A0A087YJZ4_POEFO Loading...

Cap-specific mRNA (nucleoside-2'-O-)-methyltransferase 2

AlphaFold DB , UniProt , Accession A0A087YJZ4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 764 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	29.7	Very low	28.4	Very low	250 Å²	250	157.9 Å²	157.9	100%	1.232	82%	0.821	S	S	*	*				0	99.9	0	-73.9	-171.4	167.9	0	0	108.9
2	S	22.3	Very low	29.1	Very low	117 Å²	117	158.7 Å²	158.7	82%	0.818	81%	0.805	S	S	*	*			trans	-129.7	106.2	162.5	65.8	0	0	0	0	107.3	S4	S2-S4 PolarHBondContact O-N 2.75Å; S2-S4 VanDerWaalsContact O-N 3.07Å
3	S	23.4	Very low	29.7	Very low	98 Å²	98	157 Å²	157	69%	0.685	79%	0.792	S	S	*	*			trans	-75.4	89.8	174.4	59.4	0	0	0	0	108.3	Y5	S3-Y5 VanDerWaalsContact C-N 3.31Å; S3-Y5 PolarHBondContact O-N 3.11Å
4	S	23.7	Very low	29.9	Very low	112 Å²	112	158.4 Å²	158.4	78%	0.783	79%	0.794	S	S	*	*			trans	-74.6	94.3	162.9	75.6	0	0	0	0	107.4	S2 G6	S2-S4 PolarHBondContact O-N 2.75Å; S2-S4 VanDerWaalsContact O-N 3.07Å; S4-G6 PolarHBondContact O-N 3.14Å
5	Y	26.3	Very low	30.4	Very low	201 Å²	201	156.2 Å²	156.2	79%	0.788	78%	0.781	S	S	*	*			trans	-54.8	105.9	162.3	-80.1	-90.5	0	0	0	107.4	S3 T7	S3-Y5 VanDerWaalsContact C-N 3.31Å; S3-Y5 PolarHBondContact O-N 3.11Å; Y5-T7 PolarHBondContact O-N 2.63Å
6	G	26.4	Very low	31.1	Very low	74 Å²	74	151.3 Å²	151.3	76%	0.763	76%	0.757	S	S	*	*			trans	-60.9	102.4	172.4	0	0	0	0	0	108.1	S4 R8	S4-G6 PolarHBondContact O-N 3.14Å; G6-R8 PolarHBondContact O-N 3.46Å; G6-R8 VanDerWaalsContact O-N 3.1Å
7	T	26.1	Very low	31.8	Very low	132 Å²	132	150.8 Å²	150.8	81%	0.81	75%	0.75	S	S	*	*			trans	-54.1	118.8	175	-25.5	0	0	0	0	107.2	Y5 R9	Y5-T7 PolarHBondContact O-N 2.63Å; T7-R9 PolarHBondContact O-N 2.87Å
8	R	36.1	Very low	32	Very low	238 Å²	238	147.4 Å²	147.4	90%	0.898	74%	0.743	S	S	*	*			trans	-50.3	98.8	161.7	-102.4	180	172.2	173.6	-2.9	105.8	G6 K10	G6-R8 PolarHBondContact O-N 3.46Å; G6-R8 VanDerWaalsContact O-N 3.1Å; R8-K10 PolarHBondContact O-N 2.58Å
9	R	32.7	Very low	32.5	Very low	221 Å²	221	144.6 Å²	144.6	83%	0.834	74%	0.739	S	S	*	*			trans	-63.4	95.2	163.5	-110.2	-177.4	168.2	178.9	0.3	104	T7 V11	T7-R9 PolarHBondContact O-N 2.87Å; R9-V11 HydrophobicContact CB-CB 4.22Å; R9-V11 HydrophobicContact CB-CG2 3.61Å; R9-V11 HydrophobicContact CG-CG2 3.55Å; R9-V11 PolarHBondContact O-N 2.98Å
10	K	31.9	Very low	33.5	Very low	212 Å²	212	141.4 Å²	141.4	92%	0.922	72%	0.722	S	S	*	*			trans	-60.6	68.8	155.9	-91.3	-174.6	170.4	-179.3	0	106.4	R8	R8-K10 PolarHBondContact O-N 2.58Å
11	V	33.9	Very low	34.5	Very low	82 Å²	82	139.8 Å²	139.8	50%	0.497	72%	0.72	S	S	.	*			trans	-109.5	107.3	176.9	173.6	0	0	0	0	105.3	R9 Q13	R9-V11 HydrophobicContact CB-CB 4.22Å; R9-V11 HydrophobicContact CB-CG2 3.61Å; R9-V11 HydrophobicContact CG-CG2 3.55Å; R9-V11 PolarHBondContact O-N 2.98Å; V11-Q13 VanDerWaalsContact C-N 3.29Å; V11-Q13 PolarHBondContact O-N 2.75Å
12	R	36.5	Very low	35.8	Very low	167 Å²	167	133.6 Å²	133.6	63%	0.63	70%	0.698	S	S	*	*	S	Bend	trans	61.1	10.2	155.9	-64	-175.5	173.2	-175	-0.9	119.6	Q14 Q15 L16	R12-Q14 PolarHBondContact O-N 2.96Å; R12-Q15 HydrophobicContact CB-CB 4.4Å; R12-Q15 HydrophobicContact CG-CB 4.45Å; R12-Q15 PolarHBondContact O-N 3.38Å; R12-Q15 VanDerWaalsContact O-N 3.11Å; R12-L16 PolarHBondContact O-N 2.71Å
13	Q	37.1	Very low	37.7	Very low	137 Å²	137	130 Å²	130	64%	0.64	67%	0.672	S	S	*	*	T	Hydrogen-bonded Turn	trans	-58.3	-27.2	169.1	-111.4	-178.4	1	0	0	112.7	V11 F17	V11-Q13 VanDerWaalsContact C-N 3.29Å; V11-Q13 PolarHBondContact O-N 2.75Å; Q13-F17 WeakPolarHBondContact O-CD2 3.2Å
14	Q	32.7	Very low	40.6	Very low	176 Å²	176	128.3 Å²	128.3	82%	0.822	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.4	-22.4	174.3	-82.8	176.7	-19.7	0	0	114.2	R12 S18	R12-Q14 PolarHBondContact O-N 2.96Å; Q14-S18 VanDerWaalsContact O-CB 3.26Å; Q14-S18 WeakPolarHBondContact O-CB 3.44Å; Q14-S18 PolarHBondContact O-OG 3.2Å; Q14-S18 VanDerWaalsContact O-OG 3.13Å
15	Q	37.1	Very low	43.6	Very low	126 Å²	126	128.1 Å²	128.1	59%	0.589	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-87.6	-24.9	179.8	-86.1	-177.4	-24.1	0	0	113.6	R12 F17	R12-Q15 HydrophobicContact CB-CB 4.4Å; R12-Q15 HydrophobicContact CG-CB 4.45Å; R12-Q15 PolarHBondContact O-N 3.38Å; R12-Q15 VanDerWaalsContact O-N 3.11Å; Q15-F17 VanDerWaalsContact C-N 3.32Å
16	L	42.6	Very low	46.6	Very low	77 Å²	77	124.7 Å²	124.7	40%	0.403	64%	0.643	S	S	.	*	S	Bend	trans	-71.3	-27.4	171.5	-88.7	148.3	0	0	0	112.1	R12 H410	R12-L16 PolarHBondContact O-N 2.71Å; L16-H410 PolarHBondContact O-CE1 3.24Å
17	F	42.6	Very low	49.5	Very low	143 Å²	143	121.2 Å²	121.2	63%	0.627	61%	0.607	S	S	*	*	S	Bend	trans	-97.5	-6.9	-174.7	-74.5	-95.2	0	0	0	114.3	Q13 Q15	Q13-F17 WeakPolarHBondContact O-CD2 3.2Å; Q15-F17 VanDerWaalsContact C-N 3.32Å
18	S	36	Very low	52.6	Low	90 Å²	90	121.2 Å²	121.2	63%	0.629	60%	0.598	S	S	*	*	S	Bend	trans	-112.5	6.8	-166.4	78.7	0	0	0	0	116.6	Q14	Q14-S18 VanDerWaalsContact O-CB 3.26Å; Q14-S18 WeakPolarHBondContact O-CB 3.44Å; Q14-S18 PolarHBondContact O-OG 3.2Å; Q14-S18 VanDerWaalsContact O-OG 3.13Å
19	S	40.9	Very low	55.2	Low	95 Å²	95	112.2 Å²	112.2	66%	0.664	57%	0.574	S	S	*	*			trans	-142.9	33.8	-175.4	77.2	0	0	0	0	115.6	V21	S19-V21 PolarHBondContact O-N 3.16Å
20	L	51.3	Low	58.1	Low	79 Å²	79	103.9 Å²	103.9	41%	0.414	55%	0.545	S	S	.	.			trans	-86.5	113.8	170.7	-77.9	149.1	0	0	0	109.4	H410	L20-H410 HydrophobicContact CD1-CB 4.14Å; L20-H410 VanDerWaalsContact CD1-CD2 3.44Å; L20-H410 WeakPolarHBondContact CD1-CD2 3.16Å
21	V	55.3	Low	61.1	Low	109 Å²	109	94.4 Å²	94.4	66%	0.661	50%	0.504	S	S	*	.	P	Polyproline II helix	trans	-55.3	134	156.4	179.6	0	0	0	0	106.7	S19 S23	S19-V21 PolarHBondContact O-N 3.16Å; V21-S23 PolarHBondContact O-N 2.65Å; V21-S23 VanDerWaalsContact O-N 3.17Å
22	P	56.5	Low	63.9	Low	119 Å²	119	94.6 Å²	94.6	77%	0.773	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-51.1	125.4	175.7	-23.8	31.9	0	0	0	109.8	D24	P22-D24 PolarHBondContact O-N 3.08Å
23	S	63.8	Low	66.6	Low	41 Å²	41	92 Å²	92	29%	0.287	50%	0.498	S	S	.	.	P	Polyproline II helix	trans	-58.1	136.2	175.4	-50.4	0	0	0	0	109	V21	V21-S23 PolarHBondContact O-N 2.65Å; V21-S23 VanDerWaalsContact O-N 3.17Å
24	D	83.2	Confident	69.4	Low	64 Å²	64	86.3 Å²	86.3	34%	0.342	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-62.4	156.1	171.7	68.5	88.7	0	0	0	110.3	P22 E26 T27 Q28	P22-D24 PolarHBondContact O-N 3.08Å; D24-E26 PolarHBondContact O-N 3.44Å; D24-E26 VanDerWaalsContact O-N 3.17Å; D24-E26 WeakPolarHBondContact OD1-CA 3.35Å; D24-E26 VanDerWaalsContact OD1-CB 3.3Å; D24-E26 WeakPolarHBondContact OD1-CB 3.06Å; D24-E26 PolarHBondContact OD1-N 3.38Å; D24-T27 PolarHBondContact O-N 3.49Å; D24-T27 VanDerWaalsContact O-N 3.15Å; D24-T27 PolarHBondContact OD1-N 2.74Å; D24-T27 PolarHBondContact OD1-OG1 3Å; D24-T27 VanDerWaalsContact OD2-CB 3.28Å; D24-T27 WeakPolarHBondContact OD2-CB 3.42Å; D24-T27 PolarHBondContact OD2-OG1 3.38Å; D24-Q28 PolarHBondContact O-N 3.14Å
25	P	87.3	Confident	72.5	Confident	108 Å²	108	78 Å²	78	70%	0.701	43%	0.433	S	S	*	.	H	α-helix	trans	-58	-31.1	-175.5	-26.6	35.3	0	0	0	114.4	A29	P25-A29 WeakPolarHBondContact O-CB 3.16Å; P25-A29 PolarHBondContact O-N 3.43Å
26	E	87.9	Confident	75.2	Confident	129 Å²	129	74.7 Å²	74.7	60%	0.603	42%	0.42	S	S	*	.	H	α-helix	trans	-70.2	-45.5	178.2	-57.3	-178.2	178.6	0	0	110.8	D24 Q28 A29 E30 R400	D24-E26 PolarHBondContact O-N 3.44Å; D24-E26 VanDerWaalsContact O-N 3.17Å; D24-E26 WeakPolarHBondContact OD1-CA 3.35Å; D24-E26 VanDerWaalsContact OD1-CB 3.3Å; D24-E26 WeakPolarHBondContact OD1-CB 3.06Å; D24-E26 PolarHBondContact OD1-N 3.38Å; E26-Q28 VanDerWaalsContact C-N 3.29Å; E26-Q28 PolarHBondContact O-N 3.19Å; E26-A29 PolarHBondContact O-N 2.87Å; E26-E30 PolarHBondContact O-N 3.44Å; E26-R400 IonicContact OE2-NH2 3.01Å; E26-R400 PolarHBondContact OE2-NH2 3.41Å
27	T	88.8	Confident	77.8	Confident	1 Å²	1	71.7 Å²	71.7	1%	0.006	40%	0.403	C	S	.	.	H	α-helix	trans	-59.1	-41.7	175.4	-67	0	0	0	0	111.2	D24 E30 I31 I404	D24-T27 PolarHBondContact O-N 3.49Å; D24-T27 VanDerWaalsContact O-N 3.15Å; D24-T27 PolarHBondContact OD1-N 2.74Å; D24-T27 PolarHBondContact OD1-OG1 3Å; D24-T27 VanDerWaalsContact OD2-CB 3.28Å; D24-T27 WeakPolarHBondContact OD2-CB 3.42Å; D24-T27 PolarHBondContact OD2-OG1 3.38Å; T27-E30 PolarHBondContact O-N 2.61Å; T27-I31 HydrophobicContact CG2-CD1 3.87Å; T27-I31 WeakPolarHBondContact O-CD1 3.33Å; T27-I31 VanDerWaalsContact O-CG1 3.23Å; T27-I31 WeakPolarHBondContact O-CG1 3.14Å; T27-I31 PolarHBondContact O-N 3.46Å; T27-I404 HydrophobicContact CG2-CG1 4.02Å
28	Q	89.4	Confident	80.5	Confident	132 Å²	132	67.1 Å²	67.1	62%	0.617	39%	0.387	S	S	*	.	H	α-helix	trans	-66.1	-40.5	178.1	-170.4	175.4	5	0	0	112.3	D24 E26 I31 Q32	D24-Q28 PolarHBondContact O-N 3.14Å; E26-Q28 VanDerWaalsContact C-N 3.29Å; E26-Q28 PolarHBondContact O-N 3.19Å; Q28-I31 PolarHBondContact O-N 3.38Å; Q28-Q32 WeakPolarHBondContact O-CB 3.25Å; Q28-Q32 PolarHBondContact O-N 3.03Å
29	A	92.1	Very high	83.4	Confident	48 Å²	48	66.7 Å²	66.7	40%	0.397	37%	0.374	S	S	.	.	H	α-helix	trans	-62.2	-45.8	175	0	0	0	0	0	111.5	P25 E26 I31 Q32 D33	P25-A29 WeakPolarHBondContact O-CB 3.16Å; P25-A29 PolarHBondContact O-N 3.43Å; E26-A29 PolarHBondContact O-N 2.87Å; A29-I31 VanDerWaalsContact C-N 3.32Å; A29-I31 PolarHBondContact O-N 2.91Å; A29-Q32 PolarHBondContact O-N 3.32Å; A29-Q32 VanDerWaalsContact O-N 3.13Å; A29-D33 PolarHBondContact O-N 3Å
30	E	93.1	Very high	86.2	Confident	47 Å²	47	65.2 Å²	65.2	22%	0.22	36%	0.361	C	S	.	.	H	α-helix	trans	-60.3	-40.2	178.1	-174.9	175.2	176	0	0	112.2	E26 T27 L34 R99 I404	E26-E30 PolarHBondContact O-N 3.44Å; T27-E30 PolarHBondContact O-N 2.61Å; E30-L34 WeakPolarHBondContact O-CB 3.41Å; E30-L34 PolarHBondContact O-N 3.39Å; E30-R99 IonicContact OE1-CZ 3.19Å; E30-R99 VanDerWaalsContact OE1-CZ 3.31Å; E30-R99 IonicContact OE1-NE 2.89Å; E30-R99 PolarHBondContact OE1-NE 2.97Å; E30-R99 IonicContact OE1-NH2 2.98Å; E30-R99 PolarHBondContact OE1-NH2 3.08Å; E30-I404 WeakPolarHBondContact OE2-CD1 3.29Å
31	I	94.1	Very high	88.4	Confident	12 Å²	12	61.9 Å²	61.9	6%	0.062	34%	0.343	C	S	.	.	H	α-helix	trans	-65.5	-43.5	175.4	-67.3	165.3	0	0	0	110.8	T27 Q28 A29 D33 L34 F35 C407 V408 E411	T27-I31 HydrophobicContact CG2-CD1 3.87Å; T27-I31 WeakPolarHBondContact O-CD1 3.33Å; T27-I31 VanDerWaalsContact O-CG1 3.23Å; T27-I31 WeakPolarHBondContact O-CG1 3.14Å; T27-I31 PolarHBondContact O-N 3.46Å; Q28-I31 PolarHBondContact O-N 3.38Å; A29-I31 VanDerWaalsContact C-N 3.32Å; A29-I31 PolarHBondContact O-N 2.91Å; I31-D33 PolarHBondContact O-N 3.07Å; I31-L34 WeakPolarHBondContact O-CB 2.91Å; I31-L34 PolarHBondContact O-N 3.32Å; I31-F35 HydrophobicContact CG2-CD2 4.08Å; I31-F35 HydrophobicContact CG2-CE2 4.09Å; I31-F35 WeakPolarHBondContact O-CD2 3.41Å; I31-F35 PolarHBondContact O-N 3.33Å; I31-C407 HydrophobicContact CD1-CB 3.39Å; I31-V408 HydrophobicContact CG1-CG2 3.9Å; I31-E411 HydrophobicContact CG2-CB 3.86Å; I31-E411 HydrophobicContact CG2-CG 3.69Å
