 WeakPolarHBondContact O-CB 3.46Å; R26-A30 PolarHBondContact O-N 2.75Å; R26-A30 VanDerWaalsContact O-N 3.13Å
27	K	40.6	Very low	37.9	Very low	129 Å²	129	66.6 Å²	66.6	56%	0.561	35%	0.349	S	S	*	.	H	α-helix	trans	-75.2	-39.6	-177.2	-170.2	178.7	174.7	-170.1	0	110.3	E24 D25 E31	E24-K27 PolarHBondContact O-N 2.84Å; D25-K27 VanDerWaalsContact C-N 3.28Å; D25-K27 PolarHBondContact O-N 3.17Å; K27-E31 WeakPolarHBondContact CE-OE1 3.48Å; K27-E31 WeakPolarHBondContact CG-OE1 3.5Å; K27-E31 VanDerWaalsContact O-CB 3.29Å; K27-E31 WeakPolarHBondContact O-CB 3.36Å; K27-E31 WeakPolarHBondContact O-CG 3.31Å; K27-E31 PolarHBondContact O-N 3.01Å
28	F	40.6	Very low	37.2	Very low	67 Å²	67	70.1 Å²	70.1	29%	0.294	38%	0.376	S	S	.	.	H	α-helix	trans	-67.9	-49.5	179.2	179.8	-101.3	0	0	0	112.6	D25 A30 E31 L32 A316 F317	D25-F28 PolarHBondContact O-N 2.99Å; F28-A30 VanDerWaalsContact C-N 3.33Å; F28-A30 PolarHBondContact O-N 3.19Å; F28-E31 PolarHBondContact O-N 2.93Å; F28-L32 HydrophobicContact CE1-CD2 3.97Å; F28-L32 HydrophobicContact CE2-CD1 4.42Å; F28-L32 HydrophobicContact CZ-CD1 3.96Å; F28-L32 HydrophobicContact CZ-CD2 4.08Å; F28-L32 HydrophobicContact CZ-CG 4.45Å; F28-L32 VanDerWaalsContact O-CB 3.24Å; F28-L32 WeakPolarHBondContact O-CB 3.28Å; F28-L32 PolarHBondContact O-N 2.94Å; F28-A316 WeakPolarHBondContact CE1-O 3.31Å; F28-A316 HydrophobicContact CZ-CB 4.04Å; F28-A316 WeakPolarHBondContact CZ-O 3.48Å; F28-F317 HydrophobicContact CE1-CD1 4.26Å
29	L	43	Very low	36.8	Very low	10 Å²	10	77.1 Å²	77.1	5%	0.052	41%	0.413	C	S	.	.	H	α-helix	trans	-65.7	-36	175.4	-70.9	173.4	0	0	0	111.6	A21 D25 L33 Y466	A21-L29 HydrophobicContact CB-CD1 4.41Å; D25-L29 PolarHBondContact O-N 3.19Å; L29-L33 HydrophobicContact CB-CD1 4.25Å; L29-L33 WeakPolarHBondContact O-CB 3.4Å; L29-L33 VanDerWaalsContact O-CD1 3.29Å; L29-L33 WeakPolarHBondContact O-CD1 3.18Å; L29-L33 WeakPolarHBondContact O-CG 3.12Å; L29-L33 PolarHBondContact O-N 2.91Å; L29-Y466 HydrophobicContact CD1-CD1 4.17Å; L29-Y466 HydrophobicContact CD1-CE1 3.84Å; L29-Y466 HydrophobicContact CD2-CG 4.44Å
30	A	44.7	Very low	36.6	Very low	5 Å²	5	80.6 Å²	80.6	4%	0.041	43%	0.432	C	S	.	.	H	α-helix	trans	-66.1	-39.2	174.4	0	0	0	0	0	112.8	R26 F28 G34 C35 L37	R26-A30 WeakPolarHBondContact O-CB 3.46Å; R26-A30 PolarHBondContact O-N 2.75Å; R26-A30 VanDerWaalsContact O-N 3.13Å; F28-A30 VanDerWaalsContact C-N 3.33Å; F28-A30 PolarHBondContact O-N 3.19Å; A30-G34 PolarHBondContact O-N 3.23Å; A30-C35 HydrophobicContact CB-CB 4.34Å; A30-C35 PolarHBondContact O-N 3.49Å; A30-L37 HydrophobicContact CB-CD1 4.08Å; A30-L37 HydrophobicContact CB-CG 4.16Å
31	E	44.1	Very low	36	Very low	116 Å²	116	85.1 Å²	85.1	54%	0.542	44%	0.443	S	S	.	.	H	α-helix	trans	-68	-45.2	174.6	-76.4	174.5	-171.7	0	0	111.5	K27 F28 L33 G34	K27-E31 WeakPolarHBondContact CE-OE1 3.48Å; K27-E31 WeakPolarHBondContact CG-OE1 3.5Å; K27-E31 VanDerWaalsContact O-CB 3.29Å; K27-E31 WeakPolarHBondContact O-CB 3.36Å; K27-E31 WeakPolarHBondContact O-CG 3.31Å; K27-E31 PolarHBondContact O-N 3.01Å; F28-E31 PolarHBondContact O-N 2.93Å; E31-L33 VanDerWaalsContact C-N 3.33Å; E31-L33 PolarHBondContact O-N 3Å; E31-G34 PolarHBondContact O-N 3.46Å
32	L	38.9	Very low	35.3	Very low	23 Å²	23	90.7 Å²	90.7	12%	0.12	48%	0.476	C	S	.	.	H	α-helix	trans	-72.5	-20.8	179	-156.9	82.6	0	0	0	113.6	F28 L339 V343 I462	F28-L32 HydrophobicContact CE1-CD2 3.97Å; F28-L32 HydrophobicContact CE2-CD1 4.42Å; F28-L32 HydrophobicContact CZ-CD1 3.96Å; F28-L32 HydrophobicContact CZ-CD2 4.08Å; F28-L32 HydrophobicContact CZ-CG 4.45Å; F28-L32 VanDerWaalsContact O-CB 3.24Å; F28-L32 WeakPolarHBondContact O-CB 3.28Å; F28-L32 PolarHBondContact O-N 2.94Å; L32-L339 HydrophobicContact CD1-CD2 4.01Å; L32-V343 WeakPolarHBondContact O-CG1 3.35Å; L32-V343 VanDerWaalsContact O-CG2 3.25Å; L32-V343 WeakPolarHBondContact O-CG2 3.3Å; L32-I462 HydrophobicContact CD2-CG2 3.49Å; L32-I462 VanDerWaalsContact CD2-CG2 3.49Å
33	L	42.1	Very low	34.5	Very low	33 Å²	33	94 Å²	94	17%	0.173	49%	0.49	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	8.3	176.8	-62.1	169.3	0	0	0	112.6	L29 E31 C35	L29-L33 HydrophobicContact CB-CD1 4.25Å; L29-L33 WeakPolarHBondContact O-CB 3.4Å; L29-L33 VanDerWaalsContact O-CD1 3.29Å; L29-L33 WeakPolarHBondContact O-CD1 3.18Å; L29-L33 WeakPolarHBondContact O-CG 3.12Å; L29-L33 PolarHBondContact O-N 2.91Å; E31-L33 VanDerWaalsContact C-N 3.33Å; E31-L33 PolarHBondContact O-N 3Å; L33-C35 PolarHBondContact O-N 3.18Å
34	G	36.6	Very low	34	Very low	32 Å²	32	92.6 Å²	92.6	33%	0.33	49%	0.488	S	S	.	.	T	Hydrogen-bonded Turn	trans	67	17.9	176	0	0	0	0	0	115.1	A30 E31 A36 N347	A30-G34 PolarHBondContact O-N 3.23Å; E31-G34 PolarHBondContact O-N 3.46Å; G34-A36 PolarHBondContact O-N 3.05Å; G34-N347 WeakPolarHBondContact CA-ND2 3.25Å
35	C	34.7	Very low	33.3	Very low	28 Å²	28	94 Å²	94	19%	0.189	50%	0.499	C	S	.	.			trans	-81.5	100.5	173.8	-75.5	0	0	0	0	109.1	L14 A30 L33 L37	L14-C35 WeakPolarHBondContact CD2-SG 3.43Å; A30-C35 HydrophobicContact CB-CB 4.34Å; A30-C35 PolarHBondContact O-N 3.49Å; L33-C35 PolarHBondContact O-N 3.18Å; C35-L37 PolarHBondContact O-N 3.41Å
36	A	29	Very low	32.5	Very low	89 Å²	89	101.3 Å²	101.3	74%	0.736	53%	0.53	S	S	*	.			trans	-57.8	102.5	160.2	0	0	0	0	0	108.2	G34	G34-A36 PolarHBondContact O-N 3.05Å
37	L	28.1	Very low	31.6	Very low	104 Å²	104	104.9 Å²	104.9	55%	0.545	55%	0.55	S	S	.	*	P	Polyproline II helix	trans	-61.7	127.2	166.3	-75.5	169.5	0	0	0	107	A30 C35 N39	A30-L37 HydrophobicContact CB-CD1 4.08Å; A30-L37 HydrophobicContact CB-CG 4.16Å; C35-L37 PolarHBondContact O-N 3.41Å; L37-N39 PolarHBondContact O-N 3.28Å
38	P	24.9	Very low	30.8	Very low	117 Å²	117	104.3 Å²	104.3	76%	0.76	56%	0.561	S	S	*	*	P	Polyproline II helix	trans	-56.6	131.4	174.2	21.1	-29.6	0	0	0	108.9	K40	P38-K40 PolarHBondContact O-N 3.12Å
39	N	24.6	Very low	29.9	Very low	156 Å²	156	111.4 Å²	111.4	83%	0.834	59%	0.586	S	S	*	*	P	Polyproline II helix	trans	-46.3	132.3	178.8	-112.1	-28.2	0	0	0	110.5	L37 R41	L37-N39 PolarHBondContact O-N 3.28Å; N39-R41 PolarHBondContact O-N 3.41Å
40	K	28.3	Very low	29	Very low	212 Å²	212	116 Å²	116	92%	0.922	62%	0.619	S	S	*	*	S	Bend	trans	-62.9	63.5	176.8	-70.9	-175.4	176.2	-178.8	0	112.3	P38	P38-K40 PolarHBondContact O-N 3.12Å
41	R	26	Very low	28.1	Very low	232 Å²	232	120.8 Å²	120.8	88%	0.875	65%	0.65	S	S	*	*			trans	-153.8	59.8	168.8	-68.8	-165	-175.3	179.4	1.7	110.6	N39	N39-R41 PolarHBondContact O-N 3.41Å
42	T	24	Very low	27.3	Very low	128 Å²	128	121 Å²	121	79%	0.785	66%	0.661	S	S	*	*			trans	-173.4	121.1	151.5	13.8	0	0	0	0	108.6
43	P	22.6	Very low	26.8	Very low	109 Å²	109	128.5 Å²	128.5	71%	0.708	70%	0.695	S	S	*	*			trans	-70.6	139.2	173.4	28.6	-30.2	0	0	0	109.3	L45	P43-L45 PolarHBondContact O-N 3.48Å; P43-L45 VanDerWaalsContact O-N 3.14Å
44	P	23.7	Very low	26.1	Very low	101 Å²	101	135 Å²	135	66%	0.656	73%	0.729	S	S	*	*			trans	-72.2	107.4	167.6	29	-30.1	0	0	0	108.5	F46	P44-F46 VanDerWaalsContact C-N 3.34Å; P44-F46 HydrophobicContact CB-CD2 3.77Å; P44-F46 HydrophobicContact CB-CE2 3.74Å; P44-F46 HydrophobicContact CG-CD2 4.33Å; P44-F46 HydrophobicContact CG-CE2 4.4Å; P44-F46 PolarHBondContact O-N 2.98Å
45	L	23.7	Very low	25.4	Very low	171 Å²	171	137 Å²	137	90%	0.895	75%	0.75	S	S	*	*			trans	-68.6	93.2	165.1	-79.1	161.7	0	0	0	108.2	P43	P43-L45 PolarHBondContact O-N 3.48Å; P43-L45 VanDerWaalsContact O-N 3.14Å
46	F	22.8	Very low	25	Very low	179 Å²	179	144.5 Å²	144.5	79%	0.785	79%	0.787	S	S	*	*			trans	-96.1	95.7	165.3	-82.6	-80	0	0	0	109	P44	P44-F46 VanDerWaalsContact C-N 3.34Å; P44-F46 HydrophobicContact CB-CD2 3.77Å; P44-F46 HydrophobicContact CB-CE2 3.74Å; P44-F46 HydrophobicContact CG-CD2 4.33Å; P44-F46 HydrophobicContact CG-CE2 4.4Å; P44-F46 PolarHBondContact O-N 2.98Å
47	E	21.5	Very low	24.7	Very low	162 Å²	162	143.5 Å²	143.5	76%	0.757	79%	0.785	S	S	*	*			trans	-96.7	104.2	153.8	-90.3	-169.3	166.2	0	0	108.2	R49	E47-R49 PolarHBondContact O-N 3.22Å
48	C	22.5	Very low	24.5	Very low	116 Å²	116	147.2 Å²	147.2	78%	0.784	81%	0.805	S	S	*	*			trans	-78.3	100.6	164.6	-74.6	0	0	0	0	108.8
49	R	22.2	Very low	24.4	Very low	217 Å²	217	147 Å²	147	82%	0.819	81%	0.806	S	S	*	*			trans	-92.4	110.1	159.5	-76.1	-171.2	-176.8	-161	0.1	109.3	E47	E47-R49 PolarHBondContact O-N 3.22Å
50	S	24.9	Very low	24.4	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-71.4	140	167.1	-48.2	0	0	0	0	110.2
51	P	26	Very low	24.2	Very low	105 Å²	105	146.1 Å²	146.1	68%	0.682	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-76.6	155.3	170.9	30.2	-31	0	0	0	111.7
52	P	26.9	Very low	24.1	Very low	121 Å²	121	144 Å²	144	79%	0.786	80%	0.801	S	S	*	*	P	Polyproline II helix	trans	-84.3	135.3	-174.4	34	-30.7	0	0	0	110.7
53	H	27.6	Very low	24	Very low	180 Å²	180	149.2 Å²	149.2	83%	0.833	81%	0.807	S	S	*	*			trans	-119.8	129.4	162.1	-82.9	-62.4	0	0	0	110.7
54	L	27.4	Very low	23.9	Very low	170 Å²	170	149.3 Å²	149.3	89%	0.89	81%	0.807	S	S	*	*			trans	-53.5	141.8	176.2	-75	95.3	0	0	0	111.7
55	G	22.6	Very low	23.8	Very low	73 Å²	73	150.8 Å²	150.8	75%	0.753	82%	0.815	S	S	*	*			trans	-78.9	161	177.8	0	0	0	0	0	114
56	L	25.6	Very low	23.7	Very low	186 Å²	186	152.3 Å²	152.3	97%	0.974	81%	0.814	S	S	*	*			trans	-153.4	133.3	143.2	-90.7	171.5	0	0	0	106.3
57	G	23	Very low	23.6	Very low	68 Å²	68	155.4 Å²	155.4	70%	0.701	82%	0.821	S	S	*	*			trans	-103.9	-161.3	-157.8	0	0	0	0	0	117.8
58	L	23.9	Very low	23.5	Very low	182 Å²	182	153.9 Å²	153.9	95%	0.953	83%	0.826	S	S	*	*			trans	81.2	132.3	174.4	-52.8	165.8	0	0	0	114
59	S	23.4	Very low	23.5	Very low	113 Å²	113	152.9 Å²	152.9	79%	0.79	82%	0.821	S	S	*	*			cis	-153	165.9	6.2	67.3	0	0	0	0	111.4
60	S	23.5	Very low	23.9	Very low	105 Å²	105	151 Å²	151	73%	0.734	83%	0.826	S	S	*	*			trans	-53.7	147.9	-178.8	49.2	0	0	0	0	117.7
61	R	25.1	Very low	23.9	Very low	244 Å²	244	151.7 Å²	151.7	92%	0.921	83%	0.826	S	S	*	*				-165	110.2	130	-104.7	168.5	-169.4	-159.8	2.6	112.6
62	Q	23.1	Very low	24.1	Very low	187 Å²	187	152.5 Å²	152.5	87%	0.874	82%	0.824	S	S	*	*			trans	25.8	119.8	149.2	-70.3	171.8	-17.9	0	0	121
63	R	21.7	Very low	24	Very low	238 Å²	238	155.3 Å²	155.3	90%	0.898	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-79.9	146.9	150.4	-70.8	179.4	179.7	-179.3	-1.2	109.9
64	P	21.7	Very low	23.9	Very low	111 Å²	111	157.7 Å²	157.7	72%	0.721	83%	0.829	S	S	*	*	P	Polyproline II helix	trans	-94.7	124.7	144.7	17.3	0.1	0	0	0	109.7
65	T	21.1	Very low	23.8	Very low	132 Å²	132	155.8 Å²	155.8	81%	0.81	82%	0.819	S	S	*	*	P	Polyproline II helix	trans	-70.6	126.4	160.1	38.9	0	0	0	0	109.8
66	F	21	Very low	23.9	Very low	202 Å²	202	158 Å²	158	89%	0.886	81%	0.812	S	S	*	*			trans	-120.2	121.4	154.5	-88.7	-82.7	0	0	0	109
67	R	20.8	Very low	24.1	Very low	245 Å²	245	155.1 Å²	155.1	93%	0.925	80%	0.798	S	S	*	*			trans	-105	117.7	169.5	-114.8	-172.6	-177.9	-174.6	1	107.2
68	C	20.3	Very low	24.3	Very low	129 Å²	129	158.1 Å²	158.1	87%	0.872	80%	0.798	S	S	*	*			trans	165.4	141.5	154.4	-96.8	0	0	0	0	105.5
69	S	21.7	Very low	24.4	Very low	95 Å²	95	153.5 Å²	153.5	66%	0.664	78%	0.78	S	S	*	*			cis	-169.8	144.7	-1.8	35.3	0	0	0	0	103.9	T71	S69-T71 PolarHBondContact O-N 3.39Å
70	L	29.7	Very low	24.5	Very low	179 Å²	179	158 Å²	158	94%	0.937	78%	0.78	S	S	*	*			trans	-64.2	102.7	176.9	-80.6	150.8	0	0	0	110.4
71	T	26.5	Very low	24.9	Very low	121 Å²	121	158.3 Å²	158.3	74%	0.742	77%	0.773	S	S	*	*			trans	-172.8	141.3	153.2	38.3	0	0	0	0	109.2	S69	S69-T71 PolarHBondContact O-N 3.39Å
72	D	28.8	Very low	25.1	Very low	121 Å²	121	153.1 Å²	153.1	65%	0.647	76%	0.763	S	S	*	*			trans	82.6	70.7	175.6	-66.5	-29.1	0	0	0	119.5
73	E	24.7	Very low	25.5	Very low	180 Å²	180	151.5 Å²	151.5	84%	0.841	76%	0.761	S	S	*	*	S	Bend	trans	-93.5	-3.1	159.4	-108.7	-178.8	158.2	0	0	113.7
74	R	26.7	Very low	25.9	Very low	230 Å²	230	144.3 Å²	144.3	87%	0.868	74%	0.739	S	S	*	*	S	Bend	trans	-88.3	-14.7	-175.9	-84.6	-176	176.7	-176.9	-2	115.7
75	L	25.4	Very low	26.3	Very low	130 Å²	130	143.1 Å²	143.1	68%	0.681	73%	0.731	S	S	*	*	S	Bend	trans	-96	-5.9	-177	-83.1	157.3	0	0	0	114.5
76	L	25	Very low	27.3	Very low	119 Å²	119	140.3 Å²	140.3	62%	0.623	71%	0.708	S	S	*	*	S	Bend	trans	-100.5	-2.7	179.5	-75.9	168.8	0	0	0	114.1
77	L	29.2	Very low	28	Very low	127 Å²	127	131.2 Å²	131.2	67%	0.665	67%	0.669	S	S	*	*	S	Bend	trans	-86.8	-27	177.4	-101.7	140.6	0	0	0	112.9	S79	L77-S79 PolarHBondContact O-N 2.97Å
78	D	26.9	Very low	28.6	Very low	131 Å²	131	121.8 Å²	121.8	70%	0.701	64%	0.64	S	S	*	*	G	3₁₀ helix	trans	-69.7	-31.9	179.6	-105.6	-8.8	0	0	0	112.9	R80	D78-R80 PolarHBondContact O-N 3.46Å
79	S	25.6	Very low	29.2	Very low	84 Å²	84	117.9 Å²	117.9	59%	0.587	61%	0.613	S	S	*	*	G	3₁₀ helix	trans	-87.5	3.1	-172.7	72.6	0	0	0	0	115	L77	L77-S79 PolarHBondContact O-N 2.97Å
80	R	26.9	Very low	29.9	Very low	207 Å²	207	118.5 Å²	118.5	78%	0.781	60%	0.604	S	S	*	*	G	3₁₀ helix	trans	-110.8	-9	-177.4	-69.8	-167.2	-170.7	-169.5	4.4	114.9	D78	D78-R80 PolarHBondContact O-N 3.46Å
81	L	32.2	Very low	30	Very low	112 Å²	112	116.8 Å²	116.8	59%	0.586	59%	0.589	S	S	*	*	S	Bend	trans	-86.1	-17.8	176.7	-76.8	162.4	0	0	0	113.1	N83	L81-N83 VanDerWaalsContact C-N 3.26Å; L81-N83 PolarHBondContact O-N 2.85Å; L81-N83 VanDerWaalsContact O-N 3.14Å
82	D	27.8	Very low	29.9	Very low	135 Å²	135	113.2 Å²	113.2	72%	0.722	58%	0.576	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74	1.3	-174.8	-84.7	-17.8	0	0	0	116.2
83	N	32.9	Very low	29.9	Very low	154 Å²	154	116.2 Å²	116.2	82%	0.824	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-145.8	44.2	-175.5	-84.9	-49	0	0	0	114.9	L81 P85	L81-N83 VanDerWaalsContact C-N 3.26Å; L81-N83 PolarHBondContact O-N 2.85Å; L81-N83 VanDerWaalsContact O-N 3.14Å; N83-P85 WeakPolarHBondContact O-CD 3.37Å
84	M	28	Very low	30.3	Very low	87 Å²	87	113.5 Å²	113.5	43%	0.429	58%	0.577	S	S	.	*			trans	-83.3	121	157.8	-82.7	-159.3	-62.4	0	0	110.1	Q86 F467	M84-Q86 PolarHBondContact O-N 3.09Å; M84-F467 HydrophobicContact CE-CB 4.4Å; M84-F467 HydrophobicContact CE-CD1 4.19Å; M84-F467 HydrophobicContact CE-CG 4.22Å
85	P	31.5	Very low	30.3	Very low	85 Å²	85	109.8 Å²	109.8	55%	0.552	57%	0.574	S	S	*	*			trans	-64.8	106.7	174.1	23.7	-30.5	0	0	0	109.6	N83 N428	N83-P85 WeakPolarHBondContact O-CD 3.37Å; P85-N428 HydrophobicContact CG-CB 4.2Å; P85-N428 PolarHBondContact O-ND2 3.12Å
86	Q	40.9	Very low	30.3	Very low	74 Å²	74	107 Å²	107	35%	0.346	56%	0.562	S	S	.	*	P	Polyproline II helix	trans	-69.3	165.8	179	-63.3	-61.6	-32	0	0	112	M84 P88	M84-Q86 PolarHBondContact O-N 3.09Å; Q86-P88 VanDerWaalsContact O-CD 3.25Å; Q86-P88 WeakPolarHBondContact O-CD 3.29Å
87	T	37.3	Very low	30.3	Very low	11 Å²	11	104.1 Å²	104.1	7%	0.067	56%	0.562	C	S	.	*	P	Polyproline II helix	trans	-54.6	117.1	155.7	-66.3	0	0	0	0	105.6	P89 R433 L436 D464	T87-P89 VanDerWaalsContact O-CD 3.26Å; T87-P89 WeakPolarHBondContact O-CD 3.46Å; T87-P89 VanDerWaalsContact O-N 3.1Å; T87-R433 VanDerWaalsContact N-NH1 3.13Å; T87-R433 PolarHBondContact OG1-NH1 3.23Å; T87-L436 HydrophobicContact CG2-CD2 4.38Å; T87-D464 WeakPolarHBondContact CB-OD2 3.48Å; T87-D464 PolarHBondContact OG1-OD2 2.85Å
88	P	33.2	Very low	30.2	Very low	46 Å²	46	100.7 Å²	100.7	30%	0.299	56%	0.557	S	S	.	*	P	Polyproline II helix	trans	-64	120.5	-176.8	22.5	-28.5	0	0	0	107.4	Q86 F90 R437	Q86-P88 VanDerWaalsContact O-CD 3.25Å; Q86-P88 WeakPolarHBondContact O-CD 3.29Å; P88-F90 PolarHBondContact O-N 3.38Å; P88-R437 HydrophobicContact CG-CG 4.03Å
89	P	33.2	Very low	30.6	Very low	48 Å²	48	101.9 Å²	101.9	31%	0.312	55%	0.553	S	S	.	*	P	Polyproline II helix	trans	-68.5	120.7	173.8	28.4	-31.5	0	0	0	107.5	T87 K491	T87-P89 VanDerWaalsContact O-CD 3.26Å; T87-P89 WeakPolarHBondContact O-CD 3.46Å; T87-P89 VanDerWaalsContact O-N 3.1Å; P89-K491 HydrophobicContact CB-CD 3.48Å; P89-K491 VanDerWaalsContact CB-CD 3.48Å; P89-K491 HydrophobicContact CB-CG 4.08Å; P89-K491 HydrophobicContact CG-CD 4.05Å; P89-K491 VanDerWaalsContact CG-NZ 3.33Å
90	F	36	Very low	31.2	Very low	107 Å²	107	101.1 Å²	101.1	47%	0.469	54%	0.542	S	S	.	.	P	Polyproline II helix	trans	-89.6	137.9	176.6	-153.5	-102	0	0	0	110.5	P88 G92 I444	P88-F90 PolarHBondContact O-N 3.38Å; F90-G92 PolarHBondContact O-N 3.36Å; F90-I444 HydrophobicContact CD1-CD1 4.37Å
91	K	30.4	Very low	31.2	Very low	144 Å²	144	98.5 Å²	98.5	63%	0.626	54%	0.544	S	S	*	.			trans	-62.7	82.7	171.4	-83.8	172.8	163.8	-173.9	0	109.2	T96	K91-T96 HydrophobicContact CB-CG2 4.1Å; K91-T96 HydrophobicContact CD-CG2 3.68Å; K91-T96 HydrophobicContact CG-CG2 3.83Å
92	G	25.1	Very low	31.2	Very low	46 Å²	46	98.4 Å²	98.4	47%	0.474	54%	0.544	S	S	.	.			trans	-58.3	140.4	160.6	0	0	0	0	0	108.4	F90 L94	F90-G92 PolarHBondContact O-N 3.36Å; G92-L94 PolarHBondContact O-N 2.95Å
93	Q	30	Very low	31.3	Very low	184 Å²	184	100.2 Å²	100.2	86%	0.86	55%	0.553	S	S	*	*	S	Bend	trans	-62.5	77.7	174.9	-76.6	178.6	-49.8	0	0	111.1
94	L	31.5	Very low	31.3	Very low	123 Å²	123	101.1 Å²	101.1	64%	0.644	55%	0.546	S	S	*	.	S	Bend		-83.5	134.7	119.9	-68.2	166.8	0	0	0	105.2	G92 T96	G92-L94 PolarHBondContact O-N 2.95Å; L94-T96 PolarHBondContact O-N 3.41Å
95	N	27	Very low	31.2	Very low	151 Å²	151	103.6 Å²	103.6	81%	0.807	56%	0.561	S	S	*	*			trans	-35.9	112.8	177.6	-108.6	-16.8	0	0	0	111.5	G97	N95-G97 PolarHBondContact O-N 3.4Å
96	T	26.1	Very low	31.2	Very low	71 Å²	71	108.6 Å²	108.6	44%	0.436	58%	0.577	S	S	.	*			trans	-89.9	23.3	171.5	45.1	0	0	0	0	111.3	K91 L94	K91-T96 HydrophobicContact CB-CG2 4.1Å; K91-T96 HydrophobicContact CD-CG2 3.68Å; K91-T96 HydrophobicContact CG-CG2 3.83Å; L94-T96 PolarHBondContact O-N 3.41Å
97	G	25.1	Very low	30.6	Very low	60 Å²	60	110.1 Å²	110.1	62%	0.619	59%	0.591	S	S	*	*	S	Bend	trans	-84	116.1	165.8	0	0	0	0	0	108.8	N95	N95-G97 PolarHBondContact O-N 3.4Å
98	G	25.6	Very low	30.4	Very low	54 Å²	54	119.5 Å²	119.5	56%	0.557	63%	0.631	S	S	*	*			trans	39.5	90.8	166.7	0	0	0	0	0	115.4	N100	G98-N100 PolarHBondContact O-N 2.99Å; G98-N100 VanDerWaalsContact O-N 3.09Å
99	Y	37.1	Very low	30.4	Very low	157 Å²	157	125.7 Å²	125.7	62%	0.616	66%	0.656	S	S	*	*	S	Bend	trans	-58.6	117.3	163.1	-60.8	-77.8	0	0	0	107.2
100	N	36.7	Very low	30.5	Very low	68 Å²	68	132.7 Å²	132.7	36%	0.364	69%	0.685	S	S	.	*			trans	73.2	96.2	-163.5	-78.9	-2.8	0	0	0	117	G98 N120	G98-N100 PolarHBondContact O-N 2.99Å; G98-N100 VanDerWaalsContact O-N 3.09Å; N100-N120 VanDerWaalsContact ND2-CB 3.25Å; N100-N120 WeakPolarHBondContact ND2-CB 3.12Å; N100-N120 PolarHBondContact ND2-ND2 3.08Å
101	N	26.5	Very low	30.9	Very low	152 Å²	152	132.3 Å²	132.3	81%	0.813	69%	0.691	S	S	*	*			trans	-127.3	54.3	140.1	-91.4	-16	0	0	0	109.1
102	N	32.3	Very low	32	Very low	109 Å²	109	132 Å²	132	58%	0.583	69%	0.687	S	S	*	*			trans	-88.8	105.2	146.2	-75.3	-17.9	0	0	0	104.7	Y104	N102-Y104 HydrophobicContact CB-CD2 3.92Å; N102-Y104 HydrophobicContact CB-CE2 3.59Å; N102-Y104 VanDerWaalsContact O-CD2 3.25Å; N102-Y104 WeakPolarHBondContact O-CD2 3.3Å; N102-Y104 PolarHBondContact O-N 3.22Å
103	L	30.2	Very low	34	Very low	174 Å²	174	135.5 Å²	135.5	91%	0.911	70%	0.701	S	S	*	*			trans	-57.7	92.9	157	-87	144.2	0	0	0	105.8	D105	L103-D105 VanDerWaalsContact C-N 3.32Å; L103-D105 PolarHBondContact O-N 2.53Å
104	Y	33.5	Very low	36.5	Very low	172 Å²	172	127.5 Å²	127.5	68%	0.675	67%	0.667	S	S	*	*			trans	-69.5	99	166.9	-77.5	-84.4	0	0	0	105.8	N102 E106	N102-Y104 HydrophobicContact CB-CD2 3.92Å; N102-Y104 HydrophobicContact CB-CE2 3.59Å; N102-Y104 VanDerWaalsContact O-CD2 3.25Å; N102-Y104 WeakPolarHBondContact O-CD2 3.3Å; N102-Y104 PolarHBondContact O-N 3.22Å; Y104-E106 PolarHBondContact O-N 3.34Å
105	D	26.6	Very low	39.4	Very low	139 Å²	139	122.9 Å²	122.9	74%	0.743	64%	0.643	S	S	*	*			trans	-60.6	128.9	162.7	-166.5	1.8	0	0	0	107.3	L103 T107	L103-D105 VanDerWaalsContact C-N 3.32Å; L103-D105 PolarHBondContact O-N 2.53Å; D105-T107 PolarHBondContact O-N 2.9Å
106	E	30.1	Very low	42.5	Very low	191 Å²	191	121.8 Å²	121.8	89%	0.893	63%	0.629	S	S	*	*	S	Bend	trans	-75.4	32.9	-158.9	-130.6	174.3	-166.5	0	0	113.1	Y104	Y104-E106 PolarHBondContact O-N 3.34Å
107	T	29.8	Very low	45.7	Very low	106 Å²	106	124.2 Å²	124.2	65%	0.65	63%	0.631	S	S	*	*			trans	-132.5	109.3	-170.9	53.1	0	0	0	0	114.2	D105	D105-T107 PolarHBondContact O-N 2.9Å
108	K	31.7	Very low	48.8	Very low	208 Å²	208	126.4 Å²	126.4	90%	0.904	63%	0.625	S	S	*	*			trans	93.2	84.6	163.1	-59.3	-177.6	178.1	179.3	0	116.8	E110	K108-E110 PolarHBondContact O-N 3.42Å
109	E	34.8	Very low	51.7	Low	175 Å²	175	129.9 Å²	129.9	82%	0.818	63%	0.631	S	S	*	*			trans	-62.8	116.4	161.7	-68.7	179.7	145.8	0	0	112	V111	E109-V111 HydrophobicContact CB-CG2 4.07Å; E109-V111 HydrophobicContact CG-CG2 4.02Å
110	E	34.7	Very low	54	Low	196 Å²	196	127.6 Å²	127.6	92%	0.916	63%	0.629	S	S	*	*			trans	-112.2	72.7	139.3	-80.7	-171.4	170.1	0	0	107	K108 Y112	K108-E110 PolarHBondContact O-N 3.42Å; E110-Y112 PolarHBondContact O-N 3.02Å
111	V	44.6	Very low	56.3	Low	98 Å²	98	128.1 Å²	128.1	59%	0.594	63%	0.632	S	S	*	*			trans	-75	115.9	171.9	176.8	0	0	0	0	107.3	E109 P113	E109-V111 HydrophobicContact CB-CG2 4.07Å; E109-V111 HydrophobicContact CG-CG2 4.02Å; V111-P113 WeakPolarHBondContact O-CD 3.46Å
112	Y	52.8	Low	59.5	Low	139 Å²	139	121.3 Å²	121.3	55%	0.545	60%	0.595	S	S	.	*			trans	-60.6	121.1	166.6	-94.1	-90.4	0	0	0	108.5	E110 G114 H132	E110-Y112 PolarHBondContact O-N 3.02Å; Y112-G114 PolarHBondContact O-N 3.24Å; Y112-H132 AromaticContact CE1-CE1 3.57Å; Y112-H132 AromaticContact CE1-CG 3.93Å; Y112-H132 AromaticContact CE1-ND1 3.47Å; Y112-H132 WeakPolarHBondContact CE1-ND1 3.33Å; Y112-H132 AromaticContact CZ-CE1 3.78Å; Y112-H132 AromaticContact CZ-ND1 3.44Å; Y112-H132 PolarHBondContact OH-ND1 3.39Å
113	P	68.3	Low	62.4	Low	119 Å²	119	116.6 Å²	116.6	77%	0.773	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	123.9	-179.5	24.5	-31.6	0	0	0	109.4	V111	V111-P113 WeakPolarHBondContact O-CD 3.46Å
114	G	81.8	Confident	65.5	Low	15 Å²	15	108.8 Å²	108.8	16%	0.155	53%	0.532	C	S	.	.	T	Hydrogen-bonded Turn	trans	128.8	4.2	173	0	0	0	0	0	117.2	Y112 G125 S126	Y112-G114 PolarHBondContact O-N 3.24Å; G114-G125 CarbonylContact O-C 3.43Å; G114-G125 WeakPolarHBondContact O-CA 3.48Å; G114-S126 PolarHBondContact O-N 3.26Å
115	L	91.9	Very high	68.5	Low	27 Å²	27	100.6 Å²	100.6	14%	0.141	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	137.7	164.3	-59.6	-179.9	0	0	0	110.2	Y117 L122 A129 L130 H133	L115-Y117 HydrophobicContact CB-CE2 3.89Å; L115-L122 HydrophobicContact CB-CD1 4.04Å; L115-L122 HydrophobicContact CD2-CD1 4.03Å; L115-L122 HydrophobicContact CG-CD1 4.46Å; L115-A129 HydrophobicContact CD2-CB 3.68Å; L115-A129 HydrophobicContact CG-CB 3.98Å; L115-L130 HydrophobicContact CD2-CD2 3.75Å; L115-L130 HydrophobicContact CD2-CG 4.1Å; L115-H133 HydrophobicContact CD1-CB 3.96Å
116	Y	92.9	Very high	71.7	Confident	127 Å²	127	95.6 Å²	95.6	50%	0.498	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	129.4	-179.1	-63.2	-94.4	0	0	0	109.6	A123 S124 L480	Y116-A123 PolarHBondContact O-N 3.41Å; Y116-S124 PolarHBondContact N-O 3Å; Y116-S124 PolarHBondContact O-N 2.9Å; Y116-S124 VanDerWaalsContact O-N 3.14Å; Y116-L480 HydrophobicContact CD2-CD1 3.47Å; Y116-L480 VanDerWaalsContact CD2-CD1 3.47Å; Y116-L480 HydrophobicContact CE2-CD1 3.33Å; Y116-L480 HydrophobicContact CE2-CD2 4.35Å; Y116-L480 HydrophobicContact CE2-CG 4.49Å; Y116-L480 HydrophobicContact CG-CD1 4.38Å
117	Y	92.6	Very high	74.8	Confident	122 Å²	122	87.6 Å²	87.6	48%	0.478	44%	0.438	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	140.9	-177.3	-65.1	-98.6	0	0	0	110.5	L115 N121 L122	L115-Y117 HydrophobicContact CB-CE2 3.89Å; Y117-N121 CarbonylContact C-O 3.59Å; Y117-N121 WeakPolarHBondContact CA-O 2.96Å; Y117-L122 HydrophobicContact CD1-CB 4.17Å; Y117-L122 HydrophobicContact CE1-CB 3.85Å; Y117-L122 HydrophobicContact CE1-CD1 4.29Å; Y117-L122 HydrophobicContact CE2-CD1 4.44Å
118	H	90.3	Very high	77.8	Confident	106 Å²	106	87.5 Å²	87.5	49%	0.491	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	126.6	170.7	-177.7	60	0	0	0	107.9	N120 N121 A123 E484	H118-N120 VanDerWaalsContact C-N 3.26Å; H118-N120 PolarHBondContact O-N 2.93Å; H118-N121 PolarHBondContact N-O 2.97Å; H118-N121 WeakPolarHBondContact O-CB 3.49Å; H118-N121 PolarHBondContact O-N 2.71Å; H118-A123 HydrophobicContact CB-CB 3.72Å; H118-E484 IonicContact CD2-OE1 2.81Å
119	D	86.7	Confident	80.9	Confident	128 Å²	128	77.9 Å²	77.9	68%	0.684	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	46.4	-175.8	-64.8	-19.4	0	0	0	113.6	N121	D119-N121 PolarHBondContact O-N 2.92Å; D119-N121 VanDerWaalsContact O-N 3.12Å; D119-N121 PolarHBondContact O-ND2 2.88Å
120	N	84.4	Confident	83.8	Confident	108 Å²	108	69.5 Å²	69.5	58%	0.578	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.5	4.2	-175.6	-67.7	-24.9	0	0	0	116.5	N100 H118	N100-N120 VanDerWaalsContact ND2-CB 3.25Å; N100-N120 WeakPolarHBondContact ND2-CB 3.12Å; N100-N120 PolarHBondContact ND2-ND2 3.08Å; H118-N120 VanDerWaalsContact C-N 3.26Å; H118-N120 PolarHBondContact O-N 2.93Å
121	N	86.1	Confident	86.7	Confident	80 Å²	80	60.4 Å²	60.4	43%	0.428	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	140.8	175.9	-61	-57.4	0	0	0	110.3	Y117 H118 D119 A123	Y117-N121 CarbonylContact C-O 3.59Å; Y117-N121 WeakPolarHBondContact CA-O 2.96Å; H118-N121 PolarHBondContact N-O 2.97Å; H118-N121 WeakPolarHBondContact O-CB 3.49Å; H118-N121 PolarHBondContact O-N 2.71Å; D119-N121 PolarHBondContact O-N 2.92Å; D119-N121 VanDerWaalsContact O-N 3.12Å; D119-N121 PolarHBondContact O-ND2 2.88Å; N121-A123 PolarHBondContact O-N 2.92Å
122	L	93.4	Very high	89.1	Confident	8 Å²	8	58.2 Å²	58.2	4%	0.042	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	112.7	175.3	175.9	62.6	0	0	0	109.2	L115 Y117 L130 Y146 F483 W487	L115-L122 HydrophobicContact CB-CD1 4.04Å; L115-L122 HydrophobicContact CD2-CD1 4.03Å; L115-L122 HydrophobicContact CG-CD1 4.46Å; Y117-L122 HydrophobicContact CD1-CB 4.17Å; Y117-L122 HydrophobicContact CE1-CB 3.85Å; Y117-L122 HydrophobicContact CE1-CD1 4.29Å; Y117-L122 HydrophobicContact CE2-CD1 4.44Å; L122-L130 HydrophobicContact CD2-CD2 3.71Å; L122-L130 HydrophobicContact CG-CD2 4.47Å; L122-Y146 HydrophobicContact CD2-CD2 3.82Å; L122-Y146 HydrophobicContact CD2-CE2 3.41Å; L122-Y146 VanDerWaalsContact CD2-CE2 3.41Å; L122-F483 HydrophobicContact CB-CD1 4.28Å; L122-F483 HydrophobicContact CD2-CD1 3.67Å; L122-F483 HydrophobicContact CD2-CE1 3.9Å; L122-F483 HydrophobicContact CD2-CG 4.11Å; L122-F483 HydrophobicContact CG-CB 4.33Å; L122-F483 HydrophobicContact CG-CD1 3.85Å; L122-F483 HydrophobicContact CG-CG 4.2Å; L122-W487 PolarHBondContact O-NE1 3.07Å
123	A	93.8	Very high	91.1	Very high	11 Å²	11	53.2 Å²	53.2	9%	0.091	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	-41.5	-173.8	0	0	0	0	0	112.1	Y116 H118 N121 F483 E484	Y116-A123 PolarHBondContact O-N 3.41Å; H118-A123 HydrophobicContact CB-CB 3.72Å; N121-A123 PolarHBondContact O-N 2.92Å; A123-F483 WeakPolarHBondContact O-CA 3.1Å; A123-F483 WeakPolarHBondContact O-CB 3.41Å; A123-F483 PolarHBondContact O-N 3.31Å; A123-E484 HydrophobicContact CB-CG 3.75Å; A123-E484 PolarHBondContact O-N 3.26Å; A123-E484 VanDerWaalsContact O-N 3.17Å
124	S	95.1	Very high	92.4	Very high	10 Å²	10	47.6 Å²	47.6	7%	0.07	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-156.4	165.4	177.1	61.7	0	0	0	0	112.8	Y116 I481	Y116-S124 PolarHBondContact N-O 3Å; Y116-S124 PolarHBondContact O-N 2.9Å; Y116-S124 VanDerWaalsContact O-N 3.14Å; S124-I481 WeakPolarHBondContact CA-O 3.21Å; S124-I481 WeakPolarHBondContact CB-O 3.28Å
125	G	95.4	Very high	93	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-172	169.2	171.3	0	0	0	0	0	114.4	G114 I481	G114-G125 CarbonylContact O-C 3.43Å; G114-G125 WeakPolarHBondContact O-CA 3.48Å; G125-I481 PolarHBondContact N-O 2.96Å; G125-I481 WeakPolarHBondContact O-CB 3.45Å; G125-I481 PolarHBondContact O-N 3.04Å
126	S	94.9	Very high	93	Very high	33 Å²	33	45.7 Å²	45.7	23%	0.231	22%	0.223	C	C	.	.			trans	-69.4	154.6	168.9	67.9	0	0	0	0	110	G114 E128 A129 L130	G114-S126 PolarHBondContact O-N 3.26Å; S126-E128 PolarHBondContact O-N 2.98Å; S126-A129 PolarHBondContact O-N 3.28Å; S126-A129 VanDerWaalsContact OG-CB 3.22Å; S126-A129 WeakPolarHBondContact OG-CB 3.43Å; S126-A129 PolarHBondContact OG-N 3.37Å; S126-A129 VanDerWaalsContact OG-N 3.14Å; S126-L130 VanDerWaalsContact O-CG 3.28Å; S126-L130 WeakPolarHBondContact O-CG 3.45Å; S126-L130 PolarHBondContact O-N 3.29Å
127	L	94.3	Very high	92.8	Very high	23 Å²	23	42.1 Å²	42.1	12%	0.12	21%	0.214	C	C	.	.	H	α-helix	trans	-58.3	-42.7	177.9	178.2	59.5	0	0	0	110.6	L130 I131 F150 F157 I158 I481	L127-L130 PolarHBondContact O-N 2.91Å; L127-I131 HydrophobicContact CD1-CD1 4.01Å; L127-I131 HydrophobicContact CD1-CG1 4.21Å; L127-I131 HydrophobicContact CG-CD1 3.9Å; L127-I131 HydrophobicContact CG-CG1 4.47Å; L127-I131 VanDerWaalsContact O-CG1 3.22Å; L127-I131 WeakPolarHBondContact O-CG1 3.36Å; L127-I131 PolarHBondContact O-N 2.86Å; L127-F150 HydrophobicContact CD1-CZ 4.44Å; L127-F157 HydrophobicContact CD1-CB 4.26Å; L127-I158 HydrophobicContact CD1-CG2 4.28Å; L127-I158 HydrophobicContact CD2-CB 4.36Å; L127-I481 HydrophobicContact CB-CD1 3.88Å; L127-I481 HydrophobicContact CD1-CD1 3.88Å; L127-I481 HydrophobicContact CG-CD1 4.45Å
128	E	94.4	Very high	92.5	Very high	105 Å²	105	38.1 Å²	38.1	49%	0.491	20%	0.202	S	C	.	.	H	α-helix	trans	-59.4	-50.6	177.4	-70	64.4	-144.8	0	0	111.3	S126 L130 I131 H132	S126-E128 PolarHBondContact O-N 2.98Å; E128-L130 VanDerWaalsContact C-N 3.3Å; E128-L130 PolarHBondContact O-N 3.31Å; E128-I131 PolarHBondContact O-N 3.14Å; E128-H132 PolarHBondContact O-CD2 3.03Å; E128-H132 VanDerWaalsContact O-CD2 3.23Å; E128-H132 PolarHBondContact O-N 3.3Å
129	A	95.2	Very high	92.4	Very high	5 Å²	5	40.3 Å²	40.3	4%	0.041	22%	0.218	C	C	.	.	H	α-helix	trans	-62	-39	-179.4	0	0	0	0	0	111.9	L115 S126 H132 H133	L115-A129 HydrophobicContact CD2-CB 3.68Å; L115-A129 HydrophobicContact CG-CB 3.98Å; S126-A129 PolarHBondContact O-N 3.28Å; S126-A129 VanDerWaalsContact OG-CB 3.22Å; S126-A129 WeakPolarHBondContact OG-CB 3.43Å; S126-A129 PolarHBondContact OG-N 3.37Å; S126-A129 VanDerWaalsContact OG-N 3.14Å; A129-H132 PolarHBondContact O-N 3.08Å; A129-H133 WeakPolarHBondContact O-CB 3.37Å; A129-H133 PolarHBondContact O-N 2.87Å
130	L	96.4	Very high	92.6	Very high	0 Å²	0	37.4 Å²	37.4	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-67.1	-38.9	175.9	-66.8	168	0	0	0	112.3	L115 L122 S126 L127 E128 H133 L134 Y146 F150 I481 F483	L115-L130 HydrophobicContact CD2-CD2 3.75Å; L115-L130 HydrophobicContact CD2-CG 4.1Å; L122-L130 HydrophobicContact CD2-CD2 3.71Å; L122-L130 HydrophobicContact CG-CD2 4.47Å; S126-L130 VanDerWaalsContact O-CG 3.28Å; S126-L130 WeakPolarHBondContact O-CG 3.45Å; S126-L130 PolarHBondContact O-N 3.29Å; L127-L130 PolarHBondContact O-N 2.91Å; E128-L130 VanDerWaalsContact C-N 3.3Å; E128-L130 PolarHBondContact O-N 3.31Å; L130-H133 PolarHBondContact O-N 3.23Å; L130-L134 PolarHBondContact O-N 3.41Å; L130-L134 VanDerWaalsContact O-N 3.08Å; L130-Y146 WeakPolarHBondContact CA-OH 3.38Å; L130-Y146 HydrophobicContact CD2-CE2 4.22Å; L130-Y146 PolarHBondContact O-OH 3.39Å; L130-F150 HydrophobicContact CB-CD2 3.95Å; L130-F150 HydrophobicContact CB-CE2 3.42Å; L130-F150 VanDerWaalsContact CB-CE2 3.42Å; L130-F150 HydrophobicContact CB-CZ 4.11Å; L130-F150 HydrophobicContact CD1-CE2 4.28Å; L130-F150 HydrophobicContact CG-CE2 4.41Å; L130-I481 HydrophobicContact CD1-CB 3.8Å; L130-I481 HydrophobicContact CD1-CD1 3.93Å; L130-I481 HydrophobicContact CD1-CG1 4.39Å; L130-I481 HydrophobicContact CD1-CG2 3.9Å; L130-F483 HydrophobicContact CD1-CD2 4.32Å; L130-F483 HydrophobicContact CD2-CD2 4.07Å; L130-F483 HydrophobicContact CD2-CE2 4.35Å
131	I	96.1	Very high	93	Very high	4 Å²	4	34.6 Å²	34.6	2%	0.021	18%	0.18	C	C	.	.	H	α-helix	trans	-64.6	-43.6	173.9	-67.1	172.4	0	0	0	110.4	L127 E128 H133 L134 V135 F150 I158 L163 K166 L170	L127-I131 HydrophobicContact CD1-CD1 4.01Å; L127-I131 HydrophobicContact CD1-CG1 4.21Å; L127-I131 HydrophobicContact CG-CD1 3.9Å; L127-I131 HydrophobicContact CG-CG1 4.47Å; L127-I131 VanDerWaalsContact O-CG1 3.22Å; L127-I131 WeakPolarHBondContact O-CG1 3.36Å; L127-I131 PolarHBondContact O-N 2.86Å; E128-I131 PolarHBondContact O-N 3.14Å; I131-H133 VanDerWaalsContact C-N 3.28Å; I131-H133 PolarHBondContact O-N 3.01Å; I131-L134 WeakPolarHBondContact O-CB 3.5Å; I131-L134 PolarHBondContact O-N 3.22Å; I131-L134 VanDerWaalsContact O-N 3.13Å; I131-V135 PolarHBondContact O-N 3.47Å; I131-F150 HydrophobicContact CG1-CE1 4.24Å; I131-F150 HydrophobicContact CG1-CZ 3.7Å; I131-I158 HydrophobicContact CD1-CD1 4.05Å; I131-L163 HydrophobicContact CB-CD1 4.47Å; I131-L163 HydrophobicContact CD1-CD1 3.91Å; I131-L163 HydrophobicContact CG1-CD1 3.65Å; I131-L163 HydrophobicContact CG2-CD1 4.13Å; I131-K166 HydrophobicContact CD1-CD 3.64Å; I131-K166 HydrophobicContact CG2-CB 4.24Å; I131-L170 HydrophobicContact CG2-CD1 3.79Å
132	H	94	Very high	93.3	Very high	52 Å²	52	30.8 Å²	30.8	24%	0.241	16%	0.159	C	C	.	.	H	α-helix	trans	-59.1	-41.6	173.9	-85.8	-87.9	0	0	0	111.6	Y112 E128 A129 L134 V135 L170	Y112-H132 AromaticContact CE1-CE1 3.57Å; Y112-H132 AromaticContact CE1-CG 3.93Å; Y112-H132 AromaticContact CE1-ND1 3.47Å; Y112-H132 WeakPolarHBondContact CE1-ND1 3.33Å; Y112-H132 AromaticContact CZ-CE1 3.78Å; Y112-H132 AromaticContact CZ-ND1 3.44Å; Y112-H132 PolarHBondContact OH-ND1 3.39Å; E128-H132 PolarHBondContact O-CD2 3.03Å; E128-H132 VanDerWaalsContact O-CD2 3.23Å; E128-H132 PolarHBondContact O-N 3.3Å; A129-H132 PolarHBondContact O-N 3.08Å; H132-L134 PolarHBondContact O-N 3.45Å; H132-V135 PolarHBondContact O-N 2.91Å; H132-V135 VanDerWaalsContact O-N 3.16Å; H132-L170 WeakPolarHBondContact CE1-CD2 3.49Å
133	H	95.1	Very high	93.2	Very high	35 Å²	35	34.3 Å²	34.3	16%	0.162	18%	0.178	C	C	.	.	H	α-helix	trans	-65.3	-23.9	177.2	-162	60.1	0	0	0	113.6	L115 A129 L130 I131 Y140 Y146	L115-H133 HydrophobicContact CD1-CB 3.96Å; A129-H133 WeakPolarHBondContact O-CB 3.37Å; A129-H133 PolarHBondContact O-N 2.87Å; L130-H133 PolarHBondContact O-N 3.23Å; I131-H133 VanDerWaalsContact C-N 3.28Å; I131-H133 PolarHBondContact O-N 3.01Å; H133-Y140 AromaticContact CE1-CE2 3.99Å; H133-Y140 AromaticContact CE1-CZ 3.67Å; H133-Y140 PolarHBondContact CE1-OH 3.29Å; H133-Y140 AromaticContact ND1-CZ 3.72Å; H133-Y140 PolarHBondContact ND1-OH 3.06Å; H133-Y140 VanDerWaalsContact ND1-OH 3.09Å; H133-Y140 PolarHBondContact NE2-OH 3.03Å; H133-Y140 VanDerWaalsContact O-CE1 3.28Å; H133-Y140 WeakPolarHBondContact O-CE1 3.45Å; H133-Y140 PolarHBondContact O-OH 3.27Å; H133-Y146 HydrophobicContact CB-CE1 4.23Å; H133-Y146 AromaticContact CD2-CD1 3.9Å; H133-Y146 AromaticContact CD2-CD2 3.95Å; H133-Y146 AromaticContact CD2-CE1 3.59Å; H133-Y146 AromaticContact CD2-CE2 3.67Å; H133-Y146 AromaticContact CD2-CZ 3.48Å; H133-Y146 VanDerWaalsContact CD2-CZ 3.48Å
134	L	96.3	Very high	93.1	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-74.4	-31.3	174.1	-176.5	70.2	0	0	0	112.5	L130 I131 H132 P136 P142 Y146 V147 F150 L151 L163 V167 L197	L130-L134 PolarHBondContact O-N 3.41Å; L130-L134 VanDerWaalsContact O-N 3.08Å; I131-L134 WeakPolarHBondContact O-CB 3.5Å; I131-L134 PolarHBondContact O-N 3.22Å; I131-L134 VanDerWaalsContact O-N 3.13Å; H132-L134 PolarHBondContact O-N 3.45Å; L134-P136 WeakPolarHBondContact O-CD 3.31Å; L134-P142 WeakPolarHBondContact O-CG 3.44Å; L134-Y146 HydrophobicContact CB-CE1 4.22Å; L134-Y146 HydrophobicContact CD1-CE1 4.33Å; L134-V147 HydrophobicContact CD1-CG1 4.45Å; L134-V147 HydrophobicContact CD1-CG2 4.27Å; L134-F150 HydrophobicContact CB-CD1 4.12Å; L134-F150 HydrophobicContact CB-CE1 4.23Å; L134-F150 HydrophobicContact CD1-CD1 4.06Å; L134-F150 HydrophobicContact CD2-CD1 3.79Å; L134-F150 HydrophobicContact CD2-CE1 3.81Å; L134-F150 HydrophobicContact CG-CD1 4.19Å; L134-F150 HydrophobicContact CG-CE1 4.49Å; L134-L151 HydrophobicContact CD1-CG 4.48Å; L134-L151 HydrophobicContact CD2-CD2 3.92Å; L134-L163 HydrophobicContact CD2-CD1 4.47Å; L134-L163 HydrophobicContact CD2-CD2 4.47Å; L134-V167 HydrophobicContact CD2-CG2 4.03Å; L134-L197 HydrophobicContact CD1-CD1 3.96Å; L134-L197 HydrophobicContact CG-CD1 4.33Å; L134-L197 HydrophobicContact CG-CD2 4.28Å
135	V	93.7	Very high	93	Very high	1 Å²	1	44.6 Å²	44.6	1%	0.006	22%	0.22	C	C	.	.	S	Bend	trans	-82.2	119.3	-172.7	-177.9	0	0	0	0	110.4	I131 H132 V167 L170	I131-V135 PolarHBondContact O-N 3.47Å; H132-V135 PolarHBondContact O-N 2.91Å; H132-V135 VanDerWaalsContact O-N 3.16Å; V135-V167 HydrophobicContact CG2-CB 4.37Å; V135-V167 HydrophobicContact CG2-CG1 4.21Å; V135-V167 HydrophobicContact CG2-CG2 4.07Å; V135-L170 HydrophobicContact CG1-CB 4.33Å; V135-L170 HydrophobicContact CG2-CB 4.04Å; V135-L170 HydrophobicContact CG2-CD1 3.79Å
136	P	92.3	Very high	93.1	Very high	1 Å²	1	44.7 Å²	44.7	1%	0.006	22%	0.22	C	C	.	.			trans	-64.4	149.3	179.5	-20.2	32.5	0	0	0	112.4	L134 Y141 Q174 K193 L197	L134-P136 WeakPolarHBondContact O-CD 3.31Å; P136-Y141 HydrophobicContact CB-CD2 3.91Å; P136-Y141 HydrophobicContact CG-CD2 3.72Å; P136-Y141 HydrophobicContact CG-CE2 3.85Å; P136-Q174 PolarHBondContact O-OE1 3.33Å; P136-K193 HydrophobicContact CB-CB 3.6Å; P136-K193 HydrophobicContact CB-CD 4.13Å; P136-K193 HydrophobicContact CG-CB 4.14Å; P136-L197 HydrophobicContact CG-CB 4.37Å; P136-L197 HydrophobicContact CG-CD2 4.44Å
137	T	88.9	Confident	93.2	Very high	52 Å²	52	43.3 Å²	43.3	32%	0.319	21%	0.21	S	C	.	.			trans	-120.4	-176.3	173.3	76.4	0	0	0	0	110.4	D139 Y140 K193	T137-D139 PolarHBondContact O-N 3.22Å; T137-Y140 PolarHBondContact N-O 2.83Å; T137-Y140 VanDerWaalsContact N-O 3.07Å; T137-Y140 WeakPolarHBondContact OG1-CB 3.46Å; T137-Y140 PolarHBondContact OG1-N 2.58Å; T137-K193 VanDerWaalsContact O-CD 3.27Å; T137-K193 WeakPolarHBondContact O-CD 3.21Å; T137-K193 PolarHBondContact O-NZ 3.35Å
138	V	86.1	Confident	93.3	Very high	38 Å²	38	43.6 Å²	43.6	23%	0.23	21%	0.21	C	C	.	.	S	Bend	trans	-57.5	-40.3	179.3	178.9	0	0	0	0	111.6	R186 K189 K193	V138-R186 HydrophobicContact CG2-CB 4.24Å; V138-R186 HydrophobicContact CG2-CG 4.14Å; V138-K189 HydrophobicContact CG1-CB 4.19Å; V138-K189 HydrophobicContact CG1-CD 3.71Å; V138-K193 VanDerWaalsContact C-NZ 3.28Å; V138-K193 PolarHBondContact O-NZ 3.15Å
139	D	87.3	Confident	93.3	Very high	152 Å²	152	38.6 Å²	38.6	81%	0.813	19%	0.187	S	C	*	.	S	Bend	trans	-109.6	-3.8	-172.5	-56.2	-54.6	0	0	0	113.3	T137	T137-D139 PolarHBondContact O-N 3.22Å
140	Y	90.3	Very high	93.4	Very high	67 Å²	67	38.4 Å²	38.4	26%	0.263	19%	0.185	S	C	.	.			trans	-128.2	144.8	-176.5	167.1	-100.1	0	0	0	112.7	H133 T137 P142 K193	H133-Y140 AromaticContact CE1-CE2 3.99Å; H133-Y140 AromaticContact CE1-CZ 3.67Å; H133-Y140 PolarHBondContact CE1-OH 3.29Å; H133-Y140 AromaticContact ND1-CZ 3.72Å; H133-Y140 PolarHBondContact ND1-OH 3.06Å; H133-Y140 VanDerWaalsContact ND1-OH 3.09Å; H133-Y140 PolarHBondContact NE2-OH 3.03Å; H133-Y140 VanDerWaalsContact O-CE1 3.28Å; H133-Y140 WeakPolarHBondContact O-CE1 3.45Å; H133-Y140 PolarHBondContact O-OH 3.27Å; T137-Y140 PolarHBondContact N-O 2.83Å; T137-Y140 VanDerWaalsContact N-O 3.07Å; T137-Y140 WeakPolarHBondContact OG1-CB 3.46Å; T137-Y140 PolarHBondContact OG1-N 2.58Å; Y140-P142 HydrophobicContact CE1-CB 4.43Å; Y140-P142 VanDerWaalsContact OH-CA 3.25Å; Y140-P142 WeakPolarHBondContact OH-CA 3.47Å; Y140-P142 WeakPolarHBondContact OH-CB 3.29Å; Y140-K193 PolarHBondContact O-NZ 2.97Å; Y140-K193 VanDerWaalsContact O-NZ 3.11Å
141	Y	93.3	Very high	93.4	Very high	50 Å²	50	38.5 Å²	38.5	20%	0.196	19%	0.186	C	C	.	.			trans	-138.9	131.8	164.8	-175	-92	0	0	0	107.3	P136 K193 Q196 L197 E200	P136-Y141 HydrophobicContact CB-CD2 3.91Å; P136-Y141 HydrophobicContact CG-CD2 3.72Å; P136-Y141 HydrophobicContact CG-CE2 3.85Å; Y141-K193 HydrophobicContact CD2-CB 3.91Å; Y141-K193 HydrophobicContact CD2-CD 4.48Å; Y141-K193 HydrophobicContact CD2-CG 4.19Å; Y141-K193 HydrophobicContact CE2-CB 4.41Å; Y141-K193 WeakPolarHBondContact CE2-O 3.41Å; Y141-Q196 HydrophobicContact CE2-CB 4.07Å; Y141-Q196 HydrophobicContact CE2-CG 4.17Å; Y141-Q196 WeakPolarHBondContact OH-CG 3.38Å; Y141-Q196 PolarHBondContact OH-NE2 2.98Å; Y141-L197 HydrophobicContact CE2-CB 4.48Å; Y141-L197 PolarHBondContact OH-N 2.87Å; Y141-E200 PolarHBondContact OH-OE1 2.68Å; Y141-E200 PolarHBondContact OH-OE2 3.15Å
142	P	92.6	Very high	93.3	Very high	0 Å²	0	38.3 Å²	38.3	0%	0	19%	0.185	C	C	.	.			trans	-60.9	143	177.9	26	-35.8	0	0	0	111.5	L134 Y140 Y146 V147	L134-P142 WeakPolarHBondContact O-CG 3.44Å; Y140-P142 HydrophobicContact CE1-CB 4.43Å; Y140-P142 VanDerWaalsContact OH-CA 3.25Å; Y140-P142 WeakPolarHBondContact OH-CA 3.47Å; Y140-P142 WeakPolarHBondContact OH-CB 3.29Å; P142-Y146 HydrophobicContact CB-CD1 3.8Å; P142-V147 HydrophobicContact CB-CG2 3.8Å; P142-V147 HydrophobicContact CG-CG2 3.51Å
143	D	91.5	Very high	93.2	Very high	82 Å²	82	36 Å²	36	44%	0.439	17%	0.174	S	C	.	.			trans	-62.6	150.1	174.4	77.6	73.6	0	0	0	110.9	T145 Y146 V147	D143-T145 PolarHBondContact O-N 3.27Å; D143-T145 VanDerWaalsContact OD1-CA 3.3Å; D143-T145 WeakPolarHBondContact OD1-CA 3.32Å; D143-T145 WeakPolarHBondContact OD1-CB 3.43Å; D143-T145 PolarHBondContact OD1-N 2.83Å; D143-T145 PolarHBondContact OD1-OG1 3.21Å; D143-Y146 WeakPolarHBondContact O-CB 3.43Å; D143-Y146 PolarHBondContact O-N 2.72Å; D143-Y146 VanDerWaalsContact O-N 3.12Å; D143-Y146 PolarHBondContact OD1-N 2.58Å; D143-Y146 WeakPolarHBondContact OD2-CB 3.39Å; D143-V147 WeakPolarHBondContact O-CG2 3.39Å; D143-V147 PolarHBondContact O-N 3.18Å
144	R	92.4	Very high	93.1	Very high	178 Å²	178	34.5 Å²	34.5	67%	0.672	17%	0.168	S	C	*	.	H	α-helix	trans	-61.5	-31.2	-176	-74	-174.8	172.7	166.9	3.6	113.1	V147 F148 E200	R144-V147 PolarHBondContact O-N 3.37Å; R144-F148 WeakPolarHBondContact O-CB 3.35Å; R144-F148 PolarHBondContact O-N 2.87Å; R144-E200 IonicContact NE-OE1 2.75Å; R144-E200 PolarHBondContact NE-OE1 3.21Å
145	T	93.3	Very high	92.8	Very high	59 Å²	59	34.7 Å²	34.7	36%	0.362	17%	0.169	S	C	.	.	H	α-helix	trans	-68.1	-42.3	178.7	-36.2	0	0	0	0	109.4	D143 F148 T149 W487	D143-T145 PolarHBondContact O-N 3.27Å; D143-T145 VanDerWaalsContact OD1-CA 3.3Å; D143-T145 WeakPolarHBondContact OD1-CA 3.32Å; D143-T145 WeakPolarHBondContact OD1-CB 3.43Å; D143-T145 PolarHBondContact OD1-N 2.83Å; D143-T145 PolarHBondContact OD1-OG1 3.21Å; T145-F148 PolarHBondContact O-N 3.01Å; T145-T149 WeakPolarHBondContact O-CB 3.34Å; T145-T149 PolarHBondContact O-N 3.44Å; T145-T149 PolarHBondContact O-OG1 3.16Å; T145-W487 HydrophobicContact CG2-CE3 4.13Å; T145-W487 HydrophobicContact CG2-CZ3 3.57Å
146	Y	96.1	Very high	92.4	Very high	1 Å²	1	36.4 Å²	36.4	0%	0.004	18%	0.178	C	C	.	.	H	α-helix	trans	-62.6	-49.1	173.8	179	-96.9	0	0	0	110.9	L122 L130 H133 L134 P142 D143 F148 T149 F150 F483 W487	L122-Y146 HydrophobicContact CD2-CD2 3.82Å; L122-Y146 HydrophobicContact CD2-CE2 3.41Å; L122-Y146 VanDerWaalsContact CD2-CE2 3.41Å; L130-Y146 WeakPolarHBondContact CA-OH 3.38Å; L130-Y146 HydrophobicContact CD2-CE2 4.22Å; L130-Y146 PolarHBondContact O-OH 3.39Å; H133-Y146 HydrophobicContact CB-CE1 4.23Å; H133-Y146 AromaticContact CD2-CD1 3.9Å; H133-Y146 AromaticContact CD2-CD2 3.95Å; H133-Y146 AromaticContact CD2-CE1 3.59Å; H133-Y146 AromaticContact CD2-CE2 3.67Å; H133-Y146 AromaticContact CD2-CZ 3.48Å; H133-Y146 VanDerWaalsContact CD2-CZ 3.48Å; L134-Y146 HydrophobicContact CB-CE1 4.22Å; L134-Y146 HydrophobicContact CD1-CE1 4.33Å; P142-Y146 HydrophobicContact CB-CD1 3.8Å; D143-Y146 WeakPolarHBondContact O-CB 3.43Å; D143-Y146 PolarHBondContact O-N 2.72Å; D143-Y146 VanDerWaalsContact O-N 3.12Å; D143-Y146 PolarHBondContact OD1-N 2.58Å; D143-Y146 WeakPolarHBondContact OD2-CB 3.39Å; Y146-F148 VanDerWaalsContact C-N 3.32Å; Y146-F148 PolarHBondContact O-N 2.85Å; Y146-T149 PolarHBondContact O-N 3.29Å; Y146-F150 HydrophobicContact CD1-CB 4.46Å; Y146-F150 HydrophobicContact CE1-CB 4.01Å; Y146-F150 HydrophobicContact CE1-CG 4.31Å; Y146-F150 HydrophobicContact CE2-CB 4.11Å; Y146-F150 AromaticContact CZ-CG 3.96Å; Y146-F150 VanDerWaalsContact O-CB 3.26Å; Y146-F150 WeakPolarHBondContact O-CB 3.47Å; Y146-F150 PolarHBondContact O-N 3.42Å; Y146-F483 AromaticContact CD2-CE1 3.54Å; Y146-F483 HydrophobicContact CD2-CE1 3.54Å; Y146-F483 AromaticContact CD2-CZ 3.51Å; Y146-F483 HydrophobicContact CD2-CZ 3.51Å; Y146-F483 AromaticContact CE2-CE1 3.67Å; Y146-F483 HydrophobicContact CE2-CE1 3.67Å; Y146-F483 AromaticContact CE2-CE2 3.98Å; Y146-F483 HydrophobicContact CE2-CE2 3.98Å; Y146-F483 AromaticContact CE2-CZ 3.33Å; Y146-F483 HydrophobicContact CE2-CZ 3.33Å; Y146-W487 HydrophobicContact CD2-CH2 4.25Å; Y146-W487 HydrophobicContact CD2-CZ2 4.39Å
