A0A3Q0KNH4_SCHMA Loading...

RUS1 family protein C16orf58 homolog AlphaSync

AlphaFold DB , UniProt , Accession A0A3Q0KNH4, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 467 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	49.9	Very low	69.5	Low	202 Å²	202	106.5 Å²	106.5	100%	0.995	58%	0.583	S	S	*	*				0	113.4	0	-76.6	178	-178.9	0	0	106.7	S3 K22	M1-S3 PolarHBondContact O-N 3.19Å; M1-K22 VanDerWaalsContact CE-NZ 3.28Å; M1-K22 HydrophobicContact SD-CD 4.11Å; M1-K22 PolarHBondContact SD-NZ 3.49Å
2	T	55	Low	69.3	Low	138 Å²	138	105.9 Å²	105.9	85%	0.847	58%	0.579	S	S	*	*			trans	-64	119.5	172.5	36.5	0	0	0	0	108.2	K4	T2-K4 PolarHBondContact O-N 3.2Å
3	S	65.7	Low	69.2	Low	72 Å²	72	101.8 Å²	101.8	50%	0.503	55%	0.553	S	S	.	*			trans	-60.4	123.2	171.1	42.8	0	0	0	0	107.9	M1 M5	M1-S3 PolarHBondContact O-N 3.19Å; S3-M5 PolarHBondContact O-N 3.04Å
4	K	72.7	Confident	68.9	Low	145 Å²	145	101.1 Å²	101.1	63%	0.63	55%	0.553	S	S	*	*			trans	-77	115	174	-74.2	-174	177.2	-177.5	0	107.8	T2 F6 L20	T2-K4 PolarHBondContact O-N 3.2Å; K4-F6 HydrophobicContact CB-CD2 4.48Å; K4-F6 HydrophobicContact CB-CE2 3.6Å; K4-F6 HydrophobicContact CB-CZ 4.08Å; K4-F6 HydrophobicContact CD-CZ 4.32Å; K4-L20 PolarHBondContact O-N 2.83Å
5	M	77.2	Confident	68.7	Low	125 Å²	125	97.5 Å²	97.5	62%	0.616	54%	0.538	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	135.2	169.5	-69	177.5	73	0	0	109.3	S3 V17 F18 T19	S3-M5 PolarHBondContact O-N 3.04Å; M5-V17 HydrophobicContact CE-CG1 3.5Å; M5-V17 VanDerWaalsContact CE-CG1 3.5Å; M5-F18 CarbonylContact C-O 3.58Å; M5-F18 VanDerWaalsContact CA-O 3.31Å; M5-F18 WeakPolarHBondContact CA-O 3.37Å; M5-T19 HydrophobicContact CG-CG2 4.09Å
6	F	78.6	Confident	68.8	Low	103 Å²	103	98.1 Å²	98.1	45%	0.452	53%	0.53	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	132	173.3	-61.9	-98.3	0	0	0	107.5	K4 V17 F18 L20	K4-F6 HydrophobicContact CB-CD2 4.48Å; K4-F6 HydrophobicContact CB-CE2 3.6Å; K4-F6 HydrophobicContact CB-CZ 4.08Å; K4-F6 HydrophobicContact CD-CZ 4.32Å; F6-V17 CarbonylContact O-C 3.47Å; F6-V17 WeakPolarHBondContact O-CA 3.26Å; F6-F18 HydrophobicContact CB-CB 4.3Å; F6-F18 HydrophobicContact CB-CD2 4.4Å; F6-F18 PolarHBondContact N-O 2.77Å; F6-F18 PolarHBondContact O-N 3.2Å; F6-L20 HydrophobicContact CD2-CD1 4.2Å; F6-L20 HydrophobicContact CD2-CG 4.11Å; F6-L20 HydrophobicContact CE2-CD1 3.3Å; F6-L20 HydrophobicContact CE2-CG 3.68Å; F6-L20 HydrophobicContact CZ-CD1 3.91Å
7	A	77.5	Confident	68.9	Low	66 Å²	66	95.8 Å²	95.8	55%	0.545	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.2	127.9	173.6	0	0	0	0	0	108.6	V14 R16 V17	A7-V14 HydrophobicContact CB-CG1 3.98Å; A7-R16 CarbonylContact C-O 3.5Å; A7-R16 WeakPolarHBondContact CA-O 3.48Å; A7-V17 HydrophobicContact CB-CG2 4.3Å
8	E	75.2	Confident	69	Low	72 Å²	72	95.3 Å²	95.3	34%	0.336	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	119.4	168.5	176	-175.7	-165.8	0	0	107.4	S15 R16 F18	E8-S15 WeakPolarHBondContact O-CA 3.49Å; E8-S15 WeakPolarHBondContact O-CB 3.46Å; E8-S15 PolarHBondContact O-N 2.96Å; E8-S15 PolarHBondContact O-OG 3.36Å; E8-R16 HydrophobicContact CB-CB 4.32Å; E8-R16 PolarHBondContact N-O 3.21Å; E8-R16 PolarHBondContact O-N 2.93Å; E8-R16 IonicContact OE1-CZ 2.7Å; E8-R16 IonicContact OE1-NH1 3.83Å; E8-R16 IonicContact OE1-NH2 3.55Å; E8-R16 PolarHBondContact OE1-NH2 2.9Å; E8-R16 WeakPolarHBondContact OE2-CD 3.43Å; E8-R16 IonicContact OE2-CZ 3.11Å; E8-R16 IonicContact OE2-NE 2.65Å; E8-R16 PolarHBondContact OE2-NE 3.49Å; E8-R16 IonicContact OE2-NH1 3.18Å; E8-R16 PolarHBondContact OE2-NH1 3.17Å; E8-R16 IonicContact OE2-NH2 2.74Å; E8-F18 HydrophobicContact CB-CE2 3.75Å; E8-F18 WeakPolarHBondContact OE2-CZ 3.18Å
9	S	72.6	Confident	69.2	Low	73 Å²	73	93.9 Å²	93.9	51%	0.51	51%	0.507	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	146	173.9	61.1	0	0	0	0	111.3	G11 E13	S9-G11 WeakPolarHBondContact CB-O 3.5Å; S9-G11 PolarHBondContact OG-O 2.95Å; S9-E13 CarbonylContact C-O 3.53Å; S9-E13 WeakPolarHBondContact CA-O 3.47Å; S9-E13 VanDerWaalsContact CB-O 3.23Å; S9-E13 WeakPolarHBondContact CB-O 3.45Å
10	Y	69.7	Low	68.9	Low	131 Å²	131	94.7 Å²	94.7	51%	0.514	51%	0.511	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	96.3	165	-177.2	-100.4	0	0	0	107.6	D12 E13 V39	Y10-D12 PolarHBondContact O-N 3.14Å; Y10-E13 PolarHBondContact N-O 3.48Å; Y10-E13 PolarHBondContact O-N 3.1Å; Y10-V39 HydrophobicContact CE1-CG1 4.41Å
11	G	70.1	Confident	68.5	Low	45 Å²	45	95.8 Å²	95.8	46%	0.464	51%	0.512	S	S	.	.	T	Hydrogen-bonded Turn	trans	64.1	-128	-167.1	0	0	0	0	0	111	S9 E13	S9-G11 WeakPolarHBondContact CB-O 3.5Å; S9-G11 PolarHBondContact OG-O 2.95Å; G11-E13 VanDerWaalsContact C-N 3.33Å
12	D	68.1	Low	68.8	Low	99 Å²	99	94.9 Å²	94.9	53%	0.529	50%	0.503	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.3	-7.1	-178.5	-62.7	-28.2	0	0	0	113.4	Y10 S52	Y10-D12 PolarHBondContact O-N 3.14Å; D12-S52 PolarHBondContact OD1-OG 3.06Å; D12-S52 PolarHBondContact OD2-OG 2.88Å
13	E	68.1	Low	68.7	Low	52 Å²	52	92.1 Å²	92.1	24%	0.243	49%	0.489	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	125.3	-178.3	-68.7	177.8	172	0	0	111.2	S9 Y10 G11 S15 H35 K42	S9-E13 CarbonylContact C-O 3.53Å; S9-E13 WeakPolarHBondContact CA-O 3.47Å; S9-E13 VanDerWaalsContact CB-O 3.23Å; S9-E13 WeakPolarHBondContact CB-O 3.45Å; Y10-E13 PolarHBondContact N-O 3.48Å; Y10-E13 PolarHBondContact O-N 3.1Å; G11-E13 VanDerWaalsContact C-N 3.33Å; E13-S15 PolarHBondContact O-N 2.83Å; E13-S15 VanDerWaalsContact O-N 3.14Å; E13-H35 IonicContact OE2-CE1 3.08Å; E13-H35 PolarHBondContact OE2-CE1 3.42Å; E13-H35 VanDerWaalsContact OE2-CE1 3.3Å; E13-K42 IonicContact OE1-NZ 3.08Å; E13-K42 PolarHBondContact OE1-NZ 2.9Å; E13-K42 IonicContact OE2-NZ 2.69Å
14	V	64.3	Low	68	Low	92 Å²	92	98.7 Å²	98.7	56%	0.558	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-66.9	113.4	172.8	177.8	0	0	0	0	108.9	A7 V17	A7-V14 HydrophobicContact CB-CG1 3.98Å; V14-V17 HydrophobicContact CG1-CG2 3.83Å
15	S	65.4	Low	66.8	Low	47 Å²	47	95.1 Å²	95.1	33%	0.329	51%	0.505	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	-36.6	-173	72.4	0	0	0	0	113	E8 E13	E8-S15 WeakPolarHBondContact O-CA 3.49Å; E8-S15 WeakPolarHBondContact O-CB 3.46Å; E8-S15 PolarHBondContact O-N 2.96Å; E8-S15 PolarHBondContact O-OG 3.36Å; E13-S15 PolarHBondContact O-N 2.83Å; E13-S15 VanDerWaalsContact O-N 3.14Å
16	R	71.1	Confident	65.4	Low	108 Å²	108	100.3 Å²	100.3	41%	0.408	52%	0.518	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.4	141	-177.9	-58.3	178.3	-131.1	156.9	16.8	110.1	A7 E8 F18	A7-R16 CarbonylContact C-O 3.5Å; A7-R16 WeakPolarHBondContact CA-O 3.48Å; E8-R16 HydrophobicContact CB-CB 4.32Å; E8-R16 PolarHBondContact N-O 3.21Å; E8-R16 PolarHBondContact O-N 2.93Å; E8-R16 IonicContact OE1-CZ 2.7Å; E8-R16 IonicContact OE1-NH1 3.83Å; E8-R16 IonicContact OE1-NH2 3.55Å; E8-R16 PolarHBondContact OE1-NH2 2.9Å; E8-R16 WeakPolarHBondContact OE2-CD 3.43Å; E8-R16 IonicContact OE2-CZ 3.11Å; E8-R16 IonicContact OE2-NE 2.65Å; E8-R16 PolarHBondContact OE2-NE 3.49Å; E8-R16 IonicContact OE2-NH1 3.18Å; E8-R16 PolarHBondContact OE2-NH1 3.17Å; E8-R16 IonicContact OE2-NH2 2.74Å; R16-F18 HydrophobicContact CB-CE2 3.93Å; R16-F18 HydrophobicContact CB-CZ 3.96Å
17	V	69.6	Low	64	Low	59 Å²	59	104 Å²	104	36%	0.358	54%	0.537	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119	126	173.2	-177.5	0	0	0	0	108.5	M5 F6 A7 V14	M5-V17 HydrophobicContact CE-CG1 3.5Å; M5-V17 VanDerWaalsContact CE-CG1 3.5Å; F6-V17 CarbonylContact O-C 3.47Å; F6-V17 WeakPolarHBondContact O-CA 3.26Å; A7-V17 HydrophobicContact CB-CG2 4.3Å; V14-V17 HydrophobicContact CG1-CG2 3.83Å
18	F	72.3	Confident	62.7	Low	87 Å²	87	106.7 Å²	106.7	38%	0.382	54%	0.541	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	127.9	178.5	-51.7	-90.5	0	0	0	109.2	M5 F6 E8 R16	M5-F18 CarbonylContact C-O 3.58Å; M5-F18 VanDerWaalsContact CA-O 3.31Å; M5-F18 WeakPolarHBondContact CA-O 3.37Å; F6-F18 HydrophobicContact CB-CB 4.3Å; F6-F18 HydrophobicContact CB-CD2 4.4Å; F6-F18 PolarHBondContact N-O 2.77Å; F6-F18 PolarHBondContact O-N 3.2Å; E8-F18 HydrophobicContact CB-CE2 3.75Å; E8-F18 WeakPolarHBondContact OE2-CZ 3.18Å; R16-F18 HydrophobicContact CB-CE2 3.93Å; R16-F18 HydrophobicContact CB-CZ 3.96Å
19	T	71.6	Confident	61.6	Low	69 Å²	69	107.9 Å²	107.9	42%	0.423	56%	0.557	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-104.8	120.7	168.7	-44.4	0	0	0	0	108	M5 E21	M5-T19 HydrophobicContact CG-CG2 4.09Å; T19-E21 PolarHBondContact O-N 3.31Å
20	L	62.8	Low	60.6	Low	109 Å²	109	107.7 Å²	107.7	57%	0.571	56%	0.555	S	S	*	*			trans	-74.1	91.7	171.4	-75.5	179.3	0	0	0	109.3	K4 F6	K4-L20 PolarHBondContact O-N 2.83Å; F6-L20 HydrophobicContact CD2-CD1 4.2Å; F6-L20 HydrophobicContact CD2-CG 4.11Å; F6-L20 HydrophobicContact CE2-CD1 3.3Å; F6-L20 HydrophobicContact CE2-CG 3.68Å; F6-L20 HydrophobicContact CZ-CD1 3.91Å
21	E	61.5	Low	59.8	Low	117 Å²	117	109 Å²	109	55%	0.547	57%	0.571	S	S	.	*			trans	-83	139.5	161.4	-71.8	-170	162.1	0	0	110.3	T19 S23	T19-E21 PolarHBondContact O-N 3.31Å; E21-S23 PolarHBondContact O-N 3.29Å; E21-S23 VanDerWaalsContact O-N 3.11Å
22	K	56.5	Low	58.9	Low	183 Å²	183	111.8 Å²	111.8	80%	0.796	57%	0.57	S	S	*	*	S	Bend	trans	-67.1	-3.9	177.1	-81.1	-172.8	171.2	-172.7	0	113.7	M1	M1-K22 VanDerWaalsContact CE-NZ 3.28Å; M1-K22 HydrophobicContact SD-CD 4.11Å; M1-K22 PolarHBondContact SD-NZ 3.49Å
23	S	52.9	Low	58.1	Low	80 Å²	80	114.2 Å²	114.2	56%	0.559	58%	0.583	S	S	*	*	S	Bend	trans	-133.2	93.9	-175.8	52.2	0	0	0	0	111.9	E21 S25	E21-S23 PolarHBondContact O-N 3.29Å; E21-S23 VanDerWaalsContact O-N 3.11Å; S23-S25 VanDerWaalsContact C-N 3.28Å; S23-S25 PolarHBondContact O-N 3.06Å; S23-S25 PolarHBondContact O-OG 2.88Å
24	Q	51.2	Low	57.4	Low	211 Å²	211	119.2 Å²	119.2	99%	0.986	61%	0.611	S	S	*	*	S	Bend	trans	38.8	1.1	151	-70.2	-172.9	-7.4	0	0	123.8
25	S	46.3	Very low	57.1	Low	70 Å²	70	118.6 Å²	118.6	49%	0.49	60%	0.602	S	S	.	*			trans	-109.3	90.9	173	50.8	0	0	0	0	111.5	S23 Q27	S23-S25 VanDerWaalsContact C-N 3.28Å; S23-S25 PolarHBondContact O-N 3.06Å; S23-S25 PolarHBondContact O-OG 2.88Å; S25-Q27 PolarHBondContact O-N 3.33Å
26	R	48	Very low	57	Low	234 Å²	234	121.2 Å²	121.2	88%	0.883	61%	0.612	S	S	*	*			trans	-69.2	93.5	163.4	-71.4	-178.4	-176.1	174.6	1.2	108.2	I28	R26-I28 PolarHBondContact O-N 3.32Å
27	Q	49.4	Very low	57.2	Low	180 Å²	180	119.2 Å²	119.2	84%	0.841	61%	0.614	S	S	*	*			trans	-74.6	106.2	164	-84.9	-173.3	-22.5	0	0	108.6	S25 S29	S25-Q27 PolarHBondContact O-N 3.33Å; Q27-S29 PolarHBondContact O-N 2.96Å
28	I	50	Low	57.7	Low	122 Å²	122	122.7 Å²	122.7	63%	0.626	62%	0.621	S	S	*	*			trans	-87.3	96.8	168.6	-59.4	171.9	0	0	0	106.1	R26 S30	R26-I28 PolarHBondContact O-N 3.32Å; I28-S30 PolarHBondContact O-N 3.49Å
29	S	52.6	Low	58.1	Low	97 Å²	97	120.2 Å²	120.2	68%	0.678	61%	0.613	S	S	*	*			trans	-78.8	112.4	165.8	51.7	0	0	0	0	108.1	Q27	Q27-S29 PolarHBondContact O-N 2.96Å
30	S	52	Low	58.7	Low	69 Å²	69	119.5 Å²	119.5	48%	0.483	61%	0.608	S	S	.	*			trans	-107.8	105.4	-173.9	102.7	0	0	0	0	107.9	I28 F32	I28-S30 PolarHBondContact O-N 3.49Å; S30-F32 VanDerWaalsContact C-N 3.25Å; S30-F32 VanDerWaalsContact CB-CE2 3.48Å; S30-F32 PolarHBondContact O-N 3.27Å; S30-F32 VanDerWaalsContact O-N 3.1Å; S30-F32 VanDerWaalsContact OG-CD2 3.27Å; S30-F32 WeakPolarHBondContact OG-CD2 3.39Å
31	L	51.8	Low	59.8	Low	160 Å²	160	118.4 Å²	118.4	84%	0.838	60%	0.603	S	S	*	*			trans	-80.6	67.8	170.6	-78.1	161.7	0	0	0	109.3	H35	L31-H35 WeakPolarHBondContact O-CB 3.31Å
32	F	50.7	Low	61	Low	102 Å²	102	114.9 Å²	114.9	45%	0.447	59%	0.585	S	S	.	*			trans	-95.9	-40.9	-159.9	-96.2	-109.2	0	0	0	116.9	S30 H35 L36	S30-F32 VanDerWaalsContact C-N 3.25Å; S30-F32 VanDerWaalsContact CB-CE2 3.48Å; S30-F32 PolarHBondContact O-N 3.27Å; S30-F32 VanDerWaalsContact O-N 3.1Å; S30-F32 VanDerWaalsContact OG-CD2 3.27Å; S30-F32 WeakPolarHBondContact OG-CD2 3.39Å; F32-H35 PolarHBondContact O-N 2.95Å; F32-L36 WeakPolarHBondContact O-CB 3.31Å; F32-L36 PolarHBondContact O-N 3.44Å
33	D	52.8	Low	62.5	Low	151 Å²	151	112.6 Å²	112.6	81%	0.807	58%	0.575	S	S	*	*	H	α-helix	trans	-74.9	-45.6	-158.2	-68.9	-19	0	0	0	115.7
34	L	51.8	Low	64.4	Low	157 Å²	157	114.5 Å²	114.5	82%	0.822	57%	0.574	S	S	*	*	H	α-helix	trans	-76	-26.6	175.2	-87.9	154.1	0	0	0	112.5	S37	L34-S37 PolarHBondContact O-OG 3.43Å; L34-S37 VanDerWaalsContact O-OG 3.12Å
35	H	59	Low	66.4	Low	79 Å²	79	107 Å²	107	37%	0.366	54%	0.538	S	S	.	.	H	α-helix	trans	-74	-31.3	-178.2	-140.3	-64.3	0	0	0	111.6	E13 L31 F32 S37 V39	E13-H35 IonicContact OE2-CE1 3.08Å; E13-H35 PolarHBondContact OE2-CE1 3.42Å; E13-H35 VanDerWaalsContact OE2-CE1 3.3Å; L31-H35 WeakPolarHBondContact O-CB 3.31Å; F32-H35 PolarHBondContact O-N 2.95Å; H35-S37 PolarHBondContact O-N 2.99Å; H35-V39 WeakPolarHBondContact ND1-CG2 3.26Å; H35-V39 VanDerWaalsContact O-CB 3.29Å; H35-V39 WeakPolarHBondContact O-CB 3.26Å; H35-V39 WeakPolarHBondContact O-CG2 3.34Å; H35-V39 PolarHBondContact O-N 3.36Å
36	L	62.2	Low	68.7	Low	102 Å²	102	105.1 Å²	105.1	53%	0.534	52%	0.522	S	S	.	.	H	α-helix	trans	-65.4	-37.9	-178.7	-169.7	66.3	0	0	0	112.6	F32 T40	F32-L36 WeakPolarHBondContact O-CB 3.31Å; F32-L36 PolarHBondContact O-N 3.44Å; L36-T40 WeakPolarHBondContact O-CB 3.22Å; L36-T40 PolarHBondContact O-N 3Å; L36-T40 PolarHBondContact O-OG1 2.91Å
37	S	76.3	Confident	71	Confident	66 Å²	66	94.2 Å²	94.2	46%	0.462	48%	0.482	S	S	.	.	H	α-helix	trans	-68.9	-45.1	179.9	65.2	0	0	0	0	111.7	L34 H35 T40 L41	L34-S37 PolarHBondContact O-OG 3.43Å; L34-S37 VanDerWaalsContact O-OG 3.12Å; H35-S37 PolarHBondContact O-N 2.99Å; S37-T40 PolarHBondContact O-N 3Å; S37-L41 WeakPolarHBondContact O-CG 3.33Å; S37-L41 PolarHBondContact O-N 2.8Å
38	W	79.4	Confident	72.9	Confident	131 Å²	131	90.3 Å²	90.3	50%	0.496	47%	0.47	S	S	.	.	H	α-helix	trans	-66.2	-43.3	177	-177.9	-120.6	0	0	0	112.5	T40 L41 K42	W38-T40 VanDerWaalsContact C-N 3.26Å; W38-T40 PolarHBondContact O-N 2.88Å; W38-L41 HydrophobicContact CE3-CD1 4.31Å; W38-L41 PolarHBondContact O-N 3.12Å; W38-K42 HydrophobicContact CZ2-CG 4.37Å; W38-K42 WeakPolarHBondContact O-CB 3.48Å; W38-K42 PolarHBondContact O-N 3.21Å
39	V	80.5	Confident	74.8	Confident	35 Å²	35	85.7 Å²	85.7	21%	0.212	45%	0.453	C	S	.	.	H	α-helix	trans	-61	-39	174.1	170.1	0	0	0	0	110.8	Y10 H35 K43	Y10-V39 HydrophobicContact CE1-CG1 4.41Å; H35-V39 WeakPolarHBondContact ND1-CG2 3.26Å; H35-V39 VanDerWaalsContact O-CB 3.29Å; H35-V39 WeakPolarHBondContact O-CB 3.26Å; H35-V39 WeakPolarHBondContact O-CG2 3.34Å; H35-V39 PolarHBondContact O-N 3.36Å; V39-K43 VanDerWaalsContact O-CB 3.32Å; V39-K43 WeakPolarHBondContact O-CB 3.34Å; V39-K43 PolarHBondContact O-N 3.5Å
40	T	84	Confident	76.6	Confident	54 Å²	54	83.3 Å²	83.3	33%	0.331	43%	0.429	S	S	.	.	H	α-helix	trans	-66.8	-44.9	176.5	-60.9	0	0	0	0	111.6	L36 S37 W38 K43 F44	L36-T40 WeakPolarHBondContact O-CB 3.22Å; L36-T40 PolarHBondContact O-N 3Å; L36-T40 PolarHBondContact O-OG1 2.91Å; S37-T40 PolarHBondContact O-N 3Å; W38-T40 VanDerWaalsContact C-N 3.26Å; W38-T40 PolarHBondContact O-N 2.88Å; T40-K43 WeakPolarHBondContact O-CB 3.33Å; T40-K43 PolarHBondContact O-N 3.31Å; T40-K43 VanDerWaalsContact O-N 3.16Å; T40-F44 HydrophobicContact CG2-CD2 3.78Å; T40-F44 HydrophobicContact CG2-CE2 3.48Å; T40-F44 VanDerWaalsContact CG2-CE2 3.48Å; T40-F44 WeakPolarHBondContact O-CD2 3.21Å; T40-F44 PolarHBondContact O-N 3.39Å
41	L	87	Confident	78.5	Confident	86 Å²	86	83.5 Å²	83.5	45%	0.45	43%	0.429	S	S	.	.	H	α-helix	trans	-60.4	-47.7	175.2	-74.8	170	0	0	0	111.6	S37 W38 K43 F44 F45	S37-L41 WeakPolarHBondContact O-CG 3.33Å; S37-L41 PolarHBondContact O-N 2.8Å; W38-L41 HydrophobicContact CE3-CD1 4.31Å; W38-L41 PolarHBondContact O-N 3.12Å; L41-K43 VanDerWaalsContact C-N 3.27Å; L41-K43 PolarHBondContact O-N 3.2Å; L41-F44 PolarHBondContact O-N 3.18Å; L41-F44 VanDerWaalsContact O-N 3.13Å; L41-F45 HydrophobicContact CD2-CD2 4.29Å; L41-F45 HydrophobicContact CD2-CE2 4.07Å; L41-F45 WeakPolarHBondContact O-CD2 3.04Å; L41-F45 PolarHBondContact O-N 2.94Å
42	K	87	Confident	80.4	Confident	43 Å²	43	79.3 Å²	79.3	19%	0.187	41%	0.413	C	S	.	.	H	α-helix	trans	-53.3	-46.6	172.1	-83	-178.7	161.6	-175	0	110.9	E13 W38 F44 F45 L46	E13-K42 IonicContact OE1-NZ 3.08Å; E13-K42 PolarHBondContact OE1-NZ 2.9Å; E13-K42 IonicContact OE2-NZ 2.69Å; W38-K42 HydrophobicContact CZ2-CG 4.37Å; W38-K42 WeakPolarHBondContact O-CB 3.48Å; W38-K42 PolarHBondContact O-N 3.21Å; K42-F44 VanDerWaalsContact C-N 3.29Å; K42-F44 PolarHBondContact O-N 3.06Å; K42-F45 PolarHBondContact O-N 3.46Å; K42-L46 HydrophobicContact CG-CD1 3.84Å; K42-L46 CarbonylContact O-C 3.52Å; K42-L46 WeakPolarHBondContact O-CA 3.46Å; K42-L46 WeakPolarHBondContact O-CB 3.34Å; K42-L46 PolarHBondContact O-N 2.99Å
43	K	87.9	Confident	82.5	Confident	135 Å²	135	74.5 Å²	74.5	59%	0.587	39%	0.392	S	S	*	.	H	α-helix	trans	-62	-33.6	-179.9	-175.6	179.1	178.6	-177.8	0	113.2	V39 T40 L41 K198	V39-K43 VanDerWaalsContact O-CB 3.32Å; V39-K43 WeakPolarHBondContact O-CB 3.34Å; V39-K43 PolarHBondContact O-N 3.5Å; T40-K43 WeakPolarHBondContact O-CB 3.33Å; T40-K43 PolarHBondContact O-N 3.31Å; T40-K43 VanDerWaalsContact O-N 3.16Å; L41-K43 VanDerWaalsContact C-N 3.27Å; L41-K43 PolarHBondContact O-N 3.2Å; K43-K198 WeakPolarHBondContact O-CE 3.45Å; K43-K198 PolarHBondContact O-NZ 2.98Å
44	F	91.9	Very high	84.6	Confident	120 Å²	120	67.5 Å²	67.5	53%	0.526	35%	0.354	S	S	.	.	H	α-helix	trans	-82.2	-38.5	179	-76.9	-67.9	0	0	0	112.9	T40 L41 K42 K198	T40-F44 HydrophobicContact CG2-CD2 3.78Å; T40-F44 HydrophobicContact CG2-CE2 3.48Å; T40-F44 VanDerWaalsContact CG2-CE2 3.48Å; T40-F44 WeakPolarHBondContact O-CD2 3.21Å; T40-F44 PolarHBondContact O-N 3.39Å; L41-F44 PolarHBondContact O-N 3.18Å; L41-F44 VanDerWaalsContact O-N 3.13Å; K42-F44 VanDerWaalsContact C-N 3.29Å; K42-F44 PolarHBondContact O-N 3.06Å; F44-K198 WeakPolarHBondContact O-CD 3.38Å
45	F	94.5	Very high	86.7	Confident	55 Å²	55	60.2 Å²	60.2	24%	0.241	32%	0.317	C	S	.	.	H	α-helix	trans	-113.6	-20.2	-167.4	-60.8	-68.6	0	0	0	114.6	L41 K42 Q202 L205	L41-F45 HydrophobicContact CD2-CD2 4.29Å; L41-F45 HydrophobicContact CD2-CE2 4.07Å; L41-F45 WeakPolarHBondContact O-CD2 3.04Å; L41-F45 PolarHBondContact O-N 2.94Å; K42-F45 PolarHBondContact O-N 3.46Å; F45-Q202 HydrophobicContact CB-CG 4.27Å; F45-Q202 HydrophobicContact CD1-CG 4.33Å; F45-Q202 PolarHBondContact O-NE2 2.95Å; F45-L205 HydrophobicContact CD1-CD2 4.24Å; F45-L205 HydrophobicContact CE1-CB 3.91Å; F45-L205 HydrophobicContact CE1-CD2 3.66Å; F45-L205 HydrophobicContact CE1-CG 4.29Å; F45-L205 HydrophobicContact CE2-CD2 4.37Å; F45-L205 HydrophobicContact CZ-CD2 3.73Å; F45-L205 HydrophobicContact CZ-CG 4.48Å
46	L	94.9	Very high	88.3	Confident	29 Å²	29	62.9 Å²	62.9	15%	0.152	33%	0.334	C	S	.	.	S	Bend	trans	-114.7	145.3	-176.1	-65.5	172.4	0	0	0	111.5	K42 Y50 Y58 K198	K42-L46 HydrophobicContact CG-CD1 3.84Å; K42-L46 CarbonylContact O-C 3.52Å; K42-L46 WeakPolarHBondContact O-CA 3.46Å; K42-L46 WeakPolarHBondContact O-CB 3.34Å; K42-L46 PolarHBondContact O-N 2.99Å; L46-Y50 HydrophobicContact CB-CG 4.23Å; L46-Y50 HydrophobicContact CD1-CD1 3.95Å; L46-Y50 HydrophobicContact CD1-CE1 4.19Å; L46-Y50 HydrophobicContact CD1-CG 4.37Å; L46-Y50 HydrophobicContact CD2-CD2 4.27Å; L46-Y50 HydrophobicContact CD2-CE2 4.38Å; L46-Y50 HydrophobicContact CD2-CG 4.39Å; L46-Y58 HydrophobicContact CD2-CE1 4.07Å; L46-K198 WeakPolarHBondContact O-CD 3.45Å; L46-K198 VanDerWaalsContact O-CE 3.27Å; L46-K198 WeakPolarHBondContact O-CE 3.19Å
47	P	94.4	Very high	90	Very high	5 Å²	5	58.2 Å²	58.2	3%	0.032	31%	0.309	C	S	.	.			trans	-61.5	152.4	177.6	-28.6	39.4	0	0	0	112.6	G49 Y50 V54 Y58 D194 V195 K198	P47-G49 PolarHBondContact O-N 2.76Å; P47-Y50 VanDerWaalsContact O-CB 3.23Å; P47-Y50 WeakPolarHBondContact O-CB 3.28Å; P47-Y50 PolarHBondContact O-N 3.24Å; P47-V54 HydrophobicContact CB-CG1 3.94Å; P47-V54 HydrophobicContact CG-CG1 3.74Å; P47-Y58 WeakPolarHBondContact CD-OH 3.38Å; P47-Y58 HydrophobicContact CG-CE2 4.31Å; P47-D194 VanDerWaalsContact CA-OD2 3.31Å; P47-D194 WeakPolarHBondContact CA-OD2 3.49Å; P47-V195 HydrophobicContact CB-CG2 4.17Å; P47-V195 HydrophobicContact CG-CG2 4Å; P47-K198 HydrophobicContact CG-CB 4.19Å; P47-K198 HydrophobicContact CG-CG 4.12Å
48	V	90.3	Very high	91	Very high	98 Å²	98	55.1 Å²	55.1	59%	0.594	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	127.9	175.3	178.1	0	0	0	0	108.9	Y50 S53 D194	V48-Y50 VanDerWaalsContact C-N 3.35Å; V48-S53 WeakPolarHBondContact O-CB 3.42Å; V48-S53 PolarHBondContact O-OG 3.03Å; V48-D194 PolarHBondContact N-OD2 3.25Å
49	G	89.1	Confident	91.8	Very high	25 Å²	25	53 Å²	53	26%	0.258	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	79.8	13.4	-175.3	0	0	0	0	0	114.1	P47 P51 S52 S53	P47-G49 PolarHBondContact O-N 2.76Å; G49-P51 CarbonylContact O-C 3.5Å; G49-S52 PolarHBondContact O-N 2.97Å; G49-S52 PolarHBondContact O-OG 2.56Å; G49-S53 VanDerWaalsContact C-OG 3.23Å; G49-S53 PolarHBondContact O-N 3.36Å; G49-S53 PolarHBondContact O-OG 3.17Å
50	Y	91.3	Very high	92.7	Very high	48 Å²	48	55.2 Å²	55.2	19%	0.188	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.9	134.6	170.8	177.8	-86.4	0	0	0	110.9	L46 P47 V48 S53 V54 Y58	L46-Y50 HydrophobicContact CB-CG 4.23Å; L46-Y50 HydrophobicContact CD1-CD1 3.95Å; L46-Y50 HydrophobicContact CD1-CE1 4.19Å; L46-Y50 HydrophobicContact CD1-CG 4.37Å; L46-Y50 HydrophobicContact CD2-CD2 4.27Å; L46-Y50 HydrophobicContact CD2-CE2 4.38Å; L46-Y50 HydrophobicContact CD2-CG 4.39Å; P47-Y50 VanDerWaalsContact O-CB 3.23Å; P47-Y50 WeakPolarHBondContact O-CB 3.28Å; P47-Y50 PolarHBondContact O-N 3.24Å; V48-Y50 VanDerWaalsContact C-N 3.35Å; Y50-S53 PolarHBondContact N-OG 3.11Å; Y50-V54 HydrophobicContact CD2-CG2 3.64Å; Y50-V54 HydrophobicContact CE2-CG2 3.9Å; Y50-Y58 HydrophobicContact CD2-CD1 4.16Å; Y50-Y58 HydrophobicContact CD2-CE1 4.2Å; Y50-Y58 AromaticContact CE2-CD1 3.73Å; Y50-Y58 HydrophobicContact CE2-CD1 3.73Å; Y50-Y58 HydrophobicContact CE2-CE1 4.06Å
51	P	92.3	Very high	93.3	Very high	73 Å²	73	52.9 Å²	52.9	47%	0.474	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	cis	-91.4	-11.5	7	35.3	-35.2	0	0	0	115.3	G49 S53 V54	G49-P51 CarbonylContact O-C 3.5Å; P51-S53 PolarHBondContact O-N 3.47Å; P51-V54 WeakPolarHBondContact O-CG2 3.46Å; P51-V54 PolarHBondContact O-N 2.88Å
52	S	92.1	Very high	93.9	Very high	71 Å²	71	49 Å²	49	50%	0.497	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.6	-14.1	-172.8	56.3	0	0	0	0	115	D12 G49 I188	D12-S52 PolarHBondContact OD1-OG 3.06Å; D12-S52 PolarHBondContact OD2-OG 2.88Å; G49-S52 PolarHBondContact O-N 2.97Å; G49-S52 PolarHBondContact O-OG 2.56Å; S52-I188 WeakPolarHBondContact O-CD1 3.2Å
53	S	93.9	Very high	94.4	Very high	1 Å²	1	51.2 Å²	51.2	1%	0.007	27%	0.271	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.9	-1.5	178.7	70.9	0	0	0	0	115.1	V48 G49 Y50 P51 I188 N191	V48-S53 WeakPolarHBondContact O-CB 3.42Å; V48-S53 PolarHBondContact O-OG 3.03Å; G49-S53 VanDerWaalsContact C-OG 3.23Å; G49-S53 PolarHBondContact O-N 3.36Å; G49-S53 PolarHBondContact O-OG 3.17Å; Y50-S53 PolarHBondContact N-OG 3.11Å; P51-S53 PolarHBondContact O-N 3.47Å; S53-I188 VanDerWaalsContact C-CG1 3.41Å; S53-I188 WeakPolarHBondContact O-CG1 3.3Å; S53-N191 WeakPolarHBondContact CB-ND2 3.4Å; S53-N191 PolarHBondContact O-ND2 3.18Å; S53-N191 PolarHBondContact O-OD1 3.2Å; S53-N191 PolarHBondContact OG-ND2 3.26Å
54	V	96.6	Very high	94.9	Very high	4 Å²	4	47.1 Å²	47.1	2%	0.024	25%	0.252	C	S	.	.	B	Isolated β-bridge	trans	-126.4	163	-179.7	-63.9	0	0	0	0	112.3	P47 Y50 P51 Y58 Q186 I188 V195	P47-V54 HydrophobicContact CB-CG1 3.94Å; P47-V54 HydrophobicContact CG-CG1 3.74Å; Y50-V54 HydrophobicContact CD2-CG2 3.64Å; Y50-V54 HydrophobicContact CE2-CG2 3.9Å; P51-V54 WeakPolarHBondContact O-CG2 3.46Å; P51-V54 PolarHBondContact O-N 2.88Å; V54-Y58 HydrophobicContact CB-CD2 4.13Å; V54-Y58 HydrophobicContact CB-CG 3.94Å; V54-Y58 HydrophobicContact CG1-CD2 4.08Å; V54-Y58 HydrophobicContact CG1-CE2 4.37Å; V54-Y58 HydrophobicContact CG1-CG 4.24Å; V54-Y58 HydrophobicContact CG2-CD1 3.97Å; V54-Y58 HydrophobicContact CG2-CD2 4.44Å; V54-Y58 HydrophobicContact CG2-CG 3.78Å; V54-Q186 CarbonylContact C-O 3.6Å; V54-Q186 WeakPolarHBondContact CA-O 3.41Å; V54-I188 WeakPolarHBondContact O-CD1 3.37Å; V54-V195 HydrophobicContact CG1-CG2 4.07Å
55	S	95.4	Very high	95.1	Very high	5 Å²	5	41.8 Å²	41.8	4%	0.035	23%	0.229	C	C	.	.			trans	-62.8	151	172.3	57.8	0	0	0	0	112.5	D57 Y58 Q186	S55-D57 VanDerWaalsContact CB-OD1 3.27Å; S55-D57 WeakPolarHBondContact CB-OD1 3.35Å; S55-D57 PolarHBondContact O-N 3.46Å; S55-D57 VanDerWaalsContact O-N 3.07Å; S55-D57 PolarHBondContact OG-OD1 3.27Å; S55-Y58 WeakPolarHBondContact O-CB 3.49Å; S55-Y58 PolarHBondContact O-N 2.96Å; S55-Q186 PolarHBondContact N-O 3.26Å; S55-Q186 VanDerWaalsContact N-O 3.1Å; S55-Q186 WeakPolarHBondContact OG-CA 3.42Å; S55-Q186 WeakPolarHBondContact OG-CG 3.2Å
56	D	94.5	Very high	95.3	Very high	135 Å²	135	41.5 Å²	41.5	72%	0.722	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62	-19.2	-178.5	-58.9	-34.4	0	0	0	114.4
57	D	96.5	Very high	95.4	Very high	3 Å²	3	43.3 Å²	43.3	2%	0.016	24%	0.241	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-6.4	177.8	54.9	25.9	0	0	0	113.5	S55 L59 E60 Y61 H185 C249 K251	S55-D57 VanDerWaalsContact CB-OD1 3.27Å; S55-D57 WeakPolarHBondContact CB-OD1 3.35Å; S55-D57 PolarHBondContact O-N 3.46Å; S55-D57 VanDerWaalsContact O-N 3.07Å; S55-D57 PolarHBondContact OG-OD1 3.27Å; D57-L59 PolarHBondContact O-N 3.5Å; D57-E60 PolarHBondContact O-N 3.23Å; D57-Y61 WeakPolarHBondContact O-CB 3.14Å; D57-Y61 PolarHBondContact O-N 3.2Å; D57-H185 IonicContact OD1-CD2 2.77Å; D57-H185 IonicContact OD1-NE2 3.03Å; D57-H185 PolarHBondContact OD1-NE2 3.47Å; D57-H185 IonicContact OD2-CD2 3.08Å; D57-H185 IonicContact OD2-CE1 3.77Å; D57-H185 IonicContact OD2-NE2 2.76Å; D57-H185 PolarHBondContact OD2-NE2 3.47Å; D57-C249 WeakPolarHBondContact CB-O 3.48Å; D57-K251 HydrophobicContact CB-CD 4.35Å; D57-K251 HydrophobicContact CB-CG 4.39Å; D57-K251 WeakPolarHBondContact OD2-CA 3.39Å; D57-K251 WeakPolarHBondContact OD2-CB 3.22Å; D57-K251 PolarHBondContact OD2-N 2.95Å
58	Y	97.9	Very high	95.5	Very high	1 Å²	1	43.7 Å²	43.7	0%	0.004	24%	0.242	C	C	.	.	H	α-helix	trans	-55.7	-52.7	-174.3	175.4	-90.8	0	0	0	112.3	L46 P47 Y50 V54 S55 E60 Y61 Q62 Q186 V195 Q202	L46-Y58 HydrophobicContact CD2-CE1 4.07Å; P47-Y58 WeakPolarHBondContact CD-OH 3.38Å; P47-Y58 HydrophobicContact CG-CE2 4.31Å; Y50-Y58 HydrophobicContact CD2-CD1 4.16Å; Y50-Y58 HydrophobicContact CD2-CE1 4.2Å; Y50-Y58 AromaticContact CE2-CD1 3.73Å; Y50-Y58 HydrophobicContact CE2-CD1 3.73Å; Y50-Y58 HydrophobicContact CE2-CE1 4.06Å; V54-Y58 HydrophobicContact CB-CD2 4.13Å; V54-Y58 HydrophobicContact CB-CG 3.94Å; V54-Y58 HydrophobicContact CG1-CD2 4.08Å; V54-Y58 HydrophobicContact CG1-CE2 4.37Å; V54-Y58 HydrophobicContact CG1-CG 4.24Å; V54-Y58 HydrophobicContact CG2-CD1 3.97Å; V54-Y58 HydrophobicContact CG2-CD2 4.44Å; V54-Y58 HydrophobicContact CG2-CG 3.78Å; S55-Y58 WeakPolarHBondContact O-CB 3.49Å; S55-Y58 PolarHBondContact O-N 2.96Å; Y58-E60 PolarHBondContact O-N 3.35Å; Y58-Y61 PolarHBondContact O-N 2.97Å; Y58-Q62 HydrophobicContact CD1-CG 4.15Å; Y58-Q62 HydrophobicContact CD2-CG 4.18Å; Y58-Q62 HydrophobicContact CE1-CG 3.82Å; Y58-Q62 HydrophobicContact CE2-CG 3.82Å; Y58-Q62 HydrophobicContact CG-CG 4.33Å; Y58-Q62 WeakPolarHBondContact O-CB 3.25Å; Y58-Q62 VanDerWaalsContact O-CG 3.26Å; Y58-Q62 WeakPolarHBondContact O-CG 3.45Å; Y58-Q62 PolarHBondContact O-N 3.02Å; Y58-Q186 HydrophobicContact CD2-CB 4.14Å; Y58-Q186 HydrophobicContact CD2-CG 4.06Å; Y58-V195 HydrophobicContact CE2-CG1 4.23Å; Y58-Q202 PolarHBondContact OH-NE2 3.1Å
59	L	96.8	Very high	95.9	Very high	86 Å²	86	39.3 Å²	39.3	45%	0.45	22%	0.217	S	C	.	.	H	α-helix	trans	-64.3	-45.5	-174.6	-179.6	64.4	0	0	0	111.9	D57 Y61 Q62 I63	D57-L59 PolarHBondContact O-N 3.5Å; L59-Y61 VanDerWaalsContact C-N 3.34Å; L59-Q62 PolarHBondContact O-N 3.12Å; L59-I63 HydrophobicContact CD1-CD1 4.17Å; L59-I63 HydrophobicContact CD1-CG1 4.4Å; L59-I63 HydrophobicContact CG-CD1 4Å; L59-I63 VanDerWaalsContact O-CG1 3.29Å; L59-I63 WeakPolarHBondContact O-CG1 3.38Å; L59-I63 PolarHBondContact O-N 2.9Å
60	E	98	Very high	96.3	Very high	83 Å²	83	41.1 Å²	41.1	39%	0.388	22%	0.217	S	C	.	.	H	α-helix	trans	-62.8	-44.5	178.4	-175.7	174.1	-179.1	0	0	110.4	D57 Y58 Q62 I63 W64 R245 C249	D57-E60 PolarHBondContact O-N 3.23Å; Y58-E60 PolarHBondContact O-N 3.35Å; E60-Q62 PolarHBondContact O-N 2.87Å; E60-I63 PolarHBondContact O-N 3.33Å; E60-W64 PolarHBondContact O-N 3.45Å; E60-R245 IonicContact OE1-NH2 3.43Å; E60-R245 PolarHBondContact OE1-NH2 3.45Å; E60-C249 HydrophobicContact CB-CB 4.32Å; E60-C249 VanDerWaalsContact CD-CB 3.44Å; E60-C249 HydrophobicContact CG-CB 3.82Å
61	Y	98.2	Very high	96.6	Very high	4 Å²	4	39 Å²	39	2%	0.016	21%	0.21	C	C	.	.	H	α-helix	trans	-56.1	-52	175.6	177.5	-86.2	0	0	0	111.2	D57 Y58 L59 I63 W64 D65 I182 A246 C249 L250	D57-Y61 WeakPolarHBondContact O-CB 3.14Å; D57-Y61 PolarHBondContact O-N 3.2Å; Y58-Y61 PolarHBondContact O-N 2.97Å; L59-Y61 VanDerWaalsContact C-N 3.34Å; Y61-I63 VanDerWaalsContact C-N 3.33Å; Y61-I63 PolarHBondContact O-N 3.3Å; Y61-W64 PolarHBondContact O-N 3.32Å; Y61-D65 HydrophobicContact CD1-CB 4.21Å; Y61-D65 HydrophobicContact CE1-CB 3.77Å; Y61-D65 WeakPolarHBondContact O-CB 3.5Å; Y61-D65 PolarHBondContact O-N 2.86Å; Y61-D65 PolarHBondContact OH-OD1 2.95Å; Y61-D65 VanDerWaalsContact OH-OD1 3.08Å; Y61-I182 HydrophobicContact CD2-CG2 4.49Å; Y61-I182 HydrophobicContact CE1-CG2 4.17Å; Y61-I182 HydrophobicContact CE2-CD1 3.91Å; Y61-I182 HydrophobicContact CE2-CG2 4.09Å; Y61-A246 HydrophobicContact CD2-CB 4Å; Y61-A246 WeakPolarHBondContact CD2-O 3.45Å; Y61-A246 HydrophobicContact CE2-CB 4.01Å; Y61-C249 PolarHBondContact N-SG 3.42Å; Y61-L250 HydrophobicContact CD2-CD1 4.14Å; Y61-L250 HydrophobicContact CD2-CD2 3.57Å; Y61-L250 HydrophobicContact CD2-CG 3.85Å; Y61-L250 HydrophobicContact CE2-CD1 4.11Å; Y61-L250 HydrophobicContact CE2-CD2 4.21Å; Y61-L250 HydrophobicContact CE2-CG 4.33Å; Y61-L250 HydrophobicContact CG-CD2 4.14Å
62	Q	97.7	Very high	96.8	Very high	6 Å²	6	36.6 Å²	36.6	3%	0.028	20%	0.195	C	C	.	.	H	α-helix	trans	-65.2	-34.1	-174.9	-71.2	-56.6	-20.3	0	0	113.3	Y58 L59 E60 T66 D199 Q202	Y58-Q62 HydrophobicContact CD1-CG 4.15Å; Y58-Q62 HydrophobicContact CD2-CG 4.18Å; Y58-Q62 HydrophobicContact CE1-CG 3.82Å; Y58-Q62 HydrophobicContact CE2-CG 3.82Å; Y58-Q62 HydrophobicContact CG-CG 4.33Å; Y58-Q62 WeakPolarHBondContact O-CB 3.25Å; Y58-Q62 VanDerWaalsContact O-CG 3.26Å; Y58-Q62 WeakPolarHBondContact O-CG 3.45Å; Y58-Q62 PolarHBondContact O-N 3.02Å; L59-Q62 PolarHBondContact O-N 3.12Å; E60-Q62 PolarHBondContact O-N 2.87Å; Q62-T66 WeakPolarHBondContact O-CB 3.45Å; Q62-T66 PolarHBondContact O-N 3.44Å; Q62-T66 PolarHBondContact O-OG1 3.39Å; Q62-D199 PolarHBondContact NE2-OD1 3.02Å; Q62-D199 PolarHBondContact OE1-OD1 2.84Å; Q62-Q202 VanDerWaalsContact CB-OE1 3.32Å; Q62-Q202 VanDerWaalsContact CG-OE1 3.28Å
63	I	97.9	Very high	97	Very high	88 Å²	88	34.5 Å²	34.5	45%	0.451	18%	0.18	S	C	.	.	H	α-helix	trans	-61.6	-49.7	173.7	-70.4	165.9	0	0	0	110.1	L59 E60 Y61 I67	L59-I63 HydrophobicContact CD1-CD1 4.17Å; L59-I63 HydrophobicContact CD1-CG1 4.4Å; L59-I63 HydrophobicContact CG-CD1 4Å; L59-I63 VanDerWaalsContact O-CG1 3.29Å; L59-I63 WeakPolarHBondContact O-CG1 3.38Å; L59-I63 PolarHBondContact O-N 2.9Å; E60-I63 PolarHBondContact O-N 3.33Å; Y61-I63 VanDerWaalsContact C-N 3.33Å; Y61-I63 PolarHBondContact O-N 3.3Å; I63-I67 HydrophobicContact CG2-CD1 4.18Å; I63-I67 WeakPolarHBondContact O-CG1 3.44Å; I63-I67 PolarHBondContact O-N 3.1Å
64	W	98.3	Very high	97.2	Very high	49 Å²	49	34.9 Å²	34.9	19%	0.186	18%	0.182	C	C	.	.	H	α-helix	trans	-69.5	-40.6	-179	-70	118.7	0	0	0	112.6	E60 Y61 T66 I67 Q68 Y241 R245 A246	E60-W64 PolarHBondContact O-N 3.45Å; Y61-W64 PolarHBondContact O-N 3.32Å; W64-T66 VanDerWaalsContact C-N 3.33Å; W64-T66 PolarHBondContact O-N 3.29Å; W64-I67 HydrophobicContact CE3-CD1 4.15Å; W64-I67 HydrophobicContact CZ3-CD1 4.36Å; W64-I67 PolarHBondContact O-N 2.94Å; W64-Q68 WeakPolarHBondContact O-CB 3.4Å; W64-Q68 PolarHBondContact O-N 3.18Å; W64-Y241 AromaticContact CH2-CE1 3.9Å; W64-Y241 HydrophobicContact CH2-CE1 3.9Å; W64-Y241 HydrophobicContact CZ3-CD1 4.28Å; W64-Y241 AromaticContact CZ3-CE1 3.8Å; W64-Y241 HydrophobicContact CZ3-CE1 3.8Å; W64-R245 HydrophobicContact CB-CB 4.35Å; W64-R245 HydrophobicContact CD2-CB 3.4Å; W64-R245 VanDerWaalsContact CD2-CB 3.4Å; W64-R245 HydrophobicContact CD2-CG 4.1Å; W64-R245 HydrophobicContact CE3-CB 3.87Å; W64-R245 HydrophobicContact CE3-CG 4.23Å; W64-R245 HydrophobicContact CG-CB 3.61Å; W64-R245 HydrophobicContact CH2-CG 4.15Å; W64-R245 HydrophobicContact CZ2-CB 4.1Å; W64-R245 HydrophobicContact CZ2-CG 4Å; W64-R245 HydrophobicContact CZ3-CB 4.39Å; W64-R245 HydrophobicContact CZ3-CG 4.25Å; W64-A246 HydrophobicContact CB-CB 3.66Å
65	D	97.6	Very high	97.2	Very high	9 Å²	9	34.7 Å²	34.7	5%	0.048	18%	0.181	C	C	.	.	H	α-helix	trans	-63.7	-39	177	-163.4	78.9	0	0	0	111.1	Y61 I67 Q68 A69 R133	Y61-D65 HydrophobicContact CD1-CB 4.21Å; Y61-D65 HydrophobicContact CE1-CB 3.77Å; Y61-D65 WeakPolarHBondContact O-CB 3.5Å; Y61-D65 PolarHBondContact O-N 2.86Å; Y61-D65 PolarHBondContact OH-OD1 2.95Å; Y61-D65 VanDerWaalsContact OH-OD1 3.08Å; D65-I67 PolarHBondContact O-N 2.96Å; D65-Q68 WeakPolarHBondContact O-CB 3.39Å; D65-Q68 PolarHBondContact O-N 3.42Å; D65-A69 WeakPolarHBondContact O-CB 3.42Å; D65-A69 PolarHBondContact O-N 3.38Å; D65-R133 IonicContact OD1-CZ 3.93Å; D65-R133 IonicContact OD1-NH2 3.93Å; D65-R133 PolarHBondContact OD1-NH2 3.5Å
66	T	97	Very high	97.3	Very high	49 Å²	49	35.2 Å²	35.2	30%	0.301	19%	0.187	S	C	.	.	H	α-helix	trans	-60	-46.5	173.1	-65.6	0	0	0	0	112	Q62 W64 Q68 A69 F70 S206	Q62-T66 WeakPolarHBondContact O-CB 3.45Å; Q62-T66 PolarHBondContact O-N 3.44Å; Q62-T66 PolarHBondContact O-OG1 3.39Å; W64-T66 VanDerWaalsContact C-N 3.33Å; W64-T66 PolarHBondContact O-N 3.29Å; T66-Q68 VanDerWaalsContact C-N 3.35Å; T66-A69 PolarHBondContact O-N 3.32Å; T66-F70 WeakPolarHBondContact O-CB 3.47Å; T66-F70 PolarHBondContact O-N 3.24Å; T66-S206 PolarHBondContact O-OG 3.23Å
67	I	98	Very high	97.4	Very high	66 Å²	66	29.6 Å²	29.6	34%	0.338	16%	0.159	S	C	.	.	H	α-helix	trans	-66.2	-40.2	178.4	-62.2	164.3	0	0	0	110.5	I63 W64 D65 F70 A71 I238 S242	I63-I67 HydrophobicContact CG2-CD1 4.18Å; I63-I67 WeakPolarHBondContact O-CG1 3.44Å; I63-I67 PolarHBondContact O-N 3.1Å; W64-I67 HydrophobicContact CE3-CD1 4.15Å; W64-I67 HydrophobicContact CZ3-CD1 4.36Å; W64-I67 PolarHBondContact O-N 2.94Å; D65-I67 PolarHBondContact O-N 2.96Å; I67-F70 PolarHBondContact O-N 2.96Å; I67-A71 PolarHBondContact O-N 3.15Å; I67-A71 VanDerWaalsContact O-N 3.07Å; I67-I238 HydrophobicContact CG2-CG2 3.83Å; I67-S242 VanDerWaalsContact CG2-OG 3.23Å; I67-S242 WeakPolarHBondContact CG2-OG 3.35Å
68	Q	97.4	Very high	97.5	Very high	13 Å²	13	29.6 Å²	29.6	6%	0.061	16%	0.159	C	C	.	.	H	α-helix	trans	-58.8	-53.7	175.3	178.1	-84	-67.4	0	0	110.6	W64 D65 T66 F70 A71 S72 D137 H239 N243	W64-Q68 WeakPolarHBondContact O-CB 3.4Å; W64-Q68 PolarHBondContact O-N 3.18Å; D65-Q68 WeakPolarHBondContact O-CB 3.39Å; D65-Q68 PolarHBondContact O-N 3.42Å; T66-Q68 VanDerWaalsContact C-N 3.35Å; Q68-F70 VanDerWaalsContact C-N 3.32Å; Q68-F70 PolarHBondContact O-N 3.19Å; Q68-A71 PolarHBondContact O-N 2.99Å; Q68-S72 PolarHBondContact O-N 3.4Å; Q68-D137 VanDerWaalsContact CD-OD2 3.32Å; Q68-H239 PolarHBondContact NE2-CD2 3.4Å; Q68-H239 PolarHBondContact NE2-NE2 2.91Å; Q68-H239 PolarHBondContact O-CD2 2.94Å; Q68-N243 HydrophobicContact CG-CB 4.02Å
69	A	96.8	Very high	97.5	Very high	7 Å²	7	29.5 Å²	29.5	6%	0.058	16%	0.159	C	C	.	.	H	α-helix	trans	-58.3	-42.8	179.2	0	0	0	0	0	112.2	D65 T66 A71 S72 S73 E203	D65-A69 WeakPolarHBondContact O-CB 3.42Å; D65-A69 PolarHBondContact O-N 3.38Å; T66-A69 PolarHBondContact O-N 3.32Å; A69-A71 PolarHBondContact O-N 2.95Å; A69-S72 PolarHBondContact O-N 2.98Å; A69-S73 WeakPolarHBondContact O-CB 3.3Å; A69-S73 PolarHBondContact O-N 3.05Å; A69-E203 HydrophobicContact CB-CG 4.41Å
70	F	97.6	Very high	97.4	Very high	62 Å²	62	28.6 Å²	28.6	27%	0.272	16%	0.16	S	C	.	.	H	α-helix	trans	-58.4	-49.8	176.8	-176.4	-92.6	0	0	0	111.7	T66 I67 Q68 S73 I74 S206 M209 A210 L213	T66-F70 WeakPolarHBondContact O-CB 3.47Å; T66-F70 PolarHBondContact O-N 3.24Å; I67-F70 PolarHBondContact O-N 2.96Å; Q68-F70 VanDerWaalsContact C-N 3.32Å; Q68-F70 PolarHBondContact O-N 3.19Å; F70-S73 PolarHBondContact O-N 3.34Å; F70-I74 HydrophobicContact CD1-CD1 3.98Å; F70-I74 HydrophobicContact CE1-CD1 3.51Å; F70-I74 HydrophobicContact CE1-CG1 4.5Å; F70-I74 HydrophobicContact CZ-CD1 4.11Å; F70-I74 PolarHBondContact O-N 3.36Å; F70-S206 WeakPolarHBondContact CB-OG 3.33Å; F70-S206 PolarHBondContact N-OG 2.88Å; F70-M209 HydrophobicContact CD2-CB 4.26Å; F70-M209 HydrophobicContact CE2-CB 4.04Å; F70-A210 HydrophobicContact CD2-CB 3.66Å; F70-A210 HydrophobicContact CE2-CB 3.86Å; F70-A210 HydrophobicContact CG-CB 4.24Å; F70-L213 HydrophobicContact CE1-CD2 4.18Å; F70-L213 HydrophobicContact CZ-CD2 3.68Å
71	A	98	Very high	97.3	Very high	3 Å²	3	26.3 Å²	26.3	3%	0.025	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-41.3	179.4	0	0	0	0	0	112.2	I67 Q68 A69 S73 I74 T75 C235 I238 H239	I67-A71 PolarHBondContact O-N 3.15Å; I67-A71 VanDerWaalsContact O-N 3.07Å; Q68-A71 PolarHBondContact O-N 2.99Å; A69-A71 PolarHBondContact O-N 2.95Å; A71-S73 VanDerWaalsContact C-N 3.29Å; A71-S73 PolarHBondContact O-N 3.01Å; A71-I74 PolarHBondContact O-N 2.93Å; A71-T75 PolarHBondContact O-N 3.44Å; A71-T75 PolarHBondContact O-OG1 2.95Å; A71-C235 HydrophobicContact CB-CB 4.46Å; A71-I238 HydrophobicContact CB-CB 4.33Å; A71-I238 HydrophobicContact CB-CG2 4.02Å; A71-H239 HydrophobicContact CB-CB 4.02Å
72	S	96.9	Very high	97.2	Very high	23 Å²	23	26.6 Å²	26.6	16%	0.161	15%	0.153	C	C	.	.	H	α-helix	trans	-64.2	-33.1	175.7	-174.4	0	0	0	0	112.7	Q68 A69 T75 G76 N140	Q68-S72 PolarHBondContact O-N 3.4Å; A69-S72 PolarHBondContact O-N 2.98Å; S72-T75 WeakPolarHBondContact CA-OG1 3.34Å; S72-T75 PolarHBondContact O-OG1 3.17Å; S72-G76 PolarHBondContact O-N 3.41Å; S72-N140 PolarHBondContact OG-ND2 3.48Å
73	S	97.2	Very high	97.1	Very high	28 Å²	28	26.7 Å²	26.7	20%	0.196	15%	0.154	C	C	.	.	H	α-helix	trans	-69.9	-35.2	179.1	-179.3	0	0	0	0	111.8	A69 F70 A71 G76 A77 A210 N214	A69-S73 WeakPolarHBondContact O-CB 3.3Å; A69-S73 PolarHBondContact O-N 3.05Å; F70-S73 PolarHBondContact O-N 3.34Å; A71-S73 VanDerWaalsContact C-N 3.29Å; A71-S73 PolarHBondContact O-N 3.01Å; S73-G76 PolarHBondContact O-N 3.2Å; S73-A77 PolarHBondContact O-N 3.4Å; S73-A77 VanDerWaalsContact O-N 3.08Å; S73-A210 VanDerWaalsContact CB-CB 3.44Å; S73-A210 VanDerWaalsContact OG-CB 3.32Å; S73-A210 WeakPolarHBondContact OG-CB 3.5Å; S73-N214 PolarHBondContact O-ND2 3.36Å
74	I	96.8	Very high	97	Very high	8 Å²	8	26.8 Å²	26.8	4%	0.041	16%	0.155	C	C	.	.	H	α-helix	trans	-65.9	-50.4	173.4	-63.1	171.4	0	0	0	110.9	F70 A71 G76 A77 L78 A210 L213 L217	F70-I74 HydrophobicContact CD1-CD1 3.98Å; F70-I74 HydrophobicContact CE1-CD1 3.51Å; F70-I74 HydrophobicContact CE1-CG1 4.5Å; F70-I74 HydrophobicContact CZ-CD1 4.11Å; F70-I74 PolarHBondContact O-N 3.36Å; A71-I74 PolarHBondContact O-N 2.93Å; I74-G76 VanDerWaalsContact C-N 3.25Å; I74-G76 PolarHBondContact O-N 3.27Å; I74-A77 PolarHBondContact O-N 2.88Å; I74-A77 VanDerWaalsContact O-N 3.15Å; I74-L78 PolarHBondContact O-N 3.45Å; I74-A210 HydrophobicContact CG1-CB 4.45Å; I74-L213 HydrophobicContact CD1-CD2 3.86Å; I74-L217 HydrophobicContact CG2-CD1 3.89Å; I74-L217 HydrophobicContact CG2-CD2 4.27Å