32	Q	93.3	Very high	90.3	Very high	86 Å²	86	62.6 Å²	62.6	40%	0.402	34%	0.342	S	S	.	.	H	α-helix	trans	-64.3	-42.5	-180	-173.3	62.8	-0.9	0	0	111.4	Q28 A29 L34 F35 N36	Q28-Q32 WeakPolarHBondContact O-CB 3.25Å; Q28-Q32 PolarHBondContact O-N 3.03Å; A29-Q32 PolarHBondContact O-N 3.32Å; A29-Q32 VanDerWaalsContact O-N 3.13Å; Q32-L34 VanDerWaalsContact C-N 3.3Å; Q32-L34 PolarHBondContact O-N 3.22Å; Q32-F35 PolarHBondContact O-N 2.89Å; Q32-N36 WeakPolarHBondContact CG-ND2 3.16Å; Q32-N36 PolarHBondContact NE2-ND2 3.41Å; Q32-N36 WeakPolarHBondContact O-CB 3.13Å; Q32-N36 PolarHBondContact O-N 2.68Å; Q32-N36 VanDerWaalsContact O-N 3.15Å; Q32-N36 PolarHBondContact O-ND2 2.87Å
33	D	94.2	Very high	92	Very high	112 Å²	112	60.2 Å²	60.2	60%	0.599	32%	0.32	S	S	*	.	H	α-helix	trans	-62.1	-38.6	174.6	-71.7	-17.8	0	0	0	111.5	A29 I31 F35 N36 K37	A29-D33 PolarHBondContact O-N 3Å; I31-D33 PolarHBondContact O-N 3.07Å; D33-F35 VanDerWaalsContact C-N 3.29Å; D33-F35 PolarHBondContact O-N 3.42Å; D33-N36 PolarHBondContact O-N 3.39Å; D33-K37 WeakPolarHBondContact O-CG 3.21Å
34	L	95.5	Very high	93.1	Very high	19 Å²	19	60.2 Å²	60.2	10%	0.099	32%	0.319	C	S	.	.	H	α-helix	trans	-59.4	-38.1	179	-176.6	69	0	0	0	112.8	E30 I31 Q32 K37 R99 A311 V408	E30-L34 WeakPolarHBondContact O-CB 3.41Å; E30-L34 PolarHBondContact O-N 3.39Å; I31-L34 WeakPolarHBondContact O-CB 2.91Å; I31-L34 PolarHBondContact O-N 3.32Å; Q32-L34 VanDerWaalsContact C-N 3.3Å; Q32-L34 PolarHBondContact O-N 3.22Å; L34-K37 WeakPolarHBondContact O-CE 3.22Å; L34-K37 PolarHBondContact O-NZ 2.76Å; L34-K37 VanDerWaalsContact O-NZ 3.17Å; L34-R99 HydrophobicContact CD1-CB 4.48Å; L34-R99 HydrophobicContact CD2-CB 3.78Å; L34-A311 HydrophobicContact CD1-CB 4.42Å; L34-A311 HydrophobicContact CD2-CB 4.11Å; L34-A311 HydrophobicContact CG-CB 3.72Å; L34-V408 HydrophobicContact CD2-CG1 3.88Å; L34-V408 HydrophobicContact CD2-CG2 3.72Å
35	F	96.5	Very high	92.7	Very high	1 Å²	1	65 Å²	65	0%	0.004	35%	0.35	C	S	.	.	H	α-helix	trans	-91.9	-10.5	-178.2	-76	-72.8	0	0	0	114.6	I31 Q32 D33 E125 A311 V408 E411 Y412 F416	I31-F35 HydrophobicContact CG2-CD2 4.08Å; I31-F35 HydrophobicContact CG2-CE2 4.09Å; I31-F35 WeakPolarHBondContact O-CD2 3.41Å; I31-F35 PolarHBondContact O-N 3.33Å; Q32-F35 PolarHBondContact O-N 2.89Å; D33-F35 VanDerWaalsContact C-N 3.29Å; D33-F35 PolarHBondContact O-N 3.42Å; F35-E125 WeakPolarHBondContact CD1-OE1 3.48Å; F35-A311 HydrophobicContact CD1-CB 3.44Å; F35-A311 VanDerWaalsContact CD1-CB 3.44Å; F35-A311 HydrophobicContact CE1-CB 3.35Å; F35-A311 HydrophobicContact CE2-CB 4.47Å; F35-A311 HydrophobicContact CG-CB 4.05Å; F35-A311 HydrophobicContact CZ-CB 3.91Å; F35-V408 HydrophobicContact CE2-CG1 4.18Å; F35-V408 HydrophobicContact CZ-CG1 4.1Å; F35-E411 HydrophobicContact CD2-CG 3.86Å; F35-E411 HydrophobicContact CE2-CB 4.02Å; F35-E411 HydrophobicContact CE2-CG 3.6Å; F35-E411 HydrophobicContact CZ-CG 4.42Å; F35-Y412 AromaticContact CE1-CD2 3.82Å; F35-Y412 HydrophobicContact CE1-CD2 3.82Å; F35-Y412 HydrophobicContact CZ-CD2 4.07Å; F35-F416 HydrophobicContact CD1-CE2 4Å; F35-F416 HydrophobicContact CD1-CZ 4.03Å; F35-F416 AromaticContact CE1-CE2 3.72Å; F35-F416 HydrophobicContact CE1-CE2 3.72Å; F35-F416 HydrophobicContact CE1-CZ 4.23Å
36	N	95.3	Very high	91.9	Very high	57 Å²	57	62.5 Å²	62.5	31%	0.305	34%	0.344	S	S	.	.			trans	-108.4	25	-174.9	-68	-19.3	0	0	0	113.8	Q32 D33 V38 R415	Q32-N36 WeakPolarHBondContact CG-ND2 3.16Å; Q32-N36 PolarHBondContact NE2-ND2 3.41Å; Q32-N36 WeakPolarHBondContact O-CB 3.13Å; Q32-N36 PolarHBondContact O-N 2.68Å; Q32-N36 VanDerWaalsContact O-N 3.15Å; Q32-N36 PolarHBondContact O-ND2 2.87Å; D33-N36 PolarHBondContact O-N 3.39Å; N36-V38 PolarHBondContact O-N 3.39Å; N36-R415 PolarHBondContact OD1-NH2 2.91Å
37	K	97.6	Very high	91	Very high	13 Å²	13	63 Å²	63	6%	0.057	35%	0.346	C	S	.	.			trans	-77.1	65.4	177.3	-57.4	172.5	-52.6	-150.4	0	111.1	D33 L34 F308 K309 F375 L378	D33-K37 WeakPolarHBondContact O-CG 3.21Å; L34-K37 WeakPolarHBondContact O-CE 3.22Å; L34-K37 PolarHBondContact O-NZ 2.76Å; L34-K37 VanDerWaalsContact O-NZ 3.17Å; K37-F308 WeakPolarHBondContact O-CD2 3.35Å; K37-K309 HydrophobicContact CB-CB 4.09Å; K37-K309 WeakPolarHBondContact CE-O 2.95Å; K37-K309 PolarHBondContact O-N 2.84Å; K37-F375 HydrophobicContact CB-CE1 4.45Å; K37-L378 HydrophobicContact CB-CD1 4.29Å; K37-L378 HydrophobicContact CD-CD1 4.06Å; K37-L378 HydrophobicContact CG-CD1 3.98Å
38	V	97.8	Very high	90.8	Very high	47 Å²	47	67.1 Å²	67.1	29%	0.285	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	139.4	-179.7	64.9	0	0	0	0	110.4	N36 F130 V307 F308	N36-V38 PolarHBondContact O-N 3.39Å; V38-F130 HydrophobicContact CG2-CE1 4.21Å; V38-F130 HydrophobicContact CG2-CZ 3.82Å; V38-V307 WeakPolarHBondContact CA-O 3.05Å; V38-F308 HydrophobicContact CB-CD2 3.86Å; V38-F308 HydrophobicContact CG2-CB 4.44Å; V38-F308 HydrophobicContact CG2-CD2 4.32Å
39	K	98.3	Very high	90.9	Very high	82 Å²	82	61.8 Å²	61.8	36%	0.357	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	126.7	169.2	-67.3	-65.1	-177	179.8	0	108.9	S306 V307 L371 Y374 F375	K39-S306 CarbonylContact O-C 3.56Å; K39-S306 VanDerWaalsContact O-CA 3.3Å; K39-S306 WeakPolarHBondContact O-CA 3.26Å; K39-V307 PolarHBondContact N-O 3.39Å; K39-V307 PolarHBondContact O-N 2.92Å; K39-L371 HydrophobicContact CB-CB 4.42Å; K39-L371 HydrophobicContact CB-CD1 3.5Å; K39-L371 HydrophobicContact CB-CG 3.73Å; K39-L371 HydrophobicContact CG-CD1 4.49Å; K39-L371 HydrophobicContact CG-CG 4.2Å; K39-Y374 HydrophobicContact CD-CD1 4.17Å; K39-Y374 HydrophobicContact CD-CE1 4.44Å; K39-Y374 HydrophobicContact CD-CG 4.37Å; K39-Y374 VanDerWaalsContact CE-CD1 3.42Å; K39-Y374 VanDerWaalsContact CE-CD2 3.43Å; K39-Y374 HydrophobicContact CG-CD1 3.63Å; K39-Y374 HydrophobicContact CG-CE1 4.01Å; K39-Y374 HydrophobicContact CG-CG 4.22Å; K39-F375 HydrophobicContact CB-CE2 4.3Å; K39-F375 HydrophobicContact CG-CE2 4.17Å; K39-F375 HydrophobicContact CG-CZ 4.48Å
40	T	98.3	Very high	90.9	Very high	63 Å²	63	65.9 Å²	65.9	39%	0.387	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	132.4	-179.5	-58.4	0	0	0	0	108.9	S306	T40-S306 WeakPolarHBondContact CG2-OG 3.43Å; T40-S306 PolarHBondContact OG1-OG 3.47Å
41	F	98.1	Very high	91	Very high	9 Å²	9	65.4 Å²	65.4	4%	0.039	34%	0.344	C	S	.	.			trans	-69.3	132.6	173.5	-70.2	-85.2	0	0	0	110	W49 N299 V305 V307 F364 Q367 H368 L371	F41-W49 HydrophobicContact CB-CH2 4.28Å; F41-W49 HydrophobicContact CB-CZ3 4.05Å; F41-W49 HydrophobicContact CD1-CH2 4.41Å; F41-N299 WeakPolarHBondContact CB-OD1 3.42Å; F41-N299 VanDerWaalsContact CD2-ND2 3.33Å; F41-N299 WeakPolarHBondContact CD2-ND2 3.38Å; F41-V305 HydrophobicContact CD2-CB 4.27Å; F41-V305 HydrophobicContact CD2-CG1 4.11Å; F41-V305 HydrophobicContact CE2-CG1 4.41Å; F41-V305 PolarHBondContact N-O 2.98Å; F41-V307 HydrophobicContact CE2-CG2 4.15Å; F41-F364 HydrophobicContact CD1-CD2 4.13Å; F41-F364 AromaticContact CD1-CE2 3.89Å; F41-F364 HydrophobicContact CD1-CE2 3.89Å; F41-F364 HydrophobicContact CE1-CD2 4.13Å; F41-F364 AromaticContact CE1-CE2 3.58Å; F41-F364 HydrophobicContact CE1-CE2 3.58Å; F41-F364 HydrophobicContact CE1-CZ 4.16Å; F41-F364 HydrophobicContact CZ-CE2 4.08Å; F41-F364 HydrophobicContact CZ-CZ 4.42Å; F41-Q367 HydrophobicContact CD1-CB 4.15Å; F41-Q367 HydrophobicContact CE1-CB 4.45Å; F41-H368 HydrophobicContact CE1-CB 4.19Å; F41-H368 AromaticContact CZ-ND1 3.9Å; F41-L371 HydrophobicContact CE1-CD1 4.49Å; F41-L371 HydrophobicContact CE2-CD1 3.98Å; F41-L371 HydrophobicContact CZ-CD1 3.93Å
42	L	96.1	Very high	91	Very high	124 Å²	124	65.4 Å²	65.4	65%	0.649	35%	0.345	S	S	*	.			trans	-101.4	101.9	178	-59.5	-179.8	0	0	0	108.5	W49 Q367	L42-W49 WeakPolarHBondContact O-CH2 3.4Å; L42-Q367 PolarHBondContact O-NE2 2.94Å; L42-Q367 PolarHBondContact O-OE1 3.23Å
43	K	91.4	Very high	91	Very high	69 Å²	69	66 Å²	66	30%	0.3	35%	0.35	S	S	.	.			trans	-62.6	130.4	174.5	-56.1	-167.5	-171.8	-170.4	0	109.3	W49 N299 F302 R303	K43-W49 HydrophobicContact CB-CE3 4.22Å; K43-W49 HydrophobicContact CB-CZ3 4.41Å; K43-W49 HydrophobicContact CG-CE3 3.78Å; K43-W49 HydrophobicContact CG-CZ3 3.94Å; K43-N299 WeakPolarHBondContact CE-O 3.42Å; K43-N299 PolarHBondContact NZ-O 3.3Å; K43-F302 VanDerWaalsContact CE-O 3.24Å; K43-F302 WeakPolarHBondContact CE-O 3.2Å; K43-F302 PolarHBondContact NZ-O 2.97Å; K43-R303 WeakPolarHBondContact CE-O 3.1Å
44	P	87.2	Confident	91	Very high	41 Å²	41	62.4 Å²	62.4	27%	0.266	33%	0.333	S	S	.	.			trans	-61.9	154	178	24.9	-32.6	0	0	0	111	G46 E48 W49	P44-G46 VanDerWaalsContact C-N 3.26Å; P44-G46 PolarHBondContact O-N 3.46Å; P44-E48 HydrophobicContact CG-CB 3.85Å; P44-E48 VanDerWaalsContact CG-OE2 3.29Å; P44-E48 WeakPolarHBondContact CG-OE2 3.42Å; P44-W49 HydrophobicContact CG-CD2 4.5Å; P44-W49 HydrophobicContact CG-CG 4.38Å
45	V	75.5	Confident	90.9	Very high	164 Å²	164	64.3 Å²	64.3	99%	0.994	35%	0.348	S	S	*	.	S	Bend	trans	-74.4	83.8	177.1	-174	0	0	0	0	108.2
46	G	69.6	Low	90.7	Very high	57 Å²	57	66 Å²	66	59%	0.588	36%	0.359	S	S	*	.	S	Bend	trans	159.5	168.9	-175.6	0	0	0	0	0	111.1	P44 E48	P44-G46 VanDerWaalsContact C-N 3.26Å; P44-G46 PolarHBondContact O-N 3.46Å; G46-E48 PolarHBondContact O-N 3.34Å; G46-E48 VanDerWaalsContact O-N 3.14Å
47	E	69.8	Low	90.7	Very high	138 Å²	138	63.3 Å²	63.3	65%	0.645	34%	0.344	S	S	*	.	S	Bend	trans	-87.9	41.9	-179.6	-55.9	-177.9	129.3	0	0	112.2	R50	E47-R50 VanDerWaalsContact CB-CZ 3.42Å; E47-R50 VanDerWaalsContact CD-NH2 3.29Å; E47-R50 WeakPolarHBondContact O-CD 3.15Å; E47-R50 WeakPolarHBondContact O-CG 3.34Å; E47-R50 IonicContact OE1-CZ 3.53Å; E47-R50 IonicContact OE1-NH1 3.11Å; E47-R50 PolarHBondContact OE1-NH1 3.26Å; E47-R50 VanDerWaalsContact OE1-NH1 3.11Å; E47-R50 IonicContact OE2-CZ 3.36Å; E47-R50 IonicContact OE2-NH1 2.75Å; E47-R50 PolarHBondContact OE2-NH1 2.81Å; E47-R50 IonicContact OE2-NH2 3Å; E47-R50 PolarHBondContact OE2-NH2 3.1Å
48	E	82.8	Confident	90.6	Very high	88 Å²	88	63.2 Å²	63.2	41%	0.411	34%	0.344	S	S	.	.			trans	-74.3	-37.9	-177.7	-170.2	-173.8	163.3	0	0	112	P44 G46 P361 T363	P44-E48 HydrophobicContact CG-CB 3.85Å; P44-E48 VanDerWaalsContact CG-OE2 3.29Å; P44-E48 WeakPolarHBondContact CG-OE2 3.42Å; G46-E48 PolarHBondContact O-N 3.34Å; G46-E48 VanDerWaalsContact O-N 3.14Å; E48-P361 HydrophobicContact CG-CB 4.23Å; E48-P361 HydrophobicContact CG-CG 4.41Å; E48-T363 VanDerWaalsContact OE1-CG2 3.25Å; E48-T363 WeakPolarHBondContact OE1-CG2 3.01Å; E48-T363 PolarHBondContact OE1-OG1 2.96Å; E48-T363 PolarHBondContact OE2-OG1 2.76Å
49	W	93.3	Very high	90.3	Very high	21 Å²	21	66.7 Å²	66.7	8%	0.08	36%	0.355	C	S	.	.	S	Bend	trans	-95.8	102.8	-179.8	-62.8	7.2	0	0	0	109.1	F41 L42 K43 P44 Y296 N299 T363 F364	F41-W49 HydrophobicContact CB-CH2 4.28Å; F41-W49 HydrophobicContact CB-CZ3 4.05Å; F41-W49 HydrophobicContact CD1-CH2 4.41Å; L42-W49 WeakPolarHBondContact O-CH2 3.4Å; K43-W49 HydrophobicContact CB-CE3 4.22Å; K43-W49 HydrophobicContact CB-CZ3 4.41Å; K43-W49 HydrophobicContact CG-CE3 3.78Å; K43-W49 HydrophobicContact CG-CZ3 3.94Å; P44-W49 HydrophobicContact CG-CD2 4.5Å; P44-W49 HydrophobicContact CG-CG 4.38Å; W49-Y296 HydrophobicContact CB-CE2 4.23Å; W49-Y296 HydrophobicContact CG-CE2 4.23Å; W49-N299 HydrophobicContact CE3-CB 4.11Å; W49-N299 HydrophobicContact CZ3-CB 4.29Å; W49-T363 PolarHBondContact NE1-OG1 3.33Å; W49-F364 HydrophobicContact CD2-CB 4.34Å; W49-F364 HydrophobicContact CE3-CD2 4.39Å; W49-F364 HydrophobicContact CH2-CB 4.31Å; W49-F364 HydrophobicContact CH2-CD2 4.03Å; W49-F364 VanDerWaalsContact CZ2-CA 3.46Å; W49-F364 HydrophobicContact CZ2-CB 3.7Å; W49-F364 HydrophobicContact CZ2-CD2 4.28Å; W49-F364 HydrophobicContact CZ3-CD2 4.09Å