147	V	96.8	Very high	92.1	Very high	4 Å²	4	38 Å²	38	2%	0.024	19%	0.185	C	C	.	.	H	α-helix	trans	-54.2	-51.2	177	174.8	0	0	0	0	110.1	L134 P142 D143 R144 L151 L197	L134-V147 HydrophobicContact CD1-CG1 4.45Å; L134-V147 HydrophobicContact CD1-CG2 4.27Å; P142-V147 HydrophobicContact CB-CG2 3.8Å; P142-V147 HydrophobicContact CG-CG2 3.51Å; D143-V147 WeakPolarHBondContact O-CG2 3.39Å; D143-V147 PolarHBondContact O-N 3.18Å; R144-V147 PolarHBondContact O-N 3.37Å; V147-L151 HydrophobicContact CG1-CD1 3.72Å; V147-L151 HydrophobicContact CG1-CG 4.29Å; V147-L151 WeakPolarHBondContact O-CB 3.37Å; V147-L151 WeakPolarHBondContact O-CG 3.27Å; V147-L151 PolarHBondContact O-N 3Å; V147-L197 HydrophobicContact CG1-CD1 3.78Å; V147-L197 HydrophobicContact CG2-CD1 4.26Å
148	F	96.4	Very high	92.2	Very high	29 Å²	29	36 Å²	36	13%	0.127	17%	0.172	C	C	.	.	H	α-helix	trans	-60.1	-50.3	177.6	177.1	-97.3	0	0	0	112.1	R144 T145 Y146 L152 T204 F205 P310 A490 V493 S494	R144-F148 WeakPolarHBondContact O-CB 3.35Å; R144-F148 PolarHBondContact O-N 2.87Å; T145-F148 PolarHBondContact O-N 3.01Å; Y146-F148 VanDerWaalsContact C-N 3.32Å; Y146-F148 PolarHBondContact O-N 2.85Å; F148-L152 HydrophobicContact CE1-CD2 3.84Å; F148-L152 HydrophobicContact CZ-CD2 4.02Å; F148-L152 WeakPolarHBondContact O-CB 3.5Å; F148-L152 PolarHBondContact O-N 3.09Å; F148-T204 HydrophobicContact CD2-CG2 3.79Å; F148-T204 HydrophobicContact CE2-CG2 3.92Å; F148-F205 HydrophobicContact CD2-CZ 4.28Å; F148-F205 HydrophobicContact CE2-CZ 4.3Å; F148-P310 HydrophobicContact CE2-CB 4.22Å; F148-P310 HydrophobicContact CE2-CG 4.49Å; F148-P310 HydrophobicContact CZ-CB 4.3Å; F148-A490 HydrophobicContact CD1-CB 3.95Å; F148-A490 HydrophobicContact CE1-CB 3.88Å; F148-V493 HydrophobicContact CZ-CB 4.32Å; F148-V493 HydrophobicContact CZ-CG1 3.96Å; F148-S494 WeakPolarHBondContact CE1-OG 3.35Å
149	T	96.3	Very high	92.4	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.9	-48.3	-175.2	-60.3	0	0	0	0	111.6	T145 Y146 L152 S153 F483 F486 W487 A490	T145-T149 WeakPolarHBondContact O-CB 3.34Å; T145-T149 PolarHBondContact O-N 3.44Å; T145-T149 PolarHBondContact O-OG1 3.16Å; Y146-T149 PolarHBondContact O-N 3.29Å; T149-L152 PolarHBondContact O-N 2.93Å; T149-S153 WeakPolarHBondContact O-CB 3.32Å; T149-S153 PolarHBondContact O-N 3.1Å; T149-S153 PolarHBondContact O-OG 2.78Å; T149-F483 HydrophobicContact CG2-CE1 3.89Å; T149-F483 HydrophobicContact CG2-CE2 4.27Å; T149-F483 HydrophobicContact CG2-CZ 3.62Å; T149-F486 HydrophobicContact CG2-CB 3.75Å; T149-F486 WeakPolarHBondContact CG2-O 3.05Å; T149-W487 HydrophobicContact CG2-CD2 4.31Å; T149-W487 HydrophobicContact CG2-CE3 3.82Å; T149-W487 HydrophobicContact CG2-CZ3 4.18Å; T149-W487 VanDerWaalsContact OG1-CE3 3.27Å; T149-W487 VanDerWaalsContact OG1-CZ3 3.24Å; T149-W487 WeakPolarHBondContact OG1-CZ3 3.27Å; T149-A490 HydrophobicContact CG2-CB 3.83Å; T149-A490 WeakPolarHBondContact OG1-CB 3.48Å
150	F	96.8	Very high	92.7	Very high	2 Å²	2	28 Å²	28	1%	0.009	13%	0.127	C	C	.	.	H	α-helix	trans	-68.1	-46.7	179.3	-176.7	-101.1	0	0	0	111.2	L127 L130 I131 L134 Y146 L152 S153 S154 L163 F483	L127-F150 HydrophobicContact CD1-CZ 4.44Å; L130-F150 HydrophobicContact CB-CD2 3.95Å; L130-F150 HydrophobicContact CB-CE2 3.42Å; L130-F150 VanDerWaalsContact CB-CE2 3.42Å; L130-F150 HydrophobicContact CB-CZ 4.11Å; L130-F150 HydrophobicContact CD1-CE2 4.28Å; L130-F150 HydrophobicContact CG-CE2 4.41Å; I131-F150 HydrophobicContact CG1-CE1 4.24Å; I131-F150 HydrophobicContact CG1-CZ 3.7Å; L134-F150 HydrophobicContact CB-CD1 4.12Å; L134-F150 HydrophobicContact CB-CE1 4.23Å; L134-F150 HydrophobicContact CD1-CD1 4.06Å; L134-F150 HydrophobicContact CD2-CD1 3.79Å; L134-F150 HydrophobicContact CD2-CE1 3.81Å; L134-F150 HydrophobicContact CG-CD1 4.19Å; L134-F150 HydrophobicContact CG-CE1 4.49Å; Y146-F150 HydrophobicContact CD1-CB 4.46Å; Y146-F150 HydrophobicContact CE1-CB 4.01Å; Y146-F150 HydrophobicContact CE1-CG 4.31Å; Y146-F150 HydrophobicContact CE2-CB 4.11Å; Y146-F150 AromaticContact CZ-CG 3.96Å; Y146-F150 VanDerWaalsContact O-CB 3.26Å; Y146-F150 WeakPolarHBondContact O-CB 3.47Å; Y146-F150 PolarHBondContact O-N 3.42Å; F150-L152 VanDerWaalsContact C-N 3.29Å; F150-L152 PolarHBondContact O-N 3.04Å; F150-S153 PolarHBondContact O-N 3.4Å; F150-S154 WeakPolarHBondContact O-CA 3.26Å; F150-S154 WeakPolarHBondContact O-CB 3.27Å; F150-S154 PolarHBondContact O-N 2.96Å; F150-S154 PolarHBondContact O-OG 3.48Å; F150-L163 HydrophobicContact CE1-CD1 3.93Å; F150-L163 HydrophobicContact CE1-CD2 4.02Å; F150-L163 HydrophobicContact CZ-CD1 4.36Å; F150-F483 HydrophobicContact CB-CE2 4.2Å; F150-F483 HydrophobicContact CB-CZ 4.08Å; F150-F483 AromaticContact CD2-CE2 3.99Å; F150-F483 HydrophobicContact CD2-CE2 3.99Å
151	L	96.4	Very high	92.9	Very high	1 Å²	1	26.9 Å²	26.9	1%	0.005	12%	0.123	C	C	.	.	H	α-helix	trans	-60.7	-39.5	175.5	-69.8	-178.6	0	0	0	111.5	L134 V147 S154 R155 L163 W201 F205	L134-L151 HydrophobicContact CD1-CG 4.48Å; L134-L151 HydrophobicContact CD2-CD2 3.92Å; V147-L151 HydrophobicContact CG1-CD1 3.72Å; V147-L151 HydrophobicContact CG1-CG 4.29Å; V147-L151 WeakPolarHBondContact O-CB 3.37Å; V147-L151 WeakPolarHBondContact O-CG 3.27Å; V147-L151 PolarHBondContact O-N 3Å; L151-S154 PolarHBondContact O-OG 3.21Å; L151-S154 VanDerWaalsContact O-OG 3.08Å; L151-R155 PolarHBondContact O-NH1 2.74Å; L151-L163 HydrophobicContact CD2-CD2 4Å; L151-W201 HydrophobicContact CD1-CB 3.92Å; L151-W201 HydrophobicContact CD1-CD2 3.96Å; L151-W201 HydrophobicContact CD1-CE3 4.47Å; L151-W201 HydrophobicContact CD1-CG 3.72Å; L151-W201 HydrophobicContact CD2-CD2 3.71Å; L151-W201 HydrophobicContact CD2-CE3 3.84Å; L151-W201 HydrophobicContact CD2-CG 4.33Å; L151-W201 HydrophobicContact CD2-CH2 4Å; L151-W201 HydrophobicContact CD2-CZ2 3.83Å; L151-W201 HydrophobicContact CD2-CZ3 4Å; L151-W201 HydrophobicContact CG-CD2 4.5Å; L151-F205 HydrophobicContact CB-CD2 4.04Å; L151-F205 HydrophobicContact CB-CE2 3.38Å; L151-F205 HydrophobicContact CB-CZ 3.97Å; L151-F205 HydrophobicContact CD1-CD2 4.19Å; L151-F205 HydrophobicContact CD1-CE2 3.99Å; L151-F205 HydrophobicContact CG-CE2 4.36Å
152	L	94.2	Very high	93	Very high	1 Å²	1	28 Å²	28	1%	0.005	13%	0.13	C	C	.	.	H	α-helix	trans	-59.8	-58.1	175.7	-179.6	60.1	0	0	0	111.9	F148 T149 F150 R155 F205 P310 V314 A490 V493	F148-L152 HydrophobicContact CE1-CD2 3.84Å; F148-L152 HydrophobicContact CZ-CD2 4.02Å; F148-L152 WeakPolarHBondContact O-CB 3.5Å; F148-L152 PolarHBondContact O-N 3.09Å; T149-L152 PolarHBondContact O-N 2.93Å; F150-L152 VanDerWaalsContact C-N 3.29Å; F150-L152 PolarHBondContact O-N 3.04Å; L152-R155 PolarHBondContact O-NH1 3.27Å; L152-R155 VanDerWaalsContact O-NH1 3.09Å; L152-F205 HydrophobicContact CB-CE1 4.36Å; L152-F205 HydrophobicContact CB-CZ 4.07Å; L152-F205 HydrophobicContact CD1-CE1 4.09Å; L152-P310 HydrophobicContact CD1-CB 4.17Å; L152-P310 WeakPolarHBondContact CD1-O 3.45Å; L152-V314 HydrophobicContact CD1-CG2 3.49Å; L152-V314 VanDerWaalsContact CD1-CG2 3.49Å; L152-V314 HydrophobicContact CD2-CG2 4.44Å; L152-V314 HydrophobicContact CG-CG2 3.7Å; L152-A490 HydrophobicContact CD2-CB 4.28Å; L152-V493 HydrophobicContact CD2-CB 4.03Å; L152-V493 HydrophobicContact CD2-CG1 4.23Å; L152-V493 HydrophobicContact CD2-CG2 4.07Å
153	S	91.9	Very high	93.2	Very high	3 Å²	3	28 Å²	28	2%	0.021	13%	0.13	C	C	.	.	H	α-helix	trans	-81.6	-25.7	-170.2	59.1	0	0	0	0	114.8	T149 F150 R155 L156	T149-S153 WeakPolarHBondContact O-CB 3.32Å; T149-S153 PolarHBondContact O-N 3.1Å; T149-S153 PolarHBondContact O-OG 2.78Å; F150-S153 PolarHBondContact O-N 3.4Å; S153-R155 PolarHBondContact O-N 3.15Å; S153-L156 VanDerWaalsContact O-CB 3.31Å; S153-L156 WeakPolarHBondContact O-CB 3.49Å; S153-L156 WeakPolarHBondContact O-CG 3.39Å; S153-L156 PolarHBondContact O-N 3.09Å
154	S	92.4	Very high	93.4	Very high	3 Å²	3	24.1 Å²	24.1	2%	0.021	11%	0.109	C	C	.	.	G	3₁₀ helix	trans	-54.3	-26.4	177.4	56	0	0	0	0	112.9	F150 L151 L156 F157 I158	F150-S154 WeakPolarHBondContact O-CA 3.26Å; F150-S154 WeakPolarHBondContact O-CB 3.27Å; F150-S154 PolarHBondContact O-N 2.96Å; F150-S154 PolarHBondContact O-OG 3.48Å; L151-S154 PolarHBondContact O-OG 3.21Å; L151-S154 VanDerWaalsContact O-OG 3.08Å; S154-L156 PolarHBondContact O-N 3.12Å; S154-F157 CarbonylContact O-C 3.56Å; S154-F157 PolarHBondContact O-N 3.4Å; S154-I158 WeakPolarHBondContact O-CG2 3.46Å; S154-I158 PolarHBondContact O-N 3.01Å; S154-I158 VanDerWaalsContact O-O 3.05Å
155	R	89.4	Confident	93.5	Very high	5 Å²	5	18.7 Å²	18.7	2%	0.019	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-58.4	-18.8	174.5	-63.9	-173.8	-175.7	72.5	11.2	113.9	L151 L152 S153 F157 P160 D208 F330	L151-R155 PolarHBondContact O-NH1 2.74Å; L152-R155 PolarHBondContact O-NH1 3.27Å; L152-R155 VanDerWaalsContact O-NH1 3.09Å; S153-R155 PolarHBondContact O-N 3.15Å; R155-F157 VanDerWaalsContact C-N 3.31Å; R155-P160 HydrophobicContact CG-CG 4.07Å; R155-D208 IonicContact CZ-OD1 3.04Å; R155-D208 IonicContact CZ-OD2 3.95Å; R155-D208 IonicContact NE-OD1 3.82Å; R155-D208 PolarHBondContact NE-OD1 3.22Å; R155-D208 IonicContact NE-OD2 3.62Å; R155-D208 IonicContact NH2-OD1 3.64Å; R155-D208 IonicContact NH2-OD2 2.91Å; R155-D208 PolarHBondContact NH2-OD2 3.49Å; R155-F330 WeakPolarHBondContact O-CE1 3.38Å; R155-F330 WeakPolarHBondContact O-CZ 3.48Å
156	L	85.4	Confident	93.6	Very high	37 Å²	37	20 Å²	20	19%	0.194	10%	0.099	C	C	.	.	G	3₁₀ helix	trans	-80.3	-11.7	173.6	-60.4	177.5	0	0	0	113.2	S153 S154 V314 V318 F486	S153-L156 VanDerWaalsContact O-CB 3.31Å; S153-L156 WeakPolarHBondContact O-CB 3.49Å; S153-L156 WeakPolarHBondContact O-CG 3.39Å; S153-L156 PolarHBondContact O-N 3.09Å; S154-L156 PolarHBondContact O-N 3.12Å; L156-V314 HydrophobicContact CD1-CG1 4.17Å; L156-V314 HydrophobicContact CD2-CG1 3.47Å; L156-V314 VanDerWaalsContact CD2-CG1 3.47Å; L156-V314 HydrophobicContact CG-CG1 3.65Å; L156-V318 HydrophobicContact CD2-CG2 3.7Å; L156-F486 HydrophobicContact CD1-CE1 3.51Å; L156-F486 HydrophobicContact CD1-CZ 3.95Å
157	F	87.1	Confident	93.5	Very high	35 Å²	35	20 Å²	20	15%	0.154	10%	0.099	C	C	.	.	T	Hydrogen-bonded Turn	trans	-130.9	-26.8	-169.4	-51.9	-65.6	0	0	0	114.1	L127 S154 R155 R475 I481 F486	L127-F157 HydrophobicContact CD1-CB 4.26Å; S154-F157 CarbonylContact O-C 3.56Å; S154-F157 PolarHBondContact O-N 3.4Å; R155-F157 VanDerWaalsContact C-N 3.31Å; F157-R475 HydrophobicContact CE1-CG 4.31Å; F157-I481 HydrophobicContact CB-CD1 4.31Å; F157-I481 HydrophobicContact CD1-CD1 4.18Å; F157-I481 HydrophobicContact CD1-CG1 4.35Å; F157-I481 HydrophobicContact CD2-CD1 3.83Å; F157-I481 HydrophobicContact CD2-CG1 4.49Å; F157-I481 HydrophobicContact CD2-CG2 4.39Å; F157-I481 HydrophobicContact CE1-CD1 4.43Å; F157-I481 HydrophobicContact CE1-CG1 4.18Å; F157-I481 HydrophobicContact CE2-CD1 4.11Å; F157-I481 HydrophobicContact CE2-CG1 4.34Å; F157-I481 HydrophobicContact CE2-CG2 3.66Å; F157-I481 HydrophobicContact CG-CD1 3.85Å; F157-I481 HydrophobicContact CG-CG1 4.47Å; F157-I481 HydrophobicContact CZ-CB 4.48Å; F157-I481 HydrophobicContact CZ-CD1 4.36Å; F157-I481 HydrophobicContact CZ-CG1 4.14Å; F157-I481 HydrophobicContact CZ-CG2 3.73Å; F157-F486 HydrophobicContact CE2-CD2 4.28Å; F157-F486 HydrophobicContact CE2-CE1 4.46Å; F157-F486 AromaticContact CE2-CE2 3.39Å; F157-F486 HydrophobicContact CE2-CE2 3.39Å; F157-F486 AromaticContact CE2-CZ 3.5Å; F157-F486 HydrophobicContact CE2-CZ 3.5Å; F157-F486 VanDerWaalsContact CE2-CZ 3.5Å; F157-F486 AromaticContact CZ-CE2 3.4Å; F157-F486 HydrophobicContact CZ-CE2 3.4Å; F157-F486 AromaticContact CZ-CZ 3.33Å; F157-F486 HydrophobicContact CZ-CZ 3.33Å
158	I	90.4	Very high	93.2	Very high	9 Å²	9	20.4 Å²	20.4	5%	0.046	10%	0.102	C	C	.	.	S	Bend	trans	-151.6	142.5	-176.7	-173.7	166.4	0	0	0	109.8	L127 I131 S154 E162 L163 K166	L127-I158 HydrophobicContact CD1-CG2 4.28Å; L127-I158 HydrophobicContact CD2-CB 4.36Å; I131-I158 HydrophobicContact CD1-CD1 4.05Å; S154-I158 WeakPolarHBondContact O-CG2 3.46Å; S154-I158 PolarHBondContact O-N 3.01Å; S154-I158 VanDerWaalsContact O-O 3.05Å; I158-E162 HydrophobicContact CD1-CB 4.02Å; I158-E162 HydrophobicContact CG1-CB 3.77Å; I158-L163 HydrophobicContact CD1-CB 4.19Å; I158-L163 HydrophobicContact CG1-CB 4.34Å; I158-L163 HydrophobicContact CG2-CB 4.1Å; I158-K166 HydrophobicContact CD1-CD 3.7Å
159	H	90.3	Very high	92.9	Very high	19 Å²	19	23.8 Å²	23.8	9%	0.088	12%	0.118	C	C	.	.			trans	-67.7	142.1	173.5	-75.7	-52.3	0	0	0	111.9	Y161 E162 L163 C329 F330	H159-Y161 VanDerWaalsContact C-N 3.26Å; H159-Y161 HydrophobicContact CB-CD1 3.68Å; H159-Y161 HydrophobicContact CB-CE1 3.32Å; H159-Y161 HydrophobicContact CB-CG 4.46Å; H159-Y161 AromaticContact CD2-CE1 3.82Å; H159-Y161 AromaticContact CD2-CZ 3.96Å; H159-Y161 PolarHBondContact CD2-OH 3.45Å; H159-Y161 AromaticContact CG-CE1 3.59Å; H159-Y161 PolarHBondContact O-N 2.9Å; H159-E162 HydrophobicContact CB-CB 4.35Å; H159-E162 HydrophobicContact CB-CG 4.02Å; H159-E162 IonicContact CD2-OE1 3.72Å; H159-E162 WeakPolarHBondContact O-CB 3.4Å; H159-E162 PolarHBondContact O-N 2.96Å; H159-L163 PolarHBondContact O-N 3.42Å; H159-C329 VanDerWaalsContact CE1-C 3.49Å; H159-C329 PolarHBondContact CE1-O 2.88Å; H159-C329 WeakPolarHBondContact NE2-CB 3.4Å; H159-C329 PolarHBondContact NE2-O 3.25Å; H159-C329 PolarHBondContact NE2-SG 3.41Å; H159-C329 VanDerWaalsContact NE2-SG 3.4Å; H159-F330 AromaticContact CE1-CD1 3.66Å; H159-F330 AromaticContact CE1-CE1 3.58Å; H159-F330 AromaticContact ND1-CE1 3.72Å
160	P	93.8	Very high	92.6	Very high	4 Å²	4	24.5 Å²	24.5	3%	0.026	12%	0.122	C	C	.	.	H	α-helix	trans	-53.6	-38.9	178.3	-31	37.3	0	0	0	114.4	R155 L163 M164 W201 D208	R155-P160 HydrophobicContact CG-CG 4.07Å; P160-L163 PolarHBondContact O-N 2.84Å; P160-M164 WeakPolarHBondContact O-CB 3.41Å; P160-M164 PolarHBondContact O-N 2.92Å; P160-W201 HydrophobicContact CB-CZ2 4.41Å; P160-D208 HydrophobicContact CB-CB 4.1Å; P160-D208 WeakPolarHBondContact CG-OD1 3.41Å
161	Y	94.6	Very high	92.1	Very high	42 Å²	42	24.5 Å²	24.5	17%	0.165	12%	0.122	C	C	.	.	H	α-helix	trans	-68.1	-34.8	177.6	71.7	-94.7	0	0	0	112.3	H159 S165 R213	H159-Y161 VanDerWaalsContact C-N 3.26Å; H159-Y161 HydrophobicContact CB-CD1 3.68Å; H159-Y161 HydrophobicContact CB-CE1 3.32Å; H159-Y161 HydrophobicContact CB-CG 4.46Å; H159-Y161 AromaticContact CD2-CE1 3.82Å; H159-Y161 AromaticContact CD2-CZ 3.96Å; H159-Y161 PolarHBondContact CD2-OH 3.45Å; H159-Y161 AromaticContact CG-CE1 3.59Å; H159-Y161 PolarHBondContact O-N 2.9Å; Y161-S165 WeakPolarHBondContact O-CB 3.31Å; Y161-S165 PolarHBondContact O-N 3.25Å; Y161-R213 HydrophobicContact CD2-CB 4.13Å; Y161-R213 HydrophobicContact CG-CB 4.14Å; Y161-R213 VanDerWaalsContact CZ-CZ 3.43Å; Y161-R213 PolarHBondContact OH-NH1 2.93Å
162	E	95.3	Very high	91.3	Very high	74 Å²	74	27 Å²	27	35%	0.346	14%	0.135	S	C	.	.	H	α-helix	trans	-72.2	-41	175.9	-62.5	-179.5	-177.5	0	0	110.9	I158 H159 S165 K166	I158-E162 HydrophobicContact CD1-CB 4.02Å; I158-E162 HydrophobicContact CG1-CB 3.77Å; H159-E162 HydrophobicContact CB-CB 4.35Å; H159-E162 HydrophobicContact CB-CG 4.02Å; H159-E162 IonicContact CD2-OE1 3.72Å; H159-E162 WeakPolarHBondContact O-CB 3.4Å; H159-E162 PolarHBondContact O-N 2.96Å; E162-S165 WeakPolarHBondContact O-CB 3.25Å; E162-S165 PolarHBondContact O-N 3.45Å; E162-K166 PolarHBondContact O-N 3.19Å
163	L	96.5	Very high	90.7	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-59.4	-48	173.6	177.9	59.3	0	0	0	110.8	I131 L134 F150 L151 I158 H159 P160 S165 K166 V167 W201	I131-L163 HydrophobicContact CB-CD1 4.47Å; I131-L163 HydrophobicContact CD1-CD1 3.91Å; I131-L163 HydrophobicContact CG1-CD1 3.65Å; I131-L163 HydrophobicContact CG2-CD1 4.13Å; L134-L163 HydrophobicContact CD2-CD1 4.47Å; L134-L163 HydrophobicContact CD2-CD2 4.47Å; F150-L163 HydrophobicContact CE1-CD1 3.93Å; F150-L163 HydrophobicContact CE1-CD2 4.02Å; F150-L163 HydrophobicContact CZ-CD1 4.36Å; L151-L163 HydrophobicContact CD2-CD2 4Å; I158-L163 HydrophobicContact CD1-CB 4.19Å; I158-L163 HydrophobicContact CG1-CB 4.34Å; I158-L163 HydrophobicContact CG2-CB 4.1Å; H159-L163 PolarHBondContact O-N 3.42Å; P160-L163 PolarHBondContact O-N 2.84Å; L163-S165 VanDerWaalsContact C-N 3.3Å; L163-S165 PolarHBondContact O-N 3.47Å; L163-K166 PolarHBondContact O-N 3.01Å; L163-K166 VanDerWaalsContact O-N 3.17Å; L163-V167 HydrophobicContact CD1-CG2 4.34Å; L163-V167 WeakPolarHBondContact O-CG2 3.44Å; L163-V167 PolarHBondContact O-N 3.43Å; L163-W201 HydrophobicContact CB-CH2 4.12Å; L163-W201 HydrophobicContact CD2-CH2 3.74Å; L163-W201 HydrophobicContact CD2-CZ2 4.08Å; L163-W201 HydrophobicContact CG-CH2 3.7Å; L163-W201 HydrophobicContact CG-CZ2 4.45Å; L163-W201 HydrophobicContact CG-CZ3 4.46Å
164	M	96.2	Very high	89.9	Confident	0 Å²	0	33.7 Å²	33.7	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-59.9	-42.1	176.1	179.9	62	75	0	0	111.1	P160 K166 V167 C168 L198 W201 F209 M214	P160-M164 WeakPolarHBondContact O-CB 3.41Å; P160-M164 PolarHBondContact O-N 2.92Å; M164-K166 PolarHBondContact O-N 2.96Å; M164-V167 PolarHBondContact O-N 3.25Å; M164-C168 WeakPolarHBondContact O-CB 3.49Å; M164-C168 PolarHBondContact O-N 3Å; M164-C168 PolarHBondContact O-SG 3.32Å; M164-L198 HydrophobicContact CE-CD2 3.75Å; M164-L198 HydrophobicContact SD-CD2 3.95Å; M164-W201 HydrophobicContact CB-CH2 3.97Å; M164-W201 HydrophobicContact CB-CZ3 4.29Å; M164-W201 HydrophobicContact CE-CD2 3.98Å; M164-W201 HydrophobicContact CE-CE3 3.44Å; M164-W201 VanDerWaalsContact CE-CE3 3.44Å; M164-W201 HydrophobicContact CE-CH2 4.04Å; M164-W201 HydrophobicContact CE-CZ3 3.47Å; M164-W201 VanDerWaalsContact CE-CZ3 3.47Å; M164-W201 HydrophobicContact SD-CZ3 4.1Å; M164-F209 HydrophobicContact CE-CE1 4.22Å; M164-F209 HydrophobicContact CE-CZ 4.25Å; M164-M214 HydrophobicContact CB-CE 4.05Å; M164-M214 HydrophobicContact CB-SD 3.47Å; M164-M214 WeakPolarHBondContact CB-SD 3.34Å; M164-M214 HydrophobicContact CE-CE 3.43Å; M164-M214 VanDerWaalsContact CE-CE 3.43Å; M164-M214 HydrophobicContact CE-SD 4.22Å; M164-M214 HydrophobicContact CG-CE 4.33Å; M164-M214 HydrophobicContact CG-SD 3.9Å
165	S	94.6	Very high	88.7	Confident	65 Å²	65	36.8 Å²	36.8	46%	0.455	18%	0.179	S	C	.	.	H	α-helix	trans	-60.7	-41.6	175.4	-169.9	0	0	0	0	112.7	Y161 E162 L163 C168 H169	Y161-S165 WeakPolarHBondContact O-CB 3.31Å; Y161-S165 PolarHBondContact O-N 3.25Å; E162-S165 WeakPolarHBondContact O-CB 3.25Å; E162-S165 PolarHBondContact O-N 3.45Å; L163-S165 VanDerWaalsContact C-N 3.3Å; L163-S165 PolarHBondContact O-N 3.47Å; S165-C168 PolarHBondContact O-N 3.1Å; S165-H169 PolarHBondContact O-N 3.17Å
166	K	94.8	Very high	87.6	Confident	86 Å²	86	46.5 Å²	46.5	37%	0.374	22%	0.216	S	C	.	.	H	α-helix	trans	-65.9	-42.4	174.6	-74.2	178.4	-179.8	-95.4	0	111.8	I131 I158 E162 L163 M164 C168 H169 L170	I131-K166 HydrophobicContact CD1-CD 3.64Å; I131-K166 HydrophobicContact CG2-CB 4.24Å; I158-K166 HydrophobicContact CD1-CD 3.7Å; E162-K166 PolarHBondContact O-N 3.19Å; L163-K166 PolarHBondContact O-N 3.01Å; L163-K166 VanDerWaalsContact O-N 3.17Å; M164-K166 PolarHBondContact O-N 2.96Å; K166-C168 VanDerWaalsContact C-N 3.34Å; K166-C168 PolarHBondContact O-N 3.18Å; K166-H169 PolarHBondContact O-N 3.41Å; K166-L170 WeakPolarHBondContact O-CG 3.27Å; K166-L170 PolarHBondContact O-N 3.17Å
167	V	93.9	Very high	86.3	Confident	1 Å²	1	51.4 Å²	51.4	1%	0.006	24%	0.242	C	C	.	.	H	α-helix	trans	-59.6	-45.2	174.1	168.9	0	0	0	0	110.7	L134 V135 L163 M164 H169 L170 C171 L197	L134-V167 HydrophobicContact CD2-CG2 4.03Å; V135-V167 HydrophobicContact CG2-CB 4.37Å; V135-V167 HydrophobicContact CG2-CG1 4.21Å; V135-V167 HydrophobicContact CG2-CG2 4.07Å; L163-V167 HydrophobicContact CD1-CG2 4.34Å; L163-V167 WeakPolarHBondContact O-CG2 3.44Å; L163-V167 PolarHBondContact O-N 3.43Å; M164-V167 PolarHBondContact O-N 3.25Å; V167-H169 VanDerWaalsContact C-N 3.34Å; V167-H169 PolarHBondContact O-N 2.92Å; V167-L170 PolarHBondContact O-N 3.1Å; V167-C171 WeakPolarHBondContact O-CB 3.34Å; V167-C171 PolarHBondContact O-N 3.45Å; V167-C171 PolarHBondContact O-SG 3.43Å; V167-L197 HydrophobicContact CG1-CD2 4.39Å
168	C	90.6	Very high	84.6	Confident	12 Å²	12	51.5 Å²	51.5	8%	0.081	25%	0.247	C	C	.	.	H	α-helix	trans	-58.1	-46.7	174.4	-69.6	0	0	0	0	111.3	M164 S165 K166 C171 M172	M164-C168 WeakPolarHBondContact O-CB 3.49Å; M164-C168 PolarHBondContact O-N 3Å; M164-C168 PolarHBondContact O-SG 3.32Å; S165-C168 PolarHBondContact O-N 3.1Å; K166-C168 VanDerWaalsContact C-N 3.34Å; K166-C168 PolarHBondContact O-N 3.18Å; C168-C171 WeakPolarHBondContact O-CB 3.05Å; C168-C171 PolarHBondContact O-N 2.98Å; C168-M172 VanDerWaalsContact O-CG 3.28Å; C168-M172 WeakPolarHBondContact O-CG 3.42Å; C168-M172 PolarHBondContact O-N 3.24Å
169	H	90.4	Very high	83.3	Confident	100 Å²	100	56.6 Å²	56.6	46%	0.463	27%	0.274	S	S	.	.	H	α-helix	trans	-61.4	-47.4	179.7	-175.4	-129.6	0	0	0	112.3	S165 K166 V167 C171 M172 E173	S165-H169 PolarHBondContact O-N 3.17Å; K166-H169 PolarHBondContact O-N 3.41Å; V167-H169 VanDerWaalsContact C-N 3.34Å; V167-H169 PolarHBondContact O-N 2.92Å; H169-C171 VanDerWaalsContact C-N 3.34Å; H169-C171 PolarHBondContact O-N 3.42Å; H169-M172 CarbonylContact O-C 3.57Å; H169-M172 WeakPolarHBondContact O-CA 3.45Å; H169-M172 WeakPolarHBondContact O-CB 3.32Å; H169-M172 PolarHBondContact O-N 3.47Å; H169-E173 VanDerWaalsContact CE1-CD 3.43Å; H169-E173 IonicContact CE1-OE1 3.65Å; H169-E173 PolarHBondContact CE1-OE1 2.64Å; H169-E173 IonicContact ND1-OE1 2.74Å; H169-E173 IonicContact NE2-OE1 3.9Å; H169-E173 PolarHBondContact NE2-OE1 3.12Å; H169-E173 PolarHBondContact O-N 3.21Å
170	L	89.8	Confident	82	Confident	16 Å²	16	60.1 Å²	60.1	8%	0.084	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-40	177.6	-69.9	177.5	0	0	0	112.1	I131 H132 V135 K166 V167 M172 E173 Q174	I131-L170 HydrophobicContact CG2-CD1 3.79Å; H132-L170 WeakPolarHBondContact CE1-CD2 3.49Å; V135-L170 HydrophobicContact CG1-CB 4.33Å; V135-L170 HydrophobicContact CG2-CB 4.04Å; V135-L170 HydrophobicContact CG2-CD1 3.79Å; K166-L170 WeakPolarHBondContact O-CG 3.27Å; K166-L170 PolarHBondContact O-N 3.17Å; V167-L170 PolarHBondContact O-N 3.1Å; L170-M172 PolarHBondContact O-N 3.27Å; L170-E173 PolarHBondContact O-N 2.77Å; L170-Q174 VanDerWaalsContact O-CG 3.32Å; L170-Q174 WeakPolarHBondContact O-CG 3.46Å; L170-Q174 PolarHBondContact O-N 3.41Å; L170-Q174 VanDerWaalsContact O-N 3.08Å
171	C	86	Confident	80.5	Confident	2 Å²	2	66.9 Å²	66.9	1%	0.014	33%	0.33	C	S	.	.	H	α-helix	trans	-58.9	-34.9	172	-67.6	0	0	0	0	111.9	V167 C168 H169 Q175 I194 L221	V167-C171 WeakPolarHBondContact O-CB 3.34Å; V167-C171 PolarHBondContact O-N 3.45Å; V167-C171 PolarHBondContact O-SG 3.43Å; C168-C171 WeakPolarHBondContact O-CB 3.05Å; C168-C171 PolarHBondContact O-N 2.98Å; H169-C171 VanDerWaalsContact C-N 3.34Å; H169-C171 PolarHBondContact O-N 3.42Å; C171-Q175 VanDerWaalsContact O-CG 3.29Å; C171-Q175 WeakPolarHBondContact O-CG 3.4Å; C171-Q175 PolarHBondContact O-NE2 3Å; C171-I194 HydrophobicContact CB-CD1 4.19Å; C171-L221 HydrophobicContact CB-CD1 4.29Å
172	M	80.1	Confident	78.9	Confident	54 Å²	54	66.8 Å²	66.8	27%	0.266	34%	0.338	S	S	.	.	H	α-helix	trans	-77.1	-39.9	178	-68	171.7	71.7	0	0	112.6	C168 H169 L170 Q174 Q175 R176	C168-M172 VanDerWaalsContact O-CG 3.28Å; C168-M172 WeakPolarHBondContact O-CG 3.42Å; C168-M172 PolarHBondContact O-N 3.24Å; H169-M172 CarbonylContact O-C 3.57Å; H169-M172 WeakPolarHBondContact O-CA 3.45Å; H169-M172 WeakPolarHBondContact O-CB 3.32Å; H169-M172 PolarHBondContact O-N 3.47Å; L170-M172 PolarHBondContact O-N 3.27Å; M172-Q174 VanDerWaalsContact C-N 3.33Å; M172-Q174 PolarHBondContact O-N 2.97Å; M172-Q175 WeakPolarHBondContact O-CB 3.44Å; M172-Q175 PolarHBondContact O-N 3.43Å; M172-Q175 VanDerWaalsContact O-N 3.09Å; M172-R176 PolarHBondContact O-N 3.29Å
173	E	81.3	Confident	77.5	Confident	85 Å²	85	65.2 Å²	65.2	40%	0.397	33%	0.332	S	S	.	.	H	α-helix	trans	-62.1	-42	176.7	-74.4	-174.2	149.5	0	0	111.6	H169 L170 Q175 R176	H169-E173 VanDerWaalsContact CE1-CD 3.43Å; H169-E173 IonicContact CE1-OE1 3.65Å; H169-E173 PolarHBondContact CE1-OE1 2.64Å; H169-E173 IonicContact ND1-OE1 2.74Å; H169-E173 IonicContact NE2-OE1 3.9Å; H169-E173 PolarHBondContact NE2-OE1 3.12Å; H169-E173 PolarHBondContact O-N 3.21Å; L170-E173 PolarHBondContact O-N 2.77Å; E173-Q175 PolarHBondContact O-N 3.06Å; E173-R176 PolarHBondContact O-N 3.4Å
174	Q	74.4	Confident	76.2	Confident	59 Å²	59	72 Å²	72	28%	0.276	36%	0.361	S	S	.	.	H	α-helix	trans	-57.5	-22.3	174.2	-71.9	178.5	5.7	0	0	113.4	P136 L170 M172	P136-Q174 PolarHBondContact O-OE1 3.33Å; L170-Q174 VanDerWaalsContact O-CG 3.32Å; L170-Q174 WeakPolarHBondContact O-CG 3.46Å; L170-Q174 PolarHBondContact O-N 3.41Å; L170-Q174 VanDerWaalsContact O-N 3.08Å; M172-Q174 VanDerWaalsContact C-N 3.33Å; M172-Q174 PolarHBondContact O-N 2.97Å
175	Q	68.2	Low	75	Confident	68 Å²	68	77 Å²	77	32%	0.318	39%	0.388	S	S	.	.	H	α-helix	trans	-87.7	-17	178.5	-64.7	166	12.6	0	0	113.6	C171 M172 E173	C171-Q175 VanDerWaalsContact O-CG 3.29Å; C171-Q175 WeakPolarHBondContact O-CG 3.4Å; C171-Q175 PolarHBondContact O-NE2 3Å; M172-Q175 WeakPolarHBondContact O-CB 3.44Å; M172-Q175 PolarHBondContact O-N 3.43Å; M172-Q175 VanDerWaalsContact O-N 3.09Å; E173-Q175 PolarHBondContact O-N 3.06Å
176	R	66	Low	73.9	Confident	209 Å²	209	79.7 Å²	79.7	79%	0.789	39%	0.388	S	S	*	.	H	α-helix	trans	-95.7	-9.8	-174.1	-65.4	177	105.3	167.5	4.7	113.8	M172 E173 S178	M172-R176 PolarHBondContact O-N 3.29Å; E173-R176 PolarHBondContact O-N 3.4Å; R176-S178 VanDerWaalsContact C-N 3.34Å; R176-S178 PolarHBondContact O-N 3.24Å
177	L	58.4	Low	73	Confident	139 Å²	139	78.4 Å²	78.4	73%	0.728	38%	0.384	S	S	*	.	S	Bend	trans	-88.7	15.4	-170.6	-69.8	164.7	0	0	0	113.9
178	S	52.2	Low	72.2	Confident	38 Å²	38	86 Å²	86	27%	0.266	41%	0.413	S	S	.	.	S	Bend	trans	-150.1	170.2	-174.2	-78.2	0	0	0	0	115.2	R176 D183 R186	R176-S178 VanDerWaalsContact C-N 3.34Å; R176-S178 PolarHBondContact O-N 3.24Å; S178-D183 WeakPolarHBondContact CA-OD1 3.31Å; S178-D183 WeakPolarHBondContact CB-OD1 3.24Å; S178-D183 VanDerWaalsContact O-OD2 3.13Å; S178-R186 PolarHBondContact OG-NH1 3.28Å
179	D	61.8	Low	71.9	Confident	116 Å²	116	90.8 Å²	90.8	62%	0.62	43%	0.433	S	S	*	.			trans	-69	141.7	-178.5	-165.3	25.2	0	0	0	110.6	Q181 A182 D183	D179-Q181 PolarHBondContact O-N 3.17Å; D179-A182 HydrophobicContact CB-CB 4.4Å; D179-A182 WeakPolarHBondContact O-CA 3.33Å; D179-A182 WeakPolarHBondContact O-CB 3.46Å; D179-A182 PolarHBondContact O-N 3.28Å; D179-D183 PolarHBondContact O-N 3.41Å
180	P	63.4	Low	71.7	Confident	92 Å²	92	86.7 Å²	86.7	60%	0.597	41%	0.414	S	S	*	.	H	α-helix	trans	-58.7	-21.2	-166.9	-27.3	36.1	0	0	0	116.4
181	Q	61.2	Low	71.6	Confident	146 Å²	146	86.1 Å²	86.1	68%	0.682	41%	0.412	S	S	*	.	H	α-helix	trans	-85.6	-36.4	174.2	-70.5	-70.5	-15.6	0	0	112.5	D179 D183	D179-Q181 PolarHBondContact O-N 3.17Å; Q181-D183 VanDerWaalsContact C-N 3.3Å
182	A	61.4	Low	71.7	Confident	40 Å²	40	88.6 Å²	88.6	33%	0.331	43%	0.428	S	S	.	.	H	α-helix	trans	-68.1	-33.1	174.1	0	0	0	0	0	111.3	D179 K184 L185 R186	D179-A182 HydrophobicContact CB-CB 4.4Å; D179-A182 WeakPolarHBondContact O-CA 3.33Å; D179-A182 WeakPolarHBondContact O-CB 3.46Å; D179-A182 PolarHBondContact O-N 3.28Å; A182-K184 VanDerWaalsContact C-N 3.35Å; A182-K184 PolarHBondContact O-N 2.78Å; A182-L185 PolarHBondContact O-N 3.32Å; A182-R186 WeakPolarHBondContact O-CG 3.1Å; A182-R186 PolarHBondContact O-N 3.02Å
183	D	66.1	Low	72.3	Confident	41 Å²	41	88 Å²	88	22%	0.219	42%	0.424	C	S	.	.	H	α-helix	trans	-60.5	-40.5	177	-68.2	-18.9	0	0	0	112.7	S178 D179 Q181 R186 L187	S178-D183 WeakPolarHBondContact CA-OD1 3.31Å; S178-D183 WeakPolarHBondContact CB-OD1 3.24Å; S178-D183 VanDerWaalsContact O-OD2 3.13Å; D179-D183 PolarHBondContact O-N 3.41Å; Q181-D183 VanDerWaalsContact C-N 3.3Å; D183-R186 PolarHBondContact O-N 3.36Å; D183-L187 WeakPolarHBondContact O-CB 3.47Å; D183-L187 PolarHBondContact O-N 2.93Å
184	K	68.8	Low	72.9	Confident	144 Å²	144	84.1 Å²	84.1	63%	0.626	41%	0.406	S	S	*	.	H	α-helix	trans	-65	-41.3	178.6	-74.8	-175.6	179.3	178.7	0	112.6	A182 R188	A182-K184 VanDerWaalsContact C-N 3.35Å; A182-K184 PolarHBondContact O-N 2.78Å; K184-R188 PolarHBondContact O-N 3.38Å; K184-R188 VanDerWaalsContact O-N 3.11Å
185	L	72	Confident	73.7	Confident	105 Å²	105	82 Å²	82	55%	0.55	40%	0.396	S	S	.	.	H	α-helix	trans	-70.8	-41.4	179.2	-178.2	62.8	0	0	0	111.5	A182 R188 K189	A182-L185 PolarHBondContact O-N 3.32Å; L185-R188 PolarHBondContact O-N 3.5Å; L185-K189 PolarHBondContact O-N 3.18Å
186	R	72.1	Confident	75	Confident	120 Å²	120	82.2 Å²	82.2	45%	0.453	40%	0.397	S	S	.	.	H	α-helix	trans	-63.4	-46.8	175.3	-73	-177.1	176.3	-170.2	1.7	111.4	V138 S178 A182 D183 R188 K189 T190	V138-R186 HydrophobicContact CG2-CB 4.24Å; V138-R186 HydrophobicContact CG2-CG 4.14Å; S178-R186 PolarHBondContact OG-NH1 3.28Å; A182-R186 WeakPolarHBondContact O-CG 3.1Å; A182-R186 PolarHBondContact O-N 3.02Å; D183-R186 PolarHBondContact O-N 3.36Å; R186-R188 VanDerWaalsContact C-N 3.28Å; R186-R188 PolarHBondContact O-N 3.11Å; R186-K189 PolarHBondContact O-N 2.86Å; R186-T190 PolarHBondContact O-N 3.32Å; R186-T190 PolarHBondContact O-OG1 3.19Å; R186-T190 VanDerWaalsContact O-OG1 3.11Å
187	L	74.2	Confident	76.5	Confident	59 Å²	59	72.3 Å²	72.3	31%	0.309	36%	0.36	S	S	.	.	H	α-helix	trans	-55.4	-45.4	176	-176.7	64	0	0	0	111.1	D183 K189 T190 T191	D183-L187 WeakPolarHBondContact O-CB 3.47Å; D183-L187 PolarHBondContact O-N 2.93Å; L187-K189 VanDerWaalsContact C-N 3.25Å; L187-K189 PolarHBondContact O-N 3.49Å; L187-T190 PolarHBondContact O-N 3.3Å; L187-T191 VanDerWaalsContact O-CB 3.23Å; L187-T191 WeakPolarHBondContact O-CB 3.45Å; L187-T191 PolarHBondContact O-N 2.74Å; L187-T191 PolarHBondContact O-OG1 3.25Å
188	R	78.1	Confident	78.3	Confident	162 Å²	162	65.8 Å²	65.8	61%	0.611	33%	0.325	S	S	*	.	H	α-helix	trans	-61	-32.2	178.3	-167	177.1	-178.3	-170.3	-0.2	113.3	K184 L185 R186 P192 Y232	K184-R188 PolarHBondContact O-N 3.38Å; K184-R188 VanDerWaalsContact O-N 3.11Å; L185-R188 PolarHBondContact O-N 3.5Å; R186-R188 VanDerWaalsContact C-N 3.28Å; R186-R188 PolarHBondContact O-N 3.11Å; R188-P192 WeakPolarHBondContact O-CD 3.35Å; R188-Y232 PolarHBondContact O-OH 3.21Å; R188-Y232 VanDerWaalsContact O-OH 3.09Å
189	K	83.7	Confident	80.3	Confident	112 Å²	112	65.8 Å²	65.8	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-82.1	-35.3	178.2	-70.1	-175.6	177.2	-173	0	113.1	V138 L185 R186 L187 P192	V138-K189 HydrophobicContact CG1-CB 4.19Å; V138-K189 HydrophobicContact CG1-CD 3.71Å; L185-K189 PolarHBondContact O-N 3.18Å; R186-K189 PolarHBondContact O-N 2.86Å; L187-K189 VanDerWaalsContact C-N 3.25Å; L187-K189 PolarHBondContact O-N 3.49Å; K189-P192 WeakPolarHBondContact O-CG 3.38Å
190	T	86	Confident	81.9	Confident	13 Å²	13	61.5 Å²	61.5	8%	0.08	30%	0.3	C	S	.	.	H	α-helix	trans	-87.7	-32.4	-176	-46.9	0	0	0	0	112.8	R186 L187 K193 I194	R186-T190 PolarHBondContact O-N 3.32Å; R186-T190 PolarHBondContact O-OG1 3.19Å; R186-T190 VanDerWaalsContact O-OG1 3.11Å; L187-T190 PolarHBondContact O-N 3.3Å; T190-K193 WeakPolarHBondContact O-CB 3.33Å; T190-K193 PolarHBondContact O-N 3.39Å; T190-I194 HydrophobicContact CG2-CD1 3.84Å; T190-I194 HydrophobicContact CG2-CG1 4.06Å; T190-I194 PolarHBondContact O-N 2.96Å
191	T	87.6	Confident	83.5	Confident	4 Å²	4	57.2 Å²	57.2	3%	0.025	27%	0.272	C	S	.	.	H	α-helix	trans	-49.2	-49.6	177.5	-71.1	0	0	0	0	114.8	L187 K193 I194 L195 L225 Y232	L187-T191 VanDerWaalsContact O-CB 3.23Å; L187-T191 WeakPolarHBondContact O-CB 3.45Å; L187-T191 PolarHBondContact O-N 2.74Å; L187-T191 PolarHBondContact O-OG1 3.25Å; T191-K193 PolarHBondContact O-N 3.12Å; T191-I194 PolarHBondContact O-N 3.22Å; T191-L195 WeakPolarHBondContact O-CB 3.25Å; T191-L195 PolarHBondContact O-N 3.42Å; T191-L225 HydrophobicContact CG2-CB 4.3Å; T191-L225 HydrophobicContact CG2-CD2 3.99Å; T191-Y232 HydrophobicContact CG2-CD1 3.82Å; T191-Y232 HydrophobicContact CG2-CD2 3.55Å; T191-Y232 HydrophobicContact CG2-CE1 4.04Å; T191-Y232 HydrophobicContact CG2-CE2 3.8Å; T191-Y232 HydrophobicContact CG2-CG 3.6Å
192	P	89.9	Confident	85.2	Confident	54 Å²	54	50.5 Å²	50.5	35%	0.351	24%	0.241	S	C	.	.	H	α-helix	trans	-62.6	-32.8	179.5	23.1	-33.6	0	0	0	112.6	R188 K189 Q196 Y232	R188-P192 WeakPolarHBondContact O-CD 3.35Å; K189-P192 WeakPolarHBondContact O-CG 3.38Å; P192-Q196 WeakPolarHBondContact O-CB 3.49Å; P192-Q196 PolarHBondContact O-N 3.41Å; P192-Y232 HydrophobicContact CB-CE1 4.27Å
193	K	92.5	Very high	86.7	Confident	42 Å²	42	54 Å²	54	18%	0.183	25%	0.251	C	S	.	.	H	α-helix	trans	-71.7	-43.9	177.2	-66.4	-176.6	-178.3	-175.1	0	112.2	P136 T137 V138 Y140 Y141 T190 T191 L195 Q196 L197	P136-K193 HydrophobicContact CB-CB 3.6Å; P136-K193 HydrophobicContact CB-CD 4.13Å; P136-K193 HydrophobicContact CG-CB 4.14Å; T137-K193 VanDerWaalsContact O-CD 3.27Å; T137-K193 WeakPolarHBondContact O-CD 3.21Å; T137-K193 PolarHBondContact O-NZ 3.35Å; V138-K193 VanDerWaalsContact C-NZ 3.28Å; V138-K193 PolarHBondContact O-NZ 3.15Å; Y140-K193 PolarHBondContact O-NZ 2.97Å; Y140-K193 VanDerWaalsContact O-NZ 3.11Å; Y141-K193 HydrophobicContact CD2-CB 3.91Å; Y141-K193 HydrophobicContact CD2-CD 4.48Å; Y141-K193 HydrophobicContact CD2-CG 4.19Å; Y141-K193 HydrophobicContact CE2-CB 4.41Å; Y141-K193 WeakPolarHBondContact CE2-O 3.41Å; T190-K193 WeakPolarHBondContact O-CB 3.33Å; T190-K193 PolarHBondContact O-N 3.39Å; T191-K193 PolarHBondContact O-N 3.12Å; K193-L195 VanDerWaalsContact C-N 3.3Å; K193-L195 PolarHBondContact O-N 3.2Å; K193-Q196 WeakPolarHBondContact O-CB 3.24Å; K193-Q196 PolarHBondContact O-N 3.4Å; K193-L197 PolarHBondContact O-N 2.87Å
194	I	92.4	Very high	88.1	Confident	4 Å²	4	54 Å²	54	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-61.7	-43.7	174.6	-63.5	166.6	0	0	0	109.7	C171 T190 T191 Q196 L197 L198 L221 L225	C171-I194 HydrophobicContact CB-CD1 4.19Å; T190-I194 HydrophobicContact CG2-CD1 3.84Å; T190-I194 HydrophobicContact CG2-CG1 4.06Å; T190-I194 PolarHBondContact O-N 2.96Å; T191-I194 PolarHBondContact O-N 3.22Å; I194-Q196 VanDerWaalsContact C-N 3.3Å; I194-Q196 PolarHBondContact O-N 3.36Å; I194-L197 PolarHBondContact O-N 2.92Å; I194-L198 HydrophobicContact CG2-CD1 4.27Å; I194-L198 HydrophobicContact CG2-CG 4.42Å; I194-L198 WeakPolarHBondContact O-CG 3.44Å; I194-L198 PolarHBondContact O-N 2.74Å; I194-L221 HydrophobicContact CG2-CD2 4.07Å; I194-L221 HydrophobicContact CG2-CG 4.47Å; I194-L225 HydrophobicContact CB-CD1 4.44Å; I194-L225 HydrophobicContact CB-CD2 4.38Å; I194-L225 HydrophobicContact CD1-CD2 4.34Å; I194-L225 HydrophobicContact CG2-CD1 3.86Å; I194-L225 HydrophobicContact CG2-CD2 4.3Å
195	L	92.9	Very high	89.3	Confident	15 Å²	15	47.1 Å²	47.1	8%	0.079	22%	0.222	C	C	.	.	H	α-helix	trans	-62.4	-38.2	177	-176.1	61.4	0	0	0	112.1	T191 K193 L198 T199 A235 V236 M239	T191-L195 WeakPolarHBondContact O-CB 3.25Å; T191-L195 PolarHBondContact O-N 3.42Å; K193-L195 VanDerWaalsContact C-N 3.3Å; K193-L195 PolarHBondContact O-N 3.2Å; L195-L198 PolarHBondContact O-N 3.09Å; L195-T199 WeakPolarHBondContact O-CB 3.15Å; L195-T199 PolarHBondContact O-N 3.4Å; L195-T199 PolarHBondContact O-OG1 3.35Å; L195-A235 HydrophobicContact CD2-CB 3.47Å; L195-A235 VanDerWaalsContact CD2-CB 3.47Å; L195-V236 HydrophobicContact CD1-CG2 3.83Å; L195-M239 HydrophobicContact CD1-CE 4.16Å; L195-M239 HydrophobicContact CD1-SD 3.86Å
196	Q	94.6	Very high	90.3	Very high	72 Å²	72	42.7 Å²	42.7	34%	0.336	20%	0.2	S	C	.	.	H	α-helix	trans	-60.8	-48.1	173.4	-173.2	-174.2	-23.8	0	0	111.3	Y141 P192 K193 I194 L198 T199 E200	Y141-Q196 HydrophobicContact CE2-CB 4.07Å; Y141-Q196 HydrophobicContact CE2-CG 4.17Å; Y141-Q196 WeakPolarHBondContact OH-CG 3.38Å; Y141-Q196 PolarHBondContact OH-NE2 2.98Å; P192-Q196 WeakPolarHBondContact O-CB 3.49Å; P192-Q196 PolarHBondContact O-N 3.41Å; K193-Q196 WeakPolarHBondContact O-CB 3.24Å; K193-Q196 PolarHBondContact O-N 3.4Å; I194-Q196 VanDerWaalsContact C-N 3.3Å; I194-Q196 PolarHBondContact O-N 3.36Å; Q196-L198 VanDerWaalsContact C-N 3.35Å; Q196-L198 PolarHBondContact O-N 3.28Å; Q196-T199 WeakPolarHBondContact O-CB 2.95Å; Q196-T199 PolarHBondContact O-N 2.98Å; Q196-T199 VanDerWaalsContact O-N 3.16Å; Q196-E200 PolarHBondContact NE2-OE1 3.07Å; Q196-E200 WeakPolarHBondContact O-CG 3.25Å; Q196-E200 PolarHBondContact O-N 3.16Å
197	L	96.5	Very high	91.2	Very high	1 Å²	1	38.6 Å²	38.6	1%	0.005	18%	0.184	C	C	.	.	H	α-helix	trans	-58.6	-44.9	176.5	174.6	64.2	0	0	0	111.8	L134 P136 Y141 V147 V167 K193 I194 T199 E200 W201	L134-L197 HydrophobicContact CD1-CD1 3.96Å; L134-L197 HydrophobicContact CG-CD1 4.33Å; L134-L197 HydrophobicContact CG-CD2 4.28Å; P136-L197 HydrophobicContact CG-CB 4.37Å; P136-L197 HydrophobicContact CG-CD2 4.44Å; Y141-L197 HydrophobicContact CE2-CB 4.48Å; Y141-L197 PolarHBondContact OH-N 2.87Å; V147-L197 HydrophobicContact CG1-CD1 3.78Å; V147-L197 HydrophobicContact CG2-CD1 4.26Å; V167-L197 HydrophobicContact CG1-CD2 4.39Å; K193-L197 PolarHBondContact O-N 2.87Å; I194-L197 PolarHBondContact O-N 2.92Å; L197-T199 VanDerWaalsContact C-N 3.32Å; L197-T199 PolarHBondContact O-N 3.3Å; L197-E200 PolarHBondContact O-N 3.34Å; L197-W201 WeakPolarHBondContact O-CB 3.46Å; L197-W201 PolarHBondContact O-N 3.13Å
198	L	96.2	Very high	92	Very high	1 Å²	1	36.1 Å²	36.1	1%	0.005	17%	0.171	C	C	.	.	H	α-helix	trans	-64.4	-37.6	177.2	-65.9	177.9	0	0	0	112.1	M164 I194 L195 Q196 W201 T202 L218 L221 T222 L225 M239	M164-L198 HydrophobicContact CE-CD2 3.75Å; M164-L198 HydrophobicContact SD-CD2 3.95Å; I194-L198 HydrophobicContact CG2-CD1 4.27Å; I194-L198 HydrophobicContact CG2-CG 4.42Å; I194-L198 WeakPolarHBondContact O-CG 3.44Å; I194-L198 PolarHBondContact O-N 2.74Å; L195-L198 PolarHBondContact O-N 3.09Å; Q196-L198 VanDerWaalsContact C-N 3.35Å; Q196-L198 PolarHBondContact O-N 3.28Å; L198-W201 PolarHBondContact O-N 2.83Å; L198-T202 WeakPolarHBondContact O-CB 3.45Å; L198-T202 VanDerWaalsContact O-CG2 3.23Å; L198-T202 WeakPolarHBondContact O-CG2 3.42Å; L198-T202 PolarHBondContact O-N 3.41Å; L198-T202 PolarHBondContact O-OG1 3.44Å; L198-L218 HydrophobicContact CB-CD1 4.47Å; L198-L218 HydrophobicContact CD1-CD1 4.16Å; L198-L218 HydrophobicContact CD2-CD1 4.01Å; L198-L218 HydrophobicContact CG-CD1 4.45Å; L198-L221 HydrophobicContact CD1-CD2 3.83Å; L198-L221 HydrophobicContact CD1-CG 4.13Å; L198-L221 HydrophobicContact CD2-CD2 4Å; L198-L221 HydrophobicContact CG-CD2 4.33Å; L198-T222 HydrophobicContact CD1-CG2 4.13Å; L198-L225 HydrophobicContact CD1-CD1 3.93Å; L198-M239 HydrophobicContact CB-CE 4.21Å; L198-M239 HydrophobicContact CB-SD 3.65Å
199	T	95.6	Very high	92.8	Very high	38 Å²	38	28.5 Å²	28.5	23%	0.233	14%	0.143	C	C	.	.	H	α-helix	trans	-65.1	-49	176	-56.4	0	0	0	0	110	L195 Q196 L197 W201 T202 E203	L195-T199 WeakPolarHBondContact O-CB 3.15Å; L195-T199 PolarHBondContact O-N 3.4Å; L195-T199 PolarHBondContact O-OG1 3.35Å; Q196-T199 WeakPolarHBondContact O-CB 2.95Å; Q196-T199 PolarHBondContact O-N 2.98Å; Q196-T199 VanDerWaalsContact O-N 3.16Å; L197-T199 VanDerWaalsContact C-N 3.32Å; L197-T199 PolarHBondContact O-N 3.3Å; T199-W201 VanDerWaalsContact C-N 3.31Å; T199-W201 PolarHBondContact O-N 3.39Å; T199-T202 WeakPolarHBondContact CA-OG1 3.43Å; T199-T202 PolarHBondContact O-N 2.86Å; T199-T202 PolarHBondContact O-OG1 3.41Å; T199-T202 VanDerWaalsContact O-OG1 3.04Å; T199-E203 HydrophobicContact CG2-CG 4.32Å; T199-E203 WeakPolarHBondContact O-CB 3.38Å; T199-E203 WeakPolarHBondContact O-CG 3.33Å; T199-E203 PolarHBondContact O-N 3.01Å
200	E	95.7	Very high	93.2	Very high	26 Å²	26	27.6 Å²	27.6	12%	0.121	14%	0.136	C	C	.	.	H	α-helix	trans	-59.1	-40.9	177.2	-71.4	176.9	-171.5	0	0	111.5	Y141 R144 Q196 L197 T204	Y141-E200 PolarHBondContact OH-OE1 2.68Å; Y141-E200 PolarHBondContact OH-OE2 3.15Å; R144-E200 IonicContact NE-OE1 2.75Å; R144-E200 PolarHBondContact NE-OE1 3.21Å; Q196-E200 PolarHBondContact NE2-OE1 3.07Å; Q196-E200 WeakPolarHBondContact O-CG 3.25Å; Q196-E200 PolarHBondContact O-N 3.16Å; L197-E200 PolarHBondContact O-N 3.34Å; E200-T204 WeakPolarHBondContact O-CB 3.33Å; E200-T204 PolarHBondContact O-N 2.74Å; E200-T204 PolarHBondContact O-OG1 3.37Å
201	W	97.1	Very high	93.5	Very high	2 Å²	2	29.3 Å²	29.3	1%	0.008	15%	0.145	C	C	.	.	H	α-helix	trans	-67.4	-48.8	176.7	-161.2	-17.4	0	0	0	112.1	L151 P160 L163 M164 L197 L198 T199 E203 T204 F205 D208 F209 M214	L151-W201 HydrophobicContact CD1-CB 3.92Å; L151-W201 HydrophobicContact CD1-CD2 3.96Å; L151-W201 HydrophobicContact CD1-CE3 4.47Å; L151-W201 HydrophobicContact CD1-CG 3.72Å; L151-W201 HydrophobicContact CD2-CD2 3.71Å; L151-W201 HydrophobicContact CD2-CE3 3.84Å; L151-W201 HydrophobicContact CD2-CG 4.33Å; L151-W201 HydrophobicContact CD2-CH2 4Å; L151-W201 HydrophobicContact CD2-CZ2 3.83Å; L151-W201 HydrophobicContact CD2-CZ3 4Å; L151-W201 HydrophobicContact CG-CD2 4.5Å; P160-W201 HydrophobicContact CB-CZ2 4.41Å; L163-W201 HydrophobicContact CB-CH2 4.12Å; L163-W201 HydrophobicContact CD2-CH2 3.74Å; L163-W201 HydrophobicContact CD2-CZ2 4.08Å; L163-W201 HydrophobicContact CG-CH2 3.7Å; L163-W201 HydrophobicContact CG-CZ2 4.45Å; L163-W201 HydrophobicContact CG-CZ3 4.46Å; M164-W201 HydrophobicContact CB-CH2 3.97Å; M164-W201 HydrophobicContact CB-CZ3 4.29Å; M164-W201 HydrophobicContact CE-CD2 3.98Å; M164-W201 HydrophobicContact CE-CE3 3.44Å; M164-W201 VanDerWaalsContact CE-CE3 3.44Å; M164-W201 HydrophobicContact CE-CH2 4.04Å; M164-W201 HydrophobicContact CE-CZ3 3.47Å; M164-W201 VanDerWaalsContact CE-CZ3 3.47Å; M164-W201 HydrophobicContact SD-CZ3 4.1Å; L197-W201 WeakPolarHBondContact O-CB 3.46Å; L197-W201 PolarHBondContact O-N 3.13Å; L198-W201 PolarHBondContact O-N 2.83Å; T199-W201 VanDerWaalsContact C-N 3.31Å; T199-W201 PolarHBondContact O-N 3.39Å; W201-E203 VanDerWaalsContact C-N 3.3Å; W201-E203 PolarHBondContact O-N 3.46Å; W201-T204 PolarHBondContact O-N 2.74Å; W201-F205 AromaticContact CD1-CD2 3.87Å; W201-F205 PolarHBondContact O-N 3.42Å; W201-D208 PolarHBondContact NE1-OD2 3.23Å; W201-F209 HydrophobicContact CB-CZ 4.5Å; W201-F209 AromaticContact CD1-CE2 3.94Å; W201-F209 HydrophobicContact CG-CE2 4.36Å; W201-F209 HydrophobicContact CG-CZ 4.18Å; W201-M214 HydrophobicContact CD2-CE 4.07Å; W201-M214 HydrophobicContact CH2-CE 4.05Å; W201-M214 HydrophobicContact CZ2-CE 3.53Å
202	T	96.3	Very high	93.7	Very high	5 Å²	5	36.4 Å²	36.4	3%	0.031	18%	0.178	C	C	.	.	H	α-helix	trans	-65.5	-31.4	-179.5	53.4	0	0	0	0	113.2	L198 T199 F209 L218 L243	L198-T202 WeakPolarHBondContact O-CB 3.45Å; L198-T202 VanDerWaalsContact O-CG2 3.23Å; L198-T202 WeakPolarHBondContact O-CG2 3.42Å; L198-T202 PolarHBondContact O-N 3.41Å; L198-T202 PolarHBondContact O-OG1 3.44Å; T199-T202 WeakPolarHBondContact CA-OG1 3.43Å; T199-T202 PolarHBondContact O-N 2.86Å; T199-T202 PolarHBondContact O-OG1 3.41Å; T199-T202 VanDerWaalsContact O-OG1 3.04Å; T202-F209 HydrophobicContact CG2-CD1 4.3Å; T202-F209 HydrophobicContact CG2-CD2 4.24Å; T202-F209 HydrophobicContact CG2-CE1 3.7Å; T202-F209 HydrophobicContact CG2-CE2 3.64Å; T202-F209 HydrophobicContact CG2-CZ 3.33Å; T202-L218 HydrophobicContact CG2-CD2 4.2Å; T202-L243 HydrophobicContact CG2-CD1 4.36Å; T202-L243 HydrophobicContact CG2-CD2 3.86Å; T202-L243 HydrophobicContact CG2-CG 4.49Å
203	E	93.6	Very high	94	Very high	114 Å²	114	39 Å²	39	53%	0.533	18%	0.181	S	C	.	.	H	α-helix	trans	-77.6	-42.1	175.5	-71.6	-176.9	168.1	0	0	112.3	T199 W201 R246	T199-E203 HydrophobicContact CG2-CG 4.32Å; T199-E203 WeakPolarHBondContact O-CB 3.38Å; T199-E203 WeakPolarHBondContact O-CG 3.33Å; T199-E203 PolarHBondContact O-N 3.01Å; W201-E203 VanDerWaalsContact C-N 3.3Å; W201-E203 PolarHBondContact O-N 3.46Å; E203-R246 PolarHBondContact O-NH1 3.11Å
204	T	93.7	Very high	94.1	Very high	41 Å²	41	37 Å²	37	25%	0.252	17%	0.172	S	C	.	.	H	α-helix	trans	-80.2	-41	-173.7	-53.5	0	0	0	0	112.7	F148 E200 W201 P206 P310	F148-T204 HydrophobicContact CD2-CG2 3.79Å; F148-T204 HydrophobicContact CE2-CG2 3.92Å; E200-T204 WeakPolarHBondContact O-CB 3.33Å; E200-T204 PolarHBondContact O-N 2.74Å; E200-T204 PolarHBondContact O-OG1 3.37Å; W201-T204 PolarHBondContact O-N 2.74Å; T204-P206 VanDerWaalsContact C-CD 3.41Å; T204-P206 WeakPolarHBondContact O-CD 3.39Å; T204-P310 HydrophobicContact CG2-CG 4.24Å