75	T	97.5	Very high	96.8	Very high	0 Å²	0	29 Å²	29	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-62.9	-35.3	177.8	53.8	0	0	0	0	111.6	A71 S72 A77 L78 A79 L144 F232 C235	A71-T75 PolarHBondContact O-N 3.44Å; A71-T75 PolarHBondContact O-OG1 2.95Å; S72-T75 WeakPolarHBondContact CA-OG1 3.34Å; S72-T75 PolarHBondContact O-OG1 3.17Å; T75-A77 PolarHBondContact O-N 3.43Å; T75-L78 PolarHBondContact O-N 2.91Å; T75-A79 WeakPolarHBondContact O-CB 3.31Å; T75-A79 PolarHBondContact O-N 3.48Å; T75-L144 VanDerWaalsContact OG1-CD1 3.32Å; T75-L144 WeakPolarHBondContact OG1-CD1 3.4Å; T75-F232 HydrophobicContact CG2-CD2 3.81Å; T75-F232 HydrophobicContact CG2-CE2 4.23Å; T75-C235 HydrophobicContact CG2-CB 3.46Å; T75-C235 VanDerWaalsContact CG2-CB 3.46Å
76	G	97.4	Very high	96.7	Very high	17 Å²	17	29.7 Å²	29.7	18%	0.175	18%	0.178	C	C	.	.	H	α-helix	trans	-59.2	-39.8	172.5	0	0	0	0	0	113.8	S72 S73 I74 S80	S72-G76 PolarHBondContact O-N 3.41Å; S73-G76 PolarHBondContact O-N 3.2Å; I74-G76 VanDerWaalsContact C-N 3.25Å; I74-G76 PolarHBondContact O-N 3.27Å; G76-S80 WeakPolarHBondContact O-CB 3.31Å; G76-S80 PolarHBondContact O-N 2.89Å; G76-S80 PolarHBondContact O-OG 2.99Å
77	A	97	Very high	96.6	Very high	16 Å²	16	28.5 Å²	28.5	13%	0.132	17%	0.17	C	C	.	.	H	α-helix	trans	-68	-42.1	176.6	0	0	0	0	0	112.4	S73 I74 T75 S80 Q81 N214 L218	S73-A77 PolarHBondContact O-N 3.4Å; S73-A77 VanDerWaalsContact O-N 3.08Å; I74-A77 PolarHBondContact O-N 2.88Å; I74-A77 VanDerWaalsContact O-N 3.15Å; T75-A77 PolarHBondContact O-N 3.43Å; A77-S80 PolarHBondContact O-N 3.35Å; A77-Q81 PolarHBondContact O-N 2.92Å; A77-N214 HydrophobicContact CB-CB 4.18Å; A77-N214 VanDerWaalsContact CB-ND2 3.35Å; A77-N214 WeakPolarHBondContact CB-ND2 3.48Å; A77-L218 HydrophobicContact CB-CD1 4.42Å; A77-L218 HydrophobicContact CB-CD2 4.43Å
78	L	97	Very high	96.4	Very high	3 Å²	3	26.1 Å²	26.1	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-61.1	-46.3	175	-64.2	177	0	0	0	111.6	I74 T75 Q81 A82 I148 L217 L218 V221 C231 F232	I74-L78 PolarHBondContact O-N 3.45Å; T75-L78 PolarHBondContact O-N 2.91Å; L78-Q81 PolarHBondContact O-N 3.48Å; L78-A82 PolarHBondContact O-N 3.31Å; L78-I148 HydrophobicContact CB-CD1 4.38Å; L78-L217 HydrophobicContact CD2-CD2 3.85Å; L78-L217 HydrophobicContact CG-CD2 4.44Å; L78-L218 HydrophobicContact CD2-CD2 4.24Å; L78-V221 HydrophobicContact CD2-CB 4.46Å; L78-V221 HydrophobicContact CD2-CG1 3.76Å; L78-C231 HydrophobicContact CD1-CB 3.81Å; L78-F232 HydrophobicContact CD1-CB 4.34Å
79	A	97.6	Very high	96.2	Very high	0 Å²	0	30 Å²	30	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-63.4	-41.7	176.8	0	0	0	0	0	111.9	T75 Q81 A82 V83 L144 E147 I148	T75-A79 WeakPolarHBondContact O-CB 3.31Å; T75-A79 PolarHBondContact O-N 3.48Å; A79-Q81 VanDerWaalsContact C-N 3.32Å; A79-Q81 PolarHBondContact O-N 3.47Å; A79-A82 WeakPolarHBondContact O-CB 3.28Å; A79-A82 PolarHBondContact O-N 3.34Å; A79-A82 VanDerWaalsContact O-N 3.15Å; A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 3.44Å; A79-L144 HydrophobicContact CB-CB 4.26Å; A79-L144 HydrophobicContact CB-CD2 3.64Å; A79-E147 HydrophobicContact CB-CB 3.93Å; A79-E147 WeakPolarHBondContact CB-OE2 3.31Å; A79-I148 HydrophobicContact CB-CD1 4.47Å; A79-I148 HydrophobicContact CB-CG1 4.03Å
80	S	96.1	Very high	95.8	Very high	66 Å²	66	33.8 Å²	33.8	46%	0.462	23%	0.226	S	C	.	.	H	α-helix	trans	-59.9	-42.6	176.4	-61.7	0	0	0	0	111.9	G76 A77 V83 L84	G76-S80 WeakPolarHBondContact O-CB 3.31Å; G76-S80 PolarHBondContact O-N 2.89Å; G76-S80 PolarHBondContact O-OG 2.99Å; A77-S80 PolarHBondContact O-N 3.35Å; S80-V83 PolarHBondContact O-N 3.49Å; S80-L84 WeakPolarHBondContact O-CG 3.28Å; S80-L84 PolarHBondContact O-N 2.97Å; S80-L84 VanDerWaalsContact O-N 3.1Å
81	Q	95.1	Very high	95.5	Very high	35 Å²	35	34.7 Å²	34.7	16%	0.164	23%	0.234	C	C	.	.	H	α-helix	trans	-61.7	-44.9	174.2	175.3	173.9	66.6	0	0	111.9	A77 L78 A79 V83 L84 I85 L218 T222	A77-Q81 PolarHBondContact O-N 2.92Å; L78-Q81 PolarHBondContact O-N 3.48Å; A79-Q81 VanDerWaalsContact C-N 3.32Å; A79-Q81 PolarHBondContact O-N 3.47Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-V83 PolarHBondContact O-N 2.89Å; Q81-L84 WeakPolarHBondContact O-CB 3.25Å; Q81-L84 PolarHBondContact O-N 2.93Å; Q81-I85 HydrophobicContact CG-CD1 4.2Å; Q81-I85 WeakPolarHBondContact O-CG1 3.41Å; Q81-I85 PolarHBondContact O-N 3.42Å; Q81-L218 HydrophobicContact CB-CD2 4.42Å; Q81-T222 PolarHBondContact NE2-OG1 3.13Å
82	A	96.1	Very high	95.2	Very high	11 Å²	11	40.8 Å²	40.8	9%	0.091	28%	0.277	C	S	.	.	H	α-helix	trans	-59.8	-43.3	177.8	0	0	0	0	0	111.7	L78 A79 L84 I85 G86 I148 P151	L78-A82 PolarHBondContact O-N 3.31Å; A79-A82 WeakPolarHBondContact O-CB 3.28Å; A79-A82 PolarHBondContact O-N 3.34Å; A79-A82 VanDerWaalsContact O-N 3.15Å; A82-L84 VanDerWaalsContact C-N 3.32Å; A82-L84 PolarHBondContact O-N 3.48Å; A82-I85 WeakPolarHBondContact O-CB 3.27Å; A82-I85 PolarHBondContact O-N 3.42Å; A82-G86 PolarHBondContact O-N 3.19Å; A82-I148 HydrophobicContact CB-CG1 4.41Å; A82-P151 HydrophobicContact CB-CG 4.12Å; A82-P151 WeakPolarHBondContact O-CG 3.27Å
83	V	97.1	Very high	95	Very high	8 Å²	8	44 Å²	44	5%	0.048	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-40.1	175.7	175	0	0	0	0	111.7	A79 S80 Q81 I85 G86 V87 E147 L161	A79-V83 WeakPolarHBondContact O-CG2 3.42Å; A79-V83 PolarHBondContact O-N 3.44Å; S80-V83 PolarHBondContact O-N 3.49Å; Q81-V83 VanDerWaalsContact C-N 3.33Å; Q81-V83 PolarHBondContact O-N 2.89Å; V83-I85 VanDerWaalsContact C-N 3.35Å; V83-I85 PolarHBondContact O-N 2.87Å; V83-G86 PolarHBondContact O-N 2.89Å; V83-V87 PolarHBondContact O-N 3.22Å; V83-E147 HydrophobicContact CG2-CB 3.81Å; V83-E147 HydrophobicContact CG2-CG 3.72Å; V83-L161 HydrophobicContact CG1-CD1 4.13Å; V83-L161 HydrophobicContact CG1-CD2 4.18Å; V83-L161 HydrophobicContact CG2-CD1 3.73Å
84	L	95.5	Very high	94.7	Very high	90 Å²	90	44.7 Å²	44.7	47%	0.471	31%	0.307	S	S	.	.	H	α-helix	trans	-62	-41.8	175.5	-69	172.7	0	0	0	112	S80 Q81 A82 G86 V87 V89	S80-L84 WeakPolarHBondContact O-CG 3.28Å; S80-L84 PolarHBondContact O-N 2.97Å; S80-L84 VanDerWaalsContact O-N 3.1Å; Q81-L84 WeakPolarHBondContact O-CB 3.25Å; Q81-L84 PolarHBondContact O-N 2.93Å; A82-L84 VanDerWaalsContact C-N 3.32Å; A82-L84 PolarHBondContact O-N 3.48Å; L84-G86 VanDerWaalsContact C-N 3.34Å; L84-V87 VanDerWaalsContact O-CG2 3.26Å; L84-V87 WeakPolarHBondContact O-CG2 3.3Å; L84-V89 HydrophobicContact CB-CB 4.31Å; L84-V89 HydrophobicContact CB-CG2 4.07Å; L84-V89 HydrophobicContact CD2-CG2 4.02Å; L84-V89 VanDerWaalsContact O-CB 3.26Å; L84-V89 WeakPolarHBondContact O-CB 3.41Å; L84-V89 VanDerWaalsContact O-CG2 3.31Å; L84-V89 WeakPolarHBondContact O-CG2 3.49Å; L84-V89 PolarHBondContact O-N 2.69Å
85	I	93.7	Very high	94.6	Very high	95 Å²	95	48.2 Å²	48.2	49%	0.487	33%	0.329	S	S	.	.	H	α-helix	trans	-61.6	-45.7	173.8	-65.2	167.2	0	0	0	109.9	Q81 A82 V83 V87 G88 P151	Q81-I85 HydrophobicContact CG-CD1 4.2Å; Q81-I85 WeakPolarHBondContact O-CG1 3.41Å; Q81-I85 PolarHBondContact O-N 3.42Å; A82-I85 WeakPolarHBondContact O-CB 3.27Å; A82-I85 PolarHBondContact O-N 3.42Å; V83-I85 VanDerWaalsContact C-N 3.35Å; V83-I85 PolarHBondContact O-N 2.87Å; I85-V87 PolarHBondContact O-N 2.92Å; I85-G88 WeakPolarHBondContact O-CA 3.38Å; I85-G88 PolarHBondContact O-N 3.25Å; I85-P151 HydrophobicContact CG2-CB 4.3Å
86	G	94.4	Very high	94.5	Very high	23 Å²	23	55.2 Å²	55.2	24%	0.237	36%	0.364	C	S	.	.	H	α-helix	trans	-66.3	-32.5	-177	0	0	0	0	0	114.9	A82 V83 L84 G88 F157	A82-G86 PolarHBondContact O-N 3.19Å; V83-G86 PolarHBondContact O-N 2.89Å; L84-G86 VanDerWaalsContact C-N 3.34Å; G86-G88 PolarHBondContact O-N 2.76Å; G86-F157 VanDerWaalsContact C-CE1 3.42Å; G86-F157 VanDerWaalsContact CA-CE2 3.46Å; G86-F157 WeakPolarHBondContact O-CE1 3.47Å
87	V	95.3	Very high	94.4	Very high	24 Å²	24	60.1 Å²	60.1	15%	0.145	39%	0.386	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-4.7	172.2	-60	0	0	0	0	113.2	V83 L84 I85 V89 A99 T102 F157	V83-V87 PolarHBondContact O-N 3.22Å; L84-V87 VanDerWaalsContact O-CG2 3.26Å; L84-V87 WeakPolarHBondContact O-CG2 3.3Å; I85-V87 PolarHBondContact O-N 2.92Å; V87-V89 HydrophobicContact CG2-CG2 3.95Å; V87-A99 HydrophobicContact CB-CB 4.22Å; V87-T102 HydrophobicContact CG1-CG2 4.47Å; V87-F157 HydrophobicContact CG1-CE1 3.82Å; V87-F157 HydrophobicContact CG1-CZ 3.84Å
88	G	93.9	Very high	94.3	Very high	16 Å²	16	62.5 Å²	62.5	17%	0.165	40%	0.401	C	S	.	.	T	Hydrogen-bonded Turn	trans	92	24.2	176.9	0	0	0	0	0	114.9	I85 G86 G90 D91 A94	I85-G88 WeakPolarHBondContact O-CA 3.38Å; I85-G88 PolarHBondContact O-N 3.25Å; G86-G88 PolarHBondContact O-N 2.76Å; G88-G90 PolarHBondContact O-N 2.95Å; G88-G90 VanDerWaalsContact O-N 3.14Å; G88-D91 WeakPolarHBondContact O-CB 3.42Å; G88-D91 PolarHBondContact O-N 3.38Å; G88-A94 WeakPolarHBondContact O-CB 3.4Å
89	V	92.9	Very high	94.2	Very high	96 Å²	96	63.4 Å²	63.4	58%	0.582	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	120.2	172.3	176.1	0	0	0	0	109.5	L84 V87	L84-V89 HydrophobicContact CB-CB 4.31Å; L84-V89 HydrophobicContact CB-CG2 4.07Å; L84-V89 HydrophobicContact CD2-CG2 4.02Å; L84-V89 VanDerWaalsContact O-CB 3.26Å; L84-V89 WeakPolarHBondContact O-CB 3.41Å; L84-V89 VanDerWaalsContact O-CG2 3.31Å; L84-V89 WeakPolarHBondContact O-CG2 3.49Å; L84-V89 PolarHBondContact O-N 2.69Å; V87-V89 HydrophobicContact CG2-CG2 3.95Å
90	G	89	Confident	94.2	Very high	86 Å²	86	66.1 Å²	66.1	89%	0.887	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	94.1	-7	-175.7	0	0	0	0	0	114.5	G88	G88-G90 PolarHBondContact O-N 2.95Å; G88-G90 VanDerWaalsContact O-N 3.14Å
91	D	90.6	Very high	94.2	Very high	81 Å²	81	66.7 Å²	66.7	43%	0.433	43%	0.426	S	S	.	.			trans	-92.1	119.1	173.8	-176.2	-7.2	0	0	0	110.8	G88 S93 A94	G88-D91 WeakPolarHBondContact O-CB 3.42Å; G88-D91 PolarHBondContact O-N 3.38Å; D91-S93 PolarHBondContact O-N 2.64Å; D91-S93 WeakPolarHBondContact OD1-CB 3.33Å; D91-S93 PolarHBondContact OD1-N 2.73Å; D91-S93 PolarHBondContact OD1-OG 2.95Å; D91-S93 PolarHBondContact OD2-OG 3.04Å; D91-S93 VanDerWaalsContact OD2-OG 3.04Å; D91-A94 HydrophobicContact CB-CB 4.07Å; D91-A94 WeakPolarHBondContact O-CB 3.5Å; D91-A94 PolarHBondContact O-N 3.45Å
92	S	92.3	Very high	94.3	Very high	131 Å²	131	65.5 Å²	65.5	92%	0.916	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-19.4	177.7	58.3	0	0	0	0	114.6
93	S	92.2	Very high	94.3	Very high	90 Å²	90	70.2 Å²	70.2	63%	0.629	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.6	-12.6	179.5	74	0	0	0	0	113.4	D91	D91-S93 PolarHBondContact O-N 2.64Å; D91-S93 WeakPolarHBondContact OD1-CB 3.33Å; D91-S93 PolarHBondContact OD1-N 2.73Å; D91-S93 PolarHBondContact OD1-OG 2.95Å; D91-S93 PolarHBondContact OD2-OG 3.04Å; D91-S93 VanDerWaalsContact OD2-OG 3.04Å
94	A	92	Very high	94.3	Very high	43 Å²	43	76.2 Å²	76.2	36%	0.355	47%	0.466	S	S	.	.			trans	-72.2	139.5	179	0	0	0	0	0	111.2	G88 D91	G88-A94 WeakPolarHBondContact O-CB 3.4Å; D91-A94 HydrophobicContact CB-CB 4.07Å; D91-A94 WeakPolarHBondContact O-CB 3.5Å; D91-A94 PolarHBondContact O-N 3.45Å
95	T	94.1	Very high	94.4	Very high	82 Å²	82	78.4 Å²	78.4	50%	0.503	47%	0.472	S	S	.	.			trans	-104.9	140.5	-179.1	65.8	0	0	0	0	111.1	L97 S98 A99	T95-L97 PolarHBondContact O-N 2.92Å; T95-S98 PolarHBondContact O-N 3.15Å; T95-S98 WeakPolarHBondContact OG1-CB 3.5Å; T95-S98 PolarHBondContact OG1-N 2.9Å; T95-A99 PolarHBondContact O-N 3.46Å; T95-A99 VanDerWaalsContact O-N 3.17Å
96	I	94.8	Very high	94.6	Very high	147 Å²	147	74.7 Å²	74.7	75%	0.754	45%	0.452	S	S	*	.	H	α-helix	trans	-55.5	-41.3	173.7	-62.1	172	0	0	0	110.3	S98 A99 S100	I96-S98 PolarHBondContact O-N 3.46Å; I96-A99 PolarHBondContact O-N 3.35Å; I96-S100 PolarHBondContact O-N 3.49Å; I96-S100 PolarHBondContact O-OG 3.34Å; I96-S100 VanDerWaalsContact O-OG 3.06Å
97	L	96.1	Very high	94.8	Very high	119 Å²	119	76.6 Å²	76.6	62%	0.623	46%	0.457	S	S	*	.	H	α-helix	trans	-60.8	-45.6	179	-179.9	63.3	0	0	0	112.6	T95 A99 S100 L101	T95-L97 PolarHBondContact O-N 2.92Å; L97-A99 VanDerWaalsContact C-N 3.34Å; L97-A99 PolarHBondContact O-N 3.23Å; L97-S100 PolarHBondContact O-N 3.35Å; L97-L101 HydrophobicContact CD1-CD1 4.23Å; L97-L101 HydrophobicContact CD1-CG 4.21Å; L97-L101 HydrophobicContact CG-CD1 4.13Å; L97-L101 HydrophobicContact CG-CG 4.5Å; L97-L101 WeakPolarHBondContact O-CG 3.43Å; L97-L101 PolarHBondContact O-N 3.08Å
98	S	94	Very high	94.9	Very high	66 Å²	66	76.8 Å²	76.8	46%	0.462	46%	0.464	S	S	.	.	H	α-helix	trans	-62.1	-42.8	178.1	-176.8	0	0	0	0	111.6	T95 I96 L101 T102	T95-S98 PolarHBondContact O-N 3.15Å; T95-S98 WeakPolarHBondContact OG1-CB 3.5Å; T95-S98 PolarHBondContact OG1-N 2.9Å; I96-S98 PolarHBondContact O-N 3.46Å; S98-L101 PolarHBondContact O-N 3.31Å; S98-T102 WeakPolarHBondContact O-CB 3.43Å; S98-T102 PolarHBondContact O-N 2.88Å; S98-T102 PolarHBondContact O-OG1 3.21Å
99	A	95.3	Very high	95.1	Very high	23 Å²	23	77.2 Å²	77.2	19%	0.19	46%	0.464	C	S	.	.	H	α-helix	trans	-61.6	-47.8	175.1	0	0	0	0	0	111.3	V87 T95 I96 L97 L101 T102 W103	V87-A99 HydrophobicContact CB-CB 4.22Å; T95-A99 PolarHBondContact O-N 3.46Å; T95-A99 VanDerWaalsContact O-N 3.17Å; I96-A99 PolarHBondContact O-N 3.35Å; L97-A99 VanDerWaalsContact C-N 3.34Å; L97-A99 PolarHBondContact O-N 3.23Å; A99-L101 PolarHBondContact O-N 2.91Å; A99-T102 PolarHBondContact O-N 3.49Å; A99-W103 VanDerWaalsContact O-CD1 3.31Å; A99-W103 PolarHBondContact O-N 2.85Å
100	S	97.4	Very high	95.3	Very high	57 Å²	57	72.8 Å²	72.8	40%	0.399	44%	0.438	S	S	.	.	H	α-helix	trans	-59.9	-45.3	177.6	-62.5	0	0	0	0	112.7	I96 L97 T102 W103 M104	I96-S100 PolarHBondContact O-N 3.49Å; I96-S100 PolarHBondContact O-OG 3.34Å; I96-S100 VanDerWaalsContact O-OG 3.06Å; L97-S100 PolarHBondContact O-N 3.35Å; S100-T102 PolarHBondContact O-N 3.36Å; S100-W103 PolarHBondContact O-N 3.19Å; S100-M104 WeakPolarHBondContact O-CG 3.43Å; S100-M104 PolarHBondContact O-N 2.93Å
101	L	97.2	Very high	95.8	Very high	78 Å²	78	74.6 Å²	74.6	41%	0.408	43%	0.425	S	S	.	.	H	α-helix	trans	-63.6	-41.5	177.2	-72.1	174.5	0	0	0	111.6	L97 S98 A99 W103 M104 F105	L97-L101 HydrophobicContact CD1-CD1 4.23Å; L97-L101 HydrophobicContact CD1-CG 4.21Å; L97-L101 HydrophobicContact CG-CD1 4.13Å; L97-L101 HydrophobicContact CG-CG 4.5Å; L97-L101 WeakPolarHBondContact O-CG 3.43Å; L97-L101 PolarHBondContact O-N 3.08Å; S98-L101 PolarHBondContact O-N 3.31Å; A99-L101 PolarHBondContact O-N 2.91Å; L101-W103 VanDerWaalsContact C-N 3.32Å; L101-W103 PolarHBondContact O-N 2.84Å; L101-M104 PolarHBondContact O-N 3.05Å; L101-F105 HydrophobicContact CB-CE2 4.49Å; L101-F105 WeakPolarHBondContact O-CD2 3.34Å; L101-F105 PolarHBondContact O-N 3.24Å
102	T	96.6	Very high	96.1	Very high	10 Å²	10	75.8 Å²	75.8	6%	0.061	43%	0.43	C	S	.	.	H	α-helix	trans	-59.3	-43	176	-66.1	0	0	0	0	111.7	V87 S98 A99 S100 F105 K106 F157 T158 L161	V87-T102 HydrophobicContact CG1-CG2 4.47Å; S98-T102 WeakPolarHBondContact O-CB 3.43Å; S98-T102 PolarHBondContact O-N 2.88Å; S98-T102 PolarHBondContact O-OG1 3.21Å; A99-T102 PolarHBondContact O-N 3.49Å; S100-T102 PolarHBondContact O-N 3.36Å; T102-F105 PolarHBondContact O-N 3.49Å; T102-K106 VanDerWaalsContact O-CB 3.25Å; T102-K106 WeakPolarHBondContact O-CB 3.35Å; T102-K106 PolarHBondContact O-N 3.41Å; T102-F157 HydrophobicContact CG2-CD1 4.37Å; T102-F157 HydrophobicContact CG2-CE1 3.82Å; T102-T158 HydrophobicContact CG2-CG2 4.14Å; T102-T158 PolarHBondContact OG1-OG1 3.42Å; T102-L161 HydrophobicContact CG2-CD2 3.76Å
103	W	96.2	Very high	96.4	Very high	109 Å²	109	70 Å²	70	41%	0.413	39%	0.392	S	S	.	.	H	α-helix	trans	-62.8	-44.9	173.5	-87.4	97	0	0	0	112.6	A99 S100 L101 F105 K106 D107	A99-W103 VanDerWaalsContact O-CD1 3.31Å; A99-W103 PolarHBondContact O-N 2.85Å; S100-W103 PolarHBondContact O-N 3.19Å; L101-W103 VanDerWaalsContact C-N 3.32Å; L101-W103 PolarHBondContact O-N 2.84Å; W103-F105 PolarHBondContact O-N 3.41Å; W103-K106 HydrophobicContact CE3-CD 4.11Å; W103-K106 HydrophobicContact CZ3-CD 4.29Å; W103-K106 PolarHBondContact O-N 3.2Å; W103-D107 WeakPolarHBondContact O-CB 3.32Å; W103-D107 PolarHBondContact O-N 2.75Å
104	M	97.8	Very high	96.6	Very high	135 Å²	135	72.3 Å²	72.3	67%	0.665	39%	0.387	S	S	*	.	H	α-helix	trans	-61.5	-43	177.7	-70.7	-179.9	71.1	0	0	112.5	S100 L101 G108	S100-M104 WeakPolarHBondContact O-CG 3.43Å; S100-M104 PolarHBondContact O-N 2.93Å; L101-M104 PolarHBondContact O-N 3.05Å; M104-G108 PolarHBondContact O-N 3.24Å
105	F	97.6	Very high	96.8	Very high	135 Å²	135	76.3 Å²	76.3	59%	0.592	40%	0.401	S	S	*	.	H	α-helix	trans	-65.5	-45.5	176.6	-79.8	-62.7	0	0	0	111.9	L101 T102 W103 D107 G108 S109 T158	L101-F105 HydrophobicContact CB-CE2 4.49Å; L101-F105 WeakPolarHBondContact O-CD2 3.34Å; L101-F105 PolarHBondContact O-N 3.24Å; T102-F105 PolarHBondContact O-N 3.49Å; W103-F105 PolarHBondContact O-N 3.41Å; F105-D107 PolarHBondContact O-N 2.67Å; F105-G108 PolarHBondContact O-N 2.86Å; F105-S109 WeakPolarHBondContact O-CB 3.4Å; F105-S109 PolarHBondContact O-N 3.47Å; F105-S109 PolarHBondContact O-OG 2.91Å; F105-T158 HydrophobicContact CB-CG2 4.33Å
106	K	97.3	Very high	96.9	Very high	18 Å²	18	77 Å²	77	8%	0.078	40%	0.4	C	S	.	.	H	α-helix	trans	-55.4	-51.5	175	173.5	-157.2	172.4	-162.7	0	110.9	T102 W103 S109 G110 L161 N165	T102-K106 VanDerWaalsContact O-CB 3.25Å; T102-K106 WeakPolarHBondContact O-CB 3.35Å; T102-K106 PolarHBondContact O-N 3.41Å; W103-K106 HydrophobicContact CE3-CD 4.11Å; W103-K106 HydrophobicContact CZ3-CD 4.29Å; W103-K106 PolarHBondContact O-N 3.2Å; K106-S109 PolarHBondContact O-OG 2.95Å; K106-G110 PolarHBondContact O-N 3.26Å; K106-L161 HydrophobicContact CB-CD2 4.41Å; K106-L161 HydrophobicContact CB-CG 4.26Å; K106-L161 HydrophobicContact CD-CD1 4.17Å; K106-L161 HydrophobicContact CD-CD2 3.99Å; K106-L161 HydrophobicContact CD-CG 3.82Å; K106-L161 HydrophobicContact CG-CD2 4.38Å; K106-L161 HydrophobicContact CG-CG 3.9Å; K106-N165 HydrophobicContact CD-CB 4.36Å; K106-N165 WeakPolarHBondContact CE-OD1 3.45Å; K106-N165 HydrophobicContact CG-CB 3.46Å; K106-N165 VanDerWaalsContact CG-CB 3.46Å; K106-N165 PolarHBondContact O-ND2 2.97Å
107	D	97.2	Very high	96.9	Very high	63 Å²	63	70.6 Å²	70.6	34%	0.337	37%	0.367	S	S	.	.	H	α-helix	trans	-68.8	-41.9	-176.5	-70	-16	0	0	0	111.2	W103 F105 S109 G110 M111	W103-D107 WeakPolarHBondContact O-CB 3.32Å; W103-D107 PolarHBondContact O-N 2.75Å; F105-D107 PolarHBondContact O-N 2.67Å; D107-S109 PolarHBondContact O-N 3.26Å; D107-G110 PolarHBondContact O-N 3.08Å; D107-M111 WeakPolarHBondContact O-CG 3.45Å; D107-M111 PolarHBondContact O-N 3.4Å
108	G	98.1	Very high	96.8	Very high	28 Å²	28	67.1 Å²	67.1	29%	0.289	36%	0.355	S	S	.	.	H	α-helix	trans	-59.6	-43.8	175.3	0	0	0	0	0	113.3	M104 F105 G110 M111 I112	M104-G108 PolarHBondContact O-N 3.24Å; F105-G108 PolarHBondContact O-N 2.86Å; G108-G110 VanDerWaalsContact C-N 3.35Å; G108-G110 PolarHBondContact O-N 3.37Å; G108-M111 PolarHBondContact O-N 3.5Å; G108-I112 WeakPolarHBondContact O-CG1 3.46Å; G108-I112 PolarHBondContact O-N 3.35Å; G108-I112 VanDerWaalsContact O-N 3.13Å
109	S	98.1	Very high	96.7	Very high	25 Å²	25	67.2 Å²	67.2	18%	0.175	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-41.9	176.7	70.5	0	0	0	0	111.6	F105 K106 D107 I112 G113 C162 V166	F105-S109 WeakPolarHBondContact O-CB 3.4Å; F105-S109 PolarHBondContact O-N 3.47Å; F105-S109 PolarHBondContact O-OG 2.91Å; K106-S109 PolarHBondContact O-OG 2.95Å; D107-S109 PolarHBondContact O-N 3.26Å; S109-I112 PolarHBondContact O-N 3.02Å; S109-G113 PolarHBondContact O-N 2.94Å; S109-C162 WeakPolarHBondContact OG-CA 3.44Å; S109-C162 WeakPolarHBondContact OG-CB 3.4Å; S109-C162 PolarHBondContact OG-O 2.97Å; S109-V166 WeakPolarHBondContact O-CG2 3.42Å
110	G	98.1	Very high	96.4	Very high	3 Å²	3	75.1 Å²	75.1	3%	0.031	39%	0.393	C	S	.	.	H	α-helix	trans	-61.6	-41.6	175.1	0	0	0	0	0	112.9	K106 D107 G108 I112 G113 R114 S169	K106-G110 PolarHBondContact O-N 3.26Å; D107-G110 PolarHBondContact O-N 3.08Å; G108-G110 VanDerWaalsContact C-N 3.35Å; G108-G110 PolarHBondContact O-N 3.37Å; G110-I112 PolarHBondContact O-N 2.59Å; G110-G113 PolarHBondContact O-N 3.39Å; G110-R114 WeakPolarHBondContact O-CB 3.47Å; G110-R114 PolarHBondContact O-N 3.05Å; G110-S169 WeakPolarHBondContact O-CB 3.36Å; G110-S169 PolarHBondContact O-OG 2.72Å
111	M	98.2	Very high	95.9	Very high	123 Å²	123	75.2 Å²	75.2	61%	0.606	39%	0.387	S	S	*	.	H	α-helix	trans	-62	-43.8	176.3	-69	175.2	-170.6	0	0	112	D107 G108 R114 I115	D107-M111 WeakPolarHBondContact O-CG 3.45Å; D107-M111 PolarHBondContact O-N 3.4Å; G108-M111 PolarHBondContact O-N 3.5Å; M111-R114 WeakPolarHBondContact O-CB 3.38Å; M111-R114 PolarHBondContact O-N 2.94Å; M111-I115 WeakPolarHBondContact O-CG1 3.35Å; M111-I115 PolarHBondContact O-N 3.3Å
112	I	98	Very high	95.2	Very high	106 Å²	106	73 Å²	73	54%	0.544	38%	0.383	S	S	.	.	H	α-helix	trans	-63.7	-47.6	176.8	-65.5	166.4	0	0	0	110.6	G108 S109 G110 R114 I115 I116	G108-I112 WeakPolarHBondContact O-CG1 3.46Å; G108-I112 PolarHBondContact O-N 3.35Å; G108-I112 VanDerWaalsContact O-N 3.13Å; S109-I112 PolarHBondContact O-N 3.02Å; G110-I112 PolarHBondContact O-N 2.59Å; I112-R114 VanDerWaalsContact C-N 3.31Å; I112-R114 PolarHBondContact O-N 2.97Å; I112-I115 PolarHBondContact O-N 3.18Å; I112-I116 HydrophobicContact CG2-CD1 3.72Å; I112-I116 HydrophobicContact CG2-CG1 4.42Å; I112-I116 WeakPolarHBondContact O-CG1 3.4Å; I112-I116 PolarHBondContact O-N 2.96Å; I112-I116 VanDerWaalsContact O-N 3.08Å
113	G	97.4	Very high	94.2	Very high	11 Å²	11	77.2 Å²	77.2	11%	0.113	40%	0.404	C	S	.	.	H	α-helix	trans	-56.5	-44.2	178.4	0	0	0	0	0	112.5	S109 G110 I115 I116 F117	S109-G113 PolarHBondContact O-N 2.94Å; G110-G113 PolarHBondContact O-N 3.39Å; G113-I115 PolarHBondContact O-N 2.99Å; G113-I116 PolarHBondContact O-N 2.91Å; G113-F117 VanDerWaalsContact O-CB 3.28Å; G113-F117 WeakPolarHBondContact O-CB 3.35Å; G113-F117 PolarHBondContact O-N 3.44Å
114	R	96.4	Very high	93.4	Very high	138 Å²	138	77.4 Å²	77.4	52%	0.521	41%	0.408	S	S	.	.	H	α-helix	trans	-56.1	-50.2	176	-171	-179.4	-67.1	-159.3	-0.2	112.6	G110 M111 I112 F117 A118 S169 V173	G110-R114 WeakPolarHBondContact O-CB 3.47Å; G110-R114 PolarHBondContact O-N 3.05Å; M111-R114 WeakPolarHBondContact O-CB 3.38Å; M111-R114 PolarHBondContact O-N 2.94Å; I112-R114 VanDerWaalsContact C-N 3.31Å; I112-R114 PolarHBondContact O-N 2.97Å; R114-F117 PolarHBondContact O-N 3.24Å; R114-A118 WeakPolarHBondContact O-CB 3.46Å; R114-A118 PolarHBondContact O-N 3.28Å; R114-S169 PolarHBondContact N-OG 3.28Å; R114-V173 HydrophobicContact CG-CG2 3.46Å; R114-V173 VanDerWaalsContact CG-CG2 3.46Å
115	I	96.8	Very high	92.5	Very high	127 Å²	127	71.3 Å²	71.3	65%	0.651	38%	0.378	S	S	*	.	H	α-helix	trans	-64.7	-48	-176.6	-67.2	167.2	0	0	0	110.4	M111 I112 G113 F117 A118 G119	M111-I115 WeakPolarHBondContact O-CG1 3.35Å; M111-I115 PolarHBondContact O-N 3.3Å; I112-I115 PolarHBondContact O-N 3.18Å; G113-I115 PolarHBondContact O-N 2.99Å; I115-F117 PolarHBondContact O-N 3.24Å; I115-A118 PolarHBondContact O-N 3.26Å; I115-G119 PolarHBondContact O-N 3.15Å
116	I	96.5	Very high	91.4	Very high	95 Å²	95	68.7 Å²	68.7	49%	0.487	37%	0.37	S	S	.	.	H	α-helix	trans	-61	-47.7	179.2	-67.5	174.7	0	0	0	110.1	I112 G113 G119 Y120	I112-I116 HydrophobicContact CG2-CD1 3.72Å; I112-I116 HydrophobicContact CG2-CG1 4.42Å; I112-I116 WeakPolarHBondContact O-CG1 3.4Å; I112-I116 PolarHBondContact O-N 2.96Å; I112-I116 VanDerWaalsContact O-N 3.08Å; G113-I116 PolarHBondContact O-N 2.91Å; I116-G119 PolarHBondContact O-N 3.36Å; I116-Y120 HydrophobicContact CG2-CD2 3.81Å; I116-Y120 HydrophobicContact CG2-CE2 4Å; I116-Y120 VanDerWaalsContact O-CD2 3.31Å; I116-Y120 WeakPolarHBondContact O-CD2 3.25Å; I116-Y120 PolarHBondContact O-N 2.89Å; I116-Y120 VanDerWaalsContact O-N 3.12Å
117	F	95.2	Very high	90.7	Very high	14 Å²	14	68.3 Å²	68.3	6%	0.061	37%	0.369	C	S	.	.	H	α-helix	trans	-62.3	-47.1	-178.4	-178.9	-105.2	0	0	0	112.2	G113 R114 I115 G119 Y120 H121 L125 W132 L170 V173 A174	G113-F117 VanDerWaalsContact O-CB 3.28Å; G113-F117 WeakPolarHBondContact O-CB 3.35Å; G113-F117 PolarHBondContact O-N 3.44Å; R114-F117 PolarHBondContact O-N 3.24Å; I115-F117 PolarHBondContact O-N 3.24Å; F117-G119 VanDerWaalsContact C-N 3.3Å; F117-G119 PolarHBondContact O-N 3.43Å; F117-Y120 PolarHBondContact O-N 2.91Å; F117-H121 HydrophobicContact CD2-CB 4.09Å; F117-H121 AromaticContact CD2-CG 3.85Å; F117-H121 AromaticContact CD2-ND1 3.46Å; F117-H121 WeakPolarHBondContact CD2-ND1 3.4Å; F117-H121 HydrophobicContact CE1-CB 4.37Å; F117-H121 HydrophobicContact CE2-CB 3.71Å; F117-H121 AromaticContact CE2-CG 3.53Å; F117-H121 AromaticContact CE2-ND1 3.61Å; F117-H121 HydrophobicContact CZ-CB 3.87Å; F117-H121 WeakPolarHBondContact O-CB 3.46Å; F117-H121 PolarHBondContact O-N 3.46Å; F117-L125 HydrophobicContact CE1-CD1 4.3Å; F117-L125 HydrophobicContact CE1-CD2 4.13Å; F117-L125 HydrophobicContact CZ-CD2 4.08Å; F117-W132 AromaticContact CE2-CH2 3.91Å; F117-W132 HydrophobicContact CE2-CH2 3.91Å; F117-W132 AromaticContact CE2-CZ3 3.84Å; F117-W132 HydrophobicContact CE2-CZ3 3.84Å; F117-W132 HydrophobicContact CZ-CE3 4.13Å; F117-W132 AromaticContact CZ-CH2 3.91Å; F117-W132 HydrophobicContact CZ-CH2 3.91Å; F117-W132 AromaticContact CZ-CZ3 3.54Å; F117-W132 HydrophobicContact CZ-CZ3 3.54Å; F117-L170 HydrophobicContact CB-CD2 4.1Å; F117-L170 HydrophobicContact CB-CG 4.05Å; F117-L170 HydrophobicContact CD1-CB 4.35Å; F117-L170 HydrophobicContact CD1-CD2 4.46Å; F117-L170 HydrophobicContact CD1-CG 4.39Å; F117-L170 HydrophobicContact CD2-CD2 3.32Å; F117-L170 HydrophobicContact CD2-CG 4.06Å; F117-L170 HydrophobicContact CE2-CD2 3.77Å; F117-L170 HydrophobicContact CG-CB 4.34Å; F117-L170 HydrophobicContact CG-CD2 3.7Å; F117-L170 HydrophobicContact CG-CG 3.9Å; F117-L170 HydrophobicContact CZ-CD2 4.5Å; F117-V173 HydrophobicContact CD1-CB 3.87Å; F117-V173 HydrophobicContact CD1-CG1 3.9Å; F117-V173 HydrophobicContact CD1-CG2 4.41Å; F117-V173 HydrophobicContact CE1-CB 4.13Å; F117-V173 HydrophobicContact CE1-CG1 4.07Å; F117-A174 HydrophobicContact CE1-CB 4.22Å; F117-A174 HydrophobicContact CZ-CB 4.47Å
118	A	93.2	Very high	90.4	Very high	45 Å²	45	67.9 Å²	67.9	37%	0.372	37%	0.367	S	S	.	.	H	α-helix	trans	-58.2	-42.1	177	0	0	0	0	0	111.9	R114 I115 G122 V173	R114-A118 WeakPolarHBondContact O-CB 3.46Å; R114-A118 PolarHBondContact O-N 3.28Å; I115-A118 PolarHBondContact O-N 3.26Å; A118-G122 WeakPolarHBondContact O-CA 3.16Å; A118-G122 PolarHBondContact O-N 3.11Å; A118-G122 VanDerWaalsContact O-N 3.07Å; A118-V173 HydrophobicContact CB-CG1 4.35Å
119	G	91.8	Very high	90.1	Very high	69 Å²	69	66.7 Å²	66.7	71%	0.711	36%	0.355	S	S	*	.	H	α-helix	trans	-63.7	-40.2	178.5	0	0	0	0	0	114.3	I115 I116 F117	I115-G119 PolarHBondContact O-N 3.15Å; I116-G119 PolarHBondContact O-N 3.36Å; F117-G119 VanDerWaalsContact C-N 3.3Å; F117-G119 PolarHBondContact O-N 3.43Å
120	Y	89.1	Confident	89.9	Confident	188 Å²	188	65.8 Å²	65.8	74%	0.737	35%	0.347	S	S	*	.	H	α-helix	trans	-89.6	-28	-177.2	-77.2	-72.8	0	0	0	114.7	I116 F117	I116-Y120 HydrophobicContact CG2-CD2 3.81Å; I116-Y120 HydrophobicContact CG2-CE2 4Å; I116-Y120 VanDerWaalsContact O-CD2 3.31Å; I116-Y120 WeakPolarHBondContact O-CD2 3.25Å; I116-Y120 PolarHBondContact O-N 2.89Å; I116-Y120 VanDerWaalsContact O-N 3.12Å; F117-Y120 PolarHBondContact O-N 2.91Å
121	H	88	Confident	89.8	Confident	60 Å²	60	69 Å²	69	28%	0.278	36%	0.361	S	S	.	.	H	α-helix	trans	-115.5	-9.8	-169.9	-65.2	85.1	0	0	0	114.6	F117 I123 K124 L125 W132	F117-H121 HydrophobicContact CD2-CB 4.09Å; F117-H121 AromaticContact CD2-CG 3.85Å; F117-H121 AromaticContact CD2-ND1 3.46Å; F117-H121 WeakPolarHBondContact CD2-ND1 3.4Å; F117-H121 HydrophobicContact CE1-CB 4.37Å; F117-H121 HydrophobicContact CE2-CB 3.71Å; F117-H121 AromaticContact CE2-CG 3.53Å; F117-H121 AromaticContact CE2-ND1 3.61Å; F117-H121 HydrophobicContact CZ-CB 3.87Å; F117-H121 WeakPolarHBondContact O-CB 3.46Å; F117-H121 PolarHBondContact O-N 3.46Å; H121-I123 VanDerWaalsContact C-N 3.34Å; H121-I123 PolarHBondContact O-N 3.35Å; H121-I123 VanDerWaalsContact O-N 3.15Å; H121-K124 PolarHBondContact O-N 3.23Å; H121-L125 PolarHBondContact O-N 2.75Å; H121-W132 AromaticContact CD2-CH2 3.65Å; H121-W132 AromaticContact CD2-CZ2 3.77Å
122	G	81.9	Confident	89.6	Confident	31 Å²	31	64.4 Å²	64.4	32%	0.32	34%	0.337	S	S	.	.	H	α-helix	trans	-47	-49.2	-173.7	0	0	0	0	0	114.8	A118 K124 L125	A118-G122 WeakPolarHBondContact O-CA 3.16Å; A118-G122 PolarHBondContact O-N 3.11Å; A118-G122 VanDerWaalsContact O-N 3.07Å; G122-K124 VanDerWaalsContact C-N 3.26Å; G122-K124 PolarHBondContact O-N 3Å; G122-L125 PolarHBondContact O-N 3.03Å
123	I	76.1	Confident	89.4	Confident	99 Å²	99	60.4 Å²	60.4	51%	0.508	32%	0.315	S	S	.	.	H	α-helix	trans	-61.8	-32.5	-179	-60.4	171.9	0	0	0	112.6	H121 C127 A457	H121-I123 VanDerWaalsContact C-N 3.34Å; H121-I123 PolarHBondContact O-N 3.35Å; H121-I123 VanDerWaalsContact O-N 3.15Å; I123-C127 PolarHBondContact O-SG 2.96Å; I123-C127 VanDerWaalsContact O-SG 3.35Å; I123-A457 HydrophobicContact CG2-CB 4.34Å
124	K	79.3	Confident	89.4	Confident	113 Å²	113	60.7 Å²	60.7	49%	0.491	31%	0.313	S	S	.	.	H	α-helix	trans	-83	-18.9	-175.9	-65.6	-180	-178.4	171.6	0	113	H121 G122 D126 C127 D128 W132	H121-K124 PolarHBondContact O-N 3.23Å; G122-K124 VanDerWaalsContact C-N 3.26Å; G122-K124 PolarHBondContact O-N 3Å; K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.41Å; K124-C127 PolarHBondContact O-N 2.93Å; K124-D128 PolarHBondContact O-N 3.34Å; K124-W132 PolarHBondContact O-NE1 3.48Å
125	L	79.3	Confident	89.3	Confident	6 Å²	6	55.5 Å²	55.5	3%	0.031	30%	0.296	C	S	.	.	H	α-helix	trans	-63.7	-40.9	-177.8	-65.8	176.8	0	0	0	111.5	F117 H121 G122 W132 V173 A174 A177	F117-L125 HydrophobicContact CE1-CD1 4.3Å; F117-L125 HydrophobicContact CE1-CD2 4.13Å; F117-L125 HydrophobicContact CZ-CD2 4.08Å; H121-L125 PolarHBondContact O-N 2.75Å; G122-L125 PolarHBondContact O-N 3.03Å; L125-W132 HydrophobicContact CD2-CB 4.16Å; L125-W132 HydrophobicContact CD2-CD2 3.57Å; L125-W132 HydrophobicContact CD2-CE3 3.91Å; L125-W132 HydrophobicContact CD2-CG 3.68Å; L125-V173 HydrophobicContact CD1-CG1 3.83Å; L125-A174 HydrophobicContact CD2-CB 4.03Å; L125-A177 HydrophobicContact CB-CB 4.05Å; L125-A177 HydrophobicContact CD1-CB 3.96Å
126	D	74.5	Confident	89.3	Confident	81 Å²	81	49.4 Å²	49.4	43%	0.433	27%	0.265	S	S	.	.	H	α-helix	trans	-68.9	-38.3	176.7	-68.6	-26.3	0	0	0	112.1	K124 Q455	K124-D126 VanDerWaalsContact C-N 3.34Å; K124-D126 PolarHBondContact O-N 3.41Å; D126-Q455 VanDerWaalsContact O-CD 3.28Å; D126-Q455 PolarHBondContact O-NE2 3.1Å; D126-Q455 PolarHBondContact O-OE1 3.46Å; D126-Q455 VanDerWaalsContact O-OE1 3.12Å
127	C	82.6	Confident	89.3	Confident	9 Å²	9	45.3 Å²	45.3	6%	0.061	24%	0.244	C	C	.	.	H	α-helix	trans	-72.1	-40	-170.6	-59.8	0	0	0	0	113.1	I123 K124 N256 Q455 A457	I123-C127 PolarHBondContact O-SG 2.96Å; I123-C127 VanDerWaalsContact O-SG 3.35Å; K124-C127 PolarHBondContact O-N 2.93Å; C127-N256 WeakPolarHBondContact O-CB 3.44Å; C127-N256 PolarHBondContact O-ND2 3.34Å; C127-Q455 HydrophobicContact CB-CB 4.38Å; C127-Q455 PolarHBondContact SG-O 3.39Å; C127-A457 HydrophobicContact CB-CB 4.37Å; C127-A457 VanDerWaalsContact SG-CB 3.56Å; C127-A457 PolarHBondContact SG-N 2.78Å
128	D	89.7	Confident	89.4	Confident	54 Å²	54	47.7 Å²	47.7	29%	0.289	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-115.2	50.3	-176.4	-61.5	-44.1	0	0	0	110.6	K124 K130 F131 W132	K124-D128 PolarHBondContact O-N 3.34Å; D128-K130 PolarHBondContact O-N 3.28Å; D128-F131 HydrophobicContact CB-CB 4.15Å; D128-F131 HydrophobicContact CB-CD1 4.39Å; D128-F131 WeakPolarHBondContact O-CB 3.31Å; D128-F131 PolarHBondContact O-N 3.33Å; D128-F131 VanDerWaalsContact O-N 3.12Å; D128-W132 PolarHBondContact O-N 3.22Å
129	C	92	Very high	89.6	Confident	4 Å²	4	47.2 Å²	47.2	3%	0.027	25%	0.248	C	C	.	.	H	α-helix	trans	-50	-51.4	-172.8	178.1	0	0	0	0	113.7	F131 W132 R133 T178 L252	C129-F131 PolarHBondContact O-N 3.42Å; C129-W132 PolarHBondContact O-N 3.35Å; C129-R133 WeakPolarHBondContact O-CB 2.9Å; C129-R133 PolarHBondContact O-N 3.24Å; C129-T178 WeakPolarHBondContact O-CG2 3.38Å; C129-L252 HydrophobicContact CB-CD1 4.5Å
130	K	95	Very high	89.9	Confident	5 Å²	5	45 Å²	45	2%	0.022	22%	0.22	C	C	.	.	H	α-helix	trans	-59.4	-44.6	178.9	-69.8	-178	-179.3	163.3	0	112.5	D128 F134 V247 L250 L252 N308 E311	D128-K130 PolarHBondContact O-N 3.28Å; K130-F134 WeakPolarHBondContact O-CB 3.49Å; K130-F134 PolarHBondContact O-N 3.44Å; K130-F134 VanDerWaalsContact O-N 3.16Å; K130-V247 HydrophobicContact CB-CB 4.3Å; K130-V247 VanDerWaalsContact CD-O 3.32Å; K130-V247 WeakPolarHBondContact CD-O 3.27Å; K130-V247 WeakPolarHBondContact CE-O 3.19Å; K130-V247 HydrophobicContact CG-CB 4.32Å; K130-L250 VanDerWaalsContact CE-O 3.31Å; K130-L250 WeakPolarHBondContact CE-O 3.33Å; K130-L250 PolarHBondContact NZ-O 3.16Å; K130-L252 HydrophobicContact CG-CD1 4.23Å; K130-N308 PolarHBondContact NZ-OD1 2.92Å; K130-E311 WeakPolarHBondContact CD-OE2 3.4Å; K130-E311 WeakPolarHBondContact CE-OE2 3.1Å; K130-E311 IonicContact NZ-OE2 3.78Å; K130-E311 PolarHBondContact NZ-OE2 2.9Å
131	F	94.6	Very high	90.3	Very high	72 Å²	72	36.5 Å²	36.5	32%	0.316	19%	0.187	S	C	.	.	H	α-helix	trans	-63.7	-50.3	178.5	168.5	-102.3	0	0	0	110.8	D128 C129 R133 F134 V135 I313	D128-F131 HydrophobicContact CB-CB 4.15Å; D128-F131 HydrophobicContact CB-CD1 4.39Å; D128-F131 WeakPolarHBondContact O-CB 3.31Å; D128-F131 PolarHBondContact O-N 3.33Å; D128-F131 VanDerWaalsContact O-N 3.12Å; C129-F131 PolarHBondContact O-N 3.42Å; F131-R133 VanDerWaalsContact C-N 3.34Å; F131-R133 PolarHBondContact O-N 3.26Å; F131-F134 PolarHBondContact O-N 2.93Å; F131-V135 HydrophobicContact CD1-CG2 4.25Å; F131-V135 HydrophobicContact CD2-CG2 3.94Å; F131-V135 HydrophobicContact CE1-CG2 3.89Å; F131-V135 HydrophobicContact CE2-CG2 3.57Å; F131-V135 HydrophobicContact CG-CG2 4.29Å; F131-V135 HydrophobicContact CZ-CG2 3.55Å; F131-V135 WeakPolarHBondContact O-CB 3.38Å; F131-V135 VanDerWaalsContact O-CG2 3.3Å; F131-V135 WeakPolarHBondContact O-CG2 3.41Å; F131-V135 PolarHBondContact O-N 3.14Å; F131-I313 WeakPolarHBondContact CB-O 3.37Å; F131-I313 VanDerWaalsContact CD2-O 3.23Å; F131-I313 WeakPolarHBondContact CD2-O 3.41Å
132	W	94.2	Very high	90.9	Very high	26 Å²	26	36.4 Å²	36.4	10%	0.098	19%	0.192	C	C	.	.	H	α-helix	trans	-67.2	-33.1	-178.2	-79.4	112.4	0	0	0	113.2	F117 H121 K124 L125 D128 C129 V135 A136 A174 T178	F117-W132 AromaticContact CE2-CH2 3.91Å; F117-W132 HydrophobicContact CE2-CH2 3.91Å; F117-W132 AromaticContact CE2-CZ3 3.84Å; F117-W132 HydrophobicContact CE2-CZ3 3.84Å; F117-W132 HydrophobicContact CZ-CE3 4.13Å; F117-W132 AromaticContact CZ-CH2 3.91Å; F117-W132 HydrophobicContact CZ-CH2 3.91Å; F117-W132 AromaticContact CZ-CZ3 3.54Å; F117-W132 HydrophobicContact CZ-CZ3 3.54Å; H121-W132 AromaticContact CD2-CH2 3.65Å; H121-W132 AromaticContact CD2-CZ2 3.77Å; K124-W132 PolarHBondContact O-NE1 3.48Å; L125-W132 HydrophobicContact CD2-CB 4.16Å; L125-W132 HydrophobicContact CD2-CD2 3.57Å; L125-W132 HydrophobicContact CD2-CE3 3.91Å; L125-W132 HydrophobicContact CD2-CG 3.68Å; D128-W132 PolarHBondContact O-N 3.22Å; C129-W132 PolarHBondContact O-N 3.35Å; W132-V135 HydrophobicContact CE3-CB 4.41Å; W132-V135 HydrophobicContact CE3-CG1 4.17Å; W132-V135 HydrophobicContact CZ3-CG1 4.18Å; W132-V135 PolarHBondContact O-N 3.32Å; W132-A136 VanDerWaalsContact O-CB 3.28Å; W132-A136 WeakPolarHBondContact O-CB 3.15Å; W132-A136 PolarHBondContact O-N 3.01Å; W132-A174 HydrophobicContact CE3-CB 4.42Å; W132-T178 HydrophobicContact CB-CG2 3.68Å
133	R	95	Very high	91.7	Very high	22 Å²	22	34.9 Å²	34.9	8%	0.083	18%	0.177	C	C	.	.	H	α-helix	trans	-65.1	-41.6	174.2	-179	66.6	-178.6	94.6	1.4	111.1	D65 C129 F131 D137 T178 I182 N243 V247	D65-R133 IonicContact OD1-CZ 3.93Å; D65-R133 IonicContact OD1-NH2 3.93Å; D65-R133 PolarHBondContact OD1-NH2 3.5Å; C129-R133 WeakPolarHBondContact O-CB 2.9Å; C129-R133 PolarHBondContact O-N 3.24Å; F131-R133 VanDerWaalsContact C-N 3.34Å; F131-R133 PolarHBondContact O-N 3.26Å; R133-D137 IonicContact CZ-OD2 3.75Å; R133-D137 IonicContact NH1-OD1 2.72Å; R133-D137 PolarHBondContact NH1-OD1 2.78Å; R133-D137 IonicContact NH1-OD2 3.91Å; R133-D137 PolarHBondContact NH1-OD2 3.27Å; R133-D137 VanDerWaalsContact NH1-OD2 3.08Å; R133-D137 PolarHBondContact O-N 3.41Å; R133-T178 HydrophobicContact CB-CG2 4.28Å; R133-T178 WeakPolarHBondContact CD-OG1 3.47Å; R133-I182 HydrophobicContact CG-CD1 4.36Å; R133-N243 PolarHBondContact NH1-ND2 2.73Å; R133-N243 VanDerWaalsContact NH1-ND2 3.14Å; R133-V247 HydrophobicContact CB-CG1 3.78Å; R133-V247 HydrophobicContact CG-CG1 3.49Å; R133-V247 VanDerWaalsContact CG-CG1 3.49Å
134	F	96.1	Very high	92.7	Very high	17 Å²	17	30.4 Å²	30.4	8%	0.075	15%	0.154	C	C	.	.	H	α-helix	trans	-70.8	-41	176	-173	-106.1	0	0	0	112.4	K130 F131 A136 D137 I138 N243 V247 I313 I314	K130-F134 WeakPolarHBondContact O-CB 3.49Å; K130-F134 PolarHBondContact O-N 3.44Å; K130-F134 VanDerWaalsContact O-N 3.16Å; F131-F134 PolarHBondContact O-N 2.93Å; F134-A136 PolarHBondContact O-N 3.31Å; F134-D137 PolarHBondContact O-N 2.96Å; F134-I138 HydrophobicContact CD1-CD1 3.72Å; F134-I138 HydrophobicContact CE1-CD1 3.4Å; F134-I138 HydrophobicContact CE1-CG1 4.23Å; F134-I138 HydrophobicContact CZ-CD1 4.1Å; F134-I138 PolarHBondContact O-N 3.06Å; F134-I138 VanDerWaalsContact O-N 3.11Å; F134-N243 WeakPolarHBondContact CA-OD1 3.44Å; F134-N243 HydrophobicContact CD2-CB 4.42Å; F134-N243 WeakPolarHBondContact CD2-OD1 3.44Å; F134-V247 HydrophobicContact CB-CG2 4.49Å; F134-I313 HydrophobicContact CB-CG2 3.9Å; F134-I313 HydrophobicContact CD1-CG2 4.25Å; F134-I313 HydrophobicContact CG-CG2 4.09Å; F134-I314 HydrophobicContact CD1-CD1 4.1Å; F134-I314 HydrophobicContact CD1-CG1 3.79Å; F134-I314 HydrophobicContact CE1-CD1 3.37Å; F134-I314 HydrophobicContact CE1-CG1 3.61Å; F134-I314 HydrophobicContact CZ-CD1 4.08Å
135	V	94.9	Very high	93.6	Very high	28 Å²	28	29.3 Å²	29.3	17%	0.17	15%	0.149	C	C	.	.	H	α-helix	trans	-64.1	-39.4	175.5	168.2	0	0	0	0	111.6	F131 W132 D137 I138 L139	F131-V135 HydrophobicContact CD1-CG2 4.25Å; F131-V135 HydrophobicContact CD2-CG2 3.94Å; F131-V135 HydrophobicContact CE1-CG2 3.89Å; F131-V135 HydrophobicContact CE2-CG2 3.57Å; F131-V135 HydrophobicContact CG-CG2 4.29Å; F131-V135 HydrophobicContact CZ-CG2 3.55Å; F131-V135 WeakPolarHBondContact O-CB 3.38Å; F131-V135 VanDerWaalsContact O-CG2 3.3Å; F131-V135 WeakPolarHBondContact O-CG2 3.41Å; F131-V135 PolarHBondContact O-N 3.14Å; W132-V135 HydrophobicContact CE3-CB 4.41Å; W132-V135 HydrophobicContact CE3-CG1 4.17Å; W132-V135 HydrophobicContact CZ3-CG1 4.18Å; W132-V135 PolarHBondContact O-N 3.32Å; V135-D137 PolarHBondContact O-N 3.37Å; V135-I138 PolarHBondContact O-N 3.12Å; V135-L139 HydrophobicContact CG1-CD1 3.87Å; V135-L139 HydrophobicContact CG1-CG 4.15Å; V135-L139 VanDerWaalsContact O-CG 3.28Å; V135-L139 WeakPolarHBondContact O-CG 3.37Å; V135-L139 PolarHBondContact O-N 3.48Å
136	A	96	Very high	94.5	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-56.4	-42.7	175.6	0	0	0	0	0	111.1	W132 F134 L139 N140 V171 A174	W132-A136 VanDerWaalsContact O-CB 3.28Å; W132-A136 WeakPolarHBondContact O-CB 3.15Å; W132-A136 PolarHBondContact O-N 3.01Å; F134-A136 PolarHBondContact O-N 3.31Å; A136-L139 PolarHBondContact O-N 2.97Å; A136-N140 WeakPolarHBondContact O-CB 3.46Å; A136-N140 PolarHBondContact O-N 3.37Å; A136-V171 HydrophobicContact CB-CG1 4.26Å; A136-V171 WeakPolarHBondContact O-CG2 3.49Å; A136-A174 HydrophobicContact CB-CB 3.99Å
137	D	96.2	Very high	95.7	Very high	8 Å²	8	26.4 Å²	26.4	4%	0.043	13%	0.134	C	C	.	.	H	α-helix	trans	-71.9	-37	179.6	-80.7	14.9	0	0	0	112.7	Q68 R133 F134 V135 L139 N140 D141 H239 N243	Q68-D137 VanDerWaalsContact CD-OD2 3.32Å; R133-D137 IonicContact CZ-OD2 3.75Å; R133-D137 IonicContact NH1-OD1 2.72Å; R133-D137 PolarHBondContact NH1-OD1 2.78Å; R133-D137 IonicContact NH1-OD2 3.91Å; R133-D137 PolarHBondContact NH1-OD2 3.27Å; R133-D137 VanDerWaalsContact NH1-OD2 3.08Å; R133-D137 PolarHBondContact O-N 3.41Å; F134-D137 PolarHBondContact O-N 2.96Å; V135-D137 PolarHBondContact O-N 3.37Å; D137-L139 VanDerWaalsContact C-N 3.34Å; D137-L139 PolarHBondContact O-N 3Å; D137-N140 WeakPolarHBondContact O-CB 3.32Å; D137-N140 PolarHBondContact O-N 3.3Å; D137-D141 PolarHBondContact O-N 2.93Å; D137-H239 VanDerWaalsContact CB-CE1 3.47Å; D137-H239 WeakPolarHBondContact CB-CE1 3.34Å; D137-H239 IonicContact OD2-CE1 3.23Å; D137-H239 IonicContact OD2-NE2 3.03Å; D137-H239 PolarHBondContact OD2-NE2 3.13Å; D137-N243 HydrophobicContact CB-CB 4.49Å; D137-N243 WeakPolarHBondContact OD2-CB 3.28Å; D137-N243 VanDerWaalsContact OD2-CG 3.26Å; D137-N243 PolarHBondContact OD2-ND2 3.06Å