50	R	92.1	Very high	90.1	Very high	133 Å²	133	66.6 Å²	66.6	50%	0.502	36%	0.356	S	S	.	.			trans	-134.2	153.8	-176.6	-70.9	176.5	129.6	140.3	168.9	109.6	E47 P52 Y296 C300	E47-R50 VanDerWaalsContact CB-CZ 3.42Å; E47-R50 VanDerWaalsContact CD-NH2 3.29Å; E47-R50 WeakPolarHBondContact O-CD 3.15Å; E47-R50 WeakPolarHBondContact O-CG 3.34Å; E47-R50 IonicContact OE1-CZ 3.53Å; E47-R50 IonicContact OE1-NH1 3.11Å; E47-R50 PolarHBondContact OE1-NH1 3.26Å; E47-R50 VanDerWaalsContact OE1-NH1 3.11Å; E47-R50 IonicContact OE2-CZ 3.36Å; E47-R50 IonicContact OE2-NH1 2.75Å; E47-R50 PolarHBondContact OE2-NH1 2.81Å; E47-R50 IonicContact OE2-NH2 3Å; E47-R50 PolarHBondContact OE2-NH2 3.1Å; R50-P52 WeakPolarHBondContact O-CD 3.36Å; R50-P52 VanDerWaalsContact O-N 3.14Å; R50-Y296 PolarHBondContact N-OH 3.29Å; R50-Y296 PolarHBondContact O-OH 2.9Å; R50-Y296 VanDerWaalsContact O-OH 3.14Å; R50-C300 PolarHBondContact O-SG 2.82Å; R50-C300 VanDerWaalsContact O-SG 3.38Å
51	I	94.1	Very high	89.8	Confident	37 Å²	37	68.2 Å²	68.2	19%	0.19	37%	0.368	C	S	.	.	P	Polyproline II helix	trans	-56.9	119.8	173.9	-57	177.7	0	0	0	108.4	C300 E332 V333 L336	I51-C300 HydrophobicContact CG1-CB 3.65Å; I51-E332 HydrophobicContact CD1-CB 4.03Å; I51-V333 HydrophobicContact CD1-CB 3.74Å; I51-V333 HydrophobicContact CD1-CG2 4.17Å; I51-L336 HydrophobicContact CG2-CB 4.33Å; I51-L336 HydrophobicContact CG2-CD2 3.86Å
52	P	93.6	Very high	89.5	Confident	12 Å²	12	71 Å²	71	8%	0.078	39%	0.392	C	S	.	.	P	Polyproline II helix	trans	-60.3	156.4	178.3	-28.4	38	0	0	0	112.8	R50 P54 V56 Y296 F355 V359	R50-P52 WeakPolarHBondContact O-CD 3.36Å; R50-P52 VanDerWaalsContact O-N 3.14Å; P52-P54 WeakPolarHBondContact O-CD 3.33Å; P52-V56 HydrophobicContact CB-CG2 4.37Å; P52-Y296 HydrophobicContact CG-CD1 4.24Å; P52-Y296 HydrophobicContact CG-CE1 3.64Å; P52-F355 HydrophobicContact CB-CD1 3.7Å; P52-F355 HydrophobicContact CB-CE1 3.68Å; P52-F355 HydrophobicContact CB-CG 4.4Å; P52-F355 HydrophobicContact CB-CZ 4.33Å; P52-F355 HydrophobicContact CG-CD1 3.7Å; P52-F355 HydrophobicContact CG-CD2 4.16Å; P52-F355 HydrophobicContact CG-CE1 3.62Å; P52-F355 HydrophobicContact CG-CE2 4.07Å; P52-F355 HydrophobicContact CG-CG 3.99Å; P52-F355 HydrophobicContact CG-CZ 3.8Å; P52-V359 HydrophobicContact CB-CB 4.43Å; P52-V359 HydrophobicContact CB-CG2 3.99Å; P52-V359 HydrophobicContact CG-CG2 4.08Å
53	D	93.2	Very high	89.3	Confident	98 Å²	98	68.4 Å²	68.4	52%	0.524	38%	0.377	S	S	.	.	P	Polyproline II helix	trans	-56.1	123.1	176.5	-170	-58.2	0	0	0	110.3	S55 V56	D53-S55 VanDerWaalsContact CG-OG 3.29Å; D53-S55 PolarHBondContact O-N 2.89Å; D53-S55 WeakPolarHBondContact OD1-CA 3.45Å; D53-S55 WeakPolarHBondContact OD1-CB 3.17Å; D53-S55 PolarHBondContact OD1-N 3.18Å; D53-S55 PolarHBondContact OD1-OG 3.11Å; D53-V56 WeakPolarHBondContact O-CG2 3.21Å; D53-V56 PolarHBondContact O-N 3.03Å
54	P	94.1	Very high	89.4	Confident	37 Å²	37	71.2 Å²	71.2	24%	0.24	40%	0.395	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57	-20.8	-179.4	-21.2	27.9	0	0	0	113.8	P52 V56 P335 L336 K339	P52-P54 WeakPolarHBondContact O-CD 3.33Å; P54-V56 VanDerWaalsContact C-N 3.29Å; P54-V56 PolarHBondContact O-N 3.35Å; P54-P335 HydrophobicContact CB-CB 4.39Å; P54-P335 HydrophobicContact CG-CB 3.54Å; P54-L336 HydrophobicContact CG-CB 4.35Å; P54-K339 WeakPolarHBondContact O-CD 3.46Å; P54-K339 PolarHBondContact O-NZ 2.97Å
55	S	93.8	Very high	89.8	Confident	59 Å²	59	70.1 Å²	70.1	41%	0.413	39%	0.387	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.5	-25.5	176.7	72	0	0	0	0	112.9	D53 K59	D53-S55 VanDerWaalsContact CG-OG 3.29Å; D53-S55 PolarHBondContact O-N 2.89Å; D53-S55 WeakPolarHBondContact OD1-CA 3.45Å; D53-S55 WeakPolarHBondContact OD1-CB 3.17Å; D53-S55 PolarHBondContact OD1-N 3.18Å; D53-S55 PolarHBondContact OD1-OG 3.11Å; S55-K59 WeakPolarHBondContact O-CD 3.44Å; S55-K59 WeakPolarHBondContact O-CE 3.44Å; S55-K59 PolarHBondContact O-NZ 2.71Å
56	V	93.8	Very high	90.8	Very high	37 Å²	37	71.8 Å²	71.8	22%	0.224	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-19.6	178.3	-57.9	0	0	0	0	113.4	P52 D53 P54 P356 V359	P52-V56 HydrophobicContact CB-CG2 4.37Å; D53-V56 WeakPolarHBondContact O-CG2 3.21Å; D53-V56 PolarHBondContact O-N 3.03Å; P54-V56 VanDerWaalsContact C-N 3.29Å; P54-V56 PolarHBondContact O-N 3.35Å; V56-P356 HydrophobicContact CB-CG 4.49Å; V56-V359 HydrophobicContact CG2-CG1 4.22Å; V56-V359 HydrophobicContact CG2-CG2 4.32Å
57	A	94.9	Very high	92.1	Very high	0 Å²	0	72.4 Å²	72.4	0%	0	36%	0.362	C	S	.	.	S	Bend	trans	-68.3	145.7	-175.2	0	0	0	0	0	112.8	K59 L336 K339 L354 F355	A57-K59 PolarHBondContact O-N 2.98Å; A57-L336 HydrophobicContact CB-CD1 3.59Å; A57-K339 HydrophobicContact CB-CD 4.26Å; A57-K339 WeakPolarHBondContact O-CE 3.49Å; A57-K339 PolarHBondContact O-NZ 3.07Å; A57-L354 WeakPolarHBondContact CA-O 3.42Å; A57-L354 HydrophobicContact CB-CD1 4.38Å; A57-L354 WeakPolarHBondContact CB-O 3.25Å; A57-F355 HydrophobicContact CB-CD1 4.21Å; A57-F355 HydrophobicContact CB-CE1 4.18Å
58	L	94.3	Very high	93.4	Very high	11 Å²	11	65.9 Å²	65.9	6%	0.058	33%	0.332	C	S	.	.	S	Bend	trans	49.7	59.8	177.5	-54.2	173.9	0	0	0	111.9	N343 L348 E352 A353 L354	L58-N343 HydrophobicContact CD1-CB 3.75Å; L58-L348 HydrophobicContact CD1-CD1 4.13Å; L58-L348 HydrophobicContact CD2-CD1 4.43Å; L58-E352 HydrophobicContact CB-CB 4.31Å; L58-E352 WeakPolarHBondContact CD2-O 3.23Å; L58-A353 WeakPolarHBondContact CA-O 3.39Å; L58-A353 PolarHBondContact N-O 3.06Å; L58-L354 PolarHBondContact N-O 2.76Å
59	K	92.8	Very high	94.1	Very high	120 Å²	120	63.9 Å²	63.9	52%	0.522	32%	0.323	S	S	.	.			trans	-144.9	-22.9	178.2	-78.9	-167.8	174.9	170.7	0	114.2	S55 A57	S55-K59 WeakPolarHBondContact O-CD 3.44Å; S55-K59 WeakPolarHBondContact O-CE 3.44Å; S55-K59 PolarHBondContact O-NZ 2.71Å; A57-K59 PolarHBondContact O-N 2.98Å
60	H	92.6	Very high	94.4	Very high	81 Å²	81	67.6 Å²	67.6	38%	0.375	34%	0.341	S	S	.	.	S	Bend	trans	-112.8	151.4	-175.1	-63.7	-80.3	0	0	0	109	E352 A353 P356	H60-E352 CarbonylContact O-C 3.51Å; H60-E352 WeakPolarHBondContact O-CA 3.42Å; H60-A353 PolarHBondContact O-N 2.87Å; H60-P356 HydrophobicContact CB-CB 4.28Å
61	P	92.3	Very high	94.6	Very high	96 Å²	96	62.1 Å²	62.1	62%	0.623	32%	0.322	S	S	*	.			trans	-63.4	158.1	170.9	29.2	-35	0	0	0	110.6
62	A	91.6	Very high	94.8	Very high	67 Å²	67	61.5 Å²	61.5	55%	0.554	32%	0.317	S	S	*	.			trans	-60.5	142.2	168.7	0	0	0	0	0	110.8	H289	A62-H289 HydrophobicContact CB-CB 4.09Å
63	E	93.6	Very high	95	Very high	70 Å²	70	64 Å²	64	33%	0.327	34%	0.339	S	S	.	.			trans	-113.3	134.1	-178.8	-63	174.7	-128.2	0	0	111.1	H65 H289 S357	E63-H65 PolarHBondContact O-N 3.23Å; E63-H289 VanDerWaalsContact O-CB 3.3Å; E63-H289 WeakPolarHBondContact O-CB 3.32Å; E63-H289 PolarHBondContact O-ND1 3.37Å; E63-S357 PolarHBondContact OE1-N 3.47Å; E63-S357 PolarHBondContact OE1-OG 3.19Å; E63-S357 WeakPolarHBondContact OE2-CB 3.47Å; E63-S357 PolarHBondContact OE2-OG 2.96Å
64	D	92.7	Very high	95.2	Very high	128 Å²	128	61.8 Å²	61.8	68%	0.684	33%	0.331	S	S	*	.			trans	-77.9	121.3	178	-73.7	-17.4	0	0	0	111.7	R66 Q69	D64-R66 PolarHBondContact O-N 3.22Å; D64-Q69 HydrophobicContact CB-CG 4.13Å
65	H	94.8	Very high	95.4	Very high	19 Å²	19	60 Å²	60	9%	0.088	32%	0.32	C	S	.	.			trans	-84.2	105.1	169.9	-64.3	-79.1	0	0	0	109.1	E63 H67 L68 Q69 H289	E63-H65 PolarHBondContact O-N 3.23Å; H65-H67 VanDerWaalsContact C-N 3.35Å; H65-H67 PolarHBondContact O-N 3.15Å; H65-L68 HydrophobicContact CB-CB 3.97Å; H65-L68 HydrophobicContact CB-CD1 3.69Å; H65-L68 HydrophobicContact CB-CG 3.81Å; H65-L68 PolarHBondContact O-N 3.16Å; H65-Q69 PolarHBondContact O-N 3.37Å; H65-H289 AromaticContact CD2-ND1 3.71Å; H65-H289 AromaticContact NE2-CE1 3.72Å; H65-H289 AromaticContact NE2-ND1 3.06Å; H65-H289 PolarHBondContact NE2-ND1 3.1Å
66	R	96.3	Very high	95.5	Very high	198 Å²	198	58 Å²	58	75%	0.747	30%	0.304	S	S	*	.	H	α-helix	trans	-48.4	-50.7	-171.5	-179.1	-179.3	171.2	174.6	1.9	113.7	D64 L68 Q69 E70	D64-R66 PolarHBondContact O-N 3.22Å; R66-L68 PolarHBondContact O-N 2.97Å; R66-Q69 PolarHBondContact O-N 3.4Å; R66-E70 WeakPolarHBondContact CG-OE1 3.41Å; R66-E70 IonicContact CZ-OE1 3Å; R66-E70 IonicContact NE-OE1 3.76Å; R66-E70 PolarHBondContact NE-OE1 3.21Å; R66-E70 IonicContact NH2-OE1 2.63Å; R66-E70 WeakPolarHBondContact O-CG 3.34Å; R66-E70 PolarHBondContact O-N 3.44Å
67	H	97	Very high	95.6	Very high	70 Å²	70	59 Å²	59	32%	0.324	32%	0.317	S	S	.	.	H	α-helix	trans	-62.8	-41.5	-179.1	-176.7	63.4	0	0	0	112.1	H65 Q69 E70 L71 S373	H65-H67 VanDerWaalsContact C-N 3.35Å; H65-H67 PolarHBondContact O-N 3.15Å; H67-Q69 PolarHBondContact O-N 3.49Å; H67-E70 PolarHBondContact O-N 3.41Å; H67-L71 WeakPolarHBondContact O-CG 3.5Å; H67-L71 PolarHBondContact O-N 3.47Å; H67-S373 PolarHBondContact NE2-OG 2.95Å
68	L	98.1	Very high	95.7	Very high	1 Å²	1	60 Å²	60	1%	0.005	32%	0.323	C	S	.	.	H	α-helix	trans	-65.9	-38	177.6	-58.3	-176.2	0	0	0	112	H65 R66 L71 K72 Y287 V292 E369 C372	H65-L68 HydrophobicContact CB-CB 3.97Å; H65-L68 HydrophobicContact CB-CD1 3.69Å; H65-L68 HydrophobicContact CB-CG 3.81Å; H65-L68 PolarHBondContact O-N 3.16Å; R66-L68 PolarHBondContact O-N 2.97Å; L68-L71 HydrophobicContact CD2-CD1 4.37Å; L68-L71 WeakPolarHBondContact O-CB 3.01Å; L68-L71 PolarHBondContact O-N 3.38Å; L68-K72 PolarHBondContact O-N 3.02Å; L68-Y287 WeakPolarHBondContact CB-O 3.49Å; L68-Y287 HydrophobicContact CD2-CD1 4.43Å; L68-V292 HydrophobicContact CD1-CG2 3.66Å; L68-E369 HydrophobicContact CD2-CG 3.93Å; L68-E369 HydrophobicContact CG-CG 4.39Å; L68-C372 HydrophobicContact CD2-CB 3.86Å
69	Q	97.7	Very high	95.7	Very high	47 Å²	47	61.2 Å²	61.2	22%	0.22	33%	0.327	C	S	.	.	H	α-helix	trans	-68.7	-34.2	175.6	-64.8	-57.5	-30.1	0	0	112.2	D64 H65 R66 H67 K72 A73	D64-Q69 HydrophobicContact CB-CG 4.13Å; H65-Q69 PolarHBondContact O-N 3.37Å; R66-Q69 PolarHBondContact O-N 3.4Å; H67-Q69 PolarHBondContact O-N 3.49Å; Q69-K72 PolarHBondContact O-N 3.49Å; Q69-A73 WeakPolarHBondContact O-CB 3.39Å; Q69-A73 PolarHBondContact O-N 2.88Å
70	E	98.2	Very high	95.7	Very high	99 Å²	99	59 Å²	59	46%	0.463	32%	0.322	S	S	.	.	H	α-helix	trans	-63.3	-40.6	170.8	-71.4	172.1	-170.6	0	0	111.3	R66 H67 S74	R66-E70 WeakPolarHBondContact CG-OE1 3.41Å; R66-E70 IonicContact CZ-OE1 3Å; R66-E70 IonicContact NE-OE1 3.76Å; R66-E70 PolarHBondContact NE-OE1 3.21Å; R66-E70 IonicContact NH2-OE1 2.63Å; R66-E70 WeakPolarHBondContact O-CG 3.34Å; R66-E70 PolarHBondContact O-N 3.44Å; H67-E70 PolarHBondContact O-N 3.41Å; E70-S74 WeakPolarHBondContact O-CB 3.24Å; E70-S74 PolarHBondContact O-N 3.41Å