205	F	94.6	Very high	94.2	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.18	C	C	.	.			trans	-126	60.3	-174.5	-51.5	-83	0	0	0	111.7	F148 L151 L152 W201 Y207 D208 F209 P310 E311	F148-F205 HydrophobicContact CD2-CZ 4.28Å; F148-F205 HydrophobicContact CE2-CZ 4.3Å; L151-F205 HydrophobicContact CB-CD2 4.04Å; L151-F205 HydrophobicContact CB-CE2 3.38Å; L151-F205 HydrophobicContact CB-CZ 3.97Å; L151-F205 HydrophobicContact CD1-CD2 4.19Å; L151-F205 HydrophobicContact CD1-CE2 3.99Å; L151-F205 HydrophobicContact CG-CE2 4.36Å; L152-F205 HydrophobicContact CB-CE1 4.36Å; L152-F205 HydrophobicContact CB-CZ 4.07Å; L152-F205 HydrophobicContact CD1-CE1 4.09Å; W201-F205 AromaticContact CD1-CD2 3.87Å; W201-F205 PolarHBondContact O-N 3.42Å; F205-Y207 PolarHBondContact O-N 3.22Å; F205-Y207 VanDerWaalsContact O-N 3.16Å; F205-D208 WeakPolarHBondContact CB-OD2 3.38Å; F205-D208 PolarHBondContact O-N 2.87Å; F205-F209 WeakPolarHBondContact O-CD2 3.47Å; F205-P310 HydrophobicContact CD1-CG 3.7Å; F205-P310 HydrophobicContact CE1-CB 4.08Å; F205-P310 HydrophobicContact CE1-CG 3.49Å; F205-P310 VanDerWaalsContact CE1-CG 3.49Å; F205-P310 HydrophobicContact CZ-CG 4.33Å; F205-E311 HydrophobicContact CD1-CB 4.14Å; F205-E311 WeakPolarHBondContact CD1-OE2 3.26Å; F205-E311 HydrophobicContact CE1-CB 4.5Å
206	P	93.7	Very high	94.3	Very high	11 Å²	11	45.7 Å²	45.7	7%	0.071	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-60	-30	-175.9	27.6	-37.9	0	0	0	112.7	T204 D208 F209 L243 R246 L247 L250	T204-P206 VanDerWaalsContact C-CD 3.41Å; T204-P206 WeakPolarHBondContact O-CD 3.39Å; P206-D208 VanDerWaalsContact C-N 3.28Å; P206-D208 PolarHBondContact O-N 3.11Å; P206-F209 WeakPolarHBondContact O-CB 3.04Å; P206-F209 PolarHBondContact O-N 3.13Å; P206-F209 VanDerWaalsContact O-N 3.15Å; P206-L243 HydrophobicContact CB-CD1 4.37Å; P206-R246 HydrophobicContact CB-CG 3.98Å; P206-R246 HydrophobicContact CG-CG 4.27Å; P206-L247 VanDerWaalsContact O-CD2 3.31Å; P206-L247 WeakPolarHBondContact O-CD2 3.16Å; P206-L250 HydrophobicContact CB-CD1 4.13Å; P206-L250 HydrophobicContact CG-CD1 3.97Å
207	Y	89.9	Confident	94.3	Very high	34 Å²	34	43.1 Å²	43.1	13%	0.133	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-65.9	-26.3	-178.3	-70.4	-81.8	0	0	0	113.8	F205 F209 R210 L250 Y307 E311 N338	F205-Y207 PolarHBondContact O-N 3.22Å; F205-Y207 VanDerWaalsContact O-N 3.16Å; Y207-F209 PolarHBondContact O-N 3.35Å; Y207-R210 WeakPolarHBondContact O-CB 3.04Å; Y207-R210 PolarHBondContact O-N 2.91Å; Y207-R210 VanDerWaalsContact O-N 3.09Å; Y207-L250 HydrophobicContact CD1-CD1 4.15Å; Y207-L250 HydrophobicContact CD2-CD1 4.22Å; Y207-L250 HydrophobicContact CE1-CB 4.37Å; Y207-L250 HydrophobicContact CE1-CD1 3.79Å; Y207-L250 HydrophobicContact CE1-CG 4.46Å; Y207-L250 HydrophobicContact CE2-CD1 3.9Å; Y207-L250 HydrophobicContact CE2-CD2 4.29Å; Y207-L250 HydrophobicContact CG-CD1 4.36Å; Y207-L250 WeakPolarHBondContact OH-CD2 3.43Å; Y207-Y307 PolarHBondContact OH-O 2.96Å; Y207-Y307 VanDerWaalsContact OH-O 3.09Å; Y207-E311 VanDerWaalsContact CB-OE1 3.3Å; Y207-E311 WeakPolarHBondContact CB-OE1 3.22Å; Y207-E311 WeakPolarHBondContact CD2-OE1 2.85Å; Y207-N338 PolarHBondContact OH-ND2 3.31Å
208	D	92.5	Very high	94.2	Very high	7 Å²	7	43.3 Å²	43.3	4%	0.037	20%	0.197	C	C	.	.	G	3₁₀ helix	trans	-58.8	-31.3	175	-72.1	-22.8	0	0	0	111.1	R155 P160 W201 F205 P206 R210 D211 M214	R155-D208 IonicContact CZ-OD1 3.04Å; R155-D208 IonicContact CZ-OD2 3.95Å; R155-D208 IonicContact NE-OD1 3.82Å; R155-D208 PolarHBondContact NE-OD1 3.22Å; R155-D208 IonicContact NE-OD2 3.62Å; R155-D208 IonicContact NH2-OD1 3.64Å; R155-D208 IonicContact NH2-OD2 2.91Å; R155-D208 PolarHBondContact NH2-OD2 3.49Å; P160-D208 HydrophobicContact CB-CB 4.1Å; P160-D208 WeakPolarHBondContact CG-OD1 3.41Å; W201-D208 PolarHBondContact NE1-OD2 3.23Å; F205-D208 WeakPolarHBondContact CB-OD2 3.38Å; F205-D208 PolarHBondContact O-N 2.87Å; P206-D208 VanDerWaalsContact C-N 3.28Å; P206-D208 PolarHBondContact O-N 3.11Å; D208-R210 PolarHBondContact O-N 2.83Å; D208-D211 PolarHBondContact O-N 3.3Å; D208-M214 HydrophobicContact CB-CE 4.15Å; D208-M214 HydrophobicContact CB-CG 4.45Å; D208-M214 WeakPolarHBondContact O-CB 3.25Å; D208-M214 WeakPolarHBondContact O-CG 3.47Å
209	F	94.8	Very high	94.1	Very high	3 Å²	3	49.6 Å²	49.6	1%	0.013	22%	0.224	C	C	.	.	G	3₁₀ helix	trans	-83.7	9.9	-178.5	-60.2	-87.1	0	0	0	113.8	M164 W201 T202 F205 P206 Y207 D211 M214 M215 L218 L243 L247	M164-F209 HydrophobicContact CE-CE1 4.22Å; M164-F209 HydrophobicContact CE-CZ 4.25Å; W201-F209 HydrophobicContact CB-CZ 4.5Å; W201-F209 AromaticContact CD1-CE2 3.94Å; W201-F209 HydrophobicContact CG-CE2 4.36Å; W201-F209 HydrophobicContact CG-CZ 4.18Å; T202-F209 HydrophobicContact CG2-CD1 4.3Å; T202-F209 HydrophobicContact CG2-CD2 4.24Å; T202-F209 HydrophobicContact CG2-CE1 3.7Å; T202-F209 HydrophobicContact CG2-CE2 3.64Å; T202-F209 HydrophobicContact CG2-CZ 3.33Å; F205-F209 WeakPolarHBondContact O-CD2 3.47Å; P206-F209 WeakPolarHBondContact O-CB 3.04Å; P206-F209 PolarHBondContact O-N 3.13Å; P206-F209 VanDerWaalsContact O-N 3.15Å; Y207-F209 PolarHBondContact O-N 3.35Å; F209-D211 VanDerWaalsContact C-N 3.34Å; F209-M214 HydrophobicContact CD1-CE 4.2Å; F209-M214 HydrophobicContact CD1-CG 3.79Å; F209-M214 HydrophobicContact CE1-CE 3.56Å; F209-M214 HydrophobicContact CE1-CG 4.04Å; F209-M214 HydrophobicContact CE2-CE 4.01Å; F209-M214 HydrophobicContact CG-CG 4.26Å; F209-M214 HydrophobicContact CZ-CE 3.45Å; F209-M214 VanDerWaalsContact CZ-CE 3.45Å; F209-M215 HydrophobicContact CB-CG 4.21Å; F209-M215 HydrophobicContact CB-SD 3.71Å; F209-M215 HydrophobicContact CD1-SD 3.9Å; F209-M215 HydrophobicContact CG-SD 4.28Å; F209-M215 WeakPolarHBondContact O-CG 3.45Å; F209-L218 HydrophobicContact CD1-CB 4.44Å; F209-L218 HydrophobicContact CD1-CD2 3.75Å; F209-L218 HydrophobicContact CE1-CB 4.16Å; F209-L218 HydrophobicContact CE1-CD1 4.21Å; F209-L218 HydrophobicContact CE1-CD2 3.68Å; F209-L218 HydrophobicContact CE1-CG 4.22Å; F209-L243 HydrophobicContact CB-CD1 3.94Å; F209-L243 HydrophobicContact CB-CD2 3.88Å; F209-L243 HydrophobicContact CB-CG 4.37Å; F209-L243 HydrophobicContact CD1-CD2 3.81Å; F209-L243 HydrophobicContact CD2-CD1 3.96Å; F209-L243 HydrophobicContact CD2-CD2 4.39Å; F209-L243 HydrophobicContact CE1-CD2 4.48Å; F209-L243 HydrophobicContact CG-CD1 3.99Å; F209-L243 HydrophobicContact CG-CD2 3.75Å; F209-L243 HydrophobicContact CG-CG 4.48Å; F209-L247 HydrophobicContact CB-CD1 4.3Å
210	R	90.9	Very high	93.8	Very high	92 Å²	92	52 Å²	52	35%	0.347	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-78.4	-22.4	162.5	-70	-176.8	167	-179.2	-6.6	112.1	Y207 D208 L247 E254	Y207-R210 WeakPolarHBondContact O-CB 3.04Å; Y207-R210 PolarHBondContact O-N 2.91Å; Y207-R210 VanDerWaalsContact O-N 3.09Å; D208-R210 PolarHBondContact O-N 2.83Å; R210-L247 HydrophobicContact CG-CD2 3.79Å; R210-E254 IonicContact CZ-OE1 3.78Å; R210-E254 IonicContact CZ-OE2 3.35Å; R210-E254 IonicContact NH1-OE1 2.84Å; R210-E254 PolarHBondContact NH1-OE1 2.73Å; R210-E254 IonicContact NH1-OE2 3.4Å; R210-E254 PolarHBondContact NH1-OE2 3.43Å; R210-E254 VanDerWaalsContact NH2-CD 3.29Å; R210-E254 IonicContact NH2-OE1 2.7Å; R210-E254 PolarHBondContact NH2-OE1 3.29Å; R210-E254 IonicContact NH2-OE2 3.4Å; R210-E254 PolarHBondContact NH2-OE2 3.16Å
211	D	91.7	Very high	93.5	Very high	50 Å²	50	51 Å²	51	27%	0.267	23%	0.228	S	C	.	.	S	Bend	trans	-73	127.6	174.5	-170.5	-57.2	0	0	0	110	D208 F209 R213 M214 M215	D208-D211 PolarHBondContact O-N 3.3Å; F209-D211 VanDerWaalsContact C-N 3.34Å; D211-R213 VanDerWaalsContact C-N 3.27Å; D211-R213 PolarHBondContact O-N 3.43Å; D211-R213 WeakPolarHBondContact OD1-CA 3.47Å; D211-R213 WeakPolarHBondContact OD1-CB 3.5Å; D211-R213 IonicContact OD1-CZ 3.48Å; D211-R213 PolarHBondContact OD1-N 3.21Å; D211-R213 IonicContact OD1-NE 3.46Å; D211-R213 PolarHBondContact OD1-NE 2.78Å; D211-R213 VanDerWaalsContact OD1-NE 3.13Å; D211-R213 IonicContact OD1-NH2 3.03Å; D211-R213 IonicContact OD2-CZ 3.13Å; D211-R213 IonicContact OD2-NE 3.95Å; D211-R213 PolarHBondContact OD2-NE 3.38Å; D211-R213 IonicContact OD2-NH2 4Å; D211-R213 PolarHBondContact OD2-NH2 3.43Å; D211-M214 HydrophobicContact CB-CB 4Å; D211-M214 WeakPolarHBondContact O-CB 3.43Å; D211-M214 PolarHBondContact O-N 3.06Å; D211-M214 PolarHBondContact OD1-N 2.84Å; D211-M215 PolarHBondContact O-N 2.86Å
212	E	93.1	Very high	93.2	Very high	153 Å²	153	51.4 Å²	51.4	72%	0.715	23%	0.231	S	C	*	.	H	α-helix	trans	-63.4	-32.1	-178.4	-65.1	-171.2	166.6	0	0	113	R216	E212-R216 WeakPolarHBondContact O-CB 3.13Å; E212-R216 PolarHBondContact O-N 3.47Å
213	R	95.3	Very high	92.9	Very high	109 Å²	109	57.9 Å²	57.9	41%	0.411	26%	0.26	S	S	.	.	H	α-helix	trans	-68.7	-44.9	177.5	-58.3	168	-72.5	-173.6	-2.7	109.9	Y161 D211 M215 R216 S217	Y161-R213 HydrophobicContact CD2-CB 4.13Å; Y161-R213 HydrophobicContact CG-CB 4.14Å; Y161-R213 VanDerWaalsContact CZ-CZ 3.43Å; Y161-R213 PolarHBondContact OH-NH1 2.93Å; D211-R213 VanDerWaalsContact C-N 3.27Å; D211-R213 PolarHBondContact O-N 3.43Å; D211-R213 WeakPolarHBondContact OD1-CA 3.47Å; D211-R213 WeakPolarHBondContact OD1-CB 3.5Å; D211-R213 IonicContact OD1-CZ 3.48Å; D211-R213 PolarHBondContact OD1-N 3.21Å; D211-R213 IonicContact OD1-NE 3.46Å; D211-R213 PolarHBondContact OD1-NE 2.78Å; D211-R213 VanDerWaalsContact OD1-NE 3.13Å; D211-R213 IonicContact OD1-NH2 3.03Å; D211-R213 IonicContact OD2-CZ 3.13Å; D211-R213 IonicContact OD2-NE 3.95Å; D211-R213 PolarHBondContact OD2-NE 3.38Å; D211-R213 IonicContact OD2-NH2 4Å; D211-R213 PolarHBondContact OD2-NH2 3.43Å; R213-M215 PolarHBondContact O-N 3.35Å; R213-R216 WeakPolarHBondContact O-CB 3.24Å; R213-R216 PolarHBondContact O-N 2.88Å; R213-S217 PolarHBondContact O-N 2.66Å; R213-S217 PolarHBondContact O-OG 3.47Å
214	M	94.9	Very high	92.4	Very high	0 Å²	0	57.2 Å²	57.2	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57.4	-48.8	174.2	-175.3	68.7	172.6	0	0	111.1	M164 W201 D208 F209 D211 R216 S217 L218	M164-M214 HydrophobicContact CB-CE 4.05Å; M164-M214 HydrophobicContact CB-SD 3.47Å; M164-M214 WeakPolarHBondContact CB-SD 3.34Å; M164-M214 HydrophobicContact CE-CE 3.43Å; M164-M214 VanDerWaalsContact CE-CE 3.43Å; M164-M214 HydrophobicContact CE-SD 4.22Å; M164-M214 HydrophobicContact CG-CE 4.33Å; M164-M214 HydrophobicContact CG-SD 3.9Å; W201-M214 HydrophobicContact CD2-CE 4.07Å; W201-M214 HydrophobicContact CH2-CE 4.05Å; W201-M214 HydrophobicContact CZ2-CE 3.53Å; D208-M214 HydrophobicContact CB-CE 4.15Å; D208-M214 HydrophobicContact CB-CG 4.45Å; D208-M214 WeakPolarHBondContact O-CB 3.25Å; D208-M214 WeakPolarHBondContact O-CG 3.47Å; F209-M214 HydrophobicContact CD1-CE 4.2Å; F209-M214 HydrophobicContact CD1-CG 3.79Å; F209-M214 HydrophobicContact CE1-CE 3.56Å; F209-M214 HydrophobicContact CE1-CG 4.04Å; F209-M214 HydrophobicContact CE2-CE 4.01Å; F209-M214 HydrophobicContact CG-CG 4.26Å; F209-M214 HydrophobicContact CZ-CE 3.45Å; F209-M214 VanDerWaalsContact CZ-CE 3.45Å; D211-M214 HydrophobicContact CB-CB 4Å; D211-M214 WeakPolarHBondContact O-CB 3.43Å; D211-M214 PolarHBondContact O-N 3.06Å; D211-M214 PolarHBondContact OD1-N 2.84Å; M214-R216 VanDerWaalsContact C-N 3.32Å; M214-R216 PolarHBondContact O-N 2.96Å; M214-S217 PolarHBondContact O-N 3.18Å; M214-L218 PolarHBondContact O-N 3.48Å
215	M	94.8	Very high	91.9	Very high	37 Å²	37	55.5 Å²	55.5	18%	0.182	24%	0.242	C	C	.	.	H	α-helix	trans	-64.4	-34.8	178.3	-81.1	-62.6	-73	0	0	113.3	F209 D211 R213 L218 K219 L243	F209-M215 HydrophobicContact CB-CG 4.21Å; F209-M215 HydrophobicContact CB-SD 3.71Å; F209-M215 HydrophobicContact CD1-SD 3.9Å; F209-M215 HydrophobicContact CG-SD 4.28Å; F209-M215 WeakPolarHBondContact O-CG 3.45Å; D211-M215 PolarHBondContact O-N 2.86Å; R213-M215 PolarHBondContact O-N 3.35Å; M215-L218 HydrophobicContact SD-CD2 4.17Å; M215-K219 WeakPolarHBondContact O-CB 3.47Å; M215-K219 VanDerWaalsContact O-CG 3.29Å; M215-K219 WeakPolarHBondContact O-CG 3.49Å; M215-K219 PolarHBondContact O-N 3.38Å; M215-L243 HydrophobicContact CE-CD2 4.43Å; M215-L243 HydrophobicContact SD-CD2 3.85Å
216	R	94.7	Very high	91.3	Very high	163 Å²	163	56.6 Å²	56.6	62%	0.615	25%	0.251	S	S	*	.	H	α-helix	trans	-65.3	-48	175.3	-170.1	-174.9	-58.9	151.8	3.4	111	E212 R213 M214 L218 K219 E220	E212-R216 WeakPolarHBondContact O-CB 3.13Å; E212-R216 PolarHBondContact O-N 3.47Å; R213-R216 WeakPolarHBondContact O-CB 3.24Å; R213-R216 PolarHBondContact O-N 2.88Å; M214-R216 VanDerWaalsContact C-N 3.32Å; M214-R216 PolarHBondContact O-N 2.96Å; R216-L218 VanDerWaalsContact C-N 3.34Å; R216-L218 PolarHBondContact O-N 3.41Å; R216-K219 PolarHBondContact O-N 3.37Å; R216-E220 PolarHBondContact O-N 2.64Å
217	S	94.4	Very high	90.4	Very high	19 Å²	19	60 Å²	60	13%	0.133	28%	0.276	C	S	.	.	H	α-helix	trans	-61.9	-40.9	177.6	-60.7	0	0	0	0	112	R213 M214 E220 L221	R213-S217 PolarHBondContact O-N 2.66Å; R213-S217 PolarHBondContact O-OG 3.47Å; M214-S217 PolarHBondContact O-N 3.18Å; S217-E220 PolarHBondContact O-N 2.84Å; S217-L221 PolarHBondContact O-N 3.26Å
218	L	95	Very high	89.2	Confident	4 Å²	4	62.4 Å²	62.4	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-59.3	-48.1	173.2	179.3	68.8	0	0	0	111.5	L198 T202 F209 M214 M215 R216 E220 L221 T222 M239 L243	L198-L218 HydrophobicContact CB-CD1 4.47Å; L198-L218 HydrophobicContact CD1-CD1 4.16Å; L198-L218 HydrophobicContact CD2-CD1 4.01Å; L198-L218 HydrophobicContact CG-CD1 4.45Å; T202-L218 HydrophobicContact CG2-CD2 4.2Å; F209-L218 HydrophobicContact CD1-CB 4.44Å; F209-L218 HydrophobicContact CD1-CD2 3.75Å; F209-L218 HydrophobicContact CE1-CB 4.16Å; F209-L218 HydrophobicContact CE1-CD1 4.21Å; F209-L218 HydrophobicContact CE1-CD2 3.68Å; F209-L218 HydrophobicContact CE1-CG 4.22Å; M214-L218 PolarHBondContact O-N 3.48Å; M215-L218 HydrophobicContact SD-CD2 4.17Å; R216-L218 VanDerWaalsContact C-N 3.34Å; R216-L218 PolarHBondContact O-N 3.41Å; L218-E220 VanDerWaalsContact C-N 3.34Å; L218-E220 PolarHBondContact O-N 3.09Å; L218-L221 PolarHBondContact O-N 3.48Å; L218-T222 HydrophobicContact CD1-CG2 3.91Å; L218-T222 HydrophobicContact CG-CG2 4.22Å; L218-T222 VanDerWaalsContact O-CB 3.32Å; L218-T222 WeakPolarHBondContact O-CB 3.39Å; L218-T222 VanDerWaalsContact O-CG2 3.25Å; L218-T222 WeakPolarHBondContact O-CG2 3.38Å; L218-T222 PolarHBondContact O-N 2.86Å; L218-T222 PolarHBondContact O-OG1 3.35Å; L218-M239 HydrophobicContact CD1-CE 4.06Å; L218-L243 HydrophobicContact CD2-CD2 3.63Å
219	K	93.1	Very high	88.5	Confident	133 Å²	133	64.5 Å²	64.5	58%	0.578	32%	0.321	S	S	*	.	H	α-helix	trans	-61.7	-41	179.4	-77.8	175.5	-179.9	179	0	112.2	M215 R216 T222 H223	M215-K219 WeakPolarHBondContact O-CB 3.47Å; M215-K219 VanDerWaalsContact O-CG 3.29Å; M215-K219 WeakPolarHBondContact O-CG 3.49Å; M215-K219 PolarHBondContact O-N 3.38Å; R216-K219 PolarHBondContact O-N 3.37Å; K219-T222 VanDerWaalsContact CA-OG1 3.3Å; K219-T222 WeakPolarHBondContact CA-OG1 3.2Å; K219-T222 PolarHBondContact O-OG1 2.92Å; K219-T222 VanDerWaalsContact O-OG1 3.1Å; K219-H223 VanDerWaalsContact O-CB 3.24Å; K219-H223 WeakPolarHBondContact O-CB 3.38Å; K219-H223 PolarHBondContact O-N 3.44Å
220	E	90.9	Very high	88.1	Confident	89 Å²	89	70.5 Å²	70.5	42%	0.416	35%	0.349	S	S	.	.	H	α-helix	trans	-62.7	-49.5	177.4	-176.2	176.7	176.2	0	0	111.5	R216 S217 L218 H223 R224	R216-E220 PolarHBondContact O-N 2.64Å; S217-E220 PolarHBondContact O-N 2.84Å; L218-E220 VanDerWaalsContact C-N 3.34Å; L218-E220 PolarHBondContact O-N 3.09Å; E220-H223 PolarHBondContact O-N 3.24Å; E220-R224 WeakPolarHBondContact O-CG 3.3Å; E220-R224 PolarHBondContact O-N 3.47Å; E220-R224 IonicContact OE1-CZ 3.66Å; E220-R224 IonicContact OE1-NE 3.72Å; E220-R224 IonicContact OE1-NH2 3.67Å; E220-R224 PolarHBondContact OE1-NH2 3.04Å
221	L	89.1	Confident	87.9	Confident	5 Å²	5	70.8 Å²	70.8	3%	0.026	36%	0.361	C	S	.	.	H	α-helix	trans	-64.8	-46.5	-179.7	-176.8	55.5	0	0	0	111.5	C171 I194 L198 S217 L218 H223 R224 L225	C171-L221 HydrophobicContact CB-CD1 4.29Å; I194-L221 HydrophobicContact CG2-CD2 4.07Å; I194-L221 HydrophobicContact CG2-CG 4.47Å; L198-L221 HydrophobicContact CD1-CD2 3.83Å; L198-L221 HydrophobicContact CD1-CG 4.13Å; L198-L221 HydrophobicContact CD2-CD2 4Å; L198-L221 HydrophobicContact CG-CD2 4.33Å; S217-L221 PolarHBondContact O-N 3.26Å; L218-L221 PolarHBondContact O-N 3.48Å; L221-H223 PolarHBondContact O-N 3.14Å; L221-R224 PolarHBondContact O-N 3.36Å; L221-L225 HydrophobicContact CG-CD1 4.28Å; L221-L225 WeakPolarHBondContact O-CG 3.34Å; L221-L225 PolarHBondContact O-N 2.81Å
222	T	90.6	Very high	87.7	Confident	10 Å²	10	70.3 Å²	70.3	6%	0.061	36%	0.356	C	S	.	.	H	α-helix	trans	-64.5	-35.5	179.7	51.2	0	0	0	0	113.6	L198 L218 K219 R224 L225 A226 V236 M239	L198-T222 HydrophobicContact CD1-CG2 4.13Å; L218-T222 HydrophobicContact CD1-CG2 3.91Å; L218-T222 HydrophobicContact CG-CG2 4.22Å; L218-T222 VanDerWaalsContact O-CB 3.32Å; L218-T222 WeakPolarHBondContact O-CB 3.39Å; L218-T222 VanDerWaalsContact O-CG2 3.25Å; L218-T222 WeakPolarHBondContact O-CG2 3.38Å; L218-T222 PolarHBondContact O-N 2.86Å; L218-T222 PolarHBondContact O-OG1 3.35Å; K219-T222 VanDerWaalsContact CA-OG1 3.3Å; K219-T222 WeakPolarHBondContact CA-OG1 3.2Å; K219-T222 PolarHBondContact O-OG1 2.92Å; K219-T222 VanDerWaalsContact O-OG1 3.1Å; T222-R224 VanDerWaalsContact C-N 3.3Å; T222-R224 PolarHBondContact O-N 3.32Å; T222-L225 PolarHBondContact O-N 2.95Å; T222-A226 WeakPolarHBondContact O-CB 3.35Å; T222-A226 PolarHBondContact O-N 3.1Å; T222-V236 HydrophobicContact CG2-CG1 4.05Å; T222-V236 HydrophobicContact CG2-CG2 4.47Å; T222-M239 HydrophobicContact CG2-CE 3.48Å; T222-M239 VanDerWaalsContact CG2-CE 3.48Å
223	H	89.2	Confident	87.5	Confident	141 Å²	141	68 Å²	68	65%	0.653	34%	0.343	S	S	*	.	H	α-helix	trans	-60.6	-41	174	-179	66	0	0	0	111.7	K219 E220 L221 A226 S227	K219-H223 VanDerWaalsContact O-CB 3.24Å; K219-H223 WeakPolarHBondContact O-CB 3.38Å; K219-H223 PolarHBondContact O-N 3.44Å; E220-H223 PolarHBondContact O-N 3.24Å; L221-H223 PolarHBondContact O-N 3.14Å; H223-A226 PolarHBondContact O-N 2.91Å; H223-S227 PolarHBondContact O-N 2.97Å
224	R	83.2	Confident	87.3	Confident	101 Å²	101	69.7 Å²	69.7	38%	0.381	35%	0.354	S	S	.	.	H	α-helix	trans	-69.8	-40.2	176.5	-63.1	176.4	-165.2	-84.2	3.4	112.3	E220 L221 T222 A226 S227	E220-R224 WeakPolarHBondContact O-CG 3.3Å; E220-R224 PolarHBondContact O-N 3.47Å; E220-R224 IonicContact OE1-CZ 3.66Å; E220-R224 IonicContact OE1-NE 3.72Å; E220-R224 IonicContact OE1-NH2 3.67Å; E220-R224 PolarHBondContact OE1-NH2 3.04Å; L221-R224 PolarHBondContact O-N 3.36Å; T222-R224 VanDerWaalsContact C-N 3.3Å; T222-R224 PolarHBondContact O-N 3.32Å; R224-A226 PolarHBondContact O-N 3.16Å; R224-S227 PolarHBondContact O-N 2.94Å; R224-S227 PolarHBondContact O-OG 3.31Å
225	L	83.7	Confident	87.2	Confident	5 Å²	5	71 Å²	71	3%	0.026	37%	0.365	C	S	.	.	H	α-helix	trans	-64.6	-29.9	176.4	-63.3	174.3	0	0	0	112.1	T191 I194 L198 L221 T222 V236	T191-L225 HydrophobicContact CG2-CB 4.3Å; T191-L225 HydrophobicContact CG2-CD2 3.99Å; I194-L225 HydrophobicContact CB-CD1 4.44Å; I194-L225 HydrophobicContact CB-CD2 4.38Å; I194-L225 HydrophobicContact CD1-CD2 4.34Å; I194-L225 HydrophobicContact CG2-CD1 3.86Å; I194-L225 HydrophobicContact CG2-CD2 4.3Å; L198-L225 HydrophobicContact CD1-CD1 3.93Å; L221-L225 HydrophobicContact CG-CD1 4.28Å; L221-L225 WeakPolarHBondContact O-CG 3.34Å; L221-L225 PolarHBondContact O-N 2.81Å; T222-L225 PolarHBondContact O-N 2.95Å; L225-V236 HydrophobicContact CB-CG2 4.36Å
226	A	82.9	Confident	87.2	Confident	23 Å²	23	69.9 Å²	69.9	19%	0.19	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81	-12.3	177.7	0	0	0	0	0	113.9	T222 H223 R224 G228 K233	T222-A226 WeakPolarHBondContact O-CB 3.35Å; T222-A226 PolarHBondContact O-N 3.1Å; H223-A226 PolarHBondContact O-N 2.91Å; R224-A226 PolarHBondContact O-N 3.16Å; A226-G228 PolarHBondContact O-N 3.41Å; A226-G228 VanDerWaalsContact O-N 3.11Å; A226-K233 HydrophobicContact CB-CB 4.13Å; A226-K233 HydrophobicContact CB-CG 4.34Å
227	S	74.1	Confident	87.1	Confident	83 Å²	83	63.2 Å²	63.2	58%	0.58	34%	0.342	S	S	*	.	S	Bend	trans	-82.2	86.4	178.5	65.5	0	0	0	0	110.8	H223 R224	H223-S227 PolarHBondContact O-N 2.97Å; R224-S227 PolarHBondContact O-N 2.94Å; R224-S227 PolarHBondContact O-OG 3.31Å
228	G	65.3	Low	87.2	Confident	83 Å²	83	67.8 Å²	67.8	86%	0.856	36%	0.361	S	S	*	.	S	Bend	trans	149	-19.7	167.5	0	0	0	0	0	116.8	A226	A226-G228 PolarHBondContact O-N 3.41Å; A226-G228 VanDerWaalsContact O-N 3.11Å
229	D	77.8	Confident	87.2	Confident	52 Å²	52	68.4 Å²	68.4	28%	0.278	36%	0.364	S	S	.	.			trans	-146	126.5	-178.3	-164.2	-37.5	0	0	0	111.2	V231 Y232 K233	D229-V231 PolarHBondContact O-N 3.48Å; D229-V231 WeakPolarHBondContact OD1-CB 3.42Å; D229-V231 WeakPolarHBondContact OD1-CG2 3.42Å; D229-V231 PolarHBondContact OD1-N 3.41Å; D229-Y232 HydrophobicContact CB-CD2 3.47Å; D229-Y232 VanDerWaalsContact CB-CD2 3.47Å; D229-Y232 HydrophobicContact CB-CE2 3.96Å; D229-Y232 HydrophobicContact CB-CG 4.24Å; D229-Y232 PolarHBondContact O-N 2.95Å; D229-K233 PolarHBondContact O-N 3.09Å; D229-K233 VanDerWaalsContact O-N 3.11Å
230	E	84.9	Confident	87.3	Confident	128 Å²	128	63.6 Å²	63.6	60%	0.598	35%	0.348	S	S	*	.	H	α-helix	trans	-63.6	-26	179.2	-76	-63.6	140.5	0	0	112.6	K233 K234	E230-K233 IonicContact OE1-NZ 3.13Å; E230-K233 PolarHBondContact OE1-NZ 2.93Å; E230-K233 IonicContact OE2-NZ 3.8Å; E230-K233 PolarHBondContact OE2-NZ 2.88Å; E230-K234 WeakPolarHBondContact O-CB 3.25Å; E230-K234 PolarHBondContact O-N 3.48Å
231	V	88	Confident	87.6	Confident	98 Å²	98	66 Å²	66	59%	0.594	36%	0.359	S	S	*	.	H	α-helix	trans	-65.1	-47.5	175.4	178.5	0	0	0	0	110.6	D229 K234 A235	D229-V231 PolarHBondContact O-N 3.48Å; D229-V231 WeakPolarHBondContact OD1-CB 3.42Å; D229-V231 WeakPolarHBondContact OD1-CG2 3.42Å; D229-V231 PolarHBondContact OD1-N 3.41Å; V231-K234 PolarHBondContact O-N 3.45Å; V231-A235 PolarHBondContact O-N 3.44Å
232	Y	86.5	Confident	87.9	Confident	40 Å²	40	67.7 Å²	67.7	16%	0.157	38%	0.378	C	S	.	.	H	α-helix	trans	-69.5	-37.1	179.6	-60.3	-43.2	0	0	0	111.8	R188 T191 P192 D229 K234 A235 V236	R188-Y232 PolarHBondContact O-OH 3.21Å; R188-Y232 VanDerWaalsContact O-OH 3.09Å; T191-Y232 HydrophobicContact CG2-CD1 3.82Å; T191-Y232 HydrophobicContact CG2-CD2 3.55Å; T191-Y232 HydrophobicContact CG2-CE1 4.04Å; T191-Y232 HydrophobicContact CG2-CE2 3.8Å; T191-Y232 HydrophobicContact CG2-CG 3.6Å; P192-Y232 HydrophobicContact CB-CE1 4.27Å; D229-Y232 HydrophobicContact CB-CD2 3.47Å; D229-Y232 VanDerWaalsContact CB-CD2 3.47Å; D229-Y232 HydrophobicContact CB-CE2 3.96Å; D229-Y232 HydrophobicContact CB-CG 4.24Å; D229-Y232 PolarHBondContact O-N 2.95Å; Y232-K234 VanDerWaalsContact C-N 3.34Å; Y232-K234 PolarHBondContact O-N 3.32Å; Y232-A235 PolarHBondContact O-N 2.95Å; Y232-V236 VanDerWaalsContact O-CB 3.32Å; Y232-V236 WeakPolarHBondContact O-CB 3.22Å; Y232-V236 VanDerWaalsContact O-CG2 3.3Å; Y232-V236 WeakPolarHBondContact O-CG2 3.37Å; Y232-V236 PolarHBondContact O-N 3.03Å
233	K	89.3	Confident	88.2	Confident	104 Å²	104	67.5 Å²	67.5	45%	0.452	38%	0.376	S	S	.	.	H	α-helix	trans	-59.4	-43.3	172.8	-177.6	177	164.8	-157.8	0	112.1	A226 D229 E230 G237	A226-K233 HydrophobicContact CB-CB 4.13Å; A226-K233 HydrophobicContact CB-CG 4.34Å; D229-K233 PolarHBondContact O-N 3.09Å; D229-K233 VanDerWaalsContact O-N 3.11Å; E230-K233 IonicContact OE1-NZ 3.13Å; E230-K233 PolarHBondContact OE1-NZ 2.93Å; E230-K233 IonicContact OE2-NZ 3.8Å; E230-K233 PolarHBondContact OE2-NZ 2.88Å; K233-G237 PolarHBondContact O-N 2.98Å
234	K	91.8	Very high	88.6	Confident	146 Å²	146	65.4 Å²	65.4	64%	0.635	37%	0.369	S	S	*	.	H	α-helix	trans	-63.3	-45.9	174.7	-174.8	178.5	178.5	-178.8	0	111.7	E230 V231 Y232 G237 Q238	E230-K234 WeakPolarHBondContact O-CB 3.25Å; E230-K234 PolarHBondContact O-N 3.48Å; V231-K234 PolarHBondContact O-N 3.45Å; Y232-K234 VanDerWaalsContact C-N 3.34Å; Y232-K234 PolarHBondContact O-N 3.32Å; K234-G237 PolarHBondContact O-N 3.3Å; K234-Q238 WeakPolarHBondContact O-CG 3.44Å; K234-Q238 PolarHBondContact O-N 3.2Å
235	A	92.4	Very high	89.2	Confident	28 Å²	28	69.9 Å²	69.9	23%	0.231	39%	0.386	C	S	.	.	H	α-helix	trans	-66.9	-41.8	-178.3	0	0	0	0	0	112.4	L195 V231 Y232 G237 Q238 M239	L195-A235 HydrophobicContact CD2-CB 3.47Å; L195-A235 VanDerWaalsContact CD2-CB 3.47Å; V231-A235 PolarHBondContact O-N 3.44Å; Y232-A235 PolarHBondContact O-N 2.95Å; A235-G237 VanDerWaalsContact C-N 3.32Å; A235-G237 PolarHBondContact O-N 3.32Å; A235-Q238 PolarHBondContact O-N 3.04Å; A235-M239 PolarHBondContact O-N 2.64Å
236	V	93.7	Very high	89.7	Confident	12 Å²	12	75.2 Å²	75.2	7%	0.073	41%	0.405	C	S	.	.	H	α-helix	trans	-58.5	-43.8	170.2	162	0	0	0	0	111.4	L195 T222 L225 Y232 M239 S240	L195-V236 HydrophobicContact CD1-CG2 3.83Å; T222-V236 HydrophobicContact CG2-CG1 4.05Å; T222-V236 HydrophobicContact CG2-CG2 4.47Å; L225-V236 HydrophobicContact CB-CG2 4.36Å; Y232-V236 VanDerWaalsContact O-CB 3.32Å; Y232-V236 WeakPolarHBondContact O-CB 3.22Å; Y232-V236 VanDerWaalsContact O-CG2 3.3Å; Y232-V236 WeakPolarHBondContact O-CG2 3.37Å; Y232-V236 PolarHBondContact O-N 3.03Å; V236-M239 PolarHBondContact O-N 2.84Å; V236-S240 WeakPolarHBondContact O-CB 3.32Å; V236-S240 PolarHBondContact O-N 3.31Å; V236-S240 PolarHBondContact O-OG 3.18Å
237	G	94.1	Very high	90.2	Very high	24 Å²	24	75.2 Å²	75.2	25%	0.247	40%	0.402	C	S	.	.	H	α-helix	trans	-60.4	-45.3	176.4	0	0	0	0	0	112.1	K233 K234 A235 S240 Q241	K233-G237 PolarHBondContact O-N 2.98Å; K234-G237 PolarHBondContact O-N 3.3Å; A235-G237 VanDerWaalsContact C-N 3.32Å; A235-G237 PolarHBondContact O-N 3.32Å; G237-S240 PolarHBondContact O-N 3.36Å; G237-Q241 WeakPolarHBondContact O-CB 3.39Å; G237-Q241 WeakPolarHBondContact O-CG 3.32Å; G237-Q241 PolarHBondContact O-N 2.86Å
238	Q	95.1	Very high	91.2	Very high	114 Å²	114	74.4 Å²	74.4	53%	0.533	39%	0.394	S	S	.	.	H	α-helix	trans	-62.9	-47.7	177	-73.3	174.2	-24.7	0	0	112.2	K234 A235 S240 Q241 G242	K234-Q238 WeakPolarHBondContact O-CG 3.44Å; K234-Q238 PolarHBondContact O-N 3.2Å; A235-Q238 PolarHBondContact O-N 3.04Å; Q238-S240 PolarHBondContact O-N 3.1Å; Q238-Q241 PolarHBondContact O-N 3.1Å; Q238-G242 PolarHBondContact O-N 3.24Å
239	M	96.3	Very high	92.6	Very high	17 Å²	17	73.2 Å²	73.2	8%	0.084	37%	0.37	C	S	.	.	H	α-helix	trans	-58.8	-48	176.5	-179.1	-166.8	69.3	0	0	111.2	L195 L198 L218 T222 A235 V236 Q241 G242 L243	L195-M239 HydrophobicContact CD1-CE 4.16Å; L195-M239 HydrophobicContact CD1-SD 3.86Å; L198-M239 HydrophobicContact CB-CE 4.21Å; L198-M239 HydrophobicContact CB-SD 3.65Å; L218-M239 HydrophobicContact CD1-CE 4.06Å; T222-M239 HydrophobicContact CG2-CE 3.48Å; T222-M239 VanDerWaalsContact CG2-CE 3.48Å; A235-M239 PolarHBondContact O-N 2.64Å; V236-M239 PolarHBondContact O-N 2.84Å; M239-Q241 PolarHBondContact O-N 2.68Å; M239-G242 PolarHBondContact O-N 3.3Å; M239-L243 PolarHBondContact O-N 3.49Å
240	S	95.3	Very high	93.2	Very high	33 Å²	33	71.4 Å²	71.4	23%	0.231	36%	0.36	C	S	.	.	H	α-helix	trans	-63.6	-42.7	-179.7	-57.5	0	0	0	0	112.1	V236 G237 Q238 L243 I244	V236-S240 WeakPolarHBondContact O-CB 3.32Å; V236-S240 PolarHBondContact O-N 3.31Å; V236-S240 PolarHBondContact O-OG 3.18Å; G237-S240 PolarHBondContact O-N 3.36Å; Q238-S240 PolarHBondContact O-N 3.1Å; S240-L243 PolarHBondContact O-N 3.44Å; S240-I244 VanDerWaalsContact O-CG1 3.29Å; S240-I244 WeakPolarHBondContact O-CG1 3.48Å; S240-I244 PolarHBondContact O-N 2.93Å
241	Q	95.8	Very high	93.5	Very high	139 Å²	139	67.6 Å²	67.6	65%	0.65	35%	0.347	S	S	*	.	H	α-helix	trans	-64.5	-41.1	174.9	-74.4	174.1	2.7	0	0	111.7	G237 Q238 M239 I244 R245	G237-Q241 WeakPolarHBondContact O-CB 3.39Å; G237-Q241 WeakPolarHBondContact O-CG 3.32Å; G237-Q241 PolarHBondContact O-N 2.86Å; Q238-Q241 PolarHBondContact O-N 3.1Å; M239-Q241 PolarHBondContact O-N 2.68Å; Q241-I244 PolarHBondContact O-N 2.96Å; Q241-R245 WeakPolarHBondContact O-CB 3.46Å; Q241-R245 PolarHBondContact O-N 3.38Å
242	G	96.8	Very high	93.8	Very high	41 Å²	41	68.5 Å²	68.5	42%	0.423	35%	0.345	S	S	.	.	H	α-helix	trans	-59.3	-47.2	175.5	0	0	0	0	0	112.2	Q238 M239 R245 R246	Q238-G242 PolarHBondContact O-N 3.24Å; M239-G242 PolarHBondContact O-N 3.3Å; G242-R245 PolarHBondContact O-N 3.28Å; G242-R246 WeakPolarHBondContact O-CB 3.4Å; G242-R246 PolarHBondContact O-N 2.96Å
243	L	96.9	Very high	94.1	Very high	5 Å²	5	67.2 Å²	67.2	3%	0.026	34%	0.34	C	S	.	.	H	α-helix	trans	-60	-50.5	175.9	176	62.8	0	0	0	112	T202 P206 F209 M215 L218 M239 S240 R245 R246 L247	T202-L243 HydrophobicContact CG2-CD1 4.36Å; T202-L243 HydrophobicContact CG2-CD2 3.86Å; T202-L243 HydrophobicContact CG2-CG 4.49Å; P206-L243 HydrophobicContact CB-CD1 4.37Å; F209-L243 HydrophobicContact CB-CD1 3.94Å; F209-L243 HydrophobicContact CB-CD2 3.88Å; F209-L243 HydrophobicContact CB-CG 4.37Å; F209-L243 HydrophobicContact CD1-CD2 3.81Å; F209-L243 HydrophobicContact CD2-CD1 3.96Å; F209-L243 HydrophobicContact CD2-CD2 4.39Å; F209-L243 HydrophobicContact CE1-CD2 4.48Å; F209-L243 HydrophobicContact CG-CD1 3.99Å; F209-L243 HydrophobicContact CG-CD2 3.75Å; F209-L243 HydrophobicContact CG-CG 4.48Å; M215-L243 HydrophobicContact CE-CD2 4.43Å; M215-L243 HydrophobicContact SD-CD2 3.85Å; L218-L243 HydrophobicContact CD2-CD2 3.63Å; M239-L243 PolarHBondContact O-N 3.49Å; S240-L243 PolarHBondContact O-N 3.44Å; L243-R245 VanDerWaalsContact C-N 3.31Å; L243-R245 PolarHBondContact O-N 3.47Å; L243-R246 PolarHBondContact O-N 2.98Å; L243-L247 HydrophobicContact CD1-CD1 4.14Å; L243-L247 HydrophobicContact CD1-CG 4.15Å; L243-L247 HydrophobicContact CG-CD1 4.09Å; L243-L247 HydrophobicContact CG-CG 4.49Å; L243-L247 WeakPolarHBondContact O-CG 3.39Å; L243-L247 PolarHBondContact O-N 3.31Å
244	I	95.9	Very high	94.1	Very high	97 Å²	97	64.5 Å²	64.5	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-60	-44	-179.9	-68.6	166	0	0	0	110.7	S240 Q241 R246 L247 T248	S240-I244 VanDerWaalsContact O-CG1 3.29Å; S240-I244 WeakPolarHBondContact O-CG1 3.48Å; S240-I244 PolarHBondContact O-N 2.93Å; Q241-I244 PolarHBondContact O-N 2.96Å; I244-R246 VanDerWaalsContact C-N 3.35Å; I244-R246 PolarHBondContact O-N 2.91Å; I244-L247 PolarHBondContact O-N 3.09Å; I244-T248 WeakPolarHBondContact O-CB 3.44Å; I244-T248 PolarHBondContact O-N 3.42Å; I244-T248 PolarHBondContact O-OG1 2.77Å
245	R	96.5	Very high	94.1	Very high	195 Å²	195	62.7 Å²	62.7	74%	0.736	32%	0.323	S	S	*	.	H	α-helix	trans	-59.4	-46.6	176.3	-178.6	-179.2	175.5	-172.2	-2	110.9	Q241 G242 L243 T248 V249	Q241-R245 WeakPolarHBondContact O-CB 3.46Å; Q241-R245 PolarHBondContact O-N 3.38Å; G242-R245 PolarHBondContact O-N 3.28Å; L243-R245 VanDerWaalsContact C-N 3.31Å; L243-R245 PolarHBondContact O-N 3.47Å; R245-T248 PolarHBondContact O-N 3Å; R245-V249 WeakPolarHBondContact O-CG2 3.46Å; R245-V249 PolarHBondContact O-N 3.15Å
246	R	93.9	Very high	94.1	Very high	117 Å²	117	63.6 Å²	63.6	44%	0.442	33%	0.33	S	S	.	.	H	α-helix	trans	-61.3	-49.7	178.1	-176.4	163.2	-107	169.1	2.1	110.8	E203 P206 G242 L243 I244 T248 V249 L250	E203-R246 PolarHBondContact O-NH1 3.11Å; P206-R246 HydrophobicContact CB-CG 3.98Å; P206-R246 HydrophobicContact CG-CG 4.27Å; G242-R246 WeakPolarHBondContact O-CB 3.4Å; G242-R246 PolarHBondContact O-N 2.96Å; L243-R246 PolarHBondContact O-N 2.98Å; I244-R246 VanDerWaalsContact C-N 3.35Å; I244-R246 PolarHBondContact O-N 2.91Å; R246-T248 VanDerWaalsContact C-N 3.28Å; R246-T248 PolarHBondContact O-N 3.35Å; R246-V249 PolarHBondContact O-N 3.23Å; R246-V249 VanDerWaalsContact O-N 3.12Å; R246-L250 HydrophobicContact CG-CD1 4.46Å; R246-L250 VanDerWaalsContact O-CG 3.31Å; R246-L250 WeakPolarHBondContact O-CG 3.41Å; R246-L250 PolarHBondContact O-N 3.23Å
247	L	93.9	Very high	94	Very high	24 Å²	24	64 Å²	64	13%	0.126	33%	0.332	C	S	.	.	H	α-helix	trans	-56.5	-40.1	176.2	-73	175.1	0	0	0	112.9	P206 F209 R210 L243 I244 L250 S251	P206-L247 VanDerWaalsContact O-CD2 3.31Å; P206-L247 WeakPolarHBondContact O-CD2 3.16Å; F209-L247 HydrophobicContact CB-CD1 4.3Å; R210-L247 HydrophobicContact CG-CD2 3.79Å; L243-L247 HydrophobicContact CD1-CD1 4.14Å; L243-L247 HydrophobicContact CD1-CG 4.15Å; L243-L247 HydrophobicContact CG-CD1 4.09Å; L243-L247 HydrophobicContact CG-CG 4.49Å; L243-L247 WeakPolarHBondContact O-CG 3.39Å; L243-L247 PolarHBondContact O-N 3.31Å; I244-L247 PolarHBondContact O-N 3.09Å; L247-L250 HydrophobicContact CD2-CD1 4.42Å; L247-L250 PolarHBondContact O-N 3.18Å; L247-S251 PolarHBondContact O-N 3.35Å; L247-S251 PolarHBondContact O-OG 2.99Å
248	T	95	Very high	93.9	Very high	66 Å²	66	67.7 Å²	67.7	41%	0.405	35%	0.349	S	S	.	.	H	α-helix	trans	-64.3	-44.6	176.3	-61.5	0	0	0	0	111.7	I244 R245 R246 L250 S251 Q252	I244-T248 WeakPolarHBondContact O-CB 3.44Å; I244-T248 PolarHBondContact O-N 3.42Å; I244-T248 PolarHBondContact O-OG1 2.77Å; R245-T248 PolarHBondContact O-N 3Å; R246-T248 VanDerWaalsContact C-N 3.28Å; R246-T248 PolarHBondContact O-N 3.35Å; T248-L250 VanDerWaalsContact C-N 3.33Å; T248-L250 PolarHBondContact O-N 3.46Å; T248-S251 PolarHBondContact O-N 3.27Å; T248-Q252 HydrophobicContact CG2-CG 4.48Å; T248-Q252 VanDerWaalsContact O-CG 3.32Å; T248-Q252 WeakPolarHBondContact O-CG 3.44Å; T248-Q252 PolarHBondContact O-N 2.81Å
249	V	94	Very high	93.8	Very high	58 Å²	58	68.3 Å²	68.3	35%	0.352	35%	0.35	S	S	.	.	H	α-helix	trans	-61.1	-42.4	176.3	170.3	0	0	0	0	111.2	R245 R246 S251 Q252 Y253 Y307	R245-V249 WeakPolarHBondContact O-CG2 3.46Å; R245-V249 PolarHBondContact O-N 3.15Å; R246-V249 PolarHBondContact O-N 3.23Å; R246-V249 VanDerWaalsContact O-N 3.12Å; V249-S251 PolarHBondContact O-N 3.03Å; V249-Q252 PolarHBondContact O-N 3.23Å; V249-Y253 PolarHBondContact O-N 3.05Å; V249-Y307 HydrophobicContact CG1-CE1 4.05Å
250	L	91.3	Very high	93.7	Very high	13 Å²	13	69 Å²	69	7%	0.068	36%	0.355	C	S	.	.	H	α-helix	trans	-60.2	-45.9	176.2	-62.4	176.7	0	0	0	111.7	P206 Y207 R246 L247 T248 Y253 E254 Y307	P206-L250 HydrophobicContact CB-CD1 4.13Å; P206-L250 HydrophobicContact CG-CD1 3.97Å; Y207-L250 HydrophobicContact CD1-CD1 4.15Å; Y207-L250 HydrophobicContact CD2-CD1 4.22Å; Y207-L250 HydrophobicContact CE1-CB 4.37Å; Y207-L250 HydrophobicContact CE1-CD1 3.79Å; Y207-L250 HydrophobicContact CE1-CG 4.46Å; Y207-L250 HydrophobicContact CE2-CD1 3.9Å; Y207-L250 HydrophobicContact CE2-CD2 4.29Å; Y207-L250 HydrophobicContact CG-CD1 4.36Å; Y207-L250 WeakPolarHBondContact OH-CD2 3.43Å; R246-L250 HydrophobicContact CG-CD1 4.46Å; R246-L250 VanDerWaalsContact O-CG 3.31Å; R246-L250 WeakPolarHBondContact O-CG 3.41Å; R246-L250 PolarHBondContact O-N 3.23Å; L247-L250 HydrophobicContact CD2-CD1 4.42Å; L247-L250 PolarHBondContact O-N 3.18Å; T248-L250 VanDerWaalsContact C-N 3.33Å; T248-L250 PolarHBondContact O-N 3.46Å; L250-Y253 PolarHBondContact O-N 3.29Å; L250-E254 WeakPolarHBondContact O-CG 3.18Å; L250-E254 PolarHBondContact O-N 2.9Å; L250-E254 VanDerWaalsContact O-N 3.13Å; L250-Y307 HydrophobicContact CD2-CD1 3.52Å; L250-Y307 HydrophobicContact CD2-CE1 4Å
251	S	91.3	Very high	93.4	Very high	48 Å²	48	71.4 Å²	71.4	34%	0.336	37%	0.366	S	S	.	.	H	α-helix	trans	-65.7	-39.8	178.2	-60	0	0	0	0	112.7	L247 T248 V249 Y253 E254 E255	L247-S251 PolarHBondContact O-N 3.35Å; L247-S251 PolarHBondContact O-OG 2.99Å; T248-S251 PolarHBondContact O-N 3.27Å; V249-S251 PolarHBondContact O-N 3.03Å; S251-Y253 VanDerWaalsContact C-N 3.3Å; S251-Y253 PolarHBondContact O-N 3.05Å; S251-E254 PolarHBondContact O-N 2.69Å; S251-E255 PolarHBondContact O-N 3.31Å
252	Q	94	Very high	93.2	Very high	117 Å²	117	66.9 Å²	66.9	55%	0.547	35%	0.352	S	S	.	.	H	α-helix	trans	-62.6	-38.4	176.1	-74.5	174.3	-1.8	0	0	112.2	T248 V249 E255 A256	T248-Q252 HydrophobicContact CG2-CG 4.48Å; T248-Q252 VanDerWaalsContact O-CG 3.32Å; T248-Q252 WeakPolarHBondContact O-CG 3.44Å; T248-Q252 PolarHBondContact O-N 2.81Å; V249-Q252 PolarHBondContact O-N 3.23Å; Q252-E255 PolarHBondContact O-N 2.71Å; Q252-A256 WeakPolarHBondContact O-CB 3.28Å; Q252-A256 PolarHBondContact O-N 3Å
253	Y	92.8	Very high	93	Very high	13 Å²	13	67 Å²	67	5%	0.051	34%	0.344	C	S	.	.	H	α-helix	trans	-64.8	-45.3	175.7	169.8	-104.6	0	0	0	112.1	V249 L250 S251 E255 A256 L257 E303 R304 Y307	V249-Y253 PolarHBondContact O-N 3.05Å; L250-Y253 PolarHBondContact O-N 3.29Å; S251-Y253 VanDerWaalsContact C-N 3.3Å; S251-Y253 PolarHBondContact O-N 3.05Å; Y253-E255 VanDerWaalsContact C-N 3.33Å; Y253-E255 PolarHBondContact O-N 3Å; Y253-A256 WeakPolarHBondContact O-CB 3.48Å; Y253-A256 PolarHBondContact O-N 2.69Å; Y253-A256 VanDerWaalsContact O-N 3.09Å; Y253-L257 HydrophobicContact CD1-CD1 4.19Å; Y253-L257 HydrophobicContact CD2-CG 4.5Å; Y253-L257 HydrophobicContact CE1-CD1 3.48Å; Y253-L257 VanDerWaalsContact CE1-CD1 3.48Å; Y253-L257 HydrophobicContact CE1-CG 4.06Å; Y253-L257 HydrophobicContact CE2-CD1 4.28Å; Y253-L257 HydrophobicContact CE2-CD2 4.09Å; Y253-L257 HydrophobicContact CE2-CG 4.02Å; Y253-L257 PolarHBondContact O-N 3.12Å; Y253-E303 HydrophobicContact CE2-CG 4.39Å; Y253-R304 WeakPolarHBondContact OH-CA 3.34Å; Y253-R304 WeakPolarHBondContact OH-CG 3.37Å; Y253-Y307 VanDerWaalsContact CB-CE1 3.4Å; Y253-Y307 AromaticContact CD1-CD1 3.5Å; Y253-Y307 HydrophobicContact CD1-CD1 3.5Å; Y253-Y307 AromaticContact CD1-CD2 3.7Å; Y253-Y307 HydrophobicContact CD1-CD2 3.7Å; Y253-Y307 AromaticContact CD1-CE1 3.97Å; Y253-Y307 HydrophobicContact CD1-CE1 3.97Å; Y253-Y307 HydrophobicContact CD1-CE2 4.16Å; Y253-Y307 AromaticContact CD1-CG 3.39Å; Y253-Y307 HydrophobicContact CD1-CG 3.39Å; Y253-Y307 HydrophobicContact CD2-CD1 4.38Å; Y253-Y307 AromaticContact CD2-CD2 3.53Å; Y253-Y307 HydrophobicContact CD2-CD2 3.53Å; Y253-Y307 HydrophobicContact CD2-CE1 4.19Å; Y253-Y307 AromaticContact CD2-CE2 3.32Å; Y253-Y307 HydrophobicContact CD2-CE2 3.32Å; Y253-Y307 HydrophobicContact CD2-CG 4.1Å; Y253-Y307 AromaticContact CD2-CZ 3.7Å; Y253-Y307 HydrophobicContact CE1-CD1 4.1Å; Y253-Y307 AromaticContact CE1-CD2 3.63Å; Y253-Y307 HydrophobicContact CE1-CD2 3.63Å; Y253-Y307 HydrophobicContact CE1-CE2 4.42Å; Y253-Y307 AromaticContact CE1-CG 3.48Å; Y253-Y307 HydrophobicContact CE1-CG 3.48Å; Y253-Y307 VanDerWaalsContact CE1-CG 3.48Å; Y253-Y307 AromaticContact CE2-CD2 3.48Å; Y253-Y307 HydrophobicContact CE2-CD2 3.48Å; Y253-Y307 VanDerWaalsContact CE2-CD2 3.48Å; Y253-Y307 AromaticContact CE2-CE2 3.65Å; Y253-Y307 HydrophobicContact CE2-CE2 3.65Å; Y253-Y307 HydrophobicContact CE2-CG 4.19Å; Y253-Y307 AromaticContact CG-CD1 3.65Å; Y253-Y307 HydrophobicContact CG-CD1 3.65Å; Y253-Y307 AromaticContact CG-CD2 3.62Å; Y253-Y307 HydrophobicContact CG-CD2 3.62Å; Y253-Y307 AromaticContact CG-CE1 3.59Å; Y253-Y307 HydrophobicContact CG-CE1 3.59Å; Y253-Y307 AromaticContact CG-CE2 3.6Å; Y253-Y307 HydrophobicContact CG-CE2 3.6Å; Y253-Y307 AromaticContact CG-CG 3.69Å; Y253-Y307 HydrophobicContact CG-CG 3.69Å; Y253-Y307 AromaticContact CG-CZ 3.59Å; Y253-Y307 AromaticContact CZ-CD2 3.51Å; Y253-Y307 AromaticContact CZ-CG 3.88Å
254	E	90.3	Very high	92.7	Very high	47 Å²	47	67.3 Å²	67.3	22%	0.22	35%	0.348	C	S	.	.	H	α-helix	trans	-58.2	-44.5	175.5	-72.2	166.8	-166.8	0	0	111.7	R210 L250 S251 A256 L257 V258	R210-E254 IonicContact CZ-OE1 3.78Å; R210-E254 IonicContact CZ-OE2 3.35Å; R210-E254 IonicContact NH1-OE1 2.84Å; R210-E254 PolarHBondContact NH1-OE1 2.73Å; R210-E254 IonicContact NH1-OE2 3.4Å; R210-E254 PolarHBondContact NH1-OE2 3.43Å; R210-E254 VanDerWaalsContact NH2-CD 3.29Å; R210-E254 IonicContact NH2-OE1 2.7Å; R210-E254 PolarHBondContact NH2-OE1 3.29Å; R210-E254 IonicContact NH2-OE2 3.4Å; R210-E254 PolarHBondContact NH2-OE2 3.16Å; L250-E254 WeakPolarHBondContact O-CG 3.18Å; L250-E254 PolarHBondContact O-N 2.9Å; L250-E254 VanDerWaalsContact O-N 3.13Å; S251-E254 PolarHBondContact O-N 2.69Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.09Å; E254-L257 PolarHBondContact O-N 2.79Å; E254-V258 WeakPolarHBondContact O-CG2 3.06Å; E254-V258 PolarHBondContact O-N 2.8Å; E254-V258 VanDerWaalsContact O-N 3.13Å
255	E	91.6	Very high	92.3	Very high	109 Å²	109	65.2 Å²	65.2	51%	0.509	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-39.8	174	-72.3	-179.7	-160.1	0	0	112.7	S251 Q252 Y253 V258 K259	S251-E255 PolarHBondContact O-N 3.31Å; Q252-E255 PolarHBondContact O-N 2.71Å; Y253-E255 VanDerWaalsContact C-N 3.33Å; Y253-E255 PolarHBondContact O-N 3Å; E255-V258 PolarHBondContact O-N 2.55Å; E255-K259 WeakPolarHBondContact O-CG 3.48Å; E255-K259 PolarHBondContact O-N 3.38Å; E255-K259 IonicContact OE2-NZ 3.38Å
256	A	92.4	Very high	92	Very high	46 Å²	46	62.1 Å²	62.1	38%	0.38	34%	0.339	S	S	.	.	H	α-helix	trans	-64.4	-41.7	177.7	0	0	0	0	0	111.5	Q252 Y253 E254 V258 K259 V260	Q252-A256 WeakPolarHBondContact O-CB 3.28Å; Q252-A256 PolarHBondContact O-N 3Å; Y253-A256 WeakPolarHBondContact O-CB 3.48Å; Y253-A256 PolarHBondContact O-N 2.69Å; Y253-A256 VanDerWaalsContact O-N 3.09Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 3.09Å; A256-V258 PolarHBondContact O-N 2.63Å; A256-K259 PolarHBondContact O-N 3.4Å; A256-V260 WeakPolarHBondContact O-CG2 3.45Å; A256-V260 PolarHBondContact O-N 2.98Å
257	L	91.8	Very high	91.7	Very high	21 Å²	21	60 Å²	60	11%	0.11	33%	0.331	C	S	.	.	H	α-helix	trans	-59.1	-45.8	174.3	-74.2	-177.7	0	0	0	111.9	Y253 E254 K259 V260 N261 A341	Y253-L257 HydrophobicContact CD1-CD1 4.19Å; Y253-L257 HydrophobicContact CD2-CG 4.5Å; Y253-L257 HydrophobicContact CE1-CD1 3.48Å; Y253-L257 VanDerWaalsContact CE1-CD1 3.48Å; Y253-L257 HydrophobicContact CE1-CG 4.06Å; Y253-L257 HydrophobicContact CE2-CD1 4.28Å; Y253-L257 HydrophobicContact CE2-CD2 4.09Å; Y253-L257 HydrophobicContact CE2-CG 4.02Å; Y253-L257 PolarHBondContact O-N 3.12Å; E254-L257 PolarHBondContact O-N 2.79Å; L257-K259 VanDerWaalsContact C-N 3.34Å; L257-K259 PolarHBondContact O-N 3.32Å; L257-V260 PolarHBondContact O-N 2.96Å; L257-N261 WeakPolarHBondContact O-CB 3.39Å; L257-N261 PolarHBondContact O-N 2.92Å; L257-A341 HydrophobicContact CD1-CB 4Å
258	V	91.3	Very high	91.3	Very high	101 Å²	101	60.8 Å²	60.8	61%	0.612	34%	0.335	S	S	*	.	H	α-helix	trans	-60.2	-44.6	177.4	173.6	0	0	0	0	111	E254 E255 A256 N261 A262	E254-V258 WeakPolarHBondContact O-CG2 3.06Å; E254-V258 PolarHBondContact O-N 2.8Å; E254-V258 VanDerWaalsContact O-N 3.13Å; E255-V258 PolarHBondContact O-N 2.55Å; A256-V258 PolarHBondContact O-N 2.63Å; V258-N261 PolarHBondContact O-N 3.48Å; V258-A262 WeakPolarHBondContact O-CB 3.41Å; V258-A262 PolarHBondContact O-N 2.93Å
259	K	93.4	Very high	90.8	Very high	127 Å²	127	62 Å²	62	55%	0.552	34%	0.343	S	S	*	.	H	α-helix	trans	-62.7	-42.8	177.7	-71.8	167.7	-173.3	163.8	0	112.3	E255 A256 L257 A262 T263	E255-K259 WeakPolarHBondContact O-CG 3.48Å; E255-K259 PolarHBondContact O-N 3.38Å; E255-K259 IonicContact OE2-NZ 3.38Å; A256-K259 PolarHBondContact O-N 3.4Å; L257-K259 VanDerWaalsContact C-N 3.34Å; L257-K259 PolarHBondContact O-N 3.32Å; K259-A262 PolarHBondContact O-N 3.26Å; K259-T263 WeakPolarHBondContact O-CB 3.26Å; K259-T263 PolarHBondContact O-N 3.15Å; K259-T263 PolarHBondContact O-OG1 3.09Å
260	V	92.7	Very high	90.3	Very high	31 Å²	31	61.9 Å²	61.9	19%	0.188	35%	0.348	C	S	.	.	H	α-helix	trans	-62.2	-46.5	176.6	166.9	0	0	0	0	110.7	A256 L257 T263 A264 L517 T518	A256-V260 WeakPolarHBondContact O-CG2 3.45Å; A256-V260 PolarHBondContact O-N 2.98Å; L257-V260 PolarHBondContact O-N 2.96Å; V260-T263 PolarHBondContact O-N 3.42Å; V260-A264 PolarHBondContact O-N 3.39Å; V260-L517 HydrophobicContact CG1-CB 3.9Å; V260-T518 HydrophobicContact CG1-CG2 4.04Å
261	N	89.8	Confident	89.6	Confident	84 Å²	84	62.6 Å²	62.6	45%	0.449	35%	0.352	S	S	.	.	H	α-helix	trans	-64.3	-41.6	179.1	-72.9	-13.9	0	0	0	112	L257 V258 A264 A265	L257-N261 WeakPolarHBondContact O-CB 3.39Å; L257-N261 PolarHBondContact O-N 2.92Å; V258-N261 PolarHBondContact O-N 3.48Å; N261-A264 PolarHBondContact O-N 3.24Å; N261-A265 WeakPolarHBondContact O-CB 3.31Å; N261-A265 PolarHBondContact O-N 3.37Å
262	A	92.1	Very high	88.8	Confident	44 Å²	44	67 Å²	67	36%	0.364	37%	0.365	S	S	.	.	H	α-helix	trans	-60.2	-47.1	173.7	0	0	0	0	0	111.5	V258 K259 A264 A265 E266	V258-A262 WeakPolarHBondContact O-CB 3.41Å; V258-A262 PolarHBondContact O-N 2.93Å; K259-A262 PolarHBondContact O-N 3.26Å; A262-A264 VanDerWaalsContact C-N 3.31Å; A262-A264 PolarHBondContact O-N 3.12Å; A262-A265 PolarHBondContact O-N 2.94Å; A262-A265 VanDerWaalsContact O-N 3.14Å; A262-E266 WeakPolarHBondContact O-CG 3.23Å; A262-E266 PolarHBondContact O-N 3.03Å
263	T	92.9	Very high	88	Confident	43 Å²	43	65.3 Å²	65.3	26%	0.264	37%	0.37	S	S	.	.	H	α-helix	trans	-60	-40.9	177.3	-54.9	0	0	0	0	111.9	K259 V260 R267 T518	K259-T263 WeakPolarHBondContact O-CB 3.26Å; K259-T263 PolarHBondContact O-N 3.15Å; K259-T263 PolarHBondContact O-OG1 3.09Å; V260-T263 PolarHBondContact O-N 3.42Å; T263-R267 WeakPolarHBondContact O-CG 3.5Å; T263-R267 PolarHBondContact O-N 2.71Å; T263-R267 VanDerWaalsContact O-N 3.09Å; T263-T518 HydrophobicContact CG2-CG2 3.9Å