138	I	97.5	Very high	96.4	Very high	64 Å²	64	26.5 Å²	26.5	33%	0.328	13%	0.134	S	C	.	.	H	α-helix	trans	-59.3	-46.2	170.3	-68.6	167.1	0	0	0	111	F134 V135 N140 D141 C142 L240	F134-I138 HydrophobicContact CD1-CD1 3.72Å; F134-I138 HydrophobicContact CE1-CD1 3.4Å; F134-I138 HydrophobicContact CE1-CG1 4.23Å; F134-I138 HydrophobicContact CZ-CD1 4.1Å; F134-I138 PolarHBondContact O-N 3.06Å; F134-I138 VanDerWaalsContact O-N 3.11Å; V135-I138 PolarHBondContact O-N 3.12Å; I138-N140 VanDerWaalsContact C-N 3.28Å; I138-N140 PolarHBondContact O-N 2.9Å; I138-D141 PolarHBondContact O-N 3.3Å; I138-C142 PolarHBondContact O-N 3.49Å; I138-C142 PolarHBondContact O-SG 3.48Å; I138-L240 HydrophobicContact CG1-CD2 3.83Å
139	L	98	Very high	96.7	Very high	36 Å²	36	25.1 Å²	25.1	19%	0.188	13%	0.126	C	C	.	.	H	α-helix	trans	-65	-35	179.2	-67.4	173.2	0	0	0	111.6	V135 A136 D137 A143 L167 L170 V171	V135-L139 HydrophobicContact CG1-CD1 3.87Å; V135-L139 HydrophobicContact CG1-CG 4.15Å; V135-L139 VanDerWaalsContact O-CG 3.28Å; V135-L139 WeakPolarHBondContact O-CG 3.37Å; V135-L139 PolarHBondContact O-N 3.48Å; A136-L139 PolarHBondContact O-N 2.97Å; D137-L139 VanDerWaalsContact C-N 3.34Å; D137-L139 PolarHBondContact O-N 3Å; L139-A143 WeakPolarHBondContact O-CB 3.31Å; L139-A143 PolarHBondContact O-N 3.3Å; L139-L167 HydrophobicContact CD2-CD2 3.99Å; L139-L170 HydrophobicContact CD1-CB 4.29Å; L139-V171 HydrophobicContact CB-CG2 3.76Å
140	N	98.2	Very high	97	Very high	22 Å²	22	25 Å²	25	12%	0.118	13%	0.125	C	C	.	.	H	α-helix	trans	-61.1	-50	173.4	-176.4	61.8	0	0	0	110.5	S72 A136 D137 I138 C142 A143 L144 V171	S72-N140 PolarHBondContact OG-ND2 3.48Å; A136-N140 WeakPolarHBondContact O-CB 3.46Å; A136-N140 PolarHBondContact O-N 3.37Å; D137-N140 WeakPolarHBondContact O-CB 3.32Å; D137-N140 PolarHBondContact O-N 3.3Å; I138-N140 VanDerWaalsContact C-N 3.28Å; I138-N140 PolarHBondContact O-N 2.9Å; N140-C142 VanDerWaalsContact C-N 3.35Å; N140-C142 PolarHBondContact O-N 3.49Å; N140-A143 WeakPolarHBondContact O-CA 3.47Å; N140-A143 VanDerWaalsContact O-CB 3.32Å; N140-A143 WeakPolarHBondContact O-CB 3.24Å; N140-A143 PolarHBondContact O-N 3.14Å; N140-L144 WeakPolarHBondContact O-CG 3.43Å; N140-L144 PolarHBondContact O-N 2.74Å; N140-V171 HydrophobicContact CB-CG1 4.07Å; N140-V171 HydrophobicContact CB-CG2 3.94Å
141	D	98.4	Very high	97	Very high	10 Å²	10	26 Å²	26	5%	0.053	13%	0.132	C	C	.	.	H	α-helix	trans	-64.9	-38.7	180	-66.4	-24.3	0	0	0	112.1	D137 I138 A143 L144 F145 T236 H239 L240	D137-D141 PolarHBondContact O-N 2.93Å; I138-D141 PolarHBondContact O-N 3.3Å; D141-A143 VanDerWaalsContact C-N 3.3Å; D141-A143 PolarHBondContact O-N 3.26Å; D141-L144 PolarHBondContact O-N 2.88Å; D141-F145 VanDerWaalsContact O-CB 3.31Å; D141-F145 WeakPolarHBondContact O-CB 3.46Å; D141-F145 PolarHBondContact O-N 3.42Å; D141-T236 HydrophobicContact CB-CG2 3.94Å; D141-H239 IonicContact OD1-CE1 3.35Å; D141-H239 PolarHBondContact OD1-CE1 2.91Å; D141-H239 VanDerWaalsContact OD1-CE1 3.23Å; D141-H239 IonicContact OD1-CG 3.4Å; D141-H239 IonicContact OD1-ND1 2.75Å; D141-H239 PolarHBondContact OD1-ND1 2.95Å; D141-H239 IonicContact OD2-CE1 2.64Å; D141-H239 PolarHBondContact OD2-CE1 3.33Å; D141-H239 IonicContact OD2-CG 3.26Å; D141-H239 IonicContact OD2-ND1 3.78Å; D141-H239 PolarHBondContact OD2-ND1 3.28Å; D141-L240 VanDerWaalsContact OD2-CD2 3.24Å; D141-L240 WeakPolarHBondContact OD2-CD2 3.46Å; D141-L240 VanDerWaalsContact OD2-CG 3.31Å; D141-L240 WeakPolarHBondContact OD2-CG 3.23Å
142	C	98.5	Very high	96.9	Very high	57 Å²	57	27.9 Å²	27.9	39%	0.385	15%	0.145	S	C	.	.	H	α-helix	trans	-60	-40.9	170.6	-70.5	0	0	0	0	111.8	I138 N140 F145 L146 L167	I138-C142 PolarHBondContact O-N 3.49Å; I138-C142 PolarHBondContact O-SG 3.48Å; N140-C142 VanDerWaalsContact C-N 3.35Å; N140-C142 PolarHBondContact O-N 3.49Å; C142-F145 PolarHBondContact O-N 3.06Å; C142-L146 VanDerWaalsContact O-CG 3.3Å; C142-L146 WeakPolarHBondContact O-CG 3.19Å; C142-L146 PolarHBondContact O-N 3.36Å; C142-L167 HydrophobicContact CB-CD1 3.88Å
143	A	98.7	Very high	96.9	Very high	0 Å²	0	31.5 Å²	31.5	0%	0	16%	0.161	C	C	.	.	H	α-helix	trans	-65.8	-44.2	177	0	0	0	0	0	112.2	L139 N140 D141 F145 L146 E147 A164 L167 K168	L139-A143 WeakPolarHBondContact O-CB 3.31Å; L139-A143 PolarHBondContact O-N 3.3Å; N140-A143 WeakPolarHBondContact O-CA 3.47Å; N140-A143 VanDerWaalsContact O-CB 3.32Å; N140-A143 WeakPolarHBondContact O-CB 3.24Å; N140-A143 PolarHBondContact O-N 3.14Å; D141-A143 VanDerWaalsContact C-N 3.3Å; D141-A143 PolarHBondContact O-N 3.26Å; A143-F145 VanDerWaalsContact C-N 3.32Å; A143-F145 PolarHBondContact O-N 3.43Å; A143-L146 WeakPolarHBondContact O-CB 3.42Å; A143-L146 PolarHBondContact O-N 3.32Å; A143-E147 PolarHBondContact O-N 3.3Å; A143-A164 HydrophobicContact CB-CB 4.36Å; A143-A164 WeakPolarHBondContact CB-O 3.36Å; A143-L167 HydrophobicContact CB-CB 3.79Å; A143-L167 HydrophobicContact CB-CD1 4.36Å; A143-K168 HydrophobicContact CB-CD 4.44Å; A143-K168 HydrophobicContact CB-CG 3.63Å
144	L	98.5	Very high	96.6	Very high	4 Å²	4	37.1 Å²	37.1	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-64	-39.1	176.8	-64.4	176.4	0	0	0	111.3	T75 A79 N140 D141 E147 I148 F232	T75-L144 VanDerWaalsContact OG1-CD1 3.32Å; T75-L144 WeakPolarHBondContact OG1-CD1 3.4Å; A79-L144 HydrophobicContact CB-CB 4.26Å; A79-L144 HydrophobicContact CB-CD2 3.64Å; N140-L144 WeakPolarHBondContact O-CG 3.43Å; N140-L144 PolarHBondContact O-N 2.74Å; D141-L144 PolarHBondContact O-N 2.88Å; L144-E147 PolarHBondContact O-N 2.89Å; L144-I148 WeakPolarHBondContact O-CG1 3.32Å; L144-I148 PolarHBondContact O-N 3.45Å; L144-F232 HydrophobicContact CB-CE2 3.89Å; L144-F232 HydrophobicContact CB-CZ 4.41Å
145	F	98.4	Very high	96.5	Very high	90 Å²	90	47.2 Å²	47.2	40%	0.395	23%	0.232	S	C	.	.	H	α-helix	trans	-59	-48.9	171.8	174.7	-98.4	0	0	0	111.5	D141 C142 A143 E147 I148 I149 W229 F232	D141-F145 VanDerWaalsContact O-CB 3.31Å; D141-F145 WeakPolarHBondContact O-CB 3.46Å; D141-F145 PolarHBondContact O-N 3.42Å; C142-F145 PolarHBondContact O-N 3.06Å; A143-F145 VanDerWaalsContact C-N 3.32Å; A143-F145 PolarHBondContact O-N 3.43Å; F145-E147 VanDerWaalsContact C-N 3.29Å; F145-E147 PolarHBondContact O-N 3.21Å; F145-I148 PolarHBondContact O-N 2.84Å; F145-I149 HydrophobicContact CD1-CD1 4.3Å; F145-I149 HydrophobicContact CD1-CG2 4.5Å; F145-I149 HydrophobicContact CD2-CG2 4.35Å; F145-I149 HydrophobicContact CE1-CD1 3.79Å; F145-I149 HydrophobicContact CE1-CG2 4.05Å; F145-I149 HydrophobicContact CE2-CG2 3.88Å; F145-I149 HydrophobicContact CZ-CD1 4.36Å; F145-I149 HydrophobicContact CZ-CG2 3.71Å; F145-I149 PolarHBondContact O-N 3.35Å; F145-W229 AromaticContact CD2-CH2 3.83Å; F145-W229 HydrophobicContact CD2-CH2 3.83Å; F145-W229 AromaticContact CD2-CZ3 3.73Å; F145-W229 HydrophobicContact CD2-CZ3 3.73Å; F145-W229 AromaticContact CE2-CH2 3.64Å; F145-W229 HydrophobicContact CE2-CH2 3.64Å; F145-W229 AromaticContact CE2-CZ3 3.72Å; F145-W229 HydrophobicContact CE2-CZ3 3.72Å; F145-F232 HydrophobicContact CB-CE1 4.12Å; F145-F232 HydrophobicContact CB-CZ 3.85Å; F145-F232 HydrophobicContact CD2-CE1 4.02Å
146	L	98.5	Very high	96.5	Very high	22 Å²	22	50.4 Å²	50.4	12%	0.115	25%	0.248	C	C	.	.	H	α-helix	trans	-58.7	-41	177.2	-73.3	177.2	0	0	0	111.9	C142 A143 I149 S150 L160 L163 A164 L167	C142-L146 VanDerWaalsContact O-CG 3.3Å; C142-L146 WeakPolarHBondContact O-CG 3.19Å; C142-L146 PolarHBondContact O-N 3.36Å; A143-L146 WeakPolarHBondContact O-CB 3.42Å; A143-L146 PolarHBondContact O-N 3.32Å; L146-I149 HydrophobicContact CD2-CD1 4.04Å; L146-I149 WeakPolarHBondContact O-CG1 3.39Å; L146-S150 WeakPolarHBondContact O-CB 3.31Å; L146-S150 PolarHBondContact O-N 3.28Å; L146-L160 HydrophobicContact CD2-CD2 4.08Å; L146-L163 HydrophobicContact CD1-CB 4.26Å; L146-L163 HydrophobicContact CD1-CD2 3.8Å; L146-L163 HydrophobicContact CD1-CG 3.73Å; L146-A164 HydrophobicContact CB-CB 3.81Å; L146-A164 HydrophobicContact CD1-CB 4.31Å; L146-L167 HydrophobicContact CD1-CD1 3.75Å
147	E	98.3	Very high	96.5	Very high	4 Å²	4	51 Å²	51	2%	0.019	25%	0.251	C	S	.	.	H	α-helix	trans	-62.9	-43.3	175.7	-78.5	179.3	171.2	0	0	112.2	A79 V83 A143 L144 F145 S150 P151 L161 A164 K168	A79-E147 HydrophobicContact CB-CB 3.93Å; A79-E147 WeakPolarHBondContact CB-OE2 3.31Å; V83-E147 HydrophobicContact CG2-CB 3.81Å; V83-E147 HydrophobicContact CG2-CG 3.72Å; A143-E147 PolarHBondContact O-N 3.3Å; L144-E147 PolarHBondContact O-N 2.89Å; F145-E147 VanDerWaalsContact C-N 3.29Å; F145-E147 PolarHBondContact O-N 3.21Å; E147-S150 PolarHBondContact O-N 3.46Å; E147-S150 PolarHBondContact O-OG 3.49Å; E147-P151 WeakPolarHBondContact O-CD 3.37Å; E147-L161 HydrophobicContact CG-CD1 3.95Å; E147-A164 HydrophobicContact CG-CB 3.86Å; E147-K168 WeakPolarHBondContact OE1-CE 3.46Å; E147-K168 IonicContact OE1-NZ 3.16Å; E147-K168 PolarHBondContact OE1-NZ 3.4Å; E147-K168 IonicContact OE2-NZ 2.69Å; E147-K168 PolarHBondContact OE2-NZ 2.98Å
148	I	97.5	Very high	96.6	Very high	12 Å²	12	52.6 Å²	52.6	6%	0.062	26%	0.26	C	S	.	.	H	α-helix	trans	-66.7	-40.6	178.8	-66.7	169.8	0	0	0	112	L78 A79 A82 L144 F145 P151 I228 W229 F232	L78-I148 HydrophobicContact CB-CD1 4.38Å; A79-I148 HydrophobicContact CB-CD1 4.47Å; A79-I148 HydrophobicContact CB-CG1 4.03Å; A82-I148 HydrophobicContact CB-CG1 4.41Å; L144-I148 WeakPolarHBondContact O-CG1 3.32Å; L144-I148 PolarHBondContact O-N 3.45Å; F145-I148 PolarHBondContact O-N 2.84Å; I148-P151 VanDerWaalsContact O-CD 3.28Å; I148-P151 WeakPolarHBondContact O-CD 3.28Å; I148-I228 HydrophobicContact CG2-CG2 4.19Å; I148-W229 HydrophobicContact CB-CH2 4.23Å; I148-W229 HydrophobicContact CG2-CH2 3.61Å; I148-W229 HydrophobicContact CG2-CZ2 3.51Å; I148-W229 HydrophobicContact CG2-CZ3 4.22Å; I148-F232 HydrophobicContact CD1-CB 4.16Å; I148-F232 HydrophobicContact CD1-CD1 4.34Å; I148-F232 HydrophobicContact CD1-CD2 3.24Å; I148-F232 HydrophobicContact CD1-CE2 3.63Å; I148-F232 HydrophobicContact CD1-CG 3.65Å; I148-F232 HydrophobicContact CD1-CZ 4.33Å
149	I	96.8	Very high	96.6	Very high	25 Å²	25	53 Å²	53	13%	0.128	27%	0.267	C	S	.	.	H	α-helix	trans	-78	-24.9	179.3	68.1	171.5	0	0	0	113.1	F145 L146 P151 L152 F153 W229	F145-I149 HydrophobicContact CD1-CD1 4.3Å; F145-I149 HydrophobicContact CD1-CG2 4.5Å; F145-I149 HydrophobicContact CD2-CG2 4.35Å; F145-I149 HydrophobicContact CE1-CD1 3.79Å; F145-I149 HydrophobicContact CE1-CG2 4.05Å; F145-I149 HydrophobicContact CE2-CG2 3.88Å; F145-I149 HydrophobicContact CZ-CD1 4.36Å; F145-I149 HydrophobicContact CZ-CG2 3.71Å; F145-I149 PolarHBondContact O-N 3.35Å; L146-I149 HydrophobicContact CD2-CD1 4.04Å; L146-I149 WeakPolarHBondContact O-CG1 3.39Å; I149-P151 VanDerWaalsContact C-N 3.33Å; I149-L152 VanDerWaalsContact O-CB 3.26Å; I149-L152 WeakPolarHBondContact O-CB 3.46Å; I149-L152 WeakPolarHBondContact O-CG 3.35Å; I149-L152 PolarHBondContact O-N 2.83Å; I149-F153 HydrophobicContact CB-CE2 4.38Å; I149-F153 HydrophobicContact CD1-CE2 4.43Å; I149-F153 WeakPolarHBondContact O-CD2 3.28Å; I149-W229 HydrophobicContact CG2-CH2 3.52Å; I149-W229 HydrophobicContact CG2-CZ2 3.8Å
150	S	97.5	Very high	96.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	27%	0.266	C	S	.	.	G	3₁₀ helix	trans	-53.9	-38.3	-170.5	65.9	0	0	0	0	114.7	L146 E147 L152 F153 F157	L146-S150 WeakPolarHBondContact O-CB 3.31Å; L146-S150 PolarHBondContact O-N 3.28Å; E147-S150 PolarHBondContact O-N 3.46Å; E147-S150 PolarHBondContact O-OG 3.49Å; S150-L152 PolarHBondContact O-N 3.5Å; S150-F153 PolarHBondContact O-N 2.86Å; S150-F153 VanDerWaalsContact O-N 3.12Å; S150-F157 WeakPolarHBondContact OG-CD2 3.39Å; S150-F157 WeakPolarHBondContact OG-CE2 3.42Å
151	P	94.5	Very high	96.6	Very high	28 Å²	28	51.7 Å²	51.7	18%	0.182	26%	0.26	C	S	.	.	G	3₁₀ helix	trans	-69.7	-14	179.8	-18.1	34.8	0	0	0	113.5	A82 I85 E147 I148 I149 F153	A82-P151 HydrophobicContact CB-CG 4.12Å; A82-P151 WeakPolarHBondContact O-CG 3.27Å; I85-P151 HydrophobicContact CG2-CB 4.3Å; E147-P151 WeakPolarHBondContact O-CD 3.37Å; I148-P151 VanDerWaalsContact O-CD 3.28Å; I148-P151 WeakPolarHBondContact O-CD 3.28Å; I149-P151 VanDerWaalsContact C-N 3.33Å; P151-F153 PolarHBondContact O-N 3.47Å
152	L	93.2	Very high	96.6	Very high	110 Å²	110	52.3 Å²	52.3	58%	0.576	27%	0.265	S	S	*	.	G	3₁₀ helix	trans	-73.9	-14.6	174.9	-55.8	177.2	0	0	0	112.1	I149 S150	I149-L152 VanDerWaalsContact O-CB 3.26Å; I149-L152 WeakPolarHBondContact O-CB 3.46Å; I149-L152 WeakPolarHBondContact O-CG 3.35Å; I149-L152 PolarHBondContact O-N 2.83Å; S150-L152 PolarHBondContact O-N 3.5Å
153	F	94.4	Very high	96.6	Very high	102 Å²	102	53.8 Å²	53.8	45%	0.447	27%	0.269	S	S	.	.			trans	-125.3	78.4	-173.7	-57.4	-79.5	0	0	0	111.7	I149 S150 P151 Y155 L156 F157 L160	I149-F153 HydrophobicContact CB-CE2 4.38Å; I149-F153 HydrophobicContact CD1-CE2 4.43Å; I149-F153 WeakPolarHBondContact O-CD2 3.28Å; S150-F153 PolarHBondContact O-N 2.86Å; S150-F153 VanDerWaalsContact O-N 3.12Å; P151-F153 PolarHBondContact O-N 3.47Å; F153-Y155 VanDerWaalsContact C-N 3.31Å; F153-Y155 PolarHBondContact O-N 3.08Å; F153-Y155 VanDerWaalsContact O-N 3.1Å; F153-L156 HydrophobicContact CB-CB 4Å; F153-L156 CarbonylContact O-C 3.42Å; F153-L156 PolarHBondContact O-N 2.77Å; F153-F157 PolarHBondContact O-N 2.88Å; F153-L160 HydrophobicContact CB-CD1 4.14Å; F153-L160 HydrophobicContact CD2-CD1 3.88Å; F153-L160 HydrophobicContact CG-CD1 4.33Å
154	N	89.3	Confident	96.6	Very high	140 Å²	140	53.8 Å²	53.8	75%	0.749	27%	0.269	S	S	*	.	G	3₁₀ helix	trans	-45.6	-47.8	-176.4	-64	-8.1	0	0	0	114.5	L156	N154-L156 VanDerWaalsContact C-N 3.35Å; N154-L156 PolarHBondContact O-N 2.61Å
155	Y	92.3	Very high	96.6	Very high	229 Å²	229	54.8 Å²	54.8	90%	0.898	27%	0.274	S	S	*	.	G	3₁₀ helix	trans	-74.1	-21.7	-179.2	-63.4	-71.1	0	0	0	114.4	F153	F153-Y155 VanDerWaalsContact C-N 3.31Å; F153-Y155 PolarHBondContact O-N 3.08Å; F153-Y155 VanDerWaalsContact O-N 3.1Å
156	L	95.6	Very high	96.6	Very high	96 Å²	96	52.3 Å²	52.3	50%	0.503	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-107.3	1.8	-179.1	-64.9	176.1	0	0	0	112.8	F153 N154 T158 P159 L160	F153-L156 HydrophobicContact CB-CB 4Å; F153-L156 CarbonylContact O-C 3.42Å; F153-L156 PolarHBondContact O-N 2.77Å; N154-L156 VanDerWaalsContact C-N 3.35Å; N154-L156 PolarHBondContact O-N 2.61Å; L156-T158 PolarHBondContact O-N 3.46Å; L156-P159 VanDerWaalsContact O-CD 3.31Å; L156-P159 WeakPolarHBondContact O-CD 3.3Å; L156-L160 HydrophobicContact CB-CD1 4Å; L156-L160 HydrophobicContact CB-CG 4.19Å; L156-L160 WeakPolarHBondContact O-CB 3.45Å; L156-L160 VanDerWaalsContact O-CG 3.22Å; L156-L160 WeakPolarHBondContact O-CG 3.45Å; L156-L160 PolarHBondContact O-N 3.21Å
157	F	97.1	Very high	96.6	Very high	13 Å²	13	52.6 Å²	52.6	6%	0.057	27%	0.268	C	S	.	.	H	α-helix	trans	-53.4	-57.3	-176.8	173.1	-110.4	0	0	0	111.8	G86 V87 T102 S150 F153 L160 L161	G86-F157 VanDerWaalsContact C-CE1 3.42Å; G86-F157 VanDerWaalsContact CA-CE2 3.46Å; G86-F157 WeakPolarHBondContact O-CE1 3.47Å; V87-F157 HydrophobicContact CG1-CE1 3.82Å; V87-F157 HydrophobicContact CG1-CZ 3.84Å; T102-F157 HydrophobicContact CG2-CD1 4.37Å; T102-F157 HydrophobicContact CG2-CE1 3.82Å; S150-F157 WeakPolarHBondContact OG-CD2 3.39Å; S150-F157 WeakPolarHBondContact OG-CE2 3.42Å; F153-F157 PolarHBondContact O-N 2.88Å; F157-L160 PolarHBondContact O-N 3.36Å; F157-L161 HydrophobicContact CE1-CD2 4.25Å; F157-L161 HydrophobicContact CZ-CD2 3.89Å; F157-L161 WeakPolarHBondContact O-CB 3.49Å; F157-L161 PolarHBondContact O-N 3.1Å
158	T	97.3	Very high	96.6	Very high	40 Å²	40	55.1 Å²	55.1	25%	0.245	28%	0.279	C	S	.	.	H	α-helix	trans	-61.9	-47.9	-179.7	-52.4	0	0	0	0	112.5	T102 F105 L156 L160 L161 C162	T102-T158 HydrophobicContact CG2-CG2 4.14Å; T102-T158 PolarHBondContact OG1-OG1 3.42Å; F105-T158 HydrophobicContact CB-CG2 4.33Å; L156-T158 PolarHBondContact O-N 3.46Å; T158-L160 PolarHBondContact O-N 2.84Å; T158-L161 PolarHBondContact O-N 3.48Å; T158-C162 WeakPolarHBondContact O-CB 3.47Å; T158-C162 PolarHBondContact O-N 3.47Å; T158-C162 PolarHBondContact O-SG 3.47Å
159	P	97.9	Very high	96.6	Very high	73 Å²	73	54.8 Å²	54.8	47%	0.474	28%	0.277	S	S	.	.	H	α-helix	trans	-56.3	-44	172.9	-28.5	34.2	0	0	0	114.9	L156 C162 L163	L156-P159 VanDerWaalsContact O-CD 3.31Å; L156-P159 WeakPolarHBondContact O-CD 3.3Å; P159-C162 WeakPolarHBondContact O-CB 3.41Å; P159-C162 PolarHBondContact O-N 3.47Å; P159-L163 PolarHBondContact O-N 2.9Å
160	L	98.4	Very high	96.6	Very high	30 Å²	30	55 Å²	55	16%	0.157	28%	0.279	C	S	.	.	H	α-helix	trans	-64.6	-41.8	178.4	-71.9	170.4	0	0	0	111.1	L146 F153 L156 F157 T158 L163 A164	L146-L160 HydrophobicContact CD2-CD2 4.08Å; F153-L160 HydrophobicContact CB-CD1 4.14Å; F153-L160 HydrophobicContact CD2-CD1 3.88Å; F153-L160 HydrophobicContact CG-CD1 4.33Å; L156-L160 HydrophobicContact CB-CD1 4Å; L156-L160 HydrophobicContact CB-CG 4.19Å; L156-L160 WeakPolarHBondContact O-CB 3.45Å; L156-L160 VanDerWaalsContact O-CG 3.22Å; L156-L160 WeakPolarHBondContact O-CG 3.45Å; L156-L160 PolarHBondContact O-N 3.21Å; F157-L160 PolarHBondContact O-N 3.36Å; T158-L160 PolarHBondContact O-N 2.84Å; L160-L163 PolarHBondContact O-N 2.94Å; L160-A164 WeakPolarHBondContact O-CB 3.41Å; L160-A164 PolarHBondContact O-N 3.24Å
161	L	98.1	Very high	96.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-66.2	-38.3	176.5	-170.5	61.4	0	0	0	111.9	V83 T102 K106 E147 F157 T158 A164 N165	V83-L161 HydrophobicContact CG1-CD1 4.13Å; V83-L161 HydrophobicContact CG1-CD2 4.18Å; V83-L161 HydrophobicContact CG2-CD1 3.73Å; T102-L161 HydrophobicContact CG2-CD2 3.76Å; K106-L161 HydrophobicContact CB-CD2 4.41Å; K106-L161 HydrophobicContact CB-CG 4.26Å; K106-L161 HydrophobicContact CD-CD1 4.17Å; K106-L161 HydrophobicContact CD-CD2 3.99Å; K106-L161 HydrophobicContact CD-CG 3.82Å; K106-L161 HydrophobicContact CG-CD2 4.38Å; K106-L161 HydrophobicContact CG-CG 3.9Å; E147-L161 HydrophobicContact CG-CD1 3.95Å; F157-L161 HydrophobicContact CE1-CD2 4.25Å; F157-L161 HydrophobicContact CZ-CD2 3.89Å; F157-L161 WeakPolarHBondContact O-CB 3.49Å; F157-L161 PolarHBondContact O-N 3.1Å; T158-L161 PolarHBondContact O-N 3.48Å; L161-A164 PolarHBondContact O-N 2.78Å; L161-N165 WeakPolarHBondContact O-CB 3.35Å; L161-N165 PolarHBondContact O-N 3.03Å
162	C	98.5	Very high	96.6	Very high	23 Å²	23	56.4 Å²	56.4	16%	0.155	29%	0.294	C	S	.	.	H	α-helix	trans	-62.6	-42.5	173	-68.9	0	0	0	0	111.6	S109 T158 P159 N165 V166	S109-C162 WeakPolarHBondContact OG-CA 3.44Å; S109-C162 WeakPolarHBondContact OG-CB 3.4Å; S109-C162 PolarHBondContact OG-O 2.97Å; T158-C162 WeakPolarHBondContact O-CB 3.47Å; T158-C162 PolarHBondContact O-N 3.47Å; T158-C162 PolarHBondContact O-SG 3.47Å; P159-C162 WeakPolarHBondContact O-CB 3.41Å; P159-C162 PolarHBondContact O-N 3.47Å; C162-N165 PolarHBondContact O-N 3.22Å; C162-V166 WeakPolarHBondContact O-CG2 3.23Å; C162-V166 PolarHBondContact O-N 2.97Å
163	L	98.5	Very high	96.7	Very high	88 Å²	88	52.2 Å²	52.2	46%	0.461	27%	0.273	S	S	.	.	H	α-helix	trans	-65.4	-44.7	176	179.4	61.4	0	0	0	111.4	L146 P159 L160 N165 V166 L167	L146-L163 HydrophobicContact CD1-CB 4.26Å; L146-L163 HydrophobicContact CD1-CD2 3.8Å; L146-L163 HydrophobicContact CD1-CG 3.73Å; P159-L163 PolarHBondContact O-N 2.9Å; L160-L163 PolarHBondContact O-N 2.94Å; L163-N165 VanDerWaalsContact C-N 3.29Å; L163-N165 PolarHBondContact O-N 3.4Å; L163-V166 WeakPolarHBondContact O-CB 3.48Å; L163-V166 PolarHBondContact O-N 3.42Å; L163-L167 WeakPolarHBondContact O-CG 3.33Å; L163-L167 PolarHBondContact O-N 2.88Å
164	A	98.5	Very high	96.7	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-57	-43.5	175	0	0	0	0	0	111.6	A143 L146 E147 L160 L161 L167 K168	A143-A164 HydrophobicContact CB-CB 4.36Å; A143-A164 WeakPolarHBondContact CB-O 3.36Å; L146-A164 HydrophobicContact CB-CB 3.81Å; L146-A164 HydrophobicContact CD1-CB 4.31Å; E147-A164 HydrophobicContact CG-CB 3.86Å; L160-A164 WeakPolarHBondContact O-CB 3.41Å; L160-A164 PolarHBondContact O-N 3.24Å; L161-A164 PolarHBondContact O-N 2.78Å; A164-L167 WeakPolarHBondContact O-CB 3.22Å; A164-L167 PolarHBondContact O-N 3.07Å; A164-K168 PolarHBondContact O-N 2.84Å
165	N	98.3	Very high	97	Very high	25 Å²	25	41.6 Å²	41.6	13%	0.134	23%	0.225	C	C	.	.	H	α-helix	trans	-73.7	-30.4	179.3	-158.2	58.5	0	0	0	113.4	K106 L161 C162 L163 S169	K106-N165 HydrophobicContact CD-CB 4.36Å; K106-N165 WeakPolarHBondContact CE-OD1 3.45Å; K106-N165 HydrophobicContact CG-CB 3.46Å; K106-N165 VanDerWaalsContact CG-CB 3.46Å; K106-N165 PolarHBondContact O-ND2 2.97Å; L161-N165 WeakPolarHBondContact O-CB 3.35Å; L161-N165 PolarHBondContact O-N 3.03Å; C162-N165 PolarHBondContact O-N 3.22Å; L163-N165 VanDerWaalsContact C-N 3.29Å; L163-N165 PolarHBondContact O-N 3.4Å; N165-S169 WeakPolarHBondContact O-CB 3.13Å; N165-S169 PolarHBondContact O-N 3.46Å
166	V	98.6	Very high	97	Very high	38 Å²	38	34.2 Å²	34.2	23%	0.23	21%	0.207	C	C	.	.	H	α-helix	trans	-56.3	-55.7	165.5	167.8	0	0	0	0	108.4	S109 C162 L163 K168 S169 L170	S109-V166 WeakPolarHBondContact O-CG2 3.42Å; C162-V166 WeakPolarHBondContact O-CG2 3.23Å; C162-V166 PolarHBondContact O-N 2.97Å; L163-V166 WeakPolarHBondContact O-CB 3.48Å; L163-V166 PolarHBondContact O-N 3.42Å; V166-K168 PolarHBondContact O-N 3.15Å; V166-S169 WeakPolarHBondContact O-CA 3.26Å; V166-S169 VanDerWaalsContact O-CB 3.31Å; V166-S169 WeakPolarHBondContact O-CB 3.42Å; V166-S169 PolarHBondContact O-N 2.74Å; V166-S169 PolarHBondContact O-OG 2.94Å; V166-L170 VanDerWaalsContact C-CD1 3.47Å; V166-L170 HydrophobicContact CG1-CD1 3.68Å; V166-L170 WeakPolarHBondContact O-CD1 3.32Å; V166-L170 PolarHBondContact O-N 2.97Å; V166-L170 VanDerWaalsContact O-N 3.15Å
167	L	98.5	Very high	96.9	Very high	29 Å²	29	30.8 Å²	30.8	15%	0.152	19%	0.192	C	C	.	.	H	α-helix	trans	-51.9	-53.8	178	-65.4	-178.2	0	0	0	112.3	L139 C142 A143 L146 L163 A164 S169 L170 V171	L139-L167 HydrophobicContact CD2-CD2 3.99Å; C142-L167 HydrophobicContact CB-CD1 3.88Å; A143-L167 HydrophobicContact CB-CB 3.79Å; A143-L167 HydrophobicContact CB-CD1 4.36Å; L146-L167 HydrophobicContact CD1-CD1 3.75Å; L163-L167 WeakPolarHBondContact O-CG 3.33Å; L163-L167 PolarHBondContact O-N 2.88Å; A164-L167 WeakPolarHBondContact O-CB 3.22Å; A164-L167 PolarHBondContact O-N 3.07Å; L167-S169 PolarHBondContact O-N 3.19Å; L167-L170 WeakPolarHBondContact O-CB 3.48Å; L167-L170 PolarHBondContact O-N 3.07Å; L167-V171 WeakPolarHBondContact O-CG2 3.42Å; L167-V171 PolarHBondContact O-N 2.91Å
168	K	98.2	Very high	96.7	Very high	56 Å²	56	30.1 Å²	30.1	24%	0.243	19%	0.19	C	C	.	.	H	α-helix	trans	-55.5	-33.8	175.7	-74.2	-176.9	176.4	178	0	113.3	A143 E147 A164 V166 V171 G172	A143-K168 HydrophobicContact CB-CD 4.44Å; A143-K168 HydrophobicContact CB-CG 3.63Å; E147-K168 WeakPolarHBondContact OE1-CE 3.46Å; E147-K168 IonicContact OE1-NZ 3.16Å; E147-K168 PolarHBondContact OE1-NZ 3.4Å; E147-K168 IonicContact OE2-NZ 2.69Å; E147-K168 PolarHBondContact OE2-NZ 2.98Å; A164-K168 PolarHBondContact O-N 2.84Å; V166-K168 PolarHBondContact O-N 3.15Å; K168-V171 WeakPolarHBondContact O-CB 3.16Å; K168-V171 PolarHBondContact O-N 3.34Å; K168-G172 PolarHBondContact O-N 3.05Å
169	S	97.8	Very high	96.5	Very high	5 Å²	5	31.7 Å²	31.7	4%	0.035	19%	0.191	C	C	.	.	H	α-helix	trans	-68	-37.3	176.4	83.4	0	0	0	0	112.7	G110 R114 N165 V166 L167 G172 V173	G110-S169 WeakPolarHBondContact O-CB 3.36Å; G110-S169 PolarHBondContact O-OG 2.72Å; R114-S169 PolarHBondContact N-OG 3.28Å; N165-S169 WeakPolarHBondContact O-CB 3.13Å; N165-S169 PolarHBondContact O-N 3.46Å; V166-S169 WeakPolarHBondContact O-CA 3.26Å; V166-S169 VanDerWaalsContact O-CB 3.31Å; V166-S169 WeakPolarHBondContact O-CB 3.42Å; V166-S169 PolarHBondContact O-N 2.74Å; V166-S169 PolarHBondContact O-OG 2.94Å; L167-S169 PolarHBondContact O-N 3.19Å; S169-G172 PolarHBondContact O-N 3.28Å; S169-V173 PolarHBondContact O-N 3.47Å
170	L	96.6	Very high	96.3	Very high	31 Å²	31	31 Å²	31	16%	0.162	19%	0.192	C	C	.	.	H	α-helix	trans	-65.4	-42.5	172.2	-65.9	94.6	0	0	0	110.6	F117 L139 V166 L167 G172 V173 A174	F117-L170 HydrophobicContact CB-CD2 4.1Å; F117-L170 HydrophobicContact CB-CG 4.05Å; F117-L170 HydrophobicContact CD1-CB 4.35Å; F117-L170 HydrophobicContact CD1-CD2 4.46Å; F117-L170 HydrophobicContact CD1-CG 4.39Å; F117-L170 HydrophobicContact CD2-CD2 3.32Å; F117-L170 HydrophobicContact CD2-CG 4.06Å; F117-L170 HydrophobicContact CE2-CD2 3.77Å; F117-L170 HydrophobicContact CG-CB 4.34Å; F117-L170 HydrophobicContact CG-CD2 3.7Å; F117-L170 HydrophobicContact CG-CG 3.9Å; F117-L170 HydrophobicContact CZ-CD2 4.5Å; L139-L170 HydrophobicContact CD1-CB 4.29Å; V166-L170 VanDerWaalsContact C-CD1 3.47Å; V166-L170 HydrophobicContact CG1-CD1 3.68Å; V166-L170 WeakPolarHBondContact O-CD1 3.32Å; V166-L170 PolarHBondContact O-N 2.97Å; V166-L170 VanDerWaalsContact O-N 3.15Å; L167-L170 WeakPolarHBondContact O-CB 3.48Å; L167-L170 PolarHBondContact O-N 3.07Å; L170-G172 VanDerWaalsContact C-N 3.29Å; L170-G172 PolarHBondContact O-N 2.93Å; L170-V173 PolarHBondContact O-N 3.43Å; L170-V173 VanDerWaalsContact O-N 3.14Å; L170-A174 PolarHBondContact O-N 2.69Å
171	V	97	Very high	96	Very high	21 Å²	21	30.3 Å²	30.3	13%	0.127	19%	0.19	C	C	.	.	H	α-helix	trans	-55.7	-46.4	174	-178.5	0	0	0	0	110.5	A136 L139 N140 L167 K168 V173 A174 G175	A136-V171 HydrophobicContact CB-CG1 4.26Å; A136-V171 WeakPolarHBondContact O-CG2 3.49Å; L139-V171 HydrophobicContact CB-CG2 3.76Å; N140-V171 HydrophobicContact CB-CG1 4.07Å; N140-V171 HydrophobicContact CB-CG2 3.94Å; L167-V171 WeakPolarHBondContact O-CG2 3.42Å; L167-V171 PolarHBondContact O-N 2.91Å; K168-V171 WeakPolarHBondContact O-CB 3.16Å; K168-V171 PolarHBondContact O-N 3.34Å; V171-V173 VanDerWaalsContact C-N 3.29Å; V171-V173 PolarHBondContact O-N 3.21Å; V171-A174 PolarHBondContact O-N 2.78Å; V171-G175 WeakPolarHBondContact O-CA 3.23Å; V171-G175 PolarHBondContact O-N 3.01Å
172	G	95.1	Very high	95.9	Very high	36 Å²	36	30.4 Å²	30.4	37%	0.371	19%	0.19	S	C	.	.	H	α-helix	trans	-56.7	-41	177.4	0	0	0	0	0	112.9	K168 S169 L170 S176	K168-G172 PolarHBondContact O-N 3.05Å; S169-G172 PolarHBondContact O-N 3.28Å; L170-G172 VanDerWaalsContact C-N 3.29Å; L170-G172 PolarHBondContact O-N 2.93Å; G172-S176 WeakPolarHBondContact O-CB 3.34Å; G172-S176 PolarHBondContact O-N 3.4Å; G172-S176 PolarHBondContact O-OG 3.37Å
173	V	95.2	Very high	95.8	Very high	22 Å²	22	29.6 Å²	29.6	13%	0.133	19%	0.185	C	C	.	.	H	α-helix	trans	-72.4	-53.9	177.4	-178.7	0	0	0	0	111.8	R114 F117 A118 L125 S169 L170 V171 S176 A177	R114-V173 HydrophobicContact CG-CG2 3.46Å; R114-V173 VanDerWaalsContact CG-CG2 3.46Å; F117-V173 HydrophobicContact CD1-CB 3.87Å; F117-V173 HydrophobicContact CD1-CG1 3.9Å; F117-V173 HydrophobicContact CD1-CG2 4.41Å; F117-V173 HydrophobicContact CE1-CB 4.13Å; F117-V173 HydrophobicContact CE1-CG1 4.07Å; A118-V173 HydrophobicContact CB-CG1 4.35Å; L125-V173 HydrophobicContact CD1-CG1 3.83Å; S169-V173 PolarHBondContact O-N 3.47Å; L170-V173 PolarHBondContact O-N 3.43Å; L170-V173 VanDerWaalsContact O-N 3.14Å; V171-V173 VanDerWaalsContact C-N 3.29Å; V171-V173 PolarHBondContact O-N 3.21Å; V173-S176 PolarHBondContact O-N 2.91Å; V173-S176 PolarHBondContact O-OG 3.43Å; V173-A177 WeakPolarHBondContact O-CB 3.45Å; V173-A177 PolarHBondContact O-N 2.97Å
174	A	94.8	Very high	95.6	Very high	2 Å²	2	31.9 Å²	31.9	2%	0.017	19%	0.193	C	C	.	.	H	α-helix	trans	-65.3	-43.4	-176.8	0	0	0	0	0	111.9	F117 L125 W132 A136 L170 V171 T178	F117-A174 HydrophobicContact CE1-CB 4.22Å; F117-A174 HydrophobicContact CZ-CB 4.47Å; L125-A174 HydrophobicContact CD2-CB 4.03Å; W132-A174 HydrophobicContact CE3-CB 4.42Å; A136-A174 HydrophobicContact CB-CB 3.99Å; L170-A174 PolarHBondContact O-N 2.69Å; V171-A174 PolarHBondContact O-N 2.78Å; A174-T178 WeakPolarHBondContact O-CB 3.33Å; A174-T178 VanDerWaalsContact O-CG2 3.26Å; A174-T178 WeakPolarHBondContact O-CG2 3.5Å; A174-T178 PolarHBondContact O-N 3.23Å; A174-T178 PolarHBondContact O-OG1 2.9Å
175	G	93.9	Very high	95.5	Very high	17 Å²	17	33.3 Å²	33.3	18%	0.175	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-46.1	176.8	0	0	0	0	0	112	V171 T178 R179	V171-G175 WeakPolarHBondContact O-CA 3.23Å; V171-G175 PolarHBondContact O-N 3.01Å; G175-T178 PolarHBondContact O-OG1 3.14Å; G175-R179 WeakPolarHBondContact O-CB 3.45Å; G175-R179 PolarHBondContact O-N 2.72Å
176	S	93.2	Very high	95.4	Very high	73 Å²	73	32.1 Å²	32.1	51%	0.51	19%	0.193	S	C	.	.	H	α-helix	trans	-65	-45.1	178.5	62.9	0	0	0	0	112.9	G172 V173 A180	G172-S176 WeakPolarHBondContact O-CB 3.34Å; G172-S176 PolarHBondContact O-N 3.4Å; G172-S176 PolarHBondContact O-OG 3.37Å; V173-S176 PolarHBondContact O-N 2.91Å; V173-S176 PolarHBondContact O-OG 3.43Å; S176-A180 PolarHBondContact O-N 2.9Å
177	A	92.9	Very high	95.3	Very high	24 Å²	24	31.2 Å²	31.2	20%	0.198	19%	0.19	C	C	.	.	H	α-helix	trans	-64.3	-47.4	178	0	0	0	0	0	112.3	L125 V173 R179 A180 A181	L125-A177 HydrophobicContact CB-CB 4.05Å; L125-A177 HydrophobicContact CD1-CB 3.96Å; V173-A177 WeakPolarHBondContact O-CB 3.45Å; V173-A177 PolarHBondContact O-N 2.97Å; A177-R179 PolarHBondContact O-N 3.25Å; A177-A180 WeakPolarHBondContact O-CB 3.42Å; A177-A180 PolarHBondContact O-N 3.43Å; A177-A181 PolarHBondContact O-N 3.12Å; A177-A181 VanDerWaalsContact O-N 3.1Å
178	T	93.4	Very high	95.1	Very high	0 Å²	0	33.5 Å²	33.5	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-67.7	-37.6	-179.8	54.6	0	0	0	0	112.2	C129 W132 R133 A174 G175 A181 I182	C129-T178 WeakPolarHBondContact O-CG2 3.38Å; W132-T178 HydrophobicContact CB-CG2 3.68Å; R133-T178 HydrophobicContact CB-CG2 4.28Å; R133-T178 WeakPolarHBondContact CD-OG1 3.47Å; A174-T178 WeakPolarHBondContact O-CB 3.33Å; A174-T178 VanDerWaalsContact O-CG2 3.26Å; A174-T178 WeakPolarHBondContact O-CG2 3.5Å; A174-T178 PolarHBondContact O-N 3.23Å; A174-T178 PolarHBondContact O-OG1 2.9Å; G175-T178 PolarHBondContact O-OG1 3.14Å; T178-A181 PolarHBondContact O-N 3.42Å; T178-I182 VanDerWaalsContact O-CG1 3.27Å; T178-I182 WeakPolarHBondContact O-CG1 3.3Å; T178-I182 PolarHBondContact O-N 3.16Å
179	R	93.8	Very high	94.8	Very high	73 Å²	73	36.1 Å²	36.1	28%	0.275	22%	0.218	S	C	.	.	H	α-helix	trans	-59.2	-45.9	171.1	-175.9	-177.1	-175.7	163.7	12.5	111.7	G175 A177 A181 I182 V183 D199 E203	G175-R179 WeakPolarHBondContact O-CB 3.45Å; G175-R179 PolarHBondContact O-N 2.72Å; A177-R179 PolarHBondContact O-N 3.25Å; R179-A181 VanDerWaalsContact C-N 3.31Å; R179-A181 PolarHBondContact O-N 2.78Å; R179-I182 PolarHBondContact O-N 3.08Å; R179-V183 HydrophobicContact CG-CG2 4.25Å; R179-V183 VanDerWaalsContact O-CG2 3.3Å; R179-V183 WeakPolarHBondContact O-CG2 3.28Å; R179-V183 PolarHBondContact O-N 3.28Å; R179-D199 IonicContact CZ-OD2 3.74Å; R179-D199 IonicContact NE-OD2 2.82Å; R179-D199 PolarHBondContact NE-OD2 3.41Å; R179-D199 IonicContact NH2-OD2 3.81Å; R179-D199 PolarHBondContact NH2-OD2 2.81Å; R179-E203 IonicContact CZ-OE2 3.75Å; R179-E203 IonicContact NH1-OE2 3.42Å; R179-E203 PolarHBondContact NH1-OE2 3.17Å; R179-E203 IonicContact NH2-OE2 3.05Å; R179-E203 PolarHBondContact NH2-OE2 3.38Å
180	A	93.6	Very high	94.6	Very high	59 Å²	59	44 Å²	44	49%	0.488	26%	0.26	S	S	.	.	H	α-helix	trans	-58.5	-43.2	177.3	0	0	0	0	0	112	S176 A177 Q184	S176-A180 PolarHBondContact O-N 2.9Å; A177-A180 WeakPolarHBondContact O-CB 3.42Å; A177-A180 PolarHBondContact O-N 3.43Å; A180-Q184 WeakPolarHBondContact O-CB 3.47Å; A180-Q184 PolarHBondContact O-N 3.31Å
181	A	92.7	Very high	94.6	Very high	14 Å²	14	43.5 Å²	43.5	12%	0.116	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-39.7	175.7	0	0	0	0	0	112.9	A177 T178 R179 Q184 H185	A177-A181 PolarHBondContact O-N 3.12Å; A177-A181 VanDerWaalsContact O-N 3.1Å; T178-A181 PolarHBondContact O-N 3.42Å; R179-A181 VanDerWaalsContact C-N 3.31Å; R179-A181 PolarHBondContact O-N 2.78Å; A181-Q184 PolarHBondContact O-N 3.46Å; A181-H185 PolarHBondContact O-N 2.96Å
182	I	95.3	Very high	94.5	Very high	2 Å²	2	46.6 Å²	46.6	1%	0.01	27%	0.273	C	S	.	.	H	α-helix	trans	-66.9	-47	177.4	-68.3	164.7	0	0	0	110.9	Y61 R133 T178 R179 Q184 H185 Q186 L250	Y61-I182 HydrophobicContact CD2-CG2 4.49Å; Y61-I182 HydrophobicContact CE1-CG2 4.17Å; Y61-I182 HydrophobicContact CE2-CD1 3.91Å; Y61-I182 HydrophobicContact CE2-CG2 4.09Å; R133-I182 HydrophobicContact CG-CD1 4.36Å; T178-I182 VanDerWaalsContact O-CG1 3.27Å; T178-I182 WeakPolarHBondContact O-CG1 3.3Å; T178-I182 PolarHBondContact O-N 3.16Å; R179-I182 PolarHBondContact O-N 3.08Å; I182-Q184 VanDerWaalsContact C-N 3.28Å; I182-Q184 PolarHBondContact O-N 2.88Å; I182-H185 WeakPolarHBondContact O-CB 3.2Å; I182-H185 PolarHBondContact O-N 3.42Å; I182-H185 VanDerWaalsContact O-N 3.13Å; I182-Q186 HydrophobicContact CG2-CG 4.3Å; I182-Q186 WeakPolarHBondContact O-CB 3.32Å; I182-Q186 WeakPolarHBondContact O-CG 3.44Å; I182-Q186 PolarHBondContact O-N 3.02Å; I182-L250 HydrophobicContact CD1-CD1 3.93Å; I182-L250 HydrophobicContact CG1-CD1 3.86Å; I182-L250 HydrophobicContact CG2-CD2 4.09Å
183	V	96.4	Very high	94.6	Very high	6 Å²	6	48.7 Å²	48.7	4%	0.036	29%	0.287	C	S	.	.	H	α-helix	trans	-62.3	-39	177.3	174.6	0	0	0	0	110.3	R179 H185 Q186 A187 L192 V195	R179-V183 HydrophobicContact CG-CG2 4.25Å; R179-V183 VanDerWaalsContact O-CG2 3.3Å; R179-V183 WeakPolarHBondContact O-CG2 3.28Å; R179-V183 PolarHBondContact O-N 3.28Å; V183-H185 PolarHBondContact O-N 3.06Å; V183-Q186 PolarHBondContact O-N 2.88Å; V183-A187 WeakPolarHBondContact O-CB 3.08Å; V183-A187 PolarHBondContact O-N 3.46Å; V183-L192 HydrophobicContact CB-CD1 4.43Å; V183-L192 HydrophobicContact CG1-CD1 3.66Å; V183-V195 HydrophobicContact CG1-CB 4.07Å; V183-V195 HydrophobicContact CG1-CG1 3.78Å
184	Q	94.8	Very high	94.7	Very high	137 Å²	137	49.5 Å²	49.5	64%	0.64	29%	0.29	S	S	*	.	H	α-helix	trans	-61.4	-42.3	173.3	-175.4	-179.1	0	0	0	112.6	A180 A181 I182 L192	A180-Q184 WeakPolarHBondContact O-CB 3.47Å; A180-Q184 PolarHBondContact O-N 3.31Å; A181-Q184 PolarHBondContact O-N 3.46Å; I182-Q184 VanDerWaalsContact C-N 3.28Å; I182-Q184 PolarHBondContact O-N 2.88Å; Q184-L192 HydrophobicContact CB-CD1 4.2Å
185	H	94.6	Very high	94.8	Very high	29 Å²	29	49.4 Å²	49.4	13%	0.134	29%	0.289	C	S	.	.	H	α-helix	trans	-64.6	-40.2	174.2	165.2	74.7	0	0	0	112.2	D57 A181 I182 V183 A187 K251 L252	D57-H185 IonicContact OD1-CD2 2.77Å; D57-H185 IonicContact OD1-NE2 3.03Å; D57-H185 PolarHBondContact OD1-NE2 3.47Å; D57-H185 IonicContact OD2-CD2 3.08Å; D57-H185 IonicContact OD2-CE1 3.77Å; D57-H185 IonicContact OD2-NE2 2.76Å; D57-H185 PolarHBondContact OD2-NE2 3.47Å; A181-H185 PolarHBondContact O-N 2.96Å; I182-H185 WeakPolarHBondContact O-CB 3.2Å; I182-H185 PolarHBondContact O-N 3.42Å; I182-H185 VanDerWaalsContact O-N 3.13Å; V183-H185 PolarHBondContact O-N 3.06Å; H185-A187 VanDerWaalsContact C-N 3.34Å; H185-A187 PolarHBondContact O-N 2.83Å; H185-K251 PolarHBondContact CE1-O 3.38Å; H185-L252 HydrophobicContact CB-CD2 3.85Å
186	Q	96.9	Very high	95	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-72.1	-26.5	-178.4	-73.3	174.7	-16.1	0	0	113.3	V54 S55 Y58 I182 V183 I188 V195	V54-Q186 CarbonylContact C-O 3.6Å; V54-Q186 WeakPolarHBondContact CA-O 3.41Å; S55-Q186 PolarHBondContact N-O 3.26Å; S55-Q186 VanDerWaalsContact N-O 3.1Å; S55-Q186 WeakPolarHBondContact OG-CA 3.42Å; S55-Q186 WeakPolarHBondContact OG-CG 3.2Å; Y58-Q186 HydrophobicContact CD2-CB 4.14Å; Y58-Q186 HydrophobicContact CD2-CG 4.06Å; I182-Q186 HydrophobicContact CG2-CG 4.3Å; I182-Q186 WeakPolarHBondContact O-CB 3.32Å; I182-Q186 WeakPolarHBondContact O-CG 3.44Å; I182-Q186 PolarHBondContact O-N 3.02Å; V183-Q186 PolarHBondContact O-N 2.88Å; Q186-I188 PolarHBondContact O-N 3.25Å; Q186-V195 HydrophobicContact CB-CG1 4.02Å
187	A	96.8	Very high	95.2	Very high	19 Å²	19	50.4 Å²	50.4	16%	0.157	30%	0.297	C	S	.	.	B	Isolated β-bridge	trans	-83.8	91.1	-179.1	0	0	0	0	0	112.3	V183 H185 N191 L192 V195	V183-A187 WeakPolarHBondContact O-CB 3.08Å; V183-A187 PolarHBondContact O-N 3.46Å; H185-A187 VanDerWaalsContact C-N 3.34Å; H185-A187 PolarHBondContact O-N 2.83Å; A187-N191 WeakPolarHBondContact CA-OD1 3.27Å; A187-L192 HydrophobicContact CB-CB 4.15Å; A187-L192 HydrophobicContact CB-CD1 4.12Å; A187-V195 HydrophobicContact CB-CB 4.39Å; A187-V195 HydrophobicContact CB-CG2 4Å
188	I	94.3	Very high	95.3	Very high	77 Å²	77	50.9 Å²	50.9	40%	0.395	29%	0.294	S	S	.	.			trans	-92.7	-8.5	-176.7	63.8	167.7	0	0	0	114.4	S52 S53 V54 Q186 N191	S52-I188 WeakPolarHBondContact O-CD1 3.2Å; S53-I188 VanDerWaalsContact C-CG1 3.41Å; S53-I188 WeakPolarHBondContact O-CG1 3.3Å; V54-I188 WeakPolarHBondContact O-CD1 3.37Å; Q186-I188 PolarHBondContact O-N 3.25Å; I188-N191 PolarHBondContact N-OD1 2.74Å
189	N	92.9	Very high	95.4	Very high	112 Å²	112	51 Å²	51	60%	0.599	30%	0.295	S	S	*	.	S	Bend	trans	-123.9	43.5	-177.1	-166.3	21.1	0	0	0	112.8	N191	N189-N191 PolarHBondContact N-OD1 2.92Å; N189-N191 VanDerWaalsContact N-OD1 3.13Å; N189-N191 PolarHBondContact O-N 3.27Å
190	N	93.3	Very high	95.5	Very high	170 Å²	170	48.5 Å²	48.5	91%	0.909	29%	0.292	S	S	*	.	S	Bend	trans	51.6	28.6	-176.3	-65.3	-41.9	0	0	0	113.7
191	N	95.2	Very high	95.6	Very high	20 Å²	20	48 Å²	48	11%	0.107	29%	0.285	C	S	.	.			trans	-104.7	28	-173.8	59.5	-30.6	0	0	0	112.2	S53 A187 I188 N189 A193 D194 V195	S53-N191 WeakPolarHBondContact CB-ND2 3.4Å; S53-N191 PolarHBondContact O-ND2 3.18Å; S53-N191 PolarHBondContact O-OD1 3.2Å; S53-N191 PolarHBondContact OG-ND2 3.26Å; A187-N191 WeakPolarHBondContact CA-OD1 3.27Å; I188-N191 PolarHBondContact N-OD1 2.74Å; N189-N191 PolarHBondContact N-OD1 2.92Å; N189-N191 VanDerWaalsContact N-OD1 3.13Å; N189-N191 PolarHBondContact O-N 3.27Å; N191-A193 VanDerWaalsContact C-N 3.35Å; N191-A193 PolarHBondContact O-N 3.41Å; N191-D194 HydrophobicContact CB-CB 4.45Å; N191-D194 PolarHBondContact O-N 2.96Å; N191-V195 WeakPolarHBondContact O-CG2 3.08Å; N191-V195 PolarHBondContact O-N 3.49Å
192	L	96.2	Very high	95.8	Very high	87 Å²	87	48.3 Å²	48.3	46%	0.455	28%	0.284	S	S	.	.	H	α-helix	trans	-51.5	-49.2	-174.1	-179.6	64.7	0	0	0	113.3	V183 Q184 A187 D194 V195 S196	V183-L192 HydrophobicContact CB-CD1 4.43Å; V183-L192 HydrophobicContact CG1-CD1 3.66Å; Q184-L192 HydrophobicContact CB-CD1 4.2Å; A187-L192 HydrophobicContact CB-CB 4.15Å; A187-L192 HydrophobicContact CB-CD1 4.12Å; L192-D194 VanDerWaalsContact C-N 3.31Å; L192-D194 PolarHBondContact O-N 2.81Å; L192-V195 PolarHBondContact O-N 2.91Å; L192-S196 WeakPolarHBondContact O-CB 3.45Å; L192-S196 PolarHBondContact O-N 2.95Å
193	A	97	Very high	95.8	Very high	80 Å²	80	51.2 Å²	51.2	66%	0.661	30%	0.298	S	S	*	.	H	α-helix	trans	-65.6	-35.7	-178.9	0	0	0	0	0	112.3	N191 A197	N191-A193 VanDerWaalsContact C-N 3.35Å; N191-A193 PolarHBondContact O-N 3.41Å; A193-A197 WeakPolarHBondContact O-CB 3.38Å; A193-A197 PolarHBondContact O-N 3.19Å
194	D	96.6	Very high	95.8	Very high	38 Å²	38	55.3 Å²	55.3	20%	0.203	32%	0.323	C	S	.	.	H	α-helix	trans	-69.8	-49.5	177.4	-175.5	46	0	0	0	110.5	P47 V48 N191 L192 S196 A197 K198	P47-D194 VanDerWaalsContact CA-OD2 3.31Å; P47-D194 WeakPolarHBondContact CA-OD2 3.49Å; V48-D194 PolarHBondContact N-OD2 3.25Å; N191-D194 HydrophobicContact CB-CB 4.45Å; N191-D194 PolarHBondContact O-N 2.96Å; L192-D194 VanDerWaalsContact C-N 3.31Å; L192-D194 PolarHBondContact O-N 2.81Å; D194-S196 VanDerWaalsContact C-N 3.27Å; D194-S196 PolarHBondContact O-N 3.45Å; D194-A197 PolarHBondContact O-N 2.91Å; D194-K198 VanDerWaalsContact O-CG 3.3Å; D194-K198 WeakPolarHBondContact O-CG 3.21Å; D194-K198 PolarHBondContact O-N 3.13Å; D194-K198 WeakPolarHBondContact OD1-CE 3.49Å; D194-K198 IonicContact OD1-NZ 3.78Å