71	L	98.2	Very high	95.7	Very high	18 Å²	18	60.6 Å²	60.6	9%	0.094	33%	0.329	C	S	.	.	H	α-helix	trans	-64.1	-42.8	172.5	-66.3	176.6	0	0	0	112.4	H67 L68 S74 L75 Y287 C372 H376	H67-L71 WeakPolarHBondContact O-CG 3.5Å; H67-L71 PolarHBondContact O-N 3.47Å; L68-L71 HydrophobicContact CD2-CD1 4.37Å; L68-L71 WeakPolarHBondContact O-CB 3.01Å; L68-L71 PolarHBondContact O-N 3.38Å; L71-S74 PolarHBondContact O-N 2.97Å; L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 PolarHBondContact O-N 2.96Å; L71-Y287 HydrophobicContact CB-CD1 4.4Å; L71-Y287 HydrophobicContact CB-CE1 4.05Å; L71-Y287 HydrophobicContact CB-CE2 4.42Å; L71-Y287 HydrophobicContact CD1-CE1 4.16Å; L71-C372 HydrophobicContact CD1-CB 3.91Å; L71-H376 HydrophobicContact CD2-CB 4.29Å
72	K	97.5	Very high	95.7	Very high	24 Å²	24	58 Å²	58	10%	0.104	31%	0.31	C	S	.	.	H	α-helix	trans	-57.3	-52.5	175.5	-175.3	-179.2	177.6	-179.5	0	110.8	L68 Q69 S74 L75 N76 E253 Y287 E288	L68-K72 PolarHBondContact O-N 3.02Å; Q69-K72 PolarHBondContact O-N 3.49Å; K72-S74 VanDerWaalsContact C-N 3.34Å; K72-S74 PolarHBondContact O-N 3.44Å; K72-L75 PolarHBondContact O-N 2.91Å; K72-N76 WeakPolarHBondContact O-CB 3.45Å; K72-N76 PolarHBondContact O-N 3.3Å; K72-E253 WeakPolarHBondContact CE-OE1 3.27Å; K72-E253 VanDerWaalsContact NZ-CD 3.31Å; K72-E253 IonicContact NZ-OE1 3.89Å; K72-E253 PolarHBondContact NZ-OE1 3.24Å; K72-E253 VanDerWaalsContact NZ-OE1 3.11Å; K72-E253 IonicContact NZ-OE2 3.82Å; K72-E253 PolarHBondContact NZ-OE2 3.41Å; K72-Y287 HydrophobicContact CB-CD2 3.66Å; K72-Y287 HydrophobicContact CB-CE2 4.36Å; K72-Y287 HydrophobicContact CB-CG 4.35Å; K72-Y287 HydrophobicContact CG-CD2 4.22Å; K72-E288 WeakPolarHBondContact CE-OE1 3.34Å; K72-E288 IonicContact NZ-OE1 3.91Å; K72-E288 PolarHBondContact NZ-OE1 3.16Å
73	A	97.6	Very high	95.5	Very high	65 Å²	65	55.7 Å²	55.7	54%	0.537	29%	0.29	S	S	.	.	H	α-helix	trans	-59.7	-44.1	179.2	0	0	0	0	0	111.9	Q69 A77	Q69-A73 WeakPolarHBondContact O-CB 3.39Å; Q69-A73 PolarHBondContact O-N 2.88Å; A73-A77 WeakPolarHBondContact O-CB 3.13Å; A73-A77 PolarHBondContact O-N 3.11Å
74	S	97.9	Very high	95.3	Very high	51 Å²	51	57.7 Å²	57.7	36%	0.357	30%	0.302	S	S	.	.	H	α-helix	trans	-60.1	-49.1	176.5	174.6	0	0	0	0	112.3	E70 L71 K72 A77 V78 H376	E70-S74 WeakPolarHBondContact O-CB 3.24Å; E70-S74 PolarHBondContact O-N 3.41Å; L71-S74 PolarHBondContact O-N 2.97Å; K72-S74 VanDerWaalsContact C-N 3.34Å; K72-S74 PolarHBondContact O-N 3.44Å; S74-A77 WeakPolarHBondContact O-CB 3.45Å; S74-A77 PolarHBondContact O-N 3.26Å; S74-V78 PolarHBondContact O-N 3.06Å; S74-H376 PolarHBondContact OG-NE2 2.84Å; S74-H376 VanDerWaalsContact OG-NE2 3.09Å
75	L	97.2	Very high	95.1	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	28%	0.284	C	S	.	.	H	α-helix	trans	-65.9	-42.4	-178.9	179.6	61.9	0	0	0	111.9	L71 K72 A77 V78 K79 T285 Y287 Q379 V380	L71-L75 WeakPolarHBondContact O-CB 3.46Å; L71-L75 PolarHBondContact O-N 2.96Å; K72-L75 PolarHBondContact O-N 2.91Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 3.33Å; L75-V78 PolarHBondContact O-N 2.88Å; L75-V78 VanDerWaalsContact O-N 3.14Å; L75-K79 HydrophobicContact CG-CD 4.24Å; L75-K79 HydrophobicContact CG-CG 4.5Å; L75-K79 WeakPolarHBondContact O-CG 3.33Å; L75-K79 PolarHBondContact O-N 3.37Å; L75-T285 HydrophobicContact CD2-CG2 3.73Å; L75-Y287 HydrophobicContact CD2-CE2 4.09Å; L75-Q379 HydrophobicContact CD1-CB 4.29Å; L75-Q379 HydrophobicContact CD1-CG 3.97Å; L75-V380 HydrophobicContact CD1-CG2 4.01Å
76	N	96	Very high	94.8	Very high	16 Å²	16	56.7 Å²	56.7	9%	0.086	30%	0.295	C	S	.	.	H	α-helix	trans	-65.4	-36.7	178.1	-71.5	-8	0	0	0	111.1	K72 V78 K79 N80 D252	K72-N76 WeakPolarHBondContact O-CB 3.45Å; K72-N76 PolarHBondContact O-N 3.3Å; N76-V78 VanDerWaalsContact C-N 3.26Å; N76-V78 PolarHBondContact O-N 3.17Å; N76-K79 PolarHBondContact O-N 3.45Å; N76-N80 VanDerWaalsContact O-CB 3.28Å; N76-N80 WeakPolarHBondContact O-CB 3.3Å; N76-N80 PolarHBondContact O-N 3.45Å; N76-N80 PolarHBondContact O-ND2 3.45Å; N76-N80 VanDerWaalsContact O-ND2 3.13Å; N76-D252 WeakPolarHBondContact ND2-CB 3.44Å; N76-D252 PolarHBondContact ND2-O 2.98Å
77	A	96.9	Very high	94.3	Very high	58 Å²	58	48.4 Å²	48.4	48%	0.479	27%	0.265	S	S	.	.	H	α-helix	trans	-58.8	-36.6	171.9	0	0	0	0	0	112.9	A73 S74 L75	A73-A77 WeakPolarHBondContact O-CB 3.13Å; A73-A77 PolarHBondContact O-N 3.11Å; S74-A77 WeakPolarHBondContact O-CB 3.45Å; S74-A77 PolarHBondContact O-N 3.26Å; L75-A77 VanDerWaalsContact C-N 3.32Å; L75-A77 PolarHBondContact O-N 3.33Å
78	V	96.3	Very high	93.8	Very high	22 Å²	22	49.5 Å²	49.5	13%	0.133	27%	0.27	C	S	.	.	H	α-helix	trans	-73.5	-45	175.3	176	0	0	0	0	111.5	S74 L75 N76 N80 Q81 V380 I383	S74-V78 PolarHBondContact O-N 3.06Å; L75-V78 PolarHBondContact O-N 2.88Å; L75-V78 VanDerWaalsContact O-N 3.14Å; N76-V78 VanDerWaalsContact C-N 3.26Å; N76-V78 PolarHBondContact O-N 3.17Å; V78-N80 VanDerWaalsContact C-N 3.27Å; V78-N80 PolarHBondContact O-N 3.02Å; V78-Q81 WeakPolarHBondContact O-CB 3.41Å; V78-Q81 PolarHBondContact O-N 3.47Å; V78-V380 HydrophobicContact CG2-CG1 4.13Å; V78-V380 HydrophobicContact CG2-CG2 4.2Å; V78-I383 HydrophobicContact CG1-CB 3.85Å; V78-I383 HydrophobicContact CG1-CD1 4.21Å; V78-I383 HydrophobicContact CG1-CG2 3.62Å
79	K	93.9	Very high	93.5	Very high	35 Å²	35	52.9 Å²	52.9	15%	0.152	29%	0.29	C	S	.	.	H	α-helix	trans	-60	-37.3	176.5	-72.5	173.4	176.3	172.8	0	112	L75 N76 Q81 L82 S318 I383	L75-K79 HydrophobicContact CG-CD 4.24Å; L75-K79 HydrophobicContact CG-CG 4.5Å; L75-K79 WeakPolarHBondContact O-CG 3.33Å; L75-K79 PolarHBondContact O-N 3.37Å; N76-K79 PolarHBondContact O-N 3.45Å; K79-Q81 PolarHBondContact O-N 3.02Å; K79-Q81 VanDerWaalsContact O-N 3.16Å; K79-L82 WeakPolarHBondContact O-CB 3.42Å; K79-L82 VanDerWaalsContact O-CG 3.32Å; K79-L82 WeakPolarHBondContact O-CG 3.38Å; K79-L82 PolarHBondContact O-N 3.23Å; K79-S318 WeakPolarHBondContact CE-OG 3.27Å; K79-S318 PolarHBondContact NZ-OG 3.39Å; K79-I383 HydrophobicContact CG-CD1 4.15Å
80	N	93.1	Very high	93.2	Very high	75 Å²	75	51.8 Å²	51.8	40%	0.401	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	-63.5	-20.3	-179.4	-79.2	-30.2	0	0	0	113.8	N76 V78 L82 S83	N76-N80 VanDerWaalsContact O-CB 3.28Å; N76-N80 WeakPolarHBondContact O-CB 3.3Å; N76-N80 PolarHBondContact O-N 3.45Å; N76-N80 PolarHBondContact O-ND2 3.45Å; N76-N80 VanDerWaalsContact O-ND2 3.13Å; V78-N80 VanDerWaalsContact C-N 3.27Å; V78-N80 PolarHBondContact O-N 3.02Å; N80-L82 PolarHBondContact O-N 2.99Å; N80-S83 WeakPolarHBondContact O-CB 2.63Å; N80-S83 PolarHBondContact O-N 3.2Å; N80-S83 PolarHBondContact O-OG 3.01Å
81	Q	93.8	Very high	92.8	Very high	114 Å²	114	50 Å²	50	53%	0.533	28%	0.276	S	S	.	.	G	3₁₀ helix	trans	-67.2	-12.4	171.1	-58.9	177.5	38.3	0	0	113	V78 K79 L387	V78-Q81 WeakPolarHBondContact O-CB 3.41Å; V78-Q81 PolarHBondContact O-N 3.47Å; K79-Q81 PolarHBondContact O-N 3.02Å; K79-Q81 VanDerWaalsContact O-N 3.16Å; Q81-L387 HydrophobicContact CB-CD1 4.06Å
82	L	91.1	Very high	92.4	Very high	42 Å²	42	56.1 Å²	56.1	22%	0.22	30%	0.304	C	S	.	.	G	3₁₀ helix	trans	-90.9	-10.7	178.4	-51.1	-178	0	0	0	113	K79 N80 D84 K85 W90 I383 L387	K79-L82 WeakPolarHBondContact O-CB 3.42Å; K79-L82 VanDerWaalsContact O-CG 3.32Å; K79-L82 WeakPolarHBondContact O-CG 3.38Å; K79-L82 PolarHBondContact O-N 3.23Å; N80-L82 PolarHBondContact O-N 2.99Å; L82-D84 VanDerWaalsContact C-N 3.26Å; L82-D84 PolarHBondContact O-N 3.3Å; L82-K85 WeakPolarHBondContact O-CB 3.47Å; L82-K85 PolarHBondContact O-N 2.96Å; L82-W90 HydrophobicContact CD1-CZ2 4.27Å; L82-W90 HydrophobicContact CD2-CH2 3.76Å; L82-W90 HydrophobicContact CD2-CZ2 3.37Å; L82-W90 HydrophobicContact CD2-CZ3 4.49Å; L82-W90 HydrophobicContact CG-CZ2 4.45Å; L82-I383 HydrophobicContact CD1-CG2 4.15Å; L82-I383 HydrophobicContact CD2-CG2 4.14Å; L82-I383 HydrophobicContact CG-CG2 4.34Å; L82-L387 HydrophobicContact CD2-CD1 4.33Å; L82-L387 HydrophobicContact CD2-CD2 3.76Å; L82-L387 HydrophobicContact CD2-CG 4.08Å
83	S	88.7	Confident	92.2	Very high	18 Å²	18	56.1 Å²	56.1	13%	0.126	30%	0.304	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60	-32.8	-169.5	-59.7	0	0	0	0	113.9	N80 S453 F454 N455	N80-S83 WeakPolarHBondContact O-CB 2.63Å; N80-S83 PolarHBondContact O-N 3.2Å; N80-S83 PolarHBondContact O-OG 3.01Å; S83-S453 WeakPolarHBondContact O-CB 3.49Å; S83-F454 WeakPolarHBondContact O-CB 3.48Å; S83-F454 PolarHBondContact O-N 3.37Å; S83-N455 PolarHBondContact O-N 3.37Å
84	D	89.1	Confident	92	Very high	112 Å²	112	54.2 Å²	54.2	60%	0.599	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.4	179	-62.9	-51.8	0	0	0	113.7	L82 N86 S453 N455	L82-D84 VanDerWaalsContact C-N 3.26Å; L82-D84 PolarHBondContact O-N 3.3Å; D84-N86 PolarHBondContact O-N 3.23Å; D84-S453 WeakPolarHBondContact O-CB 3.42Å; D84-N455 PolarHBondContact OD1-ND2 3.04Å
85	K	88.3	Confident	91.7	Very high	69 Å²	69	55.5 Å²	55.5	30%	0.3	29%	0.289	S	S	.	.	S	Bend	trans	-77.3	128.5	178.4	-57.2	-56.8	-176.7	-160.3	0	109.4	L82 I87 W90 F390 S453	L82-K85 WeakPolarHBondContact O-CB 3.47Å; L82-K85 PolarHBondContact O-N 2.96Å; K85-I87 PolarHBondContact O-N 2.81Å; K85-I87 VanDerWaalsContact O-N 3.14Å; K85-W90 HydrophobicContact CB-CB 4.11Å; K85-W90 HydrophobicContact CB-CD2 4.43Å; K85-W90 HydrophobicContact CB-CE3 4.43Å; K85-W90 HydrophobicContact CB-CG 4.31Å; K85-W90 HydrophobicContact CG-CE3 4.19Å; K85-F390 HydrophobicContact CD-CD1 4.45Å; K85-F390 HydrophobicContact CD-CE1 4.03Å; K85-S453 WeakPolarHBondContact O-CA 3.31Å
86	N	88.8	Confident	91.4	Very high	57 Å²	57	58.5 Å²	58.5	31%	0.305	31%	0.31	S	S	.	.			trans	-57.4	121.1	169.4	-178.7	-66.3	0	0	0	109.3	D84 Q88 V89 W90 G452	D84-N86 PolarHBondContact O-N 3.23Å; N86-Q88 PolarHBondContact O-N 2.77Å; N86-Q88 WeakPolarHBondContact OD1-CB 3.27Å; N86-Q88 PolarHBondContact OD1-N 3.47Å; N86-V89 HydrophobicContact CB-CB 4.35Å; N86-V89 HydrophobicContact CB-CG2 4.16Å; N86-V89 PolarHBondContact O-N 3.41Å; N86-V89 PolarHBondContact OD1-N 3.23Å; N86-W90 VanDerWaalsContact O-CB 3.31Å; N86-W90 WeakPolarHBondContact O-CB 3.49Å; N86-W90 PolarHBondContact O-N 2.98Å; N86-G452 WeakPolarHBondContact ND2-CA 3.39Å
87	I	85.9	Confident	91.3	Very high	24 Å²	24	57.8 Å²	57.8	12%	0.123	31%	0.306	C	S	.	.	H	α-helix	trans	-61.8	-31.9	-170	-166.4	170.5	0	0	0	112.8	K85 H91 Q450 G452	K85-I87 PolarHBondContact O-N 2.81Å; K85-I87 VanDerWaalsContact O-N 3.14Å; I87-H91 VanDerWaalsContact CG1-CE1 3.5Å; I87-H91 WeakPolarHBondContact CG1-CE1 3.4Å; I87-H91 WeakPolarHBondContact O-CB 3.27Å; I87-H91 PolarHBondContact O-N 2.99Å; I87-Q450 HydrophobicContact CD1-CB 4.14Å; I87-Q450 VanDerWaalsContact CD1-OE1 3.27Å; I87-Q450 HydrophobicContact CG2-CB 3.88Å; I87-Q450 WeakPolarHBondContact CG2-O 3.32Å; I87-G452 WeakPolarHBondContact CG2-O 3.36Å; I87-G452 PolarHBondContact N-O 3.14Å
88	Q	86.4	Confident	91.2	Very high	92 Å²	92	56.3 Å²	56.3	43%	0.43	29%	0.29	S	S	.	.	H	α-helix	trans	-72.8	-47.3	-178.7	-62.1	-178.9	-16.8	0	0	111	N86 W90 H91 Q92 Q450 T451	N86-Q88 PolarHBondContact O-N 2.77Å; N86-Q88 WeakPolarHBondContact OD1-CB 3.27Å; N86-Q88 PolarHBondContact OD1-N 3.47Å; Q88-W90 VanDerWaalsContact C-N 3.34Å; Q88-H91 PolarHBondContact O-N 2.85Å; Q88-Q92 WeakPolarHBondContact O-CB 3.44Å; Q88-Q92 PolarHBondContact O-N 3.34Å; Q88-Q450 WeakPolarHBondContact CG-O 3.13Å; Q88-Q450 PolarHBondContact NE2-O 2.82Å; Q88-T451 VanDerWaalsContact NE2-CG2 3.28Å