264	A	89.3	Confident	86.8	Confident	12 Å²	12	71.9 Å²	71.9	10%	0.099	40%	0.399	C	S	.	.	H	α-helix	trans	-64.4	-41.5	176.3	0	0	0	0	0	111.8	V260 N261 A262 R267 L268	V260-A264 PolarHBondContact O-N 3.39Å; N261-A264 PolarHBondContact O-N 3.24Å; A262-A264 VanDerWaalsContact C-N 3.31Å; A262-A264 PolarHBondContact O-N 3.12Å; A264-R267 PolarHBondContact O-N 3.31Å; A264-L268 PolarHBondContact O-N 3.12Å
265	A	88.9	Confident	85.4	Confident	53 Å²	53	74 Å²	74	44%	0.438	42%	0.417	S	S	.	.	H	α-helix	trans	-67.2	-39.9	178	0	0	0	0	0	112.6	N261 A262 L268 T269	N261-A265 WeakPolarHBondContact O-CB 3.31Å; N261-A265 PolarHBondContact O-N 3.37Å; A262-A265 PolarHBondContact O-N 2.94Å; A262-A265 VanDerWaalsContact O-N 3.14Å; A265-L268 PolarHBondContact O-N 3.14Å; A265-T269 PolarHBondContact O-N 3.41Å; A265-T269 PolarHBondContact O-OG1 3.3Å
266	E	89.7	Confident	83.5	Confident	130 Å²	130	77.7 Å²	77.7	61%	0.607	43%	0.434	S	S	*	.	H	α-helix	trans	-60.7	-46.6	173.5	-74.6	173.5	-171.6	0	0	111.4	A262 L268 T269 A270	A262-E266 WeakPolarHBondContact O-CG 3.23Å; A262-E266 PolarHBondContact O-N 3.03Å; E266-L268 VanDerWaalsContact C-N 3.33Å; E266-L268 PolarHBondContact O-N 3.23Å; E266-T269 WeakPolarHBondContact O-CB 3.49Å; E266-T269 PolarHBondContact O-N 3.45Å; E266-T269 VanDerWaalsContact O-N 3.17Å; E266-A270 PolarHBondContact O-N 2.88Å
267	R	87.1	Confident	81.4	Confident	74 Å²	74	78.4 Å²	78.4	28%	0.279	44%	0.44	S	S	.	.	H	α-helix	trans	-62.3	-39.3	176.8	-75.2	174.5	177	-159	9.7	112.5	T263 A264 T269 A270 L271 T518	T263-R267 WeakPolarHBondContact O-CG 3.5Å; T263-R267 PolarHBondContact O-N 2.71Å; T263-R267 VanDerWaalsContact O-N 3.09Å; A264-R267 PolarHBondContact O-N 3.31Å; R267-T269 VanDerWaalsContact C-N 3.34Å; R267-A270 PolarHBondContact O-N 2.92Å; R267-L271 PolarHBondContact O-N 3.14Å; R267-T518 WeakPolarHBondContact CD-O 3.49Å; R267-T518 PolarHBondContact NH1-OG1 3.47Å; R267-T518 PolarHBondContact NH2-OG1 3.01Å
268	L	85.3	Confident	79.4	Confident	39 Å²	39	78.7 Å²	78.7	20%	0.204	45%	0.446	C	S	.	.	H	α-helix	trans	-63.9	-40.4	174.5	-178.7	61.3	0	0	0	111.8	A264 A265 E266 L271 K272 P520	A264-L268 PolarHBondContact O-N 3.12Å; A265-L268 PolarHBondContact O-N 3.14Å; E266-L268 VanDerWaalsContact C-N 3.33Å; E266-L268 PolarHBondContact O-N 3.23Å; L268-L271 PolarHBondContact O-N 3.05Å; L268-K272 PolarHBondContact O-N 3.37Å; L268-P520 HydrophobicContact CB-CB 4.31Å; L268-P520 HydrophobicContact CD1-CB 4.13Å
269	T	85.6	Confident	77.4	Confident	92 Å²	92	80.3 Å²	80.3	56%	0.564	46%	0.456	S	S	*	.	H	α-helix	trans	-65.7	-42.5	176.7	-56.1	0	0	0	0	111.3	A265 E266 R267 L271 K272 A273	A265-T269 PolarHBondContact O-N 3.41Å; A265-T269 PolarHBondContact O-OG1 3.3Å; E266-T269 WeakPolarHBondContact O-CB 3.49Å; E266-T269 PolarHBondContact O-N 3.45Å; E266-T269 VanDerWaalsContact O-N 3.17Å; R267-T269 VanDerWaalsContact C-N 3.34Å; T269-L271 VanDerWaalsContact C-N 3.33Å; T269-L271 PolarHBondContact O-N 3.24Å; T269-K272 PolarHBondContact O-N 2.53Å; T269-A273 PolarHBondContact O-N 3.23Å
270	A	82.8	Confident	75.6	Confident	56 Å²	56	78.3 Å²	78.3	46%	0.463	45%	0.448	S	S	.	.	H	α-helix	trans	-61.8	-39.6	175.6	0	0	0	0	0	112.4	E266 R267 K272 A273 K274	E266-A270 PolarHBondContact O-N 2.88Å; R267-A270 PolarHBondContact O-N 2.92Å; A270-K272 VanDerWaalsContact C-N 3.33Å; A270-K272 PolarHBondContact O-N 3.37Å; A270-A273 PolarHBondContact O-N 3.08Å; A270-K274 PolarHBondContact O-N 3.26Å
271	L	77.9	Confident	74.4	Confident	28 Å²	28	85.9 Å²	85.9	15%	0.147	47%	0.474	C	S	.	.	H	α-helix	trans	-63.7	-37.2	176.3	-176.6	134.8	0	0	0	112.2	R267 L268 T269 K274 A278 P520 F522	R267-L271 PolarHBondContact O-N 3.14Å; L268-L271 PolarHBondContact O-N 3.05Å; T269-L271 VanDerWaalsContact C-N 3.33Å; T269-L271 PolarHBondContact O-N 3.24Å; L271-K274 CarbonylContact O-C 3.5Å; L271-A278 HydrophobicContact CD1-CB 4.27Å; L271-P520 HydrophobicContact CB-CB 4.5Å; L271-P520 HydrophobicContact CD1-CB 4.24Å; L271-P520 HydrophobicContact CD1-CG 3.74Å; L271-F522 HydrophobicContact CD2-CE1 3.66Å; L271-F522 HydrophobicContact CD2-CZ 4.36Å
272	K	74.5	Confident	74	Confident	141 Å²	141	83.8 Å²	83.8	61%	0.613	46%	0.462	S	S	*	.	H	α-helix	trans	-67.6	-40.1	174.1	-69.1	175.9	-178.2	177.2	0	112.5	L268 T269 A270	L268-K272 PolarHBondContact O-N 3.37Å; T269-K272 PolarHBondContact O-N 2.53Å; A270-K272 VanDerWaalsContact C-N 3.33Å; A270-K272 PolarHBondContact O-N 3.37Å
273	A	75.3	Confident	74	Confident	80 Å²	80	81.7 Å²	81.7	66%	0.661	45%	0.445	S	S	*	.	H	α-helix	trans	-72.9	-32	-177.6	0	0	0	0	0	113.5	T269 A270	T269-A273 PolarHBondContact O-N 3.23Å; A270-A273 PolarHBondContact O-N 3.08Å
274	K	68.8	Low	74	Confident	151 Å²	151	81.2 Å²	81.2	66%	0.657	44%	0.441	S	S	*	.			trans	-132.9	80.9	178.2	-68.4	-176.6	-178.6	178	0	111.2	A270 L271 Q276 A277	A270-K274 PolarHBondContact O-N 3.26Å; L271-K274 CarbonylContact O-C 3.5Å; K274-Q276 PolarHBondContact O-N 3.02Å; K274-A277 HydrophobicContact CB-CB 3.95Å; K274-A277 WeakPolarHBondContact O-CB 3.46Å; K274-A277 PolarHBondContact O-N 2.98Å
275	P	61.2	Low	74	Confident	92 Å²	92	84 Å²	84	60%	0.597	46%	0.46	S	S	*	.	G	3₁₀ helix	trans	-60.5	-29.8	-179.4	-21.8	32	0	0	0	113.3	A277 A278	P275-A277 VanDerWaalsContact C-N 3.3Å; P275-A277 PolarHBondContact O-N 2.86Å; P275-A278 WeakPolarHBondContact O-CB 3.49Å; P275-A278 PolarHBondContact O-N 3.11Å
276	Q	51.4	Low	74.2	Confident	187 Å²	187	84 Å²	84	87%	0.874	45%	0.451	S	S	*	.	G	3₁₀ helix	trans	-76.7	-13.7	178.7	-66	179.6	-10.3	0	0	113.7	K274 A278 T279	K274-Q276 PolarHBondContact O-N 3.02Å; Q276-A278 VanDerWaalsContact C-N 3.25Å; Q276-T279 PolarHBondContact O-OG1 3.44Å
277	A	48	Very low	74.4	Confident	60 Å²	60	78.3 Å²	78.3	50%	0.496	43%	0.426	S	S	.	.	G	3₁₀ helix	trans	-84.1	-0.7	170.4	0	0	0	0	0	112.5	K274 P275 T279 Q280	K274-A277 HydrophobicContact CB-CB 3.95Å; K274-A277 WeakPolarHBondContact O-CB 3.46Å; K274-A277 PolarHBondContact O-N 2.98Å; P275-A277 VanDerWaalsContact C-N 3.3Å; P275-A277 PolarHBondContact O-N 2.86Å; A277-T279 PolarHBondContact O-N 3.02Å; A277-Q280 PolarHBondContact O-N 3.42Å
278	A	49.9	Very low	74.8	Confident	28 Å²	28	81.1 Å²	81.1	23%	0.231	45%	0.447	C	S	.	.			trans	-69.1	7.6	176.3	0	0	0	0	0	114.2	L271 P275 Q276 Q280	L271-A278 HydrophobicContact CD1-CB 4.27Å; P275-A278 WeakPolarHBondContact O-CB 3.49Å; P275-A278 PolarHBondContact O-N 3.11Å; Q276-A278 VanDerWaalsContact C-N 3.25Å; A278-Q280 PolarHBondContact O-N 3.41Å
279	T	48.9	Very low	75.4	Confident	135 Å²	135	81.8 Å²	81.8	83%	0.828	45%	0.45	S	S	*	.			trans	-65	13.7	154.2	-5.8	0	0	0	0	112.8	Q276 A277 R281	Q276-T279 PolarHBondContact O-OG1 3.44Å; A277-T279 PolarHBondContact O-N 3.02Å; T279-R281 PolarHBondContact O-N 2.91Å
280	Q	54.8	Low	76	Confident	84 Å²	84	78.3 Å²	78.3	39%	0.393	43%	0.429	S	S	.	.			trans	-42	131.2	161.3	-106	-179.2	-9.1	0	0	109.5	A277 A278 D282	A277-Q280 PolarHBondContact O-N 3.42Å; A278-Q280 PolarHBondContact O-N 3.41Å; Q280-D282 PolarHBondContact O-N 3.46Å
281	R	68.7	Low	76.7	Confident	191 Å²	191	79.7 Å²	79.7	72%	0.721	43%	0.425	S	S	*	.			trans	-47.6	115.2	177.6	-72.1	-176.7	-175.1	173.5	0.9	109.8	T279 S285 I286 Y515	T279-R281 PolarHBondContact O-N 2.91Å; R281-S285 VanDerWaalsContact CA-OG 3.31Å; R281-S285 WeakPolarHBondContact CA-OG 3.44Å; R281-S285 VanDerWaalsContact CB-OG 3.24Å; R281-S285 WeakPolarHBondContact CB-OG 3.45Å; R281-I286 HydrophobicContact CB-CD1 4.14Å; R281-I286 HydrophobicContact CB-CG1 3.92Å; R281-Y515 WeakPolarHBondContact O-CE2 3.41Å; R281-Y515 PolarHBondContact O-OH 3.43Å
282	D	81.8	Confident	77.7	Confident	39 Å²	39	80.2 Å²	80.2	21%	0.209	43%	0.429	C	S	.	.			trans	-65.5	161.3	169.2	58.8	32.5	0	0	0	109.7	Q280 L284 S285 I286 H365	Q280-D282 PolarHBondContact O-N 3.46Å; D282-L284 PolarHBondContact O-N 3.2Å; D282-L284 PolarHBondContact OD1-N 2.88Å; D282-S285 PolarHBondContact N-OG 3.3Å; D282-S285 PolarHBondContact O-N 3.42Å; D282-S285 PolarHBondContact O-OG 3.32Å; D282-S285 WeakPolarHBondContact OD1-CA 3.28Å; D282-S285 WeakPolarHBondContact OD1-CB 3.3Å; D282-S285 PolarHBondContact OD1-N 3.13Å; D282-S285 PolarHBondContact OD1-OG 2.97Å; D282-I286 PolarHBondContact O-N 2.98Å; D282-H365 IonicContact OD2-CE1 3.33Å; D282-H365 PolarHBondContact OD2-CE1 3.34Å; D282-H365 IonicContact OD2-NE2 2.71Å; D282-H365 PolarHBondContact OD2-NE2 3.34Å
283	L	91.5	Very high	78.8	Confident	1 Å²	1	73.5 Å²	73.5	1%	0.005	40%	0.4	C	S	.	.	H	α-helix	trans	-56.2	-40.2	-178.6	-179.2	57.7	0	0	0	111.4	S285 I286 C287 V293 E356 F372 F373 Y515 L516	L283-S285 PolarHBondContact O-N 3.35Å; L283-I286 PolarHBondContact O-N 3.4Å; L283-C287 PolarHBondContact O-N 2.88Å; L283-C287 VanDerWaalsContact O-O 3.08Å; L283-V293 HydrophobicContact CD1-CG2 4.36Å; L283-V293 HydrophobicContact CD2-CG1 4.24Å; L283-E356 WeakPolarHBondContact CB-OE2 3.43Å; L283-E356 PolarHBondContact N-OE2 3.07Å; L283-F372 HydrophobicContact CD2-CE1 3.94Å; L283-F372 HydrophobicContact CG-CE1 4.22Å; L283-F373 HydrophobicContact CD2-CE1 3.93Å; L283-F373 HydrophobicContact CD2-CZ 3.69Å; L283-Y515 HydrophobicContact CB-CD1 4.41Å; L283-Y515 HydrophobicContact CB-CE1 3.79Å; L283-Y515 HydrophobicContact CD1-CD1 3.81Å; L283-Y515 HydrophobicContact CD1-CE1 4.07Å; L283-Y515 HydrophobicContact CG-CE1 4.47Å; L283-Y515 PolarHBondContact N-OH 3.35Å; L283-L516 HydrophobicContact CD1-CD2 4.32Å; L283-L516 HydrophobicContact CD2-CD2 4.26Å
284	L	92.2	Very high	79.9	Confident	33 Å²	33	69.7 Å²	69.7	17%	0.173	37%	0.369	C	S	.	.	H	α-helix	trans	-61.8	-29.8	-179.7	-86.9	69.8	0	0	0	113	D282 C287 R368 V369 F372	D282-L284 PolarHBondContact O-N 3.2Å; D282-L284 PolarHBondContact OD1-N 2.88Å; L284-C287 WeakPolarHBondContact CA-O 3.31Å; L284-C287 CarbonylContact O-C 3.24Å; L284-R368 HydrophobicContact CD2-CB 4.49Å; L284-V369 HydrophobicContact CD1-CB 4.43Å; L284-V369 HydrophobicContact CD1-CG1 4.32Å; L284-V369 HydrophobicContact CD1-CG2 4.03Å; L284-V369 HydrophobicContact CD2-CG2 4.08Å; L284-F372 HydrophobicContact CD1-CB 4.13Å; L284-F372 HydrophobicContact CD1-CD1 3.56Å; L284-F372 HydrophobicContact CD1-CE1 4.07Å; L284-F372 HydrophobicContact CD1-CG 3.83Å; L284-F372 HydrophobicContact CD2-CB 4.46Å; L284-F372 HydrophobicContact CG-CB 4.45Å; L284-F372 HydrophobicContact CG-CD1 4.32Å; L284-F372 HydrophobicContact CG-CD2 4.49Å; L284-F372 HydrophobicContact CG-CG 4.17Å
285	S	90.4	Very high	81.4	Confident	70 Å²	70	64.5 Å²	64.5	49%	0.49	35%	0.347	S	S	.	.	H	α-helix	trans	-78.9	-21.7	175.9	71.6	0	0	0	0	113.1	R281 D282 L283	R281-S285 VanDerWaalsContact CA-OG 3.31Å; R281-S285 WeakPolarHBondContact CA-OG 3.44Å; R281-S285 VanDerWaalsContact CB-OG 3.24Å; R281-S285 WeakPolarHBondContact CB-OG 3.45Å; D282-S285 PolarHBondContact N-OG 3.3Å; D282-S285 PolarHBondContact O-N 3.42Å; D282-S285 PolarHBondContact O-OG 3.32Å; D282-S285 WeakPolarHBondContact OD1-CA 3.28Å; D282-S285 WeakPolarHBondContact OD1-CB 3.3Å; D282-S285 PolarHBondContact OD1-N 3.13Å; D282-S285 PolarHBondContact OD1-OG 2.97Å; L283-S285 PolarHBondContact O-N 3.35Å
286	I	92.3	Very high	83.2	Confident	52 Å²	52	60.3 Å²	60.3	27%	0.267	32%	0.319	S	S	.	.	H	α-helix	trans	-86.4	-44.9	175.5	-61.3	172.3	0	0	0	109.9	R281 D282 L283 I512 Y515	R281-I286 HydrophobicContact CB-CD1 4.14Å; R281-I286 HydrophobicContact CB-CG1 3.92Å; D282-I286 PolarHBondContact O-N 2.98Å; L283-I286 PolarHBondContact O-N 3.4Å; I286-I512 HydrophobicContact CG2-CG1 4.09Å; I286-Y515 HydrophobicContact CD1-CD1 4.05Å; I286-Y515 HydrophobicContact CD1-CD2 3.06Å; I286-Y515 HydrophobicContact CD1-CE1 4.4Å; I286-Y515 HydrophobicContact CD1-CE2 3.5Å; I286-Y515 VanDerWaalsContact CD1-CE2 3.5Å; I286-Y515 HydrophobicContact CD1-CG 3.34Å
287	C	94.9	Very high	85.4	Confident	11 Å²	11	51.4 Å²	51.4	7%	0.074	28%	0.278	C	S	.	.			trans	-148.1	120	178.4	-174.8	0	0	0	0	109.7	L283 L284 D289 V293 I512	L283-C287 PolarHBondContact O-N 2.88Å; L283-C287 VanDerWaalsContact O-O 3.08Å; L284-C287 WeakPolarHBondContact CA-O 3.31Å; L284-C287 CarbonylContact O-C 3.24Å; C287-D289 PolarHBondContact SG-O 3.4Å; C287-D289 VanDerWaalsContact SG-O 3.41Å; C287-V293 HydrophobicContact CB-CG2 4.05Å; C287-I512 HydrophobicContact CB-CD1 3.55Å; C287-I512 HydrophobicContact CB-CG1 3.91Å
288	N	94.4	Very high	87.8	Confident	133 Å²	133	48.6 Å²	48.6	71%	0.711	25%	0.254	S	S	*	.			trans	-98.6	4	175.8	63.8	-2.2	0	0	0	112.8
289	D	97.9	Very high	90.1	Very high	53 Å²	53	47.8 Å²	47.8	28%	0.283	25%	0.246	S	C	.	.			trans	-99.3	111	177.7	176.3	38	0	0	0	111	C287 F291 T292 V293	C287-D289 PolarHBondContact SG-O 3.4Å; C287-D289 VanDerWaalsContact SG-O 3.41Å; D289-F291 PolarHBondContact O-N 3.24Å; D289-F291 WeakPolarHBondContact OD1-CD2 3.33Å; D289-F291 PolarHBondContact OD1-N 3.45Å; D289-T292 PolarHBondContact O-N 2.9Å; D289-T292 VanDerWaalsContact OD2-CB 3.3Å; D289-T292 WeakPolarHBondContact OD2-CB 3.31Å; D289-T292 PolarHBondContact OD2-N 3.29Å; D289-T292 PolarHBondContact OD2-OG1 3.45Å; D289-V293 PolarHBondContact O-N 3.15Å
290	P	98.1	Very high	92.5	Very high	19 Å²	19	41.4 Å²	41.4	12%	0.123	21%	0.207	C	C	.	.	H	α-helix	trans	-64.9	-27.8	-178.4	25.4	-33.7	0	0	0	112.7	V293 A294 F372 D375 V376	P290-V293 PolarHBondContact O-N 2.87Å; P290-A294 PolarHBondContact O-N 3.39Å; P290-F372 HydrophobicContact CB-CD2 4.25Å; P290-F372 HydrophobicContact CB-CE2 4.01Å; P290-D375 HydrophobicContact CB-CB 3.8Å; P290-D375 HydrophobicContact CG-CB 3.83Å; P290-V376 HydrophobicContact CB-CB 4.5Å; P290-V376 HydrophobicContact CB-CG2 3.67Å
291	F	97.9	Very high	94.5	Very high	85 Å²	85	37.4 Å²	37.4	37%	0.373	19%	0.188	S	C	.	.	H	α-helix	trans	-66.1	-49.1	178.9	-66.4	-93.2	0	0	0	110.9	D289 V293 A294 Q295 E379	D289-F291 PolarHBondContact O-N 3.24Å; D289-F291 WeakPolarHBondContact OD1-CD2 3.33Å; D289-F291 PolarHBondContact OD1-N 3.45Å; F291-V293 VanDerWaalsContact C-N 3.32Å; F291-V293 PolarHBondContact O-N 3.3Å; F291-A294 PolarHBondContact O-N 3.32Å; F291-Q295 VanDerWaalsContact O-CG 3.29Å; F291-Q295 WeakPolarHBondContact O-CG 3.32Å; F291-Q295 PolarHBondContact O-N 3.41Å; F291-E379 HydrophobicContact CD1-CB 4.37Å; F291-E379 HydrophobicContact CD1-CG 3.69Å; F291-E379 WeakPolarHBondContact CD1-OE2 3.13Å; F291-E379 HydrophobicContact CE1-CG 4.26Å; F291-E379 VanDerWaalsContact CE1-OE2 3.26Å; F291-E379 WeakPolarHBondContact CE1-OE2 3.38Å; F291-E379 HydrophobicContact CG-CG 4.39Å
292	T	98.4	Very high	95.9	Very high	39 Å²	39	28.7 Å²	28.7	24%	0.239	16%	0.155	C	C	.	.	H	α-helix	trans	-58.1	-43.3	176.4	-60.6	0	0	0	0	111.5	D289 Q295 Q296 I512	D289-T292 PolarHBondContact O-N 2.9Å; D289-T292 VanDerWaalsContact OD2-CB 3.3Å; D289-T292 WeakPolarHBondContact OD2-CB 3.31Å; D289-T292 PolarHBondContact OD2-N 3.29Å; D289-T292 PolarHBondContact OD2-OG1 3.45Å; T292-Q295 WeakPolarHBondContact O-CB 3.42Å; T292-Q295 PolarHBondContact O-N 2.97Å; T292-Q296 WeakPolarHBondContact O-CG 3.41Å; T292-Q296 PolarHBondContact O-N 3.05Å; T292-I512 HydrophobicContact CG2-CD1 3.49Å; T292-I512 VanDerWaalsContact CG2-CD1 3.49Å
293	V	98.7	Very high	96.5	Very high	0 Å²	0	31 Å²	31	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-63.3	-44	177.3	174.3	0	0	0	0	111.9	L283 C287 D289 P290 F291 Q295 Q296 L297 F372 V376 I512	L283-V293 HydrophobicContact CD1-CG2 4.36Å; L283-V293 HydrophobicContact CD2-CG1 4.24Å; C287-V293 HydrophobicContact CB-CG2 4.05Å; D289-V293 PolarHBondContact O-N 3.15Å; P290-V293 PolarHBondContact O-N 2.87Å; F291-V293 VanDerWaalsContact C-N 3.32Å; F291-V293 PolarHBondContact O-N 3.3Å; V293-Q295 VanDerWaalsContact C-N 3.28Å; V293-Q295 PolarHBondContact O-N 2.97Å; V293-Q296 PolarHBondContact O-N 2.74Å; V293-Q296 VanDerWaalsContact O-N 3.16Å; V293-L297 HydrophobicContact CG1-CD1 4.23Å; V293-L297 HydrophobicContact CG1-CG 4.39Å; V293-L297 WeakPolarHBondContact O-CG 3.5Å; V293-L297 PolarHBondContact O-N 2.81Å; V293-F372 HydrophobicContact CB-CZ 4.35Å; V293-F372 HydrophobicContact CG2-CE1 4.27Å; V293-F372 HydrophobicContact CG2-CZ 3.75Å; V293-V376 HydrophobicContact CB-CG1 4.45Å; V293-V376 HydrophobicContact CB-CG2 4.09Å; V293-V376 HydrophobicContact CG1-CG1 3.95Å; V293-V376 HydrophobicContact CG1-CG2 4.09Å; V293-I512 HydrophobicContact CG2-CG2 4.44Å
294	A	98.8	Very high	96.7	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.4	-36.5	176.8	0	0	0	0	0	112.4	P290 F291 T298 V376 E379 I383	P290-A294 PolarHBondContact O-N 3.39Å; F291-A294 PolarHBondContact O-N 3.32Å; A294-T298 WeakPolarHBondContact O-CB 3.41Å; A294-T298 PolarHBondContact O-N 2.8Å; A294-T298 PolarHBondContact O-OG1 2.59Å; A294-V376 HydrophobicContact CB-CG1 4.18Å; A294-E379 HydrophobicContact CB-CB 3.69Å; A294-E379 HydrophobicContact CB-CG 3.68Å; A294-I383 HydrophobicContact CB-CD1 4.17Å
295	Q	98.6	Very high	96.9	Very high	43 Å²	43	30.2 Å²	30.2	20%	0.201	16%	0.16	C	C	.	.	H	α-helix	trans	-66.1	-41.9	173.5	-67.8	172.9	7.3	0	0	112.2	F291 T292 V293 T298 H299 I383 F506	F291-Q295 VanDerWaalsContact O-CG 3.29Å; F291-Q295 WeakPolarHBondContact O-CG 3.32Å; F291-Q295 PolarHBondContact O-N 3.41Å; T292-Q295 WeakPolarHBondContact O-CB 3.42Å; T292-Q295 PolarHBondContact O-N 2.97Å; V293-Q295 VanDerWaalsContact C-N 3.28Å; V293-Q295 PolarHBondContact O-N 2.97Å; Q295-T298 WeakPolarHBondContact O-CB 3.26Å; Q295-T298 PolarHBondContact O-N 3.04Å; Q295-H299 PolarHBondContact O-CD2 3.12Å; Q295-H299 PolarHBondContact O-N 3.02Å; Q295-I383 HydrophobicContact CG-CD1 4.36Å; Q295-F506 HydrophobicContact CB-CB 3.78Å; Q295-F506 HydrophobicContact CB-CD1 4.3Å; Q295-F506 HydrophobicContact CB-CD2 3.74Å; Q295-F506 HydrophobicContact CB-CE2 4.41Å; Q295-F506 HydrophobicContact CB-CG 3.68Å; Q295-F506 HydrophobicContact CG-CB 4.02Å; Q295-F506 HydrophobicContact CG-CD1 3.6Å; Q295-F506 HydrophobicContact CG-CD2 3.74Å; Q295-F506 HydrophobicContact CG-CE1 3.93Å; Q295-F506 HydrophobicContact CG-CE2 4.07Å; Q295-F506 HydrophobicContact CG-CG 3.5Å; Q295-F506 HydrophobicContact CG-CZ 4.16Å
296	Q	98.6	Very high	97	Very high	3 Å²	3	29.3 Å²	29.3	1%	0.014	15%	0.154	C	C	.	.	H	α-helix	trans	-68.7	-37.1	176.7	-60.9	-38	-67.4	0	0	112.4	T292 V293 T298 H299 I300 E507 D509 I512 L513 L516	T292-Q296 WeakPolarHBondContact O-CG 3.41Å; T292-Q296 PolarHBondContact O-N 3.05Å; V293-Q296 PolarHBondContact O-N 2.74Å; V293-Q296 VanDerWaalsContact O-N 3.16Å; Q296-T298 VanDerWaalsContact C-N 3.29Å; Q296-T298 PolarHBondContact O-N 3.45Å; Q296-H299 WeakPolarHBondContact O-CB 3.28Å; Q296-H299 PolarHBondContact O-N 3.41Å; Q296-I300 WeakPolarHBondContact O-CG1 3.39Å; Q296-I300 PolarHBondContact O-N 3.44Å; Q296-E507 PolarHBondContact NE2-O 3.11Å; Q296-D509 HydrophobicContact CG-CB 4.35Å; Q296-I512 HydrophobicContact CB-CG2 3.88Å; Q296-I512 HydrophobicContact CG-CB 3.94Å; Q296-I512 HydrophobicContact CG-CD1 4.31Å; Q296-I512 HydrophobicContact CG-CG2 3.66Å; Q296-L513 HydrophobicContact CB-CD2 3.94Å; Q296-L513 HydrophobicContact CB-CG 4.35Å; Q296-L513 WeakPolarHBondContact O-CD2 3.02Å; Q296-L516 HydrophobicContact CB-CD1 4Å
297	L	98.8	Very high	97.1	Very high	1 Å²	1	28.8 Å²	28.8	1%	0.005	15%	0.149	C	C	.	.	H	α-helix	trans	-59.2	-44.3	169.9	-70.7	173.3	0	0	0	110.5	V293 H299 I300 E301 W345 L349 V376 I392 L516	V293-L297 HydrophobicContact CG1-CD1 4.23Å; V293-L297 HydrophobicContact CG1-CG 4.39Å; V293-L297 WeakPolarHBondContact O-CG 3.5Å; V293-L297 PolarHBondContact O-N 2.81Å; L297-H299 VanDerWaalsContact C-N 3.31Å; L297-H299 PolarHBondContact O-N 3.04Å; L297-I300 PolarHBondContact O-N 3.39Å; L297-I300 VanDerWaalsContact O-N 3.1Å; L297-E301 WeakPolarHBondContact O-CG 3.45Å; L297-E301 PolarHBondContact O-N 3.11Å; L297-W345 HydrophobicContact CD2-CH2 4.1Å; L297-W345 HydrophobicContact CD2-CZ2 3.76Å; L297-L349 HydrophobicContact CD2-CD1 3.7Å; L297-L349 HydrophobicContact CD2-CD2 3.92Å; L297-L349 HydrophobicContact CD2-CG 4.48Å; L297-V376 HydrophobicContact CD1-CG1 3.8Å; L297-I392 HydrophobicContact CD1-CD1 3.99Å; L297-L516 HydrophobicContact CD2-CD1 3.96Å; L297-L516 HydrophobicContact CD2-CD2 4.25Å; L297-L516 HydrophobicContact CG-CD1 4.25Å
298	T	98.6	Very high	96.9	Very high	0 Å²	0	28.3 Å²	28.3	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-62.2	-36.2	177.6	-55.9	0	0	0	0	112.6	A294 Q295 Q296 E301 L302 I383 N385 I453 I455 F506	A294-T298 WeakPolarHBondContact O-CB 3.41Å; A294-T298 PolarHBondContact O-N 2.8Å; A294-T298 PolarHBondContact O-OG1 2.59Å; Q295-T298 WeakPolarHBondContact O-CB 3.26Å; Q295-T298 PolarHBondContact O-N 3.04Å; Q296-T298 VanDerWaalsContact C-N 3.29Å; Q296-T298 PolarHBondContact O-N 3.45Å; T298-E301 PolarHBondContact O-N 3.05Å; T298-L302 HydrophobicContact CG2-CD1 3.95Å; T298-L302 HydrophobicContact CG2-CG 4.32Å; T298-L302 WeakPolarHBondContact O-CB 3.43Å; T298-L302 WeakPolarHBondContact O-CG 3.26Å; T298-L302 PolarHBondContact O-N 2.98Å; T298-I383 HydrophobicContact CG2-CG2 3.97Å; T298-N385 PolarHBondContact OG1-ND2 2.83Å; T298-I453 HydrophobicContact CG2-CD1 4.2Å; T298-I453 HydrophobicContact CG2-CG2 4.08Å; T298-I455 HydrophobicContact CG2-CD1 3.89Å; T298-F506 HydrophobicContact CG2-CD2 4.44Å; T298-F506 HydrophobicContact CG2-CE2 4.04Å
299	H	98.2	Very high	96.8	Very high	12 Å²	12	22.1 Å²	22.1	6%	0.056	11%	0.113	C	C	.	.	H	α-helix	trans	-58.2	-48.3	170.2	-88.8	-70	0	0	0	112.3	Q295 Q296 L297 E301 E303 C504 F506 K508 L513	Q295-H299 PolarHBondContact O-CD2 3.12Å; Q295-H299 PolarHBondContact O-N 3.02Å; Q296-H299 WeakPolarHBondContact O-CB 3.28Å; Q296-H299 PolarHBondContact O-N 3.41Å; L297-H299 VanDerWaalsContact C-N 3.31Å; L297-H299 PolarHBondContact O-N 3.04Å; H299-E301 VanDerWaalsContact C-N 3.34Å; H299-E303 VanDerWaalsContact O-CB 3.27Å; H299-E303 WeakPolarHBondContact O-CB 3.28Å; H299-E303 PolarHBondContact O-N 3.04Å; H299-C504 VanDerWaalsContact CE1-CB 3.44Å; H299-C504 WeakPolarHBondContact CE1-CB 3.29Å; H299-C504 PolarHBondContact CE1-SG 2.89Å; H299-C504 VanDerWaalsContact CG-SG 3.51Å; H299-C504 VanDerWaalsContact ND1-CB 3.32Å; H299-C504 WeakPolarHBondContact ND1-CB 3.34Å; H299-C504 PolarHBondContact ND1-SG 3.17Å; H299-C504 VanDerWaalsContact ND1-SG 3.36Å; H299-C504 PolarHBondContact NE2-SG 3.24Å; H299-F506 PolarHBondContact CE1-O 3.31Å; H299-F506 PolarHBondContact NE2-O 3.02Å; H299-K508 VanDerWaalsContact CE1-CG 3.43Å; H299-K508 WeakPolarHBondContact CE1-CG 3.3Å; H299-K508 WeakPolarHBondContact ND1-CE 3.33Å; H299-L513 HydrophobicContact CB-CD2 4.18Å
300	I	98.2	Very high	96.5	Very high	1 Å²	1	19.7 Å²	19.7	1%	0.005	10%	0.1	C	C	.	.	H	α-helix	trans	-63.8	-42.9	-179.4	-62.1	167	0	0	0	110.4	Q296 L297 R304 W345 L513 L516 L517	Q296-I300 WeakPolarHBondContact O-CG1 3.39Å; Q296-I300 PolarHBondContact O-N 3.44Å; L297-I300 PolarHBondContact O-N 3.39Å; L297-I300 VanDerWaalsContact O-N 3.1Å; I300-R304 HydrophobicContact CG2-CG 4.44Å; I300-R304 WeakPolarHBondContact O-CB 3.03Å; I300-R304 VanDerWaalsContact O-CG 3.26Å; I300-R304 WeakPolarHBondContact O-CG 3.14Å; I300-R304 PolarHBondContact O-N 3.01Å; I300-W345 HydrophobicContact CB-CH2 4.39Å; I300-W345 HydrophobicContact CB-CZ2 3.97Å; I300-W345 HydrophobicContact CD1-CH2 3.5Å; I300-W345 HydrophobicContact CD1-CZ2 3.86Å; I300-W345 HydrophobicContact CD1-CZ3 4.24Å; I300-W345 HydrophobicContact CG2-CD2 3.78Å; I300-W345 HydrophobicContact CG2-CE3 4.08Å; I300-W345 HydrophobicContact CG2-CG 4.44Å; I300-W345 HydrophobicContact CG2-CH2 3.89Å; I300-W345 HydrophobicContact CG2-CZ2 3.57Å; I300-W345 HydrophobicContact CG2-CZ3 4.14Å; I300-L513 HydrophobicContact CD1-CD2 3.94Å; I300-L513 HydrophobicContact CG1-CD2 3.63Å; I300-L516 HydrophobicContact CD1-CB 3.95Å; I300-L516 HydrophobicContact CD1-CD1 4.13Å; I300-L517 HydrophobicContact CD1-CD2 3.94Å; I300-L517 HydrophobicContact CD1-CG 3.96Å; I300-L517 HydrophobicContact CG1-CD2 4.21Å; I300-L517 HydrophobicContact CG1-CG 4.42Å; I300-L517 HydrophobicContact CG2-CD2 3.96Å
301	E	98	Very high	96	Very high	0 Å²	0	18.9 Å²	18.9	0%	0	10%	0.095	C	C	.	.	H	α-helix	trans	-62	-53.6	179.1	-64	-79.9	178.7	0	0	111.3	L297 T298 H299 E303 R304 L305 Y342 W345 N387 S388 I455	L297-E301 WeakPolarHBondContact O-CG 3.45Å; L297-E301 PolarHBondContact O-N 3.11Å; T298-E301 PolarHBondContact O-N 3.05Å; H299-E301 VanDerWaalsContact C-N 3.34Å; E301-E303 PolarHBondContact O-N 3.02Å; E301-R304 PolarHBondContact O-N 3.05Å; E301-L305 WeakPolarHBondContact O-CB 3.47Å; E301-L305 VanDerWaalsContact O-CG 3.28Å; E301-L305 WeakPolarHBondContact O-CG 3.33Å; E301-L305 PolarHBondContact O-N 3.39Å; E301-Y342 WeakPolarHBondContact OE2-CE2 3.43Å; E301-Y342 PolarHBondContact OE2-OH 3.26Å; E301-W345 PolarHBondContact OE1-NE1 3.14Å; E301-N387 PolarHBondContact OE1-ND2 3.19Å; E301-N387 PolarHBondContact OE2-ND2 3.44Å; E301-S388 VanDerWaalsContact CG-OG 3.3Å; E301-S388 WeakPolarHBondContact CG-OG 3.47Å; E301-S388 PolarHBondContact OE1-OG 3.47Å; E301-I455 HydrophobicContact CB-CD1 3.69Å; E301-I455 HydrophobicContact CB-CG1 4.44Å; E301-I455 HydrophobicContact CB-CG2 4.28Å; E301-I455 HydrophobicContact CG-CD1 4.42Å
302	L	97.4	Very high	95.5	Very high	7 Å²	7	15.2 Å²	15.2	4%	0.037	8%	0.079	C	C	.	.	H	α-helix	trans	-64.6	-38.6	-178.9	-70.4	174.3	0	0	0	112.5	T298 S306 I453 I455 C504	T298-L302 HydrophobicContact CG2-CD1 3.95Å; T298-L302 HydrophobicContact CG2-CG 4.32Å; T298-L302 WeakPolarHBondContact O-CB 3.43Å; T298-L302 WeakPolarHBondContact O-CG 3.26Å; T298-L302 PolarHBondContact O-N 2.98Å; L302-S306 WeakPolarHBondContact O-CB 3.27Å; L302-S306 PolarHBondContact O-N 2.91Å; L302-I453 HydrophobicContact CD1-CG1 4.43Å; L302-I453 HydrophobicContact CD1-CG2 4.48Å; L302-I455 HydrophobicContact CD2-CD1 4.09Å; L302-I455 HydrophobicContact CD2-CG1 3.91Å; L302-I455 HydrophobicContact CG-CD1 4.08Å; L302-I455 HydrophobicContact CG-CG1 4.45Å; L302-C504 HydrophobicContact CD1-CB 3.67Å
303	E	95.6	Very high	94.9	Very high	89 Å²	89	13.4 Å²	13.4	42%	0.416	7%	0.067	S	C	.	.	H	α-helix	trans	-57.8	-55.7	173.2	-179.7	176.3	-134.9	0	0	110	Y253 H299 E301 L305 S306 Y307	Y253-E303 HydrophobicContact CE2-CG 4.39Å; H299-E303 VanDerWaalsContact O-CB 3.27Å; H299-E303 WeakPolarHBondContact O-CB 3.28Å; H299-E303 PolarHBondContact O-N 3.04Å; E301-E303 PolarHBondContact O-N 3.02Å; E303-L305 PolarHBondContact O-N 3.48Å; E303-S306 WeakPolarHBondContact O-CB 3.29Å; E303-S306 PolarHBondContact O-N 2.66Å; E303-S306 PolarHBondContact O-OG 2.86Å; E303-Y307 HydrophobicContact CG-CE2 4.08Å; E303-Y307 WeakPolarHBondContact O-CD2 2.88Å
304	R	95.3	Very high	94	Very high	15 Å²	15	13.6 Å²	13.6	6%	0.057	7%	0.069	C	C	.	.	H	α-helix	trans	-61.4	-43.2	-177.8	-69.4	175.9	179	-87.6	-7.9	112.8	Y253 I300 E301 S306 Y307 A341 Y342	Y253-R304 WeakPolarHBondContact OH-CA 3.34Å; Y253-R304 WeakPolarHBondContact OH-CG 3.37Å; I300-R304 HydrophobicContact CG2-CG 4.44Å; I300-R304 WeakPolarHBondContact O-CB 3.03Å; I300-R304 VanDerWaalsContact O-CG 3.26Å; I300-R304 WeakPolarHBondContact O-CG 3.14Å; I300-R304 PolarHBondContact O-N 3.01Å; E301-R304 PolarHBondContact O-N 3.05Å; R304-S306 VanDerWaalsContact C-N 3.29Å; R304-S306 PolarHBondContact O-N 3.45Å; R304-Y307 PolarHBondContact O-N 2.78Å; R304-A341 PolarHBondContact NH1-O 3.46Å; R304-A341 VanDerWaalsContact NH1-O 3.15Å; R304-Y342 HydrophobicContact CB-CD2 3.6Å; R304-Y342 HydrophobicContact CB-CE2 4.06Å; R304-Y342 HydrophobicContact CG-CD2 4.48Å
305	L	95.1	Very high	93	Very high	1 Å²	1	15.9 Å²	15.9	1%	0.005	8%	0.079	C	C	.	.	H	α-helix	trans	-59.4	-39.4	177.5	-76.3	-176.3	0	0	0	112.3	E301 E303 Y307 I308 Y342 I455 F458 F496 K500	E301-L305 WeakPolarHBondContact O-CB 3.47Å; E301-L305 VanDerWaalsContact O-CG 3.28Å; E301-L305 WeakPolarHBondContact O-CG 3.33Å; E301-L305 PolarHBondContact O-N 3.39Å; E303-L305 PolarHBondContact O-N 3.48Å; L305-Y307 PolarHBondContact O-N 3.02Å; L305-Y307 VanDerWaalsContact O-N 3.12Å; L305-I308 HydrophobicContact CD2-CD1 3.89Å; L305-I308 PolarHBondContact O-N 3.04Å; L305-Y342 HydrophobicContact CD2-CD1 3.97Å; L305-Y342 HydrophobicContact CD2-CD2 4.44Å; L305-Y342 HydrophobicContact CD2-CE1 3.35Å; L305-Y342 HydrophobicContact CD2-CE2 3.91Å; L305-Y342 HydrophobicContact CD2-CG 4.48Å; L305-Y342 HydrophobicContact CG-CE1 4.23Å; L305-Y342 HydrophobicContact CG-CE2 3.98Å; L305-I455 HydrophobicContact CD1-CB 4.43Å; L305-I455 HydrophobicContact CD1-CG1 4.07Å; L305-I455 HydrophobicContact CD1-CG2 4.07Å; L305-F458 HydrophobicContact CD2-CD2 4.37Å; L305-F458 HydrophobicContact CD2-CE2 4.3Å; L305-F496 HydrophobicContact CD2-CE2 3.64Å; L305-F496 HydrophobicContact CD2-CZ 3.81Å; L305-K500 HydrophobicContact CB-CB 4.19Å
306	S	93.9	Very high	91.5	Very high	52 Å²	52	14.3 Å²	14.3	36%	0.364	7%	0.074	S	C	.	.	H	α-helix	trans	-58.4	-29.4	-177.4	75.9	0	0	0	0	112.9	L302 E303 R304 K500	L302-S306 WeakPolarHBondContact O-CB 3.27Å; L302-S306 PolarHBondContact O-N 2.91Å; E303-S306 WeakPolarHBondContact O-CB 3.29Å; E303-S306 PolarHBondContact O-N 2.66Å; E303-S306 PolarHBondContact O-OG 2.86Å; R304-S306 VanDerWaalsContact C-N 3.29Å; R304-S306 PolarHBondContact O-N 3.45Å; S306-K500 PolarHBondContact O-NZ 3.27Å
307	Y	93.1	Very high	90	Very high	41 Å²	41	14.6 Å²	14.6	16%	0.161	8%	0.075	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.5	-11.8	179.6	-67.6	-81.5	0	0	0	114.5	Y207 V249 L250 Y253 E303 R304 L305 G309 N338	Y207-Y307 PolarHBondContact OH-O 2.96Å; Y207-Y307 VanDerWaalsContact OH-O 3.09Å; V249-Y307 HydrophobicContact CG1-CE1 4.05Å; L250-Y307 HydrophobicContact CD2-CD1 3.52Å; L250-Y307 HydrophobicContact CD2-CE1 4Å; Y253-Y307 VanDerWaalsContact CB-CE1 3.4Å; Y253-Y307 AromaticContact CD1-CD1 3.5Å; Y253-Y307 HydrophobicContact CD1-CD1 3.5Å; Y253-Y307 AromaticContact CD1-CD2 3.7Å; Y253-Y307 HydrophobicContact CD1-CD2 3.7Å; Y253-Y307 AromaticContact CD1-CE1 3.97Å; Y253-Y307 HydrophobicContact CD1-CE1 3.97Å; Y253-Y307 HydrophobicContact CD1-CE2 4.16Å; Y253-Y307 AromaticContact CD1-CG 3.39Å; Y253-Y307 HydrophobicContact CD1-CG 3.39Å; Y253-Y307 HydrophobicContact CD2-CD1 4.38Å; Y253-Y307 AromaticContact CD2-CD2 3.53Å; Y253-Y307 HydrophobicContact CD2-CD2 3.53Å; Y253-Y307 HydrophobicContact CD2-CE1 4.19Å; Y253-Y307 AromaticContact CD2-CE2 3.32Å; Y253-Y307 HydrophobicContact CD2-CE2 3.32Å; Y253-Y307 HydrophobicContact CD2-CG 4.1Å; Y253-Y307 AromaticContact CD2-CZ 3.7Å; Y253-Y307 HydrophobicContact CE1-CD1 4.1Å; Y253-Y307 AromaticContact CE1-CD2 3.63Å; Y253-Y307 HydrophobicContact CE1-CD2 3.63Å; Y253-Y307 HydrophobicContact CE1-CE2 4.42Å; Y253-Y307 AromaticContact CE1-CG 3.48Å; Y253-Y307 HydrophobicContact CE1-CG 3.48Å; Y253-Y307 VanDerWaalsContact CE1-CG 3.48Å; Y253-Y307 AromaticContact CE2-CD2 3.48Å; Y253-Y307 HydrophobicContact CE2-CD2 3.48Å; Y253-Y307 VanDerWaalsContact CE2-CD2 3.48Å; Y253-Y307 AromaticContact CE2-CE2 3.65Å; Y253-Y307 HydrophobicContact CE2-CE2 3.65Å; Y253-Y307 HydrophobicContact CE2-CG 4.19Å; Y253-Y307 AromaticContact CG-CD1 3.65Å; Y253-Y307 HydrophobicContact CG-CD1 3.65Å; Y253-Y307 AromaticContact CG-CD2 3.62Å; Y253-Y307 HydrophobicContact CG-CD2 3.62Å; Y253-Y307 AromaticContact CG-CE1 3.59Å; Y253-Y307 HydrophobicContact CG-CE1 3.59Å; Y253-Y307 AromaticContact CG-CE2 3.6Å; Y253-Y307 HydrophobicContact CG-CE2 3.6Å; Y253-Y307 AromaticContact CG-CG 3.69Å; Y253-Y307 HydrophobicContact CG-CG 3.69Å; Y253-Y307 AromaticContact CG-CZ 3.59Å; Y253-Y307 AromaticContact CZ-CD2 3.51Å; Y253-Y307 AromaticContact CZ-CG 3.88Å; E303-Y307 HydrophobicContact CG-CE2 4.08Å; E303-Y307 WeakPolarHBondContact O-CD2 2.88Å; R304-Y307 PolarHBondContact O-N 2.78Å; L305-Y307 PolarHBondContact O-N 3.02Å; L305-Y307 VanDerWaalsContact O-N 3.12Å; Y307-G309 PolarHBondContact O-N 3.4Å; Y307-N338 PolarHBondContact O-ND2 3.25Å; Y307-N338 VanDerWaalsContact O-ND2 3.13Å
308	I	91.9	Very high	88.3	Confident	0 Å²	0	16.8 Å²	16.8	0%	0	9%	0.088	C	C	.	.			trans	-72.8	116.4	177.4	-59	178.3	0	0	0	109.4	L305 E312 F313 N338 L339 Y342 F458 F496 K500	L305-I308 HydrophobicContact CD2-CD1 3.89Å; L305-I308 PolarHBondContact O-N 3.04Å; I308-E312 WeakPolarHBondContact CA-OE1 3.47Å; I308-E312 HydrophobicContact CG2-CB 4.43Å; I308-F313 HydrophobicContact CG2-CE2 3.8Å; I308-F313 HydrophobicContact CG2-CZ 4.23Å; I308-N338 HydrophobicContact CG1-CB 4.04Å; I308-L339 HydrophobicContact CG2-CD1 4.32Å; I308-Y342 HydrophobicContact CD1-CD1 3.89Å; I308-Y342 HydrophobicContact CD1-CG 3.97Å; I308-F458 HydrophobicContact CD1-CE1 4.48Å; I308-F458 HydrophobicContact CD1-CE2 4.2Å; I308-F458 HydrophobicContact CD1-CZ 3.81Å; I308-F496 HydrophobicContact CB-CE1 4.28Å; I308-F496 HydrophobicContact CB-CZ 4.17Å; I308-F496 HydrophobicContact CD1-CZ 4.31Å; I308-F496 HydrophobicContact CG2-CE1 4.19Å; I308-F496 HydrophobicContact CG2-CZ 4.29Å; I308-K500 PolarHBondContact O-NZ 3.17Å
309	G	91.1	Very high	86.2	Confident	3 Å²	3	20.4 Å²	20.4	3%	0.031	11%	0.105	C	C	.	.			trans	-74.3	143.2	175.7	0	0	0	0	0	112.2	Y307 E311 E312	Y307-G309 PolarHBondContact O-N 3.4Å; G309-E311 PolarHBondContact O-N 2.98Å; G309-E312 PolarHBondContact N-OE1 3.4Å; G309-E312 WeakPolarHBondContact O-CB 3.28Å; G309-E312 PolarHBondContact O-N 3.37Å
310	P	91.9	Very high	83.7	Confident	2 Å²	2	26.8 Å²	26.8	1%	0.013	13%	0.133	C	C	.	.	H	α-helix	trans	-57.7	-32.5	175.2	23.6	-33.2	0	0	0	112.4	F148 L152 T204 F205 E312 F313 V493 M497	F148-P310 HydrophobicContact CE2-CB 4.22Å; F148-P310 HydrophobicContact CE2-CG 4.49Å; F148-P310 HydrophobicContact CZ-CB 4.3Å; L152-P310 HydrophobicContact CD1-CB 4.17Å; L152-P310 WeakPolarHBondContact CD1-O 3.45Å; T204-P310 HydrophobicContact CG2-CG 4.24Å; F205-P310 HydrophobicContact CD1-CG 3.7Å; F205-P310 HydrophobicContact CE1-CB 4.08Å; F205-P310 HydrophobicContact CE1-CG 3.49Å; F205-P310 VanDerWaalsContact CE1-CG 3.49Å; F205-P310 HydrophobicContact CZ-CG 4.33Å; P310-E312 PolarHBondContact O-N 3.33Å; P310-F313 PolarHBondContact O-N 3.29Å; P310-V493 HydrophobicContact CB-CG1 3.63Å; P310-M497 HydrophobicContact CB-CE 4.34Å; P310-M497 HydrophobicContact CB-CG 4.27Å; P310-M497 HydrophobicContact CB-SD 3.87Å; P310-M497 HydrophobicContact CG-CE 3.92Å; P310-M497 HydrophobicContact CG-SD 4.07Å
311	E	88.8	Confident	80.9	Confident	2 Å²	2	31 Å²	31	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-66.5	-20.8	175.9	71.1	-76.6	-177.5	0	0	114.3	F205 Y207 G309 F313 V314 Q315	F205-E311 HydrophobicContact CD1-CB 4.14Å; F205-E311 WeakPolarHBondContact CD1-OE2 3.26Å; F205-E311 HydrophobicContact CE1-CB 4.5Å; Y207-E311 VanDerWaalsContact CB-OE1 3.3Å; Y207-E311 WeakPolarHBondContact CB-OE1 3.22Å; Y207-E311 WeakPolarHBondContact CD2-OE1 2.85Å; G309-E311 PolarHBondContact O-N 2.98Å; E311-F313 VanDerWaalsContact C-N 3.27Å; E311-F313 PolarHBondContact O-N 3.45Å; E311-V314 PolarHBondContact O-N 3.34Å; E311-Q315 WeakPolarHBondContact O-CB 3.4Å; E311-Q315 WeakPolarHBondContact O-CG 3.36Å; E311-Q315 PolarHBondContact O-N 3.45Å; E311-Q315 PolarHBondContact O-NE2 3.02Å
312	E	87.2	Confident	78.1	Confident	8 Å²	8	36.2 Å²	36.2	4%	0.037	19%	0.189	C	C	.	.	H	α-helix	trans	-67.5	-31.1	177.2	-68	-173.5	-109.8	0	0	111.1	I308 G309 P310 A316 A336 S337 N338 L339	I308-E312 WeakPolarHBondContact CA-OE1 3.47Å; I308-E312 HydrophobicContact CG2-CB 4.43Å; G309-E312 PolarHBondContact N-OE1 3.4Å; G309-E312 WeakPolarHBondContact O-CB 3.28Å; G309-E312 PolarHBondContact O-N 3.37Å; P310-E312 PolarHBondContact O-N 3.33Å; E312-A316 WeakPolarHBondContact O-CB 3.35Å; E312-A316 PolarHBondContact O-N 3.19Å; E312-A336 HydrophobicContact CB-CB 4.04Å; E312-A336 HydrophobicContact CG-CB 4.22Å; E312-A336 VanDerWaalsContact OE2-C 3.26Å; E312-A336 WeakPolarHBondContact OE2-CA 3.21Å; E312-S337 PolarHBondContact OE2-N 3.24Å; E312-N338 WeakPolarHBondContact OE1-CB 3.43Å; E312-N338 PolarHBondContact OE1-ND2 3.48Å; E312-N338 PolarHBondContact OE2-N 3.3Å; E312-L339 PolarHBondContact OE2-N 2.86Å; E312-L339 VanDerWaalsContact OE2-N 3.09Å
313	F	84.8	Confident	75.6	Confident	1 Å²	1	43.4 Å²	43.4	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-65.1	-45.8	175	-67.6	-90.6	0	0	0	111.3	I308 P310 E311 A316 F317 F458 L461 I462 I465 V493 F496	I308-F313 HydrophobicContact CG2-CE2 3.8Å; I308-F313 HydrophobicContact CG2-CZ 4.23Å; P310-F313 PolarHBondContact O-N 3.29Å; E311-F313 VanDerWaalsContact C-N 3.27Å; E311-F313 PolarHBondContact O-N 3.45Å; F313-A316 PolarHBondContact O-N 3.48Å; F313-F317 WeakPolarHBondContact O-CD2 3.33Å; F313-F317 WeakPolarHBondContact O-CE2 3.38Å; F313-F458 HydrophobicContact CE1-CE2 4.18Å; F313-F458 HydrophobicContact CE1-CZ 4.1Å; F313-F458 HydrophobicContact CZ-CE2 4.02Å; F313-F458 HydrophobicContact CZ-CZ 4.07Å; F313-L461 HydrophobicContact CE1-CD2 4.4Å; F313-I462 HydrophobicContact CD1-CD1 3.44Å; F313-I462 VanDerWaalsContact CD1-CD1 3.44Å; F313-I462 HydrophobicContact CE1-CD1 3.34Å; F313-I462 HydrophobicContact CZ-CD1 4.45Å; F313-I465 HydrophobicContact CD1-CD1 3.45Å; F313-I465 VanDerWaalsContact CD1-CD1 3.45Å; F313-I465 HydrophobicContact CE1-CD1 3.75Å; F313-I465 HydrophobicContact CG-CD1 4.33Å; F313-V493 HydrophobicContact CB-CG2 4.19Å; F313-V493 HydrophobicContact CD2-CG1 4.22Å; F313-V493 HydrophobicContact CG-CG2 4.32Å; F313-F496 AromaticContact CE2-CD1 3.49Å; F313-F496 HydrophobicContact CE2-CD1 3.49Å; F313-F496 VanDerWaalsContact CE2-CD1 3.49Å; F313-F496 AromaticContact CE2-CE1 3.48Å; F313-F496 HydrophobicContact CE2-CE1 3.48Å; F313-F496 VanDerWaalsContact CE2-CE1 3.48Å; F313-F496 HydrophobicContact CE2-CG 4.26Å; F313-F496 HydrophobicContact CE2-CZ 4.23Å; F313-F496 AromaticContact CZ-CD1 3.48Å; F313-F496 HydrophobicContact CZ-CD1 3.48Å; F313-F496 VanDerWaalsContact CZ-CD1 3.48Å; F313-F496 HydrophobicContact CZ-CD2 4.15Å; F313-F496 AromaticContact CZ-CE1 3.51Å; F313-F496 HydrophobicContact CZ-CE1 3.51Å; F313-F496 HydrophobicContact CZ-CE2 4.17Å; F313-F496 AromaticContact CZ-CG 3.81Å; F313-F496 HydrophobicContact CZ-CG 3.81Å; F313-F496 AromaticContact CZ-CZ 3.86Å; F313-F496 HydrophobicContact CZ-CZ 3.86Å
314	V	81.1	Confident	73	Confident	5 Å²	5	44.3 Å²	44.3	3%	0.03	23%	0.234	C	C	.	.	H	α-helix	trans	-68.9	-42.7	178.9	179.1	0	0	0	0	110.7	L152 L156 E311 A316 F317 V318 L489	L152-V314 HydrophobicContact CD1-CG2 3.49Å; L152-V314 VanDerWaalsContact CD1-CG2 3.49Å; L152-V314 HydrophobicContact CD2-CG2 4.44Å; L152-V314 HydrophobicContact CG-CG2 3.7Å; L156-V314 HydrophobicContact CD1-CG1 4.17Å; L156-V314 HydrophobicContact CD2-CG1 3.47Å; L156-V314 VanDerWaalsContact CD2-CG1 3.47Å; L156-V314 HydrophobicContact CG-CG1 3.65Å; E311-V314 PolarHBondContact O-N 3.34Å; V314-A316 VanDerWaalsContact C-N 3.27Å; V314-A316 PolarHBondContact O-N 3.01Å; V314-F317 PolarHBondContact O-N 2.9Å; V314-F317 VanDerWaalsContact O-N 3.1Å; V314-V318 WeakPolarHBondContact O-CG2 3.48Å; V314-L489 HydrophobicContact CG2-CD2 4.15Å
315	Q	76.1	Confident	70.2	Confident	47 Å²	47	52 Å²	52	22%	0.22	28%	0.276	C	S	.	.	H	α-helix	trans	-65.2	-29.5	179.6	-73.9	169.2	52.6	0	0	113.4	E311 F317 R333	E311-Q315 WeakPolarHBondContact O-CB 3.4Å; E311-Q315 WeakPolarHBondContact O-CG 3.36Å; E311-Q315 PolarHBondContact O-N 3.45Å; E311-Q315 PolarHBondContact O-NE2 3.02Å; Q315-F317 PolarHBondContact O-N 3.41Å; Q315-R333 VanDerWaalsContact CD-NH1 3.27Å
316	A	68	Low	67.6	Low	10 Å²	10	58 Å²	58	8%	0.083	31%	0.308	C	S	.	.	H	α-helix	trans	-60.3	-27	174.5	0	0	0	0	0	111.9	F28 E312 F313 V314 L339	F28-A316 WeakPolarHBondContact CE1-O 3.31Å; F28-A316 HydrophobicContact CZ-CB 4.04Å; F28-A316 WeakPolarHBondContact CZ-O 3.48Å; E312-A316 WeakPolarHBondContact O-CB 3.35Å; E312-A316 PolarHBondContact O-N 3.19Å; F313-A316 PolarHBondContact O-N 3.48Å; V314-A316 VanDerWaalsContact C-N 3.27Å; V314-A316 PolarHBondContact O-N 3.01Å; A316-L339 HydrophobicContact CB-CD2 3.82Å
317	F	66.3	Low	65	Low	10 Å²	10	64.4 Å²	64.4	4%	0.044	33%	0.33	C	S	.	.	T	Hydrogen-bonded Turn	trans	-113.3	13	-172.5	-43.8	-50.6	0	0	0	113.7	F28 F313 V314 Q315 H319 I462 I465 Y466	F28-F317 HydrophobicContact CE1-CD1 4.26Å; F313-F317 WeakPolarHBondContact O-CD2 3.33Å; F313-F317 WeakPolarHBondContact O-CE2 3.38Å; V314-F317 PolarHBondContact O-N 2.9Å; V314-F317 VanDerWaalsContact O-N 3.1Å; Q315-F317 PolarHBondContact O-N 3.41Å; F317-H319 PolarHBondContact O-N 3.48Å; F317-H319 VanDerWaalsContact O-N 3.07Å; F317-H319 PolarHBondContact O-ND1 2.68Å; F317-H319 VanDerWaalsContact O-ND1 3.12Å; F317-I462 HydrophobicContact CE1-CG2 4.07Å; F317-I462 HydrophobicContact CZ-CG2 3.92Å; F317-I465 HydrophobicContact CD2-CG2 4.34Å; F317-I465 HydrophobicContact CE2-CB 4.08Å; F317-I465 HydrophobicContact CE2-CG2 3.53Å; F317-I465 HydrophobicContact CZ-CB 4.43Å; F317-I465 HydrophobicContact CZ-CG2 4.34Å; F317-Y466 HydrophobicContact CB-CD2 4.31Å; F317-Y466 AromaticContact CD1-CD2 3.42Å; F317-Y466 HydrophobicContact CD1-CD2 3.42Å; F317-Y466 VanDerWaalsContact CD1-CD2 3.42Å; F317-Y466 HydrophobicContact CD1-CE2 4.37Å; F317-Y466 HydrophobicContact CD1-CG 4.16Å; F317-Y466 AromaticContact CE1-CD2 3.9Å; F317-Y466 HydrophobicContact CE1-CD2 3.9Å; F317-Y466 HydrophobicContact CE1-CG 4.2Å; F317-Y466 AromaticContact CG-CD2 3.96Å; F317-Y466 HydrophobicContact CG-CD2 3.96Å
318	V	64	Low	62.4	Low	47 Å²	47	64.2 Å²	64.2	29%	0.285	34%	0.335	S	S	.	.			trans	-75.4	99.9	173.8	-178.4	0	0	0	0	108.5	L156 V314 F330	L156-V318 HydrophobicContact CD2-CG2 3.7Å; V314-V318 WeakPolarHBondContact O-CG2 3.48Å; V318-F330 HydrophobicContact CG1-CB 4.33Å; V318-F330 HydrophobicContact CG1-CD2 3.89Å; V318-F330 HydrophobicContact CG1-CE2 4.47Å; V318-F330 HydrophobicContact CG1-CG 4.09Å
319	H	54.4	Low	60	Low	76 Å²	76	67.9 Å²	67.9	35%	0.352	36%	0.36	S	S	.	.			trans	-58.4	143.7	170.9	-65.5	70.6	0	0	0	111.6	D25 F317 D321 E470	D25-H319 IonicContact OD1-CD2 2.76Å; D25-H319 PolarHBondContact OD1-CD2 3.42Å; D25-H319 IonicContact OD1-CE1 3.72Å; D25-H319 IonicContact OD1-NE2 3.51Å; D25-H319 PolarHBondContact OD1-NE2 3.24Å; D25-H319 IonicContact OD2-NE2 3.23Å; F317-H319 PolarHBondContact O-N 3.48Å; F317-H319 VanDerWaalsContact O-N 3.07Å; F317-H319 PolarHBondContact O-ND1 2.68Å; F317-H319 VanDerWaalsContact O-ND1 3.12Å; H319-D321 PolarHBondContact O-N 3.39Å; H319-E470 VanDerWaalsContact CE1-CD 3.42Å; H319-E470 IonicContact CE1-OE1 2.7Å; H319-E470 PolarHBondContact CE1-OE1 2.81Å; H319-E470 IonicContact CE1-OE2 3.84Å; H319-E470 PolarHBondContact CE1-OE2 2.83Å; H319-E470 IonicContact ND1-OE1 3.43Å; H319-E470 IonicContact NE2-OE2 3.37Å
320	K	45.1	Very low	58	Low	146 Å²	146	70.4 Å²	70.4	64%	0.635	37%	0.37	S	S	*	.			trans	-77.6	100.4	152.7	-74	-179.7	175.8	-178.1	0	106.3	P322	K320-P322 WeakPolarHBondContact O-CD 3.29Å
321	D	40.6	Very low	55.6	Low	88 Å²	88	74 Å²	74	47%	0.471	40%	0.395	S	S	.	.			trans	-62.3	119	167.2	-168.5	-25	0	0	0	108	H319 L323 D324	H319-D321 PolarHBondContact O-N 3.39Å; D321-L323 PolarHBondContact O-N 3.43Å; D321-L323 WeakPolarHBondContact OD1-CB 3Å; D321-L323 PolarHBondContact OD1-N 2.79Å; D321-D324 HydrophobicContact CB-CB 4.29Å; D321-D324 PolarHBondContact O-N 2.92Å
322	P	39.3	Very low	53.3	Low	111 Å²	111	81.3 Å²	81.3	72%	0.721	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.3	-13.3	179.7	-16	30.8	0	0	0	113.4	K320	K320-P322 WeakPolarHBondContact O-CD 3.29Å
323	L	43.4	Very low	51.5	Low	158 Å²	158	84.9 Å²	84.9	83%	0.827	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97	-10.4	-178.9	-67.5	166.6	0	0	0	113.3	D321 N325	D321-L323 PolarHBondContact O-N 3.43Å; D321-L323 WeakPolarHBondContact OD1-CB 3Å; D321-L323 PolarHBondContact OD1-N 2.79Å; L323-N325 PolarHBondContact O-N 3.39Å; L323-N325 VanDerWaalsContact O-N 3.11Å
324	D	41.2	Very low	49.8	Very low	107 Å²	107	93.8 Å²	93.8	57%	0.572	49%	0.486	S	S	*	.			trans	-77	96.8	168.7	-109.5	-18.4	0	0	0	108.9	D321 D326	D321-D324 HydrophobicContact CB-CB 4.29Å; D321-D324 PolarHBondContact O-N 2.92Å; D324-D326 PolarHBondContact O-N 3.22Å
325	N	37	Very low	48.4	Very low	176 Å²	176	100.6 Å²	100.6	94%	0.941	52%	0.515	S	S	*	.			trans	-67.1	-9.5	170	-115.1	-14.2	0	0	0	112.3	L323	L323-N325 PolarHBondContact O-N 3.39Å; L323-N325 VanDerWaalsContact O-N 3.11Å
326	D	39.9	Very low	47.6	Very low	127 Å²	127	99.2 Å²	99.2	68%	0.679	51%	0.512	S	S	*	.	S	Bend	trans	-79	121.3	166.2	-144.4	11.4	0	0	0	106.9	D324 S328	D324-D326 PolarHBondContact O-N 3.22Å; D326-S328 PolarHBondContact O-N 2.91Å
327	K	39.9	Very low	47.9	Very low	188 Å²	188	101.3 Å²	101.3	82%	0.817	53%	0.526	S	S	*	.			trans	-43.3	110	175.3	-71.9	171.9	179.2	173.2	0	107.3	C329	K327-C329 PolarHBondContact O-N 3.31Å
328	S	38.8	Very low	48.9	Very low	37 Å²	37	101 Å²	101	26%	0.259	53%	0.525	S	S	.	.			trans	-40.5	121.3	-179.9	63.8	0	0	0	0	107.7	D326 F330 S331	D326-S328 PolarHBondContact O-N 2.91Å; S328-F330 PolarHBondContact O-N 3.47Å; S328-S331 PolarHBondContact O-N 3.33Å
329	C	41.6	Very low	49.9	Very low	77 Å²	77	98.8 Å²	98.8	52%	0.52	51%	0.511	S	S	.	.	T	Hydrogen-bonded Turn	trans	-46.6	-17.3	-175.9	-104.4	0	0	0	0	113.3	H159 K327	H159-C329 VanDerWaalsContact CE1-C 3.49Å; H159-C329 PolarHBondContact CE1-O 2.88Å; H159-C329 WeakPolarHBondContact NE2-CB 3.4Å; H159-C329 PolarHBondContact NE2-O 3.25Å; H159-C329 PolarHBondContact NE2-SG 3.41Å; H159-C329 VanDerWaalsContact NE2-SG 3.4Å; K327-C329 PolarHBondContact O-N 3.31Å