195	V	97.6	Very high	95.9	Very high	0 Å²	0	52 Å²	52	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-53.5	-46.9	174.4	176.8	0	0	0	0	110.8	P47 V54 Y58 V183 Q186 A187 N191 L192 A197 K198 D199	P47-V195 HydrophobicContact CB-CG2 4.17Å; P47-V195 HydrophobicContact CG-CG2 4Å; V54-V195 HydrophobicContact CG1-CG2 4.07Å; Y58-V195 HydrophobicContact CE2-CG1 4.23Å; V183-V195 HydrophobicContact CG1-CB 4.07Å; V183-V195 HydrophobicContact CG1-CG1 3.78Å; Q186-V195 HydrophobicContact CB-CG1 4.02Å; A187-V195 HydrophobicContact CB-CB 4.39Å; A187-V195 HydrophobicContact CB-CG2 4Å; N191-V195 WeakPolarHBondContact O-CG2 3.08Å; N191-V195 PolarHBondContact O-N 3.49Å; L192-V195 PolarHBondContact O-N 2.91Å; V195-A197 PolarHBondContact O-N 3.22Å; V195-K198 PolarHBondContact O-N 3.08Å; V195-D199 WeakPolarHBondContact O-CB 3.32Å; V195-D199 PolarHBondContact O-N 3.25Å
196	S	96.9	Very high	95.9	Very high	58 Å²	58	50.8 Å²	50.8	41%	0.406	30%	0.304	S	S	.	.	H	α-helix	trans	-61.8	-40.8	177.6	-175.8	0	0	0	0	112.9	L192 D194 G200	L192-S196 WeakPolarHBondContact O-CB 3.45Å; L192-S196 PolarHBondContact O-N 2.95Å; D194-S196 VanDerWaalsContact C-N 3.27Å; D194-S196 PolarHBondContact O-N 3.45Å; S196-G200 PolarHBondContact O-N 3.03Å
197	A	97.1	Very high	95.9	Very high	54 Å²	54	53.4 Å²	53.4	45%	0.446	32%	0.318	S	S	.	.	H	α-helix	trans	-70	-35.6	179.5	0	0	0	0	0	112.5	A193 D194 V195 S201	A193-A197 WeakPolarHBondContact O-CB 3.38Å; A193-A197 PolarHBondContact O-N 3.19Å; D194-A197 PolarHBondContact O-N 2.91Å; V195-A197 PolarHBondContact O-N 3.22Å; A197-S201 PolarHBondContact O-N 3.24Å; A197-S201 PolarHBondContact O-OG 3.29Å
198	K	96.5	Very high	95.8	Very high	33 Å²	33	56.6 Å²	56.6	14%	0.143	33%	0.332	C	S	.	.	H	α-helix	trans	-72.3	-45.1	176.9	-63	-54	176.2	-153.5	0	112	K43 F44 L46 P47 D194 V195 G200 S201 Q202	K43-K198 WeakPolarHBondContact O-CE 3.45Å; K43-K198 PolarHBondContact O-NZ 2.98Å; F44-K198 WeakPolarHBondContact O-CD 3.38Å; L46-K198 WeakPolarHBondContact O-CD 3.45Å; L46-K198 VanDerWaalsContact O-CE 3.27Å; L46-K198 WeakPolarHBondContact O-CE 3.19Å; P47-K198 HydrophobicContact CG-CB 4.19Å; P47-K198 HydrophobicContact CG-CG 4.12Å; D194-K198 VanDerWaalsContact O-CG 3.3Å; D194-K198 WeakPolarHBondContact O-CG 3.21Å; D194-K198 PolarHBondContact O-N 3.13Å; D194-K198 WeakPolarHBondContact OD1-CE 3.49Å; D194-K198 IonicContact OD1-NZ 3.78Å; V195-K198 PolarHBondContact O-N 3.08Å; K198-G200 VanDerWaalsContact C-N 3.31Å; K198-G200 PolarHBondContact O-N 2.82Å; K198-S201 WeakPolarHBondContact O-CA 3.37Å; K198-S201 WeakPolarHBondContact O-CB 3.01Å; K198-S201 PolarHBondContact O-N 3.3Å; K198-Q202 WeakPolarHBondContact O-CG 3.36Å; K198-Q202 PolarHBondContact O-N 3.34Å
199	D	95.7	Very high	95.9	Very high	3 Å²	3	58 Å²	58	2%	0.016	34%	0.338	C	S	.	.	H	α-helix	trans	-53.2	-48.2	171	-179.8	74.5	0	0	0	110.9	Q62 R179 V195 S201 Q202 E203	Q62-D199 PolarHBondContact NE2-OD1 3.02Å; Q62-D199 PolarHBondContact OE1-OD1 2.84Å; R179-D199 IonicContact CZ-OD2 3.74Å; R179-D199 IonicContact NE-OD2 2.82Å; R179-D199 PolarHBondContact NE-OD2 3.41Å; R179-D199 IonicContact NH2-OD2 3.81Å; R179-D199 PolarHBondContact NH2-OD2 2.81Å; V195-D199 WeakPolarHBondContact O-CB 3.32Å; V195-D199 PolarHBondContact O-N 3.25Å; D199-S201 VanDerWaalsContact C-N 3.34Å; D199-S201 PolarHBondContact O-N 3.49Å; D199-Q202 PolarHBondContact O-N 3.35Å; D199-E203 PolarHBondContact O-N 3.26Å
200	G	95.4	Very high	96.1	Very high	21 Å²	21	52.6 Å²	52.6	22%	0.216	31%	0.309	C	S	.	.	H	α-helix	trans	-60.2	-38.2	173.6	0	0	0	0	0	114.3	S196 K198 T204	S196-G200 PolarHBondContact O-N 3.03Å; K198-G200 VanDerWaalsContact C-N 3.31Å; K198-G200 PolarHBondContact O-N 2.82Å; G200-T204 WeakPolarHBondContact O-CB 3.37Å; G200-T204 PolarHBondContact O-N 2.7Å; G200-T204 PolarHBondContact O-OG1 3.03Å
201	S	96.5	Very high	96.1	Very high	48 Å²	48	51 Å²	51	34%	0.336	29%	0.291	S	S	.	.	H	α-helix	trans	-67	-40	175.7	-60.4	0	0	0	0	112.5	A197 K198 D199 T204 L205	A197-S201 PolarHBondContact O-N 3.24Å; A197-S201 PolarHBondContact O-OG 3.29Å; K198-S201 WeakPolarHBondContact O-CA 3.37Å; K198-S201 WeakPolarHBondContact O-CB 3.01Å; K198-S201 PolarHBondContact O-N 3.3Å; D199-S201 VanDerWaalsContact C-N 3.34Å; D199-S201 PolarHBondContact O-N 3.49Å; S201-T204 PolarHBondContact O-N 2.74Å; S201-L205 WeakPolarHBondContact O-CB 3.31Å; S201-L205 PolarHBondContact O-N 3.42Å
202	Q	96.1	Very high	96.2	Very high	21 Å²	21	54.8 Å²	54.8	10%	0.098	31%	0.31	C	S	.	.	H	α-helix	trans	-65.6	-47.7	177.6	-69.9	177.5	21	0	0	111.5	F45 Y58 Q62 K198 D199 T204 L205 S206	F45-Q202 HydrophobicContact CB-CG 4.27Å; F45-Q202 HydrophobicContact CD1-CG 4.33Å; F45-Q202 PolarHBondContact O-NE2 2.95Å; Y58-Q202 PolarHBondContact OH-NE2 3.1Å; Q62-Q202 VanDerWaalsContact CB-OE1 3.32Å; Q62-Q202 VanDerWaalsContact CG-OE1 3.28Å; K198-Q202 WeakPolarHBondContact O-CG 3.36Å; K198-Q202 PolarHBondContact O-N 3.34Å; D199-Q202 PolarHBondContact O-N 3.35Å; Q202-T204 VanDerWaalsContact C-N 3.32Å; Q202-T204 PolarHBondContact O-N 3.36Å; Q202-L205 PolarHBondContact O-N 3.02Å; Q202-S206 PolarHBondContact O-N 3.01Å
203	E	95.3	Very high	96.1	Very high	62 Å²	62	53.9 Å²	53.9	29%	0.29	31%	0.305	S	S	.	.	H	α-helix	trans	-59.5	-44.3	175.3	-173.8	-170.7	164.9	0	0	111.3	A69 R179 D199 L205 S206 N207	A69-E203 HydrophobicContact CB-CG 4.41Å; R179-E203 IonicContact CZ-OE2 3.75Å; R179-E203 IonicContact NH1-OE2 3.42Å; R179-E203 PolarHBondContact NH1-OE2 3.17Å; R179-E203 IonicContact NH2-OE2 3.05Å; R179-E203 PolarHBondContact NH2-OE2 3.38Å; D199-E203 PolarHBondContact O-N 3.26Å; E203-L205 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 3.25Å; E203-S206 WeakPolarHBondContact O-CB 3.43Å; E203-S206 PolarHBondContact O-N 3.5Å; E203-N207 WeakPolarHBondContact O-CB 3.34Å; E203-N207 PolarHBondContact O-N 2.88Å; E203-N207 PolarHBondContact O-ND2 3.5Å
204	T	96.5	Very high	96.1	Very high	92 Å²	92	50.6 Å²	50.6	56%	0.564	28%	0.277	S	S	*	.	H	α-helix	trans	-61.4	-42	177.6	-59.7	0	0	0	0	111.7	G200 S201 Q202 N207 L208	G200-T204 WeakPolarHBondContact O-CB 3.37Å; G200-T204 PolarHBondContact O-N 2.7Å; G200-T204 PolarHBondContact O-OG1 3.03Å; S201-T204 PolarHBondContact O-N 2.74Å; Q202-T204 VanDerWaalsContact C-N 3.32Å; Q202-T204 PolarHBondContact O-N 3.36Å; T204-N207 PolarHBondContact O-N 3.06Å; T204-L208 WeakPolarHBondContact O-CB 3.29Å; T204-L208 PolarHBondContact O-N 2.81Å
205	L	95.8	Very high	95.9	Very high	69 Å²	69	54.7 Å²	54.7	36%	0.361	29%	0.293	S	S	.	.	H	α-helix	trans	-62.4	-44.6	175.3	177.6	65	0	0	0	111.3	F45 S201 Q202 E203 N207 L208 M209	F45-L205 HydrophobicContact CD1-CD2 4.24Å; F45-L205 HydrophobicContact CE1-CB 3.91Å; F45-L205 HydrophobicContact CE1-CD2 3.66Å; F45-L205 HydrophobicContact CE1-CG 4.29Å; F45-L205 HydrophobicContact CE2-CD2 4.37Å; F45-L205 HydrophobicContact CZ-CD2 3.73Å; F45-L205 HydrophobicContact CZ-CG 4.48Å; S201-L205 WeakPolarHBondContact O-CB 3.31Å; S201-L205 PolarHBondContact O-N 3.42Å; Q202-L205 PolarHBondContact O-N 3.02Å; E203-L205 VanDerWaalsContact C-N 3.34Å; E203-L205 PolarHBondContact O-N 3.25Å; L205-N207 VanDerWaalsContact C-N 3.34Å; L205-N207 PolarHBondContact O-N 2.89Å; L205-L208 WeakPolarHBondContact O-CB 3.44Å; L205-L208 PolarHBondContact O-N 3.48Å; L205-M209 HydrophobicContact CG-SD 4.42Å; L205-M209 WeakPolarHBondContact O-CG 3.49Å; L205-M209 PolarHBondContact O-N 3.23Å
206	S	95.9	Very high	95.8	Very high	3 Å²	3	59.9 Å²	59.9	2%	0.021	32%	0.32	C	S	.	.	H	α-helix	trans	-57.9	-48	176.3	-170.9	0	0	0	0	111.5	T66 F70 Q202 E203 L208 M209 A210	T66-S206 PolarHBondContact O-OG 3.23Å; F70-S206 WeakPolarHBondContact CB-OG 3.33Å; F70-S206 PolarHBondContact N-OG 2.88Å; Q202-S206 PolarHBondContact O-N 3.01Å; E203-S206 WeakPolarHBondContact O-CB 3.43Å; E203-S206 PolarHBondContact O-N 3.5Å; S206-L208 VanDerWaalsContact C-N 3.33Å; S206-L208 PolarHBondContact O-N 2.79Å; S206-M209 PolarHBondContact O-N 2.94Å; S206-A210 PolarHBondContact O-N 3.31Å
207	N	95.8	Very high	95.7	Very high	54 Å²	54	58.3 Å²	58.3	29%	0.289	31%	0.306	S	S	.	.	H	α-helix	trans	-62.2	-38	176.7	-74.9	-33.6	0	0	0	112.6	E203 T204 L205 A210 W211	E203-N207 WeakPolarHBondContact O-CB 3.34Å; E203-N207 PolarHBondContact O-N 2.88Å; E203-N207 PolarHBondContact O-ND2 3.5Å; T204-N207 PolarHBondContact O-N 3.06Å; L205-N207 VanDerWaalsContact C-N 3.34Å; L205-N207 PolarHBondContact O-N 2.89Å; N207-A210 PolarHBondContact O-N 3.34Å; N207-W211 VanDerWaalsContact O-CB 3.23Å; N207-W211 WeakPolarHBondContact O-CB 3.49Å; N207-W211 PolarHBondContact O-N 3.2Å
208	L	96.3	Very high	95.5	Very high	87 Å²	87	58 Å²	58	46%	0.455	30%	0.297	S	S	.	.	H	α-helix	trans	-64.6	-41.6	175.6	-179.7	64	0	0	0	111.8	T204 L205 S206 W211 L212	T204-L208 WeakPolarHBondContact O-CB 3.29Å; T204-L208 PolarHBondContact O-N 2.81Å; L205-L208 WeakPolarHBondContact O-CB 3.44Å; L205-L208 PolarHBondContact O-N 3.48Å; S206-L208 VanDerWaalsContact C-N 3.33Å; S206-L208 PolarHBondContact O-N 2.79Å; L208-W211 HydrophobicContact CD1-CE3 3.83Å; L208-W211 HydrophobicContact CD1-CZ3 4.21Å; L208-W211 WeakPolarHBondContact O-CB 3.17Å; L208-W211 PolarHBondContact O-N 3.18Å; L208-L212 WeakPolarHBondContact O-CG 3.34Å; L208-L212 PolarHBondContact O-N 3.26Å
209	M	96.1	Very high	95.3	Very high	105 Å²	105	66.2 Å²	66.2	52%	0.517	33%	0.329	S	S	.	.	H	α-helix	trans	-65.1	-44.4	176.1	-69.7	176.9	64.8	0	0	111.6	F70 L205 S206 W211 L212 L213	F70-M209 HydrophobicContact CD2-CB 4.26Å; F70-M209 HydrophobicContact CE2-CB 4.04Å; L205-M209 HydrophobicContact CG-SD 4.42Å; L205-M209 WeakPolarHBondContact O-CG 3.49Å; L205-M209 PolarHBondContact O-N 3.23Å; S206-M209 PolarHBondContact O-N 2.94Å; M209-W211 VanDerWaalsContact C-N 3.3Å; M209-W211 PolarHBondContact O-N 3.08Å; M209-L212 PolarHBondContact O-N 2.9Å; M209-L213 PolarHBondContact O-N 2.98Å; M209-L213 VanDerWaalsContact O-N 3.14Å
210	A	96.7	Very high	95.2	Very high	0 Å²	0	72.1 Å²	72.1	0%	0	36%	0.358	C	S	.	.	H	α-helix	trans	-63	-39	175	0	0	0	0	0	111.6	F70 S73 I74 S206 N207 L212 L213 N214	F70-A210 HydrophobicContact CD2-CB 3.66Å; F70-A210 HydrophobicContact CE2-CB 3.86Å; F70-A210 HydrophobicContact CG-CB 4.24Å; S73-A210 VanDerWaalsContact CB-CB 3.44Å; S73-A210 VanDerWaalsContact OG-CB 3.32Å; S73-A210 WeakPolarHBondContact OG-CB 3.5Å; I74-A210 HydrophobicContact CG1-CB 4.45Å; S206-A210 PolarHBondContact O-N 3.31Å; N207-A210 PolarHBondContact O-N 3.34Å; A210-L212 PolarHBondContact O-N 2.78Å; A210-L213 PolarHBondContact O-N 3.38Å; A210-N214 WeakPolarHBondContact O-CB 3.49Å; A210-N214 PolarHBondContact O-N 3.39Å; A210-N214 PolarHBondContact O-ND2 3.47Å
211	W	93.9	Very high	95.1	Very high	136 Å²	136	71.4 Å²	71.4	52%	0.515	35%	0.349	S	S	.	.	H	α-helix	trans	-60.2	-44.2	174.6	175.5	82.2	0	0	0	112.6	N207 L208 M209 L213 N214 F215	N207-W211 VanDerWaalsContact O-CB 3.23Å; N207-W211 WeakPolarHBondContact O-CB 3.49Å; N207-W211 PolarHBondContact O-N 3.2Å; L208-W211 HydrophobicContact CD1-CE3 3.83Å; L208-W211 HydrophobicContact CD1-CZ3 4.21Å; L208-W211 WeakPolarHBondContact O-CB 3.17Å; L208-W211 PolarHBondContact O-N 3.18Å; M209-W211 VanDerWaalsContact C-N 3.3Å; M209-W211 PolarHBondContact O-N 3.08Å; W211-L213 VanDerWaalsContact C-N 3.33Å; W211-L213 PolarHBondContact O-N 3.12Å; W211-N214 PolarHBondContact O-N 3.37Å; W211-F215 AromaticContact CD2-CE2 3.76Å; W211-F215 HydrophobicContact CD2-CE2 3.76Å; W211-F215 AromaticContact CE2-CE2 3.41Å; W211-F215 VanDerWaalsContact CE2-CE2 3.41Å; W211-F215 AromaticContact CE2-CZ 3.75Å; W211-F215 AromaticContact CE3-CE2 3.88Å; W211-F215 HydrophobicContact CE3-CE2 3.88Å; W211-F215 AromaticContact CH2-CE2 3.43Å; W211-F215 HydrophobicContact CH2-CE2 3.43Å; W211-F215 VanDerWaalsContact CH2-CE2 3.43Å; W211-F215 AromaticContact CH2-CZ 3.78Å; W211-F215 HydrophobicContact CH2-CZ 3.78Å; W211-F215 AromaticContact CZ2-CE2 3.26Å; W211-F215 HydrophobicContact CZ2-CE2 3.26Å; W211-F215 AromaticContact CZ2-CZ 3.34Å; W211-F215 HydrophobicContact CZ2-CZ 3.34Å; W211-F215 AromaticContact CZ3-CE2 3.72Å; W211-F215 HydrophobicContact CZ3-CE2 3.72Å; W211-F215 WeakPolarHBondContact O-CD2 3.45Å; W211-F215 PolarHBondContact O-N 3.37Å
212	L	95.9	Very high	94.9	Very high	99 Å²	99	72.8 Å²	72.8	52%	0.518	36%	0.356	S	S	.	.	H	α-helix	trans	-59.6	-43.2	174.4	-72.8	172.1	0	0	0	111.9	L208 M209 A210 N214 F215	L208-L212 WeakPolarHBondContact O-CG 3.34Å; L208-L212 PolarHBondContact O-N 3.26Å; M209-L212 PolarHBondContact O-N 2.9Å; A210-L212 PolarHBondContact O-N 2.78Å; L212-N214 VanDerWaalsContact C-N 3.33Å; L212-F215 PolarHBondContact O-N 3.33Å
213	L	95.7	Very high	94.5	Very high	68 Å²	68	75.2 Å²	75.2	36%	0.356	39%	0.386	S	S	.	.	H	α-helix	trans	-65.3	-38.1	176.2	179.3	60.4	0	0	0	111.9	F70 I74 M209 A210 W211 F215 I216 L217	F70-L213 HydrophobicContact CE1-CD2 4.18Å; F70-L213 HydrophobicContact CZ-CD2 3.68Å; I74-L213 HydrophobicContact CD1-CD2 3.86Å; M209-L213 PolarHBondContact O-N 2.98Å; M209-L213 VanDerWaalsContact O-N 3.14Å; A210-L213 PolarHBondContact O-N 3.38Å; W211-L213 VanDerWaalsContact C-N 3.33Å; W211-L213 PolarHBondContact O-N 3.12Å; L213-F215 PolarHBondContact O-N 2.97Å; L213-I216 PolarHBondContact O-N 3.49Å; L213-L217 WeakPolarHBondContact O-CB 3.37Å; L213-L217 PolarHBondContact O-N 3.06Å
214	N	96	Very high	94.5	Very high	11 Å²	11	75.5 Å²	75.5	6%	0.059	39%	0.39	C	S	.	.	H	α-helix	trans	-62.1	-27.1	-178.3	-77.7	-29.3	0	0	0	113.3	S73 A77 A210 W211 L212 I216 L218	S73-N214 PolarHBondContact O-ND2 3.36Å; A77-N214 HydrophobicContact CB-CB 4.18Å; A77-N214 VanDerWaalsContact CB-ND2 3.35Å; A77-N214 WeakPolarHBondContact CB-ND2 3.48Å; A210-N214 WeakPolarHBondContact O-CB 3.49Å; A210-N214 PolarHBondContact O-N 3.39Å; A210-N214 PolarHBondContact O-ND2 3.47Å; W211-N214 PolarHBondContact O-N 3.37Å; L212-N214 VanDerWaalsContact C-N 3.33Å; N214-I216 VanDerWaalsContact C-N 3.3Å; N214-I216 PolarHBondContact O-N 2.9Å; N214-L218 VanDerWaalsContact O-CB 3.27Å; N214-L218 WeakPolarHBondContact O-CB 3.27Å; N214-L218 VanDerWaalsContact O-CG 3.28Å; N214-L218 WeakPolarHBondContact O-CG 3.41Å; N214-L218 PolarHBondContact O-N 2.92Å
215	F	93.5	Very high	94.4	Very high	125 Å²	125	75.7 Å²	75.7	55%	0.548	38%	0.384	S	S	.	.	H	α-helix	trans	-58.2	-43.4	171.2	-80.9	-74.2	0	0	0	112.8	W211 L212 L213	W211-F215 AromaticContact CD2-CE2 3.76Å; W211-F215 HydrophobicContact CD2-CE2 3.76Å; W211-F215 AromaticContact CE2-CE2 3.41Å; W211-F215 VanDerWaalsContact CE2-CE2 3.41Å; W211-F215 AromaticContact CE2-CZ 3.75Å; W211-F215 AromaticContact CE3-CE2 3.88Å; W211-F215 HydrophobicContact CE3-CE2 3.88Å; W211-F215 AromaticContact CH2-CE2 3.43Å; W211-F215 HydrophobicContact CH2-CE2 3.43Å; W211-F215 VanDerWaalsContact CH2-CE2 3.43Å; W211-F215 AromaticContact CH2-CZ 3.78Å; W211-F215 HydrophobicContact CH2-CZ 3.78Å; W211-F215 AromaticContact CZ2-CE2 3.26Å; W211-F215 HydrophobicContact CZ2-CE2 3.26Å; W211-F215 AromaticContact CZ2-CZ 3.34Å; W211-F215 HydrophobicContact CZ2-CZ 3.34Å; W211-F215 AromaticContact CZ3-CE2 3.72Å; W211-F215 HydrophobicContact CZ3-CE2 3.72Å; W211-F215 WeakPolarHBondContact O-CD2 3.45Å; W211-F215 PolarHBondContact O-N 3.37Å; L212-F215 PolarHBondContact O-N 3.33Å; L213-F215 PolarHBondContact O-N 2.97Å
216	I	94.1	Very high	94.4	Very high	108 Å²	108	79.6 Å²	79.6	55%	0.554	40%	0.399	S	S	*	.	H	α-helix	trans	-77.8	-48	-179.1	-58.5	172.4	0	0	0	108.9	L213 N214 L218 Y219 M220	L213-I216 PolarHBondContact O-N 3.49Å; N214-I216 VanDerWaalsContact C-N 3.3Å; N214-I216 PolarHBondContact O-N 2.9Å; I216-L218 PolarHBondContact O-N 3.11Å; I216-Y219 PolarHBondContact O-N 3.44Å; I216-M220 HydrophobicContact CG2-SD 3.95Å; I216-M220 WeakPolarHBondContact O-CG 3.27Å; I216-M220 PolarHBondContact O-N 2.65Å
217	L	94.4	Very high	94.4	Very high	25 Å²	25	81.9 Å²	81.9	13%	0.131	41%	0.41	C	S	.	.	H	α-helix	trans	-61.8	-44.8	-174.5	-176.5	142.9	0	0	0	112.1	I74 L78 L213 Y219 M220 V221	I74-L217 HydrophobicContact CG2-CD1 3.89Å; I74-L217 HydrophobicContact CG2-CD2 4.27Å; L78-L217 HydrophobicContact CD2-CD2 3.85Å; L78-L217 HydrophobicContact CG-CD2 4.44Å; L213-L217 WeakPolarHBondContact O-CB 3.37Å; L213-L217 PolarHBondContact O-N 3.06Å; L217-Y219 VanDerWaalsContact C-N 3.33Å; L217-Y219 PolarHBondContact O-N 3.44Å; L217-M220 PolarHBondContact O-N 3.42Å; L217-M220 VanDerWaalsContact O-N 3.17Å; L217-V221 HydrophobicContact CD2-CG2 4.14Å; L217-V221 HydrophobicContact CG-CG2 4.14Å; L217-V221 VanDerWaalsContact O-CB 3.31Å; L217-V221 WeakPolarHBondContact O-CB 3.31Å; L217-V221 VanDerWaalsContact O-CG2 3.27Å; L217-V221 WeakPolarHBondContact O-CG2 3.31Å; L217-V221 PolarHBondContact O-N 3.06Å
218	L	93.6	Very high	94.4	Very high	47 Å²	47	79.9 Å²	79.9	25%	0.246	40%	0.4	C	S	.	.	H	α-helix	trans	-63.4	-39.4	179.4	-71.7	175.3	0	0	0	111.6	A77 L78 Q81 N214 I216 M220 V221 T222	A77-L218 HydrophobicContact CB-CD1 4.42Å; A77-L218 HydrophobicContact CB-CD2 4.43Å; L78-L218 HydrophobicContact CD2-CD2 4.24Å; Q81-L218 HydrophobicContact CB-CD2 4.42Å; N214-L218 VanDerWaalsContact O-CB 3.27Å; N214-L218 WeakPolarHBondContact O-CB 3.27Å; N214-L218 VanDerWaalsContact O-CG 3.28Å; N214-L218 WeakPolarHBondContact O-CG 3.41Å; N214-L218 PolarHBondContact O-N 2.92Å; I216-L218 PolarHBondContact O-N 3.11Å; L218-M220 VanDerWaalsContact C-N 3.28Å; L218-M220 PolarHBondContact O-N 3.04Å; L218-V221 PolarHBondContact O-N 3.2Å; L218-T222 WeakPolarHBondContact O-CB 3.41Å; L218-T222 PolarHBondContact O-N 3.16Å; L218-T222 PolarHBondContact O-OG1 2.89Å
219	Y	92.9	Very high	94.5	Very high	207 Å²	207	78.7 Å²	78.7	81%	0.812	39%	0.389	S	S	*	.	H	α-helix	trans	-61.7	-37.6	176.2	-173.9	-95.1	0	0	0	112.2	I216 L217	I216-Y219 PolarHBondContact O-N 3.44Å; L217-Y219 VanDerWaalsContact C-N 3.33Å; L217-Y219 PolarHBondContact O-N 3.44Å
220	M	93.3	Very high	94.5	Very high	127 Å²	127	79 Å²	79	63%	0.626	39%	0.388	S	S	*	.	H	α-helix	trans	-75.3	-34.3	179.7	-65.8	177.9	68.5	0	0	113.4	I216 L217 L218	I216-M220 HydrophobicContact CG2-SD 3.95Å; I216-M220 WeakPolarHBondContact O-CG 3.27Å; I216-M220 PolarHBondContact O-N 2.65Å; L217-M220 PolarHBondContact O-N 3.42Å; L217-M220 VanDerWaalsContact O-N 3.17Å; L218-M220 VanDerWaalsContact C-N 3.28Å; L218-M220 PolarHBondContact O-N 3.04Å
221	V	93.6	Very high	94.5	Very high	5 Å²	5	80.1 Å²	80.1	3%	0.03	40%	0.395	C	S	.	.	H	α-helix	trans	-92.8	-27.1	-170	170.5	0	0	0	0	112.4	L78 L217 L218 G223 N224 L227 I228	L78-V221 HydrophobicContact CD2-CB 4.46Å; L78-V221 HydrophobicContact CD2-CG1 3.76Å; L217-V221 HydrophobicContact CD2-CG2 4.14Å; L217-V221 HydrophobicContact CG-CG2 4.14Å; L217-V221 VanDerWaalsContact O-CB 3.31Å; L217-V221 WeakPolarHBondContact O-CB 3.31Å; L217-V221 VanDerWaalsContact O-CG2 3.27Å; L217-V221 WeakPolarHBondContact O-CG2 3.31Å; L217-V221 PolarHBondContact O-N 3.06Å; L218-V221 PolarHBondContact O-N 3.2Å; V221-G223 PolarHBondContact O-N 3.26Å; V221-N224 PolarHBondContact O-N 2.85Å; V221-L227 HydrophobicContact CG1-CB 4.36Å; V221-L227 HydrophobicContact CG2-CB 4.08Å; V221-I228 HydrophobicContact CG1-CB 4Å; V221-I228 HydrophobicContact CG1-CD1 4.35Å; V221-I228 HydrophobicContact CG1-CG1 3.17Å
222	T	91.8	Very high	94.7	Very high	78 Å²	78	74.1 Å²	74.1	48%	0.479	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	125.7	-177.9	-60	0	0	0	0	111.4	Q81 L218 N224	Q81-T222 PolarHBondContact NE2-OG1 3.13Å; L218-T222 WeakPolarHBondContact O-CB 3.41Å; L218-T222 PolarHBondContact O-N 3.16Å; L218-T222 PolarHBondContact O-OG1 2.89Å; T222-N224 PolarHBondContact O-N 3.4Å
223	G	88.6	Confident	94.8	Very high	72 Å²	72	74.2 Å²	74.2	74%	0.742	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.8	-9.9	-179.2	0	0	0	0	0	114.9	V221	V221-G223 PolarHBondContact O-N 3.26Å
224	N	94.8	Very high	95	Very high	68 Å²	68	73.4 Å²	73.4	36%	0.364	37%	0.372	S	S	.	.			trans	-105.4	92.6	176.9	-169.9	-29.5	0	0	0	111.1	V221 T222 F226 L227 I228	V221-N224 PolarHBondContact O-N 2.85Å; T222-N224 PolarHBondContact O-N 3.4Å; N224-F226 VanDerWaalsContact C-N 3.27Å; N224-F226 PolarHBondContact O-N 3.16Å; N224-F226 WeakPolarHBondContact OD1-CB 3.34Å; N224-F226 PolarHBondContact OD1-N 3.4Å; N224-L227 HydrophobicContact CB-CB 4.18Å; N224-L227 HydrophobicContact CB-CD1 4.06Å; N224-L227 HydrophobicContact CB-CG 4.22Å; N224-L227 WeakPolarHBondContact ND2-CD1 3.39Å; N224-L227 PolarHBondContact O-N 3.38Å; N224-L227 VanDerWaalsContact O-N 3.11Å; N224-L227 PolarHBondContact OD1-N 3.35Å; N224-L227 VanDerWaalsContact OD1-N 3.17Å; N224-I228 WeakPolarHBondContact O-CG1 3.33Å; N224-I228 PolarHBondContact O-N 2.75Å
225	Q	93.7	Very high	95.1	Very high	96 Å²	96	73.7 Å²	73.7	45%	0.449	38%	0.375	S	S	.	.	H	α-helix	trans	-58	-36.9	-178.8	-67.8	-60.7	-36.2	0	0	113.2	L227 I228 W229	Q225-L227 VanDerWaalsContact C-N 3.35Å; Q225-L227 PolarHBondContact O-N 2.91Å; Q225-I228 PolarHBondContact O-N 2.67Å; Q225-W229 PolarHBondContact O-N 3.34Å
226	F	96.2	Very high	95.3	Very high	151 Å²	151	68.6 Å²	68.6	66%	0.662	35%	0.354	S	S	*	.	H	α-helix	trans	-60.9	-46	177	173.4	-95.9	0	0	0	111.1	N224 W229 F230	N224-F226 VanDerWaalsContact C-N 3.27Å; N224-F226 PolarHBondContact O-N 3.16Å; N224-F226 WeakPolarHBondContact OD1-CB 3.34Å; N224-F226 PolarHBondContact OD1-N 3.4Å; F226-W229 PolarHBondContact O-N 2.79Å; F226-F230 WeakPolarHBondContact O-CB 3.5Å; F226-F230 PolarHBondContact O-N 3.13Å
227	L	96.1	Very high	95.5	Very high	51 Å²	51	66.9 Å²	66.9	27%	0.267	35%	0.351	S	S	.	.	H	α-helix	trans	-68	-37.8	178.5	-67.6	178.8	0	0	0	112.5	V221 N224 Q225 W229 F230 C231	V221-L227 HydrophobicContact CG1-CB 4.36Å; V221-L227 HydrophobicContact CG2-CB 4.08Å; N224-L227 HydrophobicContact CB-CB 4.18Å; N224-L227 HydrophobicContact CB-CD1 4.06Å; N224-L227 HydrophobicContact CB-CG 4.22Å; N224-L227 WeakPolarHBondContact ND2-CD1 3.39Å; N224-L227 PolarHBondContact O-N 3.38Å; N224-L227 VanDerWaalsContact O-N 3.11Å; N224-L227 PolarHBondContact OD1-N 3.35Å; N224-L227 VanDerWaalsContact OD1-N 3.17Å; Q225-L227 VanDerWaalsContact C-N 3.35Å; Q225-L227 PolarHBondContact O-N 2.91Å; L227-W229 PolarHBondContact O-N 3.21Å; L227-F230 PolarHBondContact O-N 3.47Å; L227-C231 VanDerWaalsContact O-CB 3.3Å; L227-C231 WeakPolarHBondContact O-CB 3.48Å; L227-C231 PolarHBondContact O-N 3.48Å; L227-C231 PolarHBondContact O-SG 3.21Å; L227-C231 VanDerWaalsContact O-SG 3.34Å
228	I	96.4	Very high	95.7	Very high	12 Å²	12	69.7 Å²	69.7	6%	0.062	37%	0.366	C	S	.	.	H	α-helix	trans	-55.5	-54.1	174.5	-66.8	168.6	0	0	0	109.7	I148 V221 N224 Q225 C231 F232	I148-I228 HydrophobicContact CG2-CG2 4.19Å; V221-I228 HydrophobicContact CG1-CB 4Å; V221-I228 HydrophobicContact CG1-CD1 4.35Å; V221-I228 HydrophobicContact CG1-CG1 3.17Å; N224-I228 WeakPolarHBondContact O-CG1 3.33Å; N224-I228 PolarHBondContact O-N 2.75Å; Q225-I228 PolarHBondContact O-N 2.67Å; I228-C231 PolarHBondContact O-N 3.39Å; I228-F232 VanDerWaalsContact O-CB 3.28Å; I228-F232 WeakPolarHBondContact O-CB 3.49Å; I228-F232 PolarHBondContact O-N 2.83Å
229	W	97.2	Very high	95.9	Very high	61 Å²	61	67.4 Å²	67.4	23%	0.231	35%	0.354	C	S	.	.	H	α-helix	trans	-68.7	-38.8	-177	-76.5	111.4	0	0	0	112.8	F145 I148 I149 Q225 F226 L227 F232 I233	F145-W229 AromaticContact CD2-CH2 3.83Å; F145-W229 HydrophobicContact CD2-CH2 3.83Å; F145-W229 AromaticContact CD2-CZ3 3.73Å; F145-W229 HydrophobicContact CD2-CZ3 3.73Å; F145-W229 AromaticContact CE2-CH2 3.64Å; F145-W229 HydrophobicContact CE2-CH2 3.64Å; F145-W229 AromaticContact CE2-CZ3 3.72Å; F145-W229 HydrophobicContact CE2-CZ3 3.72Å; I148-W229 HydrophobicContact CB-CH2 4.23Å; I148-W229 HydrophobicContact CG2-CH2 3.61Å; I148-W229 HydrophobicContact CG2-CZ2 3.51Å; I148-W229 HydrophobicContact CG2-CZ3 4.22Å; I149-W229 HydrophobicContact CG2-CH2 3.52Å; I149-W229 HydrophobicContact CG2-CZ2 3.8Å; Q225-W229 PolarHBondContact O-N 3.34Å; F226-W229 PolarHBondContact O-N 2.79Å; L227-W229 PolarHBondContact O-N 3.21Å; W229-F232 AromaticContact CE3-CD1 3.99Å; W229-F232 HydrophobicContact CE3-CD1 3.99Å; W229-F232 AromaticContact CZ3-CD1 3.8Å; W229-F232 HydrophobicContact CZ3-CD1 3.8Å; W229-F232 HydrophobicContact CZ3-CE1 4.18Å; W229-F232 PolarHBondContact O-N 3.49Å; W229-I233 WeakPolarHBondContact O-CB 3.23Å; W229-I233 VanDerWaalsContact O-CG1 3.25Å; W229-I233 WeakPolarHBondContact O-CG1 3.34Å; W229-I233 PolarHBondContact O-N 3.2Å
230	F	97.2	Very high	96.1	Very high	112 Å²	112	60 Å²	60	49%	0.491	33%	0.328	S	S	.	.	H	α-helix	trans	-59.9	-52.1	174.5	178.3	-98.1	0	0	0	111.2	F226 L227 F232 I233 C234	F226-F230 WeakPolarHBondContact O-CB 3.5Å; F226-F230 PolarHBondContact O-N 3.13Å; L227-F230 PolarHBondContact O-N 3.47Å; F230-F232 VanDerWaalsContact C-N 3.34Å; F230-F232 PolarHBondContact O-N 2.88Å; F230-I233 PolarHBondContact O-N 3.34Å; F230-C234 WeakPolarHBondContact O-CB 3.35Å; F230-C234 PolarHBondContact O-N 3.27Å; F230-C234 PolarHBondContact O-SG 3.25Å; F230-C234 VanDerWaalsContact O-SG 3.35Å
231	C	96.7	Very high	96.4	Very high	23 Å²	23	59.6 Å²	59.6	16%	0.155	32%	0.32	C	S	.	.	H	α-helix	trans	-60.5	-43.5	177	-72.8	0	0	0	0	111.7	L78 L227 I228 C235	L78-C231 HydrophobicContact CD1-CB 3.81Å; L227-C231 VanDerWaalsContact O-CB 3.3Å; L227-C231 WeakPolarHBondContact O-CB 3.48Å; L227-C231 PolarHBondContact O-N 3.48Å; L227-C231 PolarHBondContact O-SG 3.21Å; L227-C231 VanDerWaalsContact O-SG 3.34Å; I228-C231 PolarHBondContact O-N 3.39Å; C231-C235 VanDerWaalsContact O-CB 3.25Å; C231-C235 WeakPolarHBondContact O-CB 3.3Å; C231-C235 PolarHBondContact O-N 2.98Å; C231-C235 PolarHBondContact O-SG 3.31Å
232	F	97.8	Very high	96.6	Very high	11 Å²	11	59.5 Å²	59.5	5%	0.048	32%	0.32	C	S	.	.	H	α-helix	trans	-60.4	-50.1	178.6	-179.8	-104.5	0	0	0	111.9	T75 L78 L144 F145 I148 I228 W229 F230 T236	T75-F232 HydrophobicContact CG2-CD2 3.81Å; T75-F232 HydrophobicContact CG2-CE2 4.23Å; L78-F232 HydrophobicContact CD1-CB 4.34Å; L144-F232 HydrophobicContact CB-CE2 3.89Å; L144-F232 HydrophobicContact CB-CZ 4.41Å; F145-F232 HydrophobicContact CB-CE1 4.12Å; F145-F232 HydrophobicContact CB-CZ 3.85Å; F145-F232 HydrophobicContact CD2-CE1 4.02Å; I148-F232 HydrophobicContact CD1-CB 4.16Å; I148-F232 HydrophobicContact CD1-CD1 4.34Å; I148-F232 HydrophobicContact CD1-CD2 3.24Å; I148-F232 HydrophobicContact CD1-CE2 3.63Å; I148-F232 HydrophobicContact CD1-CG 3.65Å; I148-F232 HydrophobicContact CD1-CZ 4.33Å; I228-F232 VanDerWaalsContact O-CB 3.28Å; I228-F232 WeakPolarHBondContact O-CB 3.49Å; I228-F232 PolarHBondContact O-N 2.83Å; W229-F232 AromaticContact CE3-CD1 3.99Å; W229-F232 HydrophobicContact CE3-CD1 3.99Å; W229-F232 AromaticContact CZ3-CD1 3.8Å; W229-F232 HydrophobicContact CZ3-CD1 3.8Å; W229-F232 HydrophobicContact CZ3-CE1 4.18Å; W229-F232 PolarHBondContact O-N 3.49Å; F230-F232 VanDerWaalsContact C-N 3.34Å; F230-F232 PolarHBondContact O-N 2.88Å; F232-T236 WeakPolarHBondContact O-CB 3.35Å; F232-T236 PolarHBondContact O-N 3.05Å; F232-T236 PolarHBondContact O-OG1 2.9Å
233	I	98.1	Very high	96.9	Very high	100 Å²	100	55.8 Å²	55.8	51%	0.513	30%	0.297	S	S	.	.	H	α-helix	trans	-65.1	-45.1	-178.9	-68.3	166.7	0	0	0	111.2	W229 F230 S237	W229-I233 WeakPolarHBondContact O-CB 3.23Å; W229-I233 VanDerWaalsContact O-CG1 3.25Å; W229-I233 WeakPolarHBondContact O-CG1 3.34Å; W229-I233 PolarHBondContact O-N 3.2Å; F230-I233 PolarHBondContact O-N 3.34Å; I233-S237 WeakPolarHBondContact O-CB 3.44Å; I233-S237 PolarHBondContact O-N 3.43Å; I233-S237 PolarHBondContact O-OG 3.12Å
234	C	98.1	Very high	97.3	Very high	51 Å²	51	56.8 Å²	56.8	35%	0.345	28%	0.279	S	S	.	.	H	α-helix	trans	-62.9	-48.7	178.7	-71.8	0	0	0	0	111.7	F230 S237 I238	F230-C234 WeakPolarHBondContact O-CB 3.35Å; F230-C234 PolarHBondContact O-N 3.27Å; F230-C234 PolarHBondContact O-SG 3.25Å; F230-C234 VanDerWaalsContact O-SG 3.35Å; C234-S237 PolarHBondContact O-N 3.46Å; C234-I238 WeakPolarHBondContact O-CG1 3.48Å; C234-I238 PolarHBondContact O-N 3.27Å
235	C	98.1	Very high	97.4	Very high	17 Å²	17	57.6 Å²	57.6	12%	0.115	28%	0.277	C	S	.	.	H	α-helix	trans	-67.8	-39.6	-179.7	-65.2	0	0	0	0	111.6	A71 T75 C231 S237 I238 H239	A71-C235 HydrophobicContact CB-CB 4.46Å; T75-C235 HydrophobicContact CG2-CB 3.46Å; T75-C235 VanDerWaalsContact CG2-CB 3.46Å; C231-C235 VanDerWaalsContact O-CB 3.25Å; C231-C235 WeakPolarHBondContact O-CB 3.3Å; C231-C235 PolarHBondContact O-N 2.98Å; C231-C235 PolarHBondContact O-SG 3.31Å; C235-S237 VanDerWaalsContact C-N 3.3Å; C235-S237 PolarHBondContact O-N 2.77Å; C235-I238 PolarHBondContact O-N 3.44Å; C235-H239 WeakPolarHBondContact O-CB 3.22Å; C235-H239 PolarHBondContact O-N 2.99Å
236	T	98.4	Very high	97.6	Very high	19 Å²	19	53 Å²	53	12%	0.117	26%	0.256	C	S	.	.	H	α-helix	trans	-61.1	-39.5	174.5	-59.6	0	0	0	0	111.5	D141 F232 H239 L240	D141-T236 HydrophobicContact CB-CG2 3.94Å; F232-T236 WeakPolarHBondContact O-CB 3.35Å; F232-T236 PolarHBondContact O-N 3.05Å; F232-T236 PolarHBondContact O-OG1 2.9Å; T236-H239 WeakPolarHBondContact O-CB 3.5Å; T236-H239 PolarHBondContact O-N 2.86Å; T236-L240 HydrophobicContact CG2-CD1 4.23Å; T236-L240 WeakPolarHBondContact O-CG 3.43Å; T236-L240 PolarHBondContact O-N 2.88Å
237	S	98.4	Very high	97.6	Very high	71 Å²	71	45.9 Å²	45.9	50%	0.497	22%	0.224	S	C	.	.	H	α-helix	trans	-65.7	-43.3	177	-57.6	0	0	0	0	111.8	I233 C234 C235 Y241	I233-S237 WeakPolarHBondContact O-CB 3.44Å; I233-S237 PolarHBondContact O-N 3.43Å; I233-S237 PolarHBondContact O-OG 3.12Å; C234-S237 PolarHBondContact O-N 3.46Å; C235-S237 VanDerWaalsContact C-N 3.3Å; C235-S237 PolarHBondContact O-N 2.77Å; S237-Y241 VanDerWaalsContact O-CB 3.31Å; S237-Y241 WeakPolarHBondContact O-CB 3.15Å; S237-Y241 PolarHBondContact O-N 3.49Å
238	I	98.5	Very high	97.6	Very high	84 Å²	84	45.9 Å²	45.9	43%	0.431	22%	0.222	S	C	.	.	H	α-helix	trans	-63.4	-45.1	174.5	-67.8	166.8	0	0	0	110.2	I67 A71 C234 C235 Y241 S242	I67-I238 HydrophobicContact CG2-CG2 3.83Å; A71-I238 HydrophobicContact CB-CB 4.33Å; A71-I238 HydrophobicContact CB-CG2 4.02Å; C234-I238 WeakPolarHBondContact O-CG1 3.48Å; C234-I238 PolarHBondContact O-N 3.27Å; C235-I238 PolarHBondContact O-N 3.44Å; I238-Y241 PolarHBondContact O-N 3.31Å; I238-S242 VanDerWaalsContact O-CB 3.22Å; I238-S242 WeakPolarHBondContact O-CB 3.39Å; I238-S242 PolarHBondContact O-N 3.45Å; I238-S242 PolarHBondContact O-OG 3.1Å
239	H	98.3	Very high	97.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	23%	0.225	C	C	.	.	H	α-helix	trans	-54.8	-55.5	178.3	171.6	-108.4	0	0	0	112	Q68 A71 D137 D141 C235 T236 S242 N243	Q68-H239 PolarHBondContact NE2-CD2 3.4Å; Q68-H239 PolarHBondContact NE2-NE2 2.91Å; Q68-H239 PolarHBondContact O-CD2 2.94Å; A71-H239 HydrophobicContact CB-CB 4.02Å; D137-H239 VanDerWaalsContact CB-CE1 3.47Å; D137-H239 WeakPolarHBondContact CB-CE1 3.34Å; D137-H239 IonicContact OD2-CE1 3.23Å; D137-H239 IonicContact OD2-NE2 3.03Å; D137-H239 PolarHBondContact OD2-NE2 3.13Å; D141-H239 IonicContact OD1-CE1 3.35Å; D141-H239 PolarHBondContact OD1-CE1 2.91Å; D141-H239 VanDerWaalsContact OD1-CE1 3.23Å; D141-H239 IonicContact OD1-CG 3.4Å; D141-H239 IonicContact OD1-ND1 2.75Å; D141-H239 PolarHBondContact OD1-ND1 2.95Å; D141-H239 IonicContact OD2-CE1 2.64Å; D141-H239 PolarHBondContact OD2-CE1 3.33Å; D141-H239 IonicContact OD2-CG 3.26Å; D141-H239 IonicContact OD2-ND1 3.78Å; D141-H239 PolarHBondContact OD2-ND1 3.28Å; C235-H239 WeakPolarHBondContact O-CB 3.22Å; C235-H239 PolarHBondContact O-N 2.99Å; T236-H239 WeakPolarHBondContact O-CB 3.5Å; T236-H239 PolarHBondContact O-N 2.86Å; H239-S242 PolarHBondContact O-N 3.47Å; H239-N243 PolarHBondContact O-N 2.97Å
240	L	97.7	Very high	97.7	Very high	51 Å²	51	43.2 Å²	43.2	27%	0.267	21%	0.214	S	C	.	.	H	α-helix	trans	-66	-39.9	-179.5	-69.1	176.7	0	0	0	112.6	I138 D141 T236 Y244	I138-L240 HydrophobicContact CG1-CD2 3.83Å; D141-L240 VanDerWaalsContact OD2-CD2 3.24Å; D141-L240 WeakPolarHBondContact OD2-CD2 3.46Å; D141-L240 VanDerWaalsContact OD2-CG 3.31Å; D141-L240 WeakPolarHBondContact OD2-CG 3.23Å; T236-L240 HydrophobicContact CG2-CD1 4.23Å; T236-L240 WeakPolarHBondContact O-CG 3.43Å; T236-L240 PolarHBondContact O-N 2.88Å; L240-Y244 WeakPolarHBondContact O-CB 3.43Å; L240-Y244 PolarHBondContact O-N 3.07Å
241	Y	98.4	Very high	97.6	Very high	119 Å²	119	41 Å²	41	47%	0.467	20%	0.204	S	C	.	.	H	α-helix	trans	-64.7	-45.6	176.7	176	-103.3	0	0	0	111.6	W64 S237 I238 Y244 R245	W64-Y241 AromaticContact CH2-CE1 3.9Å; W64-Y241 HydrophobicContact CH2-CE1 3.9Å; W64-Y241 HydrophobicContact CZ3-CD1 4.28Å; W64-Y241 AromaticContact CZ3-CE1 3.8Å; W64-Y241 HydrophobicContact CZ3-CE1 3.8Å; S237-Y241 VanDerWaalsContact O-CB 3.31Å; S237-Y241 WeakPolarHBondContact O-CB 3.15Å; S237-Y241 PolarHBondContact O-N 3.49Å; I238-Y241 PolarHBondContact O-N 3.31Å; Y241-Y244 WeakPolarHBondContact O-CB 3.2Å; Y241-Y244 PolarHBondContact O-N 2.85Å; Y241-R245 HydrophobicContact CD1-CG 4.41Å; Y241-R245 HydrophobicContact CE1-CG 3.91Å; Y241-R245 HydrophobicContact CE2-CG 4.03Å; Y241-R245 WeakPolarHBondContact O-CG 3.48Å; Y241-R245 PolarHBondContact O-N 3.47Å
242	S	98.4	Very high	97.5	Very high	2 Å²	2	40.6 Å²	40.6	1%	0.014	20%	0.2	C	C	.	.	H	α-helix	trans	-63.5	-43.6	177.5	-66.2	0	0	0	0	111.3	I67 I238 H239 Y244 R245 A246	I67-S242 VanDerWaalsContact CG2-OG 3.23Å; I67-S242 WeakPolarHBondContact CG2-OG 3.35Å; I238-S242 VanDerWaalsContact O-CB 3.22Å; I238-S242 WeakPolarHBondContact O-CB 3.39Å; I238-S242 PolarHBondContact O-N 3.45Å; I238-S242 PolarHBondContact O-OG 3.1Å; H239-S242 PolarHBondContact O-N 3.47Å; S242-Y244 PolarHBondContact O-N 3.13Å; S242-R245 PolarHBondContact O-N 3.01Å; S242-A246 WeakPolarHBondContact O-CB 3.11Å; S242-A246 PolarHBondContact O-N 2.7Å
243	N	96.9	Very high	97.3	Very high	0 Å²	0	44.3 Å²	44.3	0%	0	21%	0.214	C	C	.	.	H	α-helix	trans	-59	-49.3	173.8	-173.3	-78.9	0	0	0	111.1	Q68 R133 F134 D137 H239 R245 A246 V247	Q68-N243 HydrophobicContact CG-CB 4.02Å; R133-N243 PolarHBondContact NH1-ND2 2.73Å; R133-N243 VanDerWaalsContact NH1-ND2 3.14Å; F134-N243 WeakPolarHBondContact CA-OD1 3.44Å; F134-N243 HydrophobicContact CD2-CB 4.42Å; F134-N243 WeakPolarHBondContact CD2-OD1 3.44Å; D137-N243 HydrophobicContact CB-CB 4.49Å; D137-N243 WeakPolarHBondContact OD2-CB 3.28Å; D137-N243 VanDerWaalsContact OD2-CG 3.26Å; D137-N243 PolarHBondContact OD2-ND2 3.06Å; H239-N243 PolarHBondContact O-N 2.97Å; N243-R245 VanDerWaalsContact C-N 3.25Å; N243-R245 PolarHBondContact O-N 3.45Å; N243-A246 WeakPolarHBondContact O-CB 3.24Å; N243-A246 PolarHBondContact O-N 2.77Å; N243-V247 VanDerWaalsContact O-CG2 3.28Å; N243-V247 WeakPolarHBondContact O-CG2 3.34Å; N243-V247 PolarHBondContact O-N 3.26Å
244	Y	97.5	Very high	97.2	Very high	94 Å²	94	41 Å²	41	37%	0.369	20%	0.198	S	C	.	.	H	α-helix	trans	-53.7	-44.8	178.2	174.8	-95.6	0	0	0	111.4	L240 Y241 S242 V247 K248 I313	L240-Y244 WeakPolarHBondContact O-CB 3.43Å; L240-Y244 PolarHBondContact O-N 3.07Å; Y241-Y244 WeakPolarHBondContact O-CB 3.2Å; Y241-Y244 PolarHBondContact O-N 2.85Å; S242-Y244 PolarHBondContact O-N 3.13Å; Y244-V247 WeakPolarHBondContact O-CG2 3.41Å; Y244-K248 WeakPolarHBondContact O-CB 3.11Å; Y244-K248 PolarHBondContact O-N 2.89Å; Y244-I313 HydrophobicContact CD2-CD1 3.78Å; Y244-I313 HydrophobicContact CE2-CD1 3.66Å
245	R	98	Very high	97	Very high	84 Å²	84	38.6 Å²	38.6	32%	0.317	18%	0.182	S	C	.	.	H	α-helix	trans	-65.7	-42.5	176.4	-70.5	-61.3	-57.1	-121.5	1.5	112.7	E60 W64 Y241 S242 N243 K248 C249	E60-R245 IonicContact OE1-NH2 3.43Å; E60-R245 PolarHBondContact OE1-NH2 3.45Å; W64-R245 HydrophobicContact CB-CB 4.35Å; W64-R245 HydrophobicContact CD2-CB 3.4Å; W64-R245 VanDerWaalsContact CD2-CB 3.4Å; W64-R245 HydrophobicContact CD2-CG 4.1Å; W64-R245 HydrophobicContact CE3-CB 3.87Å; W64-R245 HydrophobicContact CE3-CG 4.23Å; W64-R245 HydrophobicContact CG-CB 3.61Å; W64-R245 HydrophobicContact CH2-CG 4.15Å; W64-R245 HydrophobicContact CZ2-CB 4.1Å; W64-R245 HydrophobicContact CZ2-CG 4Å; W64-R245 HydrophobicContact CZ3-CB 4.39Å; W64-R245 HydrophobicContact CZ3-CG 4.25Å; Y241-R245 HydrophobicContact CD1-CG 4.41Å; Y241-R245 HydrophobicContact CE1-CG 3.91Å; Y241-R245 HydrophobicContact CE2-CG 4.03Å; Y241-R245 WeakPolarHBondContact O-CG 3.48Å; Y241-R245 PolarHBondContact O-N 3.47Å; S242-R245 PolarHBondContact O-N 3.01Å; N243-R245 VanDerWaalsContact C-N 3.25Å; N243-R245 PolarHBondContact O-N 3.45Å; R245-K248 PolarHBondContact O-N 2.86Å; R245-C249 PolarHBondContact O-N 3.28Å; R245-C249 VanDerWaalsContact O-N 3.16Å
246	A	97.7	Very high	96.8	Very high	1 Å²	1	37.8 Å²	37.8	1%	0.008	18%	0.177	C	C	.	.	H	α-helix	trans	-59	-52.3	176.6	0	0	0	0	0	111.2	Y61 W64 S242 N243 K248 C249	Y61-A246 HydrophobicContact CD2-CB 4Å; Y61-A246 WeakPolarHBondContact CD2-O 3.45Å; Y61-A246 HydrophobicContact CE2-CB 4.01Å; W64-A246 HydrophobicContact CB-CB 3.66Å; S242-A246 WeakPolarHBondContact O-CB 3.11Å; S242-A246 PolarHBondContact O-N 2.7Å; N243-A246 WeakPolarHBondContact O-CB 3.24Å; N243-A246 PolarHBondContact O-N 2.77Å; A246-K248 VanDerWaalsContact C-N 3.31Å; A246-K248 PolarHBondContact O-N 3.41Å; A246-C249 PolarHBondContact O-SG 2.97Å
247	V	96.5	Very high	96.6	Very high	0 Å²	0	39.4 Å²	39.4	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-70.9	-27.8	-179.5	-65.2	0	0	0	0	112.7	K130 R133 F134 N243 Y244 I313	K130-V247 HydrophobicContact CB-CB 4.3Å; K130-V247 VanDerWaalsContact CD-O 3.32Å; K130-V247 WeakPolarHBondContact CD-O 3.27Å; K130-V247 WeakPolarHBondContact CE-O 3.19Å; K130-V247 HydrophobicContact CG-CB 4.32Å; R133-V247 HydrophobicContact CB-CG1 3.78Å; R133-V247 HydrophobicContact CG-CG1 3.49Å; R133-V247 VanDerWaalsContact CG-CG1 3.49Å; F134-V247 HydrophobicContact CB-CG2 4.49Å; N243-V247 VanDerWaalsContact O-CG2 3.28Å; N243-V247 WeakPolarHBondContact O-CG2 3.34Å; N243-V247 PolarHBondContact O-N 3.26Å; Y244-V247 WeakPolarHBondContact O-CG2 3.41Å; V247-I313 HydrophobicContact CG2-CD1 3.63Å; V247-I313 HydrophobicContact CG2-CG2 4.37Å
248	K	96	Very high	96.4	Very high	51 Å²	51	36.8 Å²	36.8	22%	0.222	16%	0.162	C	C	.	.	H	α-helix	trans	-72.9	-32.1	-179.1	-170.4	61.1	179.1	167.1	0	113	Y244 R245 A246 L250 E309 E311 I313	Y244-K248 WeakPolarHBondContact O-CB 3.11Å; Y244-K248 PolarHBondContact O-N 2.89Å; R245-K248 PolarHBondContact O-N 2.86Å; A246-K248 VanDerWaalsContact C-N 3.31Å; A246-K248 PolarHBondContact O-N 3.41Å; K248-L250 VanDerWaalsContact C-N 3.3Å; K248-L250 PolarHBondContact O-N 2.88Å; K248-E309 WeakPolarHBondContact CE-O 3.3Å; K248-E309 PolarHBondContact NZ-O 3.35Å; K248-E311 PolarHBondContact NZ-O 3.01Å; K248-I313 HydrophobicContact CB-CD1 3.99Å; K248-I313 HydrophobicContact CD-CD1 3.89Å; K248-I313 HydrophobicContact CD-CG1 4.45Å
249	C	96.6	Very high	96.3	Very high	17 Å²	17	32.9 Å²	32.9	12%	0.115	14%	0.141	C	C	.	.	H	α-helix	trans	-76.7	-15	-179.6	74.3	0	0	0	0	113.7	D57 E60 Y61 R245 A246 K251	D57-C249 WeakPolarHBondContact CB-O 3.48Å; E60-C249 HydrophobicContact CB-CB 4.32Å; E60-C249 VanDerWaalsContact CD-CB 3.44Å; E60-C249 HydrophobicContact CG-CB 3.82Å; Y61-C249 PolarHBondContact N-SG 3.42Å; R245-C249 PolarHBondContact O-N 3.28Å; R245-C249 VanDerWaalsContact O-N 3.16Å; A246-C249 PolarHBondContact O-SG 2.97Å; C249-K251 PolarHBondContact O-N 2.98Å
250	L	97.2	Very high	96.2	Very high	1 Å²	1	32.9 Å²	32.9	1%	0.005	14%	0.141	C	C	.	.			trans	-63.1	126.8	179.8	-67.1	171.2	0	0	0	112.3	Y61 K130 I182 K248 L252 N308	Y61-L250 HydrophobicContact CD2-CD1 4.14Å; Y61-L250 HydrophobicContact CD2-CD2 3.57Å; Y61-L250 HydrophobicContact CD2-CG 3.85Å; Y61-L250 HydrophobicContact CE2-CD1 4.11Å; Y61-L250 HydrophobicContact CE2-CD2 4.21Å; Y61-L250 HydrophobicContact CE2-CG 4.33Å; Y61-L250 HydrophobicContact CG-CD2 4.14Å; K130-L250 VanDerWaalsContact CE-O 3.31Å; K130-L250 WeakPolarHBondContact CE-O 3.33Å; K130-L250 PolarHBondContact NZ-O 3.16Å; I182-L250 HydrophobicContact CD1-CD1 3.93Å; I182-L250 HydrophobicContact CG1-CD1 3.86Å; I182-L250 HydrophobicContact CG2-CD2 4.09Å; K248-L250 VanDerWaalsContact C-N 3.3Å; K248-L250 PolarHBondContact O-N 2.88Å; L250-L252 HydrophobicContact CB-CD2 4.41Å; L250-L252 HydrophobicContact CB-CG 4.22Å; L250-N308 WeakPolarHBondContact O-CB 3.49Å; L250-N308 PolarHBondContact O-OD1 3.27Å