89	V	90.3	Very high	91.2	Very high	72 Å²	72	57.4 Å²	57.4	44%	0.436	29%	0.292	S	S	.	.	H	α-helix	trans	-64.5	-43.3	177.4	-176	0	0	0	0	110	N86 Q92 H93 F390	N86-V89 HydrophobicContact CB-CB 4.35Å; N86-V89 HydrophobicContact CB-CG2 4.16Å; N86-V89 PolarHBondContact O-N 3.41Å; N86-V89 PolarHBondContact OD1-N 3.23Å; V89-Q92 PolarHBondContact O-N 3.25Å; V89-H93 WeakPolarHBondContact O-CB 3.38Å; V89-H93 PolarHBondContact O-N 2.98Å; V89-F390 HydrophobicContact CG1-CE2 3.99Å; V89-F390 HydrophobicContact CG1-CZ 4.02Å
90	W	91.4	Very high	91.3	Very high	25 Å²	25	55.9 Å²	55.9	10%	0.095	29%	0.286	C	S	.	.	H	α-helix	trans	-64.3	-42.6	176.6	-176.1	-110.9	0	0	0	112.7	L82 K85 N86 Q88 H93 T94 N386 L387 F390	L82-W90 HydrophobicContact CD1-CZ2 4.27Å; L82-W90 HydrophobicContact CD2-CH2 3.76Å; L82-W90 HydrophobicContact CD2-CZ2 3.37Å; L82-W90 HydrophobicContact CD2-CZ3 4.49Å; L82-W90 HydrophobicContact CG-CZ2 4.45Å; K85-W90 HydrophobicContact CB-CB 4.11Å; K85-W90 HydrophobicContact CB-CD2 4.43Å; K85-W90 HydrophobicContact CB-CE3 4.43Å; K85-W90 HydrophobicContact CB-CG 4.31Å; K85-W90 HydrophobicContact CG-CE3 4.19Å; N86-W90 VanDerWaalsContact O-CB 3.31Å; N86-W90 WeakPolarHBondContact O-CB 3.49Å; N86-W90 PolarHBondContact O-N 2.98Å; Q88-W90 VanDerWaalsContact C-N 3.34Å; W90-H93 AromaticContact CZ3-CD2 3.94Å; W90-H93 PolarHBondContact O-N 3.35Å; W90-T94 HydrophobicContact CD2-CG2 4.09Å; W90-T94 HydrophobicContact CG-CG2 4.47Å; W90-T94 HydrophobicContact CH2-CG2 4.46Å; W90-T94 HydrophobicContact CZ2-CG2 3.76Å; W90-T94 WeakPolarHBondContact O-CB 3.48Å; W90-T94 WeakPolarHBondContact O-CG2 3.43Å; W90-T94 PolarHBondContact O-N 2.9Å; W90-T94 PolarHBondContact O-OG1 3.48Å; W90-N386 HydrophobicContact CH2-CB 3.78Å; W90-N386 HydrophobicContact CZ2-CB 4.05Å; W90-L387 HydrophobicContact CH2-CD2 3.92Å; W90-L387 HydrophobicContact CH2-CG 4.04Å; W90-L387 HydrophobicContact CZ3-CD2 4.19Å; W90-F390 AromaticContact CE3-CD2 3.79Å; W90-F390 HydrophobicContact CE3-CD2 3.79Å; W90-F390 HydrophobicContact CE3-CE2 4.05Å; W90-F390 HydrophobicContact CE3-CG 4.09Å; W90-F390 HydrophobicContact CZ3-CB 3.83Å; W90-F390 HydrophobicContact CZ3-CD1 4.42Å; W90-F390 AromaticContact CZ3-CD2 3.89Å; W90-F390 HydrophobicContact CZ3-CD2 3.89Å; W90-F390 AromaticContact CZ3-CG 3.79Å; W90-F390 HydrophobicContact CZ3-CG 3.79Å
91	H	90.4	Very high	91.3	Very high	62 Å²	62	53.8 Å²	53.8	29%	0.287	28%	0.282	S	S	.	.	H	α-helix	trans	-64.6	-41	174.3	-77.9	-179	0	0	0	112	I87 Q88 H93 T94 N95	I87-H91 VanDerWaalsContact CG1-CE1 3.5Å; I87-H91 WeakPolarHBondContact CG1-CE1 3.4Å; I87-H91 WeakPolarHBondContact O-CB 3.27Å; I87-H91 PolarHBondContact O-N 2.99Å; Q88-H91 PolarHBondContact O-N 2.85Å; H91-H93 VanDerWaalsContact C-N 3.33Å; H91-H93 PolarHBondContact O-N 3.02Å; H91-T94 WeakPolarHBondContact CA-OG1 3.26Å; H91-T94 PolarHBondContact O-OG1 3.38Å; H91-N95 WeakPolarHBondContact O-CB 3.49Å; H91-N95 PolarHBondContact O-N 2.85Å; H91-N95 PolarHBondContact O-ND2 3.23Å; H91-N95 VanDerWaalsContact O-ND2 3.07Å
92	Q	90.4	Very high	91.4	Very high	146 Å²	146	50.5 Å²	50.5	68%	0.682	27%	0.266	S	S	*	.	H	α-helix	trans	-59.6	-46.7	174.6	-176.4	179.4	2.6	0	0	111	Q88 V89 N95 S96	Q88-Q92 WeakPolarHBondContact O-CB 3.44Å; Q88-Q92 PolarHBondContact O-N 3.34Å; V89-Q92 PolarHBondContact O-N 3.25Å; Q92-N95 PolarHBondContact O-N 3.03Å; Q92-S96 PolarHBondContact O-N 3.36Å; Q92-S96 VanDerWaalsContact O-N 3.07Å
93	H	93.1	Very high	91.7	Very high	23 Å²	23	48.6 Å²	48.6	11%	0.106	26%	0.256	C	S	.	.	H	α-helix	trans	-59	-57.9	175.9	175.8	67.7	0	0	0	112	V89 W90 H91 N95 S96 T97 N386 F390	V89-H93 WeakPolarHBondContact O-CB 3.38Å; V89-H93 PolarHBondContact O-N 2.98Å; W90-H93 AromaticContact CZ3-CD2 3.94Å; W90-H93 PolarHBondContact O-N 3.35Å; H91-H93 VanDerWaalsContact C-N 3.33Å; H91-H93 PolarHBondContact O-N 3.02Å; H93-N95 PolarHBondContact O-N 3.44Å; H93-S96 WeakPolarHBondContact O-CA 3.33Å; H93-S96 WeakPolarHBondContact O-CB 3.33Å; H93-S96 PolarHBondContact O-N 2.69Å; H93-S96 PolarHBondContact O-OG 2.85Å; H93-T97 PolarHBondContact O-N 2.9Å; H93-T97 PolarHBondContact O-OG1 3.19Å; H93-N386 PolarHBondContact NE2-O 3.09Å; H93-F390 HydrophobicContact CB-CD2 3.82Å; H93-F390 HydrophobicContact CB-CE2 4.07Å; H93-F390 AromaticContact CD2-CD2 3.59Å; H93-F390 PolarHBondContact CE1-N 2.68Å; H93-F390 AromaticContact CG-CD2 3.57Å; H93-F390 PolarHBondContact NE2-N 2.89Å
94	T	93.4	Very high	92	Very high	25 Å²	25	49.8 Å²	49.8	15%	0.153	26%	0.261	C	S	.	.	H	α-helix	trans	-63	-29.5	-178.1	52	0	0	0	0	113.1	W90 H91 T97 N98 N386	W90-T94 HydrophobicContact CD2-CG2 4.09Å; W90-T94 HydrophobicContact CG-CG2 4.47Å; W90-T94 HydrophobicContact CH2-CG2 4.46Å; W90-T94 HydrophobicContact CZ2-CG2 3.76Å; W90-T94 WeakPolarHBondContact O-CB 3.48Å; W90-T94 WeakPolarHBondContact O-CG2 3.43Å; W90-T94 PolarHBondContact O-N 2.9Å; W90-T94 PolarHBondContact O-OG1 3.48Å; H91-T94 WeakPolarHBondContact CA-OG1 3.26Å; H91-T94 PolarHBondContact O-OG1 3.38Å; T94-T97 WeakPolarHBondContact CA-OG1 3.09Å; T94-T97 PolarHBondContact O-OG1 3.39Å; T94-N98 VanDerWaalsContact O-CB 3.28Å; T94-N98 WeakPolarHBondContact O-CB 3.37Å; T94-N98 PolarHBondContact O-N 2.92Å; T94-N386 HydrophobicContact CG2-CB 4.38Å
95	N	91.3	Very high	92.2	Very high	79 Å²	79	47.4 Å²	47.4	42%	0.422	26%	0.257	S	S	.	.	H	α-helix	trans	-69	-34.9	170.9	-73.8	-24.9	0	0	0	112.3	H91 Q92 H93 R405	H91-N95 WeakPolarHBondContact O-CB 3.49Å; H91-N95 PolarHBondContact O-N 2.85Å; H91-N95 PolarHBondContact O-ND2 3.23Å; H91-N95 VanDerWaalsContact O-ND2 3.07Å; Q92-N95 PolarHBondContact O-N 3.03Å; H93-N95 PolarHBondContact O-N 3.44Å; N95-R405 PolarHBondContact O-NH1 3.18Å
96	S	91.1	Very high	92.6	Very high	62 Å²	62	45.2 Å²	45.2	43%	0.434	25%	0.251	S	S	.	.	H	α-helix	trans	-74.3	-30.6	177.1	77.3	0	0	0	0	112.9	Q92 H93 R405	Q92-S96 PolarHBondContact O-N 3.36Å; Q92-S96 VanDerWaalsContact O-N 3.07Å; H93-S96 WeakPolarHBondContact O-CA 3.33Å; H93-S96 WeakPolarHBondContact O-CB 3.33Å; H93-S96 PolarHBondContact O-N 2.69Å; H93-S96 PolarHBondContact O-OG 2.85Å; S96-R405 PolarHBondContact O-NH1 3.15Å; S96-R405 VanDerWaalsContact O-NH1 3.14Å
97	T	93.5	Very high	93	Very high	2 Å²	2	42.5 Å²	42.5	1%	0.012	24%	0.237	C	C	.	.	H	α-helix	trans	-89.1	-17.8	177.9	59.3	0	0	0	0	114	H93 T94 R99 N386 L389 M393	H93-T97 PolarHBondContact O-N 2.9Å; H93-T97 PolarHBondContact O-OG1 3.19Å; T94-T97 WeakPolarHBondContact CA-OG1 3.09Å; T94-T97 PolarHBondContact O-OG1 3.39Å; T97-R99 PolarHBondContact O-N 3.35Å; T97-R99 VanDerWaalsContact O-N 3.15Å; T97-N386 WeakPolarHBondContact CB-OD1 3.5Å; T97-N386 PolarHBondContact OG1-OD1 3.03Å; T97-L389 HydrophobicContact CG2-CD1 4.11Å; T97-M393 HydrophobicContact CG2-CE 3.65Å
98	N	94.8	Very high	93.3	Very high	27 Å²	27	48 Å²	48	14%	0.144	26%	0.256	C	S	.	.			trans	-60.4	116.5	178.7	178.7	3.8	0	0	0	111.6	T94 A100 G101 R405	T94-N98 VanDerWaalsContact O-CB 3.28Å; T94-N98 WeakPolarHBondContact O-CB 3.37Å; T94-N98 PolarHBondContact O-N 2.92Å; N98-A100 PolarHBondContact O-N 3.01Å; N98-A100 PolarHBondContact OD1-N 3.24Å; N98-G101 PolarHBondContact O-N 3.45Å; N98-R405 PolarHBondContact O-NH1 3.27Å
99	R	95.9	Very high	93.5	Very high	44 Å²	44	48.5 Å²	48.5	17%	0.166	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.7	-35.2	178.4	-71.4	105.9	175.1	131.7	4	113.5	E30 L34 T97 G101 E385 I404 R405 V408	E30-R99 IonicContact OE1-CZ 3.19Å; E30-R99 VanDerWaalsContact OE1-CZ 3.31Å; E30-R99 IonicContact OE1-NE 2.89Å; E30-R99 PolarHBondContact OE1-NE 2.97Å; E30-R99 IonicContact OE1-NH2 2.98Å; E30-R99 PolarHBondContact OE1-NH2 3.08Å; L34-R99 HydrophobicContact CD1-CB 4.48Å; L34-R99 HydrophobicContact CD2-CB 3.78Å; T97-R99 PolarHBondContact O-N 3.35Å; T97-R99 VanDerWaalsContact O-N 3.15Å; R99-G101 VanDerWaalsContact C-N 3.33Å; R99-G101 PolarHBondContact O-N 3.2Å; R99-E385 IonicContact CZ-OE1 3.6Å; R99-E385 IonicContact CZ-OE2 3.52Å; R99-E385 IonicContact NH1-OE1 3.85Å; R99-E385 IonicContact NH1-OE2 3.56Å; R99-E385 PolarHBondContact NH1-OE2 3.2Å; R99-E385 IonicContact NH2-OE1 3.51Å; R99-E385 PolarHBondContact NH2-OE1 2.58Å; R99-E385 IonicContact NH2-OE2 3.52Å; R99-E385 PolarHBondContact NH2-OE2 3.41Å; R99-I404 HydrophobicContact CB-CG2 4.32Å; R99-I404 HydrophobicContact CG-CG2 3.85Å; R99-R405 WeakPolarHBondContact O-CA 3.27Å; R99-R405 WeakPolarHBondContact O-CG 3.34Å; R99-V408 HydrophobicContact CB-CG2 4.35Å
100	A	96.3	Very high	93.6	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.033	26%	0.261	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.8	7.1	177.1	0	0	0	0	0	114.1	N98 K102 V103 A311 T312 V408	N98-A100 PolarHBondContact O-N 3.01Å; N98-A100 PolarHBondContact OD1-N 3.24Å; A100-K102 PolarHBondContact O-N 3.13Å; A100-K102 VanDerWaalsContact O-N 3.09Å; A100-V103 HydrophobicContact CB-CG2 4.11Å; A100-V103 WeakPolarHBondContact O-CB 3.32Å; A100-V103 WeakPolarHBondContact O-CG2 3.12Å; A100-V103 PolarHBondContact O-N 2.76Å; A100-A311 WeakPolarHBondContact CB-O 3.28Å; A100-T312 HydrophobicContact CB-CG2 4.33Å; A100-V408 HydrophobicContact CB-CG1 4.22Å
101	G	94.1	Very high	93.6	Very high	31 Å²	31	45.4 Å²	45.4	32%	0.32	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.3	-170.1	0	0	0	0	0	115.5	N98 R99	N98-G101 PolarHBondContact O-N 3.45Å; R99-G101 VanDerWaalsContact C-N 3.33Å; R99-G101 PolarHBondContact O-N 3.2Å
102	K	96.1	Very high	93.8	Very high	45 Å²	45	44.8 Å²	44.8	20%	0.196	26%	0.256	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	-14.7	175.4	-68.8	-178.3	177.7	169.9	0	113.5	A100 I104 A105 A106 D402 R405 D406 V409	A100-K102 PolarHBondContact O-N 3.13Å; A100-K102 VanDerWaalsContact O-N 3.09Å; K102-I104 PolarHBondContact O-N 3.39Å; K102-A105 PolarHBondContact O-N 3.4Å; K102-A106 PolarHBondContact O-N 2.68Å; K102-A106 VanDerWaalsContact O-N 3.12Å; K102-D402 WeakPolarHBondContact CE-OD1 3.36Å; K102-D402 PolarHBondContact NZ-O 3.46Å; K102-D402 IonicContact NZ-OD1 3.67Å; K102-D402 PolarHBondContact NZ-OD1 3.17Å; K102-D402 IonicContact NZ-OD2 3.02Å; K102-D402 PolarHBondContact NZ-OD2 2.88Å; K102-R405 HydrophobicContact CD-CB 3.83Å; K102-R405 HydrophobicContact CG-CB 4.13Å; K102-D406 WeakPolarHBondContact CD-OD1 3.36Å; K102-D406 WeakPolarHBondContact CE-OD1 3.29Å; K102-D406 IonicContact NZ-OD1 2.89Å; K102-D406 PolarHBondContact NZ-OD1 3.38Å; K102-D406 IonicContact NZ-OD2 2.97Å; K102-D406 PolarHBondContact NZ-OD2 3.33Å; K102-V409 HydrophobicContact CB-CG2 3.49Å; K102-V409 VanDerWaalsContact CB-CG2 3.49Å
103	V	97.2	Very high	93.9	Very high	1 Å²	1	38.2 Å²	38.2	1%	0.006	23%	0.226	C	C	.	.	H	α-helix	trans	-59.9	-49.2	-171.6	174.7	0	0	0	0	112.6	A100 A105 A106 V107 T312 V408 V409 Y412	A100-V103 HydrophobicContact CB-CG2 4.11Å; A100-V103 WeakPolarHBondContact O-CB 3.32Å; A100-V103 WeakPolarHBondContact O-CG2 3.12Å; A100-V103 PolarHBondContact O-N 2.76Å; V103-A105 VanDerWaalsContact C-N 3.33Å; V103-A105 PolarHBondContact O-N 3.37Å; V103-A106 WeakPolarHBondContact O-CB 3.42Å; V103-A106 PolarHBondContact O-N 2.93Å; V103-A106 VanDerWaalsContact O-N 3.12Å; V103-V107 HydrophobicContact CG1-CG2 4Å; V103-V107 WeakPolarHBondContact O-CG2 3.45Å; V103-V107 PolarHBondContact O-N 2.9Å; V103-T312 HydrophobicContact CB-CG2 4.25Å; V103-T312 HydrophobicContact CG1-CG2 3.87Å; V103-T312 HydrophobicContact CG2-CG2 4.48Å; V103-V408 HydrophobicContact CG2-CG1 3.94Å; V103-V409 HydrophobicContact CG2-CG2 4.23Å; V103-Y412 HydrophobicContact CG1-CD1 3.63Å; V103-Y412 HydrophobicContact CG1-CD2 3.7Å; V103-Y412 HydrophobicContact CG1-CE1 3.91Å; V103-Y412 HydrophobicContact CG1-CE2 3.98Å; V103-Y412 HydrophobicContact CG1-CG 3.54Å; V103-Y412 HydrophobicContact CG2-CG 4.41Å