330	F	49.5	Very low	51.1	Low	55 Å²	55	99.5 Å²	99.5	24%	0.241	52%	0.515	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110.3	12.6	-161.4	-53	-78.4	0	0	0	115.9	R155 H159 V318 S328 D332	R155-F330 WeakPolarHBondContact O-CE1 3.38Å; R155-F330 WeakPolarHBondContact O-CZ 3.48Å; H159-F330 AromaticContact CE1-CD1 3.66Å; H159-F330 AromaticContact CE1-CE1 3.58Å; H159-F330 AromaticContact ND1-CE1 3.72Å; V318-F330 HydrophobicContact CG1-CB 4.33Å; V318-F330 HydrophobicContact CG1-CD2 3.89Å; V318-F330 HydrophobicContact CG1-CE2 4.47Å; V318-F330 HydrophobicContact CG1-CG 4.09Å; S328-F330 PolarHBondContact O-N 3.47Å; F330-D332 VanDerWaalsContact C-N 3.29Å; F330-D332 PolarHBondContact O-N 3.29Å
331	S	39.9	Very low	53.1	Low	79 Å²	79	93.3 Å²	93.3	55%	0.552	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-21.2	-172.9	64.6	0	0	0	0	116	S328	S328-S331 PolarHBondContact O-N 3.33Å
332	D	42	Very low	55.4	Low	154 Å²	154	89.2 Å²	89.2	82%	0.824	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.6	2.3	-168.4	-69.3	-7.5	0	0	0	114.3	F330 K334	F330-D332 VanDerWaalsContact C-N 3.29Å; F330-D332 PolarHBondContact O-N 3.29Å; D332-K334 PolarHBondContact O-N 3.06Å
333	R	49.7	Very low	57.6	Low	84 Å²	84	84.5 Å²	84.5	32%	0.317	44%	0.438	S	S	.	.	S	Bend	trans	-73.3	118.2	177.1	-69.7	-168.4	167.4	-135.4	-9.2	109.3	Q315 K335	Q315-R333 VanDerWaalsContact CD-NH1 3.27Å; R333-K335 PolarHBondContact O-N 2.89Å
334	K	48.3	Very low	59.5	Low	187 Å²	187	81.1 Å²	81.1	81%	0.813	42%	0.421	S	S	*	.			trans	-43.8	113.7	157.8	-79.3	179.9	176.9	178.9	0	106.2	D332	D332-K334 PolarHBondContact O-N 3.06Å
335	K	52.3	Low	62.1	Low	148 Å²	148	76.2 Å²	76.2	64%	0.643	39%	0.394	S	S	*	.			trans	-40.8	149.4	179	-65	177.7	174.6	-172.1	0	110.4	R333 S337	R333-K335 PolarHBondContact O-N 2.89Å; K335-S337 WeakPolarHBondContact O-CA 3.37Å; K335-S337 WeakPolarHBondContact O-CB 3.15Å; K335-S337 PolarHBondContact O-N 2.84Å
336	A	57.5	Low	64.7	Low	19 Å²	19	68.7 Å²	68.7	16%	0.157	35%	0.353	C	S	.	.			trans	-47.5	82.3	176.2	0	0	0	0	0	112.2	E312 N338 L339 E340	E312-A336 HydrophobicContact CB-CB 4.04Å; E312-A336 HydrophobicContact CG-CB 4.22Å; E312-A336 VanDerWaalsContact OE2-C 3.26Å; E312-A336 WeakPolarHBondContact OE2-CA 3.21Å; A336-N338 PolarHBondContact O-N 3.15Å; A336-L339 HydrophobicContact CB-CB 3.78Å; A336-L339 HydrophobicContact CB-CD2 4.11Å; A336-L339 WeakPolarHBondContact O-CB 3.42Å; A336-L339 PolarHBondContact O-N 3.23Å; A336-E340 WeakPolarHBondContact O-CB 3.45Å; A336-E340 PolarHBondContact O-N 3.38Å
337	S	75.6	Confident	67.1	Low	54 Å²	54	64.2 Å²	64.2	38%	0.378	33%	0.329	S	S	.	.	H	α-helix	trans	-77.7	-28.9	-160.4	55.1	0	0	0	0	111.4	E312 K335 A341	E312-S337 PolarHBondContact OE2-N 3.24Å; K335-S337 WeakPolarHBondContact O-CA 3.37Å; K335-S337 WeakPolarHBondContact O-CB 3.15Å; K335-S337 PolarHBondContact O-N 2.84Å; S337-A341 WeakPolarHBondContact O-CB 3.47Å; S337-A341 PolarHBondContact O-N 2.52Å
338	N	87.2	Confident	69.6	Low	3 Å²	3	57.3 Å²	57.3	2%	0.016	30%	0.298	C	S	.	.	H	α-helix	trans	-79.2	-37.6	176.3	-51.6	-59.5	0	0	0	110.4	Y207 Y307 I308 E312 A336 A341 Y342	Y207-N338 PolarHBondContact OH-ND2 3.31Å; Y307-N338 PolarHBondContact O-ND2 3.25Å; Y307-N338 VanDerWaalsContact O-ND2 3.13Å; I308-N338 HydrophobicContact CG1-CB 4.04Å; E312-N338 WeakPolarHBondContact OE1-CB 3.43Å; E312-N338 PolarHBondContact OE1-ND2 3.48Å; E312-N338 PolarHBondContact OE2-N 3.3Å; A336-N338 PolarHBondContact O-N 3.15Å; N338-A341 PolarHBondContact O-N 3.1Å; N338-Y342 VanDerWaalsContact O-CB 3.29Å; N338-Y342 WeakPolarHBondContact O-CB 3.23Å; N338-Y342 PolarHBondContact O-N 2.91Å
339	L	84.4	Confident	72.4	Confident	1 Å²	1	55.7 Å²	55.7	1%	0.005	29%	0.286	C	S	.	.	H	α-helix	trans	-57.4	-51.8	172.7	-166.3	76	0	0	0	111.2	L32 I308 E312 A316 A336 Y342 V343 F458 I462	L32-L339 HydrophobicContact CD1-CD2 4.01Å; I308-L339 HydrophobicContact CG2-CD1 4.32Å; E312-L339 PolarHBondContact OE2-N 2.86Å; E312-L339 VanDerWaalsContact OE2-N 3.09Å; A316-L339 HydrophobicContact CB-CD2 3.82Å; A336-L339 HydrophobicContact CB-CB 3.78Å; A336-L339 HydrophobicContact CB-CD2 4.11Å; A336-L339 WeakPolarHBondContact O-CB 3.42Å; A336-L339 PolarHBondContact O-N 3.23Å; L339-Y342 PolarHBondContact O-N 2.99Å; L339-V343 WeakPolarHBondContact O-CG2 3.47Å; L339-V343 PolarHBondContact O-N 3.04Å; L339-F458 HydrophobicContact CD1-CE1 3.31Å; L339-F458 HydrophobicContact CD1-CZ 3.28Å; L339-F458 HydrophobicContact CG-CE1 4.24Å; L339-I462 HydrophobicContact CD1-CD1 3.76Å; L339-I462 HydrophobicContact CD2-CD1 4.47Å
340	E	80.6	Confident	75	Confident	91 Å²	91	52.1 Å²	52.1	43%	0.425	26%	0.263	S	S	.	.	H	α-helix	trans	-61.7	-46.4	176.5	-173	174.8	-172.8	0	0	111.2	A336 Y342 V343 D344	A336-E340 WeakPolarHBondContact O-CB 3.45Å; A336-E340 PolarHBondContact O-N 3.38Å; E340-Y342 PolarHBondContact O-N 2.86Å; E340-V343 WeakPolarHBondContact O-CB 3.46Å; E340-V343 PolarHBondContact O-N 3.2Å; E340-V343 VanDerWaalsContact O-N 3.15Å; E340-D344 PolarHBondContact O-N 3.03Å
341	A	86.1	Confident	77.1	Confident	16 Å²	16	52.8 Å²	52.8	13%	0.132	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-26.3	176.8	0	0	0	0	0	113.6	L257 R304 S337 N338 W345	L257-A341 HydrophobicContact CD1-CB 4Å; R304-A341 PolarHBondContact NH1-O 3.46Å; R304-A341 VanDerWaalsContact NH1-O 3.15Å; S337-A341 WeakPolarHBondContact O-CB 3.47Å; S337-A341 PolarHBondContact O-N 2.52Å; N338-A341 PolarHBondContact O-N 3.1Å; A341-W345 PolarHBondContact O-N 3.18Å; A341-W345 VanDerWaalsContact O-N 3.14Å
342	Y	90.1	Very high	79.9	Confident	2 Å²	2	49.1 Å²	49.1	1%	0.008	24%	0.238	C	C	.	.	H	α-helix	trans	-79.4	-37.9	176.4	-170.2	-121.1	0	0	0	112.1	E301 R304 L305 I308 N338 L339 E340 W345 F346 N387 F458	E301-Y342 WeakPolarHBondContact OE2-CE2 3.43Å; E301-Y342 PolarHBondContact OE2-OH 3.26Å; R304-Y342 HydrophobicContact CB-CD2 3.6Å; R304-Y342 HydrophobicContact CB-CE2 4.06Å; R304-Y342 HydrophobicContact CG-CD2 4.48Å; L305-Y342 HydrophobicContact CD2-CD1 3.97Å; L305-Y342 HydrophobicContact CD2-CD2 4.44Å; L305-Y342 HydrophobicContact CD2-CE1 3.35Å; L305-Y342 HydrophobicContact CD2-CE2 3.91Å; L305-Y342 HydrophobicContact CD2-CG 4.48Å; L305-Y342 HydrophobicContact CG-CE1 4.23Å; L305-Y342 HydrophobicContact CG-CE2 3.98Å; I308-Y342 HydrophobicContact CD1-CD1 3.89Å; I308-Y342 HydrophobicContact CD1-CG 3.97Å; N338-Y342 VanDerWaalsContact O-CB 3.29Å; N338-Y342 WeakPolarHBondContact O-CB 3.23Å; N338-Y342 PolarHBondContact O-N 2.91Å; L339-Y342 PolarHBondContact O-N 2.99Å; E340-Y342 PolarHBondContact O-N 2.86Å; Y342-W345 WeakPolarHBondContact O-CB 3.1Å; Y342-W345 PolarHBondContact O-N 3.06Å; Y342-F346 PolarHBondContact O-N 3.12Å; Y342-F346 VanDerWaalsContact O-N 3.15Å; Y342-N387 PolarHBondContact OH-ND2 2.7Å; Y342-F458 HydrophobicContact CD1-CB 4.19Å; Y342-F458 AromaticContact CD1-CD1 3.49Å; Y342-F458 HydrophobicContact CD1-CD1 3.49Å; Y342-F458 VanDerWaalsContact CD1-CD1 3.49Å; Y342-F458 AromaticContact CD1-CD2 3.97Å; Y342-F458 HydrophobicContact CD1-CD2 3.97Å; Y342-F458 AromaticContact CD1-CE1 3.72Å; Y342-F458 HydrophobicContact CD1-CE1 3.72Å; Y342-F458 HydrophobicContact CD1-CE2 4.19Å; Y342-F458 AromaticContact CD1-CG 3.62Å; Y342-F458 HydrophobicContact CD1-CG 3.62Å; Y342-F458 HydrophobicContact CD1-CZ 4.06Å; Y342-F458 HydrophobicContact CE1-CB 3.62Å; Y342-F458 AromaticContact CE1-CD1 3.8Å; Y342-F458 HydrophobicContact CE1-CD1 3.8Å; Y342-F458 AromaticContact CE1-CD2 3.59Å; Y342-F458 HydrophobicContact CE1-CD2 3.59Å; Y342-F458 HydrophobicContact CE1-CE1 4.32Å; Y342-F458 HydrophobicContact CE1-CE2 4.15Å; Y342-F458 AromaticContact CE1-CG 3.38Å; Y342-F458 HydrophobicContact CE1-CG 3.38Å; Y342-F458 HydrophobicContact CE1-CZ 4.48Å
343	V	83.9	Confident	82.5	Confident	11 Å²	11	41.8 Å²	41.8	7%	0.067	20%	0.199	C	C	.	.	H	α-helix	trans	-61.9	-45.6	168.7	170	0	0	0	0	110.7	L32 L339 E340 W345 F346 N347	L32-V343 WeakPolarHBondContact O-CG1 3.35Å; L32-V343 VanDerWaalsContact O-CG2 3.25Å; L32-V343 WeakPolarHBondContact O-CG2 3.3Å; L339-V343 WeakPolarHBondContact O-CG2 3.47Å; L339-V343 PolarHBondContact O-N 3.04Å; E340-V343 WeakPolarHBondContact O-CB 3.46Å; E340-V343 PolarHBondContact O-N 3.2Å; E340-V343 VanDerWaalsContact O-N 3.15Å; V343-W345 PolarHBondContact O-N 3.07Å; V343-F346 WeakPolarHBondContact O-CB 3.46Å; V343-F346 PolarHBondContact O-N 3.38Å; V343-F346 VanDerWaalsContact O-N 3.1Å; V343-N347 PolarHBondContact O-N 3.29Å; V343-N347 PolarHBondContact O-ND2 3.15Å
344	D	84.8	Confident	84.7	Confident	88 Å²	88	37.8 Å²	37.8	47%	0.471	18%	0.184	S	C	.	.	H	α-helix	trans	-59.6	-37	176.7	-80.4	-16.4	0	0	0	112	E340 N347 R348	E340-D344 PolarHBondContact O-N 3.03Å; D344-N347 PolarHBondContact O-N 3.31Å; D344-R348 WeakPolarHBondContact O-CB 3.28Å; D344-R348 PolarHBondContact O-N 3.14Å
345	W	94.4	Very high	87	Confident	3 Å²	3	29 Å²	29	1%	0.011	15%	0.146	C	C	.	.	H	α-helix	trans	-61.7	-47	173.3	166.8	-109.8	0	0	0	112.2	L297 I300 E301 A341 Y342 V343 N347 R348 L349 L516 L517	L297-W345 HydrophobicContact CD2-CH2 4.1Å; L297-W345 HydrophobicContact CD2-CZ2 3.76Å; I300-W345 HydrophobicContact CB-CH2 4.39Å; I300-W345 HydrophobicContact CB-CZ2 3.97Å; I300-W345 HydrophobicContact CD1-CH2 3.5Å; I300-W345 HydrophobicContact CD1-CZ2 3.86Å; I300-W345 HydrophobicContact CD1-CZ3 4.24Å; I300-W345 HydrophobicContact CG2-CD2 3.78Å; I300-W345 HydrophobicContact CG2-CE3 4.08Å; I300-W345 HydrophobicContact CG2-CG 4.44Å; I300-W345 HydrophobicContact CG2-CH2 3.89Å; I300-W345 HydrophobicContact CG2-CZ2 3.57Å; I300-W345 HydrophobicContact CG2-CZ3 4.14Å; E301-W345 PolarHBondContact OE1-NE1 3.14Å; A341-W345 PolarHBondContact O-N 3.18Å; A341-W345 VanDerWaalsContact O-N 3.14Å; Y342-W345 WeakPolarHBondContact O-CB 3.1Å; Y342-W345 PolarHBondContact O-N 3.06Å; V343-W345 PolarHBondContact O-N 3.07Å; W345-N347 VanDerWaalsContact C-N 3.33Å; W345-N347 PolarHBondContact O-N 3.18Å; W345-R348 PolarHBondContact O-N 3.01Å; W345-L349 HydrophobicContact CZ2-CB 4.43Å; W345-L349 HydrophobicContact CZ2-CD2 4.2Å; W345-L349 WeakPolarHBondContact O-CB 3.46Å; W345-L349 PolarHBondContact O-N 2.66Å; W345-L516 HydrophobicContact CH2-CB 4.44Å; W345-L517 HydrophobicContact CE3-CD2 4.41Å; W345-L517 HydrophobicContact CZ3-CD2 4.02Å
346	F	93.2	Very high	89	Confident	19 Å²	19	22.3 Å²	22.3	8%	0.083	12%	0.117	C	C	.	.	H	α-helix	trans	-56.4	-47.7	175.8	174.4	-84.1	0	0	0	111.6	Y342 V343 L349 S350 M390 A391 F457	Y342-F346 PolarHBondContact O-N 3.12Å; Y342-F346 VanDerWaalsContact O-N 3.15Å; V343-F346 WeakPolarHBondContact O-CB 3.46Å; V343-F346 PolarHBondContact O-N 3.38Å; V343-F346 VanDerWaalsContact O-N 3.1Å; F346-L349 PolarHBondContact O-N 3.41Å; F346-S350 PolarHBondContact O-N 2.93Å; F346-S350 PolarHBondContact O-OG 3.36Å; F346-M390 HydrophobicContact CE2-CB 4Å; F346-M390 HydrophobicContact CE2-CG 4.07Å; F346-M390 HydrophobicContact CZ-CG 4.13Å; F346-A391 HydrophobicContact CD2-CB 3.69Å; F346-A391 HydrophobicContact CE2-CB 3.69Å; F346-A391 VanDerWaalsContact CE2-N 3.33Å; F346-A391 HydrophobicContact CG-CB 4.25Å; F346-A391 HydrophobicContact CZ-CB 4.23Å; F346-F457 HydrophobicContact CE2-CD2 4.46Å; F346-F457 HydrophobicContact CE2-CE2 4.08Å; F346-F457 HydrophobicContact CZ-CE2 4.26Å
347	N	88.3	Confident	90.9	Very high	32 Å²	32	21.4 Å²	21.4	17%	0.171	11%	0.109	C	C	.	.	H	α-helix	trans	-62.8	-49.6	178.6	-69.8	-40	0	0	0	110.5	G34 V343 D344 W345 L349 S350 Y351	G34-N347 WeakPolarHBondContact CA-ND2 3.25Å; V343-N347 PolarHBondContact O-N 3.29Å; V343-N347 PolarHBondContact O-ND2 3.15Å; D344-N347 PolarHBondContact O-N 3.31Å; W345-N347 VanDerWaalsContact C-N 3.33Å; W345-N347 PolarHBondContact O-N 3.18Å; N347-L349 VanDerWaalsContact C-N 3.31Å; N347-L349 PolarHBondContact O-N 2.89Å; N347-S350 WeakPolarHBondContact O-CB 3.42Å; N347-S350 PolarHBondContact O-N 3.14Å; N347-S350 VanDerWaalsContact O-N 3.11Å; N347-Y351 VanDerWaalsContact O-CD2 3.31Å; N347-Y351 WeakPolarHBondContact O-CD2 3.46Å; N347-Y351 PolarHBondContact O-N 3.32Å
348	R	93.9	Very high	91.7	Very high	44 Å²	44	18.9 Å²	18.9	17%	0.166	9%	0.091	C	C	.	.	H	α-helix	trans	-55	-46.1	178.1	175.6	171.4	170.7	56.5	19.8	111.8	D344 W345 Y351 L352 L516 L517 A519 V521	D344-R348 WeakPolarHBondContact O-CB 3.28Å; D344-R348 PolarHBondContact O-N 3.14Å; W345-R348 PolarHBondContact O-N 3.01Å; R348-Y351 PolarHBondContact O-N 3.09Å; R348-L352 VanDerWaalsContact O-CB 3.25Å; R348-L352 WeakPolarHBondContact O-CB 3.41Å; R348-L352 PolarHBondContact O-N 3.01Å; R348-L516 PolarHBondContact NH2-O 3.01Å; R348-L517 VanDerWaalsContact CZ-O 3.29Å; R348-L517 PolarHBondContact NE-O 2.98Å; R348-L517 VanDerWaalsContact NH2-C 3.31Å; R348-L517 PolarHBondContact NH2-O 3.05Å; R348-L517 VanDerWaalsContact NH2-O 3.12Å; R348-A519 PolarHBondContact NH1-O 3.41Å; R348-A519 VanDerWaalsContact NH1-O 3.11Å; R348-A519 PolarHBondContact NH2-O 3.26Å; R348-V521 HydrophobicContact CG-CG2 4.4Å
349	L	97.6	Very high	91.7	Very high	2 Å²	2	21.4 Å²	21.4	1%	0.01	11%	0.105	C	C	.	.	H	α-helix	trans	-62.1	-44.6	177.5	177.7	57.1	0	0	0	111.3	L297 W345 F346 N347 Y351 L352 V353 A391	L297-L349 HydrophobicContact CD2-CD1 3.7Å; L297-L349 HydrophobicContact CD2-CD2 3.92Å; L297-L349 HydrophobicContact CD2-CG 4.48Å; W345-L349 HydrophobicContact CZ2-CB 4.43Å; W345-L349 HydrophobicContact CZ2-CD2 4.2Å; W345-L349 WeakPolarHBondContact O-CB 3.46Å; W345-L349 PolarHBondContact O-N 2.66Å; F346-L349 PolarHBondContact O-N 3.41Å; N347-L349 VanDerWaalsContact C-N 3.31Å; N347-L349 PolarHBondContact O-N 2.89Å; L349-Y351 PolarHBondContact O-N 3.43Å; L349-L352 PolarHBondContact O-N 3.29Å; L349-V353 HydrophobicContact CD1-CG2 4.36Å; L349-V353 WeakPolarHBondContact O-CG2 3.46Å; L349-V353 PolarHBondContact O-N 2.88Å; L349-A391 HydrophobicContact CB-CB 4.11Å; L349-A391 HydrophobicContact CD2-CB 3.7Å; L349-A391 HydrophobicContact CG-CB 3.87Å
350	S	95.3	Very high	91.7	Very high	3 Å²	3	22.3 Å²	22.3	2%	0.021	11%	0.111	C	C	.	.	H	α-helix	trans	-58.7	-47.8	177.3	-55.9	0	0	0	0	111.9	F346 N347 V353 A354 A391 G395	F346-S350 PolarHBondContact O-N 2.93Å; F346-S350 PolarHBondContact O-OG 3.36Å; N347-S350 WeakPolarHBondContact O-CB 3.42Å; N347-S350 PolarHBondContact O-N 3.14Å; N347-S350 VanDerWaalsContact O-N 3.11Å; S350-V353 PolarHBondContact O-N 2.98Å; S350-A354 PolarHBondContact O-N 2.96Å; S350-A354 VanDerWaalsContact O-N 3.16Å; S350-A391 WeakPolarHBondContact CA-O 3.36Å; S350-A391 WeakPolarHBondContact CB-O 3.41Å; S350-A391 WeakPolarHBondContact OG-CA 3.33Å; S350-A391 PolarHBondContact OG-O 3.09Å; S350-A391 VanDerWaalsContact OG-O 3.1Å; S350-G395 WeakPolarHBondContact O-CA 3.33Å
351	Y	95.1	Very high	91.8	Very high	69 Å²	69	24.3 Å²	24.3	27%	0.271	13%	0.129	S	C	.	.	H	α-helix	trans	-72	-30.3	178	-81.5	-93.1	0	0	0	112.6	N347 R348 L349 A354 T355 M398 V521 F522 E524 L527	N347-Y351 VanDerWaalsContact O-CD2 3.31Å; N347-Y351 WeakPolarHBondContact O-CD2 3.46Å; N347-Y351 PolarHBondContact O-N 3.32Å; R348-Y351 PolarHBondContact O-N 3.09Å; L349-Y351 PolarHBondContact O-N 3.43Å; Y351-A354 PolarHBondContact O-N 3.47Å; Y351-T355 WeakPolarHBondContact O-CB 3.34Å; Y351-T355 PolarHBondContact O-N 3.19Å; Y351-T355 PolarHBondContact O-OG1 3.35Å; Y351-M398 HydrophobicContact CD1-CE 4.12Å; Y351-M398 HydrophobicContact CD1-SD 4.2Å; Y351-M398 HydrophobicContact CD2-CE 3.62Å; Y351-M398 HydrophobicContact CE1-CE 4.22Å; Y351-M398 HydrophobicContact CE1-SD 4.29Å; Y351-M398 HydrophobicContact CE2-CE 3.75Å; Y351-M398 HydrophobicContact CG-CE 3.8Å; Y351-M398 HydrophobicContact CG-SD 4.39Å; Y351-V521 HydrophobicContact CG-CG1 4.29Å; Y351-F522 WeakPolarHBondContact CD1-O 3.29Å; Y351-E524 HydrophobicContact CE1-CB 4.46Å; Y351-L527 HydrophobicContact CD1-CD1 3.6Å; Y351-L527 HydrophobicContact CE1-CD1 3.99Å
352	L	96.8	Very high	92	Very high	2 Å²	2	31.3 Å²	31.3	1%	0.01	16%	0.156	C	C	.	.	H	α-helix	trans	-62.5	-47.8	172.8	177.3	61.7	0	0	0	110.7	R348 L349 A354 T355 E356 L516 A519 V521	R348-L352 VanDerWaalsContact O-CB 3.25Å; R348-L352 WeakPolarHBondContact O-CB 3.41Å; R348-L352 PolarHBondContact O-N 3.01Å; L349-L352 PolarHBondContact O-N 3.29Å; L352-A354 VanDerWaalsContact C-N 3.32Å; L352-A354 PolarHBondContact O-N 3.22Å; L352-T355 WeakPolarHBondContact O-CB 3.19Å; L352-T355 PolarHBondContact O-N 3.42Å; L352-T355 VanDerWaalsContact O-N 3.1Å; L352-E356 HydrophobicContact CD1-CG 4.23Å; L352-E356 HydrophobicContact CG-CG 4.49Å; L352-E356 WeakPolarHBondContact O-CG 3.09Å; L352-E356 PolarHBondContact O-N 3.43Å; L352-L516 HydrophobicContact CD2-CD2 4.23Å; L352-A519 HydrophobicContact CD1-CB 3.7Å; L352-V521 HydrophobicContact CB-CG2 3.79Å; L352-V521 HydrophobicContact CD1-CG2 3.97Å; L352-V521 HydrophobicContact CG-CG2 4.46Å
353	V	97.9	Very high	92.2	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-56.8	-47.2	175.2	171.2	0	0	0	0	110.8	L349 S350 T355 E356 I357 F373 I392 M396	L349-V353 HydrophobicContact CD1-CG2 4.36Å; L349-V353 WeakPolarHBondContact O-CG2 3.46Å; L349-V353 PolarHBondContact O-N 2.88Å; S350-V353 PolarHBondContact O-N 2.98Å; V353-T355 VanDerWaalsContact C-N 3.31Å; V353-T355 PolarHBondContact O-N 3.17Å; V353-E356 PolarHBondContact O-N 2.9Å; V353-I357 HydrophobicContact CG1-CD1 3.84Å; V353-I357 WeakPolarHBondContact O-CD1 3.35Å; V353-I357 VanDerWaalsContact O-CG1 3.27Å; V353-I357 WeakPolarHBondContact O-CG1 3.48Å; V353-I357 PolarHBondContact O-N 2.89Å; V353-I357 VanDerWaalsContact O-N 3.12Å; V353-F373 HydrophobicContact CG1-CB 4.5Å; V353-F373 HydrophobicContact CG1-CD1 4.44Å; V353-F373 HydrophobicContact CG1-CD2 4.1Å; V353-F373 HydrophobicContact CG1-CE2 4.43Å; V353-F373 HydrophobicContact CG1-CG 4.1Å; V353-F373 HydrophobicContact CG2-CD1 3.85Å; V353-F373 HydrophobicContact CG2-CE1 3.68Å; V353-F373 HydrophobicContact CG2-CE2 4.48Å; V353-F373 HydrophobicContact CG2-CG 4.34Å; V353-F373 HydrophobicContact CG2-CZ 4.01Å; V353-I392 HydrophobicContact CG1-CG2 4.47Å; V353-I392 HydrophobicContact CG2-CB 4.44Å; V353-I392 HydrophobicContact CG2-CG1 4.01Å; V353-I392 HydrophobicContact CG2-CG2 4.46Å; V353-M396 HydrophobicContact CG1-CG 4.14Å
354	A	96.3	Very high	92.7	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.205	C	C	.	.	H	α-helix	trans	-62.5	-38.3	176.9	0	0	0	0	0	112.6	S350 Y351 L352 I357 C358 M398 V401 L527	S350-A354 PolarHBondContact O-N 2.96Å; S350-A354 VanDerWaalsContact O-N 3.16Å; Y351-A354 PolarHBondContact O-N 3.47Å; L352-A354 VanDerWaalsContact C-N 3.32Å; L352-A354 PolarHBondContact O-N 3.22Å; A354-I357 PolarHBondContact O-N 3.5Å; A354-C358 WeakPolarHBondContact O-CB 3.48Å; A354-C358 PolarHBondContact O-N 3.2Å; A354-C358 PolarHBondContact O-SG 3.4Å; A354-M398 HydrophobicContact CB-SD 3.64Å; A354-V401 HydrophobicContact CB-CG2 3.73Å; A354-L527 HydrophobicContact CB-CD1 3.83Å; A354-L527 HydrophobicContact CB-CD2 3.95Å
355	T	95	Very high	93.2	Very high	3 Å²	3	40.2 Å²	40.2	2%	0.018	19%	0.191	C	C	.	.	H	α-helix	trans	-63.9	-51.1	177.2	-58.3	0	0	0	0	110.5	Y351 L352 V353 I357 C358 L359 F522	Y351-T355 WeakPolarHBondContact O-CB 3.34Å; Y351-T355 PolarHBondContact O-N 3.19Å; Y351-T355 PolarHBondContact O-OG1 3.35Å; L352-T355 WeakPolarHBondContact O-CB 3.19Å; L352-T355 PolarHBondContact O-N 3.42Å; L352-T355 VanDerWaalsContact O-N 3.1Å; V353-T355 VanDerWaalsContact C-N 3.31Å; V353-T355 PolarHBondContact O-N 3.17Å; T355-I357 PolarHBondContact O-N 2.87Å; T355-C358 PolarHBondContact O-N 2.84Å; T355-C358 VanDerWaalsContact O-N 3.15Å; T355-L359 VanDerWaalsContact O-CB 3.22Å; T355-L359 WeakPolarHBondContact O-CB 3.49Å; T355-L359 PolarHBondContact O-N 3.03Å; T355-F522 HydrophobicContact CG2-CB 4.28Å; T355-F522 HydrophobicContact CG2-CD1 3.78Å; T355-F522 HydrophobicContact CG2-CD2 4.12Å; T355-F522 HydrophobicContact CG2-CE1 4.1Å; T355-F522 HydrophobicContact CG2-CE2 4.42Å; T355-F522 HydrophobicContact CG2-CG 3.8Å; T355-F522 HydrophobicContact CG2-CZ 4.43Å; T355-F522 PolarHBondContact OG1-N 3.33Å
356	E	95.3	Very high	93.3	Very high	6 Å²	6	40.3 Å²	40.3	3%	0.028	19%	0.191	C	C	.	.	H	α-helix	trans	-58.5	-31.3	178.1	-72.2	-63.9	109.8	0	0	112.5	L283 L352 V353 P360 V369 F373 Y515	L283-E356 WeakPolarHBondContact CB-OE2 3.43Å; L283-E356 PolarHBondContact N-OE2 3.07Å; L352-E356 HydrophobicContact CD1-CG 4.23Å; L352-E356 HydrophobicContact CG-CG 4.49Å; L352-E356 WeakPolarHBondContact O-CG 3.09Å; L352-E356 PolarHBondContact O-N 3.43Å; V353-E356 PolarHBondContact O-N 2.9Å; E356-P360 WeakPolarHBondContact O-CD 3.48Å; E356-P360 WeakPolarHBondContact O-CG 3.5Å; E356-V369 HydrophobicContact CB-CG1 4.05Å; E356-F373 HydrophobicContact CB-CE2 3.75Å; E356-F373 HydrophobicContact CB-CZ 4.26Å; E356-F373 HydrophobicContact CG-CE2 4.19Å; E356-F373 HydrophobicContact CG-CZ 4.2Å; E356-Y515 PolarHBondContact OE1-OH 3.29Å
357	I	96.5	Very high	93.5	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	19%	0.189	C	C	.	.	H	α-helix	trans	-79.7	-39.5	177.4	-65.1	162.9	0	0	0	112	V353 A354 T355 P360 R366 V369 I370 M396 V401 L404	V353-I357 HydrophobicContact CG1-CD1 3.84Å; V353-I357 WeakPolarHBondContact O-CD1 3.35Å; V353-I357 VanDerWaalsContact O-CG1 3.27Å; V353-I357 WeakPolarHBondContact O-CG1 3.48Å; V353-I357 PolarHBondContact O-N 2.89Å; V353-I357 VanDerWaalsContact O-N 3.12Å; A354-I357 PolarHBondContact O-N 3.5Å; T355-I357 PolarHBondContact O-N 2.87Å; I357-P360 WeakPolarHBondContact O-CD 3.25Å; I357-R366 WeakPolarHBondContact O-CD 3.05Å; I357-R366 VanDerWaalsContact O-CG 3.25Å; I357-R366 WeakPolarHBondContact O-CG 3.01Å; I357-V369 HydrophobicContact CG1-CG1 3.94Å; I357-I370 HydrophobicContact CB-CG1 4.46Å; I357-I370 HydrophobicContact CD1-CG1 3.91Å; I357-I370 HydrophobicContact CG1-CG1 3.87Å; I357-I370 HydrophobicContact CG2-CD1 3.88Å; I357-I370 HydrophobicContact CG2-CG1 3.72Å; I357-M396 HydrophobicContact CD1-CG 3.87Å; I357-V401 HydrophobicContact CB-CG1 4.45Å; I357-V401 HydrophobicContact CB-CG2 4.44Å; I357-V401 HydrophobicContact CD1-CG1 4.01Å; I357-V401 HydrophobicContact CG2-CG1 3.82Å; I357-V401 HydrophobicContact CG2-CG2 4.43Å; I357-L404 HydrophobicContact CG2-CD1 4.29Å
358	C	93.6	Very high	93.9	Very high	1 Å²	1	44.1 Å²	44.1	1%	0.007	20%	0.203	C	C	.	.	H	α-helix	trans	-82.6	-24.5	-176.4	-73.7	0	0	0	0	113.7	A354 T355 L527 A530 S534	A354-C358 WeakPolarHBondContact O-CB 3.48Å; A354-C358 PolarHBondContact O-N 3.2Å; A354-C358 PolarHBondContact O-SG 3.4Å; T355-C358 PolarHBondContact O-N 2.84Å; T355-C358 VanDerWaalsContact O-N 3.15Å; C358-L527 HydrophobicContact CB-CD2 4.24Å; C358-A530 HydrophobicContact CB-CB 4.11Å; C358-S534 PolarHBondContact O-OG 2.69Å
359	L	87.8	Confident	94.1	Very high	57 Å²	57	42.1 Å²	42.1	30%	0.298	20%	0.196	S	C	.	.	S	Bend	trans	-66.2	-41.8	-177.2	-168.2	75.5	0	0	0	113.9	T355 V361 F522	T355-L359 VanDerWaalsContact O-CB 3.22Å; T355-L359 WeakPolarHBondContact O-CB 3.49Å; T355-L359 PolarHBondContact O-N 3.03Å; L359-V361 PolarHBondContact O-N 3.14Å; L359-F522 HydrophobicContact CD1-CE1 4.3Å; L359-F522 HydrophobicContact CD1-CE2 4.01Å; L359-F522 HydrophobicContact CD1-CZ 3.45Å; L359-F522 VanDerWaalsContact CD1-CZ 3.45Å
360	P	82.4	Confident	94.2	Very high	20 Å²	20	42 Å²	42	13%	0.13	20%	0.195	C	C	.	.			trans	-71	123	-175.5	-19	32.2	0	0	0	112.9	E356 I357 K362 H365 R366 V369	E356-P360 WeakPolarHBondContact O-CD 3.48Å; E356-P360 WeakPolarHBondContact O-CG 3.5Å; I357-P360 WeakPolarHBondContact O-CD 3.25Å; P360-K362 VanDerWaalsContact C-N 3.29Å; P360-K362 PolarHBondContact O-N 3.44Å; P360-H365 HydrophobicContact CB-CB 4.32Å; P360-H365 VanDerWaalsContact CB-CD2 3.46Å; P360-H365 WeakPolarHBondContact CB-CD2 3.39Å; P360-R366 HydrophobicContact CB-CG 3.86Å; P360-R366 HydrophobicContact CG-CG 4.25Å; P360-R366 VanDerWaalsContact O-CD 3.3Å; P360-R366 WeakPolarHBondContact O-CD 3.46Å; P360-R366 WeakPolarHBondContact O-CG 2.83Å; P360-R366 PolarHBondContact O-NH1 3Å; P360-V369 HydrophobicContact CG-CG2 4.4Å
361	V	82.8	Confident	94.3	Very high	132 Å²	132	44.8 Å²	44.8	80%	0.8	21%	0.208	S	C	*	.	S	Bend	trans	-62.8	-35.6	178.4	-175.7	0	0	0	0	112.1	L359 R366	L359-V361 PolarHBondContact O-N 3.14Å; V361-R366 PolarHBondContact O-NH1 3.02Å
362	K	91	Very high	94.5	Very high	164 Å²	164	42.2 Å²	42.2	71%	0.713	20%	0.198	S	C	*	.	S	Bend	trans	-84.8	118.5	-175.5	-67.6	-177.6	-179	176.3	0	111.7	P360 K364 H365 R366	P360-K362 VanDerWaalsContact C-N 3.29Å; P360-K362 PolarHBondContact O-N 3.44Å; K362-K364 VanDerWaalsContact C-N 3.34Å; K362-K364 PolarHBondContact O-N 3.12Å; K362-H365 HydrophobicContact CB-CB 4.21Å; K362-H365 WeakPolarHBondContact O-CA 3.45Å; K362-H365 WeakPolarHBondContact O-CB 3.36Å; K362-H365 PolarHBondContact O-N 3.05Å; K362-R366 PolarHBondContact O-N 3.3Å; K362-R366 VanDerWaalsContact O-N 3.08Å
363	K	94.4	Very high	94.6	Very high	87 Å²	87	42.3 Å²	42.3	38%	0.378	20%	0.198	S	C	.	.	H	α-helix	trans	-47.3	-45.9	175.8	-173.9	176.5	73.7	176	0	115.1	H365 R366 A367 K406	K363-H365 VanDerWaalsContact C-N 3.26Å; K363-H365 PolarHBondContact O-N 3.35Å; K363-R366 PolarHBondContact O-N 3.25Å; K363-A367 PolarHBondContact O-N 3.23Å; K363-K406 HydrophobicContact CD-CB 3.94Å; K363-K406 WeakPolarHBondContact CD-O 3.37Å
364	K	95.4	Very high	94.6	Very high	165 Å²	165	42.4 Å²	42.4	72%	0.717	20%	0.199	S	C	*	.	H	α-helix	trans	-63.5	-33.8	178.5	-175.4	178.9	179.1	-179.2	0	111.9	K362 R368	K362-K364 VanDerWaalsContact C-N 3.34Å; K362-K364 PolarHBondContact O-N 3.12Å; K364-R368 PolarHBondContact O-N 3.49Å
365	H	94.5	Very high	94.7	Very high	36 Å²	36	44.2 Å²	44.2	17%	0.167	21%	0.209	C	C	.	.	H	α-helix	trans	-71.2	-47.3	176.2	-173	105.9	0	0	0	110.3	D282 P360 K362 K363 A367 R368 V369	D282-H365 IonicContact OD2-CE1 3.33Å; D282-H365 PolarHBondContact OD2-CE1 3.34Å; D282-H365 IonicContact OD2-NE2 2.71Å; D282-H365 PolarHBondContact OD2-NE2 3.34Å; P360-H365 HydrophobicContact CB-CB 4.32Å; P360-H365 VanDerWaalsContact CB-CD2 3.46Å; P360-H365 WeakPolarHBondContact CB-CD2 3.39Å; K362-H365 HydrophobicContact CB-CB 4.21Å; K362-H365 WeakPolarHBondContact O-CA 3.45Å; K362-H365 WeakPolarHBondContact O-CB 3.36Å; K362-H365 PolarHBondContact O-N 3.05Å; K363-H365 VanDerWaalsContact C-N 3.26Å; K363-H365 PolarHBondContact O-N 3.35Å; H365-A367 VanDerWaalsContact C-N 3.3Å; H365-A367 PolarHBondContact O-N 3.43Å; H365-R368 PolarHBondContact ND1-NH2 2.89Å; H365-R368 VanDerWaalsContact ND1-NH2 3.16Å; H365-R368 WeakPolarHBondContact O-CA 3.25Å; H365-R368 WeakPolarHBondContact O-CB 3.24Å; H365-R368 PolarHBondContact O-N 3.41Å; H365-V369 PolarHBondContact O-N 3.4Å
366	R	96.3	Very high	94.9	Very high	4 Å²	4	44 Å²	44	2%	0.015	21%	0.208	C	C	.	.	H	α-helix	trans	-53.7	-44.3	175	-63.6	-166.8	-65.2	-94.6	12.2	113.1	I357 P360 V361 K362 K363 R368 V369 I370 T407 S534 E535	I357-R366 WeakPolarHBondContact O-CD 3.05Å; I357-R366 VanDerWaalsContact O-CG 3.25Å; I357-R366 WeakPolarHBondContact O-CG 3.01Å; P360-R366 HydrophobicContact CB-CG 3.86Å; P360-R366 HydrophobicContact CG-CG 4.25Å; P360-R366 VanDerWaalsContact O-CD 3.3Å; P360-R366 WeakPolarHBondContact O-CD 3.46Å; P360-R366 WeakPolarHBondContact O-CG 2.83Å; P360-R366 PolarHBondContact O-NH1 3Å; V361-R366 PolarHBondContact O-NH1 3.02Å; K362-R366 PolarHBondContact O-N 3.3Å; K362-R366 VanDerWaalsContact O-N 3.08Å; K363-R366 PolarHBondContact O-N 3.25Å; R366-R368 VanDerWaalsContact C-N 3.29Å; R366-R368 PolarHBondContact O-N 2.99Å; R366-V369 PolarHBondContact O-N 3.06Å; R366-V369 VanDerWaalsContact O-N 3.14Å; R366-I370 WeakPolarHBondContact O-CG1 3.18Å; R366-I370 PolarHBondContact O-N 2.83Å; R366-T407 HydrophobicContact CB-CG2 3.58Å; R366-T407 PolarHBondContact NE-OG1 3.02Å; R366-T407 PolarHBondContact NH2-OG1 2.96Å; R366-S534 PolarHBondContact NH1-OG 3.31Å; R366-S534 PolarHBondContact NH2-O 2.99Å; R366-E535 IonicContact NH2-OE1 2.65Å; R366-E535 PolarHBondContact NH2-OE1 3.05Å
367	A	97.9	Very high	95.1	Very high	5 Å²	5	43.8 Å²	43.8	4%	0.041	21%	0.206	C	C	.	.	H	α-helix	trans	-59.1	-40	176.8	0	0	0	0	0	112.3	K363 H365 I370 E371 T407 K410 V411	K363-A367 PolarHBondContact O-N 3.23Å; H365-A367 VanDerWaalsContact C-N 3.3Å; H365-A367 PolarHBondContact O-N 3.43Å; A367-I370 PolarHBondContact O-N 2.97Å; A367-E371 WeakPolarHBondContact O-CG 3.49Å; A367-E371 PolarHBondContact O-N 3.38Å; A367-T407 HydrophobicContact CB-CG2 4.25Å; A367-K410 HydrophobicContact CB-CB 3.93Å; A367-V411 HydrophobicContact CB-CG2 3.94Å
368	R	97.1	Very high	95.2	Very high	127 Å²	127	47.8 Å²	47.8	48%	0.479	22%	0.221	S	C	.	.	H	α-helix	trans	-66	-38.7	174.6	-71.2	-175.3	-63.7	176.4	5.6	112.7	L284 K364 H365 R366 I370 E371 F372	L284-R368 HydrophobicContact CD2-CB 4.49Å; K364-R368 PolarHBondContact O-N 3.49Å; H365-R368 PolarHBondContact ND1-NH2 2.89Å; H365-R368 VanDerWaalsContact ND1-NH2 3.16Å; H365-R368 WeakPolarHBondContact O-CA 3.25Å; H365-R368 WeakPolarHBondContact O-CB 3.24Å; H365-R368 PolarHBondContact O-N 3.41Å; R366-R368 VanDerWaalsContact C-N 3.29Å; R366-R368 PolarHBondContact O-N 2.99Å; R368-I370 VanDerWaalsContact C-N 3.34Å; R368-E371 PolarHBondContact O-N 3.18Å; R368-F372 VanDerWaalsContact O-CB 3.28Å; R368-F372 WeakPolarHBondContact O-CB 2.96Å; R368-F372 PolarHBondContact O-N 2.95Å
369	V	97.6	Very high	95.4	Very high	1 Å²	1	48 Å²	48	1%	0.006	22%	0.222	C	C	.	.	H	α-helix	trans	-63.2	-42.6	175.9	178.8	0	0	0	0	110.6	L284 E356 I357 P360 H365 R366 F372 F373	L284-V369 HydrophobicContact CD1-CB 4.43Å; L284-V369 HydrophobicContact CD1-CG1 4.32Å; L284-V369 HydrophobicContact CD1-CG2 4.03Å; L284-V369 HydrophobicContact CD2-CG2 4.08Å; E356-V369 HydrophobicContact CB-CG1 4.05Å; I357-V369 HydrophobicContact CG1-CG1 3.94Å; P360-V369 HydrophobicContact CG-CG2 4.4Å; H365-V369 PolarHBondContact O-N 3.4Å; R366-V369 PolarHBondContact O-N 3.06Å; R366-V369 VanDerWaalsContact O-N 3.14Å; V369-F372 WeakPolarHBondContact O-CB 2.91Å; V369-F372 PolarHBondContact O-N 3.13Å; V369-F373 HydrophobicContact CG1-CD2 3.78Å; V369-F373 HydrophobicContact CG1-CE2 3.74Å; V369-F373 WeakPolarHBondContact O-CD2 3.38Å; V369-F373 PolarHBondContact O-N 3.45Å
370	I	98.5	Very high	96	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-61.3	-50.6	174.9	-65.2	169.4	0	0	0	110.6	I357 R366 A367 R368 F372 F373 I374 M396 T407 W408 V411	I357-I370 HydrophobicContact CB-CG1 4.46Å; I357-I370 HydrophobicContact CD1-CG1 3.91Å; I357-I370 HydrophobicContact CG1-CG1 3.87Å; I357-I370 HydrophobicContact CG2-CD1 3.88Å; I357-I370 HydrophobicContact CG2-CG1 3.72Å; R366-I370 WeakPolarHBondContact O-CG1 3.18Å; R366-I370 PolarHBondContact O-N 2.83Å; A367-I370 PolarHBondContact O-N 2.97Å; R368-I370 VanDerWaalsContact C-N 3.34Å; I370-F372 VanDerWaalsContact C-N 3.27Å; I370-F372 PolarHBondContact O-N 3.42Å; I370-F373 PolarHBondContact O-N 2.84Å; I370-I374 HydrophobicContact CG2-CD1 3.86Å; I370-I374 HydrophobicContact CG2-CG1 4.43Å; I370-I374 VanDerWaalsContact O-CG1 3.3Å; I370-I374 WeakPolarHBondContact O-CG1 3.05Å; I370-I374 PolarHBondContact O-N 2.87Å; I370-M396 HydrophobicContact CG2-SD 4.12Å; I370-T407 HydrophobicContact CD1-CG2 3.75Å; I370-W408 HydrophobicContact CD1-CD2 4.38Å; I370-W408 HydrophobicContact CD1-CZ2 4.31Å; I370-W408 HydrophobicContact CG2-CE3 4.32Å; I370-W408 HydrophobicContact CG2-CH2 3.73Å; I370-W408 HydrophobicContact CG2-CZ2 4.48Å; I370-W408 HydrophobicContact CG2-CZ3 3.62Å; I370-V411 HydrophobicContact CB-CG2 3.99Å; I370-V411 HydrophobicContact CD1-CG2 4.03Å; I370-V411 HydrophobicContact CG2-CB 4.47Å; I370-V411 HydrophobicContact CG2-CG1 3.74Å; I370-V411 HydrophobicContact CG2-CG2 3.92Å
371	E	98.4	Very high	96.7	Very high	61 Å²	61	46.9 Å²	46.9	29%	0.285	21%	0.213	S	C	.	.	H	α-helix	trans	-59.7	-38.4	178.5	-71.6	-179.1	152.2	0	0	112.3	A367 R368 I374 D375 V411 K412	A367-E371 WeakPolarHBondContact O-CG 3.49Å; A367-E371 PolarHBondContact O-N 3.38Å; R368-E371 PolarHBondContact O-N 3.18Å; E371-I374 PolarHBondContact O-N 3.24Å; E371-D375 PolarHBondContact O-N 2.91Å; E371-D375 VanDerWaalsContact O-N 3.12Å; E371-V411 HydrophobicContact CG-CG1 3.95Å; E371-K412 PolarHBondContact OE1-N 2.65Å; E371-K412 VanDerWaalsContact OE1-N 3.15Å
372	F	98.6	Very high	97.4	Very high	16 Å²	16	44.5 Å²	44.5	7%	0.07	20%	0.196	C	C	.	.	H	α-helix	trans	-60.1	-51.1	174.1	177.9	-101.5	0	0	0	111.7	L283 L284 P290 V293 R368 V369 I370 I374 D375 V376	L283-F372 HydrophobicContact CD2-CE1 3.94Å; L283-F372 HydrophobicContact CG-CE1 4.22Å; L284-F372 HydrophobicContact CD1-CB 4.13Å; L284-F372 HydrophobicContact CD1-CD1 3.56Å; L284-F372 HydrophobicContact CD1-CE1 4.07Å; L284-F372 HydrophobicContact CD1-CG 3.83Å; L284-F372 HydrophobicContact CD2-CB 4.46Å; L284-F372 HydrophobicContact CG-CB 4.45Å; L284-F372 HydrophobicContact CG-CD1 4.32Å; L284-F372 HydrophobicContact CG-CD2 4.49Å; L284-F372 HydrophobicContact CG-CG 4.17Å; P290-F372 HydrophobicContact CB-CD2 4.25Å; P290-F372 HydrophobicContact CB-CE2 4.01Å; V293-F372 HydrophobicContact CB-CZ 4.35Å; V293-F372 HydrophobicContact CG2-CE1 4.27Å; V293-F372 HydrophobicContact CG2-CZ 3.75Å; R368-F372 VanDerWaalsContact O-CB 3.28Å; R368-F372 WeakPolarHBondContact O-CB 2.96Å; R368-F372 PolarHBondContact O-N 2.95Å; V369-F372 WeakPolarHBondContact O-CB 2.91Å; V369-F372 PolarHBondContact O-N 3.13Å; I370-F372 VanDerWaalsContact C-N 3.27Å; I370-F372 PolarHBondContact O-N 3.42Å; F372-I374 VanDerWaalsContact C-N 3.3Å; F372-I374 PolarHBondContact O-N 3.35Å; F372-D375 PolarHBondContact O-N 3.23Å; F372-D375 VanDerWaalsContact O-N 3.09Å; F372-V376 HydrophobicContact CD1-CG2 4.12Å; F372-V376 HydrophobicContact CE1-CG2 3.79Å; F372-V376 HydrophobicContact CE2-CG2 4.5Å; F372-V376 HydrophobicContact CZ-CG2 4Å; F372-V376 WeakPolarHBondContact O-CG2 3.48Å; F372-V376 PolarHBondContact O-N 2.72Å
373	F	98.8	Very high	97.8	Very high	3 Å²	3	36.8 Å²	36.8	1%	0.013	16%	0.163	C	C	.	.	H	α-helix	trans	-66.6	-28.9	178.3	-82.2	-63.9	0	0	0	113.6	L283 V353 E356 V369 I370 D375 V376 A377 I392	L283-F373 HydrophobicContact CD2-CE1 3.93Å; L283-F373 HydrophobicContact CD2-CZ 3.69Å; V353-F373 HydrophobicContact CG1-CB 4.5Å; V353-F373 HydrophobicContact CG1-CD1 4.44Å; V353-F373 HydrophobicContact CG1-CD2 4.1Å; V353-F373 HydrophobicContact CG1-CE2 4.43Å; V353-F373 HydrophobicContact CG1-CG 4.1Å; V353-F373 HydrophobicContact CG2-CD1 3.85Å; V353-F373 HydrophobicContact CG2-CE1 3.68Å; V353-F373 HydrophobicContact CG2-CE2 4.48Å; V353-F373 HydrophobicContact CG2-CG 4.34Å; V353-F373 HydrophobicContact CG2-CZ 4.01Å; E356-F373 HydrophobicContact CB-CE2 3.75Å; E356-F373 HydrophobicContact CB-CZ 4.26Å; E356-F373 HydrophobicContact CG-CE2 4.19Å; E356-F373 HydrophobicContact CG-CZ 4.2Å; V369-F373 HydrophobicContact CG1-CD2 3.78Å; V369-F373 HydrophobicContact CG1-CE2 3.74Å; V369-F373 WeakPolarHBondContact O-CD2 3.38Å; V369-F373 PolarHBondContact O-N 3.45Å; I370-F373 PolarHBondContact O-N 2.84Å; F373-D375 VanDerWaalsContact C-N 3.32Å; F373-V376 PolarHBondContact O-N 2.88Å; F373-A377 VanDerWaalsContact O-CB 3.26Å; F373-A377 WeakPolarHBondContact O-CB 3.11Å; F373-A377 PolarHBondContact O-N 3.12Å; F373-I392 HydrophobicContact CB-CG2 4.01Å; F373-I392 HydrophobicContact CD1-CG2 4.36Å
374	I	98.8	Very high	98	Very high	3 Å²	3	32.7 Å²	32.7	2%	0.015	15%	0.145	C	C	.	.	H	α-helix	trans	-61.6	-43.2	170.3	-69.1	165.4	0	0	0	110.4	I370 E371 F372 A377 R378 M396 V411 K415 F416 L419	I370-I374 HydrophobicContact CG2-CD1 3.86Å; I370-I374 HydrophobicContact CG2-CG1 4.43Å; I370-I374 VanDerWaalsContact O-CG1 3.3Å; I370-I374 WeakPolarHBondContact O-CG1 3.05Å; I370-I374 PolarHBondContact O-N 2.87Å; E371-I374 PolarHBondContact O-N 3.24Å; F372-I374 VanDerWaalsContact C-N 3.3Å; F372-I374 PolarHBondContact O-N 3.35Å; I374-A377 PolarHBondContact O-N 2.69Å; I374-R378 WeakPolarHBondContact O-CB 3.42Å; I374-R378 PolarHBondContact O-N 3.28Å; I374-M396 HydrophobicContact CG1-CE 4.1Å; I374-M396 HydrophobicContact CG1-SD 3.94Å; I374-V411 HydrophobicContact CD1-CG1 3.86Å; I374-K415 HydrophobicContact CG2-CB 3.56Å; I374-K415 HydrophobicContact CG2-CD 4.26Å; I374-F416 HydrophobicContact CD1-CB 3.76Å; I374-F416 HydrophobicContact CD1-CG 4.36Å; I374-F416 HydrophobicContact CG1-CB 3.93Å; I374-F416 HydrophobicContact CG1-CD2 4.03Å; I374-F416 HydrophobicContact CG1-CG 4.29Å; I374-F416 HydrophobicContact CG2-CB 4.41Å; I374-L419 HydrophobicContact CG2-CD1 4.42Å
375	D	98.8	Very high	98.1	Very high	37 Å²	37	24.8 Å²	24.8	20%	0.198	11%	0.11	C	C	.	.	H	α-helix	trans	-71.2	-35.4	177.8	-77.2	-34.4	0	0	0	112.5	P290 E371 F372 F373 R378 E379 K415	P290-D375 HydrophobicContact CB-CB 3.8Å; P290-D375 HydrophobicContact CG-CB 3.83Å; E371-D375 PolarHBondContact O-N 2.91Å; E371-D375 VanDerWaalsContact O-N 3.12Å; F372-D375 PolarHBondContact O-N 3.23Å; F372-D375 VanDerWaalsContact O-N 3.09Å; F373-D375 VanDerWaalsContact C-N 3.32Å; D375-R378 PolarHBondContact O-N 3.44Å; D375-R378 IonicContact OD1-CZ 3.61Å; D375-R378 IonicContact OD1-NE 3.88Å; D375-R378 IonicContact OD1-NH2 3.61Å; D375-E379 PolarHBondContact O-N 3.32Å; D375-E379 VanDerWaalsContact O-N 3.07Å; D375-K415 IonicContact OD1-NZ 2.67Å; D375-K415 PolarHBondContact OD1-NZ 2.95Å; D375-K415 IonicContact OD2-NZ 3.55Å
376	V	98.9	Very high	98.3	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-61	-48.9	170.5	177.6	0	0	0	0	110.5	P290 V293 A294 L297 F372 F373 R378 E379 C380 I392	P290-V376 HydrophobicContact CB-CB 4.5Å; P290-V376 HydrophobicContact CB-CG2 3.67Å; V293-V376 HydrophobicContact CB-CG1 4.45Å; V293-V376 HydrophobicContact CB-CG2 4.09Å; V293-V376 HydrophobicContact CG1-CG1 3.95Å; V293-V376 HydrophobicContact CG1-CG2 4.09Å; A294-V376 HydrophobicContact CB-CG1 4.18Å; L297-V376 HydrophobicContact CD1-CG1 3.8Å; F372-V376 HydrophobicContact CD1-CG2 4.12Å; F372-V376 HydrophobicContact CE1-CG2 3.79Å; F372-V376 HydrophobicContact CE2-CG2 4.5Å; F372-V376 HydrophobicContact CZ-CG2 4Å; F372-V376 WeakPolarHBondContact O-CG2 3.48Å; F372-V376 PolarHBondContact O-N 2.72Å; F373-V376 PolarHBondContact O-N 2.88Å; V376-R378 VanDerWaalsContact C-N 3.33Å; V376-R378 PolarHBondContact O-N 2.96Å; V376-E379 PolarHBondContact O-N 3.48Å; V376-E379 VanDerWaalsContact O-N 3.08Å; V376-C380 PolarHBondContact O-N 3.01Å; V376-C380 PolarHBondContact O-SG 2.95Å; V376-C380 VanDerWaalsContact O-SG 3.41Å; V376-I392 HydrophobicContact CB-CD1 4.35Å; V376-I392 HydrophobicContact CG1-CD1 3.69Å
377	A	98.9	Very high	98.4	Very high	0 Å²	0	23 Å²	23	0%	0	10%	0.103	C	C	.	.	H	α-helix	trans	-59.8	-43.3	179.2	0	0	0	0	0	111.9	F373 I374 E379 C380 F381 L389 I392 L419	F373-A377 VanDerWaalsContact O-CB 3.26Å; F373-A377 WeakPolarHBondContact O-CB 3.11Å; F373-A377 PolarHBondContact O-N 3.12Å; I374-A377 PolarHBondContact O-N 2.69Å; A377-E379 VanDerWaalsContact C-N 3.28Å; A377-E379 PolarHBondContact O-N 2.83Å; A377-C380 WeakPolarHBondContact O-CB 3.2Å; A377-C380 PolarHBondContact O-N 3.48Å; A377-F381 PolarHBondContact O-N 2.82Å; A377-L389 HydrophobicContact CB-CD1 3.82Å; A377-L389 WeakPolarHBondContact O-CD1 3.3Å; A377-I392 HydrophobicContact CB-CB 4.24Å; A377-I392 HydrophobicContact CB-CD1 4.32Å; A377-I392 HydrophobicContact CB-CG2 3.82Å; A377-L419 HydrophobicContact CB-CD1 3.86Å
378	R	98.7	Very high	98.4	Very high	84 Å²	84	22.8 Å²	22.8	32%	0.317	10%	0.101	S	C	.	.	H	α-helix	trans	-58.8	-41.6	173.9	-174.4	-173.9	64.8	172	-0.5	111.8	I374 D375 V376 F381 N382 L419	I374-R378 WeakPolarHBondContact O-CB 3.42Å; I374-R378 PolarHBondContact O-N 3.28Å; D375-R378 PolarHBondContact O-N 3.44Å; D375-R378 IonicContact OD1-CZ 3.61Å; D375-R378 IonicContact OD1-NE 3.88Å; D375-R378 IonicContact OD1-NH2 3.61Å; V376-R378 VanDerWaalsContact C-N 3.33Å; V376-R378 PolarHBondContact O-N 2.96Å; R378-F381 WeakPolarHBondContact O-CB 3.19Å; R378-F381 PolarHBondContact O-N 3.33Å; R378-N382 PolarHBondContact O-N 3.35Å; R378-N382 PolarHBondContact O-ND2 3.37Å; R378-L419 HydrophobicContact CB-CD1 4.2Å; R378-L419 HydrophobicContact CB-CD2 4.44Å
379	E	98.7	Very high	98.5	Very high	6 Å²	6	16.8 Å²	16.8	3%	0.028	8%	0.078	C	C	.	.	H	α-helix	trans	-71.3	-34.7	177.8	-172.2	61	-171.5	0	0	112.4	F291 A294 D375 V376 A377 F381 N382 I383 R450	F291-E379 HydrophobicContact CD1-CB 4.37Å; F291-E379 HydrophobicContact CD1-CG 3.69Å; F291-E379 WeakPolarHBondContact CD1-OE2 3.13Å; F291-E379 HydrophobicContact CE1-CG 4.26Å; F291-E379 VanDerWaalsContact CE1-OE2 3.26Å; F291-E379 WeakPolarHBondContact CE1-OE2 3.38Å; F291-E379 HydrophobicContact CG-CG 4.39Å; A294-E379 HydrophobicContact CB-CB 3.69Å; A294-E379 HydrophobicContact CB-CG 3.68Å; D375-E379 PolarHBondContact O-N 3.32Å; D375-E379 VanDerWaalsContact O-N 3.07Å; V376-E379 PolarHBondContact O-N 3.48Å; V376-E379 VanDerWaalsContact O-N 3.08Å; A377-E379 VanDerWaalsContact C-N 3.28Å; A377-E379 PolarHBondContact O-N 2.83Å; E379-F381 VanDerWaalsContact C-N 3.29Å; E379-F381 PolarHBondContact O-N 2.96Å; E379-N382 PolarHBondContact O-N 3.23Å; E379-N382 PolarHBondContact OE2-ND2 2.98Å; E379-I383 HydrophobicContact CG-CD1 3.93Å; E379-I383 HydrophobicContact CG-CG1 4.34Å; E379-I383 WeakPolarHBondContact O-CB 3.48Å; E379-I383 VanDerWaalsContact O-CG1 3.31Å; E379-I383 WeakPolarHBondContact O-CG1 3.25Å; E379-I383 PolarHBondContact O-N 2.85Å; E379-R450 IonicContact OE1-CZ 3.42Å; E379-R450 IonicContact OE1-NH2 3.86Å; E379-R450 PolarHBondContact OE1-NH2 3.41Å
380	C	98.8	Very high	98.5	Very high	0 Å²	0	16.8 Å²	16.8	0%	0	8%	0.078	C	C	.	.	H	α-helix	trans	-56.3	-44.2	168.4	-68.9	0	0	0	0	111.3	V376 A377 N382 I383 G384 N385 L389	V376-C380 PolarHBondContact O-N 3.01Å; V376-C380 PolarHBondContact O-SG 2.95Å; V376-C380 VanDerWaalsContact O-SG 3.41Å; A377-C380 WeakPolarHBondContact O-CB 3.2Å; A377-C380 PolarHBondContact O-N 3.48Å; C380-N382 PolarHBondContact O-N 3.49Å; C380-I383 PolarHBondContact O-N 3.23Å; C380-G384 PolarHBondContact O-N 2.88Å; C380-N385 HydrophobicContact CB-CB 4.18Å; C380-N385 WeakPolarHBondContact CB-O 3.24Å; C380-N385 WeakPolarHBondContact O-CA 3.14Å; C380-N385 PolarHBondContact O-N 3.09Å; C380-L389 HydrophobicContact CB-CB 4.01Å
381	F	98.6	Very high	98.3	Very high	54 Å²	54	16.8 Å²	16.8	24%	0.237	8%	0.078	C	C	.	.	H	α-helix	trans	-58.6	-47.4	173.6	-176.2	-91.2	0	0	0	112.2	A377 R378 E379 I383 G384 F386 L389 L419 Q422 A435	A377-F381 PolarHBondContact O-N 2.82Å; R378-F381 WeakPolarHBondContact O-CB 3.19Å; R378-F381 PolarHBondContact O-N 3.33Å; E379-F381 VanDerWaalsContact C-N 3.29Å; E379-F381 PolarHBondContact O-N 2.96Å; F381-I383 VanDerWaalsContact C-N 3.33Å; F381-I383 PolarHBondContact O-N 3.2Å; F381-G384 PolarHBondContact O-N 2.86Å; F381-G384 VanDerWaalsContact O-N 3.12Å; F381-F386 HydrophobicContact CD2-CD1 4.3Å; F381-F386 AromaticContact CD2-CE1 3.86Å; F381-F386 HydrophobicContact CD2-CE1 3.86Å; F381-F386 AromaticContact CE2-CE1 3.93Å; F381-F386 HydrophobicContact CE2-CE1 3.93Å; F381-L389 HydrophobicContact CB-CD2 3.92Å; F381-L389 HydrophobicContact CD2-CD2 3.69Å; F381-L389 HydrophobicContact CG-CD2 4.31Å; F381-L419 HydrophobicContact CB-CD2 4.25Å; F381-Q422 HydrophobicContact CE2-CB 4Å; F381-Q422 HydrophobicContact CE2-CG 3.98Å; F381-Q422 HydrophobicContact CZ-CG 4.24Å; F381-A435 HydrophobicContact CE2-CB 3.85Å; F381-A435 HydrophobicContact CZ-CB 4.02Å
382	N	97.8	Very high	98.3	Very high	81 Å²	81	13.9 Å²	13.9	43%	0.433	6%	0.064	S	C	.	.	H	α-helix	trans	-62.4	-38.4	-179.9	-67	-23.9	0	0	0	112.9	R378 E379 C380 G384	R378-N382 PolarHBondContact O-N 3.35Å; R378-N382 PolarHBondContact O-ND2 3.37Å; E379-N382 PolarHBondContact O-N 3.23Å; E379-N382 PolarHBondContact OE2-ND2 2.98Å; C380-N382 PolarHBondContact O-N 3.49Å; N382-G384 VanDerWaalsContact C-N 3.25Å; N382-G384 PolarHBondContact O-N 2.7Å
383	I	98.1	Very high	98.2	Very high	3 Å²	3	13.1 Å²	13.1	2%	0.015	6%	0.061	C	C	.	.	H	α-helix	trans	-69.7	-24.6	177.7	-70.1	170.2	0	0	0	111.4	A294 Q295 T298 E379 C380 F381 N385 I453 F506	A294-I383 HydrophobicContact CB-CD1 4.17Å; Q295-I383 HydrophobicContact CG-CD1 4.36Å; T298-I383 HydrophobicContact CG2-CG2 3.97Å; E379-I383 HydrophobicContact CG-CD1 3.93Å; E379-I383 HydrophobicContact CG-CG1 4.34Å; E379-I383 WeakPolarHBondContact O-CB 3.48Å; E379-I383 VanDerWaalsContact O-CG1 3.31Å; E379-I383 WeakPolarHBondContact O-CG1 3.25Å; E379-I383 PolarHBondContact O-N 2.85Å; C380-I383 PolarHBondContact O-N 3.23Å; F381-I383 VanDerWaalsContact C-N 3.33Å; F381-I383 PolarHBondContact O-N 3.2Å; I383-N385 HydrophobicContact CG2-CB 4.34Å; I383-I453 HydrophobicContact CG2-CB 4.36Å; I383-I453 HydrophobicContact CG2-CD1 3.99Å; I383-I453 HydrophobicContact CG2-CG2 3.92Å; I383-F506 HydrophobicContact CD1-CE2 4.03Å; I383-F506 HydrophobicContact CD1-CZ 3.95Å; I383-F506 HydrophobicContact CG1-CE2 4.47Å; I383-F506 HydrophobicContact CG1-CZ 4.07Å; I383-F506 HydrophobicContact CG2-CE2 4.13Å; I383-F506 HydrophobicContact CG2-CZ 4.26Å