251	K	95.5	Very high	96.1	Very high	66 Å²	66	30.6 Å²	30.6	29%	0.287	13%	0.13	S	C	.	.			trans	-103.7	56.9	179.7	-63	167.8	-179	172.9	0	110.5	D57 H185 C249 R253 V304 I305	D57-K251 HydrophobicContact CB-CD 4.35Å; D57-K251 HydrophobicContact CB-CG 4.39Å; D57-K251 WeakPolarHBondContact OD2-CA 3.39Å; D57-K251 WeakPolarHBondContact OD2-CB 3.22Å; D57-K251 PolarHBondContact OD2-N 2.95Å; H185-K251 PolarHBondContact CE1-O 3.38Å; C249-K251 PolarHBondContact O-N 2.98Å; K251-R253 PolarHBondContact O-N 3.2Å; K251-V304 HydrophobicContact CB-CG1 4.36Å; K251-V304 WeakPolarHBondContact O-CG1 3.32Å; K251-I305 HydrophobicContact CD-CG1 4.1Å; K251-I305 HydrophobicContact CG-CG1 4.49Å
252	L	95.4	Very high	96	Very high	13 Å²	13	26.6 Å²	26.6	7%	0.068	12%	0.116	C	C	.	.			trans	-60.2	128.2	-174.8	-61.3	176.8	0	0	0	112.1	C129 K130 H185 L250 R259 N308	C129-L252 HydrophobicContact CB-CD1 4.5Å; K130-L252 HydrophobicContact CG-CD1 4.23Å; H185-L252 HydrophobicContact CB-CD2 3.85Å; L250-L252 HydrophobicContact CB-CD2 4.41Å; L250-L252 HydrophobicContact CB-CG 4.22Å; L252-R259 VanDerWaalsContact C-NH1 3.33Å; L252-R259 PolarHBondContact O-NH1 3.03Å; L252-N308 PolarHBondContact N-ND2 3.02Å; L252-N308 PolarHBondContact N-OD1 2.61Å; L252-N308 PolarHBondContact O-ND2 3.41Å
253	R	94.2	Very high	95.8	Very high	90 Å²	90	26.5 Å²	26.5	34%	0.34	12%	0.115	S	C	.	.			trans	-90.2	-16	-174.3	-63.2	179.8	-179.7	-171.3	1.4	115.6	K251 V304 D448 W449 N450	K251-R253 PolarHBondContact O-N 3.2Å; R253-V304 HydrophobicContact CG-CG1 4.32Å; R253-D448 VanDerWaalsContact CB-O 3.3Å; R253-D448 WeakPolarHBondContact CB-O 3.43Å; R253-D448 VanDerWaalsContact CD-O 3.22Å; R253-D448 WeakPolarHBondContact CD-O 3.36Å; R253-D448 WeakPolarHBondContact CG-O 3.27Å; R253-W449 VanDerWaalsContact O-CE3 3.23Å; R253-N450 HydrophobicContact CB-CB 4.49Å; R253-N450 PolarHBondContact O-N 3.46Å
254	T	94.2	Very high	95.8	Very high	30 Å²	30	26.5 Å²	26.5	18%	0.184	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	117.9	-175.5	-59.7	0	0	0	0	111.3	N256 R259 N450 S453 Q455	T254-N256 PolarHBondContact O-N 2.73Å; T254-R259 PolarHBondContact O-NH1 2.72Å; T254-R259 PolarHBondContact O-NH2 2.81Å; T254-N450 PolarHBondContact OG1-ND2 3.04Å; T254-S453 WeakPolarHBondContact CG2-O 3.32Å; T254-Q455 HydrophobicContact CG2-CG 3.87Å
255	F	94.9	Very high	95.6	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58	128.4	-177.9	-70.5	-67.4	0	0	0	114	R259 F260 A263 F301 L443 W449 F454 Q455 F456	F255-R259 HydrophobicContact CD1-CB 4.48Å; F255-F260 HydrophobicContact CB-CB 4.25Å; F255-F260 HydrophobicContact CD1-CB 4Å; F255-F260 HydrophobicContact CD1-CD2 4.04Å; F255-F260 HydrophobicContact CD2-CD2 4.41Å; F255-F260 HydrophobicContact CE1-CD2 4.29Å; F255-F260 HydrophobicContact CG-CB 4.33Å; F255-F260 HydrophobicContact CG-CD2 4.11Å; F255-A263 HydrophobicContact CE1-CB 4.31Å; F255-F301 HydrophobicContact CE1-CE1 4.09Å; F255-F301 HydrophobicContact CE1-CZ 4.38Å; F255-F301 AromaticContact CZ-CE1 3.65Å; F255-F301 HydrophobicContact CZ-CE1 3.65Å; F255-F301 HydrophobicContact CZ-CZ 4.06Å; F255-L443 HydrophobicContact CE2-CD1 3.92Å; F255-L443 HydrophobicContact CE2-CD2 4.11Å; F255-L443 HydrophobicContact CZ-CD1 3.84Å; F255-W449 AromaticContact CD1-CE3 3.81Å; F255-W449 HydrophobicContact CD1-CE3 3.81Å; F255-W449 HydrophobicContact CD1-CH2 4.14Å; F255-W449 AromaticContact CD1-CZ3 3.61Å; F255-W449 HydrophobicContact CD1-CZ3 3.61Å; F255-W449 HydrophobicContact CD2-CE3 4.2Å; F255-W449 AromaticContact CE1-CD2 3.64Å; F255-W449 HydrophobicContact CE1-CD2 3.64Å; F255-W449 AromaticContact CE1-CE2 3.84Å; F255-W449 AromaticContact CE1-CE3 3.33Å; F255-W449 HydrophobicContact CE1-CE3 3.33Å; F255-W449 AromaticContact CE1-CH2 3.58Å; F255-W449 HydrophobicContact CE1-CH2 3.58Å; F255-W449 AromaticContact CE1-CZ2 3.82Å; F255-W449 HydrophobicContact CE1-CZ2 3.82Å; F255-W449 AromaticContact CE1-CZ3 3.33Å; F255-W449 HydrophobicContact CE1-CZ3 3.33Å; F255-W449 HydrophobicContact CE2-CB 4.15Å; F255-W449 AromaticContact CE2-CD2 3.89Å; F255-W449 HydrophobicContact CE2-CD2 3.89Å; F255-W449 AromaticContact CE2-CE3 3.76Å; F255-W449 HydrophobicContact CE2-CE3 3.76Å; F255-W449 HydrophobicContact CE2-CG 4.08Å; F255-W449 HydrophobicContact CG-CE3 4.22Å; F255-W449 HydrophobicContact CG-CZ3 4.33Å; F255-W449 HydrophobicContact CZ-CB 4.28Å; F255-W449 AromaticContact CZ-CD2 3.25Å; F255-W449 HydrophobicContact CZ-CD2 3.25Å; F255-W449 AromaticContact CZ-CE2 3.7Å; F255-W449 AromaticContact CZ-CE3 3.3Å; F255-W449 HydrophobicContact CZ-CE3 3.3Å; F255-W449 AromaticContact CZ-CG 3.71Å; F255-W449 HydrophobicContact CZ-CG 3.71Å; F255-W449 HydrophobicContact CZ-CH2 4.25Å; F255-W449 HydrophobicContact CZ-CZ2 4.17Å; F255-W449 AromaticContact CZ-CZ3 3.84Å; F255-W449 HydrophobicContact CZ-CZ3 3.84Å; F255-F454 HydrophobicContact CB-CD1 4.21Å; F255-F454 HydrophobicContact CD2-CD1 4.05Å; F255-F454 HydrophobicContact CD2-CE1 4.03Å; F255-Q455 PolarHBondContact O-N 3.12Å; F255-F456 HydrophobicContact CB-CE1 3.94Å; F255-F456 HydrophobicContact CB-CZ 4.06Å
256	N	94.1	Very high	95.4	Very high	1 Å²	1	21.3 Å²	21.3	1%	0.005	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	-179.5	154.3	68.9	2.4	0	0	0	109.7	C127 T254 T258 R259 F260 E311 Q455	C127-N256 WeakPolarHBondContact O-CB 3.44Å; C127-N256 PolarHBondContact O-ND2 3.34Å; T254-N256 PolarHBondContact O-N 2.73Å; N256-T258 PolarHBondContact O-N 3.42Å; N256-T258 PolarHBondContact OD1-N 3.36Å; N256-R259 WeakPolarHBondContact OD1-CB 3.16Å; N256-R259 VanDerWaalsContact OD1-CG 3.27Å; N256-R259 WeakPolarHBondContact OD1-CG 3.34Å; N256-R259 PolarHBondContact OD1-N 2.82Å; N256-R259 PolarHBondContact OD1-NE 3.32Å; N256-F260 VanDerWaalsContact O-CB 3.22Å; N256-F260 WeakPolarHBondContact O-CB 3.37Å; N256-F260 PolarHBondContact O-N 3.05Å; N256-E311 PolarHBondContact ND2-OE1 2.87Å; N256-E311 VanDerWaalsContact ND2-OE1 3.1Å; N256-Q455 WeakPolarHBondContact CA-O 3.4Å; N256-Q455 HydrophobicContact CB-CB 4.45Å
257	R	94	Very high	95.2	Very high	53 Å²	53	21.3 Å²	21.3	20%	0.2	10%	0.098	C	C	.	.	H	α-helix	trans	-59.6	-46	-179.6	-60.6	179.7	-180	-174.2	-2.2	112.3	H261 Q319 I322 F456 A457	R257-H261 VanDerWaalsContact O-CB 3.24Å; R257-H261 WeakPolarHBondContact O-CB 3.21Å; R257-H261 PolarHBondContact O-N 2.93Å; R257-Q319 VanDerWaalsContact CB-OE1 3.25Å; R257-I322 PolarHBondContact NH1-O 3.35Å; R257-I322 PolarHBondContact NH2-O 2.88Å; R257-F456 HydrophobicContact CG-CD1 4.41Å; R257-F456 PolarHBondContact NE-O 2.71Å; R257-F456 PolarHBondContact NH2-O 2.76Å; R257-A457 PolarHBondContact NH2-O 2.95Å
258	T	94.7	Very high	94.9	Very high	16 Å²	16	21.3 Å²	21.3	10%	0.098	10%	0.098	C	C	.	.	H	α-helix	trans	-66.2	-48.2	-177.7	-54.9	0	0	0	0	112.6	N256 H261 L262 E311 P312 T317 Q319	N256-T258 PolarHBondContact O-N 3.42Å; N256-T258 PolarHBondContact OD1-N 3.36Å; T258-H261 WeakPolarHBondContact O-CB 3.42Å; T258-H261 PolarHBondContact O-N 3.39Å; T258-L262 HydrophobicContact CG2-CD1 4.25Å; T258-L262 WeakPolarHBondContact O-CG 3.26Å; T258-L262 PolarHBondContact O-N 3.3Å; T258-E311 HydrophobicContact CG2-CG 4.15Å; T258-P312 HydrophobicContact CG2-CG 4.34Å; T258-T317 HydrophobicContact CG2-CG2 3.83Å; T258-Q319 PolarHBondContact OG1-NE2 3.28Å
259	R	95.4	Very high	94.6	Very high	1 Å²	1	23.5 Å²	23.5	0%	0.004	11%	0.107	C	C	.	.	H	α-helix	trans	-64.9	-41	178.5	-70.5	-178.2	-84.9	140.3	4	111.2	L252 T254 F255 N256 A263 V307 E311	L252-R259 VanDerWaalsContact C-NH1 3.33Å; L252-R259 PolarHBondContact O-NH1 3.03Å; T254-R259 PolarHBondContact O-NH1 2.72Å; T254-R259 PolarHBondContact O-NH2 2.81Å; F255-R259 HydrophobicContact CD1-CB 4.48Å; N256-R259 WeakPolarHBondContact OD1-CB 3.16Å; N256-R259 VanDerWaalsContact OD1-CG 3.27Å; N256-R259 WeakPolarHBondContact OD1-CG 3.34Å; N256-R259 PolarHBondContact OD1-N 2.82Å; N256-R259 PolarHBondContact OD1-NE 3.32Å; R259-A263 VanDerWaalsContact O-CB 3.32Å; R259-A263 WeakPolarHBondContact O-CB 3.39Å; R259-A263 PolarHBondContact O-N 3.02Å; R259-V307 HydrophobicContact CB-CG1 3.66Å; R259-V307 HydrophobicContact CG-CG1 3.89Å; R259-V307 WeakPolarHBondContact O-CG1 3.45Å; R259-E311 WeakPolarHBondContact CD-OE2 3.43Å; R259-E311 VanDerWaalsContact CG-CD 3.49Å; R259-E311 HydrophobicContact CG-CG 4.21Å; R259-E311 WeakPolarHBondContact CG-OE1 3.45Å; R259-E311 IonicContact NE-OE1 2.79Å; R259-E311 IonicContact NE-OE2 2.84Å
260	F	96.4	Very high	94.1	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-62.9	-46.9	174.5	-172.9	-105.5	0	0	0	111.4	F255 N256 L262 A263 I264 L386 M389 L390 E393 F439 F456	F255-F260 HydrophobicContact CB-CB 4.25Å; F255-F260 HydrophobicContact CD1-CB 4Å; F255-F260 HydrophobicContact CD1-CD2 4.04Å; F255-F260 HydrophobicContact CD2-CD2 4.41Å; F255-F260 HydrophobicContact CE1-CD2 4.29Å; F255-F260 HydrophobicContact CG-CB 4.33Å; F255-F260 HydrophobicContact CG-CD2 4.11Å; N256-F260 VanDerWaalsContact O-CB 3.22Å; N256-F260 WeakPolarHBondContact O-CB 3.37Å; N256-F260 PolarHBondContact O-N 3.05Å; F260-L262 PolarHBondContact O-N 3Å; F260-A263 PolarHBondContact O-N 2.8Å; F260-I264 HydrophobicContact CD1-CG2 4.19Å; F260-I264 HydrophobicContact CE1-CB 4.24Å; F260-I264 HydrophobicContact CE1-CG1 4.44Å; F260-I264 HydrophobicContact CE1-CG2 3.99Å; F260-I264 HydrophobicContact CE2-CB 4.43Å; F260-I264 HydrophobicContact CZ-CB 4.15Å; F260-I264 HydrophobicContact CZ-CD1 4.41Å; F260-I264 HydrophobicContact CZ-CG1 4.13Å; F260-I264 HydrophobicContact CZ-CG2 4.41Å; F260-I264 WeakPolarHBondContact O-CB 3.07Å; F260-I264 WeakPolarHBondContact O-CG2 3.4Å; F260-I264 PolarHBondContact O-N 3.33Å; F260-L386 HydrophobicContact CD2-CD1 4.08Å; F260-L386 HydrophobicContact CE2-CD1 3.53Å; F260-L386 HydrophobicContact CZ-CD1 4.03Å; F260-M389 HydrophobicContact CD1-CB 3.94Å; F260-M389 HydrophobicContact CD1-CE 3.97Å; F260-M389 HydrophobicContact CE1-CB 3.55Å; F260-M389 HydrophobicContact CZ-CB 4.2Å; F260-L390 HydrophobicContact CZ-CB 4.47Å; F260-E393 HydrophobicContact CD1-CG 3.98Å; F260-E393 HydrophobicContact CE1-CB 4.4Å; F260-E393 HydrophobicContact CE1-CG 3.84Å; F260-F439 HydrophobicContact CE2-CE2 4.31Å; F260-F439 AromaticContact CE2-CZ 3.88Å; F260-F439 HydrophobicContact CE2-CZ 3.88Å; F260-F439 HydrophobicContact CZ-CZ 4.28Å; F260-F456 HydrophobicContact CB-CE1 3.82Å; F260-F456 HydrophobicContact CB-CZ 4.41Å; F260-F456 HydrophobicContact CD1-CE1 4.45Å; F260-F456 HydrophobicContact CD2-CZ 4.32Å; F260-F456 HydrophobicContact CG-CE1 4.02Å; F260-F456 HydrophobicContact CG-CZ 4.18Å
261	H	96.1	Very high	93.4	Very high	4 Å²	4	25.3 Å²	25.3	2%	0.019	11%	0.114	C	C	.	.	H	α-helix	trans	-54.1	-52.9	175.9	-179	77.9	0	0	0	112	R257 T258 A263 Q265 D318 Q319 E393	R257-H261 VanDerWaalsContact O-CB 3.24Å; R257-H261 WeakPolarHBondContact O-CB 3.21Å; R257-H261 PolarHBondContact O-N 2.93Å; T258-H261 WeakPolarHBondContact O-CB 3.42Å; T258-H261 PolarHBondContact O-N 3.39Å; H261-A263 PolarHBondContact O-N 2.71Å; H261-Q265 WeakPolarHBondContact O-CB 3.35Å; H261-Q265 WeakPolarHBondContact O-CG 3.39Å; H261-Q265 PolarHBondContact O-N 2.99Å; H261-D318 IonicContact NE2-OD1 3.73Å; H261-D318 PolarHBondContact NE2-OD1 2.92Å; H261-Q319 HydrophobicContact CB-CB 4.12Å; H261-E393 IonicContact CE1-OE2 3.97Å; H261-E393 PolarHBondContact CE1-OE2 3.3Å; H261-E393 IonicContact CG-OE1 3.18Å; H261-E393 IonicContact CG-OE2 2.61Å; H261-E393 IonicContact ND1-OE1 3.3Å; H261-E393 PolarHBondContact ND1-OE1 2.96Å; H261-E393 IonicContact ND1-OE2 3.86Å; H261-E393 PolarHBondContact ND1-OE2 2.9Å
262	L	95.3	Very high	92.7	Very high	34 Å²	34	22.3 Å²	22.3	18%	0.178	10%	0.101	C	C	.	.	H	α-helix	trans	-59.7	-45.6	-179.9	-69.8	171.6	0	0	0	112.2	T258 F260 Q266 V307 E311 T317	T258-L262 HydrophobicContact CG2-CD1 4.25Å; T258-L262 WeakPolarHBondContact O-CG 3.26Å; T258-L262 PolarHBondContact O-N 3.3Å; F260-L262 PolarHBondContact O-N 3Å; L262-Q266 WeakPolarHBondContact O-CB 3.42Å; L262-Q266 PolarHBondContact O-N 3.48Å; L262-V307 HydrophobicContact CB-CG1 4.37Å; L262-E311 HydrophobicContact CD1-CB 4.33Å; L262-T317 HydrophobicContact CD2-CG2 4.35Å
263	A	95.7	Very high	91.8	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-67.7	-49.6	-178.3	0	0	0	0	0	111.9	F255 R259 F260 H261 Q266 W267 F301 P302 V307	F255-A263 HydrophobicContact CE1-CB 4.31Å; R259-A263 VanDerWaalsContact O-CB 3.32Å; R259-A263 WeakPolarHBondContact O-CB 3.39Å; R259-A263 PolarHBondContact O-N 3.02Å; F260-A263 PolarHBondContact O-N 2.8Å; H261-A263 PolarHBondContact O-N 2.71Å; A263-Q266 PolarHBondContact O-N 2.79Å; A263-W267 PolarHBondContact O-N 3.43Å; A263-F301 HydrophobicContact CB-CE1 3.62Å; A263-F301 HydrophobicContact CB-CE2 4.43Å; A263-F301 HydrophobicContact CB-CZ 3.44Å; A263-F301 VanDerWaalsContact CB-CZ 3.44Å; A263-P302 HydrophobicContact CB-CB 4.41Å; A263-P302 WeakPolarHBondContact O-CG 3.26Å; A263-V307 HydrophobicContact CB-CG2 3.71Å
264	I	95.8	Very high	90.3	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	11%	0.114	C	C	.	.	H	α-helix	trans	-73.6	-35.9	-173.2	-161.7	65.2	0	0	0	112.4	F260 Q266 W267 F268 F301 L390 E393 F439	F260-I264 HydrophobicContact CD1-CG2 4.19Å; F260-I264 HydrophobicContact CE1-CB 4.24Å; F260-I264 HydrophobicContact CE1-CG1 4.44Å; F260-I264 HydrophobicContact CE1-CG2 3.99Å; F260-I264 HydrophobicContact CE2-CB 4.43Å; F260-I264 HydrophobicContact CZ-CB 4.15Å; F260-I264 HydrophobicContact CZ-CD1 4.41Å; F260-I264 HydrophobicContact CZ-CG1 4.13Å; F260-I264 HydrophobicContact CZ-CG2 4.41Å; F260-I264 WeakPolarHBondContact O-CB 3.07Å; F260-I264 WeakPolarHBondContact O-CG2 3.4Å; F260-I264 PolarHBondContact O-N 3.33Å; I264-Q266 VanDerWaalsContact C-N 3.29Å; I264-Q266 PolarHBondContact O-N 2.53Å; I264-W267 HydrophobicContact CD1-CD2 4.39Å; I264-W267 HydrophobicContact CD1-CE3 3.71Å; I264-W267 HydrophobicContact CD1-CZ3 4.35Å; I264-W267 PolarHBondContact O-N 3.42Å; I264-F268 HydrophobicContact CB-CE2 4.48Å; I264-F268 HydrophobicContact CD1-CE1 4.45Å; I264-F268 HydrophobicContact CD1-CE2 4.49Å; I264-F268 HydrophobicContact CD1-CZ 4.24Å; I264-F268 HydrophobicContact CG1-CD2 4.05Å; I264-F268 HydrophobicContact CG1-CE1 4.3Å; I264-F268 HydrophobicContact CG1-CE2 3.53Å; I264-F268 HydrophobicContact CG1-CZ 3.69Å; I264-F268 HydrophobicContact CG2-CE2 4.3Å; I264-F268 VanDerWaalsContact O-CD2 3.25Å; I264-F268 WeakPolarHBondContact O-CD2 3.43Å; I264-F268 WeakPolarHBondContact O-CG 3.35Å; I264-F268 PolarHBondContact O-N 3.48Å; I264-F301 HydrophobicContact CD1-CE2 3.98Å; I264-L390 HydrophobicContact CD1-CD1 3.53Å; I264-L390 HydrophobicContact CG1-CD1 3.82Å; I264-E393 HydrophobicContact CG2-CB 3.47Å; I264-E393 VanDerWaalsContact CG2-CB 3.47Å; I264-E393 HydrophobicContact CG2-CG 3.64Å; I264-F439 HydrophobicContact CD1-CD2 3.66Å; I264-F439 HydrophobicContact CD1-CE2 3.62Å
265	Q	94.8	Very high	88.9	Confident	13 Å²	13	22.6 Å²	22.6	6%	0.061	11%	0.108	C	C	.	.	H	α-helix	trans	-63.4	-39.9	175.3	-68.5	-65.9	-36.6	0	0	110.6	H261 K269 E393	H261-Q265 WeakPolarHBondContact O-CB 3.35Å; H261-Q265 WeakPolarHBondContact O-CG 3.39Å; H261-Q265 PolarHBondContact O-N 2.99Å; Q265-K269 WeakPolarHBondContact O-CG 3.34Å; Q265-K269 PolarHBondContact O-N 2.86Å; Q265-E393 PolarHBondContact NE2-O 2.99Å; Q265-E393 PolarHBondContact NE2-OE2 3.1Å
266	Q	92.7	Very high	87.2	Confident	57 Å²	57	25.4 Å²	25.4	27%	0.266	12%	0.121	S	C	.	.	H	α-helix	trans	-66.4	-42.2	174.8	-177.8	59.1	23.1	0	0	111.9	L262 A263 I264 K269 Q270 P302 W306	L262-Q266 WeakPolarHBondContact O-CB 3.42Å; L262-Q266 PolarHBondContact O-N 3.48Å; A263-Q266 PolarHBondContact O-N 2.79Å; I264-Q266 VanDerWaalsContact C-N 3.29Å; I264-Q266 PolarHBondContact O-N 2.53Å; Q266-K269 WeakPolarHBondContact O-CB 3.38Å; Q266-K269 PolarHBondContact O-N 3.41Å; Q266-Q270 WeakPolarHBondContact O-CG 3.31Å; Q266-Q270 PolarHBondContact O-N 3.45Å; Q266-Q270 VanDerWaalsContact O-N 3.15Å; Q266-P302 HydrophobicContact CB-CG 4.13Å; Q266-P302 HydrophobicContact CG-CG 4.13Å; Q266-W306 HydrophobicContact CB-CH2 3.84Å; Q266-W306 HydrophobicContact CB-CZ3 4.06Å; Q266-W306 HydrophobicContact CG-CH2 3.81Å; Q266-W306 HydrophobicContact CG-CZ2 4.4Å; Q266-W306 HydrophobicContact CG-CZ3 4.18Å
267	W	93.1	Very high	85.4	Confident	0 Å²	0	32.7 Å²	32.7	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-62.5	-44	175.7	-175.5	76.9	0	0	0	111.7	A263 I264 K269 Q270 Q271 Q299 F301 L435 P438 F439 S442	A263-W267 PolarHBondContact O-N 3.43Å; I264-W267 HydrophobicContact CD1-CD2 4.39Å; I264-W267 HydrophobicContact CD1-CE3 3.71Å; I264-W267 HydrophobicContact CD1-CZ3 4.35Å; I264-W267 PolarHBondContact O-N 3.42Å; W267-K269 PolarHBondContact O-N 3.35Å; W267-Q270 PolarHBondContact O-N 3.2Å; W267-Q271 HydrophobicContact CD2-CG 3.84Å; W267-Q271 HydrophobicContact CE3-CG 4.09Å; W267-Q271 HydrophobicContact CG-CG 4.41Å; W267-Q271 HydrophobicContact CH2-CG 4.05Å; W267-Q271 HydrophobicContact CZ2-CG 3.77Å; W267-Q271 VanDerWaalsContact CZ2-NE2 3.33Å; W267-Q271 HydrophobicContact CZ3-CG 4.2Å; W267-Q271 WeakPolarHBondContact O-CG 3.5Å; W267-Q271 PolarHBondContact O-N 3.28Å; W267-Q299 PolarHBondContact NE1-O 3.12Å; W267-F301 HydrophobicContact CB-CD2 4.17Å; W267-F301 HydrophobicContact CB-CE2 4.19Å; W267-F301 AromaticContact CD1-CD2 3.97Å; W267-F301 AromaticContact CG-CD2 3.97Å; W267-F301 HydrophobicContact CG-CD2 3.97Å; W267-F301 HydrophobicContact CG-CE2 4.34Å; W267-L435 HydrophobicContact CH2-CB 4.43Å; W267-L435 HydrophobicContact CH2-CD2 4.31Å; W267-P438 HydrophobicContact CH2-CB 4.45Å; W267-P438 HydrophobicContact CZ2-CB 4.31Å; W267-F439 HydrophobicContact CH2-CB 3.71Å; W267-F439 HydrophobicContact CZ2-CB 4.15Å; W267-F439 HydrophobicContact CZ3-CB 4.1Å; W267-S442 PolarHBondContact NE1-OG 2.92Å
268	F	91.8	Very high	83.7	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-59.3	-44.9	174	-70.9	-41	0	0	0	112.2	I264 Q270 Q271 F272 L390 E393 L394 F397 L435	I264-F268 HydrophobicContact CB-CE2 4.48Å; I264-F268 HydrophobicContact CD1-CE1 4.45Å; I264-F268 HydrophobicContact CD1-CE2 4.49Å; I264-F268 HydrophobicContact CD1-CZ 4.24Å; I264-F268 HydrophobicContact CG1-CD2 4.05Å; I264-F268 HydrophobicContact CG1-CE1 4.3Å; I264-F268 HydrophobicContact CG1-CE2 3.53Å; I264-F268 HydrophobicContact CG1-CZ 3.69Å; I264-F268 HydrophobicContact CG2-CE2 4.3Å; I264-F268 VanDerWaalsContact O-CD2 3.25Å; I264-F268 WeakPolarHBondContact O-CD2 3.43Å; I264-F268 WeakPolarHBondContact O-CG 3.35Å; I264-F268 PolarHBondContact O-N 3.48Å; F268-Q270 VanDerWaalsContact C-N 3.28Å; F268-Q270 PolarHBondContact O-N 3.38Å; F268-Q271 PolarHBondContact O-N 2.82Å; F268-F272 HydrophobicContact CB-CD2 4.23Å; F268-F272 HydrophobicContact CB-CE2 4.41Å; F268-F272 HydrophobicContact CD1-CE2 4.18Å; F268-F272 VanDerWaalsContact O-CD2 3.25Å; F268-F272 WeakPolarHBondContact O-CD2 3.37Å; F268-F272 PolarHBondContact O-N 3.22Å; F268-L390 HydrophobicContact CE1-CD1 3.95Å; F268-L390 HydrophobicContact CZ-CD1 3.56Å; F268-L390 HydrophobicContact CZ-CG 4.42Å; F268-E393 HydrophobicContact CE2-CB 4.02Å; F268-L394 HydrophobicContact CD1-CD1 4.46Å; F268-L394 HydrophobicContact CE1-CD1 4.03Å; F268-L394 HydrophobicContact CE2-CB 4.17Å; F268-L394 HydrophobicContact CZ-CB 3.8Å; F268-L394 HydrophobicContact CZ-CD1 4.09Å; F268-F397 HydrophobicContact CB-CB 4.48Å; F268-F397 HydrophobicContact CB-CD1 3.97Å; F268-F397 HydrophobicContact CB-CD2 3.62Å; F268-F397 HydrophobicContact CB-CE1 4.09Å; F268-F397 HydrophobicContact CB-CE2 3.75Å; F268-F397 HydrophobicContact CB-CG 3.74Å; F268-F397 HydrophobicContact CB-CZ 3.98Å; F268-F397 HydrophobicContact CD2-CB 3.82Å; F268-F397 HydrophobicContact CD2-CD2 4.36Å; F268-F397 HydrophobicContact CD2-CG 4.01Å; F268-F397 HydrophobicContact CE2-CB 4.44Å; F268-F397 HydrophobicContact CG-CB 4.44Å; F268-F397 HydrophobicContact CG-CD1 4.42Å; F268-F397 HydrophobicContact CG-CD2 4.43Å; F268-F397 HydrophobicContact CG-CG 4.17Å; F268-L435 HydrophobicContact CD1-CD1 4.42Å; F268-L435 HydrophobicContact CE1-CD1 3.91Å
269	K	88.6	Confident	81.9	Confident	98 Å²	98	33.3 Å²	33.3	43%	0.426	16%	0.158	S	C	.	.	H	α-helix	trans	-53.9	-46	175.5	-73.2	174.7	-174.1	176.2	0	111.6	Q265 Q266 W267 N273 F397	Q265-K269 WeakPolarHBondContact O-CG 3.34Å; Q265-K269 PolarHBondContact O-N 2.86Å; Q266-K269 WeakPolarHBondContact O-CB 3.38Å; Q266-K269 PolarHBondContact O-N 3.41Å; W267-K269 PolarHBondContact O-N 3.35Å; K269-N273 WeakPolarHBondContact O-CB 3.42Å; K269-N273 PolarHBondContact O-N 3.41Å; K269-N273 PolarHBondContact O-ND2 3.19Å; K269-N273 PolarHBondContact O-OD1 2.97Å; K269-F397 HydrophobicContact CB-CE2 4.44Å; K269-F397 HydrophobicContact CG-CE2 3.68Å; K269-F397 HydrophobicContact CG-CZ 4.47Å
270	Q	86.7	Confident	80.1	Confident	53 Å²	53	39.4 Å²	39.4	25%	0.248	19%	0.19	C	C	.	.	H	α-helix	trans	-63.5	-48.3	178.3	-69	168.9	-19	0	0	111.6	Q266 W267 F268 F272 N273 D274 Q299	Q266-Q270 WeakPolarHBondContact O-CG 3.31Å; Q266-Q270 PolarHBondContact O-N 3.45Å; Q266-Q270 VanDerWaalsContact O-N 3.15Å; W267-Q270 PolarHBondContact O-N 3.2Å; F268-Q270 VanDerWaalsContact C-N 3.28Å; F268-Q270 PolarHBondContact O-N 3.38Å; Q270-F272 PolarHBondContact O-N 2.88Å; Q270-N273 PolarHBondContact O-N 2.93Å; Q270-D274 PolarHBondContact O-N 3.28Å; Q270-Q299 HydrophobicContact CB-CB 4.29Å; Q270-Q299 HydrophobicContact CB-CG 4.17Å
271	Q	82.9	Confident	78.3	Confident	2 Å²	2	45.8 Å²	45.8	1%	0.009	22%	0.221	C	C	.	.	H	α-helix	trans	-60.5	-43.8	-179.4	-67.9	-69.5	-20.2	0	0	112.6	W267 F268 I275 L296	W267-Q271 HydrophobicContact CD2-CG 3.84Å; W267-Q271 HydrophobicContact CE3-CG 4.09Å; W267-Q271 HydrophobicContact CG-CG 4.41Å; W267-Q271 HydrophobicContact CH2-CG 4.05Å; W267-Q271 HydrophobicContact CZ2-CG 3.77Å; W267-Q271 VanDerWaalsContact CZ2-NE2 3.33Å; W267-Q271 HydrophobicContact CZ3-CG 4.2Å; W267-Q271 WeakPolarHBondContact O-CG 3.5Å; W267-Q271 PolarHBondContact O-N 3.28Å; F268-Q271 PolarHBondContact O-N 2.82Å; Q271-I275 WeakPolarHBondContact O-CD1 3.36Å; Q271-I275 VanDerWaalsContact O-CG1 3.27Å; Q271-I275 WeakPolarHBondContact O-CG1 3.21Å; Q271-I275 PolarHBondContact O-N 3.45Å; Q271-L296 PolarHBondContact NE2-O 2.75Å; Q271-L296 VanDerWaalsContact NE2-O 3.14Å; Q271-L296 VanDerWaalsContact OE1-CA 3.29Å; Q271-L296 PolarHBondContact OE1-O 2.68Å
272	F	80.2	Confident	76.5	Confident	4 Å²	4	48.5 Å²	48.5	2%	0.018	24%	0.241	C	C	.	.	H	α-helix	trans	-82.5	-28.5	-177.5	-73.3	-75.7	0	0	0	113.8	F268 Q270 I275 Q276 L394 F397 F403 L412 L431 L435	F268-F272 HydrophobicContact CB-CD2 4.23Å; F268-F272 HydrophobicContact CB-CE2 4.41Å; F268-F272 HydrophobicContact CD1-CE2 4.18Å; F268-F272 VanDerWaalsContact O-CD2 3.25Å; F268-F272 WeakPolarHBondContact O-CD2 3.37Å; F268-F272 PolarHBondContact O-N 3.22Å; Q270-F272 PolarHBondContact O-N 2.88Å; F272-I275 HydrophobicContact CD1-CD1 4.05Å; F272-I275 HydrophobicContact CE1-CD1 4.43Å; F272-I275 PolarHBondContact O-N 3.01Å; F272-Q276 PolarHBondContact O-N 2.82Å; F272-Q276 VanDerWaalsContact O-N 3.16Å; F272-L394 HydrophobicContact CE2-CD1 4.24Å; F272-L394 HydrophobicContact CZ-CD1 4.29Å; F272-F397 HydrophobicContact CB-CE1 4.22Å; F272-F397 HydrophobicContact CB-CZ 4.24Å; F272-F397 HydrophobicContact CD2-CD1 4Å; F272-F397 AromaticContact CD2-CE1 3.25Å; F272-F397 HydrophobicContact CD2-CE1 3.25Å; F272-F397 AromaticContact CD2-CZ 3.84Å; F272-F397 HydrophobicContact CD2-CZ 3.84Å; F272-F397 HydrophobicContact CE2-CD1 4.07Å; F272-F397 AromaticContact CE2-CE1 3.77Å; F272-F397 HydrophobicContact CE2-CE1 3.77Å; F272-F397 AromaticContact CG-CE1 3.88Å; F272-F397 HydrophobicContact CG-CE1 3.88Å; F272-F397 HydrophobicContact CG-CZ 4.36Å; F272-F403 HydrophobicContact CB-CZ 4.35Å; F272-F403 HydrophobicContact CD1-CE1 4.39Å; F272-F403 HydrophobicContact CD1-CZ 4.03Å; F272-F403 HydrophobicContact CG-CZ 4.16Å; F272-L412 HydrophobicContact CD1-CD1 4.35Å; F272-L412 HydrophobicContact CE1-CD1 4.12Å; F272-L431 HydrophobicContact CZ-CD2 4.27Å; F272-L435 HydrophobicContact CZ-CD1 4.36Å
273	N	76.3	Confident	74.5	Confident	74 Å²	74	54.3 Å²	54.3	40%	0.396	27%	0.272	S	S	.	.	H	α-helix	trans	-64.6	-43.6	172.7	-76.3	-7.7	0	0	0	111.8	K269 Q270 I275 Q276 Y277 Y401	K269-N273 WeakPolarHBondContact O-CB 3.42Å; K269-N273 PolarHBondContact O-N 3.41Å; K269-N273 PolarHBondContact O-ND2 3.19Å; K269-N273 PolarHBondContact O-OD1 2.97Å; Q270-N273 PolarHBondContact O-N 2.93Å; N273-I275 VanDerWaalsContact C-N 3.27Å; N273-I275 PolarHBondContact O-N 3.46Å; N273-Q276 PolarHBondContact O-N 2.98Å; N273-Q276 VanDerWaalsContact O-N 3.15Å; N273-Y277 PolarHBondContact O-N 3.34Å; N273-Y401 PolarHBondContact OD1-OH 2.77Å
274	D	62.9	Low	72.4	Confident	53 Å²	53	60.1 Å²	60.1	28%	0.283	30%	0.303	S	S	.	.	H	α-helix	trans	-63.7	-34.8	177.9	-76.1	-9	0	0	0	112.2	Q270 Y277 S278 Q299	Q270-D274 PolarHBondContact O-N 3.28Å; D274-Y277 PolarHBondContact O-N 3.31Å; D274-S278 WeakPolarHBondContact O-CB 3.37Å; D274-S278 PolarHBondContact O-N 2.97Å; D274-S278 PolarHBondContact O-OG 2.78Å; D274-Q299 WeakPolarHBondContact OD2-CG 3.48Å; D274-Q299 PolarHBondContact OD2-NE2 2.86Å
275	I	63.7	Low	70.3	Confident	11 Å²	11	66.5 Å²	66.5	6%	0.056	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-45.3	173.5	-67.2	166.8	0	0	0	110.3	Q271 F272 N273 S278 M279 I291 L296	Q271-I275 WeakPolarHBondContact O-CD1 3.36Å; Q271-I275 VanDerWaalsContact O-CG1 3.27Å; Q271-I275 WeakPolarHBondContact O-CG1 3.21Å; Q271-I275 PolarHBondContact O-N 3.45Å; F272-I275 HydrophobicContact CD1-CD1 4.05Å; F272-I275 HydrophobicContact CE1-CD1 4.43Å; F272-I275 PolarHBondContact O-N 3.01Å; N273-I275 VanDerWaalsContact C-N 3.27Å; N273-I275 PolarHBondContact O-N 3.46Å; I275-S278 WeakPolarHBondContact CA-OG 3.27Å; I275-S278 PolarHBondContact O-N 2.91Å; I275-S278 PolarHBondContact O-OG 2.81Å; I275-M279 HydrophobicContact CG2-CE 3.95Å; I275-M279 HydrophobicContact CG2-SD 4.29Å; I275-M279 WeakPolarHBondContact O-CB 3.39Å; I275-M279 WeakPolarHBondContact O-CG 3.32Å; I275-M279 PolarHBondContact O-N 3.14Å; I275-I291 HydrophobicContact CD1-CD1 4.04Å; I275-I291 HydrophobicContact CD1-CG1 4.47Å; I275-I291 HydrophobicContact CD1-CG2 4.25Å; I275-I291 HydrophobicContact CG1-CG2 4.33Å; I275-L296 HydrophobicContact CD1-CD2 4.15Å
276	Q	60.8	Low	68.2	Low	59 Å²	59	72.8 Å²	72.8	28%	0.276	37%	0.37	S	S	.	.	H	α-helix	trans	-62.7	-44.2	177.5	-71.1	-175.5	-45.7	0	0	112	F272 N273 M279 L280 Y401	F272-Q276 PolarHBondContact O-N 2.82Å; F272-Q276 VanDerWaalsContact O-N 3.16Å; N273-Q276 PolarHBondContact O-N 2.98Å; N273-Q276 VanDerWaalsContact O-N 3.15Å; Q276-M279 PolarHBondContact O-N 3.13Å; Q276-L280 WeakPolarHBondContact O-CG 3.31Å; Q276-L280 PolarHBondContact O-N 2.86Å; Q276-L280 VanDerWaalsContact O-N 3.09Å; Q276-Y401 PolarHBondContact OE1-OH 3.16Å
277	Y	55.9	Low	66	Low	154 Å²	154	76.5 Å²	76.5	60%	0.604	39%	0.391	S	S	*	.	H	α-helix	trans	-65.1	-43.4	178.8	-171.8	-96.8	0	0	0	112.5	N273 D274 M279 L280 M281	N273-Y277 PolarHBondContact O-N 3.34Å; D274-Y277 PolarHBondContact O-N 3.31Å; Y277-M279 PolarHBondContact O-N 2.91Å; Y277-L280 PolarHBondContact O-N 3.05Å; Y277-M281 HydrophobicContact CD1-CG 4.26Å; Y277-M281 HydrophobicContact CE1-CG 3.9Å; Y277-M281 WeakPolarHBondContact O-CG 3.2Å; Y277-M281 PolarHBondContact O-N 3.07Å; Y277-M281 VanDerWaalsContact O-N 3.12Å
278	S	57.1	Low	63.8	Low	32 Å²	32	80.3 Å²	80.3	22%	0.224	41%	0.411	C	S	.	.	H	α-helix	trans	-66.5	-35.1	177.7	58.8	0	0	0	0	113.2	D274 I275 M281 S282 L295	D274-S278 WeakPolarHBondContact O-CB 3.37Å; D274-S278 PolarHBondContact O-N 2.97Å; D274-S278 PolarHBondContact O-OG 2.78Å; I275-S278 WeakPolarHBondContact CA-OG 3.27Å; I275-S278 PolarHBondContact O-N 2.91Å; I275-S278 PolarHBondContact O-OG 2.81Å; S278-M281 PolarHBondContact O-N 3.2Å; S278-S282 WeakPolarHBondContact O-CB 3.41Å; S278-S282 PolarHBondContact O-N 2.98Å; S278-S282 VanDerWaalsContact O-N 3.12Å; S278-L295 WeakPolarHBondContact OG-CD1 3.41Å
279	M	57.8	Low	61.7	Low	50 Å²	50	85.5 Å²	85.5	25%	0.246	44%	0.439	C	S	.	.	H	α-helix	trans	-65.2	-41.1	172.2	-76	-174.8	175.6	0	0	112.3	I275 Q276 Y277 M281 S282	I275-M279 HydrophobicContact CG2-CE 3.95Å; I275-M279 HydrophobicContact CG2-SD 4.29Å; I275-M279 WeakPolarHBondContact O-CB 3.39Å; I275-M279 WeakPolarHBondContact O-CG 3.32Å; I275-M279 PolarHBondContact O-N 3.14Å; Q276-M279 PolarHBondContact O-N 3.13Å; Y277-M279 PolarHBondContact O-N 2.91Å; M279-M281 VanDerWaalsContact C-N 3.28Å; M279-M281 PolarHBondContact O-N 3.27Å; M279-S282 PolarHBondContact O-N 3.44Å
280	L	58.3	Low	59.8	Low	130 Å²	130	89.2 Å²	89.2	68%	0.681	46%	0.455	S	S	*	.	H	α-helix	trans	-63.6	-32.5	175.8	-74.2	167.8	0	0	0	112.8	Q276 Y277	Q276-L280 WeakPolarHBondContact O-CG 3.31Å; Q276-L280 PolarHBondContact O-N 2.86Å; Q276-L280 VanDerWaalsContact O-N 3.09Å; Y277-L280 PolarHBondContact O-N 3.05Å
281	M	57	Low	58.1	Low	133 Å²	133	87.6 Å²	87.6	66%	0.655	45%	0.448	S	S	*	.	H	α-helix	trans	-85.4	-17.5	-179.3	-68.2	-66.5	-72.6	0	0	113.9	Y277 S278 M279 N283	Y277-M281 HydrophobicContact CD1-CG 4.26Å; Y277-M281 HydrophobicContact CE1-CG 3.9Å; Y277-M281 WeakPolarHBondContact O-CG 3.2Å; Y277-M281 PolarHBondContact O-N 3.07Å; Y277-M281 VanDerWaalsContact O-N 3.12Å; S278-M281 PolarHBondContact O-N 3.2Å; M279-M281 VanDerWaalsContact C-N 3.28Å; M279-M281 PolarHBondContact O-N 3.27Å; M281-N283 PolarHBondContact O-N 3.12Å
282	S	58.5	Low	56.5	Low	62 Å²	62	89.8 Å²	89.8	43%	0.434	46%	0.462	S	S	.	.			trans	-89.2	101.8	179.2	-177.6	0	0	0	0	110.7	S278 M279 N284	S278-S282 WeakPolarHBondContact O-CB 3.41Å; S278-S282 PolarHBondContact O-N 2.98Å; S278-S282 VanDerWaalsContact O-N 3.12Å; M279-S282 PolarHBondContact O-N 3.44Å; S282-N284 PolarHBondContact O-N 3.23Å; S282-N284 VanDerWaalsContact O-N 3.1Å
283	N	53.1	Low	54.9	Low	156 Å²	156	98 Å²	98	83%	0.834	50%	0.498	S	S	*	.			trans	-69.2	3.4	170.1	-81.8	-9.3	0	0	0	113.9	M281	M281-N283 PolarHBondContact O-N 3.12Å
284	N	51.8	Low	53.6	Low	121 Å²	121	101.8 Å²	101.8	65%	0.647	51%	0.508	S	S	*	.			trans	-100.2	102.2	179.1	-83.7	-23.5	0	0	0	111	S282 D286	S282-N284 PolarHBondContact O-N 3.23Å; S282-N284 VanDerWaalsContact O-N 3.1Å; N284-D286 PolarHBondContact O-N 3.43Å
285	I	51.6	Low	52.9	Low	135 Å²	135	100.9 Å²	100.9	69%	0.692	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-61.8	-24.9	-178.8	-65.8	165.7	0	0	0	112.6	N287 I288	I285-N287 PolarHBondContact O-N 2.89Å; I285-I288 HydrophobicContact CG2-CD1 4.32Å; I285-I288 WeakPolarHBondContact O-CD1 3.29Å; I285-I288 VanDerWaalsContact O-CG1 3.29Å; I285-I288 WeakPolarHBondContact O-CG1 3.5Å
286	D	51.2	Low	52.3	Low	144 Å²	144	100.9 Å²	100.9	77%	0.77	50%	0.503	S	S	*	.	G	3₁₀ helix	trans	-80.3	-12.4	-168.6	-64.8	-27.7	0	0	0	115.4	N284	N284-D286 PolarHBondContact O-N 3.43Å
287	N	47.2	Very low	51.9	Low	135 Å²	135	103.7 Å²	103.7	72%	0.722	52%	0.517	S	S	*	.	G	3₁₀ helix	trans	-99.3	13.8	-177.3	-94.4	-18.7	0	0	0	115.2	I285 N289	I285-N287 PolarHBondContact O-N 2.89Å; N287-N289 PolarHBondContact O-N 2.97Å; N287-N289 VanDerWaalsContact O-N 3.13Å
288	I	47.4	Very low	52.2	Low	81 Å²	81	102 Å²	102	42%	0.415	52%	0.519	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-19.9	179.7	-65.3	168.5	0	0	0	113	I285 K290	I285-I288 HydrophobicContact CG2-CD1 4.32Å; I285-I288 WeakPolarHBondContact O-CD1 3.29Å; I285-I288 VanDerWaalsContact O-CG1 3.29Å; I285-I288 WeakPolarHBondContact O-CG1 3.5Å; I288-K290 PolarHBondContact O-N 2.8Å
289	N	47.4	Very low	53	Low	109 Å²	109	103.3 Å²	103.3	58%	0.583	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79	-14.7	-163	-72.6	-45	0	0	0	116.6	N287	N287-N289 PolarHBondContact O-N 2.97Å; N287-N289 VanDerWaalsContact O-N 3.13Å
290	K	47.9	Very low	54.3	Low	176 Å²	176	104.7 Å²	104.7	77%	0.765	53%	0.534	S	S	*	.	S	Bend	trans	-142.3	131.1	177.3	-76.4	179.2	179.3	171	0	108.8	I288 P292	I288-K290 PolarHBondContact O-N 2.8Å; K290-P292 WeakPolarHBondContact O-CD 3.41Å; K290-P292 VanDerWaalsContact O-N 3.08Å
291	I	51.9	Low	56	Low	19 Å²	19	98.8 Å²	98.8	10%	0.097	50%	0.503	C	S	.	.			trans	-55.7	119.4	165.5	-48	172.3	0	0	0	106.5	I275 K293 L295 L296 H409	I275-I291 HydrophobicContact CD1-CD1 4.04Å; I275-I291 HydrophobicContact CD1-CG1 4.47Å; I275-I291 HydrophobicContact CD1-CG2 4.25Å; I275-I291 HydrophobicContact CG1-CG2 4.33Å; I291-K293 PolarHBondContact O-N 3.25Å; I291-L295 HydrophobicContact CG2-CB 4.43Å; I291-L296 HydrophobicContact CB-CD1 3.99Å; I291-L296 HydrophobicContact CB-CG 4.31Å; I291-L296 HydrophobicContact CD1-CD1 3.84Å; I291-L296 HydrophobicContact CD1-CD2 4.16Å; I291-L296 HydrophobicContact CD1-CG 4.31Å; I291-L296 HydrophobicContact CG1-CD1 4.48Å; I291-L296 HydrophobicContact CG2-CD1 3.79Å; I291-L296 HydrophobicContact CG2-CD2 4.11Å; I291-L296 HydrophobicContact CG2-CG 3.55Å; I291-H409 WeakPolarHBondContact CG1-NE2 3.25Å
292	P	48.5	Very low	57.7	Low	48 Å²	48	93 Å²	93	31%	0.312	48%	0.476	S	S	.	.			trans	-57.1	120	171.4	-21.1	31.8	0	0	0	107.6	K290 Y294 L295	K290-P292 WeakPolarHBondContact O-CD 3.41Å; K290-P292 VanDerWaalsContact O-N 3.08Å; P292-Y294 HydrophobicContact CB-CD1 3.48Å; P292-Y294 VanDerWaalsContact CB-CD1 3.48Å; P292-Y294 HydrophobicContact CB-CE1 3.11Å; P292-Y294 HydrophobicContact CB-CE2 4.46Å; P292-Y294 HydrophobicContact CB-CG 4.3Å; P292-Y294 HydrophobicContact CG-CE1 4.05Å; P292-Y294 PolarHBondContact O-N 3.49Å; P292-L295 HydrophobicContact CB-CD1 4.14Å; P292-L295 HydrophobicContact CG-CD1 3.78Å; P292-L295 PolarHBondContact O-N 3.46Å
293	K	47.4	Very low	59.3	Low	175 Å²	175	93.9 Å²	93.9	76%	0.761	47%	0.473	S	S	*	.	H	α-helix	trans	-50.1	-29.4	-175	-81	-177.7	175.2	-179.7	0	112.9	I291 L295 M297	I291-K293 PolarHBondContact O-N 3.25Å; K293-L295 VanDerWaalsContact C-N 3.34Å; K293-L295 PolarHBondContact O-N 2.93Å; K293-M297 VanDerWaalsContact O-CG 3.29Å; K293-M297 WeakPolarHBondContact O-CG 3.48Å; K293-M297 PolarHBondContact O-N 3.24Å
294	Y	48.6	Very low	61.2	Low	154 Å²	154	86.7 Å²	86.7	60%	0.604	43%	0.434	S	S	*	.	H	α-helix	trans	-67.5	-27	177.9	71.6	-99.3	0	0	0	114.1	P292	P292-Y294 HydrophobicContact CB-CD1 3.48Å; P292-Y294 VanDerWaalsContact CB-CD1 3.48Å; P292-Y294 HydrophobicContact CB-CE1 3.11Å; P292-Y294 HydrophobicContact CB-CE2 4.46Å; P292-Y294 HydrophobicContact CB-CG 4.3Å; P292-Y294 HydrophobicContact CG-CE1 4.05Å; P292-Y294 PolarHBondContact O-N 3.49Å
295	L	48.5	Very low	63.2	Low	35 Å²	35	83.7 Å²	83.7	18%	0.183	42%	0.418	C	S	.	.	H	α-helix	trans	-74.4	-35.9	178.4	-81.5	160.6	0	0	0	112.2	S278 I291 P292 K293 M297	S278-L295 WeakPolarHBondContact OG-CD1 3.41Å; I291-L295 HydrophobicContact CG2-CB 4.43Å; P292-L295 HydrophobicContact CB-CD1 4.14Å; P292-L295 HydrophobicContact CG-CD1 3.78Å; P292-L295 PolarHBondContact O-N 3.46Å; K293-L295 VanDerWaalsContact C-N 3.34Å; K293-L295 PolarHBondContact O-N 2.93Å; L295-M297 VanDerWaalsContact C-N 3.29Å; L295-M297 PolarHBondContact O-N 2.88Å
296	L	50.8	Low	65.2	Low	10 Å²	10	82.3 Å²	82.3	5%	0.052	40%	0.404	C	S	.	.	H	α-helix	trans	-73.1	-22.5	175.9	-69.3	169.7	0	0	0	113.2	Q271 I275 I291 N298 L435 P438	Q271-L296 PolarHBondContact NE2-O 2.75Å; Q271-L296 VanDerWaalsContact NE2-O 3.14Å; Q271-L296 VanDerWaalsContact OE1-CA 3.29Å; Q271-L296 PolarHBondContact OE1-O 2.68Å; I275-L296 HydrophobicContact CD1-CD2 4.15Å; I291-L296 HydrophobicContact CB-CD1 3.99Å; I291-L296 HydrophobicContact CB-CG 4.31Å; I291-L296 HydrophobicContact CD1-CD1 3.84Å; I291-L296 HydrophobicContact CD1-CD2 4.16Å; I291-L296 HydrophobicContact CD1-CG 4.31Å; I291-L296 HydrophobicContact CG1-CD1 4.48Å; I291-L296 HydrophobicContact CG2-CD1 3.79Å; I291-L296 HydrophobicContact CG2-CD2 4.11Å; I291-L296 HydrophobicContact CG2-CG 3.55Å; L296-N298 PolarHBondContact O-N 3.09Å; L296-L435 HydrophobicContact CD1-CD2 4.42Å; L296-L435 HydrophobicContact CD2-CD2 3.73Å; L296-P438 HydrophobicContact CB-CB 4.26Å; L296-P438 HydrophobicContact CB-CG 4.01Å
297	M	51.9	Low	67.3	Low	118 Å²	118	75.5 Å²	75.5	58%	0.581	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.9	-14.7	-164.1	-91.8	171	62.3	0	0	115.1	K293 L295	K293-M297 VanDerWaalsContact O-CG 3.29Å; K293-M297 WeakPolarHBondContact O-CG 3.48Å; K293-M297 PolarHBondContact O-N 3.24Å; L295-M297 VanDerWaalsContact C-N 3.29Å; L295-M297 PolarHBondContact O-N 2.88Å
298	N	62.1	Low	69.6	Low	120 Å²	120	69.1 Å²	69.1	64%	0.642	33%	0.333	S	S	*	.			trans	-112.7	-5.3	-157.6	-68.5	-5.1	0	0	0	116.5	L296	L296-N298 PolarHBondContact O-N 3.09Å
299	Q	74.3	Confident	71.8	Confident	58 Å²	58	71 Å²	71	27%	0.271	34%	0.341	S	S	.	.	P	Polyproline II helix	trans	-86.8	124.6	-179.9	-61.5	-58.9	-27.7	0	0	111.8	W267 Q270 D274	W267-Q299 PolarHBondContact NE1-O 3.12Å; Q270-Q299 HydrophobicContact CB-CB 4.29Å; Q270-Q299 HydrophobicContact CB-CG 4.17Å; D274-Q299 WeakPolarHBondContact OD2-CG 3.48Å; D274-Q299 PolarHBondContact OD2-NE2 2.86Å
300	P	85.8	Confident	74	Confident	80 Å²	80	68.1 Å²	68.1	52%	0.519	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-65.8	144.1	-179.7	28.7	-34.4	0	0	0	110.4
301	F	92.2	Very high	76.2	Confident	5 Å²	5	60.2 Å²	60.2	2%	0.022	30%	0.295	C	S	.	.	P	Polyproline II helix	trans	-71	141	172.8	-165.7	-97	0	0	0	110.4	F255 A263 I264 W267 H303 F439 S442 L443 N446 W449	F255-F301 HydrophobicContact CE1-CE1 4.09Å; F255-F301 HydrophobicContact CE1-CZ 4.38Å; F255-F301 AromaticContact CZ-CE1 3.65Å; F255-F301 HydrophobicContact CZ-CE1 3.65Å; F255-F301 HydrophobicContact CZ-CZ 4.06Å; A263-F301 HydrophobicContact CB-CE1 3.62Å; A263-F301 HydrophobicContact CB-CE2 4.43Å; A263-F301 HydrophobicContact CB-CZ 3.44Å; A263-F301 VanDerWaalsContact CB-CZ 3.44Å; I264-F301 HydrophobicContact CD1-CE2 3.98Å; W267-F301 HydrophobicContact CB-CD2 4.17Å; W267-F301 HydrophobicContact CB-CE2 4.19Å; W267-F301 AromaticContact CD1-CD2 3.97Å; W267-F301 AromaticContact CG-CD2 3.97Å; W267-F301 HydrophobicContact CG-CD2 3.97Å; W267-F301 HydrophobicContact CG-CE2 4.34Å; F301-H303 PolarHBondContact O-N 3.33Å; F301-F439 HydrophobicContact CD2-CD2 4.29Å; F301-F439 HydrophobicContact CD2-CE2 4.17Å; F301-F439 HydrophobicContact CE2-CD2 4.07Å; F301-F439 AromaticContact CE2-CE2 3.62Å; F301-F439 HydrophobicContact CE2-CE2 3.62Å; F301-F439 HydrophobicContact CZ-CE2 4.22Å; F301-S442 WeakPolarHBondContact CB-O 3.34Å; F301-L443 HydrophobicContact CD1-CD1 3.52Å; F301-L443 HydrophobicContact CE1-CD1 3.69Å; F301-L443 HydrophobicContact CG-CD1 4Å; F301-L443 HydrophobicContact CZ-CD1 4.3Å; F301-N446 PolarHBondContact O-ND2 3.09Å; F301-W449 AromaticContact CD1-CD1 3.96Å; F301-W449 AromaticContact CD1-NE1 3.6Å; F301-W449 AromaticContact CE1-NE1 3.75Å
302	P	92.6	Very high	78.2	Confident	13 Å²	13	61.4 Å²	61.4	8%	0.084	30%	0.303	C	S	.	.	P	Polyproline II helix	trans	-53.1	140.4	-179.4	-30.6	38.1	0	0	0	113.9	A263 Q266 W306 V307 W449	A263-P302 HydrophobicContact CB-CB 4.41Å; A263-P302 WeakPolarHBondContact O-CG 3.26Å; Q266-P302 HydrophobicContact CB-CG 4.13Å; Q266-P302 HydrophobicContact CG-CG 4.13Å; P302-W306 HydrophobicContact CB-CE3 3.83Å; P302-W306 HydrophobicContact CB-CZ3 4.11Å; P302-V307 HydrophobicContact CB-CG2 3.98Å; P302-W449 PolarHBondContact O-NE1 2.88Å
303	H	92.2	Very high	80.3	Confident	80 Å²	80	59.6 Å²	59.6	37%	0.37	29%	0.291	S	S	.	.	P	Polyproline II helix	trans	-72	147.8	-176.8	-153.7	-87.6	0	0	0	112.2	F301 I305 W306 V307 D448	F301-H303 PolarHBondContact O-N 3.33Å; H303-I305 PolarHBondContact O-N 3.36Å; H303-W306 PolarHBondContact O-N 3.46Å; H303-W306 VanDerWaalsContact O-N 3.17Å; H303-V307 WeakPolarHBondContact O-CG2 3.42Å; H303-V307 PolarHBondContact O-N 2.78Å; H303-V307 VanDerWaalsContact O-N 3.13Å; H303-D448 IonicContact CE1-OD2 3.53Å; H303-D448 PolarHBondContact CE1-OD2 2.92Å; H303-D448 IonicContact ND1-OD2 3.2Å; H303-D448 IonicContact NE2-OD2 3.57Å; H303-D448 PolarHBondContact NE2-OD2 2.85Å