104	I	94.4	Very high	93.8	Very high	43 Å²	43	37.5 Å²	37.5	22%	0.221	22%	0.223	C	C	.	.	H	α-helix	trans	-59.7	-44.9	-175.8	-56.1	168.9	0	0	0	111.1	K102 A106 V107 R108 Q118	K102-I104 PolarHBondContact O-N 3.39Å; I104-A106 VanDerWaalsContact C-N 3.33Å; I104-A106 PolarHBondContact O-N 2.98Å; I104-V107 PolarHBondContact O-N 3.01Å; I104-R108 WeakPolarHBondContact O-CB 3.07Å; I104-R108 PolarHBondContact O-N 3.28Å; I104-Q118 HydrophobicContact CD1-CB 3.76Å; I104-Q118 HydrophobicContact CD1-CG 4.01Å
105	A	94.1	Very high	93.6	Very high	63 Å²	63	37.2 Å²	37.2	52%	0.521	22%	0.221	S	C	.	.	H	α-helix	trans	-64.6	-40.1	178.7	0	0	0	0	0	111.5	K102 V103 S109	K102-A105 PolarHBondContact O-N 3.4Å; V103-A105 VanDerWaalsContact C-N 3.33Å; V103-A105 PolarHBondContact O-N 3.37Å; A105-S109 WeakPolarHBondContact O-CB 3.24Å; A105-S109 PolarHBondContact O-N 3.48Å; A105-S109 VanDerWaalsContact O-N 3.11Å
106	A	95.8	Very high	93.6	Very high	22 Å²	22	33.8 Å²	33.8	18%	0.182	20%	0.202	C	C	.	.	H	α-helix	trans	-65.8	-46.4	176.9	0	0	0	0	0	112.3	K102 V103 I104 R108 S109 A110 V409	K102-A106 PolarHBondContact O-N 2.68Å; K102-A106 VanDerWaalsContact O-N 3.12Å; V103-A106 WeakPolarHBondContact O-CB 3.42Å; V103-A106 PolarHBondContact O-N 2.93Å; V103-A106 VanDerWaalsContact O-N 3.12Å; I104-A106 VanDerWaalsContact C-N 3.33Å; I104-A106 PolarHBondContact O-N 2.98Å; A106-R108 PolarHBondContact O-N 2.94Å; A106-S109 PolarHBondContact O-N 2.74Å; A106-A110 VanDerWaalsContact O-CB 3.3Å; A106-A110 WeakPolarHBondContact O-CB 3.43Å; A106-A110 PolarHBondContact O-N 3.25Å; A106-V409 HydrophobicContact CB-CB 4.38Å; A106-V409 HydrophobicContact CB-CG1 3.33Å; A106-V409 HydrophobicContact CB-CG2 4.11Å
107	V	96.2	Very high	93.7	Very high	0 Å²	0	32.8 Å²	32.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-59.6	-47.1	175.8	170.1	0	0	0	0	110.7	V103 I104 S109 A110 A111 A113 W120 Y412 L413 V418	V103-V107 HydrophobicContact CG1-CG2 4Å; V103-V107 WeakPolarHBondContact O-CG2 3.45Å; V103-V107 PolarHBondContact O-N 2.9Å; I104-V107 PolarHBondContact O-N 3.01Å; V107-S109 PolarHBondContact O-N 3.33Å; V107-A110 PolarHBondContact O-N 2.9Å; V107-A111 HydrophobicContact CG1-CB 4.14Å; V107-A111 WeakPolarHBondContact O-CA 3.33Å; V107-A111 WeakPolarHBondContact O-CB 3.47Å; V107-A111 PolarHBondContact O-N 3.04Å; V107-A113 HydrophobicContact CG1-CB 4.08Å; V107-W120 HydrophobicContact CG1-CE3 3.97Å; V107-W120 HydrophobicContact CG1-CH2 3.91Å; V107-W120 HydrophobicContact CG1-CZ3 3.45Å; V107-W120 VanDerWaalsContact CG1-CZ3 3.45Å; V107-Y412 HydrophobicContact CG2-CD1 3.98Å; V107-Y412 HydrophobicContact CG2-CE1 3.68Å; V107-L413 HydrophobicContact CG2-CD2 3.97Å; V107-V418 HydrophobicContact CG1-CG1 4.33Å
108	R	92.1	Very high	93.7	Very high	141 Å²	141	35 Å²	35	53%	0.532	20%	0.204	S	C	.	.	H	α-helix	trans	-57.4	-40.6	177.8	-169.8	179.9	-61.4	150.2	2	112	I104 A106 N112 C116	I104-R108 WeakPolarHBondContact O-CB 3.07Å; I104-R108 PolarHBondContact O-N 3.28Å; A106-R108 PolarHBondContact O-N 2.94Å; R108-N112 PolarHBondContact O-N 3.1Å; R108-C116 HydrophobicContact CB-CB 4.39Å; R108-C116 PolarHBondContact NH2-O 2.61Å
109	S	90.8	Very high	93.8	Very high	101 Å²	101	34.5 Å²	34.5	71%	0.706	20%	0.203	S	C	*	.	H	α-helix	trans	-72.8	-46.4	179.1	-173.6	0	0	0	0	112.9	A105 A106 V107	A105-S109 WeakPolarHBondContact O-CB 3.24Å; A105-S109 PolarHBondContact O-N 3.48Å; A105-S109 VanDerWaalsContact O-N 3.11Å; A106-S109 PolarHBondContact O-N 2.74Å; V107-S109 PolarHBondContact O-N 3.33Å
110	A	92.3	Very high	93.8	Very high	33 Å²	33	32.4 Å²	32.4	27%	0.273	20%	0.195	S	C	.	.	H	α-helix	trans	-82.1	-38	-172.5	0	0	0	0	0	113.2	A106 V107	A106-A110 VanDerWaalsContact O-CB 3.3Å; A106-A110 WeakPolarHBondContact O-CB 3.43Å; A106-A110 PolarHBondContact O-N 3.25Å; V107-A110 PolarHBondContact O-N 2.9Å
111	A	93.3	Very high	93.9	Very high	0 Å²	0	32.2 Å²	32.2	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-97.7	-19.9	-170.2	0	0	0	0	0	113.3	V107 A113 H161 V418 F420 L421	V107-A111 HydrophobicContact CG1-CB 4.14Å; V107-A111 WeakPolarHBondContact O-CA 3.33Å; V107-A111 WeakPolarHBondContact O-CB 3.47Å; V107-A111 PolarHBondContact O-N 3.04Å; A111-A113 HydrophobicContact CB-CB 4.22Å; A111-A113 PolarHBondContact O-N 2.98Å; A111-H161 PolarHBondContact O-CE1 3.24Å; A111-V418 HydrophobicContact CB-CG1 3.56Å; A111-F420 WeakPolarHBondContact O-CA 3.5Å; A111-L421 PolarHBondContact O-N 3Å
112	N	93.3	Very high	94.1	Very high	49 Å²	49	31.3 Å²	31.3	26%	0.262	18%	0.181	S	C	.	.			trans	52.4	45.3	-167.4	-174	58.3	0	0	0	111.1	R108 F420 L421 W426	R108-N112 PolarHBondContact O-N 3.1Å; N112-F420 HydrophobicContact CB-CD2 3.72Å; N112-F420 HydrophobicContact CB-CE2 3.42Å; N112-F420 VanDerWaalsContact CB-CE2 3.42Å; N112-F420 HydrophobicContact CB-CZ 4.24Å; N112-L421 PolarHBondContact ND2-O 3.35Å; N112-W426 VanDerWaalsContact ND2-CZ2 3.34Å; N112-W426 WeakPolarHBondContact ND2-CZ2 3.38Å; N112-W426 VanDerWaalsContact O-CZ2 3.24Å; N112-W426 WeakPolarHBondContact O-CZ2 3.44Å; N112-W426 PolarHBondContact O-NE1 2.88Å; N112-W426 WeakPolarHBondContact OD1-CZ2 3.36Å
113	A	92.3	Very high	94.3	Very high	8 Å²	8	29.2 Å²	29.2	7%	0.066	17%	0.172	C	C	.	.			trans	-72.8	129.6	-176.5	0	0	0	0	0	111.9	V107 A111 C116 W120	V107-A113 HydrophobicContact CG1-CB 4.08Å; A111-A113 HydrophobicContact CB-CB 4.22Å; A111-A113 PolarHBondContact O-N 2.98Å; A113-C116 HydrophobicContact CB-CB 3.75Å; A113-C116 WeakPolarHBondContact O-CB 3.12Å; A113-W120 HydrophobicContact CB-CD2 4.39Å; A113-W120 HydrophobicContact CB-CH2 4.13Å; A113-W120 HydrophobicContact CB-CZ2 3.63Å
114	E	91.6	Very high	94.3	Very high	7 Å²	7	29.3 Å²	29.3	3%	0.033	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72.4	130.2	177.5	-176.5	179.9	-164.8	0	0	110.7	C116 T157 W426 I427 S428	E114-C116 PolarHBondContact O-N 3.46Å; E114-T157 HydrophobicContact CB-CG2 4.22Å; E114-T157 HydrophobicContact CG-CG2 3.83Å; E114-T157 VanDerWaalsContact O-CB 3.29Å; E114-T157 WeakPolarHBondContact O-CB 3.26Å; E114-T157 PolarHBondContact O-OG1 3.42Å; E114-W426 HydrophobicContact CB-CD2 3.91Å; E114-W426 HydrophobicContact CB-CE3 4.32Å; E114-W426 HydrophobicContact CB-CG 4.06Å; E114-W426 HydrophobicContact CG-CD2 4.17Å; E114-W426 HydrophobicContact CG-CE3 4.15Å; E114-W426 HydrophobicContact CG-CG 4.39Å; E114-W426 WeakPolarHBondContact OE2-CA 3.36Å; E114-W426 WeakPolarHBondContact OE2-CB 3.16Å; E114-I427 PolarHBondContact OE2-N 2.85Å; E114-S428 WeakPolarHBondContact OE1-CA 3.47Å; E114-S428 WeakPolarHBondContact OE1-CB 3.44Å; E114-S428 PolarHBondContact OE1-N 3.36Å; E114-S428 PolarHBondContact OE1-OG 3.43Å
115	I	88.8	Confident	94.5	Very high	20 Å²	20	27.2 Å²	27.2	10%	0.103	16%	0.162	C	C	.	.	T	Hydrogen-bonded Turn	trans	50.4	46	-177	-55.1	174.3	0	0	0	110.9	T117 P152 T157 L199	I115-T117 VanDerWaalsContact C-N 3.3Å; I115-T117 HydrophobicContact CG2-CG2 3.97Å; I115-T117 PolarHBondContact O-N 3.1Å; I115-P152 HydrophobicContact CG2-CG 4.08Å; I115-T157 HydrophobicContact CB-CG2 4.39Å; I115-T157 HydrophobicContact CD1-CG2 4.25Å; I115-L199 HydrophobicContact CD1-CB 3.56Å; I115-L199 HydrophobicContact CD1-CG 4.43Å
116	C	91.6	Very high	94.7	Very high	6 Å²	6	24.2 Å²	24.2	4%	0.041	14%	0.137	C	C	.	.			trans	-70.3	86.2	178.8	-176.8	0	0	0	0	111.2	R108 A113 E114	R108-C116 HydrophobicContact CB-CB 4.39Å; R108-C116 PolarHBondContact NH2-O 2.61Å; A113-C116 HydrophobicContact CB-CB 3.75Å; A113-C116 WeakPolarHBondContact O-CB 3.12Å; E114-C116 PolarHBondContact O-N 3.46Å
117	T	92.8	Very high	94.8	Very high	41 Å²	41	23.3 Å²	23.3	25%	0.252	13%	0.129	S	C	.	.			trans	-100.6	179.9	173.5	66.9	0	0	0	0	110.5	I115 A119 W120 C121 A154	I115-T117 VanDerWaalsContact C-N 3.3Å; I115-T117 HydrophobicContact CG2-CG2 3.97Å; I115-T117 PolarHBondContact O-N 3.1Å; T117-A119 VanDerWaalsContact C-N 3.31Å; T117-A119 PolarHBondContact OG1-N 3.21Å; T117-W120 WeakPolarHBondContact O-CB 3.34Å; T117-W120 PolarHBondContact O-N 3.13Å; T117-W120 PolarHBondContact OG1-N 3.25Å; T117-C121 PolarHBondContact O-N 3.47Å; T117-A154 VanDerWaalsContact OG1-CB 3.28Å; T117-A154 WeakPolarHBondContact OG1-CB 3.15Å
118	Q	94.6	Very high	94.8	Very high	49 Å²	49	25.1 Å²	25.1	23%	0.229	15%	0.147	C	C	.	.	H	α-helix	trans	-63.5	-38.7	171.9	-164	-179.4	13.8	0	0	111.6	I104 W120 C121 K122 T312	I104-Q118 HydrophobicContact CD1-CB 3.76Å; I104-Q118 HydrophobicContact CD1-CG 4.01Å; Q118-W120 VanDerWaalsContact C-N 3.31Å; Q118-W120 PolarHBondContact O-N 3.1Å; Q118-C121 PolarHBondContact O-N 3.4Å; Q118-K122 WeakPolarHBondContact O-CG 3.38Å; Q118-K122 PolarHBondContact O-N 2.96Å; Q118-T312 WeakPolarHBondContact CG-O 3.25Å; Q118-T312 PolarHBondContact NE2-O 3.47Å
119	A	95.8	Very high	95	Very high	16 Å²	16	20.7 Å²	20.7	13%	0.132	14%	0.136	C	C	.	.	H	α-helix	trans	-61.4	-39	177.1	0	0	0	0	0	111.8	T117 C121 K122 F123 A154 F155	T117-A119 VanDerWaalsContact C-N 3.31Å; T117-A119 PolarHBondContact OG1-N 3.21Å; A119-C121 VanDerWaalsContact C-N 3.34Å; A119-C121 PolarHBondContact O-N 3.39Å; A119-K122 PolarHBondContact O-N 3.29Å; A119-F123 PolarHBondContact O-N 3.02Å; A119-A154 HydrophobicContact CB-CB 3.81Å; A119-F155 HydrophobicContact CB-CD1 4.38Å; A119-F155 HydrophobicContact CB-CE1 4.04Å; A119-F155 WeakPolarHBondContact O-CE1 3.48Å
120	W	97.4	Very high	95.4	Very high	0 Å²	0	16.9 Å²	16.9	0%	0	11%	0.107	C	C	.	.	H	α-helix	trans	-54.9	-49.1	173	-171.6	101.3	0	0	0	111.5	V107 A113 T117 Q118 F123 Y124 A154 T157 A158 H161	V107-W120 HydrophobicContact CG1-CE3 3.97Å; V107-W120 HydrophobicContact CG1-CH2 3.91Å; V107-W120 HydrophobicContact CG1-CZ3 3.45Å; V107-W120 VanDerWaalsContact CG1-CZ3 3.45Å; A113-W120 HydrophobicContact CB-CD2 4.39Å; A113-W120 HydrophobicContact CB-CH2 4.13Å; A113-W120 HydrophobicContact CB-CZ2 3.63Å; T117-W120 WeakPolarHBondContact O-CB 3.34Å; T117-W120 PolarHBondContact O-N 3.13Å; T117-W120 PolarHBondContact OG1-N 3.25Å; Q118-W120 VanDerWaalsContact C-N 3.31Å; Q118-W120 PolarHBondContact O-N 3.1Å; W120-F123 PolarHBondContact O-N 2.84Å; W120-Y124 HydrophobicContact CH2-CD1 4.43Å; W120-Y124 AromaticContact CH2-CD2 3.33Å; W120-Y124 HydrophobicContact CH2-CD2 3.33Å; W120-Y124 AromaticContact CH2-CE2 3.77Å; W120-Y124 HydrophobicContact CH2-CE2 3.77Å; W120-Y124 AromaticContact CH2-CG 3.71Å; W120-Y124 HydrophobicContact CH2-CG 3.71Å; W120-Y124 AromaticContact CZ2-CD2 3.76Å; W120-Y124 HydrophobicContact CZ2-CD2 3.76Å; W120-Y124 HydrophobicContact CZ2-CE2 4.18Å; W120-Y124 HydrophobicContact CZ2-CG 4.47Å; W120-Y124 HydrophobicContact CZ3-CD1 4.44Å; W120-Y124 AromaticContact CZ3-CD2 3.86Å; W120-Y124 HydrophobicContact CZ3-CD2 3.86Å; W120-Y124 AromaticContact CZ3-CG 3.75Å; W120-Y124 HydrophobicContact CZ3-CG 3.75Å; W120-Y124 WeakPolarHBondContact O-CB 3.46Å; W120-Y124 PolarHBondContact O-N 2.88Å; W120-A154 HydrophobicContact CB-CB 4.3Å; W120-T157 VanDerWaalsContact CD1-OG1 3.3Å; W120-A158 HydrophobicContact CD2-CB 3.97Å; W120-A158 HydrophobicContact CG-CB 3.84Å; W120-A158 HydrophobicContact CZ2-CB 4.49Å; W120-H161 HydrophobicContact CZ2-CB 3.69Å; W120-H161 AromaticContact CZ2-CG 3.64Å; W120-H161 AromaticContact CZ2-ND1 3.93Å