384	G	98	Very high	97.9	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	6%	0.063	C	C	.	.	T	Hydrogen-bonded Turn	trans	89.5	17.7	-167.5	0	0	0	0	0	113.1	C380 F381 N382 F386 I455	C380-G384 PolarHBondContact O-N 2.88Å; F381-G384 PolarHBondContact O-N 2.86Å; F381-G384 VanDerWaalsContact O-N 3.12Å; N382-G384 VanDerWaalsContact C-N 3.25Å; N382-G384 PolarHBondContact O-N 2.7Å; G384-F386 WeakPolarHBondContact O-CD2 3.42Å; G384-F386 PolarHBondContact O-N 3.26Å; G384-I455 PolarHBondContact O-N 3.04Å
385	N	98.7	Very high	97.7	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	6%	0.062	C	C	.	.	B	Isolated β-bridge	trans	-89.8	77	173.9	-174.6	-5.1	0	0	0	111.9	T298 C380 I383 S388 L389 I455	T298-N385 PolarHBondContact OG1-ND2 2.83Å; C380-N385 HydrophobicContact CB-CB 4.18Å; C380-N385 WeakPolarHBondContact CB-O 3.24Å; C380-N385 WeakPolarHBondContact O-CA 3.14Å; C380-N385 PolarHBondContact O-N 3.09Å; I383-N385 HydrophobicContact CG2-CB 4.34Å; N385-S388 WeakPolarHBondContact ND2-CB 3.33Å; N385-S388 PolarHBondContact ND2-OG 3.09Å; N385-S388 WeakPolarHBondContact OD1-CB 3.47Å; N385-S388 PolarHBondContact OD1-N 2.97Å; N385-S388 PolarHBondContact OD1-OG 2.88Å; N385-L389 WeakPolarHBondContact O-CB 3.4Å; N385-L389 PolarHBondContact O-N 3.13Å; N385-I455 HydrophobicContact CB-CD1 3.92Å
386	F	98.7	Very high	97.5	Very high	2 Å²	2	11.4 Å²	11.4	1%	0.009	5%	0.053	C	C	.	.	H	α-helix	trans	-75.2	-26.8	-176.9	-57.8	-74.7	0	0	0	112.9	F381 G384 L389 M390 Y432 A435 L436 A439 I455	F381-F386 HydrophobicContact CD2-CD1 4.3Å; F381-F386 AromaticContact CD2-CE1 3.86Å; F381-F386 HydrophobicContact CD2-CE1 3.86Å; F381-F386 AromaticContact CE2-CE1 3.93Å; F381-F386 HydrophobicContact CE2-CE1 3.93Å; G384-F386 WeakPolarHBondContact O-CD2 3.42Å; G384-F386 PolarHBondContact O-N 3.26Å; F386-L389 HydrophobicContact CD1-CD2 4.18Å; F386-M390 WeakPolarHBondContact O-CB 3.46Å; F386-M390 PolarHBondContact O-N 3.12Å; F386-Y432 HydrophobicContact CB-CD2 4.34Å; F386-Y432 HydrophobicContact CB-CE2 3.74Å; F386-Y432 HydrophobicContact CD1-CD2 4.29Å; F386-Y432 HydrophobicContact CD1-CE2 4.3Å; F386-Y432 HydrophobicContact CD2-CE2 4.31Å; F386-Y432 HydrophobicContact CG-CD2 4.32Å; F386-Y432 AromaticContact CG-CE2 3.87Å; F386-Y432 HydrophobicContact CG-CE2 3.87Å; F386-A435 HydrophobicContact CE1-CB 3.91Å; F386-A435 HydrophobicContact CZ-CB 4.13Å; F386-L436 HydrophobicContact CD2-CD1 4.09Å; F386-L436 HydrophobicContact CE2-CD1 4.05Å; F386-A439 HydrophobicContact CE2-CB 3.74Å; F386-A439 HydrophobicContact CZ-CB 4Å; F386-I455 WeakPolarHBondContact CB-O 3.44Å; F386-I455 WeakPolarHBondContact CD2-O 3.16Å; F386-I455 PolarHBondContact N-O 3.31Å
387	N	98.1	Very high	97.2	Very high	1 Å²	1	12.1 Å²	12.1	1%	0.005	6%	0.056	C	C	.	.	H	α-helix	trans	-65.3	-52.7	177.7	-162.9	58.9	0	0	0	111.9	E301 Y342 L389 M390 A391 I455 P456 F458	E301-N387 PolarHBondContact OE1-ND2 3.19Å; E301-N387 PolarHBondContact OE2-ND2 3.44Å; Y342-N387 PolarHBondContact OH-ND2 2.7Å; N387-L389 PolarHBondContact O-N 2.96Å; N387-M390 PolarHBondContact O-N 3.03Å; N387-A391 PolarHBondContact O-N 3.4Å; N387-I455 HydrophobicContact CB-CG2 3.67Å; N387-P456 WeakPolarHBondContact CB-O 3.38Å; N387-F458 PolarHBondContact OD1-N 3.31Å
388	S	98.8	Very high	96.9	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-65.2	-38.3	177	-67.5	0	0	0	0	112.3	E301 N385 M390 A391 I392	E301-S388 VanDerWaalsContact CG-OG 3.3Å; E301-S388 WeakPolarHBondContact CG-OG 3.47Å; E301-S388 PolarHBondContact OE1-OG 3.47Å; N385-S388 WeakPolarHBondContact ND2-CB 3.33Å; N385-S388 PolarHBondContact ND2-OG 3.09Å; N385-S388 WeakPolarHBondContact OD1-CB 3.47Å; N385-S388 PolarHBondContact OD1-N 2.97Å; N385-S388 PolarHBondContact OD1-OG 2.88Å; S388-M390 VanDerWaalsContact C-N 3.32Å; S388-M390 PolarHBondContact O-N 3.13Å; S388-A391 PolarHBondContact O-N 2.75Å; S388-I392 WeakPolarHBondContact O-CD1 3.39Å; S388-I392 VanDerWaalsContact O-CG1 3.25Å; S388-I392 WeakPolarHBondContact O-CG1 3.31Å; S388-I392 PolarHBondContact O-N 3.39Å
389	L	98.7	Very high	96.6	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-53.2	-51.7	172.1	163.4	63.3	0	0	0	110.8	A377 C380 F381 N385 F386 N387 A391 I392 I393 L419 M423	A377-L389 HydrophobicContact CB-CD1 3.82Å; A377-L389 WeakPolarHBondContact O-CD1 3.3Å; C380-L389 HydrophobicContact CB-CB 4.01Å; F381-L389 HydrophobicContact CB-CD2 3.92Å; F381-L389 HydrophobicContact CD2-CD2 3.69Å; F381-L389 HydrophobicContact CG-CD2 4.31Å; N385-L389 WeakPolarHBondContact O-CB 3.4Å; N385-L389 PolarHBondContact O-N 3.13Å; F386-L389 HydrophobicContact CD1-CD2 4.18Å; N387-L389 PolarHBondContact O-N 2.96Å; L389-A391 PolarHBondContact O-N 3.49Å; L389-I392 PolarHBondContact O-N 3.36Å; L389-I393 HydrophobicContact CD1-CD1 3.66Å; L389-I393 HydrophobicContact CD1-CG1 4.19Å; L389-I393 HydrophobicContact CG-CD1 4.11Å; L389-I393 WeakPolarHBondContact O-CG1 3.45Å; L389-I393 PolarHBondContact O-N 3.03Å; L389-L419 HydrophobicContact CD1-CB 4.41Å; L389-L419 HydrophobicContact CD1-CD2 4.05Å; L389-M423 HydrophobicContact CD2-CG 3.84Å; L389-M423 HydrophobicContact CD2-SD 3.68Å; L389-M423 HydrophobicContact CG-CG 4.06Å; L389-M423 HydrophobicContact CG-SD 4.32Å
390	M	96.9	Very high	96.3	Very high	1 Å²	1	11 Å²	11	1%	0.005	6%	0.058	C	C	.	.	H	α-helix	trans	-65.7	-39.2	-178.7	-170.4	52.3	161	0	0	111.8	Y10 F346 F386 N387 S388 I392 I393 S394 M423 F429 F457	Y10-M390 HydrophobicContact CE2-CE 4.42Å; Y10-M390 WeakPolarHBondContact OH-CE 3.11Å; Y10-M390 PolarHBondContact OH-SD 2.91Å; Y10-M390 VanDerWaalsContact OH-SD 3.37Å; F346-M390 HydrophobicContact CE2-CB 4Å; F346-M390 HydrophobicContact CE2-CG 4.07Å; F346-M390 HydrophobicContact CZ-CG 4.13Å; F386-M390 WeakPolarHBondContact O-CB 3.46Å; F386-M390 PolarHBondContact O-N 3.12Å; N387-M390 PolarHBondContact O-N 3.03Å; S388-M390 VanDerWaalsContact C-N 3.32Å; S388-M390 PolarHBondContact O-N 3.13Å; M390-I392 PolarHBondContact O-N 3.32Å; M390-I393 PolarHBondContact O-N 3.41Å; M390-S394 WeakPolarHBondContact O-CB 3.43Å; M390-S394 PolarHBondContact O-N 3.39Å; M390-S394 PolarHBondContact O-OG 3.45Å; M390-M423 HydrophobicContact CB-CE 3.92Å; M390-M423 HydrophobicContact CG-CE 4.12Å; M390-M423 HydrophobicContact SD-CB 3.97Å; M390-M423 HydrophobicContact SD-CE 3.95Å; M390-M423 HydrophobicContact SD-CG 4.42Å; M390-F429 HydrophobicContact CE-CE1 4.23Å; M390-F457 HydrophobicContact CB-CD2 4Å; M390-F457 HydrophobicContact CB-CE2 4.3Å; M390-F457 HydrophobicContact CB-CG 4.44Å; M390-F457 HydrophobicContact CE-CE1 3.93Å; M390-F457 HydrophobicContact CE-CZ 3.96Å; M390-F457 HydrophobicContact CG-CD1 4.43Å; M390-F457 HydrophobicContact CG-CD2 3.75Å; M390-F457 HydrophobicContact CG-CE1 4.29Å; M390-F457 HydrophobicContact CG-CE2 3.6Å; M390-F457 HydrophobicContact CG-CG 4.18Å; M390-F457 HydrophobicContact CG-CZ 3.89Å
391	A	95.2	Very high	96.2	Very high	0 Å²	0	11 Å²	11	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-61.3	-43.4	175.3	0	0	0	0	0	111.9	F346 L349 S350 N387 S388 L389 S394 G395	F346-A391 HydrophobicContact CD2-CB 3.69Å; F346-A391 HydrophobicContact CE2-CB 3.69Å; F346-A391 VanDerWaalsContact CE2-N 3.33Å; F346-A391 HydrophobicContact CG-CB 4.25Å; F346-A391 HydrophobicContact CZ-CB 4.23Å; L349-A391 HydrophobicContact CB-CB 4.11Å; L349-A391 HydrophobicContact CD2-CB 3.7Å; L349-A391 HydrophobicContact CG-CB 3.87Å; S350-A391 WeakPolarHBondContact CA-O 3.36Å; S350-A391 WeakPolarHBondContact CB-O 3.41Å; S350-A391 WeakPolarHBondContact OG-CA 3.33Å; S350-A391 PolarHBondContact OG-O 3.09Å; S350-A391 VanDerWaalsContact OG-O 3.1Å; N387-A391 PolarHBondContact O-N 3.4Å; S388-A391 PolarHBondContact O-N 2.75Å; L389-A391 PolarHBondContact O-N 3.49Å; A391-S394 WeakPolarHBondContact O-CB 3.41Å; A391-S394 PolarHBondContact O-N 3.13Å; A391-G395 PolarHBondContact O-N 3.35Å
392	I	98.6	Very high	96.1	Very high	0 Å²	0	8.4 Å²	8.4	0%	0	5%	0.047	C	C	.	.	H	α-helix	trans	-65	-44.7	178.3	-67.5	163	0	0	0	111.3	L297 V353 F373 V376 A377 S388 L389 M390 S394 G395 M396	L297-I392 HydrophobicContact CD1-CD1 3.99Å; V353-I392 HydrophobicContact CG1-CG2 4.47Å; V353-I392 HydrophobicContact CG2-CB 4.44Å; V353-I392 HydrophobicContact CG2-CG1 4.01Å; V353-I392 HydrophobicContact CG2-CG2 4.46Å; F373-I392 HydrophobicContact CB-CG2 4.01Å; F373-I392 HydrophobicContact CD1-CG2 4.36Å; V376-I392 HydrophobicContact CB-CD1 4.35Å; V376-I392 HydrophobicContact CG1-CD1 3.69Å; A377-I392 HydrophobicContact CB-CB 4.24Å; A377-I392 HydrophobicContact CB-CD1 4.32Å; A377-I392 HydrophobicContact CB-CG2 3.82Å; S388-I392 WeakPolarHBondContact O-CD1 3.39Å; S388-I392 VanDerWaalsContact O-CG1 3.25Å; S388-I392 WeakPolarHBondContact O-CG1 3.31Å; S388-I392 PolarHBondContact O-N 3.39Å; L389-I392 PolarHBondContact O-N 3.36Å; M390-I392 PolarHBondContact O-N 3.32Å; I392-S394 VanDerWaalsContact C-N 3.32Å; I392-S394 PolarHBondContact O-N 3.34Å; I392-G395 PolarHBondContact O-N 3.43Å; I392-M396 HydrophobicContact CG2-CE 3.51Å; I392-M396 PolarHBondContact O-N 3.49Å; I392-M396 VanDerWaalsContact O-N 3.11Å
393	I	96.3	Very high	95.9	Very high	0 Å²	0	5 Å²	5	0%	0	3%	0.028	C	C	.	.	H	α-helix	trans	-59.5	-44.9	173.5	-69	170.5	0	0	0	110.3	F6 L389 M390 G395 M396 N397 F416 L419 E420 M423	F6-I393 HydrophobicContact CE1-CG2 3.68Å; F6-I393 HydrophobicContact CZ-CG2 3.91Å; L389-I393 HydrophobicContact CD1-CD1 3.66Å; L389-I393 HydrophobicContact CD1-CG1 4.19Å; L389-I393 HydrophobicContact CG-CD1 4.11Å; L389-I393 WeakPolarHBondContact O-CG1 3.45Å; L389-I393 PolarHBondContact O-N 3.03Å; M390-I393 PolarHBondContact O-N 3.41Å; I393-G395 VanDerWaalsContact C-N 3.35Å; I393-G395 PolarHBondContact O-N 2.96Å; I393-M396 PolarHBondContact O-N 3.48Å; I393-N397 WeakPolarHBondContact CG2-ND2 3.46Å; I393-N397 WeakPolarHBondContact O-CB 3.45Å; I393-N397 PolarHBondContact O-N 3.04Å; I393-N397 PolarHBondContact O-ND2 3.31Å; I393-F416 HydrophobicContact CG1-CE2 4.18Å; I393-F416 HydrophobicContact CG2-CE2 4.43Å; I393-F416 HydrophobicContact CG2-CZ 4.44Å; I393-L419 HydrophobicContact CD1-CB 4.13Å; I393-E420 HydrophobicContact CG2-CG 4.22Å; I393-M423 HydrophobicContact CD1-CB 4.07Å; I393-M423 HydrophobicContact CD1-CG 3.76Å
394	S	92.1	Very high	95.9	Very high	8 Å²	8	4.9 Å²	4.9	6%	0.056	3%	0.027	C	C	.	.	H	α-helix	trans	-57.3	-47.4	178.5	-56.3	0	0	0	0	111.3	Y10 M390 A391 I392 M396 N397 M398	Y10-S394 PolarHBondContact OH-OG 3.29Å; M390-S394 WeakPolarHBondContact O-CB 3.43Å; M390-S394 PolarHBondContact O-N 3.39Å; M390-S394 PolarHBondContact O-OG 3.45Å; A391-S394 WeakPolarHBondContact O-CB 3.41Å; A391-S394 PolarHBondContact O-N 3.13Å; I392-S394 VanDerWaalsContact C-N 3.32Å; I392-S394 PolarHBondContact O-N 3.34Å; S394-M396 PolarHBondContact O-N 2.93Å; S394-N397 PolarHBondContact O-N 3.36Å; S394-M398 WeakPolarHBondContact O-CG 3.4Å; S394-M398 PolarHBondContact O-N 2.79Å; S394-M398 VanDerWaalsContact O-N 3.09Å
395	G	94.3	Very high	95.8	Very high	0 Å²	0	9 Å²	9	0%	0	5%	0.045	C	C	.	.	H	α-helix	trans	-58.6	-45.4	176.6	0	0	0	0	0	113.2	S350 A391 I392 I393 N397 M398	S350-G395 WeakPolarHBondContact O-CA 3.33Å; A391-G395 PolarHBondContact O-N 3.35Å; I392-G395 PolarHBondContact O-N 3.43Å; I393-G395 VanDerWaalsContact C-N 3.35Å; I393-G395 PolarHBondContact O-N 2.96Å; G395-N397 VanDerWaalsContact C-N 3.29Å; G395-N397 PolarHBondContact O-N 2.94Å; G395-M398 WeakPolarHBondContact O-CB 3.41Å; G395-M398 PolarHBondContact O-N 2.96Å
396	M	95.8	Very high	95.7	Very high	0 Å²	0	15 Å²	15	0%	0	7%	0.071	C	C	.	.	H	α-helix	trans	-66.6	-29.7	176.6	-74	-169.5	-89.6	0	0	113.3	V353 I357 I370 I374 I392 I393 S394 V401 W408 F416	V353-M396 HydrophobicContact CG1-CG 4.14Å; I357-M396 HydrophobicContact CD1-CG 3.87Å; I370-M396 HydrophobicContact CG2-SD 4.12Å; I374-M396 HydrophobicContact CG1-CE 4.1Å; I374-M396 HydrophobicContact CG1-SD 3.94Å; I392-M396 HydrophobicContact CG2-CE 3.51Å; I392-M396 PolarHBondContact O-N 3.49Å; I392-M396 VanDerWaalsContact O-N 3.11Å; I393-M396 PolarHBondContact O-N 3.48Å; S394-M396 PolarHBondContact O-N 2.93Å; M396-V401 WeakPolarHBondContact O-CG1 3.43Å; M396-W408 HydrophobicContact CB-CH2 4.35Å; M396-W408 HydrophobicContact SD-CH2 4.28Å; M396-F416 HydrophobicContact CB-CE2 4.01Å; M396-F416 HydrophobicContact CB-CZ 3.89Å; M396-F416 HydrophobicContact CE-CD2 3.59Å; M396-F416 HydrophobicContact CE-CE2 3.32Å; M396-F416 HydrophobicContact CE-CZ 4.38Å; M396-F416 HydrophobicContact CG-CE2 4.46Å; M396-F416 HydrophobicContact SD-CD2 3.91Å; M396-F416 HydrophobicContact SD-CE2 3.68Å; M396-F416 HydrophobicContact SD-CZ 4.33Å
397	N	92.1	Very high	95.6	Very high	14 Å²	14	14.9 Å²	14.9	8%	0.075	7%	0.071	C	C	.	.	H	α-helix	trans	-85.9	-8.3	179.9	-84.3	-36.2	0	0	0	114.9	F6 I393 S394 G395 E420	F6-N397 WeakPolarHBondContact CD1-ND2 3.3Å; F6-N397 VanDerWaalsContact CE1-ND2 3.31Å; F6-N397 WeakPolarHBondContact CE1-ND2 3.46Å; I393-N397 WeakPolarHBondContact CG2-ND2 3.46Å; I393-N397 WeakPolarHBondContact O-CB 3.45Å; I393-N397 PolarHBondContact O-N 3.04Å; I393-N397 PolarHBondContact O-ND2 3.31Å; S394-N397 PolarHBondContact O-N 3.36Å; G395-N397 VanDerWaalsContact C-N 3.29Å; G395-N397 PolarHBondContact O-N 2.94Å; N397-E420 PolarHBondContact ND2-OE1 2.7Å; N397-E420 PolarHBondContact OD1-OE1 3.09Å
398	M	91.1	Very high	95.6	Very high	37 Å²	37	15.5 Å²	15.5	18%	0.182	7%	0.073	C	C	.	.	S	Bend	trans	-54	143.8	171.9	-66	-172.7	176.3	0	0	111	Y351 A354 S394 G395 P400 V401 S402 L527	Y351-M398 HydrophobicContact CD1-CE 4.12Å; Y351-M398 HydrophobicContact CD1-SD 4.2Å; Y351-M398 HydrophobicContact CD2-CE 3.62Å; Y351-M398 HydrophobicContact CE1-CE 4.22Å; Y351-M398 HydrophobicContact CE1-SD 4.29Å; Y351-M398 HydrophobicContact CE2-CE 3.75Å; Y351-M398 HydrophobicContact CG-CE 3.8Å; Y351-M398 HydrophobicContact CG-SD 4.39Å; A354-M398 HydrophobicContact CB-SD 3.64Å; S394-M398 WeakPolarHBondContact O-CG 3.4Å; S394-M398 PolarHBondContact O-N 2.79Å; S394-M398 VanDerWaalsContact O-N 3.09Å; G395-M398 WeakPolarHBondContact O-CB 3.41Å; G395-M398 PolarHBondContact O-N 2.96Å; M398-P400 VanDerWaalsContact C-CD 3.46Å; M398-V401 PolarHBondContact O-N 2.91Å; M398-V401 VanDerWaalsContact O-N 3.14Å; M398-S402 WeakPolarHBondContact O-CB 3.47Å; M398-S402 PolarHBondContact O-N 3.16Å; M398-S402 PolarHBondContact O-OG 3.44Å; M398-S402 VanDerWaalsContact O-OG 3.12Å; M398-L527 HydrophobicContact SD-CD1 4.08Å
399	S	93.3	Very high	95.5	Very high	25 Å²	25	20 Å²	20	18%	0.175	10%	0.104	C	C	.	.	H	α-helix	trans	-55.8	-42.4	-176.5	-156.2	0	0	0	0	114.3	R11 V401 S402 R403 Y528	R11-S399 PolarHBondContact NH2-OG 2.96Å; S399-V401 VanDerWaalsContact C-N 3.27Å; S399-V401 PolarHBondContact O-N 3.04Å; S399-S402 PolarHBondContact O-N 2.88Å; S399-R403 WeakPolarHBondContact O-CB 3.19Å; S399-R403 WeakPolarHBondContact O-CG 3.41Å; S399-R403 PolarHBondContact O-N 2.81Å; S399-Y528 WeakPolarHBondContact CB-OH 3.49Å; S399-Y528 PolarHBondContact OG-OH 3.47Å
400	P	93	Very high	95.5	Very high	4 Å²	4	26.3 Å²	26.3	3%	0.026	13%	0.132	C	C	.	.	H	α-helix	trans	-60.8	-34.4	178.6	-25.5	37.1	0	0	0	113.4	M398 R403 L404 L527 Y528 S531	M398-P400 VanDerWaalsContact C-CD 3.46Å; P400-R403 WeakPolarHBondContact O-CG 3.39Å; P400-L404 WeakPolarHBondContact O-CG 3.39Å; P400-L527 HydrophobicContact CB-CB 3.92Å; P400-L527 HydrophobicContact CG-CB 3.8Å; P400-Y528 HydrophobicContact CB-CG 4.5Å; P400-Y528 HydrophobicContact CG-CD1 3.98Å; P400-Y528 HydrophobicContact CG-CD2 3.6Å; P400-Y528 HydrophobicContact CG-CE1 4.08Å; P400-Y528 HydrophobicContact CG-CE2 3.66Å; P400-Y528 HydrophobicContact CG-CG 3.76Å; P400-S531 VanDerWaalsContact O-CB 3.27Å; P400-S531 WeakPolarHBondContact O-CB 3.33Å; P400-S531 PolarHBondContact O-OG 3.45Å; P400-S531 VanDerWaalsContact O-OG 3.1Å
401	V	96.6	Very high	95.5	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-79.8	-47.1	178.4	178.2	0	0	0	0	110.7	A354 I357 M396 M398 S399 R403 L404 W408	A354-V401 HydrophobicContact CB-CG2 3.73Å; I357-V401 HydrophobicContact CB-CG1 4.45Å; I357-V401 HydrophobicContact CB-CG2 4.44Å; I357-V401 HydrophobicContact CD1-CG1 4.01Å; I357-V401 HydrophobicContact CG2-CG1 3.82Å; I357-V401 HydrophobicContact CG2-CG2 4.43Å; M396-V401 WeakPolarHBondContact O-CG1 3.43Å; M398-V401 PolarHBondContact O-N 2.91Å; M398-V401 VanDerWaalsContact O-N 3.14Å; S399-V401 VanDerWaalsContact C-N 3.27Å; S399-V401 PolarHBondContact O-N 3.04Å; V401-R403 PolarHBondContact O-N 2.85Å; V401-L404 WeakPolarHBondContact O-CB 3.32Å; V401-L404 WeakPolarHBondContact O-CG 3.45Å; V401-L404 PolarHBondContact O-N 3.22Å; V401-L404 VanDerWaalsContact O-N 3.1Å; V401-W408 HydrophobicContact CG1-CZ2 4Å; V401-W408 PolarHBondContact O-NE1 2.72Å
402	S	95.3	Very high	95.6	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-75.5	-7.5	-170.1	78.8	0	0	0	0	113.8	R7 M398 S399 K405	R7-S402 PolarHBondContact NH2-O 2.92Å; R7-S402 PolarHBondContact NH2-OG 2.7Å; R7-S402 VanDerWaalsContact NH2-OG 3.09Å; M398-S402 WeakPolarHBondContact O-CB 3.47Å; M398-S402 PolarHBondContact O-N 3.16Å; M398-S402 PolarHBondContact O-OG 3.44Å; M398-S402 VanDerWaalsContact O-OG 3.12Å; S399-S402 PolarHBondContact O-N 2.88Å; S402-K405 PolarHBondContact O-NZ 2.9Å
403	R	95.3	Very high	95.4	Very high	11 Å²	11	37.1 Å²	37.1	4%	0.042	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.4	-12.9	169.5	71.2	172.7	-69.9	-69.7	-1.2	114.7	S399 P400 V401 K405 S531 E535 G536 E542	S399-R403 WeakPolarHBondContact O-CB 3.19Å; S399-R403 WeakPolarHBondContact O-CG 3.41Å; S399-R403 PolarHBondContact O-N 2.81Å; P400-R403 WeakPolarHBondContact O-CG 3.39Å; V401-R403 PolarHBondContact O-N 2.85Å; R403-K405 WeakPolarHBondContact O-CG 3.24Å; R403-K405 PolarHBondContact O-N 3.35Å; R403-S531 VanDerWaalsContact CD-OG 3.26Å; R403-S531 WeakPolarHBondContact CD-OG 3.06Å; R403-S531 WeakPolarHBondContact CG-OG 3.17Å; R403-S531 PolarHBondContact NH1-O 3.07Å; R403-S531 PolarHBondContact NH1-OG 2.85Å; R403-E535 PolarHBondContact NH1-O 2.82Å; R403-E535 PolarHBondContact NH2-O 3Å; R403-G536 PolarHBondContact NH2-O 3.14Å; R403-E542 IonicContact CZ-OE1 3.56Å; R403-E542 IonicContact CZ-OE2 3.66Å; R403-E542 IonicContact NE-OE1 2.7Å; R403-E542 PolarHBondContact NE-OE1 3.23Å; R403-E542 IonicContact NE-OE2 3.33Å; R403-E542 PolarHBondContact NE-OE2 3.44Å; R403-E542 IonicContact NH2-OE1 3.76Å; R403-E542 IonicContact NH2-OE2 3.9Å; R403-E542 PolarHBondContact NH2-OE2 3.21Å
404	L	96.3	Very high	95.5	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.21	C	C	.	.			trans	-72.9	61.7	-178.1	-59.1	176	0	0	0	112.4	I357 P400 V401 K406 T407 W408 E535	I357-L404 HydrophobicContact CG2-CD1 4.29Å; P400-L404 WeakPolarHBondContact O-CG 3.39Å; V401-L404 WeakPolarHBondContact O-CB 3.32Å; V401-L404 WeakPolarHBondContact O-CG 3.45Å; V401-L404 PolarHBondContact O-N 3.22Å; V401-L404 VanDerWaalsContact O-N 3.1Å; L404-K406 PolarHBondContact O-N 3.42Å; L404-T407 WeakPolarHBondContact O-CB 3.37Å; L404-T407 PolarHBondContact O-N 3.17Å; L404-W408 PolarHBondContact O-N 2.77Å; L404-E535 WeakPolarHBondContact CA-OE2 3.48Å; L404-E535 HydrophobicContact CD2-CB 3.88Å; L404-E535 HydrophobicContact CD2-CG 3.91Å
405	K	96.3	Very high	95.7	Very high	86 Å²	86	44 Å²	44	37%	0.374	23%	0.225	S	C	.	.	H	α-helix	trans	-57.6	-35.8	-169.5	-60.2	-48.5	-175.5	-169	0	112.8	S402 R403 T407 W408 S409 E535	S402-K405 PolarHBondContact O-NZ 2.9Å; R403-K405 WeakPolarHBondContact O-CG 3.24Å; R403-K405 PolarHBondContact O-N 3.35Å; K405-T407 VanDerWaalsContact C-N 3.34Å; K405-W408 PolarHBondContact O-N 3.2Å; K405-S409 PolarHBondContact O-N 3.36Å; K405-E535 PolarHBondContact N-OE2 2.8Å
406	K	96.2	Very high	95.8	Very high	125 Å²	125	44 Å²	44	54%	0.543	23%	0.225	S	C	.	.	H	α-helix	trans	-71.8	-31.8	179.7	-57.8	173.7	-178.1	171.4	0	111.3	K363 L404 S409 E535	K363-K406 HydrophobicContact CD-CB 3.94Å; K363-K406 WeakPolarHBondContact CD-O 3.37Å; L404-K406 PolarHBondContact O-N 3.42Å; K406-S409 PolarHBondContact O-OG 3.46Å; K406-E535 VanDerWaalsContact CB-OE2 3.32Å; K406-E535 WeakPolarHBondContact CB-OE2 3.22Å; K406-E535 PolarHBondContact N-OE2 3.29Å
407	T	97.7	Very high	95.8	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-71.2	-49.6	172.8	-58.6	0	0	0	0	110.2	R366 A367 I370 L404 K405 S409 K410 E535	R366-T407 HydrophobicContact CB-CG2 3.58Å; R366-T407 PolarHBondContact NE-OG1 3.02Å; R366-T407 PolarHBondContact NH2-OG1 2.96Å; A367-T407 HydrophobicContact CB-CG2 4.25Å; I370-T407 HydrophobicContact CD1-CG2 3.75Å; L404-T407 WeakPolarHBondContact O-CB 3.37Å; L404-T407 PolarHBondContact O-N 3.17Å; K405-T407 VanDerWaalsContact C-N 3.34Å; T407-S409 VanDerWaalsContact C-N 3.26Å; T407-S409 PolarHBondContact O-N 3.13Å; T407-K410 WeakPolarHBondContact O-CB 3.18Å; T407-K410 PolarHBondContact O-N 3.02Å; T407-E535 WeakPolarHBondContact CB-OE1 3.29Å; T407-E535 PolarHBondContact N-OE1 3.08Å; T407-E535 PolarHBondContact OG1-OE1 3.49Å
408	W	97.9	Very high	96.1	Very high	15 Å²	15	51.6 Å²	51.6	6%	0.057	26%	0.264	C	S	.	.	H	α-helix	trans	-60.2	-31.7	-179.9	-77.4	107.5	0	0	0	113.7	F2 I370 M396 V401 L404 K405 K410 V411 T413 F416	F2-W408 HydrophobicContact CE1-CH2 4.45Å; F2-W408 HydrophobicContact CE1-CZ3 4.38Å; F2-W408 AromaticContact CE2-CD2 3.88Å; F2-W408 HydrophobicContact CE2-CD2 3.88Å; F2-W408 HydrophobicContact CE2-CE3 4.23Å; F2-W408 HydrophobicContact CE2-CG 4.07Å; F2-W408 AromaticContact CZ-CD2 3.67Å; F2-W408 HydrophobicContact CZ-CD2 3.67Å; F2-W408 AromaticContact CZ-CE2 3.89Å; F2-W408 AromaticContact CZ-CE3 3.58Å; F2-W408 HydrophobicContact CZ-CE3 3.58Å; F2-W408 HydrophobicContact CZ-CG 4.32Å; F2-W408 AromaticContact CZ-CH2 3.89Å; F2-W408 HydrophobicContact CZ-CH2 3.89Å; F2-W408 HydrophobicContact CZ-CZ2 4Å; F2-W408 AromaticContact CZ-CZ3 3.69Å; F2-W408 HydrophobicContact CZ-CZ3 3.69Å; I370-W408 HydrophobicContact CD1-CD2 4.38Å; I370-W408 HydrophobicContact CD1-CZ2 4.31Å; I370-W408 HydrophobicContact CG2-CE3 4.32Å; I370-W408 HydrophobicContact CG2-CH2 3.73Å; I370-W408 HydrophobicContact CG2-CZ2 4.48Å; I370-W408 HydrophobicContact CG2-CZ3 3.62Å; M396-W408 HydrophobicContact CB-CH2 4.35Å; M396-W408 HydrophobicContact SD-CH2 4.28Å; V401-W408 HydrophobicContact CG1-CZ2 4Å; V401-W408 PolarHBondContact O-NE1 2.72Å; L404-W408 PolarHBondContact O-N 2.77Å; K405-W408 PolarHBondContact O-N 3.2Å; W408-K410 PolarHBondContact O-N 2.91Å; W408-K410 VanDerWaalsContact O-N 3.11Å; W408-V411 HydrophobicContact CE3-CB 4.15Å; W408-V411 HydrophobicContact CE3-CG1 4.2Å; W408-V411 HydrophobicContact CE3-CG2 4.33Å; W408-V411 HydrophobicContact CZ3-CG1 4.18Å; W408-V411 PolarHBondContact O-N 3.04Å; W408-T413 HydrophobicContact CE3-CG2 4.2Å; W408-T413 HydrophobicContact CZ3-CG2 4.47Å; W408-F416 HydrophobicContact CH2-CE1 4.35Å
409	S	97.4	Very high	96.4	Very high	93 Å²	93	50.1 Å²	50.1	65%	0.65	26%	0.258	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-9.2	174.8	69.9	0	0	0	0	114.5	K405 K406 T407	K405-S409 PolarHBondContact O-N 3.36Å; K406-S409 PolarHBondContact O-OG 3.46Å; T407-S409 VanDerWaalsContact C-N 3.26Å; T407-S409 PolarHBondContact O-N 3.13Å
410	K	97.4	Very high	96.4	Very high	134 Å²	134	49.8 Å²	49.8	58%	0.583	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.3	-7.2	173.5	-67.4	-65.7	-175.1	-176.9	0	113.7	A367 T407 W408	A367-K410 HydrophobicContact CB-CB 3.93Å; T407-K410 WeakPolarHBondContact O-CB 3.18Å; T407-K410 PolarHBondContact O-N 3.02Å; W408-K410 PolarHBondContact O-N 2.91Å; W408-K410 VanDerWaalsContact O-N 3.11Å
411	V	98	Very high	96.5	Very high	13 Å²	13	54.3 Å²	54.3	8%	0.079	27%	0.274	C	S	.	.	S	Bend	trans	-94.1	137.6	-177.1	175.3	0	0	0	0	109.6	A367 I370 E371 I374 W408 T413	A367-V411 HydrophobicContact CB-CG2 3.94Å; I370-V411 HydrophobicContact CB-CG2 3.99Å; I370-V411 HydrophobicContact CD1-CG2 4.03Å; I370-V411 HydrophobicContact CG2-CB 4.47Å; I370-V411 HydrophobicContact CG2-CG1 3.74Å; I370-V411 HydrophobicContact CG2-CG2 3.92Å; E371-V411 HydrophobicContact CG-CG1 3.95Å; I374-V411 HydrophobicContact CD1-CG1 3.86Å; W408-V411 HydrophobicContact CE3-CB 4.15Å; W408-V411 HydrophobicContact CE3-CG1 4.2Å; W408-V411 HydrophobicContact CE3-CG2 4.33Å; W408-V411 HydrophobicContact CZ3-CG1 4.18Å; W408-V411 PolarHBondContact O-N 3.04Å; V411-T413 HydrophobicContact CG1-CG2 4.38Å; V411-T413 PolarHBondContact O-N 3.33Å
412	K	96	Very high	96.3	Very high	169 Å²	169	56.8 Å²	56.8	74%	0.735	29%	0.285	S	S	*	.			trans	-78.3	97.5	168.5	-64.8	177.6	-177	177	0	110.6	E371 A414	E371-K412 PolarHBondContact OE1-N 2.65Å; E371-K412 VanDerWaalsContact OE1-N 3.15Å; K412-A414 PolarHBondContact O-N 3.03Å
413	T	95.5	Very high	96.1	Very high	45 Å²	45	56.8 Å²	56.8	28%	0.276	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.8	-16.2	-171.5	65.2	0	0	0	0	115.1	W408 V411 K415 F416 D417	W408-T413 HydrophobicContact CE3-CG2 4.2Å; W408-T413 HydrophobicContact CZ3-CG2 4.47Å; V411-T413 HydrophobicContact CG1-CG2 4.38Å; V411-T413 PolarHBondContact O-N 3.33Å; T413-K415 VanDerWaalsContact C-N 3.26Å; T413-K415 PolarHBondContact O-N 3.16Å; T413-F416 CarbonylContact O-C 3.55Å; T413-F416 WeakPolarHBondContact O-CA 3.3Å; T413-F416 VanDerWaalsContact O-CB 3.28Å; T413-F416 WeakPolarHBondContact O-CB 3.32Å; T413-F416 PolarHBondContact O-N 3.22Å; T413-D417 VanDerWaalsContact C-OD2 3.3Å; T413-D417 WeakPolarHBondContact CB-OD2 3.13Å; T413-D417 VanDerWaalsContact O-CG 3.31Å; T413-D417 PolarHBondContact O-N 2.97Å; T413-D417 PolarHBondContact OG1-OD2 3.12Å
414	A	97.2	Very high	95.6	Very high	68 Å²	68	57.1 Å²	57.1	56%	0.562	29%	0.288	S	S	*	.	H	α-helix	trans	-52.2	-40.6	-172	0	0	0	0	0	114.2	K412 I418	K412-A414 PolarHBondContact O-N 3.03Å; A414-I418 WeakPolarHBondContact O-CD1 3.22Å; A414-I418 VanDerWaalsContact O-CG1 3.3Å; A414-I418 WeakPolarHBondContact O-CG1 3.47Å; A414-I418 PolarHBondContact O-N 3.07Å
415	K	96.1	Very high	94.9	Very high	86 Å²	86	58.1 Å²	58.1	37%	0.374	29%	0.294	S	S	.	.	H	α-helix	trans	-65.9	-41.1	174.7	-70.1	179.9	-177.5	175.4	0	112.1	I374 D375 T413 I418 L419	I374-K415 HydrophobicContact CG2-CB 3.56Å; I374-K415 HydrophobicContact CG2-CD 4.26Å; D375-K415 IonicContact OD1-NZ 2.67Å; D375-K415 PolarHBondContact OD1-NZ 2.95Å; D375-K415 IonicContact OD2-NZ 3.55Å; T413-K415 VanDerWaalsContact C-N 3.26Å; T413-K415 PolarHBondContact O-N 3.16Å; K415-I418 PolarHBondContact O-N 3.33Å; K415-L419 WeakPolarHBondContact O-CG 3.36Å; K415-L419 PolarHBondContact O-N 3.38Å; K415-L419 VanDerWaalsContact O-N 3.16Å
416	F	97.1	Very high	94.2	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-64.9	-45.5	177.7	-174.8	-113.1	0	0	0	111.4	F2 I374 I393 M396 W408 T413 I418 L419 E420	F2-F416 HydrophobicContact CD1-CE1 4.21Å; F2-F416 AromaticContact CE1-CD1 3.82Å; F2-F416 HydrophobicContact CE1-CD1 3.82Å; F2-F416 AromaticContact CE1-CE1 3.56Å; F2-F416 HydrophobicContact CE1-CE1 3.56Å; F2-F416 HydrophobicContact CZ-CE1 4.47Å; I374-F416 HydrophobicContact CD1-CB 3.76Å; I374-F416 HydrophobicContact CD1-CG 4.36Å; I374-F416 HydrophobicContact CG1-CB 3.93Å; I374-F416 HydrophobicContact CG1-CD2 4.03Å; I374-F416 HydrophobicContact CG1-CG 4.29Å; I374-F416 HydrophobicContact CG2-CB 4.41Å; I393-F416 HydrophobicContact CG1-CE2 4.18Å; I393-F416 HydrophobicContact CG2-CE2 4.43Å; I393-F416 HydrophobicContact CG2-CZ 4.44Å; M396-F416 HydrophobicContact CB-CE2 4.01Å; M396-F416 HydrophobicContact CB-CZ 3.89Å; M396-F416 HydrophobicContact CE-CD2 3.59Å; M396-F416 HydrophobicContact CE-CE2 3.32Å; M396-F416 HydrophobicContact CE-CZ 4.38Å; M396-F416 HydrophobicContact CG-CE2 4.46Å; M396-F416 HydrophobicContact SD-CD2 3.91Å; M396-F416 HydrophobicContact SD-CE2 3.68Å; M396-F416 HydrophobicContact SD-CZ 4.33Å; W408-F416 HydrophobicContact CH2-CE1 4.35Å; T413-F416 CarbonylContact O-C 3.55Å; T413-F416 WeakPolarHBondContact O-CA 3.3Å; T413-F416 VanDerWaalsContact O-CB 3.28Å; T413-F416 WeakPolarHBondContact O-CB 3.32Å; T413-F416 PolarHBondContact O-N 3.22Å; F416-I418 PolarHBondContact O-N 3.37Å; F416-L419 PolarHBondContact O-N 2.9Å; F416-E420 HydrophobicContact CD1-CG 4.09Å; F416-E420 HydrophobicContact CE1-CG 3.68Å; F416-E420 WeakPolarHBondContact CE1-OE2 3.41Å; F416-E420 HydrophobicContact CE2-CG 4.13Å; F416-E420 HydrophobicContact CZ-CG 3.71Å; F416-E420 PolarHBondContact O-N 3.37Å
417	D	96.7	Very high	93.9	Very high	69 Å²	69	55.9 Å²	55.9	37%	0.369	31%	0.305	S	S	.	.	H	α-helix	trans	-59	-36.8	179.2	-58.5	-41.3	0	0	0	111.3	T413 H421	T413-D417 VanDerWaalsContact C-OD2 3.3Å; T413-D417 WeakPolarHBondContact CB-OD2 3.13Å; T413-D417 VanDerWaalsContact O-CG 3.31Å; T413-D417 PolarHBondContact O-N 2.97Å; T413-D417 PolarHBondContact OG1-OD2 3.12Å; D417-H421 WeakPolarHBondContact O-CB 3.25Å; D417-H421 PolarHBondContact O-N 2.77Å
418	I	97.3	Very high	93.2	Very high	103 Å²	103	57.6 Å²	57.6	53%	0.528	32%	0.315	S	S	.	.	H	α-helix	trans	-66.1	-46	173.4	-67.2	164.2	0	0	0	111.2	A414 K415 F416 H421 Q422	A414-I418 WeakPolarHBondContact O-CD1 3.22Å; A414-I418 VanDerWaalsContact O-CG1 3.3Å; A414-I418 WeakPolarHBondContact O-CG1 3.47Å; A414-I418 PolarHBondContact O-N 3.07Å; K415-I418 PolarHBondContact O-N 3.33Å; F416-I418 PolarHBondContact O-N 3.37Å; I418-H421 WeakPolarHBondContact O-CB 3.26Å; I418-H421 PolarHBondContact O-N 2.77Å; I418-Q422 WeakPolarHBondContact O-CG 3.33Å; I418-Q422 PolarHBondContact O-N 3.49Å
419	L	96.9	Very high	92.9	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.037	31%	0.313	C	S	.	.	H	α-helix	trans	-65.2	-40.3	179.8	-67.3	170.4	0	0	0	111.7	I374 A377 R378 F381 L389 I393 K415 F416 H421 Q422 M423	I374-L419 HydrophobicContact CG2-CD1 4.42Å; A377-L419 HydrophobicContact CB-CD1 3.86Å; R378-L419 HydrophobicContact CB-CD1 4.2Å; R378-L419 HydrophobicContact CB-CD2 4.44Å; F381-L419 HydrophobicContact CB-CD2 4.25Å; L389-L419 HydrophobicContact CD1-CB 4.41Å; L389-L419 HydrophobicContact CD1-CD2 4.05Å; I393-L419 HydrophobicContact CD1-CB 4.13Å; K415-L419 WeakPolarHBondContact O-CG 3.36Å; K415-L419 PolarHBondContact O-N 3.38Å; K415-L419 VanDerWaalsContact O-N 3.16Å; F416-L419 PolarHBondContact O-N 2.9Å; L419-H421 VanDerWaalsContact C-N 3.31Å; L419-H421 PolarHBondContact O-N 3.21Å; L419-Q422 PolarHBondContact O-N 3.37Å; L419-M423 PolarHBondContact O-N 2.94Å; L419-M423 VanDerWaalsContact O-N 3.15Å
420	E	93.9	Very high	92.8	Very high	18 Å²	18	59.5 Å²	59.5	8%	0.084	31%	0.309	C	S	.	.	H	α-helix	trans	-59.4	-43.3	171.7	-72.3	-165.6	114.7	0	0	111	F6 I393 N397 F416 Q422 M423 D424	F6-E420 HydrophobicContact CE2-CB 4.35Å; F6-E420 WeakPolarHBondContact CE2-O 3.29Å; I393-E420 HydrophobicContact CG2-CG 4.22Å; N397-E420 PolarHBondContact ND2-OE1 2.7Å; N397-E420 PolarHBondContact OD1-OE1 3.09Å; F416-E420 HydrophobicContact CD1-CG 4.09Å; F416-E420 HydrophobicContact CE1-CG 3.68Å; F416-E420 WeakPolarHBondContact CE1-OE2 3.41Å; F416-E420 HydrophobicContact CE2-CG 4.13Å; F416-E420 HydrophobicContact CZ-CG 3.71Å; F416-E420 PolarHBondContact O-N 3.37Å; E420-Q422 VanDerWaalsContact C-N 3.32Å; E420-Q422 PolarHBondContact O-N 2.66Å; E420-M423 CarbonylContact O-C 3.39Å; E420-M423 PolarHBondContact O-N 3.44Å; E420-D424 PolarHBondContact O-N 2.83Å
421	H	94.5	Very high	92.6	Very high	98 Å²	98	54.9 Å²	54.9	45%	0.454	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-36.8	176.9	-176.3	58.6	0	0	0	113.1	D417 I418 L419 M423 D424 N431	D417-H421 WeakPolarHBondContact O-CB 3.25Å; D417-H421 PolarHBondContact O-N 2.77Å; I418-H421 WeakPolarHBondContact O-CB 3.26Å; I418-H421 PolarHBondContact O-N 2.77Å; L419-H421 VanDerWaalsContact C-N 3.31Å; L419-H421 PolarHBondContact O-N 3.21Å; H421-M423 VanDerWaalsContact C-N 3.3Å; H421-M423 PolarHBondContact O-N 3.43Å; H421-D424 WeakPolarHBondContact O-CB 3.11Å; H421-D424 PolarHBondContact O-N 3.36Å; H421-N431 PolarHBondContact CE1-ND2 3.47Å; H421-N431 PolarHBondContact NE2-ND2 3.46Å; H421-N431 VanDerWaalsContact NE2-ND2 3.15Å; H421-N431 PolarHBondContact O-ND2 3.38Å
422	Q	94.3	Very high	92.5	Very high	53 Å²	53	54.4 Å²	54.4	25%	0.248	29%	0.287	C	S	.	.	H	α-helix	trans	-66.4	-33	176.1	-69.4	-59.5	-33.9	0	0	112.4	F381 I418 L419 E420 N431 Y432	F381-Q422 HydrophobicContact CE2-CB 4Å; F381-Q422 HydrophobicContact CE2-CG 3.98Å; F381-Q422 HydrophobicContact CZ-CG 4.24Å; I418-Q422 WeakPolarHBondContact O-CG 3.33Å; I418-Q422 PolarHBondContact O-N 3.49Å; L419-Q422 PolarHBondContact O-N 3.37Å; E420-Q422 VanDerWaalsContact C-N 3.32Å; E420-Q422 PolarHBondContact O-N 2.66Å; Q422-N431 CarbonylContact O-C 3.58Å; Q422-N431 WeakPolarHBondContact O-CB 3.34Å; Q422-Y432 WeakPolarHBondContact O-CA 3.48Å; Q422-Y432 PolarHBondContact O-N 3.23Å
423	M	89.8	Confident	92.6	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.7	15.5	179.7	-60.3	-56.6	-58	0	0	113.1	L389 M390 I393 L419 E420 H421 Y432 F457	L389-M423 HydrophobicContact CD2-CG 3.84Å; L389-M423 HydrophobicContact CD2-SD 3.68Å; L389-M423 HydrophobicContact CG-CG 4.06Å; L389-M423 HydrophobicContact CG-SD 4.32Å; M390-M423 HydrophobicContact CB-CE 3.92Å; M390-M423 HydrophobicContact CG-CE 4.12Å; M390-M423 HydrophobicContact SD-CB 3.97Å; M390-M423 HydrophobicContact SD-CE 3.95Å; M390-M423 HydrophobicContact SD-CG 4.42Å; I393-M423 HydrophobicContact CD1-CB 4.07Å; I393-M423 HydrophobicContact CD1-CG 3.76Å; L419-M423 PolarHBondContact O-N 2.94Å; L419-M423 VanDerWaalsContact O-N 3.15Å; E420-M423 CarbonylContact O-C 3.39Å; E420-M423 PolarHBondContact O-N 3.44Å; H421-M423 VanDerWaalsContact C-N 3.3Å; H421-M423 PolarHBondContact O-N 3.43Å; M423-Y432 HydrophobicContact CE-CD2 3.67Å; M423-Y432 HydrophobicContact CE-CE2 4.31Å; M423-Y432 HydrophobicContact CE-CG 4.18Å; M423-Y432 HydrophobicContact SD-CD2 3.82Å; M423-Y432 HydrophobicContact SD-CG 4.41Å; M423-F457 HydrophobicContact CE-CB 4.21Å; M423-F457 HydrophobicContact CE-CD1 4.43Å; M423-F457 HydrophobicContact CE-CG 4.4Å
424	D	85.1	Confident	92.6	Very high	17 Å²	17	47.5 Å²	47.5	9%	0.091	26%	0.258	C	S	.	.			trans	-65.6	132.4	-176.5	-170.8	-85.8	0	0	0	111.2	E420 H421 S426 F429	E420-D424 PolarHBondContact O-N 2.83Å; H421-D424 WeakPolarHBondContact O-CB 3.11Å; H421-D424 PolarHBondContact O-N 3.36Å; D424-S426 VanDerWaalsContact C-N 3.27Å; D424-S426 PolarHBondContact O-N 2.94Å; D424-S426 WeakPolarHBondContact OD1-CA 3.47Å; D424-S426 WeakPolarHBondContact OD1-CB 2.79Å; D424-S426 PolarHBondContact OD1-N 3.09Å; D424-S426 PolarHBondContact OD1-OG 2.99Å; D424-F429 WeakPolarHBondContact O-CA 3.34Å
425	P	81.3	Confident	92.7	Very high	21 Å²	21	45 Å²	45	14%	0.136	24%	0.237	C	C	.	.			trans	-75.6	-11.6	-176.4	30.6	-37	0	0	0	114.3	F9 N428 F429	F9-P425 HydrophobicContact CB-CG 3.96Å; F9-P425 HydrophobicContact CD1-CB 4.36Å; F9-P425 HydrophobicContact CD1-CG 4.29Å; F9-P425 HydrophobicContact CD2-CB 3.25Å; F9-P425 HydrophobicContact CD2-CG 3.33Å; F9-P425 HydrophobicContact CE1-CB 4.3Å; F9-P425 HydrophobicContact CE2-CB 3.11Å; F9-P425 HydrophobicContact CE2-CG 3.79Å; F9-P425 HydrophobicContact CG-CB 3.89Å; F9-P425 HydrophobicContact CG-CG 3.61Å; F9-P425 HydrophobicContact CZ-CB 3.74Å; P425-N428 PolarHBondContact O-N 3.36Å; P425-F429 HydrophobicContact CB-CD1 4.41Å; P425-F429 HydrophobicContact CB-CD2 4.39Å; P425-F429 HydrophobicContact CB-CE1 3.92Å; P425-F429 HydrophobicContact CB-CE2 3.91Å; P425-F429 HydrophobicContact CB-CZ 3.67Å; P425-F429 PolarHBondContact O-N 3.5Å; P425-F429 VanDerWaalsContact O-N 3.11Å
426	S	82.3	Confident	92.7	Very high	65 Å²	65	41.2 Å²	41.2	46%	0.455	22%	0.221	S	C	.	.	H	α-helix	trans	-59.1	150.2	-177.8	-53.4	0	0	0	0	111.6	D424 N428 F429 Y430	D424-S426 VanDerWaalsContact C-N 3.27Å; D424-S426 PolarHBondContact O-N 2.94Å; D424-S426 WeakPolarHBondContact OD1-CA 3.47Å; D424-S426 WeakPolarHBondContact OD1-CB 2.79Å; D424-S426 PolarHBondContact OD1-N 3.09Å; D424-S426 PolarHBondContact OD1-OG 2.99Å; S426-N428 PolarHBondContact O-N 3.4Å; S426-F429 PolarHBondContact O-N 3.25Å; S426-F429 VanDerWaalsContact O-N 3.13Å; S426-Y430 PolarHBondContact O-N 2.81Å
427	S	89.2	Confident	92.7	Very high	99 Å²	99	45.6 Å²	45.6	69%	0.692	24%	0.237	S	C	*	.	H	α-helix	trans	53.5	40.5	-179.3	-52.9	0	0	0	0	112.2	Y430	S427-Y430 PolarHBondContact O-N 3.1Å
428	N	84.3	Confident	92.7	Very high	37 Å²	37	43.9 Å²	43.9	20%	0.198	24%	0.236	C	C	.	.	H	α-helix	trans	51.9	54.8	-174.3	-168.5	25.2	0	0	0	112.6	P85 P425 S426 Y430 R433	P85-N428 HydrophobicContact CG-CB 4.2Å; P85-N428 PolarHBondContact O-ND2 3.12Å; P425-N428 PolarHBondContact O-N 3.36Å; S426-N428 PolarHBondContact O-N 3.4Å; N428-Y430 VanDerWaalsContact C-N 3.34Å; N428-Y430 PolarHBondContact O-N 3.11Å; N428-R433 PolarHBondContact ND2-NH2 3.41Å; N428-R433 WeakPolarHBondContact O-CD 3.43Å; N428-R433 PolarHBondContact O-NE 3.49Å; N428-R433 PolarHBondContact OD1-NH2 3.16Å
429	F	90.7	Very high	92.6	Very high	7 Å²	7	39 Å²	39	3%	0.031	21%	0.21	C	C	.	.	H	α-helix	trans	59.3	38.2	178.2	-67.8	-92.5	0	0	0	114.5	F9 M390 D424 P425 S426 N431 Y432 R433 F457 L460	F9-F429 AromaticContact CE1-CZ 3.9Å; F9-F429 HydrophobicContact CE1-CZ 3.9Å; F9-F429 HydrophobicContact CE2-CE2 4.14Å; F9-F429 HydrophobicContact CE2-CZ 4.03Å; F9-F429 HydrophobicContact CZ-CE1 4.48Å; F9-F429 AromaticContact CZ-CE2 3.75Å; F9-F429 HydrophobicContact CZ-CE2 3.75Å; F9-F429 AromaticContact CZ-CZ 3.36Å; F9-F429 HydrophobicContact CZ-CZ 3.36Å; M390-F429 HydrophobicContact CE-CE1 4.23Å; D424-F429 WeakPolarHBondContact O-CA 3.34Å; P425-F429 HydrophobicContact CB-CD1 4.41Å; P425-F429 HydrophobicContact CB-CD2 4.39Å; P425-F429 HydrophobicContact CB-CE1 3.92Å; P425-F429 HydrophobicContact CB-CE2 3.91Å; P425-F429 HydrophobicContact CB-CZ 3.67Å; P425-F429 PolarHBondContact O-N 3.5Å; P425-F429 VanDerWaalsContact O-N 3.11Å; S426-F429 PolarHBondContact O-N 3.25Å; S426-F429 VanDerWaalsContact O-N 3.13Å; F429-N431 VanDerWaalsContact C-N 3.32Å; F429-N431 PolarHBondContact O-N 3.25Å; F429-Y432 HydrophobicContact CB-CD1 4.01Å; F429-Y432 PolarHBondContact O-N 2.97Å; F429-R433 HydrophobicContact CB-CG 4.49Å; F429-R433 WeakPolarHBondContact O-CG 2.92Å; F429-R433 PolarHBondContact O-N 2.73Å; F429-F457 HydrophobicContact CE1-CD1 4.33Å; F429-F457 HydrophobicContact CE1-CE1 4Å; F429-F457 AromaticContact CZ-CE1 3.98Å; F429-F457 HydrophobicContact CZ-CE1 3.98Å; F429-L460 HydrophobicContact CB-CD2 3.63Å; F429-L460 HydrophobicContact CD1-CD2 4.17Å; F429-L460 HydrophobicContact CD2-CD1 3.93Å; F429-L460 HydrophobicContact CD2-CD2 3.61Å; F429-L460 HydrophobicContact CD2-CG 4.42Å; F429-L460 HydrophobicContact CE2-CD1 4.15Å; F429-L460 HydrophobicContact CE2-CD2 4.24Å; F429-L460 HydrophobicContact CG-CD2 3.55Å
430	Y	94.3	Very high	92.5	Very high	141 Å²	141	39.1 Å²	39.1	55%	0.553	21%	0.212	S	C	*	.	H	α-helix	trans	-51.3	-46.2	-174.7	174.2	-95.1	0	0	0	113.8	S426 S427 N428 R433 T434	S426-Y430 PolarHBondContact O-N 2.81Å; S427-Y430 PolarHBondContact O-N 3.1Å; N428-Y430 VanDerWaalsContact C-N 3.34Å; N428-Y430 PolarHBondContact O-N 3.11Å; Y430-R433 PolarHBondContact O-N 2.7Å; Y430-T434 PolarHBondContact O-N 2.64Å; Y430-T434 PolarHBondContact O-OG1 3.39Å
431	N	94.3	Very high	92.6	Very high	37 Å²	37	42 Å²	42	20%	0.198	23%	0.225	C	C	.	.	H	α-helix	trans	-65	-50	-179	-73.6	-19.8	0	0	0	111.4	H421 Q422 F429 R433 T434 A435	H421-N431 PolarHBondContact CE1-ND2 3.47Å; H421-N431 PolarHBondContact NE2-ND2 3.46Å; H421-N431 VanDerWaalsContact NE2-ND2 3.15Å; H421-N431 PolarHBondContact O-ND2 3.38Å; Q422-N431 CarbonylContact O-C 3.58Å; Q422-N431 WeakPolarHBondContact O-CB 3.34Å; F429-N431 VanDerWaalsContact C-N 3.32Å; F429-N431 PolarHBondContact O-N 3.25Å; N431-R433 VanDerWaalsContact C-N 3.33Å; N431-R433 PolarHBondContact O-N 2.88Å; N431-T434 WeakPolarHBondContact O-CB 3.36Å; N431-T434 PolarHBondContact O-N 2.92Å; N431-T434 VanDerWaalsContact O-N 3.1Å; N431-A435 PolarHBondContact O-N 3.47Å
432	Y	96.8	Very high	92.7	Very high	3 Å²	3	42 Å²	42	1%	0.012	22%	0.221	C	C	.	.	H	α-helix	trans	-56.9	-47.1	175.7	156.9	-97.9	0	0	0	111.2	F386 Q422 M423 F429 T434 A435 L436 F457 L460	F386-Y432 HydrophobicContact CB-CD2 4.34Å; F386-Y432 HydrophobicContact CB-CE2 3.74Å; F386-Y432 HydrophobicContact CD1-CD2 4.29Å; F386-Y432 HydrophobicContact CD1-CE2 4.3Å; F386-Y432 HydrophobicContact CD2-CE2 4.31Å; F386-Y432 HydrophobicContact CG-CD2 4.32Å; F386-Y432 AromaticContact CG-CE2 3.87Å; F386-Y432 HydrophobicContact CG-CE2 3.87Å; Q422-Y432 WeakPolarHBondContact O-CA 3.48Å; Q422-Y432 PolarHBondContact O-N 3.23Å; M423-Y432 HydrophobicContact CE-CD2 3.67Å; M423-Y432 HydrophobicContact CE-CE2 4.31Å; M423-Y432 HydrophobicContact CE-CG 4.18Å; M423-Y432 HydrophobicContact SD-CD2 3.82Å; M423-Y432 HydrophobicContact SD-CG 4.41Å; F429-Y432 HydrophobicContact CB-CD1 4.01Å; F429-Y432 PolarHBondContact O-N 2.97Å; Y432-T434 PolarHBondContact O-N 3.34Å; Y432-A435 CarbonylContact O-C 3.52Å; Y432-A435 WeakPolarHBondContact O-CB 3.15Å; Y432-A435 PolarHBondContact O-N 2.89Å; Y432-A435 VanDerWaalsContact O-N 3.09Å; Y432-L436 HydrophobicContact CE1-CD2 4.25Å; Y432-L436 HydrophobicContact CE2-CB 4.37Å; Y432-L436 WeakPolarHBondContact O-CB 3.17Å; Y432-L436 PolarHBondContact O-N 2.99Å; Y432-F457 HydrophobicContact CD2-CB 4.41Å; Y432-F457 HydrophobicContact CE1-CB 4.4Å; Y432-F457 HydrophobicContact CE2-CB 3.7Å; Y432-F457 PolarHBondContact OH-N 2.93Å; Y432-L460 HydrophobicContact CD1-CD2 3.65Å; Y432-L460 HydrophobicContact CE1-CD2 3.55Å
433	R	96.3	Very high	92.7	Very high	11 Å²	11	40.5 Å²	40.5	4%	0.042	22%	0.217	C	C	.	.	H	α-helix	trans	-61	-35	179.2	-69.3	-179.3	-173	-75.4	7.3	111.4	T87 N428 F429 Y430 N431 R437 D464	T87-R433 VanDerWaalsContact N-NH1 3.13Å; T87-R433 PolarHBondContact OG1-NH1 3.23Å; N428-R433 PolarHBondContact ND2-NH2 3.41Å; N428-R433 WeakPolarHBondContact O-CD 3.43Å; N428-R433 PolarHBondContact O-NE 3.49Å; N428-R433 PolarHBondContact OD1-NH2 3.16Å; F429-R433 HydrophobicContact CB-CG 4.49Å; F429-R433 WeakPolarHBondContact O-CG 2.92Å; F429-R433 PolarHBondContact O-N 2.73Å; Y430-R433 PolarHBondContact O-N 2.7Å; N431-R433 VanDerWaalsContact C-N 3.33Å; N431-R433 PolarHBondContact O-N 2.88Å; R433-R437 WeakPolarHBondContact O-CG 3.47Å; R433-R437 PolarHBondContact O-N 3.22Å; R433-R437 PolarHBondContact O-NH1 2.64Å; R433-D464 IonicContact CZ-OD2 3.54Å; R433-D464 IonicContact NH1-OD2 3.27Å; R433-D464 PolarHBondContact NH1-OD2 3.46Å; R433-D464 IonicContact NH2-OD1 3.18Å; R433-D464 PolarHBondContact NH2-OD1 3.05Å; R433-D464 IonicContact NH2-OD2 2.78Å; R433-D464 PolarHBondContact NH2-OD2 2.86Å
434	T	97.3	Very high	92.8	Very high	57 Å²	57	44.1 Å²	44.1	35%	0.35	24%	0.235	S	C	.	.	H	α-helix	trans	-67.8	-43.8	174.3	-55.9	0	0	0	0	111.8	Y430 N431 Y432 R437 G438	Y430-T434 PolarHBondContact O-N 2.64Å; Y430-T434 PolarHBondContact O-OG1 3.39Å; N431-T434 WeakPolarHBondContact O-CB 3.36Å; N431-T434 PolarHBondContact O-N 2.92Å; N431-T434 VanDerWaalsContact O-N 3.1Å; Y432-T434 PolarHBondContact O-N 3.34Å; T434-R437 PolarHBondContact O-N 3.16Å; T434-R437 PolarHBondContact OG1-NH2 3.3Å; T434-G438 PolarHBondContact O-N 3.48Å
435	A	97.8	Very high	93.2	Very high	15 Å²	15	47.4 Å²	47.4	12%	0.124	26%	0.256	C	S	.	.	H	α-helix	trans	-64	-40.9	175.1	0	0	0	0	0	112.4	F381 F386 N431 Y432 G438 A439	F381-A435 HydrophobicContact CE2-CB 3.85Å; F381-A435 HydrophobicContact CZ-CB 4.02Å; F386-A435 HydrophobicContact CE1-CB 3.91Å; F386-A435 HydrophobicContact CZ-CB 4.13Å; N431-A435 PolarHBondContact O-N 3.47Å; Y432-A435 CarbonylContact O-C 3.52Å; Y432-A435 WeakPolarHBondContact O-CB 3.15Å; Y432-A435 PolarHBondContact O-N 2.89Å; Y432-A435 VanDerWaalsContact O-N 3.09Å; A435-G438 PolarHBondContact O-N 2.93Å; A435-A439 PolarHBondContact O-N 2.89Å
436	L	97.5	Very high	93.7	Very high	7 Å²	7	47.4 Å²	47.4	4%	0.037	26%	0.258	C	S	.	.	H	α-helix	trans	-60.9	-48.6	175.1	-178.3	67.9	0	0	0	110.9	T87 F386 Y432 G438 A439 T440 V454 P456 W499	T87-L436 HydrophobicContact CG2-CD2 4.38Å; F386-L436 HydrophobicContact CD2-CD1 4.09Å; F386-L436 HydrophobicContact CE2-CD1 4.05Å; Y432-L436 HydrophobicContact CE1-CD2 4.25Å; Y432-L436 HydrophobicContact CE2-CB 4.37Å; Y432-L436 WeakPolarHBondContact O-CB 3.17Å; Y432-L436 PolarHBondContact O-N 2.99Å; L436-G438 VanDerWaalsContact C-N 3.27Å; L436-G438 PolarHBondContact O-N 2.74Å; L436-A439 CarbonylContact O-C 3.47Å; L436-A439 WeakPolarHBondContact O-CA 3.43Å; L436-A439 WeakPolarHBondContact O-CB 3.2Å; L436-A439 PolarHBondContact O-N 3.04Å; L436-T440 PolarHBondContact O-N 2.9Å; L436-T440 PolarHBondContact O-OG1 3.38Å; L436-V454 HydrophobicContact CD1-CG1 3.76Å; L436-P456 HydrophobicContact CD1-CB 4.23Å; L436-W499 HydrophobicContact CD2-CH2 4.48Å
437	R	95.8	Very high	94.1	Very high	93 Å²	93	51.8 Å²	51.8	35%	0.351	28%	0.276	S	S	.	.	H	α-helix	trans	-55.6	-43.5	174.2	-77	-168.1	-60.2	-80.1	4.5	112	P88 R433 T434 A439 T440 Q441	P88-R437 HydrophobicContact CG-CG 4.03Å; R433-R437 WeakPolarHBondContact O-CG 3.47Å; R433-R437 PolarHBondContact O-N 3.22Å; R433-R437 PolarHBondContact O-NH1 2.64Å; T434-R437 PolarHBondContact O-N 3.16Å; T434-R437 PolarHBondContact OG1-NH2 3.3Å; R437-A439 VanDerWaalsContact C-N 3.33Å; R437-A439 PolarHBondContact O-N 2.83Å; R437-T440 PolarHBondContact O-N 3.3Å; R437-Q441 WeakPolarHBondContact O-CB 3.42Å; R437-Q441 PolarHBondContact O-N 2.75Å