304	V	94.4	Very high	82.3	Confident	4 Å²	4	55.5 Å²	55.5	2%	0.024	28%	0.276	C	S	.	.	H	α-helix	trans	-51.6	-44.6	177.5	173.3	0	0	0	0	111.5	K251 R253 V307 N308 D448 W449	K251-V304 HydrophobicContact CB-CG1 4.36Å; K251-V304 WeakPolarHBondContact O-CG1 3.32Å; R253-V304 HydrophobicContact CG-CG1 4.32Å; V304-V307 PolarHBondContact O-N 3.24Å; V304-N308 VanDerWaalsContact CG1-ND2 3.3Å; V304-N308 WeakPolarHBondContact CG1-ND2 3.2Å; V304-N308 WeakPolarHBondContact O-CB 3.38Å; V304-N308 PolarHBondContact O-N 3.32Å; V304-N308 PolarHBondContact O-ND2 2.85Å; V304-D448 HydrophobicContact CB-CB 4.23Å; V304-D448 HydrophobicContact CG2-CB 3.51Å; V304-W449 VanDerWaalsContact CA-CZ2 3.48Å; V304-W449 HydrophobicContact CB-CH2 4.4Å; V304-W449 HydrophobicContact CB-CZ2 4.19Å; V304-W449 HydrophobicContact CG2-CD2 3.45Å; V304-W449 VanDerWaalsContact CG2-CD2 3.45Å; V304-W449 VanDerWaalsContact CG2-CE2 3.42Å; V304-W449 HydrophobicContact CG2-CE3 3.81Å; V304-W449 HydrophobicContact CG2-CG 3.89Å; V304-W449 HydrophobicContact CG2-CH2 4.05Å; V304-W449 HydrophobicContact CG2-CZ2 3.74Å; V304-W449 HydrophobicContact CG2-CZ3 4.08Å
305	I	93.6	Very high	84.1	Confident	59 Å²	59	55 Å²	55	30%	0.303	28%	0.279	S	S	.	.	H	α-helix	trans	-55.9	-56.4	178.8	-61	171.6	0	0	0	111	K251 H303 V307 N308 E309	K251-I305 HydrophobicContact CD-CG1 4.1Å; K251-I305 HydrophobicContact CG-CG1 4.49Å; H303-I305 PolarHBondContact O-N 3.36Å; I305-V307 VanDerWaalsContact C-N 3.3Å; I305-V307 PolarHBondContact O-N 3.48Å; I305-N308 PolarHBondContact O-N 3.3Å; I305-E309 HydrophobicContact CG2-CG 4.46Å; I305-E309 WeakPolarHBondContact O-CG 3.42Å; I305-E309 PolarHBondContact O-N 2.96Å
306	W	93.8	Very high	85.7	Confident	106 Å²	106	62.9 Å²	62.9	40%	0.402	31%	0.312	S	S	.	.	H	α-helix	trans	-59.3	-41.3	-177.8	178.9	83	0	0	0	112.4	Q266 P302 H303 S310	Q266-W306 HydrophobicContact CB-CH2 3.84Å; Q266-W306 HydrophobicContact CB-CZ3 4.06Å; Q266-W306 HydrophobicContact CG-CH2 3.81Å; Q266-W306 HydrophobicContact CG-CZ2 4.4Å; Q266-W306 HydrophobicContact CG-CZ3 4.18Å; P302-W306 HydrophobicContact CB-CE3 3.83Å; P302-W306 HydrophobicContact CB-CZ3 4.11Å; H303-W306 PolarHBondContact O-N 3.46Å; H303-W306 VanDerWaalsContact O-N 3.17Å; W306-S310 VanDerWaalsContact O-CB 3.31Å; W306-S310 WeakPolarHBondContact O-CB 3.23Å; W306-S310 PolarHBondContact O-N 3.49Å; W306-S310 PolarHBondContact O-OG 3.23Å
307	V	95.3	Very high	87.4	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-67	-42.2	179.4	175.7	0	0	0	0	111.3	R259 L262 A263 P302 H303 V304 I305 S310 E311 W449	R259-V307 HydrophobicContact CB-CG1 3.66Å; R259-V307 HydrophobicContact CG-CG1 3.89Å; R259-V307 WeakPolarHBondContact O-CG1 3.45Å; L262-V307 HydrophobicContact CB-CG1 4.37Å; A263-V307 HydrophobicContact CB-CG2 3.71Å; P302-V307 HydrophobicContact CB-CG2 3.98Å; H303-V307 WeakPolarHBondContact O-CG2 3.42Å; H303-V307 PolarHBondContact O-N 2.78Å; H303-V307 VanDerWaalsContact O-N 3.13Å; V304-V307 PolarHBondContact O-N 3.24Å; I305-V307 VanDerWaalsContact C-N 3.3Å; I305-V307 PolarHBondContact O-N 3.48Å; V307-S310 CarbonylContact O-C 3.57Å; V307-S310 PolarHBondContact O-N 2.98Å; V307-E311 PolarHBondContact O-N 3.1Å; V307-W449 HydrophobicContact CB-CH2 3.86Å; V307-W449 HydrophobicContact CB-CZ2 3.95Å; V307-W449 HydrophobicContact CG1-CH2 3.86Å; V307-W449 HydrophobicContact CG1-CZ2 4.34Å; V307-W449 HydrophobicContact CG2-CH2 4.13Å; V307-W449 HydrophobicContact CG2-CZ2 3.76Å
308	N	95.4	Very high	89	Confident	2 Å²	2	63.3 Å²	63.3	1%	0.011	32%	0.318	C	S	.	.	H	α-helix	trans	-69	-36.6	178.3	-82.8	-84.1	0	0	0	112.6	K130 L250 L252 V304 I305 S310 E311	K130-N308 PolarHBondContact NZ-OD1 2.92Å; L250-N308 WeakPolarHBondContact O-CB 3.49Å; L250-N308 PolarHBondContact O-OD1 3.27Å; L252-N308 PolarHBondContact N-ND2 3.02Å; L252-N308 PolarHBondContact N-OD1 2.61Å; L252-N308 PolarHBondContact O-ND2 3.41Å; V304-N308 VanDerWaalsContact CG1-ND2 3.3Å; V304-N308 WeakPolarHBondContact CG1-ND2 3.2Å; V304-N308 WeakPolarHBondContact O-CB 3.38Å; V304-N308 PolarHBondContact O-N 3.32Å; V304-N308 PolarHBondContact O-ND2 2.85Å; I305-N308 PolarHBondContact O-N 3.3Å; N308-S310 VanDerWaalsContact C-N 3.3Å; N308-E311 PolarHBondContact O-N 3.33Å
309	E	93.8	Very high	90.4	Very high	121 Å²	121	59 Å²	59	57%	0.565	29%	0.294	S	S	*	.	H	α-helix	trans	-66.4	-33.4	172.4	-73.8	176.5	175.3	0	0	112	K248 I305	K248-E309 WeakPolarHBondContact CE-O 3.3Å; K248-E309 PolarHBondContact NZ-O 3.35Å; I305-E309 HydrophobicContact CG2-CG 4.46Å; I305-E309 WeakPolarHBondContact O-CG 3.42Å; I305-E309 PolarHBondContact O-N 2.96Å
310	S	93.3	Very high	91.2	Very high	48 Å²	48	56.7 Å²	56.7	34%	0.336	28%	0.284	S	S	.	.	H	α-helix	trans	-83.5	-16.6	177.6	-57.5	0	0	0	0	113.6	W306 V307 N308 P312	W306-S310 VanDerWaalsContact O-CB 3.31Å; W306-S310 WeakPolarHBondContact O-CB 3.23Å; W306-S310 PolarHBondContact O-N 3.49Å; W306-S310 PolarHBondContact O-OG 3.23Å; V307-S310 CarbonylContact O-C 3.57Å; V307-S310 PolarHBondContact O-N 2.98Å; N308-S310 VanDerWaalsContact C-N 3.3Å; S310-P312 WeakPolarHBondContact O-CD 3.29Å
311	E	94.7	Very high	91.6	Very high	10 Å²	10	57.1 Å²	57.1	5%	0.047	28%	0.281	C	S	.	.			trans	-64.2	119.3	-179.4	-172.6	177.5	-157.5	0	0	110.9	K130 K248 N256 T258 R259 L262 V307 N308	K130-E311 WeakPolarHBondContact CD-OE2 3.4Å; K130-E311 WeakPolarHBondContact CE-OE2 3.1Å; K130-E311 IonicContact NZ-OE2 3.78Å; K130-E311 PolarHBondContact NZ-OE2 2.9Å; K248-E311 PolarHBondContact NZ-O 3.01Å; N256-E311 PolarHBondContact ND2-OE1 2.87Å; N256-E311 VanDerWaalsContact ND2-OE1 3.1Å; T258-E311 HydrophobicContact CG2-CG 4.15Å; R259-E311 WeakPolarHBondContact CD-OE2 3.43Å; R259-E311 VanDerWaalsContact CG-CD 3.49Å; R259-E311 HydrophobicContact CG-CG 4.21Å; R259-E311 WeakPolarHBondContact CG-OE1 3.45Å; R259-E311 IonicContact NE-OE1 2.79Å; R259-E311 IonicContact NE-OE2 2.84Å; L262-E311 HydrophobicContact CD1-CB 4.33Å; V307-E311 PolarHBondContact O-N 3.1Å; N308-E311 PolarHBondContact O-N 3.33Å
312	P	93.5	Very high	91.7	Very high	43 Å²	43	57.2 Å²	57.2	28%	0.279	28%	0.281	S	S	.	.			trans	-73.8	140.2	172.7	31	-33.6	0	0	0	110.1	T258 S310 H315 T317	T258-P312 HydrophobicContact CG2-CG 4.34Å; S310-P312 WeakPolarHBondContact O-CD 3.29Å; P312-H315 WeakPolarHBondContact CB-O 3.44Å; P312-H315 VanDerWaalsContact CG-O 3.3Å; P312-H315 WeakPolarHBondContact CG-O 3.38Å; P312-T317 HydrophobicContact CG-CG2 3.58Å
313	I	92.2	Very high	91.9	Very high	11 Å²	11	58.3 Å²	58.3	6%	0.056	29%	0.286	C	S	.	.	S	Bend	trans	-85.6	-51.3	-178.9	-61.7	176.8	0	0	0	110.5	F131 F134 Y244 V247 K248	F131-I313 WeakPolarHBondContact CB-O 3.37Å; F131-I313 VanDerWaalsContact CD2-O 3.23Å; F131-I313 WeakPolarHBondContact CD2-O 3.41Å; F134-I313 HydrophobicContact CB-CG2 3.9Å; F134-I313 HydrophobicContact CD1-CG2 4.25Å; F134-I313 HydrophobicContact CG-CG2 4.09Å; Y244-I313 HydrophobicContact CD2-CD1 3.78Å; Y244-I313 HydrophobicContact CE2-CD1 3.66Å; V247-I313 HydrophobicContact CG2-CD1 3.63Å; V247-I313 HydrophobicContact CG2-CG2 4.37Å; K248-I313 HydrophobicContact CB-CD1 3.99Å; K248-I313 HydrophobicContact CD-CD1 3.89Å; K248-I313 HydrophobicContact CD-CG1 4.45Å
314	I	89.1	Confident	92	Very high	88 Å²	88	54.7 Å²	54.7	45%	0.451	27%	0.269	S	S	.	.	S	Bend	trans	-96.3	-42	-172.1	-56.8	169.3	0	0	0	111.8	F134	F134-I314 HydrophobicContact CD1-CD1 4.1Å; F134-I314 HydrophobicContact CD1-CG1 3.79Å; F134-I314 HydrophobicContact CE1-CD1 3.37Å; F134-I314 HydrophobicContact CE1-CG1 3.61Å; F134-I314 HydrophobicContact CZ-CD1 4.08Å
315	H	86.2	Confident	92	Very high	144 Å²	144	54.5 Å²	54.5	67%	0.667	27%	0.268	S	S	*	.	S	Bend	trans	-87.2	142.5	-172.5	-53.7	-62	0	0	0	111.2	P312	P312-H315 WeakPolarHBondContact CB-O 3.44Å; P312-H315 VanDerWaalsContact CG-O 3.3Å; P312-H315 WeakPolarHBondContact CG-O 3.38Å
316	K	82.4	Confident	92.1	Very high	201 Å²	201	51.7 Å²	51.7	87%	0.874	25%	0.254	S	S	*	.	P	Polyproline II helix	trans	-76.2	142.7	171.7	-67.1	-175.4	178.9	178.4	0	110.2
317	T	86.4	Confident	92.1	Very high	29 Å²	29	47.7 Å²	47.7	18%	0.178	24%	0.242	C	C	.	.	P	Polyproline II helix	trans	-74.4	171.2	167.6	57.7	0	0	0	0	110.9	T258 L262 P312 Q319	T258-T317 HydrophobicContact CG2-CG2 3.83Å; L262-T317 HydrophobicContact CD2-CG2 4.35Å; P312-T317 HydrophobicContact CG-CG2 3.58Å; T317-Q319 PolarHBondContact O-N 2.65Å; T317-Q319 WeakPolarHBondContact OG1-CB 3.49Å; T317-Q319 WeakPolarHBondContact OG1-CG 3.39Å; T317-Q319 PolarHBondContact OG1-NE2 3.39Å
318	D	86.6	Confident	92	Very high	107 Å²	107	49.9 Å²	49.9	57%	0.572	25%	0.254	S	S	*	.	S	Bend	trans	-77.5	32.5	171.8	64.3	-18.4	0	0	0	112.8	H261 K400	H261-D318 IonicContact NE2-OD1 3.73Å; H261-D318 PolarHBondContact NE2-OD1 2.92Å; D318-K400 PolarHBondContact O-NZ 3.49Å; D318-K400 IonicContact OD1-NZ 3.96Å; D318-K400 PolarHBondContact OD1-NZ 3.2Å; D318-K400 VanDerWaalsContact OD1-NZ 3.16Å; D318-K400 WeakPolarHBondContact OD2-CE 3.34Å; D318-K400 IonicContact OD2-NZ 3.47Å; D318-K400 PolarHBondContact OD2-NZ 2.96Å
319	Q	90.2	Very high	91.8	Very high	31 Å²	31	59.3 Å²	59.3	15%	0.145	29%	0.291	C	S	.	.			trans	-73.4	151.1	176.2	69.7	-174.7	-70.4	0	0	111.1	R257 T258 H261 T317	R257-Q319 VanDerWaalsContact CB-OE1 3.25Å; T258-Q319 PolarHBondContact OG1-NE2 3.28Å; H261-Q319 HydrophobicContact CB-CB 4.12Å; T317-Q319 PolarHBondContact O-N 2.65Å; T317-Q319 WeakPolarHBondContact OG1-CB 3.49Å; T317-Q319 WeakPolarHBondContact OG1-CG 3.39Å; T317-Q319 PolarHBondContact OG1-NE2 3.39Å
320	P	92.3	Very high	91.8	Very high	9 Å²	9	58.8 Å²	58.8	6%	0.058	29%	0.287	C	S	.	.			trans	-63.2	153.9	175.9	25.6	-33	0	0	0	112.2	I322 L370 M372 V392 A396	P320-I322 HydrophobicContact CB-CG1 4.36Å; P320-I322 HydrophobicContact CG-CD1 4.14Å; P320-I322 HydrophobicContact CG-CG1 4.07Å; P320-I322 PolarHBondContact O-N 2.86Å; P320-L370 CarbonylContact C-O 3.6Å; P320-L370 WeakPolarHBondContact CA-O 3.49Å; P320-L370 HydrophobicContact CB-CB 4.14Å; P320-L370 WeakPolarHBondContact CB-O 3.25Å; P320-M372 HydrophobicContact CB-CG 3.96Å; P320-V392 HydrophobicContact CB-CG1 4.23Å; P320-V392 HydrophobicContact CG-CG1 3.44Å; P320-V392 VanDerWaalsContact CG-CG1 3.44Å; P320-A396 HydrophobicContact CG-CB 4.16Å
321	I	93.3	Very high	91.9	Very high	89 Å²	89	56.8 Å²	56.8	46%	0.456	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.1	104.3	171.1	-60.2	173.2	0	0	0	107.8	P369 L370 T371 M372	I321-P369 HydrophobicContact CD1-CG 4.01Å; I321-P369 HydrophobicContact CG1-CB 4.34Å; I321-P369 HydrophobicContact CG1-CG 4.33Å; I321-L370 PolarHBondContact N-O 3.29Å; I321-T371 HydrophobicContact CG2-CG2 4.44Å; I321-T371 CarbonylContact O-C 3.53Å; I321-T371 WeakPolarHBondContact O-CA 3.3Å; I321-M372 PolarHBondContact O-N 2.89Å
322	I	95	Very high	91.9	Very high	6 Å²	6	58.4 Å²	58.4	3%	0.031	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	127.1	-176.6	-53.6	174.1	0	0	0	110.6	R257 P320 M324 M372 I374 M389 V392	R257-I322 PolarHBondContact NH1-O 3.35Å; R257-I322 PolarHBondContact NH2-O 2.88Å; P320-I322 HydrophobicContact CB-CG1 4.36Å; P320-I322 HydrophobicContact CG-CD1 4.14Å; P320-I322 HydrophobicContact CG-CG1 4.07Å; P320-I322 PolarHBondContact O-N 2.86Å; I322-M324 HydrophobicContact CG2-CB 4.15Å; I322-M372 WeakPolarHBondContact CA-O 3.34Å; I322-M372 HydrophobicContact CG1-CB 4.46Å; I322-I374 HydrophobicContact CG2-CD1 3.85Å; I322-M389 HydrophobicContact CD1-CE 3.39Å; I322-M389 HydrophobicContact CD1-SD 3.7Å; I322-M389 HydrophobicContact CG2-SD 4.32Å; I322-V392 HydrophobicContact CD1-CG1 3.65Å; I322-V392 HydrophobicContact CG1-CG1 3.94Å
323	I	95.3	Very high	91.8	Very high	37 Å²	37	62 Å²	62	19%	0.19	30%	0.299	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.5	90.3	172.3	-50.4	175.9	0	0	0	106.9	C326 K330 M372 Y373 I374	I323-C326 HydrophobicContact CG2-CB 3.72Å; I323-K330 HydrophobicContact CG2-CD 3.96Å; I323-M372 PolarHBondContact N-O 3.33Å; I323-Y373 HydrophobicContact CB-CD1 4.26Å; I323-Y373 HydrophobicContact CD1-CD1 4.04Å; I323-Y373 HydrophobicContact CD1-CE1 3.52Å; I323-I374 PolarHBondContact O-N 3.3Å
324	M	95.5	Very high	91.8	Very high	3 Å²	3	67.9 Å²	67.9	2%	0.015	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	143.3	-175.8	-179.6	179	-96.7	0	0	112.2	I322 C326 I374 L376 Q385 A388 M389 F456 A458 D459	I322-M324 HydrophobicContact CG2-CB 4.15Å; M324-C326 VanDerWaalsContact C-N 3.28Å; M324-C326 PolarHBondContact O-N 3.32Å; M324-I374 CarbonylContact C-O 3.52Å; M324-I374 HydrophobicContact CB-CB 4.35Å; M324-I374 HydrophobicContact CB-CD1 4.29Å; M324-I374 HydrophobicContact CE-CD1 3.49Å; M324-I374 VanDerWaalsContact CE-CD1 3.49Å; M324-I374 HydrophobicContact CE-CG2 4.42Å; M324-I374 HydrophobicContact CG-CB 4.23Å; M324-I374 HydrophobicContact CG-CD1 4.31Å; M324-I374 HydrophobicContact CG-CG2 4.36Å; M324-L376 HydrophobicContact CG-CD1 4.09Å; M324-Q385 HydrophobicContact CE-CB 4.05Å; M324-Q385 HydrophobicContact SD-CB 4.2Å; M324-Q385 HydrophobicContact SD-CG 4.34Å; M324-A388 HydrophobicContact CE-CB 4.11Å; M324-M389 HydrophobicContact CE-CG 3.72Å; M324-M389 HydrophobicContact CE-SD 3.84Å; M324-F456 HydrophobicContact SD-CB 3.91Å; M324-A458 HydrophobicContact CB-CB 4.4Å; M324-A458 HydrophobicContact CG-CB 3.76Å; M324-A458 HydrophobicContact SD-CB 3.77Å; M324-D459 PolarHBondContact O-N 2.99Å
325	G	95.2	Very high	91.9	Very high	0 Å²	0	63.7 Å²	63.7	0%	0	31%	0.305	C	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	30	-179	0	0	0	0	0	112	I374 D459 W461	G325-I374 PolarHBondContact N-O 3.37Å; G325-D459 CarbonylContact O-C 3.59Å; G325-D459 WeakPolarHBondContact O-CB 3.17Å; G325-W461 VanDerWaalsContact O-CB 3.27Å; G325-W461 WeakPolarHBondContact O-CB 3.29Å; G325-W461 PolarHBondContact O-N 3.49Å
326	C	94.2	Very high	92.2	Very high	1 Å²	1	60.2 Å²	60.2	1%	0.007	29%	0.289	C	S	.	.			trans	-83.6	153.7	-175.3	63.3	0	0	0	0	113.1	I323 M324 K330 I374	I323-C326 HydrophobicContact CG2-CB 3.72Å; M324-C326 VanDerWaalsContact C-N 3.28Å; M324-C326 PolarHBondContact O-N 3.32Å; C326-K330 HydrophobicContact CB-CB 4.31Å; C326-K330 HydrophobicContact CB-CD 4.13Å; C326-I374 PolarHBondContact N-O 2.95Å
327	S	94.6	Very high	92.7	Very high	22 Å²	22	58.3 Å²	58.3	15%	0.154	28%	0.28	C	S	.	.			trans	-62.5	147	168.5	-178.3	0	0	0	0	111.8	Y329 K330	S327-Y329 PolarHBondContact O-N 3.42Å; S327-Y329 PolarHBondContact OG-N 2.9Å; S327-K330 VanDerWaalsContact O-CB 3.31Å; S327-K330 WeakPolarHBondContact O-CB 3.45Å; S327-K330 PolarHBondContact O-N 3.47Å
328	L	92.2	Very high	93	Very high	46 Å²	46	59.3 Å²	59.3	24%	0.241	28%	0.284	C	S	.	.	G	3₁₀ helix	trans	-54.5	-33.9	173.3	-67.8	177.8	0	0	0	112.4	K330 L331 L339 V375 L463	L328-K330 PolarHBondContact O-N 3.43Å; L328-L331 HydrophobicContact CD2-CD1 4.03Å; L328-L331 VanDerWaalsContact O-CB 3.27Å; L328-L331 WeakPolarHBondContact O-CB 3.31Å; L328-L331 WeakPolarHBondContact O-CG 3.16Å; L328-L331 PolarHBondContact O-N 3.17Å; L328-L331 VanDerWaalsContact O-N 3.13Å; L328-L339 HydrophobicContact CB-CD1 4.47Å; L328-L339 HydrophobicContact CD1-CD1 4.4Å; L328-L339 HydrophobicContact CD2-CD1 3.95Å; L328-L339 HydrophobicContact CD2-CD2 3.61Å; L328-L339 HydrophobicContact CD2-CG 4.46Å; L328-V375 HydrophobicContact CD2-CG1 3.95Å; L328-V375 HydrophobicContact CD2-CG2 3.96Å; L328-L463 HydrophobicContact CD1-CD1 3.87Å
329	Y	92.3	Very high	93.1	Very high	199 Å²	199	55.3 Å²	55.3	78%	0.78	26%	0.263	S	S	*	.	G	3₁₀ helix	trans	-68.3	-16.9	178.4	-64.7	-73.6	0	0	0	113.9	S327 L331	S327-Y329 PolarHBondContact O-N 3.42Å; S327-Y329 PolarHBondContact OG-N 2.9Å; Y329-L331 VanDerWaalsContact C-N 3.31Å
330	K	94.4	Very high	93.1	Very high	111 Å²	111	58.1 Å²	58.1	48%	0.483	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-81.6	-15.6	176.2	-161.2	165.1	-176.8	175.1	0	112.1	I323 C326 S327 L328 Y373	I323-K330 HydrophobicContact CG2-CD 3.96Å; C326-K330 HydrophobicContact CB-CB 4.31Å; C326-K330 HydrophobicContact CB-CD 4.13Å; S327-K330 VanDerWaalsContact O-CB 3.31Å; S327-K330 WeakPolarHBondContact O-CB 3.45Å; S327-K330 PolarHBondContact O-N 3.47Å; L328-K330 PolarHBondContact O-N 3.43Å; K330-Y373 HydrophobicContact CG-CE1 4.33Å; K330-Y373 WeakPolarHBondContact O-CE1 3.37Å
331	L	93.9	Very high	92.9	Very high	6 Å²	6	61.5 Å²	61.5	3%	0.031	30%	0.301	C	S	.	.	S	Bend	trans	-65.2	140.8	171.8	-62.7	170.7	0	0	0	109.6	L328 Y329 Q336 L339 Y354 Y373 V375	L328-L331 HydrophobicContact CD2-CD1 4.03Å; L328-L331 VanDerWaalsContact O-CB 3.27Å; L328-L331 WeakPolarHBondContact O-CB 3.31Å; L328-L331 WeakPolarHBondContact O-CG 3.16Å; L328-L331 PolarHBondContact O-N 3.17Å; L328-L331 VanDerWaalsContact O-N 3.13Å; Y329-L331 VanDerWaalsContact C-N 3.31Å; L331-Q336 HydrophobicContact CB-CG 3.93Å; L331-Q336 PolarHBondContact O-NE2 3.47Å; L331-L339 HydrophobicContact CD1-CD1 4.35Å; L331-L339 HydrophobicContact CD1-CD2 3.85Å; L331-L339 HydrophobicContact CD1-CG 4.3Å; L331-Y354 HydrophobicContact CD2-CD1 3.94Å; L331-Y354 HydrophobicContact CD2-CG 4.27Å; L331-Y373 VanDerWaalsContact CD2-CB 3.41Å; L331-Y373 HydrophobicContact CD2-CD1 4.12Å; L331-Y373 HydrophobicContact CD2-CG 3.84Å; L331-V375 HydrophobicContact CD1-CG2 4.21Å; L331-V375 HydrophobicContact CD2-CG2 4.45Å
332	P	94.2	Very high	92.6	Very high	43 Å²	43	57.4 Å²	57.4	28%	0.279	28%	0.28	S	S	.	.			trans	-52.9	153.3	165.8	-28.2	36.2	0	0	0	112.3	E334 G335 Q336 Y354 P356 Y373	P332-E334 PolarHBondContact O-N 3.05Å; P332-E334 VanDerWaalsContact O-N 3.13Å; P332-G335 WeakPolarHBondContact O-CA 3.32Å; P332-G335 PolarHBondContact O-N 3.38Å; P332-Q336 PolarHBondContact O-N 2.84Å; P332-Y354 HydrophobicContact CB-CE1 4.13Å; P332-Y354 HydrophobicContact CG-CE1 3.91Å; P332-P356 HydrophobicContact CG-CB 4.38Å; P332-P356 HydrophobicContact CG-CG 3.86Å; P332-Y373 HydrophobicContact CG-CE2 4.17Å
333	I	93.3	Very high	92.3	Very high	119 Å²	119	61.1 Å²	61.1	61%	0.61	30%	0.299	S	S	*	.	H	α-helix	trans	-53.5	-39	-176	-63.3	169.5	0	0	0	111.8	Q336 K337	I333-Q336 PolarHBondContact O-N 3.46Å; I333-K337 WeakPolarHBondContact O-CG 3.38Å; I333-K337 PolarHBondContact O-N 3.32Å; I333-K337 VanDerWaalsContact O-N 3.08Å
334	E	91.4	Very high	91.8	Very high	134 Å²	134	66.2 Å²	66.2	63%	0.626	32%	0.322	S	S	*	.	H	α-helix	trans	-63.7	-43.1	176.3	-66.9	175	-176.3	0	0	112.3	P332 Q336 K337 L338	P332-E334 PolarHBondContact O-N 3.05Å; P332-E334 VanDerWaalsContact O-N 3.13Å; E334-Q336 VanDerWaalsContact C-N 3.33Å; E334-Q336 PolarHBondContact O-N 2.61Å; E334-K337 PolarHBondContact O-N 3.06Å; E334-L338 WeakPolarHBondContact O-CG 3.37Å; E334-L338 PolarHBondContact O-N 3.03Å
335	G	91.1	Very high	91.4	Very high	0 Å²	0	67.2 Å²	67.2	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-62.9	-39.4	174.4	0	0	0	0	0	112.4	P332 K337 L338 L339 Y354	P332-G335 WeakPolarHBondContact O-CA 3.32Å; P332-G335 PolarHBondContact O-N 3.38Å; G335-K337 VanDerWaalsContact C-N 3.34Å; G335-K337 PolarHBondContact O-N 3.44Å; G335-L338 PolarHBondContact O-N 2.82Å; G335-L339 PolarHBondContact O-N 3.07Å; G335-Y354 VanDerWaalsContact CA-CE2 3.46Å; G335-Y354 PolarHBondContact N-OH 3.05Å
336	Q	92.7	Very high	90.8	Very high	71 Å²	71	67.3 Å²	67.3	33%	0.332	33%	0.327	S	S	.	.	H	α-helix	trans	-62.3	-40.5	175.4	-64	-179.8	26.7	0	0	111.9	L331 P332 I333 E334 L338 L339	L331-Q336 HydrophobicContact CB-CG 3.93Å; L331-Q336 PolarHBondContact O-NE2 3.47Å; P332-Q336 PolarHBondContact O-N 2.84Å; I333-Q336 PolarHBondContact O-N 3.46Å; E334-Q336 VanDerWaalsContact C-N 3.33Å; E334-Q336 PolarHBondContact O-N 2.61Å; Q336-L338 VanDerWaalsContact C-N 3.27Å; Q336-L338 PolarHBondContact O-N 2.98Å; Q336-L339 HydrophobicContact CB-CD1 4.37Å; Q336-L339 VanDerWaalsContact O-CB 3.31Å; Q336-L339 WeakPolarHBondContact O-CB 3.17Å; Q336-L339 WeakPolarHBondContact O-CD1 3.3Å; Q336-L339 WeakPolarHBondContact O-CG 3.11Å; Q336-L339 PolarHBondContact O-N 2.96Å
337	K	92.5	Very high	90	Very high	161 Å²	161	72.5 Å²	72.5	70%	0.7	35%	0.352	S	S	*	.	H	α-helix	trans	-65.1	-30.5	176.4	-71.2	174	-179.3	178.2	0	113	I333 E334 G335 L339	I333-K337 WeakPolarHBondContact O-CG 3.38Å; I333-K337 PolarHBondContact O-N 3.32Å; I333-K337 VanDerWaalsContact O-N 3.08Å; E334-K337 PolarHBondContact O-N 3.06Å; G335-K337 VanDerWaalsContact C-N 3.34Å; G335-K337 PolarHBondContact O-N 3.44Å; K337-L339 VanDerWaalsContact C-N 3.31Å
338	L	92.1	Very high	89.5	Confident	50 Å²	50	80.2 Å²	80.2	26%	0.262	38%	0.383	S	S	.	.	H	α-helix	trans	-80.7	-11.1	179.1	-68.4	169.7	0	0	0	113.2	E334 G335 Q336 P340 N341 L342 Y354 Y421	E334-L338 WeakPolarHBondContact O-CG 3.37Å; E334-L338 PolarHBondContact O-N 3.03Å; G335-L338 PolarHBondContact O-N 2.82Å; Q336-L338 VanDerWaalsContact C-N 3.27Å; Q336-L338 PolarHBondContact O-N 2.98Å; L338-P340 VanDerWaalsContact C-CD 3.46Å; L338-N341 PolarHBondContact O-N 3.27Å; L338-L342 HydrophobicContact CB-CD1 3.95Å; L338-L342 HydrophobicContact CB-CG 4.1Å; L338-L342 WeakPolarHBondContact O-CG 3.3Å; L338-L342 PolarHBondContact O-N 3.45Å; L338-Y354 HydrophobicContact CD1-CE2 4.12Å; L338-Y421 HydrophobicContact CD1-CD1 3.97Å; L338-Y421 HydrophobicContact CD1-CG 4.24Å
339	L	89.6	Confident	89.4	Confident	24 Å²	24	79.8 Å²	79.8	13%	0.126	38%	0.378	C	S	.	.	H	α-helix	trans	-49.4	-45.1	-174.6	-79.4	168.9	0	0	0	114.7	L328 L331 G335 Q336 K337 N341 L342 M343 I352	L328-L339 HydrophobicContact CB-CD1 4.47Å; L328-L339 HydrophobicContact CD1-CD1 4.4Å; L328-L339 HydrophobicContact CD2-CD1 3.95Å; L328-L339 HydrophobicContact CD2-CD2 3.61Å; L328-L339 HydrophobicContact CD2-CG 4.46Å; L331-L339 HydrophobicContact CD1-CD1 4.35Å; L331-L339 HydrophobicContact CD1-CD2 3.85Å; L331-L339 HydrophobicContact CD1-CG 4.3Å; G335-L339 PolarHBondContact O-N 3.07Å; Q336-L339 HydrophobicContact CB-CD1 4.37Å; Q336-L339 VanDerWaalsContact O-CB 3.31Å; Q336-L339 WeakPolarHBondContact O-CB 3.17Å; Q336-L339 WeakPolarHBondContact O-CD1 3.3Å; Q336-L339 WeakPolarHBondContact O-CG 3.11Å; Q336-L339 PolarHBondContact O-N 2.96Å; K337-L339 VanDerWaalsContact C-N 3.31Å; L339-N341 VanDerWaalsContact C-N 3.32Å; L339-N341 PolarHBondContact O-N 3.01Å; L339-L342 PolarHBondContact O-N 2.81Å; L339-M343 WeakPolarHBondContact O-CB 3.4Å; L339-M343 VanDerWaalsContact O-CG 3.25Å; L339-M343 WeakPolarHBondContact O-CG 3.27Å; L339-M343 PolarHBondContact O-N 3.3Å; L339-I352 HydrophobicContact CD2-CD1 4.36Å
340	P	89.3	Confident	89.5	Confident	89 Å²	89	71.9 Å²	71.9	58%	0.578	35%	0.349	S	S	*	.	H	α-helix	trans	-57.8	-44	179.4	-25.6	35.6	0	0	0	113	L338 Q344	L338-P340 VanDerWaalsContact C-CD 3.46Å; P340-Q344 PolarHBondContact O-N 3.22Å
341	N	88.7	Confident	89.5	Confident	80 Å²	80	66.6 Å²	66.6	43%	0.428	33%	0.326	S	S	.	.	H	α-helix	trans	-70.2	-39.9	178.7	-62.5	-14.8	0	0	0	111.1	L338 L339 Q344 L345 Y422	L338-N341 PolarHBondContact O-N 3.27Å; L339-N341 VanDerWaalsContact C-N 3.32Å; L339-N341 PolarHBondContact O-N 3.01Å; N341-Q344 PolarHBondContact O-N 3.03Å; N341-L345 PolarHBondContact O-N 3.25Å; N341-Y422 HydrophobicContact CB-CD2 3.95Å; N341-Y422 HydrophobicContact CB-CE2 4.42Å
342	L	88.2	Confident	89.5	Confident	3 Å²	3	66.4 Å²	66.4	2%	0.016	33%	0.325	C	S	.	.	H	α-helix	trans	-66.4	-39.8	178.2	-64.6	179.6	0	0	0	111.9	L338 L339 Q344 L345 C346 I352 Y354 Y421 L425	L338-L342 HydrophobicContact CB-CD1 3.95Å; L338-L342 HydrophobicContact CB-CG 4.1Å; L338-L342 WeakPolarHBondContact O-CG 3.3Å; L338-L342 PolarHBondContact O-N 3.45Å; L339-L342 PolarHBondContact O-N 2.81Å; L342-Q344 PolarHBondContact O-N 3.45Å; L342-L345 PolarHBondContact O-N 2.96Å; L342-C346 WeakPolarHBondContact O-CB 3.22Å; L342-C346 PolarHBondContact O-N 3.37Å; L342-C346 PolarHBondContact O-SG 3.34Å; L342-I352 HydrophobicContact CB-CG2 3.91Å; L342-I352 HydrophobicContact CD1-CG2 4.18Å; L342-Y354 HydrophobicContact CD1-CD2 4.44Å; L342-Y421 HydrophobicContact CD1-CE1 4.27Å; L342-Y421 HydrophobicContact CD2-CD1 3.88Å; L342-Y421 HydrophobicContact CD2-CE1 3.71Å; L342-L425 HydrophobicContact CD2-CD2 3.35Å
343	M	87.4	Confident	89.6	Confident	85 Å²	85	64.4 Å²	64.4	42%	0.419	31%	0.312	S	S	.	.	H	α-helix	trans	-59.7	-46.3	177.3	-77	-179.8	70.6	0	0	110.9	L339 L345 C346 E347 I352	L339-M343 WeakPolarHBondContact O-CB 3.4Å; L339-M343 VanDerWaalsContact O-CG 3.25Å; L339-M343 WeakPolarHBondContact O-CG 3.27Å; L339-M343 PolarHBondContact O-N 3.3Å; M343-L345 VanDerWaalsContact C-N 3.29Å; M343-L345 PolarHBondContact O-N 3.4Å; M343-C346 PolarHBondContact O-N 3.13Å; M343-E347 WeakPolarHBondContact O-CB 3.35Å; M343-E347 PolarHBondContact O-N 3.17Å; M343-I352 HydrophobicContact CG-CD1 3.92Å
344	Q	85.9	Confident	89.6	Confident	143 Å²	143	59 Å²	59	67%	0.668	28%	0.284	S	S	*	.	H	α-helix	trans	-59.7	-38.3	177.7	-170.4	-179.8	12.7	0	0	112.8	P340 N341 L342	P340-Q344 PolarHBondContact O-N 3.22Å; N341-Q344 PolarHBondContact O-N 3.03Å; L342-Q344 PolarHBondContact O-N 3.45Å
345	L	86.1	Confident	89.8	Confident	25 Å²	25	52.7 Å²	52.7	13%	0.131	26%	0.255	C	S	.	.	H	α-helix	trans	-76.5	-40.2	179.5	-174.7	65.6	0	0	0	112.4	N341 L342 M343 Y422 L425 Q426 L429	N341-L345 PolarHBondContact O-N 3.25Å; L342-L345 PolarHBondContact O-N 2.96Å; M343-L345 VanDerWaalsContact C-N 3.29Å; M343-L345 PolarHBondContact O-N 3.4Å; L345-Y422 HydrophobicContact CB-CE2 3.95Å; L345-Y422 HydrophobicContact CD2-CD2 4.41Å; L345-Y422 HydrophobicContact CD2-CE2 4.25Å; L345-Y422 HydrophobicContact CG-CE2 4.48Å; L345-L425 HydrophobicContact CD2-CB 4.1Å; L345-L425 HydrophobicContact CD2-CD2 3.89Å; L345-L425 HydrophobicContact CD2-CG 3.88Å; L345-Q426 HydrophobicContact CD1-CB 4.08Å; L345-Q426 HydrophobicContact CD1-CG 4Å; L345-Q426 HydrophobicContact CD2-CB 4.08Å; L345-L429 HydrophobicContact CD1-CD1 4.35Å; L345-L429 HydrophobicContact CD2-CD1 3.78Å; L345-L429 HydrophobicContact CG-CD1 3.71Å
346	C	83.5	Confident	89.8	Confident	1 Å²	1	54.6 Å²	54.6	1%	0.007	27%	0.267	C	S	.	.	H	α-helix	trans	-91.5	-9.3	-170.1	-72.9	0	0	0	0	114.5	L342 M343 K348 Y349 Y351 I352	L342-C346 WeakPolarHBondContact O-CB 3.22Å; L342-C346 PolarHBondContact O-N 3.37Å; L342-C346 PolarHBondContact O-SG 3.34Å; M343-C346 PolarHBondContact O-N 3.13Å; C346-K348 PolarHBondContact O-N 3.31Å; C346-Y349 PolarHBondContact O-N 3.15Å; C346-Y351 VanDerWaalsContact CB-O 3.3Å; C346-Y351 WeakPolarHBondContact CB-O 3.48Å; C346-I352 HydrophobicContact CB-CB 4.43Å; C346-I352 HydrophobicContact CB-CG1 3.95Å
347	E	76.3	Confident	89.7	Confident	111 Å²	111	53.2 Å²	53.2	52%	0.519	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.1	-30.3	-177.3	-168.7	172.6	-166.7	0	0	113.6	M343 R465	M343-E347 WeakPolarHBondContact O-CB 3.35Å; M343-E347 PolarHBondContact O-N 3.17Å; E347-R465 PolarHBondContact O-NH1 3.28Å; E347-R465 PolarHBondContact O-NH2 3.16Å
348	K	85.6	Confident	89.5	Confident	184 Å²	184	46.8 Å²	46.8	80%	0.8	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-79.9	-15.5	-179.5	-62.9	-178	-178.9	178.8	0	114.9	C346	C346-K348 PolarHBondContact O-N 3.31Å
349	Y	88.9	Confident	89.3	Confident	36 Å²	36	49.4 Å²	49.4	14%	0.141	24%	0.244	C	C	.	.	T	Hydrogen-bonded Turn	trans	-110.2	-2.3	-167.4	-58.1	-78.3	0	0	0	114.6	C346 Y351 L429 N433	C346-Y349 PolarHBondContact O-N 3.15Å; Y349-Y351 WeakPolarHBondContact O-CD1 3.3Å; Y349-Y351 PolarHBondContact O-N 2.79Å; Y349-L429 HydrophobicContact CD2-CD1 4.42Å; Y349-L429 HydrophobicContact CD2-CD2 4.16Å; Y349-L429 HydrophobicContact CE2-CD1 4.05Å; Y349-L429 HydrophobicContact CE2-CD2 4.1Å; Y349-L429 HydrophobicContact CG-CD2 4.42Å; Y349-N433 WeakPolarHBondContact CE1-OD1 3.41Å; Y349-N433 PolarHBondContact OH-ND2 2.92Å
350	N	93.5	Very high	89.1	Confident	34 Å²	34	49.1 Å²	49.1	18%	0.182	25%	0.245	C	C	.	.	T	Hydrogen-bonded Turn	trans	56.7	17.4	-176.2	-59.2	-30.7	0	0	0	114.9	F377 D384 R465	N350-F377 HydrophobicContact CB-CB 4.46Å; N350-F377 WeakPolarHBondContact O-CD2 3.45Å; N350-F377 PolarHBondContact O-N 3.05Å; N350-D384 HydrophobicContact CB-CB 4.33Å; N350-D384 PolarHBondContact ND2-OD2 3.34Å; N350-R465 PolarHBondContact OD1-NH2 3.29Å
351	Y	95.3	Very high	88.9	Confident	0 Å²	0	45.1 Å²	45.1	0%	0	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.1	152.2	167.8	71.1	-93.1	0	0	0	111.1	C346 Y349 L353 I374 V375 K387 A388 H391	C346-Y351 VanDerWaalsContact CB-O 3.3Å; C346-Y351 WeakPolarHBondContact CB-O 3.48Å; Y349-Y351 WeakPolarHBondContact O-CD1 3.3Å; Y349-Y351 PolarHBondContact O-N 2.79Å; Y351-L353 HydrophobicContact CD2-CB 4.41Å; Y351-L353 HydrophobicContact CE2-CB 4.22Å; Y351-I374 HydrophobicContact CD2-CG2 4.45Å; Y351-V375 CarbonylContact C-O 3.59Å; Y351-V375 WeakPolarHBondContact CA-O 3.39Å; Y351-K387 HydrophobicContact CE1-CB 4.29Å; Y351-K387 HydrophobicContact CE1-CG 4.2Å; Y351-A388 HydrophobicContact CD1-CB 3.84Å; Y351-A388 HydrophobicContact CD2-CB 3.73Å; Y351-A388 HydrophobicContact CE1-CB 4.05Å; Y351-A388 HydrophobicContact CE2-CB 3.96Å; Y351-A388 HydrophobicContact CG-CB 3.69Å; Y351-H391 AromaticContact CE2-ND1 3.75Å; Y351-H391 AromaticContact CZ-ND1 3.9Å; Y351-H391 PolarHBondContact OH-ND1 3.21Å; Y351-H391 VanDerWaalsContact OH-ND1 3.11Å
352	I	94.3	Very high	88.6	Confident	2 Å²	2	43.3 Å²	43.3	1%	0.01	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	131.9	168.7	-51.4	177.5	0	0	0	107.8	L339 L342 M343 C346 I374 V375 F377 L463	L339-I352 HydrophobicContact CD2-CD1 4.36Å; L342-I352 HydrophobicContact CB-CG2 3.91Å; L342-I352 HydrophobicContact CD1-CG2 4.18Å; M343-I352 HydrophobicContact CG-CD1 3.92Å; C346-I352 HydrophobicContact CB-CB 4.43Å; C346-I352 HydrophobicContact CB-CG1 3.95Å; I352-I374 WeakPolarHBondContact O-CA 3.46Å; I352-V375 HydrophobicContact CB-CB 4.17Å; I352-V375 PolarHBondContact N-O 2.9Å; I352-V375 PolarHBondContact O-N 3.44Å; I352-F377 HydrophobicContact CD1-CE2 4.14Å; I352-F377 HydrophobicContact CD1-CZ 3.98Å; I352-F377 HydrophobicContact CG1-CE2 3.59Å; I352-F377 HydrophobicContact CG1-CZ 3.93Å; I352-L463 HydrophobicContact CD1-CD2 4.19Å
353	L	95.1	Very high	88.2	Confident	0 Å²	0	48.1 Å²	48.1	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.6	132.6	174.7	-175.5	67.9	0	0	0	109.8	Y351 M372 Y373 I374 H391 V392 I395 Y421 L425	Y351-L353 HydrophobicContact CD2-CB 4.41Å; Y351-L353 HydrophobicContact CE2-CB 4.22Å; L353-M372 HydrophobicContact CD1-CB 4.46Å; L353-M372 HydrophobicContact CD1-CE 3.94Å; L353-M372 HydrophobicContact CD2-CE 3.89Å; L353-M372 HydrophobicContact CG-CE 4.1Å; L353-Y373 WeakPolarHBondContact CA-O 3.15Å; L353-I374 HydrophobicContact CD1-CD1 4.43Å; L353-I374 HydrophobicContact CD1-CG1 3.6Å; L353-H391 HydrophobicContact CD2-CB 4.3Å; L353-V392 HydrophobicContact CD1-CG2 3.56Å; L353-V392 HydrophobicContact CD2-CG2 4.4Å; L353-I395 HydrophobicContact CD2-CD1 3.7Å; L353-Y421 PolarHBondContact O-OH 2.86Å; L353-Y421 VanDerWaalsContact O-OH 3.12Å; L353-L425 HydrophobicContact CB-CD1 4.25Å; L353-L425 HydrophobicContact CD2-CD1 4.4Å
354	Y	95.3	Very high	87.5	Confident	7 Å²	7	45.8 Å²	45.8	3%	0.027	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	129.5	171.6	-179.7	-113.8	0	0	0	111.1	L331 P332 G335 L338 L342 P356 Y373 Y421	L331-Y354 HydrophobicContact CD2-CD1 3.94Å; L331-Y354 HydrophobicContact CD2-CG 4.27Å; P332-Y354 HydrophobicContact CB-CE1 4.13Å; P332-Y354 HydrophobicContact CG-CE1 3.91Å; G335-Y354 VanDerWaalsContact CA-CE2 3.46Å; G335-Y354 PolarHBondContact N-OH 3.05Å; L338-Y354 HydrophobicContact CD1-CE2 4.12Å; L342-Y354 HydrophobicContact CD1-CD2 4.44Å; Y354-P356 HydrophobicContact CD1-CG 4.09Å; Y354-P356 HydrophobicContact CE1-CB 4.01Å; Y354-P356 HydrophobicContact CE1-CG 3.61Å; Y354-Y373 HydrophobicContact CD1-CD2 4.16Å; Y354-Y373 PolarHBondContact N-O 3.44Å; Y354-Y373 PolarHBondContact O-N 3.34Å; Y354-Y421 VanDerWaalsContact CA-OH 3.23Å; Y354-Y421 WeakPolarHBondContact CA-OH 3.25Å; Y354-Y421 HydrophobicContact CD2-CD1 4.22Å; Y354-Y421 AromaticContact CD2-CE1 3.69Å; Y354-Y421 HydrophobicContact CD2-CE1 3.69Å; Y354-Y421 AromaticContact CD2-CZ 3.92Å; Y354-Y421 HydrophobicContact CE2-CD1 4.41Å; Y354-Y421 HydrophobicContact CE2-CE1 4.3Å
355	C	94.3	Very high	86.7	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.			trans	-123.4	105.1	176.9	-179.3	0	0	0	0	108.5	N357 W358 M372 Y421	C355-N357 PolarHBondContact O-N 3.03Å; C355-W358 HydrophobicContact CB-CB 4.2Å; C355-W358 WeakPolarHBondContact O-CB 3.35Å; C355-W358 PolarHBondContact O-N 2.97Å; C355-M372 HydrophobicContact CB-CE 3.78Å; C355-M372 HydrophobicContact CB-SD 3.65Å; C355-M372 PolarHBondContact SG-SD 3.2Å; C355-Y421 HydrophobicContact CB-CE2 4.17Å; C355-Y421 PolarHBondContact N-OH 3.41Å
356	P	92.1	Very high	85.9	Confident	40 Å²	40	45.7 Å²	45.7	26%	0.26	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.4	-40.1	-177.6	-14.7	26.7	0	0	0	112	P332 Y354 W358 T371 Y373	P332-P356 HydrophobicContact CG-CB 4.38Å; P332-P356 HydrophobicContact CG-CG 3.86Å; Y354-P356 HydrophobicContact CD1-CG 4.09Å; Y354-P356 HydrophobicContact CE1-CB 4.01Å; Y354-P356 HydrophobicContact CE1-CG 3.61Å; P356-W358 VanDerWaalsContact C-N 3.3Å; P356-W358 PolarHBondContact O-N 3.4Å; P356-T371 WeakPolarHBondContact CD-O 3.1Å; P356-Y373 HydrophobicContact CG-CD2 4.06Å; P356-Y373 HydrophobicContact CG-CE2 3.64Å
357	N	89	Confident	85.2	Confident	43 Å²	43	53 Å²	53	23%	0.23	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	-93.5	34.8	-179.1	60.5	-23.7	0	0	0	113.2	C355 E359 A360 T371	C355-N357 PolarHBondContact O-N 3.03Å; N357-E359 PolarHBondContact O-N 3.34Å; N357-A360 WeakPolarHBondContact O-CB 3.33Å; N357-A360 PolarHBondContact O-N 3.32Å; N357-A360 VanDerWaalsContact O-N 3.08Å; N357-T371 PolarHBondContact OD1-N 3.47Å
358	W	89.8	Confident	85	Confident	25 Å²	25	53.4 Å²	53.4	10%	0.095	28%	0.281	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-30.2	-178.2	72.5	-82	0	0	0	113.3	C355 P356 A360 V361 Q362 A418 Y421 F424	C355-W358 HydrophobicContact CB-CB 4.2Å; C355-W358 WeakPolarHBondContact O-CB 3.35Å; C355-W358 PolarHBondContact O-N 2.97Å; P356-W358 VanDerWaalsContact C-N 3.3Å; P356-W358 PolarHBondContact O-N 3.4Å; W358-A360 PolarHBondContact O-N 3.24Å; W358-V361 WeakPolarHBondContact O-CB 3.42Å; W358-V361 WeakPolarHBondContact O-CG2 3.42Å; W358-V361 PolarHBondContact O-N 3.49Å; W358-Q362 HydrophobicContact CZ3-CG 4.18Å; W358-A418 HydrophobicContact CZ3-CB 4.35Å; W358-Y421 HydrophobicContact CB-CD2 3.99Å; W358-Y421 HydrophobicContact CB-CE2 3.91Å; W358-Y421 AromaticContact CD1-CD2 3.5Å; W358-Y421 AromaticContact CD2-CD2 3.99Å; W358-Y421 HydrophobicContact CD2-CD2 3.99Å; W358-Y421 AromaticContact CG-CD2 3.53Å; W358-Y421 HydrophobicContact CG-CD2 3.53Å; W358-Y421 AromaticContact CG-CE2 3.98Å; W358-Y421 HydrophobicContact CG-CE2 3.98Å; W358-Y421 AromaticContact NE1-CD2 3.93Å; W358-F424 HydrophobicContact CB-CD1 4.15Å; W358-F424 HydrophobicContact CB-CE1 3.88Å; W358-F424 HydrophobicContact CB-CZ 4.16Å; W358-F424 HydrophobicContact CD2-CD1 4.46Å; W358-F424 HydrophobicContact CD2-CG 4.28Å; W358-F424 HydrophobicContact CE3-CB 3.76Å; W358-F424 HydrophobicContact CE3-CD1 4.1Å; W358-F424 AromaticContact CE3-CD2 3.57Å; W358-F424 HydrophobicContact CE3-CD2 3.57Å; W358-F424 HydrophobicContact CE3-CE2 4.18Å; W358-F424 AromaticContact CE3-CG 3.53Å; W358-F424 HydrophobicContact CE3-CG 3.53Å; W358-F424 HydrophobicContact CZ3-CB 3.84Å; W358-F424 HydrophobicContact CZ3-CD2 4.06Å; W358-F424 HydrophobicContact CZ3-CG 4.06Å
359	E	87.6	Confident	85	Confident	105 Å²	105	47.6 Å²	47.6	49%	0.491	26%	0.262	S	S	.	.	H	α-helix	trans	-61.6	-25.1	176.8	-63.2	-177.6	178.1	0	0	112.5	N357 V361 Q362 Q363	N357-E359 PolarHBondContact O-N 3.34Å; E359-V361 PolarHBondContact O-N 3.33Å; E359-Q362 WeakPolarHBondContact O-CB 3.49Å; E359-Q362 PolarHBondContact O-N 2.93Å; E359-Q363 WeakPolarHBondContact O-CG 3.49Å; E359-Q363 PolarHBondContact O-N 2.92Å
360	A	85.5	Confident	85.1	Confident	18 Å²	18	46.4 Å²	46.4	15%	0.149	26%	0.258	C	S	.	.	H	α-helix	trans	-60.2	-28.1	173.5	0	0	0	0	0	112	N357 W358 Q363 G364 N365 L370	N357-A360 WeakPolarHBondContact O-CB 3.33Å; N357-A360 PolarHBondContact O-N 3.32Å; N357-A360 VanDerWaalsContact O-N 3.08Å; W358-A360 PolarHBondContact O-N 3.24Å; A360-Q363 PolarHBondContact O-N 3.06Å; A360-G364 PolarHBondContact O-N 3.49Å; A360-N365 PolarHBondContact O-N 2.84Å; A360-N365 VanDerWaalsContact O-N 3.11Å; A360-L370 HydrophobicContact CB-CD2 4.41Å
361	V	83.6	Confident	85.1	Confident	6 Å²	6	46.4 Å²	46.4	4%	0.036	26%	0.26	C	S	.	.	H	α-helix	trans	-64.5	-42.8	174.4	-174.9	0	0	0	0	110.7	W358 E359 G364 L370 I395 I398 V399 F424	W358-V361 WeakPolarHBondContact O-CB 3.42Å; W358-V361 WeakPolarHBondContact O-CG2 3.42Å; W358-V361 PolarHBondContact O-N 3.49Å; E359-V361 PolarHBondContact O-N 3.33Å; V361-G364 PolarHBondContact O-N 3.31Å; V361-L370 HydrophobicContact CG2-CD1 4.43Å; V361-I395 HydrophobicContact CG2-CG2 3.73Å; V361-I398 HydrophobicContact CG1-CB 4.16Å; V361-I398 HydrophobicContact CG1-CG2 3.61Å; V361-V399 HydrophobicContact CB-CG2 3.88Å; V361-V399 HydrophobicContact CG1-CG2 4.03Å; V361-V399 HydrophobicContact CG2-CG2 3.46Å; V361-V399 VanDerWaalsContact CG2-CG2 3.46Å; V361-F424 HydrophobicContact CB-CE2 4.16Å; V361-F424 HydrophobicContact CB-CZ 4.48Å; V361-F424 HydrophobicContact CG1-CE2 4.09Å; V361-F424 HydrophobicContact CG2-CE2 4.22Å; V361-F424 HydrophobicContact CG2-CZ 4.03Å
362	Q	82.6	Confident	85.1	Confident	42 Å²	42	46.4 Å²	46.4	20%	0.196	26%	0.26	C	S	.	.	H	α-helix	trans	-70.5	-36.1	178.3	-58	178.5	-57.1	0	0	111.4	W358 E359 G364 K404 I416 A418	W358-Q362 HydrophobicContact CZ3-CG 4.18Å; E359-Q362 WeakPolarHBondContact O-CB 3.49Å; E359-Q362 PolarHBondContact O-N 2.93Å; Q362-G364 VanDerWaalsContact C-N 3.33Å; Q362-K404 VanDerWaalsContact O-CE 3.26Å; Q362-K404 WeakPolarHBondContact O-CE 3.46Å; Q362-K404 PolarHBondContact O-NZ 3.43Å; Q362-I416 WeakPolarHBondContact CG-O 3.49Å; Q362-I416 PolarHBondContact NE2-O 2.97Å; Q362-A418 PolarHBondContact NE2-O 3.27Å
363	Q	79.8	Confident	85.2	Confident	103 Å²	103	48 Å²	48	48%	0.481	27%	0.266	S	S	.	.	H	α-helix	trans	-73.8	-25	178	-65.1	174.7	11.6	0	0	112.4	E359 A360 N365 K404	E359-Q363 WeakPolarHBondContact O-CG 3.49Å; E359-Q363 PolarHBondContact O-N 2.92Å; A360-Q363 PolarHBondContact O-N 3.06Å; Q363-N365 VanDerWaalsContact C-N 3.27Å; Q363-N365 HydrophobicContact CB-CB 4.28Å; Q363-N365 PolarHBondContact OE1-ND2 2.93Å; Q363-K404 VanDerWaalsContact C-NZ 3.27Å; Q363-K404 PolarHBondContact O-NZ 3.05Å
364	G	74.2	Confident	85.3	Confident	36 Å²	36	48 Å²	48	37%	0.371	27%	0.266	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.7	25.4	-171.4	0	0	0	0	0	112.1	A360 V361 Q362 S366	A360-G364 PolarHBondContact O-N 3.49Å; V361-G364 PolarHBondContact O-N 3.31Å; Q362-G364 VanDerWaalsContact C-N 3.33Å; G364-S366 PolarHBondContact O-N 3.18Å
365	N	69.1	Low	85.3	Confident	83 Å²	83	47.9 Å²	47.9	44%	0.444	27%	0.266	S	S	.	.			trans	-86.8	107	-178.3	-82.9	-18.2	0	0	0	109.5	A360 Q363	A360-N365 PolarHBondContact O-N 2.84Å; A360-N365 VanDerWaalsContact O-N 3.11Å; Q363-N365 VanDerWaalsContact C-N 3.27Å; Q363-N365 HydrophobicContact CB-CB 4.28Å; Q363-N365 PolarHBondContact OE1-ND2 2.93Å
366	S	68.2	Low	85.4	Confident	84 Å²	84	47.9 Å²	47.9	59%	0.587	27%	0.266	S	S	*	.			trans	-96.2	3.8	-177.2	60.6	0	0	0	0	114.7	G364 I368	G364-S366 PolarHBondContact O-N 3.18Å; S366-I368 VanDerWaalsContact C-N 3.34Å; S366-I368 PolarHBondContact O-N 3.18Å
367	I	68.3	Low	85.5	Confident	153 Å²	153	46.2 Å²	46.2	79%	0.785	26%	0.255	S	S	*	.	S	Bend	trans	-67.5	-35.2	-171.5	-58.3	171.7	0	0	0	111.8
368	I	73.8	Confident	85.7	Confident	121 Å²	121	46.2 Å²	46.2	62%	0.621	26%	0.258	S	S	*	.	S	Bend	trans	-109.6	130	-177.7	-55.2	173.3	0	0	0	108.5	S366 L370	S366-I368 VanDerWaalsContact C-N 3.34Å; S366-I368 PolarHBondContact O-N 3.18Å; I368-L370 PolarHBondContact O-N 2.86Å
369	P	83.8	Confident	85.8	Confident	62 Å²	62	49 Å²	49	40%	0.403	27%	0.272	S	S	.	.	P	Polyproline II helix	trans	-61	135.7	174.8	25.9	-33.9	0	0	0	110.5	I321 T371	I321-P369 HydrophobicContact CD1-CG 4.01Å; I321-P369 HydrophobicContact CG1-CB 4.34Å; I321-P369 HydrophobicContact CG1-CG 4.33Å; P369-T371 PolarHBondContact O-N 3.22Å
370	L	91.3	Very high	86	Confident	10 Å²	10	44.8 Å²	44.8	5%	0.052	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-60.6	137.8	174.5	-68.1	179.4	0	0	0	110.5	P320 I321 A360 V361 I368 M372 I395 V399	P320-L370 CarbonylContact C-O 3.6Å; P320-L370 WeakPolarHBondContact CA-O 3.49Å; P320-L370 HydrophobicContact CB-CB 4.14Å; P320-L370 WeakPolarHBondContact CB-O 3.25Å; I321-L370 PolarHBondContact N-O 3.29Å; A360-L370 HydrophobicContact CB-CD2 4.41Å; V361-L370 HydrophobicContact CG2-CD1 4.43Å; I368-L370 PolarHBondContact O-N 2.86Å; L370-M372 HydrophobicContact CB-CG 4.46Å; L370-M372 HydrophobicContact CB-SD 4.02Å; L370-M372 HydrophobicContact CD1-SD 4.41Å; L370-I395 HydrophobicContact CD1-CG2 3.7Å; L370-V399 HydrophobicContact CD1-CG2 3.66Å; L370-V399 HydrophobicContact CD2-CG2 4.39Å; L370-V399 HydrophobicContact CG-CG2 4.26Å