121	C	98.3	Very high	95.6	Very high	0 Å²	0	21.4 Å²	21.4	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-68.1	-39.2	-179.5	-62.8	0	0	0	0	112.3	T117 Q118 A119 F123 Y124 E125 T312 Y412	T117-C121 PolarHBondContact O-N 3.47Å; Q118-C121 PolarHBondContact O-N 3.4Å; A119-C121 VanDerWaalsContact C-N 3.34Å; A119-C121 PolarHBondContact O-N 3.39Å; C121-F123 VanDerWaalsContact C-N 3.32Å; C121-F123 PolarHBondContact O-N 3.21Å; C121-Y124 PolarHBondContact O-N 3.27Å; C121-E125 VanDerWaalsContact O-CB 3.27Å; C121-E125 WeakPolarHBondContact O-CB 3.44Å; C121-E125 PolarHBondContact O-N 2.97Å; C121-T312 HydrophobicContact CB-CG2 3.89Å; C121-Y412 VanDerWaalsContact CA-OH 3.28Å; C121-Y412 WeakPolarHBondContact CA-OH 3.41Å; C121-Y412 HydrophobicContact CB-CE2 4.48Å; C121-Y412 WeakPolarHBondContact CB-OH 3.4Å; C121-Y412 PolarHBondContact O-OH 3.07Å
122	K	98.3	Very high	95.7	Very high	13 Å²	13	21.5 Å²	21.5	6%	0.057	13%	0.127	C	C	.	.	H	α-helix	trans	-58.5	-45.9	175.8	-66.2	171.7	-156.5	173.2	0	111.2	Q118 A119 E125 I126 P310 T312 E319 Y321	Q118-K122 WeakPolarHBondContact O-CG 3.38Å; Q118-K122 PolarHBondContact O-N 2.96Å; A119-K122 PolarHBondContact O-N 3.29Å; K122-E125 WeakPolarHBondContact O-CB 3.48Å; K122-E125 PolarHBondContact O-N 3.22Å; K122-I126 WeakPolarHBondContact O-CG1 3.4Å; K122-I126 PolarHBondContact O-N 3.5Å; K122-P310 HydrophobicContact CB-CB 4.23Å; K122-P310 HydrophobicContact CB-CG 4.07Å; K122-P310 HydrophobicContact CG-CB 4.18Å; K122-P310 HydrophobicContact CG-CG 4.3Å; K122-T312 WeakPolarHBondContact CA-OG1 3.45Å; K122-T312 PolarHBondContact N-OG1 2.85Å; K122-E319 VanDerWaalsContact CE-OE1 3.23Å; K122-E319 WeakPolarHBondContact CE-OE1 3.32Å; K122-E319 IonicContact NZ-OE1 2.67Å; K122-E319 PolarHBondContact NZ-OE1 2.77Å; K122-E319 IonicContact NZ-OE2 2.6Å; K122-E319 PolarHBondContact NZ-OE2 2.98Å; K122-Y321 HydrophobicContact CB-CE2 4.32Å; K122-Y321 HydrophobicContact CD-CE2 3.83Å; K122-Y321 WeakPolarHBondContact CD-OH 2.93Å
123	F	98.6	Very high	95.9	Very high	0 Å²	0	20 Å²	20	0%	0	12%	0.119	C	C	.	.	H	α-helix	trans	-71.7	-38.6	-179.4	-167.4	-116.6	0	0	0	112.9	A119 W120 C121 E125 I126 L127 L132 F155 A158 L159 T240 V280	A119-F123 PolarHBondContact O-N 3.02Å; W120-F123 PolarHBondContact O-N 2.84Å; C121-F123 VanDerWaalsContact C-N 3.32Å; C121-F123 PolarHBondContact O-N 3.21Å; F123-E125 PolarHBondContact O-N 3.39Å; F123-I126 HydrophobicContact CD2-CB 4.47Å; F123-I126 HydrophobicContact CD2-CD1 4.4Å; F123-I126 WeakPolarHBondContact O-CB 3.4Å; F123-I126 PolarHBondContact O-N 3.18Å; F123-I126 VanDerWaalsContact O-N 3.09Å; F123-L127 HydrophobicContact CD1-CD1 3.76Å; F123-L127 HydrophobicContact CD1-CG 4.15Å; F123-L127 HydrophobicContact CE1-CD1 3.64Å; F123-L127 HydrophobicContact CE1-CD2 4.11Å; F123-L127 HydrophobicContact CE1-CG 3.89Å; F123-L127 HydrophobicContact CZ-CD1 4.41Å; F123-L127 HydrophobicContact CZ-CD2 4.11Å; F123-L127 HydrophobicContact CZ-CG 4.19Å; F123-L127 WeakPolarHBondContact O-CG 3.18Å; F123-L127 PolarHBondContact O-N 3.23Å; F123-L132 HydrophobicContact CE2-CD2 3.92Å; F123-L132 HydrophobicContact CZ-CD2 3.81Å; F123-F155 HydrophobicContact CB-CB 4.29Å; F123-F155 HydrophobicContact CB-CD1 3.41Å; F123-F155 VanDerWaalsContact CB-CD1 3.41Å; F123-F155 HydrophobicContact CB-CD2 4.07Å; F123-F155 HydrophobicContact CB-CE1 3.56Å; F123-F155 HydrophobicContact CB-CE2 4.2Å; F123-F155 HydrophobicContact CB-CG 3.66Å; F123-F155 HydrophobicContact CB-CZ 3.94Å; F123-F155 HydrophobicContact CD1-CB 3.75Å; F123-F155 HydrophobicContact CD1-CD1 4.49Å; F123-F155 HydrophobicContact CD1-CD2 4.29Å; F123-F155 AromaticContact CD1-CG 3.96Å; F123-F155 HydrophobicContact CD1-CG 3.96Å; F123-F155 HydrophobicContact CD2-CB 4.32Å; F123-F155 HydrophobicContact CD2-CD1 4.27Å; F123-F155 AromaticContact CD2-CD2 3.32Å; F123-F155 HydrophobicContact CD2-CD2 3.32Å; F123-F155 HydrophobicContact CD2-CE1 4.39Å; F123-F155 AromaticContact CD2-CE2 3.46Å; F123-F155 HydrophobicContact CD2-CE2 3.46Å; F123-F155 VanDerWaalsContact CD2-CE2 3.46Å; F123-F155 AromaticContact CD2-CG 3.74Å; F123-F155 HydrophobicContact CD2-CG 3.74Å; F123-F155 AromaticContact CD2-CZ 4Å; F123-F155 HydrophobicContact CD2-CZ 4Å; F123-F155 HydrophobicContact CE1-CB 4.14Å; F123-F155 AromaticContact CE2-CD2 3.76Å; F123-F155 HydrophobicContact CE2-CD2 3.76Å; F123-F155 HydrophobicContact CE2-CE2 4.11Å; F123-F155 HydrophobicContact CE2-CG 4.39Å; F123-F155 HydrophobicContact CG-CB 3.85Å; F123-F155 AromaticContact CG-CD1 3.83Å; F123-F155 HydrophobicContact CG-CD1 3.83Å; F123-F155 AromaticContact CG-CD2 3.63Å; F123-F155 HydrophobicContact CG-CD2 3.63Å; F123-F155 HydrophobicContact CG-CE1 4.21Å; F123-F155 HydrophobicContact CG-CE2 4.02Å; F123-F155 AromaticContact CG-CG 3.5Å; F123-F155 HydrophobicContact CG-CG 3.5Å; F123-F155 VanDerWaalsContact CG-CG 3.5Å; F123-F155 HydrophobicContact CG-CZ 4.27Å; F123-F155 HydrophobicContact CZ-CD2 4.41Å; F123-A158 HydrophobicContact CB-CB 4.37Å; F123-A158 HydrophobicContact CD1-CB 3.95Å; F123-L159 HydrophobicContact CE1-CB 4.04Å; F123-T240 HydrophobicContact CE2-CG2 3.64Å; F123-T240 HydrophobicContact CZ-CG2 3.7Å; F123-V280 HydrophobicContact CE2-CG2 4.28Å
124	Y	98.3	Very high	95.9	Very high	3 Å²	3	20.1 Å²	20.1	1%	0.012	12%	0.119	C	C	.	.	H	α-helix	trans	-62.9	-35.4	174.5	-158.2	-82.2	0	0	0	111.7	W120 C121 L127 G128 H161 Y162 F416 V418	W120-Y124 HydrophobicContact CH2-CD1 4.43Å; W120-Y124 AromaticContact CH2-CD2 3.33Å; W120-Y124 HydrophobicContact CH2-CD2 3.33Å; W120-Y124 AromaticContact CH2-CE2 3.77Å; W120-Y124 HydrophobicContact CH2-CE2 3.77Å; W120-Y124 AromaticContact CH2-CG 3.71Å; W120-Y124 HydrophobicContact CH2-CG 3.71Å; W120-Y124 AromaticContact CZ2-CD2 3.76Å; W120-Y124 HydrophobicContact CZ2-CD2 3.76Å; W120-Y124 HydrophobicContact CZ2-CE2 4.18Å; W120-Y124 HydrophobicContact CZ2-CG 4.47Å; W120-Y124 HydrophobicContact CZ3-CD1 4.44Å; W120-Y124 AromaticContact CZ3-CD2 3.86Å; W120-Y124 HydrophobicContact CZ3-CD2 3.86Å; W120-Y124 AromaticContact CZ3-CG 3.75Å; W120-Y124 HydrophobicContact CZ3-CG 3.75Å; W120-Y124 WeakPolarHBondContact O-CB 3.46Å; W120-Y124 PolarHBondContact O-N 2.88Å; C121-Y124 PolarHBondContact O-N 3.27Å; Y124-L127 PolarHBondContact O-N 3.2Å; Y124-G128 PolarHBondContact O-N 3.36Å; Y124-H161 HydrophobicContact CE2-CB 4.38Å; Y124-H161 AromaticContact CE2-CD2 3.77Å; Y124-Y162 HydrophobicContact CE1-CD2 4.47Å; Y124-Y162 HydrophobicContact CE2-CD2 4.06Å; Y124-Y162 HydrophobicContact CE2-CG 4.49Å; Y124-F416 HydrophobicContact CD1-CB 4.03Å; Y124-F416 HydrophobicContact CE1-CB 3.89Å; Y124-F416 WeakPolarHBondContact CE1-O 3.32Å; Y124-V418 HydrophobicContact CD1-CG2 4.07Å; Y124-V418 HydrophobicContact CE1-CG2 3.64Å
125	E	98.1	Very high	95.9	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	15%	0.147	C	C	.	.	H	α-helix	trans	-65.8	-37.5	171.2	-178.6	172.6	171.6	0	0	112.5	F35 C121 K122 F123 G128 T129 F308 P310 A311 T312 Y412 F416	F35-E125 WeakPolarHBondContact CD1-OE1 3.48Å; C121-E125 VanDerWaalsContact O-CB 3.27Å; C121-E125 WeakPolarHBondContact O-CB 3.44Å; C121-E125 PolarHBondContact O-N 2.97Å; K122-E125 WeakPolarHBondContact O-CB 3.48Å; K122-E125 PolarHBondContact O-N 3.22Å; F123-E125 PolarHBondContact O-N 3.39Å; E125-G128 PolarHBondContact O-N 2.88Å; E125-T129 VanDerWaalsContact O-CB 3.25Å; E125-T129 WeakPolarHBondContact O-CB 3.39Å; E125-T129 PolarHBondContact O-N 3.44Å; E125-T129 PolarHBondContact O-OG1 3.44Å; E125-F308 HydrophobicContact CG-CE1 4.02Å; E125-F308 HydrophobicContact CG-CZ 3.92Å; E125-F308 WeakPolarHBondContact OE1-CZ 3.25Å; E125-P310 HydrophobicContact CG-CB 4.31Å; E125-P310 WeakPolarHBondContact OE1-CA 3.32Å; E125-P310 WeakPolarHBondContact OE2-CB 3.48Å; E125-A311 VanDerWaalsContact CD-N 3.32Å; E125-A311 WeakPolarHBondContact OE1-CB 3.44Å; E125-A311 PolarHBondContact OE1-N 2.74Å; E125-A311 PolarHBondContact OE2-N 2.86Å; E125-T312 PolarHBondContact OE2-N 2.87Å; E125-T312 PolarHBondContact OE2-OG1 3.24Å; E125-Y412 HydrophobicContact CB-CE2 4.2Å; E125-F416 HydrophobicContact CB-CE2 4.18Å; E125-F416 HydrophobicContact CB-CZ 4.25Å; E125-F416 HydrophobicContact CG-CE1 4.37Å; E125-F416 HydrophobicContact CG-CE2 3.84Å; E125-F416 HydrophobicContact CG-CZ 3.6Å
126	I	98.7	Very high	96.1	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	17%	0.167	C	C	.	.	H	α-helix	trans	-63.9	-48.7	172.1	-69	164.5	0	0	0	110.6	K122 F123 G128 T129 F130 V280 F308 Y321 V323	K122-I126 WeakPolarHBondContact O-CG1 3.4Å; K122-I126 PolarHBondContact O-N 3.5Å; F123-I126 HydrophobicContact CD2-CB 4.47Å; F123-I126 HydrophobicContact CD2-CD1 4.4Å; F123-I126 WeakPolarHBondContact O-CB 3.4Å; F123-I126 PolarHBondContact O-N 3.18Å; F123-I126 VanDerWaalsContact O-N 3.09Å; I126-G128 PolarHBondContact O-N 3.41Å; I126-T129 PolarHBondContact O-N 3.21Å; I126-T129 VanDerWaalsContact O-N 3.15Å; I126-F130 HydrophobicContact CG2-CD2 4.08Å; I126-F130 WeakPolarHBondContact O-CD2 3.29Å; I126-F130 PolarHBondContact O-N 2.92Å; I126-V280 HydrophobicContact CD1-CG1 3.99Å; I126-V280 HydrophobicContact CG2-CG2 4.19Å; I126-F308 HydrophobicContact CG1-CD1 3.85Å; I126-F308 HydrophobicContact CG1-CE1 4.02Å; I126-Y321 HydrophobicContact CD1-CD1 3.94Å; I126-Y321 HydrophobicContact CD1-CD2 4.17Å; I126-Y321 HydrophobicContact CD1-CG 3.72Å; I126-V323 HydrophobicContact CG2-CG2 4.13Å
127	L	97.9	Very high	96.1	Very high	3 Å²	3	30.6 Å²	30.6	2%	0.016	17%	0.165	C	C	.	.	H	α-helix	trans	-60.6	-29.9	177.8	-71	170	0	0	0	113.4	F123 Y124 L132 L133 L159 Y162	F123-L127 HydrophobicContact CD1-CD1 3.76Å; F123-L127 HydrophobicContact CD1-CG 4.15Å; F123-L127 HydrophobicContact CE1-CD1 3.64Å; F123-L127 HydrophobicContact CE1-CD2 4.11Å; F123-L127 HydrophobicContact CE1-CG 3.89Å; F123-L127 HydrophobicContact CZ-CD1 4.41Å; F123-L127 HydrophobicContact CZ-CD2 4.11Å; F123-L127 HydrophobicContact CZ-CG 4.19Å; F123-L127 WeakPolarHBondContact O-CG 3.18Å; F123-L127 PolarHBondContact O-N 3.23Å; Y124-L127 PolarHBondContact O-N 3.2Å; L127-L132 HydrophobicContact CD2-CB 4.3Å; L127-L132 HydrophobicContact CD2-CD2 3.67Å; L127-L133 HydrophobicContact CD2-CD2 4.27Å; L127-L159 HydrophobicContact CD1-CD1 4.19Å; L127-L159 HydrophobicContact CD2-CD1 4.04Å; L127-Y162 HydrophobicContact CB-CD2 3.75Å; L127-Y162 HydrophobicContact CB-CE2 3.77Å; L127-Y162 HydrophobicContact CB-CG 4.25Å; L127-Y162 HydrophobicContact CD1-CD2 4.12Å; L127-Y162 HydrophobicContact CD1-CG 3.94Å; L127-Y162 PolarHBondContact O-OH 3.42Å
128	G	96.1	Very high	96.1	Very high	37 Å²	37	30.8 Å²	30.8	38%	0.381	16%	0.164	S	C	.	.	H	α-helix	trans	-87.5	-18.7	177.9	0	0	0	0	0	114.4	Y124 E125 I126	Y124-G128 PolarHBondContact O-N 3.36Å; E125-G128 PolarHBondContact O-N 2.88Å; I126-G128 PolarHBondContact O-N 3.41Å