438	G	96.6	Very high	94.2	Very high	32 Å²	32	49.4 Å²	49.4	33%	0.33	26%	0.26	S	S	.	.	H	α-helix	trans	-58.7	-44	174.2	0	0	0	0	0	112.2	T434 A435 L436 Q441 R442	T434-G438 PolarHBondContact O-N 3.48Å; A435-G438 PolarHBondContact O-N 2.93Å; L436-G438 VanDerWaalsContact C-N 3.27Å; L436-G438 PolarHBondContact O-N 2.74Å; G438-Q441 PolarHBondContact O-N 3.43Å; G438-R442 VanDerWaalsContact O-CG 3.29Å; G438-R442 WeakPolarHBondContact O-CG 3.42Å; G438-R442 PolarHBondContact O-N 3.41Å
439	A	96.6	Very high	94.5	Very high	0 Å²	0	51 Å²	51	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-65.8	-44.3	177.1	0	0	0	0	0	113.1	F386 A435 L436 R437 Q441 R442 S443 V454	F386-A439 HydrophobicContact CE2-CB 3.74Å; F386-A439 HydrophobicContact CZ-CB 4Å; A435-A439 PolarHBondContact O-N 2.89Å; L436-A439 CarbonylContact O-C 3.47Å; L436-A439 WeakPolarHBondContact O-CA 3.43Å; L436-A439 WeakPolarHBondContact O-CB 3.2Å; L436-A439 PolarHBondContact O-N 3.04Å; R437-A439 VanDerWaalsContact C-N 3.33Å; R437-A439 PolarHBondContact O-N 2.83Å; A439-Q441 VanDerWaalsContact C-N 3.34Å; A439-Q441 PolarHBondContact O-N 2.7Å; A439-R442 VanDerWaalsContact CA-CZ 3.45Å; A439-R442 PolarHBondContact O-N 3.27Å; A439-S443 PolarHBondContact O-N 2.93Å; A439-V454 HydrophobicContact CB-CG2 4.25Å
440	T	94.9	Very high	94.5	Very high	10 Å²	10	55.6 Å²	55.6	6%	0.061	29%	0.291	C	S	.	.	H	α-helix	trans	-57.9	-47.3	173.9	-56.5	0	0	0	0	110.8	L436 R437 R442 S443 I444	L436-T440 PolarHBondContact O-N 2.9Å; L436-T440 PolarHBondContact O-OG1 3.38Å; R437-T440 PolarHBondContact O-N 3.3Å; T440-R442 PolarHBondContact O-N 2.9Å; T440-S443 WeakPolarHBondContact O-CB 3.47Å; T440-S443 PolarHBondContact O-N 3.15Å; T440-S443 VanDerWaalsContact O-N 3.12Å; T440-S443 PolarHBondContact O-OG 3.27Å; T440-I444 HydrophobicContact CG2-CD1 4.3Å; T440-I444 WeakPolarHBondContact O-CG1 3.49Å; T440-I444 PolarHBondContact O-N 3.46Å
441	Q	95.3	Very high	94.5	Very high	79 Å²	79	52.6 Å²	52.6	37%	0.369	28%	0.282	S	S	.	.	H	α-helix	trans	-61.8	-41.9	178	-173.4	58.2	59.8	0	0	112.5	R437 G438 A439 S443 I444 T445	R437-Q441 WeakPolarHBondContact O-CB 3.42Å; R437-Q441 PolarHBondContact O-N 2.75Å; G438-Q441 PolarHBondContact O-N 3.43Å; A439-Q441 VanDerWaalsContact C-N 3.34Å; A439-Q441 PolarHBondContact O-N 2.7Å; Q441-S443 VanDerWaalsContact C-N 3.28Å; Q441-S443 PolarHBondContact O-N 3.45Å; Q441-I444 PolarHBondContact O-N 3.24Å; Q441-T445 PolarHBondContact O-N 2.92Å; Q441-T445 PolarHBondContact O-OG1 3.04Å
442	R	95.4	Very high	94.5	Very high	97 Å²	97	55.8 Å²	55.8	37%	0.366	29%	0.294	S	S	.	.	H	α-helix	trans	-59.4	-39.2	174.4	-72.2	-173.1	-34.8	-102.2	4.6	112	G438 A439 T440 I444 T445 A446	G438-R442 VanDerWaalsContact O-CG 3.29Å; G438-R442 WeakPolarHBondContact O-CG 3.42Å; G438-R442 PolarHBondContact O-N 3.41Å; A439-R442 VanDerWaalsContact CA-CZ 3.45Å; A439-R442 PolarHBondContact O-N 3.27Å; T440-R442 PolarHBondContact O-N 2.9Å; R442-I444 VanDerWaalsContact C-N 3.33Å; R442-I444 PolarHBondContact O-N 3.47Å; R442-T445 CarbonylContact O-C 3.6Å; R442-T445 PolarHBondContact O-N 3.47Å; R442-A446 WeakPolarHBondContact O-CA 3.45Å; R442-A446 WeakPolarHBondContact O-CB 3.47Å; R442-A446 PolarHBondContact O-N 2.94Å
443	S	95.3	Very high	94.6	Very high	23 Å²	23	55.6 Å²	55.6	16%	0.161	29%	0.293	C	S	.	.	H	α-helix	trans	-64.9	-35.9	179.6	76.8	0	0	0	0	113.1	A439 T440 Q441 A446 E451	A439-S443 PolarHBondContact O-N 2.93Å; T440-S443 WeakPolarHBondContact O-CB 3.47Å; T440-S443 PolarHBondContact O-N 3.15Å; T440-S443 VanDerWaalsContact O-N 3.12Å; T440-S443 PolarHBondContact O-OG 3.27Å; Q441-S443 VanDerWaalsContact C-N 3.28Å; Q441-S443 PolarHBondContact O-N 3.45Å; S443-A446 VanDerWaalsContact O-CB 3.26Å; S443-A446 WeakPolarHBondContact O-CB 2.99Å; S443-E451 VanDerWaalsContact CA-O 3.27Å; S443-E451 WeakPolarHBondContact CA-O 3.47Å; S443-E451 PolarHBondContact N-O 3.49Å
444	I	91.8	Very high	94.6	Very high	76 Å²	76	55.1 Å²	55.1	39%	0.39	29%	0.291	S	S	.	.	H	α-helix	trans	-69.9	-42.4	178.8	-65.8	165.3	0	0	0	110.9	F90 T440 Q441 R442 A446	F90-I444 HydrophobicContact CD1-CD1 4.37Å; T440-I444 HydrophobicContact CG2-CD1 4.3Å; T440-I444 WeakPolarHBondContact O-CG1 3.49Å; T440-I444 PolarHBondContact O-N 3.46Å; Q441-I444 PolarHBondContact O-N 3.24Å; R442-I444 VanDerWaalsContact C-N 3.33Å; R442-I444 PolarHBondContact O-N 3.47Å; I444-A446 VanDerWaalsContact C-N 3.31Å
445	T	93.6	Very high	94.7	Very high	86 Å²	86	52.4 Å²	52.4	53%	0.528	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.9	21.5	-179.3	61.9	0	0	0	0	112.6	Q441 R442	Q441-T445 PolarHBondContact O-N 2.92Å; Q441-T445 PolarHBondContact O-OG1 3.04Å; R442-T445 CarbonylContact O-C 3.6Å; R442-T445 PolarHBondContact O-N 3.47Å
446	A	91.3	Very high	94.6	Very high	21 Å²	21	51.7 Å²	51.7	17%	0.174	27%	0.269	C	S	.	.			trans	-67.5	131.4	-172.3	0	0	0	0	0	111.8	R442 S443 I444 E451 K452	R442-A446 WeakPolarHBondContact O-CA 3.45Å; R442-A446 WeakPolarHBondContact O-CB 3.47Å; R442-A446 PolarHBondContact O-N 2.94Å; S443-A446 VanDerWaalsContact O-CB 3.26Å; S443-A446 WeakPolarHBondContact O-CB 2.99Å; I444-A446 VanDerWaalsContact C-N 3.31Å; A446-E451 HydrophobicContact CB-CB 3.64Å; A446-K452 HydrophobicContact CB-CG 3.59Å
447	N	90.3	Very high	94.5	Very high	156 Å²	156	52 Å²	52	83%	0.834	27%	0.27	S	S	*	.	S	Bend	trans	-99.7	-5.6	172.2	-63.1	-63	0	0	0	111.8	E451	N447-E451 PolarHBondContact N-OE2 2.94Å
448	S	91.9	Very high	94.2	Very high	50 Å²	50	47.7 Å²	47.7	35%	0.35	25%	0.254	S	S	.	.	S	Bend	trans	-138.9	155.3	177.5	68.2	0	0	0	0	111.8	R450 E451	S448-R450 PolarHBondContact O-N 3.43Å; S448-E451 PolarHBondContact N-OE2 2.87Å; S448-E451 PolarHBondContact O-N 3.46Å; S448-E451 WeakPolarHBondContact OG-CG 3.35Å; S448-E451 PolarHBondContact OG-OE2 3.39Å
449	S	90.3	Very high	93.5	Very high	70 Å²	70	47.2 Å²	47.2	49%	0.49	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-61.1	-27.2	176.9	-54.7	0	0	0	0	113.2	K452	S449-K452 PolarHBondContact O-N 3.29Å
450	R	92	Very high	93	Very high	104 Å²	104	47.4 Å²	47.4	39%	0.392	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-64.6	-40.6	176.5	-179.9	-179.4	176.5	166.8	4.5	112.3	E379 S448 K452 I453 P505 F506	E379-R450 IonicContact OE1-CZ 3.42Å; E379-R450 IonicContact OE1-NH2 3.86Å; E379-R450 PolarHBondContact OE1-NH2 3.41Å; S448-R450 PolarHBondContact O-N 3.43Å; R450-K452 PolarHBondContact O-N 3.17Å; R450-I453 WeakPolarHBondContact O-CG1 3.3Å; R450-I453 PolarHBondContact O-N 3.49Å; R450-P505 HydrophobicContact CB-CG 4.21Å; R450-F506 HydrophobicContact CG-CE1 4.11Å; R450-F506 HydrophobicContact CG-CZ 3.99Å
451	E	92.9	Very high	92.7	Very high	78 Å²	78	47.3 Å²	47.3	36%	0.364	25%	0.245	S	C	.	.	G	3₁₀ helix	trans	-71.4	-16.3	-177.4	-69.4	165	139.3	0	0	112.7	S443 A446 N447 S448 I453	S443-E451 VanDerWaalsContact CA-O 3.27Å; S443-E451 WeakPolarHBondContact CA-O 3.47Å; S443-E451 PolarHBondContact N-O 3.49Å; A446-E451 HydrophobicContact CB-CB 3.64Å; N447-E451 PolarHBondContact N-OE2 2.94Å; S448-E451 PolarHBondContact N-OE2 2.87Å; S448-E451 PolarHBondContact O-N 3.46Å; S448-E451 WeakPolarHBondContact OG-CG 3.35Å; S448-E451 PolarHBondContact OG-OE2 3.39Å; E451-I453 VanDerWaalsContact C-N 3.29Å; E451-I453 PolarHBondContact O-N 3.4Å
452	K	95.5	Very high	92.2	Very high	103 Å²	103	43.7 Å²	43.7	45%	0.448	23%	0.229	S	C	.	.	G	3₁₀ helix	trans	-74.2	-17.1	176.5	-63	-175.4	178.8	-177.6	0	113.6	A446 S449 R450 V454 V502	A446-K452 HydrophobicContact CB-CG 3.59Å; S449-K452 PolarHBondContact O-N 3.29Å; R450-K452 PolarHBondContact O-N 3.17Å; K452-V454 PolarHBondContact O-N 3.18Å; K452-V502 HydrophobicContact CB-CG1 4.15Å; K452-V502 HydrophobicContact CB-CG2 4.1Å; K452-V502 WeakPolarHBondContact O-CG2 3.3Å
453	I	97.4	Very high	91.5	Very high	0 Å²	0	41 Å²	41	0%	0	22%	0.22	C	C	.	.			trans	-70.3	122.4	-173.5	-57.9	168.8	0	0	0	110.2	T298 L302 I383 R450 E451 I455 V502 P505 F506	T298-I453 HydrophobicContact CG2-CD1 4.2Å; T298-I453 HydrophobicContact CG2-CG2 4.08Å; L302-I453 HydrophobicContact CD1-CG1 4.43Å; L302-I453 HydrophobicContact CD1-CG2 4.48Å; I383-I453 HydrophobicContact CG2-CB 4.36Å; I383-I453 HydrophobicContact CG2-CD1 3.99Å; I383-I453 HydrophobicContact CG2-CG2 3.92Å; R450-I453 WeakPolarHBondContact O-CG1 3.3Å; R450-I453 PolarHBondContact O-N 3.49Å; E451-I453 VanDerWaalsContact C-N 3.29Å; E451-I453 PolarHBondContact O-N 3.4Å; I453-I455 HydrophobicContact CG2-CD1 4.02Å; I453-I455 HydrophobicContact CG2-CG1 4.27Å; I453-V502 HydrophobicContact CG1-CG1 3.89Å; I453-P505 HydrophobicContact CD1-CG 3.97Å; I453-F506 HydrophobicContact CD1-CE2 3.69Å; I453-F506 HydrophobicContact CD1-CZ 3.95Å
454	V	97.8	Very high	91	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.214	C	C	.	.			trans	-137	114.5	169.3	-176.4	0	0	0	0	107.3	L436 A439 K452 W499	L436-V454 HydrophobicContact CD1-CG1 3.76Å; A439-V454 HydrophobicContact CB-CG2 4.25Å; K452-V454 PolarHBondContact O-N 3.18Å; V454-W499 HydrophobicContact CB-CB 4.46Å; V454-W499 HydrophobicContact CB-CD2 4.23Å; V454-W499 HydrophobicContact CB-CG 3.9Å; V454-W499 HydrophobicContact CG1-CD2 3.91Å; V454-W499 HydrophobicContact CG1-CE3 4.48Å; V454-W499 HydrophobicContact CG1-CG 4.13Å; V454-W499 HydrophobicContact CG1-CZ2 4.18Å; V454-W499 WeakPolarHBondContact O-CB 3.47Å
455	I	98.2	Very high	90.8	Very high	0 Å²	0	36.7 Å²	36.7	0%	0	20%	0.195	C	C	.	.	B	Isolated β-bridge	trans	-121.1	103.7	173.8	-62.2	154.7	0	0	0	106	T298 E301 L302 L305 G384 N385 F386 N387 I453	T298-I455 HydrophobicContact CG2-CD1 3.89Å; E301-I455 HydrophobicContact CB-CD1 3.69Å; E301-I455 HydrophobicContact CB-CG1 4.44Å; E301-I455 HydrophobicContact CB-CG2 4.28Å; E301-I455 HydrophobicContact CG-CD1 4.42Å; L302-I455 HydrophobicContact CD2-CD1 4.09Å; L302-I455 HydrophobicContact CD2-CG1 3.91Å; L302-I455 HydrophobicContact CG-CD1 4.08Å; L302-I455 HydrophobicContact CG-CG1 4.45Å; L305-I455 HydrophobicContact CD1-CB 4.43Å; L305-I455 HydrophobicContact CD1-CG1 4.07Å; L305-I455 HydrophobicContact CD1-CG2 4.07Å; G384-I455 PolarHBondContact O-N 3.04Å; N385-I455 HydrophobicContact CB-CD1 3.92Å; F386-I455 WeakPolarHBondContact CB-O 3.44Å; F386-I455 WeakPolarHBondContact CD2-O 3.16Å; F386-I455 PolarHBondContact N-O 3.31Å; N387-I455 HydrophobicContact CB-CG2 3.67Å; I453-I455 HydrophobicContact CG2-CD1 4.02Å; I453-I455 HydrophobicContact CG2-CG1 4.27Å
456	P	96.7	Very high	90.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.006	17%	0.171	C	C	.	.			trans	-68.9	160.1	-175.6	30.4	-36.1	0	0	0	111	N387 L436 F458 L461 W499	N387-P456 WeakPolarHBondContact CB-O 3.38Å; L436-P456 HydrophobicContact CD1-CB 4.23Å; P456-F458 PolarHBondContact O-N 2.96Å; P456-L461 HydrophobicContact CG-CD2 3.95Å; P456-W499 HydrophobicContact CB-CE3 4.45Å; P456-W499 HydrophobicContact CB-CZ3 4.01Å; P456-W499 HydrophobicContact CG-CE3 3.85Å; P456-W499 HydrophobicContact CG-CZ3 3.77Å
457	F	94.4	Very high	89.8	Confident	12 Å²	12	34.3 Å²	34.3	5%	0.053	17%	0.174	C	C	.	.			trans	-65.2	101.3	162.5	173.8	-145.6	0	0	0	108.7	F346 M390 M423 F429 Y432 S459 L460 L461	F346-F457 HydrophobicContact CE2-CD2 4.46Å; F346-F457 HydrophobicContact CE2-CE2 4.08Å; F346-F457 HydrophobicContact CZ-CE2 4.26Å; M390-F457 HydrophobicContact CB-CD2 4Å; M390-F457 HydrophobicContact CB-CE2 4.3Å; M390-F457 HydrophobicContact CB-CG 4.44Å; M390-F457 HydrophobicContact CE-CE1 3.93Å; M390-F457 HydrophobicContact CE-CZ 3.96Å; M390-F457 HydrophobicContact CG-CD1 4.43Å; M390-F457 HydrophobicContact CG-CD2 3.75Å; M390-F457 HydrophobicContact CG-CE1 4.29Å; M390-F457 HydrophobicContact CG-CE2 3.6Å; M390-F457 HydrophobicContact CG-CG 4.18Å; M390-F457 HydrophobicContact CG-CZ 3.89Å; M423-F457 HydrophobicContact CE-CB 4.21Å; M423-F457 HydrophobicContact CE-CD1 4.43Å; M423-F457 HydrophobicContact CE-CG 4.4Å; F429-F457 HydrophobicContact CE1-CD1 4.33Å; F429-F457 HydrophobicContact CE1-CE1 4Å; F429-F457 AromaticContact CZ-CE1 3.98Å; F429-F457 HydrophobicContact CZ-CE1 3.98Å; Y432-F457 HydrophobicContact CD2-CB 4.41Å; Y432-F457 HydrophobicContact CE1-CB 4.4Å; Y432-F457 HydrophobicContact CE2-CB 3.7Å; Y432-F457 PolarHBondContact OH-N 2.93Å; F457-S459 PolarHBondContact O-N 3.06Å; F457-L460 HydrophobicContact CD1-CB 3.58Å; F457-L460 HydrophobicContact CD1-CD2 4.34Å; F457-L460 HydrophobicContact CE1-CB 3.94Å; F457-L460 HydrophobicContact CG-CB 4.27Å; F457-L460 PolarHBondContact O-N 3.33Å; F457-L460 VanDerWaalsContact O-N 3.15Å; F457-L461 PolarHBondContact O-N 2.91Å
458	F	89.6	Confident	89.6	Confident	3 Å²	3	28.5 Å²	28.5	1%	0.013	14%	0.143	C	C	.	.	H	α-helix	trans	-67	-38.6	-160.7	-167.7	-107.6	0	0	0	113.5	L305 I308 F313 L339 Y342 N387 P456 L460 L461 I462 F496	L305-F458 HydrophobicContact CD2-CD2 4.37Å; L305-F458 HydrophobicContact CD2-CE2 4.3Å; I308-F458 HydrophobicContact CD1-CE1 4.48Å; I308-F458 HydrophobicContact CD1-CE2 4.2Å; I308-F458 HydrophobicContact CD1-CZ 3.81Å; F313-F458 HydrophobicContact CE1-CE2 4.18Å; F313-F458 HydrophobicContact CE1-CZ 4.1Å; F313-F458 HydrophobicContact CZ-CE2 4.02Å; F313-F458 HydrophobicContact CZ-CZ 4.07Å; L339-F458 HydrophobicContact CD1-CE1 3.31Å; L339-F458 HydrophobicContact CD1-CZ 3.28Å; L339-F458 HydrophobicContact CG-CE1 4.24Å; Y342-F458 HydrophobicContact CD1-CB 4.19Å; Y342-F458 AromaticContact CD1-CD1 3.49Å; Y342-F458 HydrophobicContact CD1-CD1 3.49Å; Y342-F458 VanDerWaalsContact CD1-CD1 3.49Å; Y342-F458 AromaticContact CD1-CD2 3.97Å; Y342-F458 HydrophobicContact CD1-CD2 3.97Å; Y342-F458 AromaticContact CD1-CE1 3.72Å; Y342-F458 HydrophobicContact CD1-CE1 3.72Å; Y342-F458 HydrophobicContact CD1-CE2 4.19Å; Y342-F458 AromaticContact CD1-CG 3.62Å; Y342-F458 HydrophobicContact CD1-CG 3.62Å; Y342-F458 HydrophobicContact CD1-CZ 4.06Å; Y342-F458 HydrophobicContact CE1-CB 3.62Å; Y342-F458 AromaticContact CE1-CD1 3.8Å; Y342-F458 HydrophobicContact CE1-CD1 3.8Å; Y342-F458 AromaticContact CE1-CD2 3.59Å; Y342-F458 HydrophobicContact CE1-CD2 3.59Å; Y342-F458 HydrophobicContact CE1-CE1 4.32Å; Y342-F458 HydrophobicContact CE1-CE2 4.15Å; Y342-F458 AromaticContact CE1-CG 3.38Å; Y342-F458 HydrophobicContact CE1-CG 3.38Å; Y342-F458 HydrophobicContact CE1-CZ 4.48Å; N387-F458 PolarHBondContact OD1-N 3.31Å; P456-F458 PolarHBondContact O-N 2.96Å; F458-L460 PolarHBondContact O-N 3.02Å; F458-L461 HydrophobicContact CD2-CD2 4.2Å; F458-L461 HydrophobicContact CE2-CD2 4.25Å; F458-L461 WeakPolarHBondContact O-CB 3.48Å; F458-L461 PolarHBondContact O-N 2.85Å; F458-L461 VanDerWaalsContact O-N 3.12Å; F458-I462 HydrophobicContact CD1-CG1 3.85Å; F458-I462 HydrophobicContact CE1-CD1 3.84Å; F458-I462 HydrophobicContact CE1-CG1 3.57Å; F458-I462 HydrophobicContact CE2-CD1 4.49Å; F458-I462 HydrophobicContact CG-CG1 4.47Å; F458-I462 HydrophobicContact CZ-CD1 3.78Å; F458-I462 HydrophobicContact CZ-CG1 3.94Å; F458-I462 WeakPolarHBondContact O-CG1 3.38Å; F458-I462 PolarHBondContact O-N 2.94Å; F458-F496 HydrophobicContact CD2-CE2 4.29Å; F458-F496 HydrophobicContact CE2-CD2 4.39Å; F458-F496 AromaticContact CE2-CE2 3.7Å; F458-F496 HydrophobicContact CE2-CE2 3.7Å; F458-F496 HydrophobicContact CE2-CZ 4.1Å
459	S	82.3	Confident	89.1	Confident	22 Å²	22	26.8 Å²	26.8	15%	0.154	13%	0.13	C	C	.	.	H	α-helix	trans	-58.3	-36.3	176.6	-58	0	0	0	0	112.8	F457 K463	F457-S459 PolarHBondContact O-N 3.06Å; S459-K463 WeakPolarHBondContact O-CB 3.31Å; S459-K463 PolarHBondContact O-N 2.82Å
460	L	85.8	Confident	88.7	Confident	5 Å²	5	27.1 Å²	27.1	3%	0.026	12%	0.124	C	C	.	.	H	α-helix	trans	-74.7	-37.3	177	-176.7	58.5	0	0	0	111.9	F429 Y432 F457 F458 K463 D464	F429-L460 HydrophobicContact CB-CD2 3.63Å; F429-L460 HydrophobicContact CD1-CD2 4.17Å; F429-L460 HydrophobicContact CD2-CD1 3.93Å; F429-L460 HydrophobicContact CD2-CD2 3.61Å; F429-L460 HydrophobicContact CD2-CG 4.42Å; F429-L460 HydrophobicContact CE2-CD1 4.15Å; F429-L460 HydrophobicContact CE2-CD2 4.24Å; F429-L460 HydrophobicContact CG-CD2 3.55Å; Y432-L460 HydrophobicContact CD1-CD2 3.65Å; Y432-L460 HydrophobicContact CE1-CD2 3.55Å; F457-L460 HydrophobicContact CD1-CB 3.58Å; F457-L460 HydrophobicContact CD1-CD2 4.34Å; F457-L460 HydrophobicContact CE1-CB 3.94Å; F457-L460 HydrophobicContact CG-CB 4.27Å; F457-L460 PolarHBondContact O-N 3.33Å; F457-L460 VanDerWaalsContact O-N 3.15Å; F458-L460 PolarHBondContact O-N 3.02Å; L460-K463 HydrophobicContact CD1-CD 4.13Å; L460-K463 WeakPolarHBondContact O-CB 3.38Å; L460-K463 PolarHBondContact O-N 3.27Å; L460-D464 VanDerWaalsContact O-CG 3.29Å; L460-D464 PolarHBondContact O-N 3.24Å
461	L	88.9	Confident	88.1	Confident	7 Å²	7	24.6 Å²	24.6	4%	0.037	13%	0.13	C	C	.	.	H	α-helix	trans	-58.5	-48.8	172.4	175.7	66	0	0	0	111	F313 P456 F457 F458 K463 D464 I465 F496	F313-L461 HydrophobicContact CE1-CD2 4.4Å; P456-L461 HydrophobicContact CG-CD2 3.95Å; F457-L461 PolarHBondContact O-N 2.91Å; F458-L461 HydrophobicContact CD2-CD2 4.2Å; F458-L461 HydrophobicContact CE2-CD2 4.25Å; F458-L461 WeakPolarHBondContact O-CB 3.48Å; F458-L461 PolarHBondContact O-N 2.85Å; F458-L461 VanDerWaalsContact O-N 3.12Å; L461-K463 VanDerWaalsContact C-N 3.33Å; L461-K463 PolarHBondContact O-N 3.39Å; L461-D464 PolarHBondContact O-N 2.93Å; L461-I465 HydrophobicContact CD1-CD1 4Å; L461-I465 HydrophobicContact CD1-CG1 4.4Å; L461-I465 HydrophobicContact CG-CD1 3.98Å; L461-I465 VanDerWaalsContact O-CG1 3.31Å; L461-I465 WeakPolarHBondContact O-CG1 3.42Å; L461-I465 PolarHBondContact O-N 3.08Å; L461-F496 HydrophobicContact CD2-CB 4.27Å; L461-F496 HydrophobicContact CD2-CD2 3.7Å; L461-F496 HydrophobicContact CD2-CE2 4.46Å; L461-F496 HydrophobicContact CD2-CG 4.26Å
462	I	84.3	Confident	87.6	Confident	4 Å²	4	23.8 Å²	23.8	2%	0.021	13%	0.132	C	C	.	.	H	α-helix	trans	-61.7	-42	177.7	-67.1	-64.1	0	0	0	111.6	L32 F313 F317 L339 F458 D464 I465 Y466	L32-I462 HydrophobicContact CD2-CG2 3.49Å; L32-I462 VanDerWaalsContact CD2-CG2 3.49Å; F313-I462 HydrophobicContact CD1-CD1 3.44Å; F313-I462 VanDerWaalsContact CD1-CD1 3.44Å; F313-I462 HydrophobicContact CE1-CD1 3.34Å; F313-I462 HydrophobicContact CZ-CD1 4.45Å; F317-I462 HydrophobicContact CE1-CG2 4.07Å; F317-I462 HydrophobicContact CZ-CG2 3.92Å; L339-I462 HydrophobicContact CD1-CD1 3.76Å; L339-I462 HydrophobicContact CD2-CD1 4.47Å; F458-I462 HydrophobicContact CD1-CG1 3.85Å; F458-I462 HydrophobicContact CE1-CD1 3.84Å; F458-I462 HydrophobicContact CE1-CG1 3.57Å; F458-I462 HydrophobicContact CE2-CD1 4.49Å; F458-I462 HydrophobicContact CG-CG1 4.47Å; F458-I462 HydrophobicContact CZ-CD1 3.78Å; F458-I462 HydrophobicContact CZ-CG1 3.94Å; F458-I462 WeakPolarHBondContact O-CG1 3.38Å; F458-I462 PolarHBondContact O-N 2.94Å; I462-D464 PolarHBondContact O-N 3.21Å; I462-I465 PolarHBondContact O-N 3.3Å; I462-Y466 WeakPolarHBondContact O-CB 3.23Å; I462-Y466 PolarHBondContact O-N 2.95Å
463	K	81.4	Confident	87.2	Confident	41 Å²	41	22.1 Å²	22.1	18%	0.178	14%	0.138	C	C	.	.	H	α-helix	trans	-57.7	-47.5	174.7	-178.4	-174.9	175	-172	0	111.4	S459 L460 L461 Y466 F467	S459-K463 WeakPolarHBondContact O-CB 3.31Å; S459-K463 PolarHBondContact O-N 2.82Å; L460-K463 HydrophobicContact CD1-CD 4.13Å; L460-K463 WeakPolarHBondContact O-CB 3.38Å; L460-K463 PolarHBondContact O-N 3.27Å; L461-K463 VanDerWaalsContact C-N 3.33Å; L461-K463 PolarHBondContact O-N 3.39Å; K463-Y466 WeakPolarHBondContact O-CB 3.45Å; K463-Y466 PolarHBondContact O-N 2.82Å; K463-F467 HydrophobicContact CD-CE2 4.18Å; K463-F467 VanDerWaalsContact CE-CE2 3.45Å; K463-F467 HydrophobicContact CG-CD2 3.7Å; K463-F467 HydrophobicContact CG-CE2 3.6Å; K463-F467 VanDerWaalsContact O-CD2 3.22Å; K463-F467 WeakPolarHBondContact O-CD2 3.36Å; K463-F467 PolarHBondContact O-N 3.41Å
464	D	85.2	Confident	86.7	Confident	7 Å²	7	23.8 Å²	23.8	4%	0.037	15%	0.149	C	C	.	.	H	α-helix	trans	-64.9	-42.5	-178.8	-69.6	-12.2	0	0	0	111.3	T87 R433 L460 L461 I462 Y466 F467 L468	T87-D464 WeakPolarHBondContact CB-OD2 3.48Å; T87-D464 PolarHBondContact OG1-OD2 2.85Å; R433-D464 IonicContact CZ-OD2 3.54Å; R433-D464 IonicContact NH1-OD2 3.27Å; R433-D464 PolarHBondContact NH1-OD2 3.46Å; R433-D464 IonicContact NH2-OD1 3.18Å; R433-D464 PolarHBondContact NH2-OD1 3.05Å; R433-D464 IonicContact NH2-OD2 2.78Å; R433-D464 PolarHBondContact NH2-OD2 2.86Å; L460-D464 VanDerWaalsContact O-CG 3.29Å; L460-D464 PolarHBondContact O-N 3.24Å; L461-D464 PolarHBondContact O-N 2.93Å; I462-D464 PolarHBondContact O-N 3.21Å; D464-Y466 VanDerWaalsContact C-N 3.35Å; D464-Y466 PolarHBondContact O-N 3.45Å; D464-F467 PolarHBondContact O-N 2.69Å; D464-L468 WeakPolarHBondContact O-CB 3.22Å; D464-L468 PolarHBondContact O-N 3.08Å
465	I	86.1	Confident	86.4	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-64.5	-39.9	176.5	-62.4	170.3	0	0	0	111	F313 F317 L461 I462 L468 N469 L489 Q492 V493	F313-I465 HydrophobicContact CD1-CD1 3.45Å; F313-I465 VanDerWaalsContact CD1-CD1 3.45Å; F313-I465 HydrophobicContact CE1-CD1 3.75Å; F313-I465 HydrophobicContact CG-CD1 4.33Å; F317-I465 HydrophobicContact CD2-CG2 4.34Å; F317-I465 HydrophobicContact CE2-CB 4.08Å; F317-I465 HydrophobicContact CE2-CG2 3.53Å; F317-I465 HydrophobicContact CZ-CB 4.43Å; F317-I465 HydrophobicContact CZ-CG2 4.34Å; L461-I465 HydrophobicContact CD1-CD1 4Å; L461-I465 HydrophobicContact CD1-CG1 4.4Å; L461-I465 HydrophobicContact CG-CD1 3.98Å; L461-I465 VanDerWaalsContact O-CG1 3.31Å; L461-I465 WeakPolarHBondContact O-CG1 3.42Å; L461-I465 PolarHBondContact O-N 3.08Å; I462-I465 PolarHBondContact O-N 3.3Å; I465-L468 PolarHBondContact O-N 2.8Å; I465-N469 PolarHBondContact O-N 2.92Å; I465-L489 HydrophobicContact CG2-CD1 3.5Å; I465-L489 VanDerWaalsContact CG2-CD1 3.5Å; I465-Q492 HydrophobicContact CG1-CB 4.05Å; I465-V493 HydrophobicContact CD1-CG2 4.43Å
466	Y	82.6	Confident	85.9	Confident	6 Å²	6	32.2 Å²	32.2	2%	0.024	19%	0.185	C	C	.	.	H	α-helix	trans	-60.1	-52.7	174.5	173.6	-101.7	0	0	0	111.6	D25 L29 F317 I462 K463 D464 L468 N469 E470	D25-Y466 WeakPolarHBondContact CB-OH 3.46Å; D25-Y466 PolarHBondContact OD1-OH 3.27Å; L29-Y466 HydrophobicContact CD1-CD1 4.17Å; L29-Y466 HydrophobicContact CD1-CE1 3.84Å; L29-Y466 HydrophobicContact CD2-CG 4.44Å; F317-Y466 HydrophobicContact CB-CD2 4.31Å; F317-Y466 AromaticContact CD1-CD2 3.42Å; F317-Y466 HydrophobicContact CD1-CD2 3.42Å; F317-Y466 VanDerWaalsContact CD1-CD2 3.42Å; F317-Y466 HydrophobicContact CD1-CE2 4.37Å; F317-Y466 HydrophobicContact CD1-CG 4.16Å; F317-Y466 AromaticContact CE1-CD2 3.9Å; F317-Y466 HydrophobicContact CE1-CD2 3.9Å; F317-Y466 HydrophobicContact CE1-CG 4.2Å; F317-Y466 AromaticContact CG-CD2 3.96Å; F317-Y466 HydrophobicContact CG-CD2 3.96Å; I462-Y466 WeakPolarHBondContact O-CB 3.23Å; I462-Y466 PolarHBondContact O-N 2.95Å; K463-Y466 WeakPolarHBondContact O-CB 3.45Å; K463-Y466 PolarHBondContact O-N 2.82Å; D464-Y466 VanDerWaalsContact C-N 3.35Å; D464-Y466 PolarHBondContact O-N 3.45Å; Y466-L468 VanDerWaalsContact C-N 3.26Å; Y466-L468 PolarHBondContact O-N 3.06Å; Y466-N469 WeakPolarHBondContact O-CA 3.48Å; Y466-N469 WeakPolarHBondContact O-CB 3.36Å; Y466-N469 PolarHBondContact O-N 3.01Å; Y466-E470 HydrophobicContact CD1-CG 4.26Å; Y466-E470 HydrophobicContact CD2-CG 4.14Å; Y466-E470 HydrophobicContact CE1-CG 3.79Å; Y466-E470 HydrophobicContact CE2-CG 3.68Å; Y466-E470 HydrophobicContact CG-CG 4.44Å; Y466-E470 VanDerWaalsContact CZ-CG 3.49Å; Y466-E470 PolarHBondContact O-N 3.13Å
467	F	82.8	Confident	85.5	Confident	51 Å²	51	42.3 Å²	42.3	22%	0.224	23%	0.232	C	C	.	.	H	α-helix	trans	-65.1	-30.5	-179.5	-81.1	-67.2	0	0	0	113	M84 K463 D464 N469 E470 G471	M84-F467 HydrophobicContact CE-CB 4.4Å; M84-F467 HydrophobicContact CE-CD1 4.19Å; M84-F467 HydrophobicContact CE-CG 4.22Å; K463-F467 HydrophobicContact CD-CE2 4.18Å; K463-F467 VanDerWaalsContact CE-CE2 3.45Å; K463-F467 HydrophobicContact CG-CD2 3.7Å; K463-F467 HydrophobicContact CG-CE2 3.6Å; K463-F467 VanDerWaalsContact O-CD2 3.22Å; K463-F467 WeakPolarHBondContact O-CD2 3.36Å; K463-F467 PolarHBondContact O-N 3.41Å; D464-F467 PolarHBondContact O-N 2.69Å; F467-N469 VanDerWaalsContact C-N 3.33Å; F467-E470 PolarHBondContact O-N 2.84Å; F467-G471 WeakPolarHBondContact O-CA 3.34Å; F467-G471 PolarHBondContact O-N 3.31Å
468	L	84.9	Confident	85.1	Confident	34 Å²	34	46.9 Å²	46.9	18%	0.178	26%	0.257	C	S	.	.	H	α-helix	trans	-65.5	-38.2	171.2	-177.6	64.3	0	0	0	111.8	D464 I465 Y466 E488 L489 Q492	D464-L468 WeakPolarHBondContact O-CB 3.22Å; D464-L468 PolarHBondContact O-N 3.08Å; I465-L468 PolarHBondContact O-N 2.8Å; Y466-L468 VanDerWaalsContact C-N 3.26Å; Y466-L468 PolarHBondContact O-N 3.06Å; L468-E488 HydrophobicContact CD1-CB 4.06Å; L468-E488 HydrophobicContact CD2-CB 4.14Å; L468-L489 HydrophobicContact CD2-CB 4.46Å; L468-L489 HydrophobicContact CD2-CD1 4.37Å; L468-Q492 HydrophobicContact CD2-CG 3.85Å
469	N	83.1	Confident	85	Confident	14 Å²	14	48.6 Å²	48.6	8%	0.075	28%	0.276	C	S	.	.	H	α-helix	trans	-67.7	-44.9	174	-176.6	66.9	0	0	0	112	I465 Y466 F467 C472 K485	I465-N469 PolarHBondContact O-N 2.92Å; Y466-N469 WeakPolarHBondContact O-CA 3.48Å; Y466-N469 WeakPolarHBondContact O-CB 3.36Å; Y466-N469 PolarHBondContact O-N 3.01Å; F467-N469 VanDerWaalsContact C-N 3.33Å; N469-C472 VanDerWaalsContact O-O 3.08Å; N469-K485 WeakPolarHBondContact O-CE 3.01Å; N469-K485 PolarHBondContact O-NZ 3.11Å; N469-K485 WeakPolarHBondContact OD1-CE 3.44Å; N469-K485 PolarHBondContact OD1-NZ 3.25Å
470	E	80.3	Confident	85.5	Confident	78 Å²	78	48.7 Å²	48.7	36%	0.364	27%	0.274	S	S	.	.	H	α-helix	trans	-74.9	-31.2	-177.2	-66.9	-50	104.8	0	0	113.4	H319 Y466 F467 C472	H319-E470 VanDerWaalsContact CE1-CD 3.42Å; H319-E470 IonicContact CE1-OE1 2.7Å; H319-E470 PolarHBondContact CE1-OE1 2.81Å; H319-E470 IonicContact CE1-OE2 3.84Å; H319-E470 PolarHBondContact CE1-OE2 2.83Å; H319-E470 IonicContact ND1-OE1 3.43Å; H319-E470 IonicContact NE2-OE2 3.37Å; Y466-E470 HydrophobicContact CD1-CG 4.26Å; Y466-E470 HydrophobicContact CD2-CG 4.14Å; Y466-E470 HydrophobicContact CE1-CG 3.79Å; Y466-E470 HydrophobicContact CE2-CG 3.68Å; Y466-E470 HydrophobicContact CG-CG 4.44Å; Y466-E470 VanDerWaalsContact CZ-CG 3.49Å; Y466-E470 PolarHBondContact O-N 3.13Å; F467-E470 PolarHBondContact O-N 2.84Å; E470-C472 PolarHBondContact O-N 3.3Å; E470-C472 VanDerWaalsContact O-N 3.16Å
471	G	80.5	Confident	85.9	Confident	51 Å²	51	48.5 Å²	48.5	53%	0.526	27%	0.274	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-10.8	-176.4	0	0	0	0	0	114.4	F467	F467-G471 WeakPolarHBondContact O-CA 3.34Å; F467-G471 PolarHBondContact O-N 3.31Å
472	C	82.6	Confident	86.1	Confident	61 Å²	61	49 Å²	49	41%	0.412	28%	0.276	S	S	.	.	S	Bend	trans	-140.4	135.1	-177.2	-74.2	0	0	0	0	111.5	N469 E470 K485	N469-C472 VanDerWaalsContact O-O 3.08Å; E470-C472 PolarHBondContact O-N 3.3Å; E470-C472 VanDerWaalsContact O-N 3.16Å; C472-K485 HydrophobicContact CB-CB 4.21Å; C472-K485 HydrophobicContact CB-CD 3.88Å; C472-K485 HydrophobicContact CB-CG 3.91Å; C472-K485 VanDerWaalsContact O-CD 3.3Å; C472-K485 WeakPolarHBondContact O-CD 3.28Å; C472-K485 VanDerWaalsContact O-CE 3.24Å; C472-K485 WeakPolarHBondContact O-CE 3.18Å; C472-K485 PolarHBondContact O-NZ 3.29Å
473	A	86.2	Confident	86.6	Confident	68 Å²	68	48.9 Å²	48.9	56%	0.562	28%	0.275	S	S	*	.			trans	-67.1	135.1	176.4	0	0	0	0	0	111.5	R475 N482	A473-R475 VanDerWaalsContact CB-O 3.32Å; A473-R475 WeakPolarHBondContact CB-O 3.48Å; A473-R475 PolarHBondContact O-N 3.07Å; A473-N482 WeakPolarHBondContact O-CB 3.37Å; A473-N482 PolarHBondContact O-ND2 3.3Å
474	S	87.6	Confident	87.1	Confident	34 Å²	34	51.3 Å²	51.3	24%	0.238	29%	0.287	C	S	.	.	S	Bend	trans	-68.6	-20.8	176.8	-63.2	0	0	0	0	113.1	N482 K485	S474-N482 PolarHBondContact O-N 3.42Å; S474-K485 PolarHBondContact OG-NZ 3Å
475	R	90.3	Very high	87.4	Confident	114 Å²	114	51.5 Å²	51.5	43%	0.43	29%	0.288	S	S	.	.	B	Isolated β-bridge	trans	-124.8	141.1	171.7	-66.2	-177.6	-178.4	-81	-1.3	110	F157 A473 G479 L480	F157-R475 HydrophobicContact CE1-CG 4.31Å; A473-R475 VanDerWaalsContact CB-O 3.32Å; A473-R475 WeakPolarHBondContact CB-O 3.48Å; A473-R475 PolarHBondContact O-N 3.07Å; R475-G479 PolarHBondContact NH1-O 3.32Å; R475-L480 CarbonylContact C-O 3.5Å; R475-L480 WeakPolarHBondContact CA-O 3.16Å
476	L	89.3	Confident	87.8	Confident	64 Å²	64	51.6 Å²	51.6	34%	0.335	29%	0.288	S	S	.	.			trans	-73.4	167	170.2	-60.1	-179	0	0	0	110.2	N478 G479 L480 N482	L476-N478 VanDerWaalsContact CB-OD1 3.28Å; L476-N478 WeakPolarHBondContact CB-OD1 3.28Å; L476-N478 PolarHBondContact O-N 2.94Å; L476-N478 VanDerWaalsContact O-N 3.12Å; L476-G479 PolarHBondContact O-N 2.98Å; L476-L480 PolarHBondContact N-O 3.35Å; L476-N482 HydrophobicContact CD2-CB 3.87Å; L476-N482 HydrophobicContact CG-CB 4.09Å
477	Q	88.1	Confident	88.3	Confident	213 Å²	213	53.9 Å²	53.9	100%	0.995	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-26.8	-179.6	-65.9	179.4	2.7	0	0	113.5	G479	Q477-G479 PolarHBondContact O-N 3.37Å
478	N	86.4	Confident	88.8	Confident	107 Å²	107	55 Å²	55	57%	0.572	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	7	175.9	63.8	4.3	0	0	0	113.7	L476 L480	L476-N478 VanDerWaalsContact CB-OD1 3.28Å; L476-N478 WeakPolarHBondContact CB-OD1 3.28Å; L476-N478 PolarHBondContact O-N 2.94Å; L476-N478 VanDerWaalsContact O-N 3.12Å; N478-L480 VanDerWaalsContact C-N 3.28Å; N478-L480 VanDerWaalsContact ND2-CD1 3.32Å; N478-L480 WeakPolarHBondContact ND2-CD1 3Å; N478-L480 PolarHBondContact O-N 2.92Å; N478-L480 WeakPolarHBondContact OD1-CB 3.32Å; N478-L480 VanDerWaalsContact OD1-CG 3.3Å; N478-L480 WeakPolarHBondContact OD1-CG 3.15Å; N478-L480 PolarHBondContact OD1-N 3.3Å
479	G	87	Confident	89.1	Confident	39 Å²	39	53.6 Å²	53.6	40%	0.402	30%	0.296	S	S	.	.	S	Bend	trans	83.3	-8.1	178.6	0	0	0	0	0	115.3	R475 L476 Q477	R475-G479 PolarHBondContact NH1-O 3.32Å; L476-G479 PolarHBondContact O-N 2.98Å; Q477-G479 PolarHBondContact O-N 3.37Å
480	L	92.1	Very high	89.6	Confident	24 Å²	24	53 Å²	53	13%	0.126	29%	0.293	C	S	.	.			trans	-67.3	148.8	177.1	-58.9	-179.7	0	0	0	111.1	Y116 R475 L476 N478 N482	Y116-L480 HydrophobicContact CD2-CD1 3.47Å; Y116-L480 VanDerWaalsContact CD2-CD1 3.47Å; Y116-L480 HydrophobicContact CE2-CD1 3.33Å; Y116-L480 HydrophobicContact CE2-CD2 4.35Å; Y116-L480 HydrophobicContact CE2-CG 4.49Å; Y116-L480 HydrophobicContact CG-CD1 4.38Å; R475-L480 CarbonylContact C-O 3.5Å; R475-L480 WeakPolarHBondContact CA-O 3.16Å; L476-L480 PolarHBondContact N-O 3.35Å; N478-L480 VanDerWaalsContact C-N 3.28Å; N478-L480 VanDerWaalsContact ND2-CD1 3.32Å; N478-L480 WeakPolarHBondContact ND2-CD1 3Å; N478-L480 PolarHBondContact O-N 2.92Å; N478-L480 WeakPolarHBondContact OD1-CB 3.32Å; N478-L480 VanDerWaalsContact OD1-CG 3.3Å; N478-L480 WeakPolarHBondContact OD1-CG 3.15Å; N478-L480 PolarHBondContact OD1-N 3.3Å; L480-N482 PolarHBondContact O-N 3.06Å
481	I	93.6	Very high	90.2	Very high	2 Å²	2	53.4 Å²	53.4	1%	0.01	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	127.1	174.8	-67.9	177.9	0	0	0	108.5	S124 G125 L127 L130 F157 F483 F486	S124-I481 WeakPolarHBondContact CA-O 3.21Å; S124-I481 WeakPolarHBondContact CB-O 3.28Å; G125-I481 PolarHBondContact N-O 2.96Å; G125-I481 WeakPolarHBondContact O-CB 3.45Å; G125-I481 PolarHBondContact O-N 3.04Å; L127-I481 HydrophobicContact CB-CD1 3.88Å; L127-I481 HydrophobicContact CD1-CD1 3.88Å; L127-I481 HydrophobicContact CG-CD1 4.45Å; L130-I481 HydrophobicContact CD1-CB 3.8Å; L130-I481 HydrophobicContact CD1-CD1 3.93Å; L130-I481 HydrophobicContact CD1-CG1 4.39Å; L130-I481 HydrophobicContact CD1-CG2 3.9Å; F157-I481 HydrophobicContact CB-CD1 4.31Å; F157-I481 HydrophobicContact CD1-CD1 4.18Å; F157-I481 HydrophobicContact CD1-CG1 4.35Å; F157-I481 HydrophobicContact CD2-CD1 3.83Å; F157-I481 HydrophobicContact CD2-CG1 4.49Å; F157-I481 HydrophobicContact CD2-CG2 4.39Å; F157-I481 HydrophobicContact CE1-CD1 4.43Å; F157-I481 HydrophobicContact CE1-CG1 4.18Å; F157-I481 HydrophobicContact CE2-CD1 4.11Å; F157-I481 HydrophobicContact CE2-CG1 4.34Å; F157-I481 HydrophobicContact CE2-CG2 3.66Å; F157-I481 HydrophobicContact CG-CD1 3.85Å; F157-I481 HydrophobicContact CG-CG1 4.47Å; F157-I481 HydrophobicContact CZ-CB 4.48Å; F157-I481 HydrophobicContact CZ-CD1 4.36Å; F157-I481 HydrophobicContact CZ-CG1 4.14Å; F157-I481 HydrophobicContact CZ-CG2 3.73Å; I481-F483 PolarHBondContact O-N 3.33Å; I481-F486 HydrophobicContact CG2-CD2 4.04Å; I481-F486 HydrophobicContact CG2-CE2 3.61Å
482	N	93.1	Very high	90.6	Very high	18 Å²	18	51.4 Å²	51.4	10%	0.096	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.1	96.3	177.1	-179.2	-4	0	0	0	109.6	A473 S474 L476 L480 E484 K485 F486	A473-N482 WeakPolarHBondContact O-CB 3.37Å; A473-N482 PolarHBondContact O-ND2 3.3Å; S474-N482 PolarHBondContact O-N 3.42Å; L476-N482 HydrophobicContact CD2-CB 3.87Å; L476-N482 HydrophobicContact CG-CB 4.09Å; L480-N482 PolarHBondContact O-N 3.06Å; N482-E484 PolarHBondContact OD1-N 3.09Å; N482-K485 HydrophobicContact CB-CB 4.46Å; N482-K485 PolarHBondContact OD1-N 3.19Å; N482-F486 WeakPolarHBondContact O-CD2 3.46Å; N482-F486 WeakPolarHBondContact O-CE2 3.31Å
483	F	94.9	Very high	91.1	Very high	0 Å²	0	48.5 Å²	48.5	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-80.2	-24.5	-175.4	-148.8	-103.2	0	0	0	112.8	L122 A123 L130 Y146 T149 F150 I481 K485 F486 W487	L122-F483 HydrophobicContact CB-CD1 4.28Å; L122-F483 HydrophobicContact CD2-CD1 3.67Å; L122-F483 HydrophobicContact CD2-CE1 3.9Å; L122-F483 HydrophobicContact CD2-CG 4.11Å; L122-F483 HydrophobicContact CG-CB 4.33Å; L122-F483 HydrophobicContact CG-CD1 3.85Å; L122-F483 HydrophobicContact CG-CG 4.2Å; A123-F483 WeakPolarHBondContact O-CA 3.1Å; A123-F483 WeakPolarHBondContact O-CB 3.41Å; A123-F483 PolarHBondContact O-N 3.31Å; L130-F483 HydrophobicContact CD1-CD2 4.32Å; L130-F483 HydrophobicContact CD2-CD2 4.07Å; L130-F483 HydrophobicContact CD2-CE2 4.35Å; Y146-F483 AromaticContact CD2-CE1 3.54Å; Y146-F483 HydrophobicContact CD2-CE1 3.54Å; Y146-F483 AromaticContact CD2-CZ 3.51Å; Y146-F483 HydrophobicContact CD2-CZ 3.51Å; Y146-F483 AromaticContact CE2-CE1 3.67Å; Y146-F483 HydrophobicContact CE2-CE1 3.67Å; Y146-F483 AromaticContact CE2-CE2 3.98Å; Y146-F483 HydrophobicContact CE2-CE2 3.98Å; Y146-F483 AromaticContact CE2-CZ 3.33Å; Y146-F483 HydrophobicContact CE2-CZ 3.33Å; T149-F483 HydrophobicContact CG2-CE1 3.89Å; T149-F483 HydrophobicContact CG2-CE2 4.27Å; T149-F483 HydrophobicContact CG2-CZ 3.62Å; F150-F483 HydrophobicContact CB-CE2 4.2Å; F150-F483 HydrophobicContact CB-CZ 4.08Å; F150-F483 AromaticContact CD2-CE2 3.99Å; F150-F483 HydrophobicContact CD2-CE2 3.99Å; I481-F483 PolarHBondContact O-N 3.33Å; F483-K485 VanDerWaalsContact C-N 3.32Å; F483-K485 PolarHBondContact O-N 2.83Å; F483-F486 HydrophobicContact CD2-CD2 4.28Å; F483-F486 PolarHBondContact O-N 3.25Å; F483-W487 AromaticContact CD1-CD1 3.99Å; F483-W487 HydrophobicContact CD1-CD2 4.18Å; F483-W487 AromaticContact CD1-CE2 3.54Å; F483-W487 HydrophobicContact CD1-CG 4.45Å; F483-W487 AromaticContact CD1-CZ2 3.89Å; F483-W487 HydrophobicContact CD1-CZ2 3.89Å; F483-W487 AromaticContact CD1-NE1 3.39Å; F483-W487 AromaticContact CE1-CD2 3.98Å; F483-W487 HydrophobicContact CE1-CD2 3.98Å; F483-W487 AromaticContact CE1-CE2 3.46Å; F483-W487 VanDerWaalsContact CE1-CE2 3.46Å; F483-W487 HydrophobicContact CE1-CE3 4.38Å; F483-W487 AromaticContact CE1-CH2 3.91Å; F483-W487 HydrophobicContact CE1-CH2 3.91Å; F483-W487 AromaticContact CE1-CZ2 3.45Å; F483-W487 HydrophobicContact CE1-CZ2 3.45Å; F483-W487 VanDerWaalsContact CE1-CZ2 3.45Å; F483-W487 HydrophobicContact CE1-CZ3 4.33Å; F483-W487 AromaticContact CE1-NE1 3.84Å; F483-W487 PolarHBondContact O-N 3.25Å
484	E	92.8	Very high	91.4	Very high	92 Å²	92	47.2 Å²	47.2	43%	0.43	24%	0.238	S	C	.	.	H	α-helix	trans	-58.3	-43.4	172.7	-60.3	-173	134.6	0	0	112.1	H118 A123 N482 F486 W487 E488	H118-E484 IonicContact CD2-OE1 2.81Å; A123-E484 HydrophobicContact CB-CG 3.75Å; A123-E484 PolarHBondContact O-N 3.26Å; A123-E484 VanDerWaalsContact O-N 3.17Å; N482-E484 PolarHBondContact OD1-N 3.09Å; E484-F486 VanDerWaalsContact C-N 3.27Å; E484-F486 PolarHBondContact O-N 2.92Å; E484-W487 PolarHBondContact O-N 2.89Å; E484-E488 PolarHBondContact O-N 3.09Å
485	K	91.6	Very high	91.6	Very high	11 Å²	11	47 Å²	47	5%	0.048	23%	0.233	C	C	.	.	H	α-helix	trans	-54.4	-45.6	171.6	175.5	-173.4	176.2	174.4	0	111.3	N469 C472 S474 N482 F483 E488 L489	N469-K485 WeakPolarHBondContact O-CE 3.01Å; N469-K485 PolarHBondContact O-NZ 3.11Å; N469-K485 WeakPolarHBondContact OD1-CE 3.44Å; N469-K485 PolarHBondContact OD1-NZ 3.25Å; C472-K485 HydrophobicContact CB-CB 4.21Å; C472-K485 HydrophobicContact CB-CD 3.88Å; C472-K485 HydrophobicContact CB-CG 3.91Å; C472-K485 VanDerWaalsContact O-CD 3.3Å; C472-K485 WeakPolarHBondContact O-CD 3.28Å; C472-K485 VanDerWaalsContact O-CE 3.24Å; C472-K485 WeakPolarHBondContact O-CE 3.18Å; C472-K485 PolarHBondContact O-NZ 3.29Å; S474-K485 PolarHBondContact OG-NZ 3Å; N482-K485 HydrophobicContact CB-CB 4.46Å; N482-K485 PolarHBondContact OD1-N 3.19Å; F483-K485 VanDerWaalsContact C-N 3.32Å; F483-K485 PolarHBondContact O-N 2.83Å; K485-E488 PolarHBondContact O-N 2.81Å; K485-L489 PolarHBondContact O-N 2.9Å
486	F	93.1	Very high	91.7	Very high	2 Å²	2	41.6 Å²	41.6	1%	0.009	21%	0.213	C	C	.	.	H	α-helix	trans	-73.3	-29.1	-175.3	-61.9	-50.5	0	0	0	113.1	T149 L156 F157 I481 N482 F483 E484 L489 A490	T149-F486 HydrophobicContact CG2-CB 3.75Å; T149-F486 WeakPolarHBondContact CG2-O 3.05Å; L156-F486 HydrophobicContact CD1-CE1 3.51Å; L156-F486 HydrophobicContact CD1-CZ 3.95Å; F157-F486 HydrophobicContact CE2-CD2 4.28Å; F157-F486 HydrophobicContact CE2-CE1 4.46Å; F157-F486 AromaticContact CE2-CE2 3.39Å; F157-F486 HydrophobicContact CE2-CE2 3.39Å; F157-F486 AromaticContact CE2-CZ 3.5Å; F157-F486 HydrophobicContact CE2-CZ 3.5Å; F157-F486 VanDerWaalsContact CE2-CZ 3.5Å; F157-F486 AromaticContact CZ-CE2 3.4Å; F157-F486 HydrophobicContact CZ-CE2 3.4Å; F157-F486 AromaticContact CZ-CZ 3.33Å; F157-F486 HydrophobicContact CZ-CZ 3.33Å; I481-F486 HydrophobicContact CG2-CD2 4.04Å; I481-F486 HydrophobicContact CG2-CE2 3.61Å; N482-F486 WeakPolarHBondContact O-CD2 3.46Å; N482-F486 WeakPolarHBondContact O-CE2 3.31Å; F483-F486 HydrophobicContact CD2-CD2 4.28Å; F483-F486 PolarHBondContact O-N 3.25Å; E484-F486 VanDerWaalsContact C-N 3.27Å; E484-F486 PolarHBondContact O-N 2.92Å; F486-L489 HydrophobicContact CD1-CD2 4.22Å; F486-L489 PolarHBondContact O-N 3.45Å; F486-A490 WeakPolarHBondContact O-CB 3.45Å; F486-A490 PolarHBondContact O-N 3.12Å
487	W	94.4	Very high	91.8	Very high	55 Å²	55	39.8 Å²	39.8	21%	0.208	20%	0.203	C	C	.	.	H	α-helix	trans	-58.1	-48.5	169.2	-72.4	131.3	0	0	0	111.9	L122 T145 Y146 T149 F483 E484 A490 K491	L122-W487 PolarHBondContact O-NE1 3.07Å; T145-W487 HydrophobicContact CG2-CE3 4.13Å; T145-W487 HydrophobicContact CG2-CZ3 3.57Å; Y146-W487 HydrophobicContact CD2-CH2 4.25Å; Y146-W487 HydrophobicContact CD2-CZ2 4.39Å; T149-W487 HydrophobicContact CG2-CD2 4.31Å; T149-W487 HydrophobicContact CG2-CE3 3.82Å; T149-W487 HydrophobicContact CG2-CZ3 4.18Å; T149-W487 VanDerWaalsContact OG1-CE3 3.27Å; T149-W487 VanDerWaalsContact OG1-CZ3 3.24Å; T149-W487 WeakPolarHBondContact OG1-CZ3 3.27Å; F483-W487 AromaticContact CD1-CD1 3.99Å; F483-W487 HydrophobicContact CD1-CD2 4.18Å; F483-W487 AromaticContact CD1-CE2 3.54Å; F483-W487 HydrophobicContact CD1-CG 4.45Å; F483-W487 AromaticContact CD1-CZ2 3.89Å; F483-W487 HydrophobicContact CD1-CZ2 3.89Å; F483-W487 AromaticContact CD1-NE1 3.39Å; F483-W487 AromaticContact CE1-CD2 3.98Å; F483-W487 HydrophobicContact CE1-CD2 3.98Å; F483-W487 AromaticContact CE1-CE2 3.46Å; F483-W487 VanDerWaalsContact CE1-CE2 3.46Å; F483-W487 HydrophobicContact CE1-CE3 4.38Å; F483-W487 AromaticContact CE1-CH2 3.91Å; F483-W487 HydrophobicContact CE1-CH2 3.91Å; F483-W487 AromaticContact CE1-CZ2 3.45Å; F483-W487 HydrophobicContact CE1-CZ2 3.45Å; F483-W487 VanDerWaalsContact CE1-CZ2 3.45Å; F483-W487 HydrophobicContact CE1-CZ3 4.33Å; F483-W487 AromaticContact CE1-NE1 3.84Å; F483-W487 PolarHBondContact O-N 3.25Å; E484-W487 PolarHBondContact O-N 2.89Å; W487-A490 PolarHBondContact O-N 3.43Å; W487-K491 WeakPolarHBondContact O-CB 3.46Å; W487-K491 PolarHBondContact O-N 3.37Å
488	E	92.2	Very high	92	Very high	74 Å²	74	34 Å²	34	35%	0.346	18%	0.182	S	C	.	.	H	α-helix	trans	-66.9	-38.4	178.7	-72.2	-60.7	141.1	0	0	111.9	L468 E484 K485 K491 Q492	L468-E488 HydrophobicContact CD1-CB 4.06Å; L468-E488 HydrophobicContact CD2-CB 4.14Å; E484-E488 PolarHBondContact O-N 3.09Å; K485-E488 PolarHBondContact O-N 2.81Å; E488-K491 WeakPolarHBondContact O-CB 3.38Å; E488-K491 PolarHBondContact O-N 2.89Å; E488-K491 IonicContact OE1-NZ 3.82Å; E488-K491 PolarHBondContact OE1-NZ 3.14Å; E488-K491 WeakPolarHBondContact OE2-CD 3.36Å; E488-K491 IonicContact OE2-NZ 3.84Å; E488-K491 PolarHBondContact OE2-NZ 3.02Å; E488-Q492 PolarHBondContact O-N 2.98Å
489	L	91.6	Very high	92.3	Very high	4 Å²	4	29.3 Å²	29.3	2%	0.021	16%	0.156	C	C	.	.	H	α-helix	trans	-62.2	-48.3	175.2	-172.3	69.2	0	0	0	111.7	V314 I465 L468 K485 F486 K491 Q492 V493	V314-L489 HydrophobicContact CG2-CD2 4.15Å; I465-L489 HydrophobicContact CG2-CD1 3.5Å; I465-L489 VanDerWaalsContact CG2-CD1 3.5Å; L468-L489 HydrophobicContact CD2-CB 4.46Å; L468-L489 HydrophobicContact CD2-CD1 4.37Å; K485-L489 PolarHBondContact O-N 2.9Å; F486-L489 HydrophobicContact CD1-CD2 4.22Å; F486-L489 PolarHBondContact O-N 3.45Å; L489-K491 VanDerWaalsContact C-N 3.27Å; L489-K491 PolarHBondContact O-N 3.22Å; L489-Q492 PolarHBondContact O-N 3.06Å; L489-V493 WeakPolarHBondContact O-CG2 3.41Å; L489-V493 PolarHBondContact O-N 3.23Å
490	A	93.4	Very high	92.6	Very high	3 Å²	3	28.9 Å²	28.9	3%	0.025	14%	0.144	C	C	.	.	H	α-helix	trans	-63.6	-33.9	-179.9	0	0	0	0	0	112.3	F148 T149 L152 F486 W487 V493 S494	F148-A490 HydrophobicContact CD1-CB 3.95Å; F148-A490 HydrophobicContact CE1-CB 3.88Å; T149-A490 HydrophobicContact CG2-CB 3.83Å; T149-A490 WeakPolarHBondContact OG1-CB 3.48Å; L152-A490 HydrophobicContact CD2-CB 4.28Å; F486-A490 WeakPolarHBondContact O-CB 3.45Å; F486-A490 PolarHBondContact O-N 3.12Å; W487-A490 PolarHBondContact O-N 3.43Å; A490-V493 PolarHBondContact O-N 3.17Å; A490-S494 WeakPolarHBondContact O-CB 3.36Å; A490-S494 PolarHBondContact O-N 3.41Å; A490-S494 PolarHBondContact O-OG 3.02Å
491	K	92.3	Very high	92.5	Very high	85 Å²	85	34.6 Å²	34.6	37%	0.37	17%	0.17	S	C	.	.	H	α-helix	trans	-60.2	-47.4	175.3	-170	-168.7	-153.4	178.9	0	112	P89 W487 E488 L489 S494 E495	P89-K491 HydrophobicContact CB-CD 3.48Å; P89-K491 VanDerWaalsContact CB-CD 3.48Å; P89-K491 HydrophobicContact CB-CG 4.08Å; P89-K491 HydrophobicContact CG-CD 4.05Å; P89-K491 VanDerWaalsContact CG-NZ 3.33Å; W487-K491 WeakPolarHBondContact O-CB 3.46Å; W487-K491 PolarHBondContact O-N 3.37Å; E488-K491 WeakPolarHBondContact O-CB 3.38Å; E488-K491 PolarHBondContact O-N 2.89Å; E488-K491 IonicContact OE1-NZ 3.82Å; E488-K491 PolarHBondContact OE1-NZ 3.14Å; E488-K491 WeakPolarHBondContact OE2-CD 3.36Å; E488-K491 IonicContact OE2-NZ 3.84Å; E488-K491 PolarHBondContact OE2-NZ 3.02Å; L489-K491 VanDerWaalsContact C-N 3.27Å; L489-K491 PolarHBondContact O-N 3.22Å; K491-S494 PolarHBondContact O-N 3.36Å; K491-E495 PolarHBondContact O-N 3.37Å
492	Q	90.7	Very high	92.5	Very high	9 Å²	9	35.8 Å²	35.8	4%	0.042	18%	0.177	C	C	.	.	H	α-helix	trans	-63.7	-44.5	177.8	-62.8	-64.1	-32.2	0	0	111.6	I465 L468 E488 L489 E495 F496	I465-Q492 HydrophobicContact CG1-CB 4.05Å; L468-Q492 HydrophobicContact CD2-CG 3.85Å; E488-Q492 PolarHBondContact O-N 2.98Å; L489-Q492 PolarHBondContact O-N 3.06Å; Q492-E495 PolarHBondContact O-N 2.92Å; Q492-F496 PolarHBondContact O-N 2.95Å
493	V	93.1	Very high	92.5	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-68.1	-37.8	178.8	-178.3	0	0	0	0	111.1	F148 L152 P310 F313 I465 L489 A490 E495 F496 M497	F148-V493 HydrophobicContact CZ-CB 4.32Å; F148-V493 HydrophobicContact CZ-CG1 3.96Å; L152-V493 HydrophobicContact CD2-CB 4.03Å; L152-V493 HydrophobicContact CD2-CG1 4.23Å; L152-V493 HydrophobicContact CD2-CG2 4.07Å; P310-V493 HydrophobicContact CB-CG1 3.63Å; F313-V493 HydrophobicContact CB-CG2 4.19Å; F313-V493 HydrophobicContact CD2-CG1 4.22Å; F313-V493 HydrophobicContact CG-CG2 4.32Å; I465-V493 HydrophobicContact CD1-CG2 4.43Å; L489-V493 WeakPolarHBondContact O-CG2 3.41Å; L489-V493 PolarHBondContact O-N 3.23Å; A490-V493 PolarHBondContact O-N 3.17Å; V493-E495 VanDerWaalsContact C-N 3.32Å; V493-E495 PolarHBondContact O-N 3.27Å; V493-F496 WeakPolarHBondContact O-CB 3.32Å; V493-F496 PolarHBondContact O-N 2.93Å; V493-M497 HydrophobicContact CG1-CG 4.23Å; V493-M497 VanDerWaalsContact O-CG 3.23Å; V493-M497 WeakPolarHBondContact O-CG 3.39Å; V493-M497 PolarHBondContact O-N 3.5Å