371	T	93.9	Very high	86.4	Confident	35 Å²	35	50.9 Å²	50.9	22%	0.215	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.8	123	171	-55.4	0	0	0	0	108.8	I321 P356 N357 P369 Y373	I321-T371 HydrophobicContact CG2-CG2 4.44Å; I321-T371 CarbonylContact O-C 3.53Å; I321-T371 WeakPolarHBondContact O-CA 3.3Å; P356-T371 WeakPolarHBondContact CD-O 3.1Å; N357-T371 PolarHBondContact OD1-N 3.47Å; P369-T371 PolarHBondContact O-N 3.22Å; T371-Y373 HydrophobicContact CG2-CD2 4.24Å; T371-Y373 HydrophobicContact CG2-CE2 3.47Å; T371-Y373 VanDerWaalsContact CG2-CE2 3.47Å
372	M	95.7	Very high	86.8	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.6	122.9	-174	-52.3	-59.7	-71.6	0	0	109.7	P320 I321 I322 I323 L353 C355 L370 V392 I395	P320-M372 HydrophobicContact CB-CG 3.96Å; I321-M372 PolarHBondContact O-N 2.89Å; I322-M372 WeakPolarHBondContact CA-O 3.34Å; I322-M372 HydrophobicContact CG1-CB 4.46Å; I323-M372 PolarHBondContact N-O 3.33Å; L353-M372 HydrophobicContact CD1-CB 4.46Å; L353-M372 HydrophobicContact CD1-CE 3.94Å; L353-M372 HydrophobicContact CD2-CE 3.89Å; L353-M372 HydrophobicContact CG-CE 4.1Å; C355-M372 HydrophobicContact CB-CE 3.78Å; C355-M372 HydrophobicContact CB-SD 3.65Å; C355-M372 PolarHBondContact SG-SD 3.2Å; L370-M372 HydrophobicContact CB-CG 4.46Å; L370-M372 HydrophobicContact CB-SD 4.02Å; L370-M372 HydrophobicContact CD1-SD 4.41Å; M372-V392 HydrophobicContact CB-CG1 4.26Å; M372-V392 HydrophobicContact CB-CG2 3.86Å; M372-V392 HydrophobicContact CE-CG2 3.99Å; M372-V392 HydrophobicContact CG-CG1 3.79Å; M372-V392 HydrophobicContact CG-CG2 4.08Å; M372-I395 HydrophobicContact CE-CB 4.36Å; M372-I395 HydrophobicContact CE-CD1 3.7Å; M372-I395 HydrophobicContact CE-CG2 4.35Å
373	Y	96.8	Very high	87.4	Confident	35 Å²	35	55.3 Å²	55.3	14%	0.137	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	125.9	175.6	-63.3	-100.8	0	0	0	108.8	I323 K330 L331 P332 L353 Y354 P356 T371	I323-Y373 HydrophobicContact CB-CD1 4.26Å; I323-Y373 HydrophobicContact CD1-CD1 4.04Å; I323-Y373 HydrophobicContact CD1-CE1 3.52Å; K330-Y373 HydrophobicContact CG-CE1 4.33Å; K330-Y373 WeakPolarHBondContact O-CE1 3.37Å; L331-Y373 VanDerWaalsContact CD2-CB 3.41Å; L331-Y373 HydrophobicContact CD2-CD1 4.12Å; L331-Y373 HydrophobicContact CD2-CG 3.84Å; P332-Y373 HydrophobicContact CG-CE2 4.17Å; L353-Y373 WeakPolarHBondContact CA-O 3.15Å; Y354-Y373 HydrophobicContact CD1-CD2 4.16Å; Y354-Y373 PolarHBondContact N-O 3.44Å; Y354-Y373 PolarHBondContact O-N 3.34Å; P356-Y373 HydrophobicContact CG-CD2 4.06Å; P356-Y373 HydrophobicContact CG-CE2 3.64Å; T371-Y373 HydrophobicContact CG2-CD2 4.24Å; T371-Y373 HydrophobicContact CG2-CE2 3.47Å; T371-Y373 VanDerWaalsContact CG2-CE2 3.47Å
374	I	96.6	Very high	88.1	Confident	0 Å²	0	51.9 Å²	51.9	0%	0	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.5	176.7	-54.6	167	0	0	0	108.2	I322 I323 M324 G325 C326 Y351 I352 L353 L376 A388 V392	I322-I374 HydrophobicContact CG2-CD1 3.85Å; I323-I374 PolarHBondContact O-N 3.3Å; M324-I374 CarbonylContact C-O 3.52Å; M324-I374 HydrophobicContact CB-CB 4.35Å; M324-I374 HydrophobicContact CB-CD1 4.29Å; M324-I374 HydrophobicContact CE-CD1 3.49Å; M324-I374 VanDerWaalsContact CE-CD1 3.49Å; M324-I374 HydrophobicContact CE-CG2 4.42Å; M324-I374 HydrophobicContact CG-CB 4.23Å; M324-I374 HydrophobicContact CG-CD1 4.31Å; M324-I374 HydrophobicContact CG-CG2 4.36Å; G325-I374 PolarHBondContact N-O 3.37Å; C326-I374 PolarHBondContact N-O 2.95Å; Y351-I374 HydrophobicContact CD2-CG2 4.45Å; I352-I374 WeakPolarHBondContact O-CA 3.46Å; L353-I374 HydrophobicContact CD1-CD1 4.43Å; L353-I374 HydrophobicContact CD1-CG1 3.6Å; I374-L376 HydrophobicContact CG2-CD2 3.68Å; I374-L376 HydrophobicContact CG2-CG 4.36Å; I374-A388 HydrophobicContact CD1-CB 4.07Å; I374-A388 HydrophobicContact CG2-CB 3.96Å; I374-V392 HydrophobicContact CD1-CG2 3.88Å; I374-V392 HydrophobicContact CG1-CG2 4.31Å
375	V	95.7	Very high	89.1	Confident	5 Å²	5	51.4 Å²	51.4	3%	0.03	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	128.3	170.2	-177.2	0	0	0	0	107.2	L328 L331 Y351 I352 L463	L328-V375 HydrophobicContact CD2-CG1 3.95Å; L328-V375 HydrophobicContact CD2-CG2 3.96Å; L331-V375 HydrophobicContact CD1-CG2 4.21Å; L331-V375 HydrophobicContact CD2-CG2 4.45Å; Y351-V375 CarbonylContact C-O 3.59Å; Y351-V375 WeakPolarHBondContact CA-O 3.39Å; I352-V375 HydrophobicContact CB-CB 4.17Å; I352-V375 PolarHBondContact N-O 2.9Å; I352-V375 PolarHBondContact O-N 3.44Å; V375-L463 HydrophobicContact CG1-CB 4.14Å
376	L	95.7	Very high	90.4	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.9	138.2	-179.6	-61.3	177.6	0	0	0	109.5	M324 I374 Q385 A458 R462 L463	M324-L376 HydrophobicContact CG-CD1 4.09Å; I374-L376 HydrophobicContact CG2-CD2 3.68Å; I374-L376 HydrophobicContact CG2-CG 4.36Å; L376-Q385 HydrophobicContact CD1-CG 3.98Å; L376-Q385 HydrophobicContact CD2-CG 4.29Å; L376-A458 HydrophobicContact CD1-CB 4.3Å; L376-R462 CarbonylContact O-C 3.43Å; L376-R462 WeakPolarHBondContact O-CA 3.3Å; L376-L463 PolarHBondContact O-N 2.71Å
377	F	94.6	Very high	91.7	Very high	5 Å²	5	44.8 Å²	44.8	2%	0.022	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-79.4	161.6	171.9	-71.5	-98.3	0	0	0	111	N350 I352 E379 S380 R462 L463 R465	N350-F377 HydrophobicContact CB-CB 4.46Å; N350-F377 WeakPolarHBondContact O-CD2 3.45Å; N350-F377 PolarHBondContact O-N 3.05Å; I352-F377 HydrophobicContact CD1-CE2 4.14Å; I352-F377 HydrophobicContact CD1-CZ 3.98Å; I352-F377 HydrophobicContact CG1-CE2 3.59Å; I352-F377 HydrophobicContact CG1-CZ 3.93Å; F377-E379 PolarHBondContact O-N 3.13Å; F377-S380 WeakPolarHBondContact O-CB 3.12Å; F377-S380 PolarHBondContact O-N 3.49Å; F377-R462 WeakPolarHBondContact O-CD 3.29Å; F377-L463 CarbonylContact C-O 3.58Å; F377-L463 VanDerWaalsContact CA-O 3.3Å; F377-L463 WeakPolarHBondContact CA-O 3.5Å; F377-L463 HydrophobicContact CD1-CB 4.33Å; F377-L463 HydrophobicContact CD1-CD2 4.21Å; F377-L463 HydrophobicContact CD1-CG 4.32Å; F377-L463 HydrophobicContact CE1-CD2 3.77Å; F377-L463 HydrophobicContact CE1-CG 4.31Å; F377-L463 HydrophobicContact CZ-CD2 4.17Å; F377-R465 HydrophobicContact CD1-CG 3.84Å; F377-R465 HydrophobicContact CE1-CG 4.13Å
378	S	92.7	Very high	93.1	Very high	42 Å²	42	37.5 Å²	37.5	29%	0.294	20%	0.197	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-32	176.6	32.3	0	0	0	0	113.7	S380 L463 H464	S378-S380 VanDerWaalsContact C-N 3.26Å; S378-S380 PolarHBondContact O-N 2.97Å; S378-L463 PolarHBondContact N-O 3.32Å; S378-L463 PolarHBondContact OG-O 3.38Å; S378-H464 WeakPolarHBondContact CB-ND1 3.31Å
379	E	91.5	Very high	94.2	Very high	83 Å²	83	31.7 Å²	31.7	39%	0.388	17%	0.167	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.7	-0.5	-179.4	-52	73.5	-133.6	0	0	113.4	F377 K381 R465	F377-E379 PolarHBondContact O-N 3.13Å; E379-K381 PolarHBondContact O-N 3.49Å; E379-R465 IonicContact OE2-CZ 3.85Å; E379-R465 IonicContact OE2-NE 2.78Å; E379-R465 PolarHBondContact OE2-NE 3.11Å; E379-R465 IonicContact OE2-NH2 3.27Å
380	S	93.2	Very high	94.9	Very high	17 Å²	17	28.8 Å²	28.8	12%	0.119	15%	0.148	C	C	.	.			trans	-65.2	120.3	-173.7	-175.4	0	0	0	0	112.4	F377 S378	F377-S380 WeakPolarHBondContact O-CB 3.12Å; F377-S380 PolarHBondContact O-N 3.49Å; S378-S380 VanDerWaalsContact C-N 3.26Å; S378-S380 PolarHBondContact O-N 2.97Å
381	K	93	Very high	95.1	Very high	147 Å²	147	28.3 Å²	28.3	64%	0.639	15%	0.146	S	C	*	.			trans	-96.4	167.3	176.8	-64.6	-179.7	-176.2	178.7	0	111.5	E379 L383 D384 Q385	E379-K381 PolarHBondContact O-N 3.49Å; K381-L383 PolarHBondContact O-N 2.86Å; K381-D384 PolarHBondContact N-OD2 3.34Å; K381-D384 WeakPolarHBondContact O-CB 3.48Å; K381-D384 PolarHBondContact O-N 3.46Å; K381-Q385 PolarHBondContact O-N 3Å
382	P	92.9	Very high	95.3	Very high	58 Å²	58	26.6 Å²	26.6	38%	0.377	14%	0.135	S	C	.	.	H	α-helix	trans	-51.7	-39.2	175.2	-29.4	36.4	0	0	0	113.9	D384 Q385 L386 F454	P382-D384 VanDerWaalsContact C-N 3.33Å; P382-D384 PolarHBondContact O-N 2.99Å; P382-Q385 WeakPolarHBondContact O-CB 3.34Å; P382-Q385 PolarHBondContact O-N 3.46Å; P382-L386 PolarHBondContact O-N 3.11Å; P382-F454 HydrophobicContact CB-CD2 3.88Å; P382-F454 HydrophobicContact CB-CE2 3.87Å; P382-F454 WeakPolarHBondContact O-CD2 3.36Å; P382-F454 WeakPolarHBondContact O-CE2 3.41Å
383	L	94.3	Very high	95.3	Very high	82 Å²	82	26.6 Å²	26.6	43%	0.429	14%	0.135	S	C	.	.	H	α-helix	trans	-66.5	-31	176.1	-69.9	177.4	0	0	0	113.5	K381 Q385 L386 K387 W436 M451	K381-L383 PolarHBondContact O-N 2.86Å; L383-Q385 VanDerWaalsContact C-N 3.34Å; L383-L386 HydrophobicContact CD2-CD2 4.24Å; L383-L386 PolarHBondContact O-N 3.41Å; L383-K387 WeakPolarHBondContact O-CB 3.5Å; L383-K387 PolarHBondContact O-N 3.36Å; L383-W436 WeakPolarHBondContact O-CH2 3.46Å; L383-M451 HydrophobicContact CD2-CE 4.19Å
384	D	94.5	Very high	95.1	Very high	31 Å²	31	25 Å²	25	17%	0.166	13%	0.129	C	C	.	.	H	α-helix	trans	-69	-37.4	174.7	-60.9	-43.6	0	0	0	110.4	N350 K381 P382 K387 A388	N350-D384 HydrophobicContact CB-CB 4.33Å; N350-D384 PolarHBondContact ND2-OD2 3.34Å; K381-D384 PolarHBondContact N-OD2 3.34Å; K381-D384 WeakPolarHBondContact O-CB 3.48Å; K381-D384 PolarHBondContact O-N 3.46Å; P382-D384 VanDerWaalsContact C-N 3.33Å; P382-D384 PolarHBondContact O-N 2.99Å; D384-K387 PolarHBondContact O-N 3.45Å; D384-A388 PolarHBondContact O-N 2.9Å
385	Q	95.4	Very high	95	Very high	27 Å²	27	25 Å²	25	13%	0.126	13%	0.129	C	C	.	.	H	α-helix	trans	-64.7	-42.9	172.5	-61.3	179.4	28.8	0	0	111.3	M324 L376 K381 P382 L383 K387 A388 M389 F456	M324-Q385 HydrophobicContact CE-CB 4.05Å; M324-Q385 HydrophobicContact SD-CB 4.2Å; M324-Q385 HydrophobicContact SD-CG 4.34Å; L376-Q385 HydrophobicContact CD1-CG 3.98Å; L376-Q385 HydrophobicContact CD2-CG 4.29Å; K381-Q385 PolarHBondContact O-N 3Å; P382-Q385 WeakPolarHBondContact O-CB 3.34Å; P382-Q385 PolarHBondContact O-N 3.46Å; L383-Q385 VanDerWaalsContact C-N 3.34Å; Q385-K387 VanDerWaalsContact C-N 3.3Å; Q385-K387 PolarHBondContact O-N 3.48Å; Q385-A388 WeakPolarHBondContact O-CB 3.26Å; Q385-A388 PolarHBondContact O-N 2.92Å; Q385-M389 WeakPolarHBondContact O-CG 3.36Å; Q385-M389 PolarHBondContact O-N 2.99Å; Q385-F456 HydrophobicContact CB-CD2 4.44Å
386	L	96.6	Very high	94.8	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.6	-41.6	173.8	-174.8	67.1	0	0	0	111.4	F260 P382 L383 M389 L390 W436 F439 I440 L443 M451 F454 F456	F260-L386 HydrophobicContact CD2-CD1 4.08Å; F260-L386 HydrophobicContact CE2-CD1 3.53Å; F260-L386 HydrophobicContact CZ-CD1 4.03Å; P382-L386 PolarHBondContact O-N 3.11Å; L383-L386 HydrophobicContact CD2-CD2 4.24Å; L383-L386 PolarHBondContact O-N 3.41Å; L386-M389 PolarHBondContact O-N 3.33Å; L386-L390 PolarHBondContact O-N 2.65Å; L386-W436 HydrophobicContact CB-CH2 4.48Å; L386-W436 HydrophobicContact CD2-CH2 4.36Å; L386-W436 HydrophobicContact CG-CH2 4.48Å; L386-F439 HydrophobicContact CD1-CE1 4.48Å; L386-F439 HydrophobicContact CD1-CZ 4.23Å; L386-F439 HydrophobicContact CD2-CE1 3.8Å; L386-F439 HydrophobicContact CD2-CZ 4.09Å; L386-F439 HydrophobicContact CG-CE1 3.97Å; L386-F439 HydrophobicContact CG-CZ 4.21Å; L386-I440 HydrophobicContact CD2-CD1 4.22Å; L386-L443 HydrophobicContact CD2-CD2 4.35Å; L386-M451 HydrophobicContact CD2-CE 3.84Å; L386-F454 HydrophobicContact CB-CD2 4.33Å; L386-F454 HydrophobicContact CB-CE2 3.88Å; L386-F454 HydrophobicContact CB-CZ 4.15Å; L386-F454 HydrophobicContact CD1-CD1 4.47Å; L386-F454 HydrophobicContact CD1-CE1 4.17Å; L386-F454 HydrophobicContact CD1-CZ 4.27Å; L386-F454 HydrophobicContact CD2-CE1 4.27Å; L386-F454 HydrophobicContact CD2-CE2 4.3Å; L386-F454 HydrophobicContact CD2-CZ 3.75Å; L386-F454 HydrophobicContact CG-CZ 4.28Å; L386-F456 HydrophobicContact CD1-CE2 4.11Å; L386-F456 HydrophobicContact CD1-CZ 3.9Å
387	K	96.2	Very high	94.6	Very high	27 Å²	27	25.1 Å²	25.1	12%	0.117	13%	0.13	C	C	.	.	H	α-helix	trans	-65	-40	175.6	-167.4	168.2	-178.1	173.6	0	112.5	Y351 L383 D384 Q385 M389 L390 H391 V432 N433 W436	Y351-K387 HydrophobicContact CE1-CB 4.29Å; Y351-K387 HydrophobicContact CE1-CG 4.2Å; L383-K387 WeakPolarHBondContact O-CB 3.5Å; L383-K387 PolarHBondContact O-N 3.36Å; D384-K387 PolarHBondContact O-N 3.45Å; Q385-K387 VanDerWaalsContact C-N 3.3Å; Q385-K387 PolarHBondContact O-N 3.48Å; K387-M389 VanDerWaalsContact C-N 3.33Å; K387-L390 PolarHBondContact O-N 3.41Å; K387-H391 WeakPolarHBondContact O-CB 3.33Å; K387-H391 PolarHBondContact O-N 3.21Å; K387-V432 HydrophobicContact CG-CG1 4.08Å; K387-N433 WeakPolarHBondContact CE-OD1 3.36Å; K387-N433 PolarHBondContact NZ-OD1 2.67Å; K387-W436 VanDerWaalsContact CA-CZ3 3.43Å; K387-W436 HydrophobicContact CB-CE3 3.98Å; K387-W436 HydrophobicContact CB-CH2 3.65Å; K387-W436 HydrophobicContact CB-CZ2 4.34Å; K387-W436 HydrophobicContact CB-CZ3 3.46Å; K387-W436 VanDerWaalsContact CB-CZ3 3.46Å; K387-W436 HydrophobicContact CD-CD2 4.03Å; K387-W436 HydrophobicContact CD-CE3 4.07Å; K387-W436 HydrophobicContact CD-CZ2 4.5Å; K387-W436 HydrophobicContact CD-CZ3 4.34Å; K387-W436 HydrophobicContact CG-CD2 4.22Å; K387-W436 HydrophobicContact CG-CE3 3.73Å; K387-W436 HydrophobicContact CG-CH2 4.26Å; K387-W436 HydrophobicContact CG-CZ3 3.77Å
388	A	96.7	Very high	94.3	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	13%	0.131	C	C	.	.	H	α-helix	trans	-63.4	-40	173.8	0	0	0	0	0	111.5	M324 Y351 I374 D384 Q385 H391 V392	M324-A388 HydrophobicContact CE-CB 4.11Å; Y351-A388 HydrophobicContact CD1-CB 3.84Å; Y351-A388 HydrophobicContact CD2-CB 3.73Å; Y351-A388 HydrophobicContact CE1-CB 4.05Å; Y351-A388 HydrophobicContact CE2-CB 3.96Å; Y351-A388 HydrophobicContact CG-CB 3.69Å; I374-A388 HydrophobicContact CD1-CB 4.07Å; I374-A388 HydrophobicContact CG2-CB 3.96Å; D384-A388 PolarHBondContact O-N 2.9Å; Q385-A388 WeakPolarHBondContact O-CB 3.26Å; Q385-A388 PolarHBondContact O-N 2.92Å; A388-H391 WeakPolarHBondContact O-CB 3.5Å; A388-H391 PolarHBondContact O-N 3.01Å; A388-V392 PolarHBondContact O-N 2.91Å
389	M	97.3	Very high	94	Very high	0 Å²	0	23.8 Å²	23.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-65.7	-43.9	174.7	-73	-60.7	-57.4	0	0	112.3	F260 I322 M324 Q385 L386 K387 H391 V392 E393 F456	F260-M389 HydrophobicContact CD1-CB 3.94Å; F260-M389 HydrophobicContact CD1-CE 3.97Å; F260-M389 HydrophobicContact CE1-CB 3.55Å; F260-M389 HydrophobicContact CZ-CB 4.2Å; I322-M389 HydrophobicContact CD1-CE 3.39Å; I322-M389 HydrophobicContact CD1-SD 3.7Å; I322-M389 HydrophobicContact CG2-SD 4.32Å; M324-M389 HydrophobicContact CE-CG 3.72Å; M324-M389 HydrophobicContact CE-SD 3.84Å; Q385-M389 WeakPolarHBondContact O-CG 3.36Å; Q385-M389 PolarHBondContact O-N 2.99Å; L386-M389 PolarHBondContact O-N 3.33Å; K387-M389 VanDerWaalsContact C-N 3.33Å; M389-H391 PolarHBondContact O-N 3.25Å; M389-V392 PolarHBondContact O-N 3.18Å; M389-E393 WeakPolarHBondContact O-CB 3.31Å; M389-E393 WeakPolarHBondContact O-CG 3.47Å; M389-E393 PolarHBondContact O-N 3.36Å; M389-F456 HydrophobicContact CB-CE2 4.31Å; M389-F456 HydrophobicContact CB-CZ 4.33Å; M389-F456 HydrophobicContact CE-CD1 4.14Å; M389-F456 HydrophobicContact CE-CE1 4.35Å; M389-F456 HydrophobicContact CG-CB 4.47Å; M389-F456 HydrophobicContact CG-CD1 4.02Å; M389-F456 HydrophobicContact CG-CD2 3.61Å; M389-F456 HydrophobicContact CG-CE1 4.11Å; M389-F456 HydrophobicContact CG-CE2 3.69Å; M389-F456 HydrophobicContact CG-CG 3.78Å; M389-F456 HydrophobicContact CG-CZ 3.96Å; M389-F456 HydrophobicContact SD-CB 4.43Å; M389-F456 HydrophobicContact SD-CD1 4.32Å; M389-F456 HydrophobicContact SD-CG 4.21Å
390	L	97.2	Very high	93.6	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.118	C	C	.	.	H	α-helix	trans	-55.2	-42.9	172.9	179	71	0	0	0	111	F260 I264 F268 L386 K387 E393 L394 V432 W436 F439	F260-L390 HydrophobicContact CZ-CB 4.47Å; I264-L390 HydrophobicContact CD1-CD1 3.53Å; I264-L390 HydrophobicContact CG1-CD1 3.82Å; F268-L390 HydrophobicContact CE1-CD1 3.95Å; F268-L390 HydrophobicContact CZ-CD1 3.56Å; F268-L390 HydrophobicContact CZ-CG 4.42Å; L386-L390 PolarHBondContact O-N 2.65Å; K387-L390 PolarHBondContact O-N 3.41Å; L390-E393 PolarHBondContact O-N 2.93Å; L390-L394 VanDerWaalsContact O-CB 3.31Å; L390-L394 WeakPolarHBondContact O-CB 3.33Å; L390-L394 PolarHBondContact O-N 3.45Å; L390-V432 HydrophobicContact CD2-CG1 4.19Å; L390-W436 HydrophobicContact CD2-CE3 3.71Å; L390-W436 HydrophobicContact CD2-CZ3 4.24Å; L390-F439 HydrophobicContact CD1-CD1 4.33Å; L390-F439 HydrophobicContact CD1-CD2 4.4Å; L390-F439 HydrophobicContact CD1-CG 4.21Å; L390-F439 HydrophobicContact CD2-CD1 3.96Å; L390-F439 HydrophobicContact CD2-CG 4.33Å
391	H	96.9	Very high	92.7	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-64.8	-45.5	178.8	-168.5	177.4	0	0	0	112.2	Y351 L353 K387 A388 M389 E393 L394 I395 L425 T428 L429 V432	Y351-H391 AromaticContact CE2-ND1 3.75Å; Y351-H391 AromaticContact CZ-ND1 3.9Å; Y351-H391 PolarHBondContact OH-ND1 3.21Å; Y351-H391 VanDerWaalsContact OH-ND1 3.11Å; L353-H391 HydrophobicContact CD2-CB 4.3Å; K387-H391 WeakPolarHBondContact O-CB 3.33Å; K387-H391 PolarHBondContact O-N 3.21Å; A388-H391 WeakPolarHBondContact O-CB 3.5Å; A388-H391 PolarHBondContact O-N 3.01Å; M389-H391 PolarHBondContact O-N 3.25Å; H391-E393 VanDerWaalsContact C-N 3.34Å; H391-E393 PolarHBondContact O-N 2.98Å; H391-L394 PolarHBondContact O-N 3.17Å; H391-I395 WeakPolarHBondContact O-CG1 3.22Å; H391-I395 PolarHBondContact O-N 3.4Å; H391-I395 VanDerWaalsContact O-N 3.17Å; H391-L425 VanDerWaalsContact CE1-CD1 3.48Å; H391-L425 WeakPolarHBondContact CE1-CD1 3.38Å; H391-T428 VanDerWaalsContact NE2-CB 3.34Å; H391-T428 WeakPolarHBondContact NE2-CB 3.1Å; H391-T428 PolarHBondContact NE2-OG1 3.43Å; H391-L429 WeakPolarHBondContact CE1-CD2 3.36Å; H391-L429 VanDerWaalsContact CE1-CG 3.5Å; H391-L429 WeakPolarHBondContact CE1-CG 3.28Å; H391-V432 HydrophobicContact CB-CG1 4.47Å; H391-V432 HydrophobicContact CB-CG2 3.71Å
392	V	96.7	Very high	91.3	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.121	C	C	.	.	H	α-helix	trans	-57.6	-48.6	174.1	162.6	0	0	0	0	111.6	P320 I322 L353 M372 I374 A388 M389 L394 I395 A396	P320-V392 HydrophobicContact CB-CG1 4.23Å; P320-V392 HydrophobicContact CG-CG1 3.44Å; P320-V392 VanDerWaalsContact CG-CG1 3.44Å; I322-V392 HydrophobicContact CD1-CG1 3.65Å; I322-V392 HydrophobicContact CG1-CG1 3.94Å; L353-V392 HydrophobicContact CD1-CG2 3.56Å; L353-V392 HydrophobicContact CD2-CG2 4.4Å; M372-V392 HydrophobicContact CB-CG1 4.26Å; M372-V392 HydrophobicContact CB-CG2 3.86Å; M372-V392 HydrophobicContact CE-CG2 3.99Å; M372-V392 HydrophobicContact CG-CG1 3.79Å; M372-V392 HydrophobicContact CG-CG2 4.08Å; I374-V392 HydrophobicContact CD1-CG2 3.88Å; I374-V392 HydrophobicContact CG1-CG2 4.31Å; A388-V392 PolarHBondContact O-N 2.91Å; M389-V392 PolarHBondContact O-N 3.18Å; V392-L394 VanDerWaalsContact C-N 3.32Å; V392-L394 PolarHBondContact O-N 3.42Å; V392-I395 PolarHBondContact O-N 3.31Å; V392-A396 PolarHBondContact O-N 2.86Å
393	E	95.8	Very high	89.7	Confident	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-70.3	-31.7	-175.2	-70.7	-66.6	162.3	0	0	112.1	F260 H261 I264 Q265 F268 M389 L390 H391 A396 F397	F260-E393 HydrophobicContact CD1-CG 3.98Å; F260-E393 HydrophobicContact CE1-CB 4.4Å; F260-E393 HydrophobicContact CE1-CG 3.84Å; H261-E393 IonicContact CE1-OE2 3.97Å; H261-E393 PolarHBondContact CE1-OE2 3.3Å; H261-E393 IonicContact CG-OE1 3.18Å; H261-E393 IonicContact CG-OE2 2.61Å; H261-E393 IonicContact ND1-OE1 3.3Å; H261-E393 PolarHBondContact ND1-OE1 2.96Å; H261-E393 IonicContact ND1-OE2 3.86Å; H261-E393 PolarHBondContact ND1-OE2 2.9Å; I264-E393 HydrophobicContact CG2-CB 3.47Å; I264-E393 VanDerWaalsContact CG2-CB 3.47Å; I264-E393 HydrophobicContact CG2-CG 3.64Å; Q265-E393 PolarHBondContact NE2-O 2.99Å; Q265-E393 PolarHBondContact NE2-OE2 3.1Å; F268-E393 HydrophobicContact CE2-CB 4.02Å; M389-E393 WeakPolarHBondContact O-CB 3.31Å; M389-E393 WeakPolarHBondContact O-CG 3.47Å; M389-E393 PolarHBondContact O-N 3.36Å; L390-E393 PolarHBondContact O-N 2.93Å; H391-E393 VanDerWaalsContact C-N 3.34Å; H391-E393 PolarHBondContact O-N 2.98Å; E393-A396 PolarHBondContact O-N 3.28Å; E393-F397 VanDerWaalsContact O-CB 3.3Å; E393-F397 WeakPolarHBondContact O-CB 3.18Å; E393-F397 PolarHBondContact O-N 3.49Å
394	L	94	Very high	87.7	Confident	1 Å²	1	23 Å²	23	1%	0.005	11%	0.113	C	C	.	.	H	α-helix	trans	-61.2	-46	170.9	178.6	67.7	0	0	0	111	F268 F272 L390 H391 V392 F397 I398 L431 V432 L435	F268-L394 HydrophobicContact CD1-CD1 4.46Å; F268-L394 HydrophobicContact CE1-CD1 4.03Å; F268-L394 HydrophobicContact CE2-CB 4.17Å; F268-L394 HydrophobicContact CZ-CB 3.8Å; F268-L394 HydrophobicContact CZ-CD1 4.09Å; F272-L394 HydrophobicContact CE2-CD1 4.24Å; F272-L394 HydrophobicContact CZ-CD1 4.29Å; L390-L394 VanDerWaalsContact O-CB 3.31Å; L390-L394 WeakPolarHBondContact O-CB 3.33Å; L390-L394 PolarHBondContact O-N 3.45Å; H391-L394 PolarHBondContact O-N 3.17Å; V392-L394 VanDerWaalsContact C-N 3.32Å; V392-L394 PolarHBondContact O-N 3.42Å; L394-F397 WeakPolarHBondContact O-CB 3.44Å; L394-F397 PolarHBondContact O-N 3.35Å; L394-I398 HydrophobicContact CD1-CD1 4.35Å; L394-I398 HydrophobicContact CG-CD1 4.11Å; L394-I398 VanDerWaalsContact O-CG1 3.27Å; L394-I398 WeakPolarHBondContact O-CG1 3.37Å; L394-I398 PolarHBondContact O-N 2.84Å; L394-L431 HydrophobicContact CD1-CD2 3.99Å; L394-L431 HydrophobicContact CD1-CG 4.32Å; L394-L431 HydrophobicContact CD2-CB 3.97Å; L394-L431 HydrophobicContact CD2-CD2 3.93Å; L394-L431 HydrophobicContact CD2-CG 3.8Å; L394-L431 HydrophobicContact CG-CD2 4.37Å; L394-V432 HydrophobicContact CD2-CG2 3.58Å; L394-L435 HydrophobicContact CD1-CD1 3.92Å
395	I	93.3	Very high	85.4	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	14%	0.137	C	C	.	.	H	α-helix	trans	-62.2	-46.3	177.3	-66.5	169.1	0	0	0	110	L353 V361 L370 M372 H391 V392 F397 I398 V399 F424 T428	L353-I395 HydrophobicContact CD2-CD1 3.7Å; V361-I395 HydrophobicContact CG2-CG2 3.73Å; L370-I395 HydrophobicContact CD1-CG2 3.7Å; M372-I395 HydrophobicContact CE-CB 4.36Å; M372-I395 HydrophobicContact CE-CD1 3.7Å; M372-I395 HydrophobicContact CE-CG2 4.35Å; H391-I395 WeakPolarHBondContact O-CG1 3.22Å; H391-I395 PolarHBondContact O-N 3.4Å; H391-I395 VanDerWaalsContact O-N 3.17Å; V392-I395 PolarHBondContact O-N 3.31Å; I395-F397 VanDerWaalsContact C-N 3.29Å; I395-F397 PolarHBondContact O-N 3.18Å; I395-I398 PolarHBondContact O-N 3Å; I395-V399 WeakPolarHBondContact O-CG2 3.27Å; I395-V399 PolarHBondContact O-N 3Å; I395-F424 HydrophobicContact CD1-CE1 4.15Å; I395-F424 HydrophobicContact CD1-CZ 4.28Å; I395-F424 HydrophobicContact CG1-CZ 4.28Å; I395-F424 HydrophobicContact CG2-CZ 4.06Å; I395-T428 HydrophobicContact CD1-CG2 4.37Å; I395-T428 HydrophobicContact CG1-CG2 3.97Å
396	A	92.5	Very high	83.1	Confident	5 Å²	5	32.2 Å²	32.2	4%	0.041	17%	0.173	C	C	.	.	H	α-helix	trans	-60.8	-37.3	177.1	0	0	0	0	0	112.8	P320 V392 E393 K400	P320-A396 HydrophobicContact CG-CB 4.16Å; V392-A396 PolarHBondContact O-N 2.86Å; E393-A396 PolarHBondContact O-N 3.28Å; A396-K400 PolarHBondContact O-N 2.93Å
397	F	90.8	Very high	80.8	Confident	3 Å²	3	34.7 Å²	34.7	1%	0.013	19%	0.19	C	C	.	.	H	α-helix	trans	-63.6	-46	175.1	177.1	-99.6	0	0	0	111.3	F268 K269 F272 E393 L394 I395 V399 K400 Y401 F403	F268-F397 HydrophobicContact CB-CB 4.48Å; F268-F397 HydrophobicContact CB-CD1 3.97Å; F268-F397 HydrophobicContact CB-CD2 3.62Å; F268-F397 HydrophobicContact CB-CE1 4.09Å; F268-F397 HydrophobicContact CB-CE2 3.75Å; F268-F397 HydrophobicContact CB-CG 3.74Å; F268-F397 HydrophobicContact CB-CZ 3.98Å; F268-F397 HydrophobicContact CD2-CB 3.82Å; F268-F397 HydrophobicContact CD2-CD2 4.36Å; F268-F397 HydrophobicContact CD2-CG 4.01Å; F268-F397 HydrophobicContact CE2-CB 4.44Å; F268-F397 HydrophobicContact CG-CB 4.44Å; F268-F397 HydrophobicContact CG-CD1 4.42Å; F268-F397 HydrophobicContact CG-CD2 4.43Å; F268-F397 HydrophobicContact CG-CG 4.17Å; K269-F397 HydrophobicContact CB-CE2 4.44Å; K269-F397 HydrophobicContact CG-CE2 3.68Å; K269-F397 HydrophobicContact CG-CZ 4.47Å; F272-F397 HydrophobicContact CB-CE1 4.22Å; F272-F397 HydrophobicContact CB-CZ 4.24Å; F272-F397 HydrophobicContact CD2-CD1 4Å; F272-F397 AromaticContact CD2-CE1 3.25Å; F272-F397 HydrophobicContact CD2-CE1 3.25Å; F272-F397 AromaticContact CD2-CZ 3.84Å; F272-F397 HydrophobicContact CD2-CZ 3.84Å; F272-F397 HydrophobicContact CE2-CD1 4.07Å; F272-F397 AromaticContact CE2-CE1 3.77Å; F272-F397 HydrophobicContact CE2-CE1 3.77Å; F272-F397 AromaticContact CG-CE1 3.88Å; F272-F397 HydrophobicContact CG-CE1 3.88Å; F272-F397 HydrophobicContact CG-CZ 4.36Å; E393-F397 VanDerWaalsContact O-CB 3.3Å; E393-F397 WeakPolarHBondContact O-CB 3.18Å; E393-F397 PolarHBondContact O-N 3.49Å; L394-F397 WeakPolarHBondContact O-CB 3.44Å; L394-F397 PolarHBondContact O-N 3.35Å; I395-F397 VanDerWaalsContact C-N 3.29Å; I395-F397 PolarHBondContact O-N 3.18Å; F397-V399 VanDerWaalsContact C-N 3.3Å; F397-V399 PolarHBondContact O-N 2.89Å; F397-K400 PolarHBondContact O-N 3.43Å; F397-K400 VanDerWaalsContact O-N 3.14Å; F397-Y401 HydrophobicContact CE1-CD2 4.3Å; F397-Y401 HydrophobicContact CE1-CG 4.13Å; F397-Y401 AromaticContact CE2-CD2 3.93Å; F397-Y401 HydrophobicContact CE2-CD2 3.93Å; F397-Y401 HydrophobicContact CE2-CG 4.46Å; F397-Y401 AromaticContact CZ-CD2 3.54Å; F397-Y401 HydrophobicContact CZ-CD2 3.54Å; F397-Y401 HydrophobicContact CZ-CE2 4.17Å; F397-Y401 AromaticContact CZ-CG 3.83Å; F397-Y401 HydrophobicContact CZ-CG 3.83Å; F397-Y401 WeakPolarHBondContact O-CB 3.39Å; F397-Y401 PolarHBondContact O-N 3.31Å; F397-F403 HydrophobicContact CE1-CE2 4.29Å; F397-F403 HydrophobicContact CE1-CZ 4.08Å
398	I	88.1	Confident	78.8	Confident	7 Å²	7	34.9 Å²	34.9	4%	0.036	20%	0.195	C	C	.	.	H	α-helix	trans	-61.7	-36.7	-179.4	-65.6	164.9	0	0	0	111.6	V361 L394 I395 K400 L412 I415 L431	V361-I398 HydrophobicContact CG1-CB 4.16Å; V361-I398 HydrophobicContact CG1-CG2 3.61Å; L394-I398 HydrophobicContact CD1-CD1 4.35Å; L394-I398 HydrophobicContact CG-CD1 4.11Å; L394-I398 VanDerWaalsContact O-CG1 3.27Å; L394-I398 WeakPolarHBondContact O-CG1 3.37Å; L394-I398 PolarHBondContact O-N 2.84Å; I395-I398 PolarHBondContact O-N 3Å; I398-K400 VanDerWaalsContact C-N 3.32Å; I398-K400 PolarHBondContact O-N 2.76Å; I398-L412 HydrophobicContact CD1-CD2 3.96Å; I398-L412 HydrophobicContact CG1-CD2 4Å; I398-I415 HydrophobicContact CD1-CD1 3.81Å; I398-I415 HydrophobicContact CD1-CG2 4.48Å; I398-L431 HydrophobicContact CD1-CD2 4.49Å
399	V	87.1	Confident	77.2	Confident	12 Å²	12	35.3 Å²	35.3	7%	0.073	20%	0.197	C	C	.	.	H	α-helix	trans	-62.2	-41.7	176	-173.7	0	0	0	0	111.9	V361 L370 I395 F397	V361-V399 HydrophobicContact CB-CG2 3.88Å; V361-V399 HydrophobicContact CG1-CG2 4.03Å; V361-V399 HydrophobicContact CG2-CG2 3.46Å; V361-V399 VanDerWaalsContact CG2-CG2 3.46Å; L370-V399 HydrophobicContact CD1-CG2 3.66Å; L370-V399 HydrophobicContact CD2-CG2 4.39Å; L370-V399 HydrophobicContact CG-CG2 4.26Å; I395-V399 WeakPolarHBondContact O-CG2 3.27Å; I395-V399 PolarHBondContact O-N 3Å; F397-V399 VanDerWaalsContact C-N 3.3Å; F397-V399 PolarHBondContact O-N 2.89Å
400	K	82.9	Confident	75.9	Confident	75 Å²	75	40.3 Å²	40.3	33%	0.326	22%	0.219	S	C	.	.	H	α-helix	trans	-79.9	-29.4	-175.6	-65.6	176.8	-171.8	176.5	0	112.2	D318 A396 F397 I398 P402	D318-K400 PolarHBondContact O-NZ 3.49Å; D318-K400 IonicContact OD1-NZ 3.96Å; D318-K400 PolarHBondContact OD1-NZ 3.2Å; D318-K400 VanDerWaalsContact OD1-NZ 3.16Å; D318-K400 WeakPolarHBondContact OD2-CE 3.34Å; D318-K400 IonicContact OD2-NZ 3.47Å; D318-K400 PolarHBondContact OD2-NZ 2.96Å; A396-K400 PolarHBondContact O-N 2.93Å; F397-K400 PolarHBondContact O-N 3.43Å; F397-K400 VanDerWaalsContact O-N 3.14Å; I398-K400 VanDerWaalsContact C-N 3.32Å; I398-K400 PolarHBondContact O-N 2.76Å; K400-P402 WeakPolarHBondContact O-CD 3.42Å
401	Y	75	Confident	74.7	Confident	45 Å²	45	41.1 Å²	41.1	18%	0.176	22%	0.224	C	C	.	.	S	Bend	trans	-89.4	111.8	-175.5	-155.1	-89.6	0	0	0	110.6	N273 Q276 F397 F403	N273-Y401 PolarHBondContact OD1-OH 2.77Å; Q276-Y401 PolarHBondContact OE1-OH 3.16Å; F397-Y401 HydrophobicContact CE1-CD2 4.3Å; F397-Y401 HydrophobicContact CE1-CG 4.13Å; F397-Y401 AromaticContact CE2-CD2 3.93Å; F397-Y401 HydrophobicContact CE2-CD2 3.93Å; F397-Y401 HydrophobicContact CE2-CG 4.46Å; F397-Y401 AromaticContact CZ-CD2 3.54Å; F397-Y401 HydrophobicContact CZ-CD2 3.54Å; F397-Y401 HydrophobicContact CZ-CE2 4.17Å; F397-Y401 AromaticContact CZ-CG 3.83Å; F397-Y401 HydrophobicContact CZ-CG 3.83Å; F397-Y401 WeakPolarHBondContact O-CB 3.39Å; F397-Y401 PolarHBondContact O-N 3.31Å; Y401-F403 VanDerWaalsContact C-N 3.34Å; Y401-F403 AromaticContact CD1-CD1 3.68Å; Y401-F403 HydrophobicContact CD1-CD1 3.68Å; Y401-F403 AromaticContact CD1-CD2 3.8Å; Y401-F403 HydrophobicContact CD1-CD2 3.8Å; Y401-F403 AromaticContact CD1-CE1 3.33Å; Y401-F403 HydrophobicContact CD1-CE1 3.33Å; Y401-F403 AromaticContact CD1-CE2 3.48Å; Y401-F403 HydrophobicContact CD1-CE2 3.48Å; Y401-F403 VanDerWaalsContact CD1-CE2 3.48Å; Y401-F403 AromaticContact CD1-CG 3.91Å; Y401-F403 HydrophobicContact CD1-CG 3.91Å; Y401-F403 AromaticContact CD1-CZ 3.23Å; Y401-F403 HydrophobicContact CD1-CZ 3.23Å; Y401-F403 AromaticContact CE1-CD1 3.92Å; Y401-F403 HydrophobicContact CE1-CD1 3.92Å; Y401-F403 AromaticContact CE1-CE1 3.49Å; Y401-F403 HydrophobicContact CE1-CE1 3.49Å; Y401-F403 VanDerWaalsContact CE1-CE1 3.49Å; Y401-F403 HydrophobicContact CE1-CE2 4.44Å; Y401-F403 AromaticContact CE1-CZ 3.8Å; Y401-F403 HydrophobicContact CE1-CZ 3.8Å; Y401-F403 HydrophobicContact CG-CD2 4.47Å; Y401-F403 HydrophobicContact CG-CE1 4.42Å; Y401-F403 AromaticContact CG-CE2 3.94Å; Y401-F403 HydrophobicContact CG-CE2 3.94Å; Y401-F403 AromaticContact CG-CZ 3.92Å; Y401-F403 HydrophobicContact CG-CZ 3.92Å; Y401-F403 WeakPolarHBondContact O-CD2 3.45Å; Y401-F403 PolarHBondContact O-N 3.21Å
402	P	61.9	Low	73.9	Confident	101 Å²	101	41.2 Å²	41.2	66%	0.656	22%	0.224	S	C	*	.			trans	-76.3	84.5	-176.3	31.8	-33.9	0	0	0	110.3	K400 K404	K400-P402 WeakPolarHBondContact O-CD 3.42Å; P402-K404 PolarHBondContact O-N 3.15Å; P402-K404 VanDerWaalsContact O-N 3.13Å
403	F	61	Low	73.1	Confident	17 Å²	17	44.1 Å²	44.1	8%	0.075	24%	0.238	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.7	6	172.2	-68.8	-72.8	0	0	0	113.6	F272 F397 Y401 T405 L412 I416	F272-F403 HydrophobicContact CB-CZ 4.35Å; F272-F403 HydrophobicContact CD1-CE1 4.39Å; F272-F403 HydrophobicContact CD1-CZ 4.03Å; F272-F403 HydrophobicContact CG-CZ 4.16Å; F397-F403 HydrophobicContact CE1-CE2 4.29Å; F397-F403 HydrophobicContact CE1-CZ 4.08Å; Y401-F403 VanDerWaalsContact C-N 3.34Å; Y401-F403 AromaticContact CD1-CD1 3.68Å; Y401-F403 HydrophobicContact CD1-CD1 3.68Å; Y401-F403 AromaticContact CD1-CD2 3.8Å; Y401-F403 HydrophobicContact CD1-CD2 3.8Å; Y401-F403 AromaticContact CD1-CE1 3.33Å; Y401-F403 HydrophobicContact CD1-CE1 3.33Å; Y401-F403 AromaticContact CD1-CE2 3.48Å; Y401-F403 HydrophobicContact CD1-CE2 3.48Å; Y401-F403 VanDerWaalsContact CD1-CE2 3.48Å; Y401-F403 AromaticContact CD1-CG 3.91Å; Y401-F403 HydrophobicContact CD1-CG 3.91Å; Y401-F403 AromaticContact CD1-CZ 3.23Å; Y401-F403 HydrophobicContact CD1-CZ 3.23Å; Y401-F403 AromaticContact CE1-CD1 3.92Å; Y401-F403 HydrophobicContact CE1-CD1 3.92Å; Y401-F403 AromaticContact CE1-CE1 3.49Å; Y401-F403 HydrophobicContact CE1-CE1 3.49Å; Y401-F403 VanDerWaalsContact CE1-CE1 3.49Å; Y401-F403 HydrophobicContact CE1-CE2 4.44Å; Y401-F403 AromaticContact CE1-CZ 3.8Å; Y401-F403 HydrophobicContact CE1-CZ 3.8Å; Y401-F403 HydrophobicContact CG-CD2 4.47Å; Y401-F403 HydrophobicContact CG-CE1 4.42Å; Y401-F403 AromaticContact CG-CE2 3.94Å; Y401-F403 HydrophobicContact CG-CE2 3.94Å; Y401-F403 AromaticContact CG-CZ 3.92Å; Y401-F403 HydrophobicContact CG-CZ 3.92Å; Y401-F403 WeakPolarHBondContact O-CD2 3.45Å; Y401-F403 PolarHBondContact O-N 3.21Å; F403-T405 VanDerWaalsContact C-N 3.26Å; F403-T405 PolarHBondContact O-N 3.23Å; F403-T405 VanDerWaalsContact O-N 3.16Å; F403-L412 HydrophobicContact CD1-CD1 3.66Å; F403-L412 HydrophobicContact CD2-CD1 3.93Å; F403-L412 HydrophobicContact CD2-CD2 4.49Å; F403-L412 HydrophobicContact CE1-CD1 3.43Å; F403-L412 VanDerWaalsContact CE1-CD1 3.43Å; F403-L412 HydrophobicContact CE2-CD1 3.71Å; F403-L412 HydrophobicContact CE2-CD2 4.16Å; F403-L412 HydrophobicContact CG-CD1 3.9Å; F403-L412 HydrophobicContact CZ-CD1 3.45Å; F403-L412 VanDerWaalsContact CZ-CD1 3.45Å; F403-I416 HydrophobicContact CB-CD1 4.43Å
404	K	51.8	Low	72.6	Confident	131 Å²	131	47.8 Å²	47.8	57%	0.57	26%	0.255	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-5.8	-167.2	-77.2	-172.2	175.7	-179.1	0	115.8	Q362 Q363 P402	Q362-K404 VanDerWaalsContact O-CE 3.26Å; Q362-K404 WeakPolarHBondContact O-CE 3.46Å; Q362-K404 PolarHBondContact O-NZ 3.43Å; Q363-K404 VanDerWaalsContact C-NZ 3.27Å; Q363-K404 PolarHBondContact O-NZ 3.05Å; P402-K404 PolarHBondContact O-N 3.15Å; P402-K404 VanDerWaalsContact O-N 3.13Å
405	T	46.6	Very low	72.3	Confident	109 Å²	109	47.7 Å²	47.7	67%	0.669	26%	0.255	S	S	*	.	S	Bend	trans	-134.4	115.8	-177.6	48.3	0	0	0	0	111.7	F403	F403-T405 VanDerWaalsContact C-N 3.26Å; F403-T405 PolarHBondContact O-N 3.23Å; F403-T405 VanDerWaalsContact O-N 3.16Å
406	T	46.7	Very low	71.9	Confident	143 Å²	143	50 Å²	50	88%	0.877	27%	0.266	S	S	*	.	S	Bend	trans	93	-14.9	153.2	37.8	0	0	0	0	123.4
407	S	48.9	Very low	71.7	Confident	52 Å²	52	56.5 Å²	56.5	36%	0.364	29%	0.294	S	S	.	.			trans	-170	59.1	174.3	34.5	0	0	0	0	113.1
408	S	53.5	Low	71.6	Confident	32 Å²	32	56.7 Å²	56.7	22%	0.224	30%	0.296	C	S	.	.			trans	-71.2	129.3	-179.6	37.4	0	0	0	0	112.4	E413	S408-E413 VanDerWaalsContact OG-CG 3.25Å; S408-E413 WeakPolarHBondContact OG-CG 3.21Å; S408-E413 PolarHBondContact OG-OE1 3.03Å
409	H	62.1	Low	71.7	Confident	9 Å²	9	64.9 Å²	64.9	4%	0.042	33%	0.331	C	S	.	.			trans	-54.7	136.6	171.2	-172.1	-101	0	0	0	111.2	I291 V411 L412 E413	I291-H409 WeakPolarHBondContact CG1-NE2 3.25Å; H409-V411 PolarHBondContact ND1-N 3Å; H409-V411 PolarHBondContact O-N 2.98Å; H409-V411 VanDerWaalsContact O-N 3.09Å; H409-L412 HydrophobicContact CB-CB 4.33Å; H409-L412 HydrophobicContact CB-CD1 3.9Å; H409-L412 HydrophobicContact CB-CG 4.11Å; H409-L412 WeakPolarHBondContact O-CA 3.25Å; H409-L412 WeakPolarHBondContact O-CB 3.49Å; H409-L412 PolarHBondContact O-N 3.09Å; H409-E413 PolarHBondContact O-N 3.41Å
410	K	70.5	Confident	72	Confident	105 Å²	105	67.6 Å²	67.6	46%	0.457	35%	0.345	S	S	.	.	H	α-helix	trans	-49.9	-41.7	-176.4	-175.9	179	176.7	178.6	0	113.5	E413 E414	K410-E413 WeakPolarHBondContact O-CB 3.41Å; K410-E413 PolarHBondContact O-N 3.5Å; K410-E414 WeakPolarHBondContact O-CG 3.37Å; K410-E414 PolarHBondContact O-N 2.84Å
411	V	72.9	Confident	72.4	Confident	17 Å²	17	64.5 Å²	64.5	10%	0.103	33%	0.332	C	S	.	.	H	α-helix	trans	-67.9	-35.2	178.8	-177.5	0	0	0	0	112.1	H409 E414 I415 L431	H409-V411 PolarHBondContact ND1-N 3Å; H409-V411 PolarHBondContact O-N 2.98Å; H409-V411 VanDerWaalsContact O-N 3.09Å; V411-E414 PolarHBondContact O-N 2.84Å; V411-I415 WeakPolarHBondContact O-CG1 3.27Å; V411-I415 PolarHBondContact O-N 3.26Å; V411-L431 HydrophobicContact CG1-CB 3.88Å; V411-L431 HydrophobicContact CG1-CD1 4.38Å; V411-L431 HydrophobicContact CG1-CD2 4.42Å; V411-L431 HydrophobicContact CG1-CG 4.46Å
412	L	79.1	Confident	73.2	Confident	1 Å²	1	65.6 Å²	65.6	1%	0.005	34%	0.336	C	S	.	.	H	α-helix	trans	-70.1	-36.6	174.8	-68.5	173.2	0	0	0	110.9	F272 I398 F403 H409 E414 I415 I416 L431	F272-L412 HydrophobicContact CD1-CD1 4.35Å; F272-L412 HydrophobicContact CE1-CD1 4.12Å; I398-L412 HydrophobicContact CD1-CD2 3.96Å; I398-L412 HydrophobicContact CG1-CD2 4Å; F403-L412 HydrophobicContact CD1-CD1 3.66Å; F403-L412 HydrophobicContact CD2-CD1 3.93Å; F403-L412 HydrophobicContact CD2-CD2 4.49Å; F403-L412 HydrophobicContact CE1-CD1 3.43Å; F403-L412 VanDerWaalsContact CE1-CD1 3.43Å; F403-L412 HydrophobicContact CE2-CD1 3.71Å; F403-L412 HydrophobicContact CE2-CD2 4.16Å; F403-L412 HydrophobicContact CG-CD1 3.9Å; F403-L412 HydrophobicContact CZ-CD1 3.45Å; F403-L412 VanDerWaalsContact CZ-CD1 3.45Å; H409-L412 HydrophobicContact CB-CB 4.33Å; H409-L412 HydrophobicContact CB-CD1 3.9Å; H409-L412 HydrophobicContact CB-CG 4.11Å; H409-L412 WeakPolarHBondContact O-CA 3.25Å; H409-L412 WeakPolarHBondContact O-CB 3.49Å; H409-L412 PolarHBondContact O-N 3.09Å; L412-E414 VanDerWaalsContact C-N 3.34Å; L412-I415 HydrophobicContact CD2-CD1 4.4Å; L412-I415 PolarHBondContact O-N 3.45Å; L412-I416 WeakPolarHBondContact O-CG1 3.2Å; L412-I416 PolarHBondContact O-N 2.78Å; L412-L431 HydrophobicContact CD2-CD2 3.92Å
413	E	80	Confident	74.6	Confident	61 Å²	61	64.1 Å²	64.1	29%	0.285	32%	0.32	S	S	.	.	H	α-helix	trans	-62.6	-40.5	172.5	-67.8	-164.7	-173.9	0	0	112.4	S408 H409 K410 I415 I416 K417	S408-E413 VanDerWaalsContact OG-CG 3.25Å; S408-E413 WeakPolarHBondContact OG-CG 3.21Å; S408-E413 PolarHBondContact OG-OE1 3.03Å; H409-E413 PolarHBondContact O-N 3.41Å; K410-E413 WeakPolarHBondContact O-CB 3.41Å; K410-E413 PolarHBondContact O-N 3.5Å; E413-I415 VanDerWaalsContact C-N 3.3Å; E413-I415 PolarHBondContact O-N 2.93Å; E413-I416 PolarHBondContact O-N 3.27Å; E413-K417 HydrophobicContact CB-CD 4.47Å; E413-K417 WeakPolarHBondContact O-CB 3.4Å; E413-K417 VanDerWaalsContact O-CG 3.3Å; E413-K417 WeakPolarHBondContact O-CG 3.31Å; E413-K417 PolarHBondContact O-N 2.86Å; E413-K417 IonicContact OE2-NZ 2.78Å; E413-K417 PolarHBondContact OE2-NZ 2.81Å
414	E	85.7	Confident	76.2	Confident	77 Å²	77	63.3 Å²	63.3	36%	0.36	32%	0.317	S	S	.	.	H	α-helix	trans	-60.5	-40.1	175.1	-71.8	171.5	-171.6	0	0	111.5	K410 V411 L412 A418	K410-E414 WeakPolarHBondContact O-CG 3.37Å; K410-E414 PolarHBondContact O-N 2.84Å; V411-E414 PolarHBondContact O-N 2.84Å; L412-E414 VanDerWaalsContact C-N 3.34Å; E414-A418 PolarHBondContact O-N 3.2Å
415	I	87.6	Confident	78.1	Confident	0 Å²	0	57 Å²	57	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-64.7	-46	175.6	-64.4	166.4	0	0	0	111	I398 V411 L412 E413 A418 F424 T428 L431	I398-I415 HydrophobicContact CD1-CD1 3.81Å; I398-I415 HydrophobicContact CD1-CG2 4.48Å; V411-I415 WeakPolarHBondContact O-CG1 3.27Å; V411-I415 PolarHBondContact O-N 3.26Å; L412-I415 HydrophobicContact CD2-CD1 4.4Å; L412-I415 PolarHBondContact O-N 3.45Å; E413-I415 VanDerWaalsContact C-N 3.3Å; E413-I415 PolarHBondContact O-N 2.93Å; I415-A418 WeakPolarHBondContact O-CB 3.46Å; I415-F424 HydrophobicContact CG2-CD2 3.78Å; I415-F424 HydrophobicContact CG2-CE2 3.57Å; I415-T428 HydrophobicContact CD1-CG2 3.87Å; I415-T428 HydrophobicContact CG1-CG2 3.96Å; I415-T428 HydrophobicContact CG2-CG2 3.99Å; I415-L431 HydrophobicContact CD1-CD2 4Å
416	I	85.3	Confident	80.3	Confident	47 Å²	47	55.5 Å²	55.5	24%	0.241	28%	0.275	C	S	.	.	H	α-helix	trans	-69.5	-36	-178.7	-65.9	167.2	0	0	0	111.3	Q362 F403 L412 E413	Q362-I416 WeakPolarHBondContact CG-O 3.49Å; Q362-I416 PolarHBondContact NE2-O 2.97Å; F403-I416 HydrophobicContact CB-CD1 4.43Å; L412-I416 WeakPolarHBondContact O-CG1 3.2Å; L412-I416 PolarHBondContact O-N 2.78Å; E413-I416 PolarHBondContact O-N 3.27Å
417	K	87.5	Confident	82.5	Confident	142 Å²	142	49.2 Å²	49.2	62%	0.617	24%	0.237	S	C	*	.	T	Hydrogen-bonded Turn	trans	-90.8	2.1	-177.7	-66	172	179.2	165.1	0	113.9	E413 K419	E413-K417 HydrophobicContact CB-CD 4.47Å; E413-K417 WeakPolarHBondContact O-CB 3.4Å; E413-K417 VanDerWaalsContact O-CG 3.3Å; E413-K417 WeakPolarHBondContact O-CG 3.31Å; E413-K417 PolarHBondContact O-N 2.86Å; E413-K417 IonicContact OE2-NZ 2.78Å; E413-K417 PolarHBondContact OE2-NZ 2.81Å; K417-K419 PolarHBondContact O-N 2.74Å
418	A	90.2	Very high	84.6	Confident	7 Å²	7	46.8 Å²	46.8	6%	0.058	22%	0.22	C	C	.	.			trans	-54.3	129.9	179	0	0	0	0	0	111.6	W358 Q362 E414 I415 E423 F424	W358-A418 HydrophobicContact CZ3-CB 4.35Å; Q362-A418 PolarHBondContact NE2-O 3.27Å; E414-A418 PolarHBondContact O-N 3.2Å; I415-A418 WeakPolarHBondContact O-CB 3.46Å; A418-E423 HydrophobicContact CB-CB 4.04Å; A418-F424 HydrophobicContact CB-CB 3.71Å
419	K	90.4	Very high	86.5	Confident	180 Å²	180	45.3 Å²	45.3	78%	0.783	21%	0.209	S	C	*	.	S	Bend	trans	-84.7	-21.6	-176.2	-63	175.1	-179.3	174.1	0	113.1	K417 E423	K417-K419 PolarHBondContact O-N 2.74Å; K419-E423 WeakPolarHBondContact CB-OE2 3.34Å; K419-E423 PolarHBondContact N-OE2 3.46Å
420	N	91.5	Very high	87.9	Confident	69 Å²	69	48 Å²	48	37%	0.369	22%	0.224	S	C	.	.	S	Bend	trans	-149.3	167.2	-178.5	59.6	58.3	0	0	0	109.7	Y422 E423 F424	N420-Y422 PolarHBondContact O-N 3Å; N420-Y422 WeakPolarHBondContact OD1-CA 3.49Å; N420-Y422 WeakPolarHBondContact OD1-CB 3.19Å; N420-Y422 PolarHBondContact OD1-N 3.46Å; N420-Y422 VanDerWaalsContact OD1-N 3.09Å; N420-E423 PolarHBondContact O-N 3.15Å; N420-E423 PolarHBondContact OD1-N 2.95Å; N420-F424 PolarHBondContact O-N 3.36Å; N420-F424 VanDerWaalsContact O-N 3.09Å
421	Y	92	Very high	88.9	Confident	10 Å²	10	43 Å²	43	4%	0.039	20%	0.202	C	C	.	.	H	α-helix	trans	-60.6	-30.9	-178.5	-172	-106.6	0	0	0	113.6	L338 L342 L353 Y354 C355 W358 F424 L425	L338-Y421 HydrophobicContact CD1-CD1 3.97Å; L338-Y421 HydrophobicContact CD1-CG 4.24Å; L342-Y421 HydrophobicContact CD1-CE1 4.27Å; L342-Y421 HydrophobicContact CD2-CD1 3.88Å; L342-Y421 HydrophobicContact CD2-CE1 3.71Å; L353-Y421 PolarHBondContact O-OH 2.86Å; L353-Y421 VanDerWaalsContact O-OH 3.12Å; Y354-Y421 VanDerWaalsContact CA-OH 3.23Å; Y354-Y421 WeakPolarHBondContact CA-OH 3.25Å; Y354-Y421 HydrophobicContact CD2-CD1 4.22Å; Y354-Y421 AromaticContact CD2-CE1 3.69Å; Y354-Y421 HydrophobicContact CD2-CE1 3.69Å; Y354-Y421 AromaticContact CD2-CZ 3.92Å; Y354-Y421 HydrophobicContact CE2-CD1 4.41Å; Y354-Y421 HydrophobicContact CE2-CE1 4.3Å; C355-Y421 HydrophobicContact CB-CE2 4.17Å; C355-Y421 PolarHBondContact N-OH 3.41Å; W358-Y421 HydrophobicContact CB-CD2 3.99Å; W358-Y421 HydrophobicContact CB-CE2 3.91Å; W358-Y421 AromaticContact CD1-CD2 3.5Å; W358-Y421 AromaticContact CD2-CD2 3.99Å; W358-Y421 HydrophobicContact CD2-CD2 3.99Å; W358-Y421 AromaticContact CG-CD2 3.53Å; W358-Y421 HydrophobicContact CG-CD2 3.53Å; W358-Y421 AromaticContact CG-CE2 3.98Å; W358-Y421 HydrophobicContact CG-CE2 3.98Å; W358-Y421 AromaticContact NE1-CD2 3.93Å; Y421-F424 HydrophobicContact CD2-CD1 4Å; Y421-F424 AromaticContact CE2-CD1 3.79Å; Y421-F424 HydrophobicContact CE2-CD1 3.79Å; Y421-F424 HydrophobicContact CE2-CE1 4.11Å; Y421-F424 PolarHBondContact O-N 3.25Å; Y421-L425 HydrophobicContact CE1-CB 4.34Å; Y421-L425 HydrophobicContact CE1-CD2 4.08Å; Y421-L425 VanDerWaalsContact O-CB 3.29Å; Y421-L425 WeakPolarHBondContact O-CB 3.39Å; Y421-L425 PolarHBondContact O-N 2.9Å
422	Y	91.7	Very high	89.9	Confident	68 Å²	68	42.2 Å²	42.2	27%	0.267	20%	0.197	S	C	.	.	H	α-helix	trans	-67.5	-48.2	179.6	178.2	-85.9	0	0	0	111.5	N341 L345 N420 F424 L425 Q426	N341-Y422 HydrophobicContact CB-CD2 3.95Å; N341-Y422 HydrophobicContact CB-CE2 4.42Å; L345-Y422 HydrophobicContact CB-CE2 3.95Å; L345-Y422 HydrophobicContact CD2-CD2 4.41Å; L345-Y422 HydrophobicContact CD2-CE2 4.25Å; L345-Y422 HydrophobicContact CG-CE2 4.48Å; N420-Y422 PolarHBondContact O-N 3Å; N420-Y422 WeakPolarHBondContact OD1-CA 3.49Å; N420-Y422 WeakPolarHBondContact OD1-CB 3.19Å; N420-Y422 PolarHBondContact OD1-N 3.46Å; N420-Y422 VanDerWaalsContact OD1-N 3.09Å; Y422-F424 VanDerWaalsContact C-N 3.32Å; Y422-F424 PolarHBondContact O-N 3.16Å; Y422-L425 PolarHBondContact O-N 3.47Å; Y422-Q426 VanDerWaalsContact CE1-OE1 3.32Å; Y422-Q426 WeakPolarHBondContact O-CB 3.34Å; Y422-Q426 PolarHBondContact O-N 2.94Å
423	E	91.9	Very high	90.5	Very high	69 Å²	69	44.7 Å²	44.7	32%	0.322	21%	0.211	S	C	.	.	H	α-helix	trans	-59.7	-44.9	174.1	-72.7	176.5	-169.7	0	0	110.9	A418 K419 N420 L425 Q426 S427	A418-E423 HydrophobicContact CB-CB 4.04Å; K419-E423 WeakPolarHBondContact CB-OE2 3.34Å; K419-E423 PolarHBondContact N-OE2 3.46Å; N420-E423 PolarHBondContact O-N 3.15Å; N420-E423 PolarHBondContact OD1-N 2.95Å; E423-L425 PolarHBondContact O-N 2.87Å; E423-Q426 PolarHBondContact O-N 3.38Å; E423-S427 PolarHBondContact O-N 3.1Å; E423-S427 PolarHBondContact O-OG 3.46Å
424	F	93.4	Very high	91	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-55.9	-52.8	176.9	170.9	-96.3	0	0	0	111.1	W358 V361 I395 I415 A418 N420 Y421 Y422 Q426 S427 T428	W358-F424 HydrophobicContact CB-CD1 4.15Å; W358-F424 HydrophobicContact CB-CE1 3.88Å; W358-F424 HydrophobicContact CB-CZ 4.16Å; W358-F424 HydrophobicContact CD2-CD1 4.46Å; W358-F424 HydrophobicContact CD2-CG 4.28Å; W358-F424 HydrophobicContact CE3-CB 3.76Å; W358-F424 HydrophobicContact CE3-CD1 4.1Å; W358-F424 AromaticContact CE3-CD2 3.57Å; W358-F424 HydrophobicContact CE3-CD2 3.57Å; W358-F424 HydrophobicContact CE3-CE2 4.18Å; W358-F424 AromaticContact CE3-CG 3.53Å; W358-F424 HydrophobicContact CE3-CG 3.53Å; W358-F424 HydrophobicContact CZ3-CB 3.84Å; W358-F424 HydrophobicContact CZ3-CD2 4.06Å; W358-F424 HydrophobicContact CZ3-CG 4.06Å; V361-F424 HydrophobicContact CB-CE2 4.16Å; V361-F424 HydrophobicContact CB-CZ 4.48Å; V361-F424 HydrophobicContact CG1-CE2 4.09Å; V361-F424 HydrophobicContact CG2-CE2 4.22Å; V361-F424 HydrophobicContact CG2-CZ 4.03Å; I395-F424 HydrophobicContact CD1-CE1 4.15Å; I395-F424 HydrophobicContact CD1-CZ 4.28Å; I395-F424 HydrophobicContact CG1-CZ 4.28Å; I395-F424 HydrophobicContact CG2-CZ 4.06Å; I415-F424 HydrophobicContact CG2-CD2 3.78Å; I415-F424 HydrophobicContact CG2-CE2 3.57Å; A418-F424 HydrophobicContact CB-CB 3.71Å; N420-F424 PolarHBondContact O-N 3.36Å; N420-F424 VanDerWaalsContact O-N 3.09Å; Y421-F424 HydrophobicContact CD2-CD1 4Å; Y421-F424 AromaticContact CE2-CD1 3.79Å; Y421-F424 HydrophobicContact CE2-CD1 3.79Å; Y421-F424 HydrophobicContact CE2-CE1 4.11Å; Y421-F424 PolarHBondContact O-N 3.25Å; Y422-F424 VanDerWaalsContact C-N 3.32Å; Y422-F424 PolarHBondContact O-N 3.16Å; F424-Q426 PolarHBondContact O-N 2.94Å; F424-S427 PolarHBondContact O-N 3.36Å; F424-T428 HydrophobicContact CE1-CG2 4.2Å; F424-T428 HydrophobicContact CE2-CG2 4.14Å; F424-T428 HydrophobicContact CZ-CG2 3.96Å; F424-T428 WeakPolarHBondContact O-CG2 3.42Å; F424-T428 PolarHBondContact O-N 2.83Å; F424-T428 PolarHBondContact O-OG1 3.36Å
425	L	93.6	Very high	91.3	Very high	0 Å²	0	42.3 Å²	42.3	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.5	-37	-177.9	-174.4	65.4	0	0	0	112.3	L342 L345 L353 H391 Y421 Y422 E423 T428 L429	L342-L425 HydrophobicContact CD2-CD2 3.35Å; L345-L425 HydrophobicContact CD2-CB 4.1Å; L345-L425 HydrophobicContact CD2-CD2 3.89Å; L345-L425 HydrophobicContact CD2-CG 3.88Å; L353-L425 HydrophobicContact CB-CD1 4.25Å; L353-L425 HydrophobicContact CD2-CD1 4.4Å; H391-L425 VanDerWaalsContact CE1-CD1 3.48Å; H391-L425 WeakPolarHBondContact CE1-CD1 3.38Å; Y421-L425 HydrophobicContact CE1-CB 4.34Å; Y421-L425 HydrophobicContact CE1-CD2 4.08Å; Y421-L425 VanDerWaalsContact O-CB 3.29Å; Y421-L425 WeakPolarHBondContact O-CB 3.39Å; Y421-L425 PolarHBondContact O-N 2.9Å; Y422-L425 PolarHBondContact O-N 3.47Å; E423-L425 PolarHBondContact O-N 2.87Å; L425-T428 WeakPolarHBondContact CA-OG1 3.38Å; L425-T428 PolarHBondContact O-OG1 3.34Å; L425-L429 HydrophobicContact CG-CD1 4.12Å; L425-L429 HydrophobicContact CG-CG 4.48Å; L425-L429 VanDerWaalsContact O-CB 3.31Å; L425-L429 WeakPolarHBondContact O-CB 3.25Å; L425-L429 VanDerWaalsContact O-CG 3.26Å; L425-L429 WeakPolarHBondContact O-CG 3.33Å; L425-L429 PolarHBondContact O-N 3.46Å
426	Q	92.8	Very high	91.6	Very high	76 Å²	76	44.2 Å²	44.2	36%	0.355	21%	0.207	S	C	.	.	H	α-helix	trans	-64.4	-43.9	176.8	-176.2	171.4	8.5	0	0	111.1	L345 Y422 E423 F424 L429 N430	L345-Q426 HydrophobicContact CD1-CB 4.08Å; L345-Q426 HydrophobicContact CD1-CG 4Å; L345-Q426 HydrophobicContact CD2-CB 4.08Å; Y422-Q426 VanDerWaalsContact CE1-OE1 3.32Å; Y422-Q426 WeakPolarHBondContact O-CB 3.34Å; Y422-Q426 PolarHBondContact O-N 2.94Å; E423-Q426 PolarHBondContact O-N 3.38Å; F424-Q426 PolarHBondContact O-N 2.94Å; Q426-L429 PolarHBondContact O-N 2.85Å; Q426-N430 PolarHBondContact O-N 3.48Å; Q426-N430 PolarHBondContact O-ND2 3.44Å
427	S	91.9	Very high	92	Very high	12 Å²	12	47.1 Å²	47.1	8%	0.084	22%	0.223	C	C	.	.	H	α-helix	trans	-67.4	-39.6	177.7	-65.4	0	0	0	0	112.4	E423 F424 N430 L431	E423-S427 PolarHBondContact O-N 3.1Å; E423-S427 PolarHBondContact O-OG 3.46Å; F424-S427 PolarHBondContact O-N 3.36Å; S427-N430 PolarHBondContact O-N 3.36Å; S427-L431 PolarHBondContact O-N 2.95Å
428	T	93.2	Very high	92.1	Very high	0 Å²	0	41.2 Å²	41.2	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-66.8	-41.5	174.6	59	0	0	0	0	111.7	H391 I395 I415 F424 L425 N430 L431 V432	H391-T428 VanDerWaalsContact NE2-CB 3.34Å; H391-T428 WeakPolarHBondContact NE2-CB 3.1Å; H391-T428 PolarHBondContact NE2-OG1 3.43Å; I395-T428 HydrophobicContact CD1-CG2 4.37Å; I395-T428 HydrophobicContact CG1-CG2 3.97Å; I415-T428 HydrophobicContact CD1-CG2 3.87Å; I415-T428 HydrophobicContact CG1-CG2 3.96Å; I415-T428 HydrophobicContact CG2-CG2 3.99Å; F424-T428 HydrophobicContact CE1-CG2 4.2Å; F424-T428 HydrophobicContact CE2-CG2 4.14Å; F424-T428 HydrophobicContact CZ-CG2 3.96Å; F424-T428 WeakPolarHBondContact O-CG2 3.42Å; F424-T428 PolarHBondContact O-N 2.83Å; F424-T428 PolarHBondContact O-OG1 3.36Å; L425-T428 WeakPolarHBondContact CA-OG1 3.38Å; L425-T428 PolarHBondContact O-OG1 3.34Å; T428-N430 VanDerWaalsContact C-N 3.34Å; T428-N430 PolarHBondContact O-N 3.42Å; T428-L431 PolarHBondContact O-N 3.15Å; T428-V432 WeakPolarHBondContact O-CG2 3.16Å; T428-V432 PolarHBondContact O-N 3.14Å
429	L	93.4	Very high	92.3	Very high	1 Å²	1	40.9 Å²	40.9	1%	0.005	20%	0.196	C	C	.	.	H	α-helix	trans	-60.7	-40.9	174.6	-79.8	169.9	0	0	0	112.6	L345 Y349 H391 L425 Q426 L431 V432 N433	L345-L429 HydrophobicContact CD1-CD1 4.35Å; L345-L429 HydrophobicContact CD2-CD1 3.78Å; L345-L429 HydrophobicContact CG-CD1 3.71Å; Y349-L429 HydrophobicContact CD2-CD1 4.42Å; Y349-L429 HydrophobicContact CD2-CD2 4.16Å; Y349-L429 HydrophobicContact CE2-CD1 4.05Å; Y349-L429 HydrophobicContact CE2-CD2 4.1Å; Y349-L429 HydrophobicContact CG-CD2 4.42Å; H391-L429 WeakPolarHBondContact CE1-CD2 3.36Å; H391-L429 VanDerWaalsContact CE1-CG 3.5Å; H391-L429 WeakPolarHBondContact CE1-CG 3.28Å; L425-L429 HydrophobicContact CG-CD1 4.12Å; L425-L429 HydrophobicContact CG-CG 4.48Å; L425-L429 VanDerWaalsContact O-CB 3.31Å; L425-L429 WeakPolarHBondContact O-CB 3.25Å; L425-L429 VanDerWaalsContact O-CG 3.26Å; L425-L429 WeakPolarHBondContact O-CG 3.33Å; L425-L429 PolarHBondContact O-N 3.46Å; Q426-L429 PolarHBondContact O-N 2.85Å; L429-L431 VanDerWaalsContact C-N 3.31Å; L429-L431 PolarHBondContact O-N 3.09Å; L429-V432 PolarHBondContact O-N 3.48Å; L429-N433 PolarHBondContact O-N 3.37Å; L429-N433 PolarHBondContact O-ND2 3.47Å
430	N	91.9	Very high	92.4	Very high	66 Å²	66	33.3 Å²	33.3	35%	0.353	16%	0.164	S	C	.	.	H	α-helix	trans	-60.1	-43.5	176	-74.8	-20.9	0	0	0	111.2	Q426 S427 T428 N433 Q434	Q426-N430 PolarHBondContact O-N 3.48Å; Q426-N430 PolarHBondContact O-ND2 3.44Å; S427-N430 PolarHBondContact O-N 3.36Å; T428-N430 VanDerWaalsContact C-N 3.34Å; T428-N430 PolarHBondContact O-N 3.42Å; N430-N433 PolarHBondContact O-N 2.79Å; N430-Q434 WeakPolarHBondContact O-CG 3.23Å; N430-Q434 PolarHBondContact O-N 3.39Å; N430-Q434 VanDerWaalsContact O-N 3.15Å
431	L	90.8	Very high	92.5	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	H	α-helix	trans	-66.4	-41.8	176.5	-173	52	0	0	0	112	F272 L394 I398 V411 L412 I415 S427 T428 L429 N433 Q434 L435	F272-L431 HydrophobicContact CZ-CD2 4.27Å; L394-L431 HydrophobicContact CD1-CD2 3.99Å; L394-L431 HydrophobicContact CD1-CG 4.32Å; L394-L431 HydrophobicContact CD2-CB 3.97Å; L394-L431 HydrophobicContact CD2-CD2 3.93Å; L394-L431 HydrophobicContact CD2-CG 3.8Å; L394-L431 HydrophobicContact CG-CD2 4.37Å; I398-L431 HydrophobicContact CD1-CD2 4.49Å; V411-L431 HydrophobicContact CG1-CB 3.88Å; V411-L431 HydrophobicContact CG1-CD1 4.38Å; V411-L431 HydrophobicContact CG1-CD2 4.42Å; V411-L431 HydrophobicContact CG1-CG 4.46Å; L412-L431 HydrophobicContact CD2-CD2 3.92Å; I415-L431 HydrophobicContact CD1-CD2 4Å; S427-L431 PolarHBondContact O-N 2.95Å; T428-L431 PolarHBondContact O-N 3.15Å; L429-L431 VanDerWaalsContact C-N 3.31Å; L429-L431 PolarHBondContact O-N 3.09Å; L431-N433 VanDerWaalsContact C-N 3.3Å; L431-N433 PolarHBondContact O-N 3.41Å; L431-Q434 PolarHBondContact O-N 3.47Å; L431-Q434 VanDerWaalsContact O-N 3.16Å; L431-L435 HydrophobicContact CD1-CD1 4.14Å; L431-L435 HydrophobicContact CD1-CG 4.29Å; L431-L435 HydrophobicContact CG-CD1 4.06Å; L431-L435 WeakPolarHBondContact O-CG 3.13Å; L431-L435 PolarHBondContact O-N 3.14Å
432	V	93.7	Very high	92.4	Very high	0 Å²	0	34.2 Å²	34.2	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-57	-43.5	173.7	170.2	0	0	0	0	111.3	K387 L390 H391 L394 T428 L429 Q434 L435 W436	K387-V432 HydrophobicContact CG-CG1 4.08Å; L390-V432 HydrophobicContact CD2-CG1 4.19Å; H391-V432 HydrophobicContact CB-CG1 4.47Å; H391-V432 HydrophobicContact CB-CG2 3.71Å; L394-V432 HydrophobicContact CD2-CG2 3.58Å; T428-V432 WeakPolarHBondContact O-CG2 3.16Å; T428-V432 PolarHBondContact O-N 3.14Å; L429-V432 PolarHBondContact O-N 3.48Å; V432-Q434 VanDerWaalsContact C-N 3.34Å; V432-Q434 PolarHBondContact O-N 3.16Å; V432-L435 PolarHBondContact O-N 3.44Å; V432-W436 WeakPolarHBondContact O-CB 3.49Å; V432-W436 PolarHBondContact O-N 3.26Å
433	N	92.8	Very high	92.4	Very high	54 Å²	54	31 Å²	31	29%	0.289	16%	0.158	S	C	.	.	H	α-helix	trans	-65.9	-35.2	178.2	-73.9	-34.5	0	0	0	113.4	Y349 K387 L429 N430 L431 L435	Y349-N433 WeakPolarHBondContact CE1-OD1 3.41Å; Y349-N433 PolarHBondContact OH-ND2 2.92Å; K387-N433 WeakPolarHBondContact CE-OD1 3.36Å; K387-N433 PolarHBondContact NZ-OD1 2.67Å; L429-N433 PolarHBondContact O-N 3.37Å; L429-N433 PolarHBondContact O-ND2 3.47Å; N430-N433 PolarHBondContact O-N 2.79Å; L431-N433 VanDerWaalsContact C-N 3.3Å; L431-N433 PolarHBondContact O-N 3.41Å; N433-L435 VanDerWaalsContact C-N 3.33Å
434	Q	90.2	Very high	92.3	Very high	86 Å²	86	33.1 Å²	33.1	40%	0.402	17%	0.168	S	C	.	.	H	α-helix	trans	-66.6	-37.9	174.7	-69.8	176.5	9	0	0	111.5	N430 L431 V432 P438	N430-Q434 WeakPolarHBondContact O-CG 3.23Å; N430-Q434 PolarHBondContact O-N 3.39Å; N430-Q434 VanDerWaalsContact O-N 3.15Å; L431-Q434 PolarHBondContact O-N 3.47Å; L431-Q434 VanDerWaalsContact O-N 3.16Å; V432-Q434 VanDerWaalsContact C-N 3.34Å; V432-Q434 PolarHBondContact O-N 3.16Å; Q434-P438 WeakPolarHBondContact O-CD 3Å
435	L	91.3	Very high	92	Very high	1 Å²	1	36.9 Å²	36.9	1%	0.005	19%	0.194	C	C	.	.	H	α-helix	trans	-83.5	-19.7	-178.9	-65.3	174.5	0	0	0	113.7	W267 F268 F272 L296 L394 L431 V432 N433 N437 P438 F439	W267-L435 HydrophobicContact CH2-CB 4.43Å; W267-L435 HydrophobicContact CH2-CD2 4.31Å; F268-L435 HydrophobicContact CD1-CD1 4.42Å; F268-L435 HydrophobicContact CE1-CD1 3.91Å; F272-L435 HydrophobicContact CZ-CD1 4.36Å; L296-L435 HydrophobicContact CD1-CD2 4.42Å; L296-L435 HydrophobicContact CD2-CD2 3.73Å; L394-L435 HydrophobicContact CD1-CD1 3.92Å; L431-L435 HydrophobicContact CD1-CD1 4.14Å; L431-L435 HydrophobicContact CD1-CG 4.29Å; L431-L435 HydrophobicContact CG-CD1 4.06Å; L431-L435 WeakPolarHBondContact O-CG 3.13Å; L431-L435 PolarHBondContact O-N 3.14Å; V432-L435 PolarHBondContact O-N 3.44Å; N433-L435 VanDerWaalsContact C-N 3.33Å; L435-N437 PolarHBondContact O-N 2.98Å; L435-P438 WeakPolarHBondContact O-CD 3.2Å; L435-F439 WeakPolarHBondContact O-CB 3.35Å; L435-F439 PolarHBondContact O-N 2.89Å
436	W	94	Very high	91.4	Very high	40 Å²	40	37.8 Å²	37.8	15%	0.152	20%	0.199	C	C	.	.	H	α-helix	trans	-57.8	-52.6	-172.7	-178.7	-108.9	0	0	0	113.6	L383 L386 K387 L390 V432 F439 I440	L383-W436 WeakPolarHBondContact O-CH2 3.46Å; L386-W436 HydrophobicContact CB-CH2 4.48Å; L386-W436 HydrophobicContact CD2-CH2 4.36Å; L386-W436 HydrophobicContact CG-CH2 4.48Å; K387-W436 VanDerWaalsContact CA-CZ3 3.43Å; K387-W436 HydrophobicContact CB-CE3 3.98Å; K387-W436 HydrophobicContact CB-CH2 3.65Å; K387-W436 HydrophobicContact CB-CZ2 4.34Å; K387-W436 HydrophobicContact CB-CZ3 3.46Å; K387-W436 VanDerWaalsContact CB-CZ3 3.46Å; K387-W436 HydrophobicContact CD-CD2 4.03Å; K387-W436 HydrophobicContact CD-CE3 4.07Å; K387-W436 HydrophobicContact CD-CZ2 4.5Å; K387-W436 HydrophobicContact CD-CZ3 4.34Å; K387-W436 HydrophobicContact CG-CD2 4.22Å; K387-W436 HydrophobicContact CG-CE3 3.73Å; K387-W436 HydrophobicContact CG-CH2 4.26Å; K387-W436 HydrophobicContact CG-CZ3 3.77Å; L390-W436 HydrophobicContact CD2-CE3 3.71Å; L390-W436 HydrophobicContact CD2-CZ3 4.24Å; V432-W436 WeakPolarHBondContact O-CB 3.49Å; V432-W436 PolarHBondContact O-N 3.26Å; W436-F439 HydrophobicContact CE3-CD1 4.03Å; W436-F439 HydrophobicContact CE3-CE1 4.49Å; W436-F439 AromaticContact CZ3-CD1 3.98Å; W436-F439 HydrophobicContact CZ3-CD1 3.98Å; W436-F439 AromaticContact CZ3-CE1 3.98Å; W436-F439 HydrophobicContact CZ3-CE1 3.98Å; W436-F439 PolarHBondContact O-N 3.49Å; W436-I440 HydrophobicContact CD2-CG1 4.06Å; W436-I440 HydrophobicContact CE3-CG1 4.4Å; W436-I440 HydrophobicContact CH2-CD1 3.79Å; W436-I440 HydrophobicContact CH2-CG1 4.18Å; W436-I440 HydrophobicContact CZ2-CD1 3.77Å; W436-I440 HydrophobicContact CZ2-CG1 3.81Å; W436-I440 HydrophobicContact CZ3-CD1 4.24Å; W436-I440 HydrophobicContact CZ3-CG1 4.44Å; W436-I440 WeakPolarHBondContact O-CG1 3.48Å; W436-I440 PolarHBondContact O-N 3.02Å
437	N	93.1	Very high	90.7	Very high	108 Å²	108	42.2 Å²	42.2	58%	0.578	22%	0.219	S	C	*	.	H	α-helix	trans	-67.6	-46	-179.1	-67.9	-12.7	0	0	0	112.3	L435 F439 I440 N441	L435-N437 PolarHBondContact O-N 2.98Å; N437-F439 VanDerWaalsContact C-N 3.28Å; N437-F439 PolarHBondContact O-N 3.39Å; N437-I440 PolarHBondContact O-N 3.41Å; N437-N441 WeakPolarHBondContact O-CB 3.47Å; N437-N441 PolarHBondContact O-N 3.12Å; N437-N441 PolarHBondContact O-ND2 2.92Å; N437-N441 PolarHBondContact O-OD1 3.18Å
438	P	90.9	Very high	90.5	Very high	19 Å²	19	44 Å²	44	12%	0.123	23%	0.228	C	C	.	.	H	α-helix	trans	-54.4	-42.4	171.2	-27.7	34.2	0	0	0	113.6	W267 L296 Q434 L435 S442	W267-P438 HydrophobicContact CH2-CB 4.45Å; W267-P438 HydrophobicContact CZ2-CB 4.31Å; L296-P438 HydrophobicContact CB-CB 4.26Å; L296-P438 HydrophobicContact CB-CG 4.01Å; Q434-P438 WeakPolarHBondContact O-CD 3Å; L435-P438 WeakPolarHBondContact O-CD 3.2Å; P438-S442 WeakPolarHBondContact O-CB 3.4Å; P438-S442 PolarHBondContact O-N 3.45Å; P438-S442 PolarHBondContact O-OG 3.43Å
439	F	93.6	Very high	90.5	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-64.3	-48.5	177.5	165.5	-112.5	0	0	0	112.3	F260 I264 W267 F301 L386 L390 L435 W436 N437 N441 S442 L443	F260-F439 HydrophobicContact CE2-CE2 4.31Å; F260-F439 AromaticContact CE2-CZ 3.88Å; F260-F439 HydrophobicContact CE2-CZ 3.88Å; F260-F439 HydrophobicContact CZ-CZ 4.28Å; I264-F439 HydrophobicContact CD1-CD2 3.66Å; I264-F439 HydrophobicContact CD1-CE2 3.62Å; W267-F439 HydrophobicContact CH2-CB 3.71Å; W267-F439 HydrophobicContact CZ2-CB 4.15Å; W267-F439 HydrophobicContact CZ3-CB 4.1Å; F301-F439 HydrophobicContact CD2-CD2 4.29Å; F301-F439 HydrophobicContact CD2-CE2 4.17Å; F301-F439 HydrophobicContact CE2-CD2 4.07Å; F301-F439 AromaticContact CE2-CE2 3.62Å; F301-F439 HydrophobicContact CE2-CE2 3.62Å; F301-F439 HydrophobicContact CZ-CE2 4.22Å; L386-F439 HydrophobicContact CD1-CE1 4.48Å; L386-F439 HydrophobicContact CD1-CZ 4.23Å; L386-F439 HydrophobicContact CD2-CE1 3.8Å; L386-F439 HydrophobicContact CD2-CZ 4.09Å; L386-F439 HydrophobicContact CG-CE1 3.97Å; L386-F439 HydrophobicContact CG-CZ 4.21Å; L390-F439 HydrophobicContact CD1-CD1 4.33Å; L390-F439 HydrophobicContact CD1-CD2 4.4Å; L390-F439 HydrophobicContact CD1-CG 4.21Å; L390-F439 HydrophobicContact CD2-CD1 3.96Å; L390-F439 HydrophobicContact CD2-CG 4.33Å; L435-F439 WeakPolarHBondContact O-CB 3.35Å; L435-F439 PolarHBondContact O-N 2.89Å; W436-F439 HydrophobicContact CE3-CD1 4.03Å; W436-F439 HydrophobicContact CE3-CE1 4.49Å; W436-F439 AromaticContact CZ3-CD1 3.98Å; W436-F439 HydrophobicContact CZ3-CD1 3.98Å; W436-F439 AromaticContact CZ3-CE1 3.98Å; W436-F439 HydrophobicContact CZ3-CE1 3.98Å; W436-F439 PolarHBondContact O-N 3.49Å; N437-F439 VanDerWaalsContact C-N 3.28Å; N437-F439 PolarHBondContact O-N 3.39Å; F439-N441 VanDerWaalsContact C-N 3.33Å; F439-N441 PolarHBondContact O-N 3.47Å; F439-S442 PolarHBondContact O-N 2.67Å; F439-S442 PolarHBondContact O-OG 3.29Å; F439-L443 HydrophobicContact CE1-CD2 4.27Å; F439-L443 HydrophobicContact CE2-CD2 3.92Å; F439-L443 HydrophobicContact CZ-CD2 3.58Å; F439-L443 VanDerWaalsContact O-CB 3.25Å; F439-L443 WeakPolarHBondContact O-CB 3.48Å; F439-L443 PolarHBondContact O-N 3.4Å
440	I	93.7	Very high	90.4	Very high	21 Å²	21	46.8 Å²	46.8	11%	0.108	24%	0.242	C	C	.	.	H	α-helix	trans	-64	-41.1	178.4	-69.3	-62.7	0	0	0	111	L386 W436 N437 L443 Q444 M451	L386-I440 HydrophobicContact CD2-CD1 4.22Å; W436-I440 HydrophobicContact CD2-CG1 4.06Å; W436-I440 HydrophobicContact CE3-CG1 4.4Å; W436-I440 HydrophobicContact CH2-CD1 3.79Å; W436-I440 HydrophobicContact CH2-CG1 4.18Å; W436-I440 HydrophobicContact CZ2-CD1 3.77Å; W436-I440 HydrophobicContact CZ2-CG1 3.81Å; W436-I440 HydrophobicContact CZ3-CD1 4.24Å; W436-I440 HydrophobicContact CZ3-CG1 4.44Å; W436-I440 WeakPolarHBondContact O-CG1 3.48Å; W436-I440 PolarHBondContact O-N 3.02Å; N437-I440 PolarHBondContact O-N 3.41Å; I440-L443 PolarHBondContact O-N 3.49Å; I440-Q444 HydrophobicContact CG2-CG 4.22Å; I440-Q444 WeakPolarHBondContact O-CB 3.35Å; I440-Q444 VanDerWaalsContact O-CG 3.28Å; I440-Q444 WeakPolarHBondContact O-CG 3.42Å; I440-Q444 PolarHBondContact O-N 3.32Å; I440-M451 HydrophobicContact CD1-CE 3.97Å
441	N	92	Very high	90.3	Very high	89 Å²	89	45.5 Å²	45.5	48%	0.476	23%	0.234	S	C	.	.	H	α-helix	trans	-64.7	-43.6	177.8	-68.9	-9.6	0	0	0	111.7	N437 F439 L443 Q444 S445	N437-N441 WeakPolarHBondContact O-CB 3.47Å; N437-N441 PolarHBondContact O-N 3.12Å; N437-N441 PolarHBondContact O-ND2 2.92Å; N437-N441 PolarHBondContact O-OD1 3.18Å; F439-N441 VanDerWaalsContact C-N 3.33Å; F439-N441 PolarHBondContact O-N 3.47Å; N441-L443 VanDerWaalsContact C-N 3.3Å; N441-L443 PolarHBondContact O-N 3.37Å; N441-Q444 PolarHBondContact O-N 2.77Å; N441-S445 WeakPolarHBondContact O-CB 3.49Å; N441-S445 PolarHBondContact O-N 3.45Å
442	S	91.2	Very high	90.2	Very high	9 Å²	9	52.2 Å²	52.2	6%	0.063	27%	0.27	C	S	.	.	H	α-helix	trans	-65.9	-36.7	178	70.1	0	0	0	0	111.4	W267 F301 P438 F439 S445	W267-S442 PolarHBondContact NE1-OG 2.92Å; F301-S442 WeakPolarHBondContact CB-O 3.34Å; P438-S442 WeakPolarHBondContact O-CB 3.4Å; P438-S442 PolarHBondContact O-N 3.45Å; P438-S442 PolarHBondContact O-OG 3.43Å; F439-S442 PolarHBondContact O-N 2.67Å; F439-S442 PolarHBondContact O-OG 3.29Å; S442-S445 PolarHBondContact O-OG 3.24Å
443	L	91.5	Very high	90	Very high	1 Å²	1	54.8 Å²	54.8	1%	0.005	29%	0.288	C	S	.	.	H	α-helix	trans	-71.2	-43.4	177.5	-170.3	54.8	0	0	0	112.2	F255 F301 L386 F439 I440 N441 S445 N446 W449 M451	F255-L443 HydrophobicContact CE2-CD1 3.92Å; F255-L443 HydrophobicContact CE2-CD2 4.11Å; F255-L443 HydrophobicContact CZ-CD1 3.84Å; F301-L443 HydrophobicContact CD1-CD1 3.52Å; F301-L443 HydrophobicContact CE1-CD1 3.69Å; F301-L443 HydrophobicContact CG-CD1 4Å; F301-L443 HydrophobicContact CZ-CD1 4.3Å; L386-L443 HydrophobicContact CD2-CD2 4.35Å; F439-L443 HydrophobicContact CE1-CD2 4.27Å; F439-L443 HydrophobicContact CE2-CD2 3.92Å; F439-L443 HydrophobicContact CZ-CD2 3.58Å; F439-L443 VanDerWaalsContact O-CB 3.25Å; F439-L443 WeakPolarHBondContact O-CB 3.48Å; F439-L443 PolarHBondContact O-N 3.4Å; I440-L443 PolarHBondContact O-N 3.49Å; N441-L443 VanDerWaalsContact C-N 3.3Å; N441-L443 PolarHBondContact O-N 3.37Å; L443-S445 VanDerWaalsContact C-N 3.31Å; L443-S445 PolarHBondContact O-N 3.48Å; L443-N446 CarbonylContact O-C 3.58Å; L443-N446 PolarHBondContact O-N 3.42Å; L443-N446 VanDerWaalsContact O-N 3.1Å; L443-W449 HydrophobicContact CD1-CB 3.82Å; L443-W449 HydrophobicContact CD1-CG 3.73Å; L443-M451 HydrophobicContact CD1-SD 4.38Å; L443-M451 HydrophobicContact CD2-CE 3.52Å; L443-M451 HydrophobicContact CD2-SD 3.19Å; L443-M451 WeakPolarHBondContact CD2-SD 3.33Å; L443-M451 HydrophobicContact CG-CE 4.07Å; L443-M451 HydrophobicContact CG-SD 3.49Å; L443-M451 WeakPolarHBondContact CG-SD 3.43Å
444	Q	90.2	Very high	90	Very high	113 Å²	113	53.4 Å²	53.4	53%	0.528	28%	0.279	S	S	.	.	H	α-helix	trans	-67.6	-28.6	176	-74.6	178.1	-18.4	0	0	113.4	I440 N441 N446 H447	I440-Q444 HydrophobicContact CG2-CG 4.22Å; I440-Q444 WeakPolarHBondContact O-CB 3.35Å; I440-Q444 VanDerWaalsContact O-CG 3.28Å; I440-Q444 WeakPolarHBondContact O-CG 3.42Å; I440-Q444 PolarHBondContact O-N 3.32Å; N441-Q444 PolarHBondContact O-N 2.77Å; Q444-N446 PolarHBondContact O-N 2.96Å; Q444-H447 PolarHBondContact O-CE1 3.13Å; Q444-H447 PolarHBondContact O-ND1 2.96Å
445	S	85.9	Confident	90.1	Very high	78 Å²	78	51.5 Å²	51.5	55%	0.545	27%	0.271	S	S	.	.	H	α-helix	trans	-65.2	-21.9	172.7	76	0	0	0	0	112.7	N441 S442 L443	N441-S445 WeakPolarHBondContact O-CB 3.49Å; N441-S445 PolarHBondContact O-N 3.45Å; S442-S445 PolarHBondContact O-OG 3.24Å; L443-S445 VanDerWaalsContact C-N 3.31Å; L443-S445 PolarHBondContact O-N 3.48Å
446	N	81.3	Confident	90.2	Very high	20 Å²	20	51.6 Å²	51.6	11%	0.107	27%	0.271	C	S	.	.	S	Bend	trans	-101.8	92.4	175.8	-167.6	-23.9	0	0	0	109.3	F301 L443 Q444 D448	F301-N446 PolarHBondContact O-ND2 3.09Å; L443-N446 CarbonylContact O-C 3.58Å; L443-N446 PolarHBondContact O-N 3.42Å; L443-N446 VanDerWaalsContact O-N 3.1Å; Q444-N446 PolarHBondContact O-N 2.96Å; N446-D448 PolarHBondContact O-N 3.39Å
447	H	79	Confident	90.1	Very high	168 Å²	168	50.8 Å²	50.8	78%	0.778	27%	0.273	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.2	-1.6	-173	-63	-56.7	0	0	0	115.4	Q444	Q444-H447 PolarHBondContact O-CE1 3.13Å; Q444-H447 PolarHBondContact O-ND1 2.96Å
448	D	87.5	Confident	90.1	Very high	49 Å²	49	46.9 Å²	46.9	26%	0.262	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.7	-23.6	-176.2	-70.1	-4.8	0	0	0	113.6	R253 H303 V304 N446	R253-D448 VanDerWaalsContact CB-O 3.3Å; R253-D448 WeakPolarHBondContact CB-O 3.43Å; R253-D448 VanDerWaalsContact CD-O 3.22Å; R253-D448 WeakPolarHBondContact CD-O 3.36Å; R253-D448 WeakPolarHBondContact CG-O 3.27Å; H303-D448 IonicContact CE1-OD2 3.53Å; H303-D448 PolarHBondContact CE1-OD2 2.92Å; H303-D448 IonicContact ND1-OD2 3.2Å; H303-D448 IonicContact NE2-OD2 3.57Å; H303-D448 PolarHBondContact NE2-OD2 2.85Å; V304-D448 HydrophobicContact CB-CB 4.23Å; V304-D448 HydrophobicContact CG2-CB 3.51Å; N446-D448 PolarHBondContact O-N 3.39Å
449	W	93.1	Very high	90.1	Very high	13 Å²	13	48.5 Å²	48.5	5%	0.049	26%	0.263	C	S	.	.	S	Bend	trans	-80.8	134	-178.3	-71.4	106.6	0	0	0	111.8	R253 F255 F301 P302 V304 V307 L443 M451	R253-W449 VanDerWaalsContact O-CE3 3.23Å; F255-W449 AromaticContact CD1-CE3 3.81Å; F255-W449 HydrophobicContact CD1-CE3 3.81Å; F255-W449 HydrophobicContact CD1-CH2 4.14Å; F255-W449 AromaticContact CD1-CZ3 3.61Å; F255-W449 HydrophobicContact CD1-CZ3 3.61Å; F255-W449 HydrophobicContact CD2-CE3 4.2Å; F255-W449 AromaticContact CE1-CD2 3.64Å; F255-W449 HydrophobicContact CE1-CD2 3.64Å; F255-W449 AromaticContact CE1-CE2 3.84Å; F255-W449 AromaticContact CE1-CE3 3.33Å; F255-W449 HydrophobicContact CE1-CE3 3.33Å; F255-W449 AromaticContact CE1-CH2 3.58Å; F255-W449 HydrophobicContact CE1-CH2 3.58Å; F255-W449 AromaticContact CE1-CZ2 3.82Å; F255-W449 HydrophobicContact CE1-CZ2 3.82Å; F255-W449 AromaticContact CE1-CZ3 3.33Å; F255-W449 HydrophobicContact CE1-CZ3 3.33Å; F255-W449 HydrophobicContact CE2-CB 4.15Å; F255-W449 AromaticContact CE2-CD2 3.89Å; F255-W449 HydrophobicContact CE2-CD2 3.89Å; F255-W449 AromaticContact CE2-CE3 3.76Å; F255-W449 HydrophobicContact CE2-CE3 3.76Å; F255-W449 HydrophobicContact CE2-CG 4.08Å; F255-W449 HydrophobicContact CG-CE3 4.22Å; F255-W449 HydrophobicContact CG-CZ3 4.33Å; F255-W449 HydrophobicContact CZ-CB 4.28Å; F255-W449 AromaticContact CZ-CD2 3.25Å; F255-W449 HydrophobicContact CZ-CD2 3.25Å; F255-W449 AromaticContact CZ-CE2 3.7Å; F255-W449 AromaticContact CZ-CE3 3.3Å; F255-W449 HydrophobicContact CZ-CE3 3.3Å; F255-W449 AromaticContact CZ-CG 3.71Å; F255-W449 HydrophobicContact CZ-CG 3.71Å; F255-W449 HydrophobicContact CZ-CH2 4.25Å; F255-W449 HydrophobicContact CZ-CZ2 4.17Å; F255-W449 AromaticContact CZ-CZ3 3.84Å; F255-W449 HydrophobicContact CZ-CZ3 3.84Å; F301-W449 AromaticContact CD1-CD1 3.96Å; F301-W449 AromaticContact CD1-NE1 3.6Å; F301-W449 AromaticContact CE1-NE1 3.75Å; P302-W449 PolarHBondContact O-NE1 2.88Å; V304-W449 VanDerWaalsContact CA-CZ2 3.48Å; V304-W449 HydrophobicContact CB-CH2 4.4Å; V304-W449 HydrophobicContact CB-CZ2 4.19Å; V304-W449 HydrophobicContact CG2-CD2 3.45Å; V304-W449 VanDerWaalsContact CG2-CD2 3.45Å; V304-W449 VanDerWaalsContact CG2-CE2 3.42Å; V304-W449 HydrophobicContact CG2-CE3 3.81Å; V304-W449 HydrophobicContact CG2-CG 3.89Å; V304-W449 HydrophobicContact CG2-CH2 4.05Å; V304-W449 HydrophobicContact CG2-CZ2 3.74Å; V304-W449 HydrophobicContact CG2-CZ3 4.08Å; V307-W449 HydrophobicContact CB-CH2 3.86Å; V307-W449 HydrophobicContact CB-CZ2 3.95Å; V307-W449 HydrophobicContact CG1-CH2 3.86Å; V307-W449 HydrophobicContact CG1-CZ2 4.34Å; V307-W449 HydrophobicContact CG2-CH2 4.13Å; V307-W449 HydrophobicContact CG2-CZ2 3.76Å; L443-W449 HydrophobicContact CD1-CB 3.82Å; L443-W449 HydrophobicContact CD1-CG 3.73Å; W449-M451 PolarHBondContact O-N 3.48Å
450	N	91.6	Very high	90	Very high	48 Å²	48	55.2 Å²	55.2	26%	0.257	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.5	118.9	172.1	-177.2	-6.1	0	0	0	110	R253 T254 D452 S453	R253-N450 HydrophobicContact CB-CB 4.49Å; R253-N450 PolarHBondContact O-N 3.46Å; T254-N450 PolarHBondContact OG1-ND2 3.04Å; N450-D452 PolarHBondContact OD1-N 3.46Å; N450-S453 PolarHBondContact ND2-OG 3.26Å; N450-S453 PolarHBondContact OD1-N 3.47Å
451	M	89.7	Confident	90.1	Very high	39 Å²	39	61.1 Å²	61.1	19%	0.192	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	-7.1	-178.3	-70.9	-60.8	-73.1	0	0	114.3	L383 L386 I440 L443 W449 F454	L383-M451 HydrophobicContact CD2-CE 4.19Å; L386-M451 HydrophobicContact CD2-CE 3.84Å; I440-M451 HydrophobicContact CD1-CE 3.97Å; L443-M451 HydrophobicContact CD1-SD 4.38Å; L443-M451 HydrophobicContact CD2-CE 3.52Å; L443-M451 HydrophobicContact CD2-SD 3.19Å; L443-M451 WeakPolarHBondContact CD2-SD 3.33Å; L443-M451 HydrophobicContact CG-CE 4.07Å; L443-M451 HydrophobicContact CG-SD 3.49Å; L443-M451 WeakPolarHBondContact CG-SD 3.43Å; W449-M451 PolarHBondContact O-N 3.48Å; M451-F454 VanDerWaalsContact O-CZ 3.31Å; M451-F454 WeakPolarHBondContact O-CZ 3.33Å; M451-F454 HydrophobicContact SD-CE1 4.34Å; M451-F454 HydrophobicContact SD-CZ 4.36Å
452	D	88.8	Confident	90.2	Very high	141 Å²	141	60.6 Å²	60.6	75%	0.754	31%	0.31	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-89.4	-24.8	-175.3	-62.2	-38.9	0	0	0	112.1	N450	N450-D452 PolarHBondContact OD1-N 3.46Å
453	S	88.5	Confident	90.3	Very high	53 Å²	53	61.9 Å²	61.9	37%	0.371	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.7	144.2	-177.5	69.2	0	0	0	0	111.8	T254 N450	T254-S453 WeakPolarHBondContact CG2-O 3.32Å; N450-S453 PolarHBondContact ND2-OG 3.26Å; N450-S453 PolarHBondContact OD1-N 3.47Å
454	F	93.2	Very high	90.2	Very high	26 Å²	26	68.2 Å²	68.2	11%	0.114	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.8	178.4	-50	-65.6	0	0	0	110.4	F255 P382 L386 M451 F456	F255-F454 HydrophobicContact CB-CD1 4.21Å; F255-F454 HydrophobicContact CD2-CD1 4.05Å; F255-F454 HydrophobicContact CD2-CE1 4.03Å; P382-F454 HydrophobicContact CB-CD2 3.88Å; P382-F454 HydrophobicContact CB-CE2 3.87Å; P382-F454 WeakPolarHBondContact O-CD2 3.36Å; P382-F454 WeakPolarHBondContact O-CE2 3.41Å; L386-F454 HydrophobicContact CB-CD2 4.33Å; L386-F454 HydrophobicContact CB-CE2 3.88Å; L386-F454 HydrophobicContact CB-CZ 4.15Å; L386-F454 HydrophobicContact CD1-CD1 4.47Å; L386-F454 HydrophobicContact CD1-CE1 4.17Å; L386-F454 HydrophobicContact CD1-CZ 4.27Å; L386-F454 HydrophobicContact CD2-CE1 4.27Å; L386-F454 HydrophobicContact CD2-CE2 4.3Å; L386-F454 HydrophobicContact CD2-CZ 3.75Å; L386-F454 HydrophobicContact CG-CZ 4.28Å; M451-F454 VanDerWaalsContact O-CZ 3.31Å; M451-F454 WeakPolarHBondContact O-CZ 3.33Å; M451-F454 HydrophobicContact SD-CE1 4.34Å; M451-F454 HydrophobicContact SD-CZ 4.36Å; F454-F456 HydrophobicContact CB-CD2 3.57Å; F454-F456 HydrophobicContact CB-CE1 4.47Å; F454-F456 HydrophobicContact CB-CE2 3.35Å; F454-F456 HydrophobicContact CB-CG 4.24Å; F454-F456 HydrophobicContact CB-CZ 3.84Å; F454-F456 HydrophobicContact CD1-CE2 4.2Å; F454-F456 HydrophobicContact CD1-CZ 4.2Å; F454-F456 HydrophobicContact CD2-CE2 4.07Å; F454-F456 HydrophobicContact CG-CD2 4.28Å; F454-F456 AromaticContact CG-CE2 3.61Å; F454-F456 HydrophobicContact CG-CE2 3.61Å; F454-F456 HydrophobicContact CG-CZ 4.06Å
455	Q	92.7	Very high	89.9	Confident	46 Å²	46	66.8 Å²	66.8	22%	0.215	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	60.2	-179.3	-67.5	174	-30.1	0	0	110.6	D126 C127 T254 F255 N256 A457	D126-Q455 VanDerWaalsContact O-CD 3.28Å; D126-Q455 PolarHBondContact O-NE2 3.1Å; D126-Q455 PolarHBondContact O-OE1 3.46Å; D126-Q455 VanDerWaalsContact O-OE1 3.12Å; C127-Q455 HydrophobicContact CB-CB 4.38Å; C127-Q455 PolarHBondContact SG-O 3.39Å; T254-Q455 HydrophobicContact CG2-CG 3.87Å; F255-Q455 PolarHBondContact O-N 3.12Å; N256-Q455 WeakPolarHBondContact CA-O 3.4Å; N256-Q455 HydrophobicContact CB-CB 4.45Å; Q455-A457 VanDerWaalsContact C-N 3.27Å; Q455-A457 PolarHBondContact O-N 3.02Å
456	F	93.5	Very high	89.5	Confident	2 Å²	2	70.7 Å²	70.7	1%	0.009	35%	0.35	C	S	.	.			trans	-86	10.1	179.1	-59.9	-45.1	0	0	0	113.9	F255 R257 F260 M324 Q385 L386 M389 F454 A458	F255-F456 HydrophobicContact CB-CE1 3.94Å; F255-F456 HydrophobicContact CB-CZ 4.06Å; R257-F456 HydrophobicContact CG-CD1 4.41Å; R257-F456 PolarHBondContact NE-O 2.71Å; R257-F456 PolarHBondContact NH2-O 2.76Å; F260-F456 HydrophobicContact CB-CE1 3.82Å; F260-F456 HydrophobicContact CB-CZ 4.41Å; F260-F456 HydrophobicContact CD1-CE1 4.45Å; F260-F456 HydrophobicContact CD2-CZ 4.32Å; F260-F456 HydrophobicContact CG-CE1 4.02Å; F260-F456 HydrophobicContact CG-CZ 4.18Å; M324-F456 HydrophobicContact SD-CB 3.91Å; Q385-F456 HydrophobicContact CB-CD2 4.44Å; L386-F456 HydrophobicContact CD1-CE2 4.11Å; L386-F456 HydrophobicContact CD1-CZ 3.9Å; M389-F456 HydrophobicContact CB-CE2 4.31Å; M389-F456 HydrophobicContact CB-CZ 4.33Å; M389-F456 HydrophobicContact CE-CD1 4.14Å; M389-F456 HydrophobicContact CE-CE1 4.35Å; M389-F456 HydrophobicContact CG-CB 4.47Å; M389-F456 HydrophobicContact CG-CD1 4.02Å; M389-F456 HydrophobicContact CG-CD2 3.61Å; M389-F456 HydrophobicContact CG-CE1 4.11Å; M389-F456 HydrophobicContact CG-CE2 3.69Å; M389-F456 HydrophobicContact CG-CG 3.78Å; M389-F456 HydrophobicContact CG-CZ 3.96Å; M389-F456 HydrophobicContact SD-CB 4.43Å; M389-F456 HydrophobicContact SD-CD1 4.32Å; M389-F456 HydrophobicContact SD-CG 4.21Å; F454-F456 HydrophobicContact CB-CD2 3.57Å; F454-F456 HydrophobicContact CB-CE1 4.47Å; F454-F456 HydrophobicContact CB-CE2 3.35Å; F454-F456 HydrophobicContact CB-CG 4.24Å; F454-F456 HydrophobicContact CB-CZ 3.84Å; F454-F456 HydrophobicContact CD1-CE2 4.2Å; F454-F456 HydrophobicContact CD1-CZ 4.2Å; F454-F456 HydrophobicContact CD2-CE2 4.07Å; F454-F456 HydrophobicContact CG-CD2 4.28Å; F454-F456 AromaticContact CG-CE2 3.61Å; F454-F456 HydrophobicContact CG-CE2 3.61Å; F454-F456 HydrophobicContact CG-CZ 4.06Å; F456-A458 VanDerWaalsContact C-N 3.3Å; F456-A458 PolarHBondContact O-N 3.36Å
457	A	91.1	Very high	88.4	Confident	24 Å²	24	82.5 Å²	82.5	20%	0.198	40%	0.404	C	S	.	.			trans	48.2	50.2	-175.5	0	0	0	0	0	112.3	I123 C127 R257 Q455	I123-A457 HydrophobicContact CG2-CB 4.34Å; C127-A457 HydrophobicContact CB-CB 4.37Å; C127-A457 VanDerWaalsContact SG-CB 3.56Å; C127-A457 PolarHBondContact SG-N 2.78Å; R257-A457 PolarHBondContact NH2-O 2.95Å; Q455-A457 VanDerWaalsContact C-N 3.27Å; Q455-A457 PolarHBondContact O-N 3.02Å
458	A	92.4	Very high	88.9	Confident	26 Å²	26	78.2 Å²	78.2	22%	0.215	39%	0.385	C	S	.	.			trans	-72.4	130.1	173.4	0	0	0	0	0	109.7	M324 L376 F456	M324-A458 HydrophobicContact CB-CB 4.4Å; M324-A458 HydrophobicContact CG-CB 3.76Å; M324-A458 HydrophobicContact SD-CB 3.77Å; L376-A458 HydrophobicContact CD1-CB 4.3Å; F456-A458 VanDerWaalsContact C-N 3.3Å; F456-A458 PolarHBondContact O-N 3.36Å
459	D	91.5	Very high	88.9	Confident	52 Å²	52	79.7 Å²	79.7	28%	0.278	39%	0.392	S	S	.	.			trans	-72.9	167.7	171.8	-168.2	-0.5	0	0	0	109.9	M324 G325 R462	M324-D459 PolarHBondContact O-N 2.99Å; G325-D459 CarbonylContact O-C 3.59Å; G325-D459 WeakPolarHBondContact O-CB 3.17Å; D459-R462 PolarHBondContact O-NH1 3.05Å
460	I	91.7	Very high	88.7	Confident	141 Å²	141	83.4 Å²	83.4	72%	0.723	41%	0.411	S	S	*	.	S	Bend	trans	-85.5	-6.8	-169.8	58	170.2	0	0	0	113.8	R462	I460-R462 PolarHBondContact O-N 3.02Å
461	W	95.1	Very high	88.5	Confident	146 Å²	146	85.5 Å²	85.5	55%	0.553	42%	0.42	S	S	*	.			trans	-65	131.2	179.8	-64.6	88.6	0	0	0	111	G325	G325-W461 VanDerWaalsContact O-CB 3.27Å; G325-W461 WeakPolarHBondContact O-CB 3.29Å; G325-W461 PolarHBondContact O-N 3.49Å
462	R	95.1	Very high	88.5	Confident	78 Å²	78	88.4 Å²	88.4	29%	0.294	43%	0.434	S	S	.	.			trans	-129.3	136.9	175	-62.9	-64.5	177.7	-84.3	-2.9	109.5	L376 F377 D459 I460	L376-R462 CarbonylContact O-C 3.43Å; L376-R462 WeakPolarHBondContact O-CA 3.3Å; F377-R462 WeakPolarHBondContact O-CD 3.29Å; D459-R462 PolarHBondContact O-NH1 3.05Å; I460-R462 PolarHBondContact O-N 3.02Å
463	L	92.3	Very high	88.4	Confident	35 Å²	35	84.9 Å²	84.9	18%	0.183	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-87.2	114.8	172.7	-176.8	62.5	0	0	0	108.9	L328 I352 V375 L376 F377 S378	L328-L463 HydrophobicContact CD1-CD1 3.87Å; I352-L463 HydrophobicContact CD1-CD2 4.19Å; V375-L463 HydrophobicContact CG1-CB 4.14Å; L376-L463 PolarHBondContact O-N 2.71Å; F377-L463 CarbonylContact C-O 3.58Å; F377-L463 VanDerWaalsContact CA-O 3.3Å; F377-L463 WeakPolarHBondContact CA-O 3.5Å; F377-L463 HydrophobicContact CD1-CB 4.33Å; F377-L463 HydrophobicContact CD1-CD2 4.21Å; F377-L463 HydrophobicContact CD1-CG 4.32Å; F377-L463 HydrophobicContact CE1-CD2 3.77Å; F377-L463 HydrophobicContact CE1-CG 4.31Å; F377-L463 HydrophobicContact CZ-CD2 4.17Å; S378-L463 PolarHBondContact N-O 3.32Å; S378-L463 PolarHBondContact OG-O 3.38Å
464	H	90.4	Very high	88.4	Confident	135 Å²	135	87.2 Å²	87.2	63%	0.625	42%	0.416	S	S	*	.	P	Polyproline II helix	trans	-82.6	133.6	172.7	-69	-88.4	0	0	0	109.9	S378	S378-H464 WeakPolarHBondContact CB-ND1 3.31Å
465	R	83.9	Confident	88.1	Confident	83 Å²	83	91.9 Å²	91.9	31%	0.313	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-78.6	121.5	167.3	-52.9	178.2	-161.8	-142	-3.4	106.6	E347 N350 F377 E379 E467	E347-R465 PolarHBondContact O-NH1 3.28Å; E347-R465 PolarHBondContact O-NH2 3.16Å; N350-R465 PolarHBondContact OD1-NH2 3.29Å; F377-R465 HydrophobicContact CD1-CG 3.84Å; F377-R465 HydrophobicContact CE1-CG 4.13Å; E379-R465 IonicContact OE2-CZ 3.85Å; E379-R465 IonicContact OE2-NE 2.78Å; E379-R465 PolarHBondContact OE2-NE 3.11Å; E379-R465 IonicContact OE2-NH2 3.27Å; R465-E467 PolarHBondContact O-N 3.15Å
466	N	78.1	Confident	87.7	Confident	159 Å²	159	95.8 Å²	95.8	85%	0.85	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-74.7	117.5	161.1	-76.3	-6	0	0	0	105.8
467	E	57.3	Low	87.2	Confident	268 Å²	268	104.3 Å²	104.3	100%	1.252	50%	0.499	S	S	*	.			trans	-65.6	0	165.4	-70.2	-173.4	167.4	0	0	110.8	R465	R465-E467 PolarHBondContact O-N 3.15Å

Retrieved 467 of 467 residues in 1179.4 ms (Link to these results)

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