494	S	92.6	Very high	92.5	Very high	42 Å²	42	44.4 Å²	44.4	29%	0.294	22%	0.219	S	C	.	.	H	α-helix	trans	-62.8	-37.6	178.9	-64.1	0	0	0	0	112.7	F148 A490 K491 M497 T498	F148-S494 WeakPolarHBondContact CE1-OG 3.35Å; A490-S494 WeakPolarHBondContact O-CB 3.36Å; A490-S494 PolarHBondContact O-N 3.41Å; A490-S494 PolarHBondContact O-OG 3.02Å; K491-S494 PolarHBondContact O-N 3.36Å; S494-M497 PolarHBondContact O-N 3.37Å; S494-T498 PolarHBondContact O-N 3.16Å; S494-T498 VanDerWaalsContact O-N 3.14Å; S494-T498 PolarHBondContact O-OG1 3.23Å; S494-T498 VanDerWaalsContact O-OG1 3.12Å
495	E	90.5	Very high	92.6	Very high	29 Å²	29	42.8 Å²	42.8	14%	0.136	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-47.2	175.4	-164.3	178.3	-164.6	0	0	110.7	K491 Q492 V493 M497 T498 W499	K491-E495 PolarHBondContact O-N 3.37Å; Q492-E495 PolarHBondContact O-N 2.92Å; V493-E495 VanDerWaalsContact C-N 3.32Å; V493-E495 PolarHBondContact O-N 3.27Å; E495-M497 VanDerWaalsContact C-N 3.31Å; E495-M497 PolarHBondContact O-N 3.34Å; E495-T498 WeakPolarHBondContact O-CB 3.36Å; E495-T498 PolarHBondContact O-N 2.9Å; E495-T498 VanDerWaalsContact O-N 3.08Å; E495-W499 HydrophobicContact CG-CD2 4.47Å; E495-W499 HydrophobicContact CG-CH2 3.81Å; E495-W499 HydrophobicContact CG-CZ2 3.38Å; E495-W499 PolarHBondContact O-N 3.17Å; E495-W499 VanDerWaalsContact OE1-CZ2 3.25Å; E495-W499 WeakPolarHBondContact OE1-CZ2 2.97Å
496	F	92.4	Very high	92.8	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-58.1	-42.1	173.2	172.5	-97.3	0	0	0	112.8	L305 I308 F313 F458 L461 Q492 V493 T498 W499 K500	L305-F496 HydrophobicContact CD2-CE2 3.64Å; L305-F496 HydrophobicContact CD2-CZ 3.81Å; I308-F496 HydrophobicContact CB-CE1 4.28Å; I308-F496 HydrophobicContact CB-CZ 4.17Å; I308-F496 HydrophobicContact CD1-CZ 4.31Å; I308-F496 HydrophobicContact CG2-CE1 4.19Å; I308-F496 HydrophobicContact CG2-CZ 4.29Å; F313-F496 AromaticContact CE2-CD1 3.49Å; F313-F496 HydrophobicContact CE2-CD1 3.49Å; F313-F496 VanDerWaalsContact CE2-CD1 3.49Å; F313-F496 AromaticContact CE2-CE1 3.48Å; F313-F496 HydrophobicContact CE2-CE1 3.48Å; F313-F496 VanDerWaalsContact CE2-CE1 3.48Å; F313-F496 HydrophobicContact CE2-CG 4.26Å; F313-F496 HydrophobicContact CE2-CZ 4.23Å; F313-F496 AromaticContact CZ-CD1 3.48Å; F313-F496 HydrophobicContact CZ-CD1 3.48Å; F313-F496 VanDerWaalsContact CZ-CD1 3.48Å; F313-F496 HydrophobicContact CZ-CD2 4.15Å; F313-F496 AromaticContact CZ-CE1 3.51Å; F313-F496 HydrophobicContact CZ-CE1 3.51Å; F313-F496 HydrophobicContact CZ-CE2 4.17Å; F313-F496 AromaticContact CZ-CG 3.81Å; F313-F496 HydrophobicContact CZ-CG 3.81Å; F313-F496 AromaticContact CZ-CZ 3.86Å; F313-F496 HydrophobicContact CZ-CZ 3.86Å; F458-F496 HydrophobicContact CD2-CE2 4.29Å; F458-F496 HydrophobicContact CE2-CD2 4.39Å; F458-F496 AromaticContact CE2-CE2 3.7Å; F458-F496 HydrophobicContact CE2-CE2 3.7Å; F458-F496 HydrophobicContact CE2-CZ 4.1Å; L461-F496 HydrophobicContact CD2-CB 4.27Å; L461-F496 HydrophobicContact CD2-CD2 3.7Å; L461-F496 HydrophobicContact CD2-CE2 4.46Å; L461-F496 HydrophobicContact CD2-CG 4.26Å; Q492-F496 PolarHBondContact O-N 2.95Å; V493-F496 WeakPolarHBondContact O-CB 3.32Å; V493-F496 PolarHBondContact O-N 2.93Å; F496-T498 PolarHBondContact O-N 3.4Å; F496-W499 HydrophobicContact CB-CE3 4.49Å; F496-W499 PolarHBondContact O-N 2.7Å; F496-W499 VanDerWaalsContact O-N 3.14Å; F496-K500 HydrophobicContact CD1-CD 4.48Å; F496-K500 HydrophobicContact CE1-CD 3.88Å; F496-K500 HydrophobicContact CZ-CB 4.42Å; F496-K500 HydrophobicContact CZ-CD 4.44Å; F496-K500 PolarHBondContact O-N 3.36Å
497	M	92.3	Very high	92.9	Very high	26 Å²	26	51.6 Å²	51.6	13%	0.128	26%	0.258	C	S	.	.	H	α-helix	trans	-62.5	-26.1	178.5	-70.3	-60.1	-72.3	0	0	112.7	P310 V493 S494 E495 K500 Q501	P310-M497 HydrophobicContact CB-CE 4.34Å; P310-M497 HydrophobicContact CB-CG 4.27Å; P310-M497 HydrophobicContact CB-SD 3.87Å; P310-M497 HydrophobicContact CG-CE 3.92Å; P310-M497 HydrophobicContact CG-SD 4.07Å; V493-M497 HydrophobicContact CG1-CG 4.23Å; V493-M497 VanDerWaalsContact O-CG 3.23Å; V493-M497 WeakPolarHBondContact O-CG 3.39Å; V493-M497 PolarHBondContact O-N 3.5Å; S494-M497 PolarHBondContact O-N 3.37Å; E495-M497 VanDerWaalsContact C-N 3.31Å; E495-M497 PolarHBondContact O-N 3.34Å; M497-K500 HydrophobicContact CE-CD 4.41Å; M497-K500 VanDerWaalsContact CE-CE 3.44Å; M497-K500 HydrophobicContact SD-CD 3.82Å; M497-K500 WeakPolarHBondContact SD-CE 3.23Å; M497-Q501 WeakPolarHBondContact O-CG 3.43Å; M497-Q501 PolarHBondContact O-NE2 2.88Å
498	T	91.9	Very high	93.1	Very high	91 Å²	91	55.7 Å²	55.7	56%	0.558	28%	0.277	S	S	*	.	H	α-helix	trans	-74.1	-47.1	173.5	-56.6	0	0	0	0	110.8	S494 E495 F496 K500 Q501	S494-T498 PolarHBondContact O-N 3.16Å; S494-T498 VanDerWaalsContact O-N 3.14Å; S494-T498 PolarHBondContact O-OG1 3.23Å; S494-T498 VanDerWaalsContact O-OG1 3.12Å; E495-T498 WeakPolarHBondContact O-CB 3.36Å; E495-T498 PolarHBondContact O-N 2.9Å; E495-T498 VanDerWaalsContact O-N 3.08Å; F496-T498 PolarHBondContact O-N 3.4Å; T498-K500 PolarHBondContact O-N 2.86Å; T498-Q501 PolarHBondContact O-N 3.4Å
499	W	92.4	Very high	93.3	Very high	10 Å²	10	55.1 Å²	55.1	4%	0.038	28%	0.276	C	S	.	.	H	α-helix	trans	-62.7	-39.3	-178.5	-61.2	-25.8	0	0	0	113.2	L436 V454 P456 E495 F496 Q501 V502	L436-W499 HydrophobicContact CD2-CH2 4.48Å; V454-W499 HydrophobicContact CB-CB 4.46Å; V454-W499 HydrophobicContact CB-CD2 4.23Å; V454-W499 HydrophobicContact CB-CG 3.9Å; V454-W499 HydrophobicContact CG1-CD2 3.91Å; V454-W499 HydrophobicContact CG1-CE3 4.48Å; V454-W499 HydrophobicContact CG1-CG 4.13Å; V454-W499 HydrophobicContact CG1-CZ2 4.18Å; V454-W499 WeakPolarHBondContact O-CB 3.47Å; P456-W499 HydrophobicContact CB-CE3 4.45Å; P456-W499 HydrophobicContact CB-CZ3 4.01Å; P456-W499 HydrophobicContact CG-CE3 3.85Å; P456-W499 HydrophobicContact CG-CZ3 3.77Å; E495-W499 HydrophobicContact CG-CD2 4.47Å; E495-W499 HydrophobicContact CG-CH2 3.81Å; E495-W499 HydrophobicContact CG-CZ2 3.38Å; E495-W499 PolarHBondContact O-N 3.17Å; E495-W499 VanDerWaalsContact OE1-CZ2 3.25Å; E495-W499 WeakPolarHBondContact OE1-CZ2 2.97Å; F496-W499 HydrophobicContact CB-CE3 4.49Å; F496-W499 PolarHBondContact O-N 2.7Å; F496-W499 VanDerWaalsContact O-N 3.14Å; W499-Q501 PolarHBondContact O-N 2.89Å; W499-V502 WeakPolarHBondContact O-CG2 3.32Å; W499-V502 PolarHBondContact O-N 3.42Å
500	K	92.6	Very high	93.5	Very high	30 Å²	30	65.3 Å²	65.3	13%	0.13	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-71.1	-12.5	-177.9	78.4	170.3	-153.6	156.8	0	114.7	L305 S306 I308 F496 M497 T498 V502	L305-K500 HydrophobicContact CB-CB 4.19Å; S306-K500 PolarHBondContact O-NZ 3.27Å; I308-K500 PolarHBondContact O-NZ 3.17Å; F496-K500 HydrophobicContact CD1-CD 4.48Å; F496-K500 HydrophobicContact CE1-CD 3.88Å; F496-K500 HydrophobicContact CZ-CB 4.42Å; F496-K500 HydrophobicContact CZ-CD 4.44Å; F496-K500 PolarHBondContact O-N 3.36Å; M497-K500 HydrophobicContact CE-CD 4.41Å; M497-K500 VanDerWaalsContact CE-CE 3.44Å; M497-K500 HydrophobicContact SD-CD 3.82Å; M497-K500 WeakPolarHBondContact SD-CE 3.23Å; T498-K500 PolarHBondContact O-N 2.86Å; K500-V502 VanDerWaalsContact C-N 3.27Å
501	Q	90.8	Very high	93.6	Very high	144 Å²	144	73 Å²	73	67%	0.673	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-7.1	179.6	-71.6	175.2	20.1	0	0	113.1	M497 T498 W499 E503	M497-Q501 WeakPolarHBondContact O-CG 3.43Å; M497-Q501 PolarHBondContact O-NE2 2.88Å; T498-Q501 PolarHBondContact O-N 3.4Å; W499-Q501 PolarHBondContact O-N 2.89Å; Q501-E503 PolarHBondContact O-N 2.97Å
502	V	93.3	Very high	93.8	Very high	26 Å²	26	69 Å²	69	16%	0.158	33%	0.33	C	S	.	.	P	Polyproline II helix	trans	-71.7	118.8	-177.8	179.2	0	0	0	0	110.2	K452 I453 W499 K500	K452-V502 HydrophobicContact CB-CG1 4.15Å; K452-V502 HydrophobicContact CB-CG2 4.1Å; K452-V502 WeakPolarHBondContact O-CG2 3.3Å; I453-V502 HydrophobicContact CG1-CG1 3.89Å; W499-V502 WeakPolarHBondContact O-CG2 3.32Å; W499-V502 PolarHBondContact O-N 3.42Å; K500-V502 VanDerWaalsContact C-N 3.27Å
503	E	92.7	Very high	94.1	Very high	173 Å²	173	69.9 Å²	69.9	81%	0.808	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-71.5	134.5	168.9	-66.6	-173.5	171.5	0	0	110.3	Q501 P505	Q501-E503 PolarHBondContact O-N 2.97Å; E503-P505 VanDerWaalsContact O-CD 3.32Å; E503-P505 WeakPolarHBondContact O-CD 3.32Å
504	C	94.9	Very high	94.2	Very high	27 Å²	27	73.9 Å²	73.9	18%	0.182	35%	0.353	C	S	.	.	P	Polyproline II helix	trans	-68.7	118.3	179.9	-169.2	0	0	0	0	110.5	H299 L302 F506	H299-C504 VanDerWaalsContact CE1-CB 3.44Å; H299-C504 WeakPolarHBondContact CE1-CB 3.29Å; H299-C504 PolarHBondContact CE1-SG 2.89Å; H299-C504 VanDerWaalsContact CG-SG 3.51Å; H299-C504 VanDerWaalsContact ND1-CB 3.32Å; H299-C504 WeakPolarHBondContact ND1-CB 3.34Å; H299-C504 PolarHBondContact ND1-SG 3.17Å; H299-C504 VanDerWaalsContact ND1-SG 3.36Å; H299-C504 PolarHBondContact NE2-SG 3.24Å; L302-C504 HydrophobicContact CD1-CB 3.67Å; C504-F506 VanDerWaalsContact C-N 3.3Å; C504-F506 PolarHBondContact O-N 3.11Å; C504-F506 VanDerWaalsContact SG-CD2 3.56Å
505	P	95.3	Very high	94.3	Very high	58 Å²	58	73.2 Å²	73.2	38%	0.377	35%	0.345	S	S	.	.			trans	-84.4	-3.5	-172.9	34.9	-36.2	0	0	0	113.7	R450 I453 E503	R450-P505 HydrophobicContact CB-CG 4.21Å; I453-P505 HydrophobicContact CD1-CG 3.97Å; E503-P505 VanDerWaalsContact O-CD 3.32Å; E503-P505 WeakPolarHBondContact O-CD 3.32Å
506	F	96.5	Very high	94.6	Very high	25 Å²	25	71.9 Å²	71.9	11%	0.11	34%	0.338	C	S	.	.	S	Bend	trans	-84.3	155.7	-177.4	-52	-58.9	0	0	0	111.2	Q295 T298 H299 I383 R450 I453 C504	Q295-F506 HydrophobicContact CB-CB 3.78Å; Q295-F506 HydrophobicContact CB-CD1 4.3Å; Q295-F506 HydrophobicContact CB-CD2 3.74Å; Q295-F506 HydrophobicContact CB-CE2 4.41Å; Q295-F506 HydrophobicContact CB-CG 3.68Å; Q295-F506 HydrophobicContact CG-CB 4.02Å; Q295-F506 HydrophobicContact CG-CD1 3.6Å; Q295-F506 HydrophobicContact CG-CD2 3.74Å; Q295-F506 HydrophobicContact CG-CE1 3.93Å; Q295-F506 HydrophobicContact CG-CE2 4.07Å; Q295-F506 HydrophobicContact CG-CG 3.5Å; Q295-F506 HydrophobicContact CG-CZ 4.16Å; T298-F506 HydrophobicContact CG2-CD2 4.44Å; T298-F506 HydrophobicContact CG2-CE2 4.04Å; H299-F506 PolarHBondContact CE1-O 3.31Å; H299-F506 PolarHBondContact NE2-O 3.02Å; I383-F506 HydrophobicContact CD1-CE2 4.03Å; I383-F506 HydrophobicContact CD1-CZ 3.95Å; I383-F506 HydrophobicContact CG1-CE2 4.47Å; I383-F506 HydrophobicContact CG1-CZ 4.07Å; I383-F506 HydrophobicContact CG2-CE2 4.13Å; I383-F506 HydrophobicContact CG2-CZ 4.26Å; R450-F506 HydrophobicContact CG-CE1 4.11Å; R450-F506 HydrophobicContact CG-CZ 3.99Å; I453-F506 HydrophobicContact CD1-CE2 3.69Å; I453-F506 HydrophobicContact CD1-CZ 3.95Å; C504-F506 VanDerWaalsContact C-N 3.3Å; C504-F506 PolarHBondContact O-N 3.11Å; C504-F506 VanDerWaalsContact SG-CD2 3.56Å
507	E	96	Very high	94.8	Very high	173 Å²	173	73 Å²	73	81%	0.808	34%	0.344	S	S	*	.	P	Polyproline II helix	trans	-69.6	143.4	173.2	-66	-172.7	169.9	0	0	111.2	Q296	Q296-E507 PolarHBondContact NE2-O 3.11Å
508	K	96.9	Very high	94.9	Very high	141 Å²	141	71.8 Å²	71.8	61%	0.613	34%	0.338	S	S	*	.	P	Polyproline II helix	trans	-87.1	119.1	178.8	-70.7	-172.7	178.3	-172.3	0	110.5	H299 L513	H299-K508 VanDerWaalsContact CE1-CG 3.43Å; H299-K508 WeakPolarHBondContact CE1-CG 3.3Å; H299-K508 WeakPolarHBondContact ND1-CE 3.33Å; K508-L513 HydrophobicContact CB-CD1 4.21Å; K508-L513 HydrophobicContact CG-CD1 4.44Å
509	D	97.3	Very high	94.9	Very high	61 Å²	61	67.5 Å²	67.5	33%	0.326	31%	0.312	S	S	.	.			trans	-98.3	104.7	167	-171.5	-44.2	0	0	0	110	Q296 K511 I512 L513	Q296-D509 HydrophobicContact CG-CB 4.35Å; D509-K511 VanDerWaalsContact C-N 3.27Å; D509-K511 PolarHBondContact O-N 2.95Å; D509-K511 WeakPolarHBondContact OD1-CA 3.39Å; D509-K511 WeakPolarHBondContact OD1-CB 3.22Å; D509-K511 PolarHBondContact OD1-N 3.21Å; D509-I512 HydrophobicContact CB-CB 4.2Å; D509-I512 HydrophobicContact CB-CD1 3.84Å; D509-I512 HydrophobicContact CB-CG1 4.11Å; D509-I512 PolarHBondContact O-N 3.44Å; D509-I512 PolarHBondContact OD1-N 2.83Å; D509-I512 VanDerWaalsContact OD1-N 3.13Å; D509-L513 WeakPolarHBondContact O-CB 3.22Å; D509-L513 VanDerWaalsContact O-CG 3.28Å; D509-L513 WeakPolarHBondContact O-CG 3.47Å; D509-L513 PolarHBondContact O-N 2.76Å
510	R	95.8	Very high	94.8	Very high	218 Å²	218	67.5 Å²	67.5	82%	0.823	31%	0.314	S	S	*	.	H	α-helix	trans	-62	-31.1	-177.7	-65.2	-175.3	179.9	-176	-0.2	113.3	Q514	R510-Q514 WeakPolarHBondContact O-CB 3.2Å; R510-Q514 PolarHBondContact O-N 3.4Å
511	K	95.2	Very high	94.8	Very high	165 Å²	165	67.2 Å²	67.2	72%	0.717	31%	0.314	S	S	*	.	H	α-helix	trans	-72.1	-44.1	-178.3	-65.8	175.2	-177.7	168.1	0	110.2	D509 Y515	D509-K511 VanDerWaalsContact C-N 3.27Å; D509-K511 PolarHBondContact O-N 2.95Å; D509-K511 WeakPolarHBondContact OD1-CA 3.39Å; D509-K511 WeakPolarHBondContact OD1-CB 3.22Å; D509-K511 PolarHBondContact OD1-N 3.21Å; K511-Y515 PolarHBondContact O-N 3.39Å; K511-Y515 VanDerWaalsContact O-N 3.09Å
512	I	96.9	Very high	94.7	Very high	2 Å²	2	61.6 Å²	61.6	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-67	-48.2	177.9	-59.9	172.7	0	0	0	110	I286 C287 T292 V293 Q296 D509 Q514 Y515 L516	I286-I512 HydrophobicContact CG2-CG1 4.09Å; C287-I512 HydrophobicContact CB-CD1 3.55Å; C287-I512 HydrophobicContact CB-CG1 3.91Å; T292-I512 HydrophobicContact CG2-CD1 3.49Å; T292-I512 VanDerWaalsContact CG2-CD1 3.49Å; V293-I512 HydrophobicContact CG2-CG2 4.44Å; Q296-I512 HydrophobicContact CB-CG2 3.88Å; Q296-I512 HydrophobicContact CG-CB 3.94Å; Q296-I512 HydrophobicContact CG-CD1 4.31Å; Q296-I512 HydrophobicContact CG-CG2 3.66Å; D509-I512 HydrophobicContact CB-CB 4.2Å; D509-I512 HydrophobicContact CB-CD1 3.84Å; D509-I512 HydrophobicContact CB-CG1 4.11Å; D509-I512 PolarHBondContact O-N 3.44Å; D509-I512 PolarHBondContact OD1-N 2.83Å; D509-I512 VanDerWaalsContact OD1-N 3.13Å; I512-Q514 PolarHBondContact O-N 3.03Å; I512-Y515 WeakPolarHBondContact O-CB 3.45Å; I512-Y515 PolarHBondContact O-N 3.33Å; I512-Y515 VanDerWaalsContact O-N 3.11Å; I512-L516 HydrophobicContact CG2-CD1 3.82Å; I512-L516 HydrophobicContact CG2-CG 4.22Å; I512-L516 WeakPolarHBondContact O-CG 3.37Å; I512-L516 PolarHBondContact O-N 3.18Å
513	L	96.6	Very high	94.5	Very high	26 Å²	26	64 Å²	64	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-49.3	177.4	-72.3	169.9	0	0	0	111.7	Q296 H299 I300 K508 D509 Y515 L516 L517	Q296-L513 HydrophobicContact CB-CD2 3.94Å; Q296-L513 HydrophobicContact CB-CG 4.35Å; Q296-L513 WeakPolarHBondContact O-CD2 3.02Å; H299-L513 HydrophobicContact CB-CD2 4.18Å; I300-L513 HydrophobicContact CD1-CD2 3.94Å; I300-L513 HydrophobicContact CG1-CD2 3.63Å; K508-L513 HydrophobicContact CB-CD1 4.21Å; K508-L513 HydrophobicContact CG-CD1 4.44Å; D509-L513 WeakPolarHBondContact O-CB 3.22Å; D509-L513 VanDerWaalsContact O-CG 3.28Å; D509-L513 WeakPolarHBondContact O-CG 3.47Å; D509-L513 PolarHBondContact O-N 2.76Å; L513-Y515 VanDerWaalsContact C-N 3.25Å; L513-Y515 PolarHBondContact O-N 3.11Å; L513-L516 PolarHBondContact O-N 3.42Å; L513-L517 WeakPolarHBondContact O-CB 3.32Å; L513-L517 VanDerWaalsContact O-CG 3.28Å; L513-L517 WeakPolarHBondContact O-CG 3.36Å; L513-L517 PolarHBondContact O-N 3.46Å
514	Q	94.8	Very high	94.3	Very high	85 Å²	85	60 Å²	60	40%	0.397	28%	0.283	S	S	.	.	H	α-helix	trans	-57.9	-41.8	177.6	-176.7	64.6	40.9	0	0	111.1	R510 I512 T518	R510-Q514 WeakPolarHBondContact O-CB 3.2Å; R510-Q514 PolarHBondContact O-N 3.4Å; I512-Q514 PolarHBondContact O-N 3.03Å; Q514-T518 VanDerWaalsContact NE2-CG2 3.28Å; Q514-T518 PolarHBondContact NE2-OG1 3.34Å; Q514-T518 PolarHBondContact O-N 3.39Å; Q514-T518 PolarHBondContact O-OG1 3.48Å
515	Y	95.4	Very high	94.2	Very high	27 Å²	27	62.1 Å²	62.1	11%	0.106	29%	0.293	C	S	.	.	H	α-helix	trans	-64.7	-53.9	178.2	-174.4	-93.7	0	0	0	112.1	R281 L283 I286 E356 K511 I512 L513 L517 T518 A519	R281-Y515 WeakPolarHBondContact O-CE2 3.41Å; R281-Y515 PolarHBondContact O-OH 3.43Å; L283-Y515 HydrophobicContact CB-CD1 4.41Å; L283-Y515 HydrophobicContact CB-CE1 3.79Å; L283-Y515 HydrophobicContact CD1-CD1 3.81Å; L283-Y515 HydrophobicContact CD1-CE1 4.07Å; L283-Y515 HydrophobicContact CG-CE1 4.47Å; L283-Y515 PolarHBondContact N-OH 3.35Å; I286-Y515 HydrophobicContact CD1-CD1 4.05Å; I286-Y515 HydrophobicContact CD1-CD2 3.06Å; I286-Y515 HydrophobicContact CD1-CE1 4.4Å; I286-Y515 HydrophobicContact CD1-CE2 3.5Å; I286-Y515 VanDerWaalsContact CD1-CE2 3.5Å; I286-Y515 HydrophobicContact CD1-CG 3.34Å; E356-Y515 PolarHBondContact OE1-OH 3.29Å; K511-Y515 PolarHBondContact O-N 3.39Å; K511-Y515 VanDerWaalsContact O-N 3.09Å; I512-Y515 WeakPolarHBondContact O-CB 3.45Å; I512-Y515 PolarHBondContact O-N 3.33Å; I512-Y515 VanDerWaalsContact O-N 3.11Å; L513-Y515 VanDerWaalsContact C-N 3.25Å; L513-Y515 PolarHBondContact O-N 3.11Å; Y515-L517 PolarHBondContact O-N 3.43Å; Y515-T518 PolarHBondContact O-N 2.86Å; Y515-T518 VanDerWaalsContact O-N 3.15Å; Y515-A519 HydrophobicContact CD1-CB 4.17Å; Y515-A519 HydrophobicContact CD2-CB 4.31Å; Y515-A519 HydrophobicContact CE1-CB 3.92Å; Y515-A519 HydrophobicContact CE2-CB 4.1Å; Y515-A519 HydrophobicContact CG-CB 4.38Å; Y515-A519 WeakPolarHBondContact O-CB 3.41Å; Y515-A519 PolarHBondContact O-N 2.86Å
516	L	96.8	Very high	93.9	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-54	-43.8	179.4	-67.5	171.2	0	0	0	111.4	L283 Q296 L297 I300 W345 R348 L352 I512 L513	L283-L516 HydrophobicContact CD1-CD2 4.32Å; L283-L516 HydrophobicContact CD2-CD2 4.26Å; Q296-L516 HydrophobicContact CB-CD1 4Å; L297-L516 HydrophobicContact CD2-CD1 3.96Å; L297-L516 HydrophobicContact CD2-CD2 4.25Å; L297-L516 HydrophobicContact CG-CD1 4.25Å; I300-L516 HydrophobicContact CD1-CB 3.95Å; I300-L516 HydrophobicContact CD1-CD1 4.13Å; W345-L516 HydrophobicContact CH2-CB 4.44Å; R348-L516 PolarHBondContact NH2-O 3.01Å; L352-L516 HydrophobicContact CD2-CD2 4.23Å; I512-L516 HydrophobicContact CG2-CD1 3.82Å; I512-L516 HydrophobicContact CG2-CG 4.22Å; I512-L516 WeakPolarHBondContact O-CG 3.37Å; I512-L516 PolarHBondContact O-N 3.18Å; L513-L516 PolarHBondContact O-N 3.42Å
517	L	95.7	Very high	93.7	Very high	24 Å²	24	59.4 Å²	59.4	13%	0.126	28%	0.28	C	S	.	.	H	α-helix	trans	-72.2	-31.7	-178.2	-70.2	171.6	0	0	0	114	V260 I300 W345 R348 L513 Y515	V260-L517 HydrophobicContact CG1-CB 3.9Å; I300-L517 HydrophobicContact CD1-CD2 3.94Å; I300-L517 HydrophobicContact CD1-CG 3.96Å; I300-L517 HydrophobicContact CG1-CD2 4.21Å; I300-L517 HydrophobicContact CG1-CG 4.42Å; I300-L517 HydrophobicContact CG2-CD2 3.96Å; W345-L517 HydrophobicContact CE3-CD2 4.41Å; W345-L517 HydrophobicContact CZ3-CD2 4.02Å; R348-L517 VanDerWaalsContact CZ-O 3.29Å; R348-L517 PolarHBondContact NE-O 2.98Å; R348-L517 VanDerWaalsContact NH2-C 3.31Å; R348-L517 PolarHBondContact NH2-O 3.05Å; R348-L517 VanDerWaalsContact NH2-O 3.12Å; L513-L517 WeakPolarHBondContact O-CB 3.32Å; L513-L517 VanDerWaalsContact O-CG 3.28Å; L513-L517 WeakPolarHBondContact O-CG 3.36Å; L513-L517 PolarHBondContact O-N 3.46Å; Y515-L517 PolarHBondContact O-N 3.43Å
518	T	94.6	Very high	93.6	Very high	0 Å²	0	51.8 Å²	51.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-125.6	0.1	-169	62.4	0	0	0	0	115.8	V260 T263 R267 Q514 Y515	V260-T518 HydrophobicContact CG1-CG2 4.04Å; T263-T518 HydrophobicContact CG2-CG2 3.9Å; R267-T518 WeakPolarHBondContact CD-O 3.49Å; R267-T518 PolarHBondContact NH1-OG1 3.47Å; R267-T518 PolarHBondContact NH2-OG1 3.01Å; Q514-T518 VanDerWaalsContact NE2-CG2 3.28Å; Q514-T518 PolarHBondContact NE2-OG1 3.34Å; Q514-T518 PolarHBondContact O-N 3.39Å; Q514-T518 PolarHBondContact O-OG1 3.48Å; Y515-T518 PolarHBondContact O-N 2.86Å; Y515-T518 VanDerWaalsContact O-N 3.15Å
519	A	92.9	Very high	93.4	Very high	1 Å²	1	45.9 Å²	45.9	1%	0.008	22%	0.219	C	C	.	.	S	Bend	trans	-55.5	138.6	173.2	0	0	0	0	0	110.9	R348 L352 Y515 V521	R348-A519 PolarHBondContact NH1-O 3.41Å; R348-A519 VanDerWaalsContact NH1-O 3.11Å; R348-A519 PolarHBondContact NH2-O 3.26Å; L352-A519 HydrophobicContact CD1-CB 3.7Å; Y515-A519 HydrophobicContact CD1-CB 4.17Å; Y515-A519 HydrophobicContact CD2-CB 4.31Å; Y515-A519 HydrophobicContact CE1-CB 3.92Å; Y515-A519 HydrophobicContact CE2-CB 4.1Å; Y515-A519 HydrophobicContact CG-CB 4.38Å; Y515-A519 WeakPolarHBondContact O-CB 3.41Å; Y515-A519 PolarHBondContact O-N 2.86Å; A519-V521 PolarHBondContact O-N 3.33Å
520	P	90.3	Very high	93.2	Very high	11 Å²	11	43.3 Å²	43.3	7%	0.071	21%	0.207	C	C	.	.			trans	-62.7	136.8	176.1	28.2	-33.8	0	0	0	109.6	L268 L271	L268-P520 HydrophobicContact CB-CB 4.31Å; L268-P520 HydrophobicContact CD1-CB 4.13Å; L271-P520 HydrophobicContact CB-CB 4.5Å; L271-P520 HydrophobicContact CD1-CB 4.24Å; L271-P520 HydrophobicContact CD1-CG 3.74Å
521	V	91.1	Very high	93.1	Very high	23 Å²	23	33 Å²	33	14%	0.139	17%	0.168	C	C	.	.			trans	-120.3	131.7	-178.8	171.3	0	0	0	0	108.6	R348 Y351 L352 A519	R348-V521 HydrophobicContact CG-CG2 4.4Å; Y351-V521 HydrophobicContact CG-CG1 4.29Å; L352-V521 HydrophobicContact CB-CG2 3.79Å; L352-V521 HydrophobicContact CD1-CG2 3.97Å; L352-V521 HydrophobicContact CG-CG2 4.46Å; A519-V521 PolarHBondContact O-N 3.33Å
522	F	89.9	Confident	93.1	Very high	27 Å²	27	25.5 Å²	25.5	12%	0.118	14%	0.135	C	C	.	.			trans	-73.7	144.1	-178.1	-75.3	3.7	0	0	0	111.4	L271 Y351 T355 L359 A526 L527 A530	L271-F522 HydrophobicContact CD2-CE1 3.66Å; L271-F522 HydrophobicContact CD2-CZ 4.36Å; Y351-F522 WeakPolarHBondContact CD1-O 3.29Å; T355-F522 HydrophobicContact CG2-CB 4.28Å; T355-F522 HydrophobicContact CG2-CD1 3.78Å; T355-F522 HydrophobicContact CG2-CD2 4.12Å; T355-F522 HydrophobicContact CG2-CE1 4.1Å; T355-F522 HydrophobicContact CG2-CE2 4.42Å; T355-F522 HydrophobicContact CG2-CG 3.8Å; T355-F522 HydrophobicContact CG2-CZ 4.43Å; T355-F522 PolarHBondContact OG1-N 3.33Å; L359-F522 HydrophobicContact CD1-CE1 4.3Å; L359-F522 HydrophobicContact CD1-CE2 4.01Å; L359-F522 HydrophobicContact CD1-CZ 3.45Å; L359-F522 VanDerWaalsContact CD1-CZ 3.45Å; F522-A526 HydrophobicContact CB-CB 3.9Å; F522-A526 HydrophobicContact CD2-CB 4.27Å; F522-A526 HydrophobicContact CG-CB 4.04Å; F522-L527 HydrophobicContact CB-CD2 3.74Å; F522-L527 HydrophobicContact CB-CG 3.67Å; F522-L527 HydrophobicContact CD2-CD2 4.11Å; F522-L527 HydrophobicContact CG-CD2 4.38Å; F522-A530 HydrophobicContact CD2-CB 4.22Å; F522-A530 HydrophobicContact CE2-CB 3.86Å
523	T	89.5	Confident	92.8	Very high	75 Å²	75	31.9 Å²	31.9	46%	0.46	17%	0.165	S	C	.	.			trans	-67.2	164.3	165	61.5	0	0	0	0	109.9	D525 A526 L527	T523-D525 VanDerWaalsContact C-N 3.29Å; T523-D525 PolarHBondContact O-N 3.42Å; T523-A526 PolarHBondContact O-N 3.02Å; T523-A526 VanDerWaalsContact O-N 3.13Å; T523-A526 WeakPolarHBondContact OG1-CB 3.48Å; T523-A526 PolarHBondContact OG1-N 3.34Å; T523-L527 WeakPolarHBondContact O-CG 3.47Å; T523-L527 PolarHBondContact O-N 3.2Å
524	E	88.2	Confident	92.6	Very high	89 Å²	89	31.7 Å²	31.7	42%	0.416	17%	0.166	S	C	.	.	H	α-helix	trans	-52.2	-48.8	176.7	-172.6	-178.2	177	0	0	111.8	Y351 A526 L527 Y528 R545	Y351-E524 HydrophobicContact CE1-CB 4.46Å; E524-A526 PolarHBondContact O-N 2.79Å; E524-L527 WeakPolarHBondContact O-CB 3.49Å; E524-L527 PolarHBondContact O-N 3.32Å; E524-Y528 HydrophobicContact CG-CD2 3.92Å; E524-Y528 HydrophobicContact CG-CE2 3.71Å; E524-Y528 VanDerWaalsContact O-CD2 3.28Å; E524-Y528 WeakPolarHBondContact O-CD2 3.41Å; E524-Y528 PolarHBondContact O-N 3.44Å; E524-Y528 WeakPolarHBondContact OE1-CE2 3.18Å; E524-R545 IonicContact OE1-NH2 3.91Å
525	D	91.4	Very high	92.6	Very high	72 Å²	72	28.2 Å²	28.2	39%	0.385	15%	0.15	S	C	.	.	H	α-helix	trans	-61.3	-41.5	178.7	-75.3	-16.9	0	0	0	113.1	T523 Y528 L529 L549 L553	T523-D525 VanDerWaalsContact C-N 3.29Å; T523-D525 PolarHBondContact O-N 3.42Å; D525-Y528 PolarHBondContact O-N 2.9Å; D525-L529 PolarHBondContact O-N 3.1Å; D525-L549 HydrophobicContact CB-CD2 3.65Å; D525-L549 WeakPolarHBondContact OD1-CD2 3.45Å; D525-L553 HydrophobicContact CB-CD1 4.23Å
526	A	90.7	Very high	92.5	Very high	26 Å²	26	29 Å²	29	22%	0.215	17%	0.166	C	C	.	.	H	α-helix	trans	-66.9	-37.3	176.5	0	0	0	0	0	111.8	F522 T523 E524 L529 A530	F522-A526 HydrophobicContact CB-CB 3.9Å; F522-A526 HydrophobicContact CD2-CB 4.27Å; F522-A526 HydrophobicContact CG-CB 4.04Å; T523-A526 PolarHBondContact O-N 3.02Å; T523-A526 VanDerWaalsContact O-N 3.13Å; T523-A526 WeakPolarHBondContact OG1-CB 3.48Å; T523-A526 PolarHBondContact OG1-N 3.34Å; E524-A526 PolarHBondContact O-N 2.79Å; A526-L529 PolarHBondContact O-N 2.68Å; A526-A530 WeakPolarHBondContact O-CB 3.43Å; A526-A530 PolarHBondContact O-N 3.02Å
527	L	92.6	Very high	92.3	Very high	1 Å²	1	31 Å²	31	1%	0.005	18%	0.179	C	C	.	.	H	α-helix	trans	-62.4	-45.1	172.8	-74.5	173.9	0	0	0	111.6	Y351 A354 C358 M398 P400 F522 T523 E524 A530 S531	Y351-L527 HydrophobicContact CD1-CD1 3.6Å; Y351-L527 HydrophobicContact CE1-CD1 3.99Å; A354-L527 HydrophobicContact CB-CD1 3.83Å; A354-L527 HydrophobicContact CB-CD2 3.95Å; C358-L527 HydrophobicContact CB-CD2 4.24Å; M398-L527 HydrophobicContact SD-CD1 4.08Å; P400-L527 HydrophobicContact CB-CB 3.92Å; P400-L527 HydrophobicContact CG-CB 3.8Å; F522-L527 HydrophobicContact CB-CD2 3.74Å; F522-L527 HydrophobicContact CB-CG 3.67Å; F522-L527 HydrophobicContact CD2-CD2 4.11Å; F522-L527 HydrophobicContact CG-CD2 4.38Å; T523-L527 WeakPolarHBondContact O-CG 3.47Å; T523-L527 PolarHBondContact O-N 3.2Å; E524-L527 WeakPolarHBondContact O-CB 3.49Å; E524-L527 PolarHBondContact O-N 3.32Å; L527-A530 PolarHBondContact O-N 3.48Å; L527-S531 VanDerWaalsContact O-CB 3.24Å; L527-S531 WeakPolarHBondContact O-CB 3.38Å; L527-S531 PolarHBondContact O-N 2.97Å
528	Y	93.7	Very high	92	Very high	12 Å²	12	35.4 Å²	35.4	5%	0.047	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-44.5	176.4	-87.2	-80.3	0	0	0	111.7	S399 P400 E524 D525 S531 Y532 R545 L549	S399-Y528 WeakPolarHBondContact CB-OH 3.49Å; S399-Y528 PolarHBondContact OG-OH 3.47Å; P400-Y528 HydrophobicContact CB-CG 4.5Å; P400-Y528 HydrophobicContact CG-CD1 3.98Å; P400-Y528 HydrophobicContact CG-CD2 3.6Å; P400-Y528 HydrophobicContact CG-CE1 4.08Å; P400-Y528 HydrophobicContact CG-CE2 3.66Å; P400-Y528 HydrophobicContact CG-CG 3.76Å; E524-Y528 HydrophobicContact CG-CD2 3.92Å; E524-Y528 HydrophobicContact CG-CE2 3.71Å; E524-Y528 VanDerWaalsContact O-CD2 3.28Å; E524-Y528 WeakPolarHBondContact O-CD2 3.41Å; E524-Y528 PolarHBondContact O-N 3.44Å; E524-Y528 WeakPolarHBondContact OE1-CE2 3.18Å; D525-Y528 PolarHBondContact O-N 2.9Å; Y528-S531 WeakPolarHBondContact O-CB 3.3Å; Y528-S531 PolarHBondContact O-N 3.11Å; Y528-Y532 HydrophobicContact CD1-CE2 4.19Å; Y528-Y532 WeakPolarHBondContact O-CD2 3.25Å; Y528-Y532 PolarHBondContact O-N 3.45Å; Y528-R545 VanDerWaalsContact CD2-NH2 3.3Å; Y528-R545 VanDerWaalsContact CE1-NH1 3.31Å; Y528-R545 VanDerWaalsContact CZ-CZ 3.46Å; Y528-R545 PolarHBondContact OH-NH1 3.44Å; Y528-R545 VanDerWaalsContact OH-NH1 3.09Å; Y528-L549 HydrophobicContact CG-CD1 4.48Å
529	L	92.5	Very high	91.9	Very high	17 Å²	17	38.7 Å²	38.7	9%	0.089	22%	0.216	C	C	.	.	H	α-helix	trans	-59.1	-52.1	177.7	-177.1	61.7	0	0	0	111	D525 A526 S531 Y532 E533 R550 L553	D525-L529 PolarHBondContact O-N 3.1Å; A526-L529 PolarHBondContact O-N 2.68Å; L529-S531 VanDerWaalsContact C-N 3.28Å; L529-S531 PolarHBondContact O-N 2.84Å; L529-Y532 PolarHBondContact O-N 3.11Å; L529-Y532 VanDerWaalsContact O-N 3.09Å; L529-E533 WeakPolarHBondContact O-CG 3.37Å; L529-E533 PolarHBondContact O-N 3.28Å; L529-R550 HydrophobicContact CD1-CB 4.5Å; L529-L553 HydrophobicContact CB-CD1 4.24Å; L529-L553 HydrophobicContact CD2-CB 4.26Å; L529-L553 HydrophobicContact CD2-CD1 3.78Å
530	A	91.9	Very high	91.8	Very high	8 Å²	8	44.6 Å²	44.6	7%	0.066	25%	0.248	C	C	.	.	H	α-helix	trans	-60.5	-36.7	177.7	0	0	0	0	0	112.7	C358 F522 A526 L527 E533 S534	C358-A530 HydrophobicContact CB-CB 4.11Å; F522-A530 HydrophobicContact CD2-CB 4.22Å; F522-A530 HydrophobicContact CE2-CB 3.86Å; A526-A530 WeakPolarHBondContact O-CB 3.43Å; A526-A530 PolarHBondContact O-N 3.02Å; L527-A530 PolarHBondContact O-N 3.48Å; A530-E533 PolarHBondContact O-N 2.8Å; A530-S534 VanDerWaalsContact O-CB 3.31Å; A530-S534 WeakPolarHBondContact O-CB 3.32Å; A530-S534 PolarHBondContact O-N 3.26Å; A530-S534 PolarHBondContact O-OG 3.46Å
531	S	95	Very high	91.9	Very high	0 Å²	0	51.4 Å²	51.4	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-62.7	-45	173.3	147.8	0	0	0	0	112	P400 R403 L527 Y528 L529 E533 S534 E535	P400-S531 VanDerWaalsContact O-CB 3.27Å; P400-S531 WeakPolarHBondContact O-CB 3.33Å; P400-S531 PolarHBondContact O-OG 3.45Å; P400-S531 VanDerWaalsContact O-OG 3.1Å; R403-S531 VanDerWaalsContact CD-OG 3.26Å; R403-S531 WeakPolarHBondContact CD-OG 3.06Å; R403-S531 WeakPolarHBondContact CG-OG 3.17Å; R403-S531 PolarHBondContact NH1-O 3.07Å; R403-S531 PolarHBondContact NH1-OG 2.85Å; L527-S531 VanDerWaalsContact O-CB 3.24Å; L527-S531 WeakPolarHBondContact O-CB 3.38Å; L527-S531 PolarHBondContact O-N 2.97Å; Y528-S531 WeakPolarHBondContact O-CB 3.3Å; Y528-S531 PolarHBondContact O-N 3.11Å; L529-S531 VanDerWaalsContact C-N 3.28Å; L529-S531 PolarHBondContact O-N 2.84Å; S531-E533 VanDerWaalsContact C-N 3.35Å; S531-S534 WeakPolarHBondContact O-CB 3.24Å; S531-S534 PolarHBondContact O-N 3.4Å; S531-E535 PolarHBondContact O-N 3.41Å
532	Y	94.2	Very high	91.9	Very high	9 Å²	9	51.9 Å²	51.9	4%	0.035	28%	0.281	C	S	.	.	H	α-helix	trans	-68	-34.6	177.7	-69.5	-51.8	0	0	0	112.6	Y528 L529 S534 E535 G536 P537 E542 W546 L549	Y528-Y532 HydrophobicContact CD1-CE2 4.19Å; Y528-Y532 WeakPolarHBondContact O-CD2 3.25Å; Y528-Y532 PolarHBondContact O-N 3.45Å; L529-Y532 PolarHBondContact O-N 3.11Å; L529-Y532 VanDerWaalsContact O-N 3.09Å; Y532-S534 VanDerWaalsContact C-N 3.31Å; Y532-E535 WeakPolarHBondContact CA-O 3.45Å; Y532-E535 CarbonylContact O-C 3.54Å; Y532-E535 VanDerWaalsContact O-C 3.24Å; Y532-G536 VanDerWaalsContact O-CA 3.32Å; Y532-G536 WeakPolarHBondContact O-CA 3.23Å; Y532-G536 PolarHBondContact O-N 3.34Å; Y532-P537 HydrophobicContact CD1-CB 4.23Å; Y532-P537 HydrophobicContact CE1-CB 4.25Å; Y532-E542 HydrophobicContact CE1-CB 3.82Å; Y532-E542 HydrophobicContact CE1-CG 4.09Å; Y532-W546 VanDerWaalsContact CB-CD1 3.48Å; Y532-W546 HydrophobicContact CD2-CB 3.71Å; Y532-W546 AromaticContact CD2-CD1 3.86Å; Y532-W546 HydrophobicContact CD2-CG 4.16Å; Y532-W546 HydrophobicContact CE2-CB 3.99Å; Y532-W546 HydrophobicContact CG-CB 4.01Å; Y532-W546 AromaticContact CG-CD1 3.9Å; Y532-W546 HydrophobicContact CG-CG 4.2Å; Y532-L549 HydrophobicContact CD2-CD1 4.46Å; Y532-L549 HydrophobicContact CE2-CD1 4.13Å
533	E	91.2	Very high	92	Very high	135 Å²	135	55.2 Å²	55.2	63%	0.631	30%	0.295	S	S	*	.	H	α-helix	trans	-66.1	-36.3	172.9	-70.2	172.7	173.2	0	0	111.6	L529 A530 S531	L529-E533 WeakPolarHBondContact O-CG 3.37Å; L529-E533 PolarHBondContact O-N 3.28Å; A530-E533 PolarHBondContact O-N 2.8Å; S531-E533 VanDerWaalsContact C-N 3.35Å
534	S	92.3	Very high	92.1	Very high	23 Å²	23	56 Å²	56	16%	0.161	30%	0.297	C	S	.	.	H	α-helix	trans	-72.9	-42.4	176.3	-81.2	0	0	0	0	113.8	C358 R366 A530 S531 Y532	C358-S534 PolarHBondContact O-OG 2.69Å; R366-S534 PolarHBondContact NH1-OG 3.31Å; R366-S534 PolarHBondContact NH2-O 2.99Å; A530-S534 VanDerWaalsContact O-CB 3.31Å; A530-S534 WeakPolarHBondContact O-CB 3.32Å; A530-S534 PolarHBondContact O-N 3.26Å; A530-S534 PolarHBondContact O-OG 3.46Å; S531-S534 WeakPolarHBondContact O-CB 3.24Å; S531-S534 PolarHBondContact O-N 3.4Å; Y532-S534 VanDerWaalsContact C-N 3.31Å
535	E	93.9	Very high	92.3	Very high	12 Å²	12	56.1 Å²	56.1	6%	0.056	29%	0.293	C	S	.	.	S	Bend	trans	-144.8	109.7	176.3	-64.7	-175.1	-154	0	0	109.2	R366 R403 L404 K405 K406 T407 S531 Y532	R366-E535 IonicContact NH2-OE1 2.65Å; R366-E535 PolarHBondContact NH2-OE1 3.05Å; R403-E535 PolarHBondContact NH1-O 2.82Å; R403-E535 PolarHBondContact NH2-O 3Å; L404-E535 WeakPolarHBondContact CA-OE2 3.48Å; L404-E535 HydrophobicContact CD2-CB 3.88Å; L404-E535 HydrophobicContact CD2-CG 3.91Å; K405-E535 PolarHBondContact N-OE2 2.8Å; K406-E535 VanDerWaalsContact CB-OE2 3.32Å; K406-E535 WeakPolarHBondContact CB-OE2 3.22Å; K406-E535 PolarHBondContact N-OE2 3.29Å; T407-E535 WeakPolarHBondContact CB-OE1 3.29Å; T407-E535 PolarHBondContact N-OE1 3.08Å; T407-E535 PolarHBondContact OG1-OE1 3.49Å; S531-E535 PolarHBondContact O-N 3.41Å; Y532-E535 WeakPolarHBondContact CA-O 3.45Å; Y532-E535 CarbonylContact O-C 3.54Å; Y532-E535 VanDerWaalsContact O-C 3.24Å
536	G	93.2	Very high	92.3	Very high	43 Å²	43	55.8 Å²	55.8	44%	0.443	29%	0.287	S	S	.	.			trans	-53.5	163.1	-174.1	0	0	0	0	0	115.3	R403 Y532	R403-G536 PolarHBondContact NH2-O 3.14Å; Y532-G536 VanDerWaalsContact O-CA 3.32Å; Y532-G536 WeakPolarHBondContact O-CA 3.23Å; Y532-G536 PolarHBondContact O-N 3.34Å
537	P	93.3	Very high	92.4	Very high	43 Å²	43	59.4 Å²	59.4	28%	0.279	30%	0.298	S	S	.	.			trans	-61.1	137.3	-178.6	25.5	-34.3	0	0	0	112	Y532 E542 K543 W546	Y532-P537 HydrophobicContact CD1-CB 4.23Å; Y532-P537 HydrophobicContact CE1-CB 4.25Å; P537-E542 WeakPolarHBondContact CA-OE2 3.48Å; P537-E542 HydrophobicContact CB-CB 3.59Å; P537-K543 HydrophobicContact CB-CB 4.21Å; P537-K543 HydrophobicContact CG-CB 4.17Å; P537-K543 HydrophobicContact CG-CG 4.4Å; P537-W546 HydrophobicContact CG-CE3 4.45Å
538	E	90.4	Very high	92.3	Very high	116 Å²	116	62.7 Å²	62.7	54%	0.542	32%	0.321	S	S	.	.	S	Bend	trans	-92.9	-18.8	-176.2	-64.4	-173	160.9	0	0	113.3	E542	E538-E542 PolarHBondContact N-OE2 3.31Å
539	N	91.4	Very high	92.1	Very high	70 Å²	70	62.6 Å²	62.6	37%	0.374	32%	0.321	S	S	.	.	S	Bend	trans	-143.3	171.9	-177.8	63.3	53.4	0	0	0	112.1	M541 E542 K543	N539-M541 PolarHBondContact O-N 2.9Å; N539-M541 WeakPolarHBondContact OD1-CB 3.45Å; N539-M541 PolarHBondContact OD1-N 3.41Å; N539-M541 VanDerWaalsContact OD1-N 3.16Å; N539-E542 PolarHBondContact O-N 3.2Å; N539-E542 PolarHBondContact OD1-N 3.48Å; N539-K543 WeakPolarHBondContact O-CB 3.38Å; N539-K543 PolarHBondContact O-N 2.96Å
540	N	92	Very high	91.8	Very high	125 Å²	125	68.1 Å²	68.1	67%	0.668	34%	0.341	S	S	*	.	H	α-helix	trans	-62.1	-39.5	-177.4	-71.3	-26.7	0	0	0	112.8	E542 K543 D544	N540-E542 PolarHBondContact O-N 3.44Å; N540-K543 WeakPolarHBondContact O-CB 3.37Å; N540-K543 PolarHBondContact O-N 3.09Å; N540-D544 PolarHBondContact O-N 2.86Å
541	M	90.7	Very high	91.5	Very high	153 Å²	153	71.2 Å²	71.2	75%	0.754	36%	0.362	S	S	*	.	H	α-helix	trans	-62.3	-44.6	177.9	-62.5	-174.2	-66.2	0	0	111.9	N539 K543 D544 R545	N539-M541 PolarHBondContact O-N 2.9Å; N539-M541 WeakPolarHBondContact OD1-CB 3.45Å; N539-M541 PolarHBondContact OD1-N 3.41Å; N539-M541 VanDerWaalsContact OD1-N 3.16Å; M541-K543 VanDerWaalsContact C-N 3.32Å; M541-D544 PolarHBondContact O-N 3.46Å; M541-R545 WeakPolarHBondContact O-CB 3.46Å; M541-R545 PolarHBondContact O-N 3.25Å
542	E	92.3	Very high	90.9	Very high	33 Å²	33	74.2 Å²	74.2	15%	0.154	38%	0.381	C	S	.	.	H	α-helix	trans	-64.1	-39.1	174.9	-73.5	-163.3	161.5	0	0	111.5	R403 Y532 P537 E538 N539 N540 D544 R545 W546	R403-E542 IonicContact CZ-OE1 3.56Å; R403-E542 IonicContact CZ-OE2 3.66Å; R403-E542 IonicContact NE-OE1 2.7Å; R403-E542 PolarHBondContact NE-OE1 3.23Å; R403-E542 IonicContact NE-OE2 3.33Å; R403-E542 PolarHBondContact NE-OE2 3.44Å; R403-E542 IonicContact NH2-OE1 3.76Å; R403-E542 IonicContact NH2-OE2 3.9Å; R403-E542 PolarHBondContact NH2-OE2 3.21Å; Y532-E542 HydrophobicContact CE1-CB 3.82Å; Y532-E542 HydrophobicContact CE1-CG 4.09Å; P537-E542 WeakPolarHBondContact CA-OE2 3.48Å; P537-E542 HydrophobicContact CB-CB 3.59Å; E538-E542 PolarHBondContact N-OE2 3.31Å; N539-E542 PolarHBondContact O-N 3.2Å; N539-E542 PolarHBondContact OD1-N 3.48Å; N540-E542 PolarHBondContact O-N 3.44Å; E542-D544 VanDerWaalsContact C-N 3.33Å; E542-D544 PolarHBondContact O-N 2.99Å; E542-R545 PolarHBondContact O-N 3.44Å; E542-W546 VanDerWaalsContact O-CB 3.25Å; E542-W546 WeakPolarHBondContact O-CB 3.01Å; E542-W546 PolarHBondContact O-N 2.91Å
543	K	92.1	Very high	90.1	Very high	97 Å²	97	76.8 Å²	76.8	42%	0.422	39%	0.394	S	S	.	.	H	α-helix	trans	-62.7	-41.1	177.7	-170.1	178.3	-176.4	178.1	0	111.4	P537 N539 N540 M541 K547	P537-K543 HydrophobicContact CB-CB 4.21Å; P537-K543 HydrophobicContact CG-CB 4.17Å; P537-K543 HydrophobicContact CG-CG 4.4Å; N539-K543 WeakPolarHBondContact O-CB 3.38Å; N539-K543 PolarHBondContact O-N 2.96Å; N540-K543 WeakPolarHBondContact O-CB 3.37Å; N540-K543 PolarHBondContact O-N 3.09Å; M541-K543 VanDerWaalsContact C-N 3.32Å; K543-K547 VanDerWaalsContact O-CG 3.31Å; K543-K547 WeakPolarHBondContact O-CG 3.29Å; K543-K547 PolarHBondContact O-N 3.13Å
544	D	91.6	Very high	89.1	Confident	92 Å²	92	74.7 Å²	74.7	49%	0.492	39%	0.387	S	S	.	.	H	α-helix	trans	-71.7	-42.2	178	-66.6	-24.8	0	0	0	111.6	N540 M541 E542 W546 K547 S548	N540-D544 PolarHBondContact O-N 2.86Å; M541-D544 PolarHBondContact O-N 3.46Å; E542-D544 VanDerWaalsContact C-N 3.33Å; E542-D544 PolarHBondContact O-N 2.99Å; D544-W546 VanDerWaalsContact C-N 3.34Å; D544-W546 PolarHBondContact O-N 2.99Å; D544-K547 PolarHBondContact O-N 2.79Å; D544-K547 IonicContact OD1-NZ 3.06Å; D544-S548 WeakPolarHBondContact O-CB 3.43Å; D544-S548 PolarHBondContact O-N 3.05Å
545	R	91.5	Very high	87.5	Confident	91 Å²	91	77.7 Å²	77.7	34%	0.343	41%	0.408	S	S	.	.	H	α-helix	trans	-60.2	-44	172.7	-173.3	173	-177.5	178	3.3	111.7	E524 Y528 M541 E542 S548 L549	E524-R545 IonicContact OE1-NH2 3.91Å; Y528-R545 VanDerWaalsContact CD2-NH2 3.3Å; Y528-R545 VanDerWaalsContact CE1-NH1 3.31Å; Y528-R545 VanDerWaalsContact CZ-CZ 3.46Å; Y528-R545 PolarHBondContact OH-NH1 3.44Å; Y528-R545 VanDerWaalsContact OH-NH1 3.09Å; M541-R545 WeakPolarHBondContact O-CB 3.46Å; M541-R545 PolarHBondContact O-N 3.25Å; E542-R545 PolarHBondContact O-N 3.44Å; R545-S548 PolarHBondContact O-N 3.35Å; R545-L549 HydrophobicContact CG-CD1 4.03Å; R545-L549 HydrophobicContact CG-CG 4.35Å; R545-L549 WeakPolarHBondContact O-CB 3.28Å; R545-L549 VanDerWaalsContact O-CG 3.3Å; R545-L549 WeakPolarHBondContact O-CG 3.43Å; R545-L549 PolarHBondContact O-N 2.98Å
546	W	92.1	Very high	85.4	Confident	65 Å²	65	87.3 Å²	87.3	25%	0.246	44%	0.444	C	S	.	.	H	α-helix	trans	-60.3	-46.4	176.4	169.1	66	0	0	0	112	Y532 P537 E542 D544 S548 L549 R550	Y532-W546 VanDerWaalsContact CB-CD1 3.48Å; Y532-W546 HydrophobicContact CD2-CB 3.71Å; Y532-W546 AromaticContact CD2-CD1 3.86Å; Y532-W546 HydrophobicContact CD2-CG 4.16Å; Y532-W546 HydrophobicContact CE2-CB 3.99Å; Y532-W546 HydrophobicContact CG-CB 4.01Å; Y532-W546 AromaticContact CG-CD1 3.9Å; Y532-W546 HydrophobicContact CG-CG 4.2Å; P537-W546 HydrophobicContact CG-CE3 4.45Å; E542-W546 VanDerWaalsContact O-CB 3.25Å; E542-W546 WeakPolarHBondContact O-CB 3.01Å; E542-W546 PolarHBondContact O-N 2.91Å; D544-W546 VanDerWaalsContact C-N 3.34Å; D544-W546 PolarHBondContact O-N 2.99Å; W546-S548 VanDerWaalsContact C-N 3.34Å; W546-S548 PolarHBondContact O-N 3.49Å; W546-L549 PolarHBondContact O-N 2.92Å; W546-R550 VanDerWaalsContact O-CB 3.26Å; W546-R550 WeakPolarHBondContact O-CB 3.48Å; W546-R550 PolarHBondContact O-N 3.4Å
547	K	91.8	Very high	82.8	Confident	103 Å²	103	94.3 Å²	94.3	45%	0.448	48%	0.477	S	S	.	.	H	α-helix	trans	-59.8	-44.4	175.3	-73.6	170.4	-177.1	170.5	0	111.9	K543 D544 R550 S551	K543-K547 VanDerWaalsContact O-CG 3.31Å; K543-K547 WeakPolarHBondContact O-CG 3.29Å; K543-K547 PolarHBondContact O-N 3.13Å; D544-K547 PolarHBondContact O-N 2.79Å; D544-K547 IonicContact OD1-NZ 3.06Å; K547-R550 PolarHBondContact O-N 3.25Å; K547-S551 WeakPolarHBondContact O-CB 3.5Å; K547-S551 PolarHBondContact O-N 2.94Å
548	S	91.3	Very high	82.3	Confident	70 Å²	70	96.9 Å²	96.9	49%	0.49	49%	0.487	S	S	.	.	H	α-helix	trans	-60.1	-51.8	177.3	173	0	0	0	0	111.1	D544 R545 W546 R550 S551 T552	D544-S548 WeakPolarHBondContact O-CB 3.43Å; D544-S548 PolarHBondContact O-N 3.05Å; R545-S548 PolarHBondContact O-N 3.35Å; W546-S548 VanDerWaalsContact C-N 3.34Å; W546-S548 PolarHBondContact O-N 3.49Å; S548-R550 VanDerWaalsContact C-N 3.34Å; S548-R550 PolarHBondContact O-N 2.99Å; S548-S551 WeakPolarHBondContact O-CB 3.36Å; S548-S551 PolarHBondContact O-N 3.2Å; S548-T552 PolarHBondContact O-N 3.03Å; S548-T552 PolarHBondContact O-OG1 2.87Å; S548-T552 VanDerWaalsContact O-OG1 3.06Å
549	L	89.8	Confident	81.9	Confident	10 Å²	10	95.8 Å²	95.8	5%	0.052	48%	0.484	C	S	.	.	H	α-helix	trans	-59.1	-44.6	177.8	-72.9	171.8	0	0	0	112.1	D525 Y528 Y532 R545 W546 S551 T552 L553	D525-L549 HydrophobicContact CB-CD2 3.65Å; D525-L549 WeakPolarHBondContact OD1-CD2 3.45Å; Y528-L549 HydrophobicContact CG-CD1 4.48Å; Y532-L549 HydrophobicContact CD2-CD1 4.46Å; Y532-L549 HydrophobicContact CE2-CD1 4.13Å; R545-L549 HydrophobicContact CG-CD1 4.03Å; R545-L549 HydrophobicContact CG-CG 4.35Å; R545-L549 WeakPolarHBondContact O-CB 3.28Å; R545-L549 VanDerWaalsContact O-CG 3.3Å; R545-L549 WeakPolarHBondContact O-CG 3.43Å; R545-L549 PolarHBondContact O-N 2.98Å; W546-L549 PolarHBondContact O-N 2.92Å; L549-S551 VanDerWaalsContact C-N 3.33Å; L549-S551 PolarHBondContact O-N 3.22Å; L549-T552 PolarHBondContact O-N 3.42Å; L549-L553 VanDerWaalsContact O-CB 3.28Å; L549-L553 WeakPolarHBondContact O-CB 3.47Å; L549-L553 WeakPolarHBondContact O-CG 3.18Å; L549-L553 PolarHBondContact O-N 3.01Å
550	R	86.9	Confident	81.3	Confident	132 Å²	132	97.3 Å²	97.3	50%	0.498	49%	0.49	S	S	.	.	H	α-helix	trans	-61.9	-42.7	178.1	-168.9	-178.1	171.6	-174.5	-4.2	111.1	L529 W546 K547 S548 L554	L529-R550 HydrophobicContact CD1-CB 4.5Å; W546-R550 VanDerWaalsContact O-CB 3.26Å; W546-R550 WeakPolarHBondContact O-CB 3.48Å; W546-R550 PolarHBondContact O-N 3.4Å; K547-R550 PolarHBondContact O-N 3.25Å; S548-R550 VanDerWaalsContact C-N 3.34Å; S548-R550 PolarHBondContact O-N 2.99Å; R550-L554 HydrophobicContact CG-CD1 3.48Å; R550-L554 VanDerWaalsContact CG-CD1 3.48Å; R550-L554 HydrophobicContact CG-CG 4.22Å; R550-L554 WeakPolarHBondContact O-CB 3.45Å; R550-L554 PolarHBondContact O-N 2.74Å
551	S	85.1	Confident	80.7	Confident	74 Å²	74	95.6 Å²	95.6	52%	0.517	48%	0.48	S	S	.	.	H	α-helix	trans	-61.3	-54.8	173.6	178.6	0	0	0	0	110.2	K547 S548 L549 L553 S555	K547-S551 WeakPolarHBondContact O-CB 3.5Å; K547-S551 PolarHBondContact O-N 2.94Å; S548-S551 WeakPolarHBondContact O-CB 3.36Å; S548-S551 PolarHBondContact O-N 3.2Å; L549-S551 VanDerWaalsContact C-N 3.33Å; L549-S551 PolarHBondContact O-N 3.22Å; S551-L553 PolarHBondContact O-N 2.91Å; S551-S555 WeakPolarHBondContact O-CB 3.32Å; S551-S555 PolarHBondContact O-N 3.34Å; S551-S555 PolarHBondContact O-OG 3.48Å
552	T	82.8	Confident	80.1	Confident	63 Å²	63	92.1 Å²	92.1	39%	0.387	46%	0.463	S	S	.	.	H	α-helix	trans	-64.6	-38.2	-174.5	-53.7	0	0	0	0	114	S548 L549	S548-T552 PolarHBondContact O-N 3.03Å; S548-T552 PolarHBondContact O-OG1 2.87Å; S548-T552 VanDerWaalsContact O-OG1 3.06Å; L549-T552 PolarHBondContact O-N 3.42Å
553	L	77.8	Confident	79.3	Confident	62 Å²	62	96 Å²	96	33%	0.325	48%	0.484	S	S	.	.	H	α-helix	trans	-89.6	-31.5	-174.9	-67.3	171.7	0	0	0	113.4	D525 L529 L549 S551	D525-L553 HydrophobicContact CB-CD1 4.23Å; L529-L553 HydrophobicContact CB-CD1 4.24Å; L529-L553 HydrophobicContact CD2-CB 4.26Å; L529-L553 HydrophobicContact CD2-CD1 3.78Å; L549-L553 VanDerWaalsContact O-CB 3.28Å; L549-L553 WeakPolarHBondContact O-CB 3.47Å; L549-L553 WeakPolarHBondContact O-CG 3.18Å; L549-L553 PolarHBondContact O-N 3.01Å; S551-L553 PolarHBondContact O-N 2.91Å
554	L	69.4	Low	78.3	Confident	92 Å²	92	95.9 Å²	95.9	48%	0.482	49%	0.488	S	S	.	.	H	α-helix	trans	-99.2	-16	-178.3	-55.1	-179.2	0	0	0	114.1	R550 R556	R550-L554 HydrophobicContact CG-CD1 3.48Å; R550-L554 VanDerWaalsContact CG-CD1 3.48Å; R550-L554 HydrophobicContact CG-CG 4.22Å; R550-L554 WeakPolarHBondContact O-CB 3.45Å; R550-L554 PolarHBondContact O-N 2.74Å; L554-R556 VanDerWaalsContact C-N 3.3Å
555	S	58.3	Low	77.3	Confident	85 Å²	85	96.2 Å²	96.2	59%	0.594	49%	0.488	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.8	0.5	174.8	69.3	0	0	0	0	114.4	S551 V557	S551-S555 WeakPolarHBondContact O-CB 3.32Å; S551-S555 PolarHBondContact O-N 3.34Å; S551-S555 PolarHBondContact O-OG 3.48Å; S555-V557 VanDerWaalsContact C-N 3.34Å
556	R	49	Very low	76.1	Confident	215 Å²	215	96.7 Å²	96.7	81%	0.811	50%	0.5	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.4	19.8	174.7	-72	-173.7	175.2	-171.1	0.6	113.3	L554	L554-R556 VanDerWaalsContact C-N 3.3Å
557	V	39.5	Very low	74.7	Confident	189 Å²	189	99.5 Å²	99.5	100%	1.145	52%	0.523	S	S	*	.			trans	-108.8	0	173.9	-178.9	0	0	0	0	109.6	S555	S555-V557 VanDerWaalsContact C-N 3.34Å

Retrieved 557 of 557 residues in 489.5 ms (Link to these results)

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