129	T	97.4	Very high	95.9	Very high	48 Å²	48	35.9 Å²	35.9	29%	0.294	19%	0.188	S	C	.	.	H	α-helix	trans	-96.8	-32.9	-178.8	-58.8	0	0	0	0	112.5	E125 I126	E125-T129 VanDerWaalsContact O-CB 3.25Å; E125-T129 WeakPolarHBondContact O-CB 3.39Å; E125-T129 PolarHBondContact O-N 3.44Å; E125-T129 PolarHBondContact O-OG1 3.44Å; I126-T129 PolarHBondContact O-N 3.21Å; I126-T129 VanDerWaalsContact O-N 3.15Å
130	F	97.8	Very high	95.6	Very high	22 Å²	22	40.9 Å²	40.9	10%	0.096	21%	0.212	C	C	.	.	S	Bend	trans	-119.3	145.5	-175.1	-60	-86.5	0	0	0	111.4	V38 I126 L132 F308 V323 L325	V38-F130 HydrophobicContact CG2-CE1 4.21Å; V38-F130 HydrophobicContact CG2-CZ 3.82Å; I126-F130 HydrophobicContact CG2-CD2 4.08Å; I126-F130 WeakPolarHBondContact O-CD2 3.29Å; I126-F130 PolarHBondContact O-N 2.92Å; F130-L132 PolarHBondContact O-N 3.25Å; F130-F308 HydrophobicContact CE2-CB 4.04Å; F130-F308 AromaticContact CE2-CD1 3.77Å; F130-F308 HydrophobicContact CE2-CD1 3.77Å; F130-F308 HydrophobicContact CE2-CD2 4.39Å; F130-F308 HydrophobicContact CE2-CE1 4.28Å; F130-F308 AromaticContact CE2-CG 3.82Å; F130-F308 HydrophobicContact CE2-CG 3.82Å; F130-F308 HydrophobicContact CZ-CB 3.95Å; F130-F308 HydrophobicContact CZ-CD1 4.47Å; F130-F308 HydrophobicContact CZ-CD2 4.45Å; F130-F308 HydrophobicContact CZ-CG 4.06Å; F130-V323 HydrophobicContact CB-CG1 4.15Å; F130-V323 HydrophobicContact CD1-CB 4.44Å; F130-V323 HydrophobicContact CD1-CG1 4Å; F130-V323 HydrophobicContact CD2-CB 4.47Å; F130-V323 HydrophobicContact CD2-CG1 4.11Å; F130-V323 HydrophobicContact CD2-CG2 4.11Å; F130-V323 HydrophobicContact CE1-CB 4.38Å; F130-V323 HydrophobicContact CE1-CG1 4.43Å; F130-V323 HydrophobicContact CE2-CB 4.43Å; F130-V323 HydrophobicContact CE2-CG2 3.91Å; F130-V323 HydrophobicContact CG-CB 4.48Å; F130-V323 HydrophobicContact CG-CG1 3.82Å; F130-V323 HydrophobicContact CZ-CB 4.37Å; F130-V323 HydrophobicContact CZ-CG2 4.21Å; F130-L325 HydrophobicContact CB-CD1 4.41Å; F130-L325 HydrophobicContact CD1-CD1 4.39Å
131	D	95.9	Very high	95.4	Very high	128 Å²	128	42.1 Å²	42.1	68%	0.684	23%	0.225	S	C	*	.			trans	-72.4	63.3	169.7	-74.2	-19.5	0	0	0	110.4	L133	D131-L133 VanDerWaalsContact C-N 3.34Å; D131-L133 PolarHBondContact O-N 2.87Å
132	L	96.8	Very high	95.3	Very high	2 Å²	2	44.7 Å²	44.7	1%	0.01	24%	0.237	C	C	.	.			trans	-68.7	-34.4	-172.2	-169.1	71.6	0	0	0	112.2	F123 L127 F130 P134 V238 S278 V280 V323 L325	F123-L132 HydrophobicContact CE2-CD2 3.92Å; F123-L132 HydrophobicContact CZ-CD2 3.81Å; L127-L132 HydrophobicContact CD2-CB 4.3Å; L127-L132 HydrophobicContact CD2-CD2 3.67Å; F130-L132 PolarHBondContact O-N 3.25Å; L132-P134 WeakPolarHBondContact O-CD 3.26Å; L132-V238 HydrophobicContact CD2-CG1 4.05Å; L132-V238 HydrophobicContact CG-CG1 4.3Å; L132-S278 WeakPolarHBondContact O-CB 3.39Å; L132-S278 PolarHBondContact O-OG 2.85Å; L132-V280 HydrophobicContact CD1-CG2 3.47Å; L132-V280 VanDerWaalsContact CD1-CG2 3.47Å; L132-V280 HydrophobicContact CD2-CG2 3.93Å; L132-V280 HydrophobicContact CG-CG2 4.38Å; L132-V323 HydrophobicContact CD1-CG1 4.22Å; L132-L325 HydrophobicContact CD1-CD2 3.93Å
133	L	96.8	Very high	95.2	Very high	16 Å²	16	44 Å²	44	8%	0.084	23%	0.234	C	C	.	.	S	Bend	trans	-86	119	-175.3	-51.8	-174.8	0	0	0	110	L127 D131 K135 L138 L143 L159 Y162 M163 T169 V238	L127-L133 HydrophobicContact CD2-CD2 4.27Å; D131-L133 VanDerWaalsContact C-N 3.34Å; D131-L133 PolarHBondContact O-N 2.87Å; L133-K135 PolarHBondContact O-N 2.85Å; L133-L138 HydrophobicContact CB-CD1 4.17Å; L133-L138 HydrophobicContact CB-CD2 4.34Å; L133-L138 HydrophobicContact CB-CG 4.39Å; L133-L138 HydrophobicContact CD1-CD2 4.38Å; L133-L143 HydrophobicContact CB-CD1 4.22Å; L133-L143 HydrophobicContact CD2-CD1 4.14Å; L133-L143 HydrophobicContact CD2-CD2 4.1Å; L133-L159 HydrophobicContact CD2-CD1 4.07Å; L133-Y162 HydrophobicContact CD1-CD1 4.21Å; L133-Y162 HydrophobicContact CD1-CE1 3.98Å; L133-M163 HydrophobicContact CD1-SD 3.73Å; L133-T169 HydrophobicContact CD1-CG2 3.71Å; L133-V238 HydrophobicContact CD2-CG2 3.98Å
134	P	93.6	Very high	95.2	Very high	11 Å²	11	44.5 Å²	44.5	7%	0.071	24%	0.237	C	C	.	.			trans	-59.4	128.9	-178.8	-25.2	35.4	0	0	0	111.9	L132 E136 A137 L138 D237	L132-P134 WeakPolarHBondContact O-CD 3.26Å; P134-E136 PolarHBondContact O-N 2.81Å; P134-A137 HydrophobicContact CB-CB 4.29Å; P134-A137 WeakPolarHBondContact O-CB 3.37Å; P134-A137 PolarHBondContact O-N 3.41Å; P134-L138 PolarHBondContact O-N 3.06Å; P134-D237 HydrophobicContact CG-CB 4.06Å
135	K	91.7	Very high	95.2	Very high	144 Å²	144	44.4 Å²	44.4	63%	0.626	24%	0.236	S	C	*	.	H	α-helix	trans	-57.2	-36.9	-178.7	-67.9	-179.3	-178.3	174.7	0	112.5	L133 L138 Q139	L133-K135 PolarHBondContact O-N 2.85Å; K135-L138 PolarHBondContact O-N 2.9Å; K135-Q139 WeakPolarHBondContact O-CB 3.31Å; K135-Q139 VanDerWaalsContact O-CG 3.23Å; K135-Q139 WeakPolarHBondContact O-CG 3.13Å; K135-Q139 PolarHBondContact O-N 3.48Å
136	E	90.9	Very high	95.3	Very high	110 Å²	110	44.4 Å²	44.4	51%	0.514	24%	0.236	S	C	.	.	H	α-helix	trans	-61.3	-42.5	176.4	-65.2	-178.7	172.3	0	0	112.6	P134 L138 Q139 N140 R235	P134-E136 PolarHBondContact O-N 2.81Å; E136-L138 VanDerWaalsContact C-N 3.35Å; E136-Q139 PolarHBondContact O-N 2.93Å; E136-N140 WeakPolarHBondContact O-CB 3.41Å; E136-N140 PolarHBondContact O-N 2.79Å; E136-N140 PolarHBondContact O-ND2 2.8Å; E136-N140 VanDerWaalsContact O-ND2 3.14Å; E136-R235 IonicContact OE2-NH1 2.94Å; E136-R235 PolarHBondContact OE2-NH1 2.87Å; E136-R235 VanDerWaalsContact OE2-NH1 3.1Å
137	A	92.3	Very high	95.3	Very high	0 Å²	0	44.4 Å²	44.4	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.8	-43.5	178.6	0	0	0	0	0	110.7	P134 Q139 N140 G141 E142 L143	P134-A137 HydrophobicContact CB-CB 4.29Å; P134-A137 WeakPolarHBondContact O-CB 3.37Å; P134-A137 PolarHBondContact O-N 3.41Å; A137-Q139 PolarHBondContact O-N 2.63Å; A137-N140 PolarHBondContact O-N 2.89Å; A137-G141 PolarHBondContact O-N 2.75Å; A137-E142 WeakPolarHBondContact CB-O 3.36Å; A137-E142 PolarHBondContact O-N 3.04Å; A137-L143 HydrophobicContact CB-CD1 4.03Å
138	L	92.4	Very high	95.3	Very high	45 Å²	45	44.2 Å²	44.2	24%	0.236	24%	0.235	C	C	.	.	H	α-helix	trans	-64.1	-38.5	175.8	-58.6	-176.2	0	0	0	112.7	L133 P134 K135 E136 G141 L143 T169 C172	L133-L138 HydrophobicContact CB-CD1 4.17Å; L133-L138 HydrophobicContact CB-CD2 4.34Å; L133-L138 HydrophobicContact CB-CG 4.39Å; L133-L138 HydrophobicContact CD1-CD2 4.38Å; P134-L138 PolarHBondContact O-N 3.06Å; K135-L138 PolarHBondContact O-N 2.9Å; E136-L138 VanDerWaalsContact C-N 3.35Å; L138-G141 PolarHBondContact O-N 3.17Å; L138-L143 HydrophobicContact CD2-CD1 4.39Å; L138-T169 HydrophobicContact CD1-CG2 4.3Å; L138-T169 HydrophobicContact CD2-CG2 3.95Å; L138-C172 HydrophobicContact CD2-CB 4.47Å
139	Q	90.9	Very high	95.3	Very high	155 Å²	155	43.8 Å²	43.8	72%	0.724	23%	0.226	S	C	*	.	H	α-helix	trans	-68.3	-38.1	176.2	-74.8	169.5	-3.7	0	0	112.5	K135 E136 A137 G141	K135-Q139 WeakPolarHBondContact O-CB 3.31Å; K135-Q139 VanDerWaalsContact O-CG 3.23Å; K135-Q139 WeakPolarHBondContact O-CG 3.13Å; K135-Q139 PolarHBondContact O-N 3.48Å; E136-Q139 PolarHBondContact O-N 2.93Å; A137-Q139 PolarHBondContact O-N 2.63Å; Q139-G141 PolarHBondContact O-N 2.83Å
140	N	90.3	Very high	95.2	Very high	122 Å²	122	41.7 Å²	41.7	65%	0.652	21%	0.213	S	C	*	.	H	α-helix	trans	-74.4	-13.7	176.2	-67.6	-26.1	0	0	0	112.7	E136 A137 E142	E136-N140 WeakPolarHBondContact O-CB 3.41Å; E136-N140 PolarHBondContact O-N 2.79Å; E136-N140 PolarHBondContact O-ND2 2.8Å; E136-N140 VanDerWaalsContact O-ND2 3.14Å; A137-N140 PolarHBondContact O-N 2.89Å; N140-E142 VanDerWaalsContact C-N 3.34Å
141	G	93.2	Very high	94.8	Very high	26 Å²	26	41 Å²	41	27%	0.268	21%	0.212	S	C	.	.	T	Hydrogen-bonded Turn	trans	78.3	13.3	177.9	0	0	0	0	0	114.6	A137 L138 Q139 D173	A137-G141 PolarHBondContact O-N 2.75Å; L138-G141 PolarHBondContact O-N 3.17Å; Q139-G141 PolarHBondContact O-N 2.83Å; G141-D173 PolarHBondContact O-N 3.24Å
142	E	95.3	Very high	94.6	Very high	53 Å²	53	35.9 Å²	35.9	25%	0.248	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	122.1	-179.3	-170.3	-173.2	158.6	0	0	109.7	A137 N140 N144 D173 R234	A137-E142 WeakPolarHBondContact CB-O 3.36Å; A137-E142 PolarHBondContact O-N 3.04Å; N140-E142 VanDerWaalsContact C-N 3.34Å; E142-N144 PolarHBondContact OE1-ND2 3.34Å; E142-N144 VanDerWaalsContact OE1-ND2 3.16Å; E142-D173 WeakPolarHBondContact CA-O 3.43Å; E142-R234 WeakPolarHBondContact OE2-CD 3.28Å; E142-R234 IonicContact OE2-CZ 3.16Å; E142-R234 IonicContact OE2-NE 3.1Å; E142-R234 IonicContact OE2-NH1 3.1Å; E142-R234 PolarHBondContact OE2-NH1 3.03Å
143	L	97.4	Very high	94.4	Very high	0 Å²	0	35.8 Å²	35.8	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	132.1	176.1	-174.1	100.8	0	0	0	109.5	L133 A137 L138 M163 D173 W174 G175 D237	L133-L143 HydrophobicContact CB-CD1 4.22Å; L133-L143 HydrophobicContact CD2-CD1 4.14Å; L133-L143 HydrophobicContact CD2-CD2 4.1Å; A137-L143 HydrophobicContact CB-CD1 4.03Å; L138-L143 HydrophobicContact CD2-CD1 4.39Å; L143-M163 HydrophobicContact CB-CE 4.2Å; L143-M163 HydrophobicContact CD2-CE 3.99Å; L143-M163 HydrophobicContact CD2-SD 3.92Å; L143-D173 PolarHBondContact N-O 3.22Å; L143-W174 HydrophobicContact CD2-CG 4.5Å; L143-W174 VanDerWaalsContact O-CA 3.31Å; L143-W174 WeakPolarHBondContact O-CA 3.45Å; L143-G175 PolarHBondContact O-N 3.13Å; L143-D237 HydrophobicContact CD1-CB 4.1Å; L143-D237 HydrophobicContact CG-CB 4.43Å
144	N	98.1	Very high	94.4	Very high	10 Å²	10	35.1 Å²	35.1	5%	0.053	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127.6	177	-71	-55	0	0	0	111.4	E142 G175 M233 R235 D237 V238	E142-N144 PolarHBondContact OE1-ND2 3.34Å; E142-N144 VanDerWaalsContact OE1-ND2 3.16Å; N144-G175 VanDerWaalsContact CA-O 3.31Å; N144-G175 WeakPolarHBondContact CA-O 3.41Å; N144-M233 HydrophobicContact CB-CB 4.35Å; N144-M233 HydrophobicContact CB-CG 4.35Å; N144-M233 HydrophobicContact CB-SD 3.9Å; N144-R235 WeakPolarHBondContact CB-O 3.24Å; N144-R235 PolarHBondContact ND2-O 3.31Å; N144-D237 PolarHBondContact N-OD2 3.02Å; N144-D237 WeakPolarHBondContact O-CB 3.28Å; N144-D237 PolarHBondContact O-N 3.09Å; N144-V238 PolarHBondContact O-N 2.96Å
145	S	98.6	Very high	94.6	Very high	0 Å²	0	34.6 Å²	34.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	149.2	179.6	62.7	0	0	0	0	113.7	H147 W174 G175 W176 V177 V238	S145-H147 PolarHBondContact OG-NE2 3.27Å; S145-W174 PolarHBondContact OG-NE1 3.46Å; S145-G175 PolarHBondContact N-O 3.05Å; S145-W176 CarbonylContact O-C 3.53Å; S145-W176 VanDerWaalsContact O-CA 3.24Å; S145-W176 WeakPolarHBondContact O-CA 3.41Å; S145-V177 PolarHBondContact O-N 3.31Å; S145-V238 CarbonylContact C-O 3.46Å; S145-V238 WeakPolarHBondContact CA-O 3.4Å
146	V	98.8	Very high	94.9	Very high	0 Å²	0	27.7 Å²	27.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	129.4	171.8	-179.9	0	0	0	0	109.4	L148 V177 V230 M233 V236 V238 V239 T240 L272	V146-L148 HydrophobicContact CG1-CD2 3.98Å; V146-V177 CarbonylContact C-O 3.51Å; V146-V177 VanDerWaalsContact CA-O 3.28Å; V146-V177 WeakPolarHBondContact CA-O 3.49Å; V146-V230 HydrophobicContact CG2-CG1 3.89Å; V146-M233 HydrophobicContact CG2-SD 4.48Å; V146-V236 HydrophobicContact CB-CG1 4.42Å; V146-V236 HydrophobicContact CG2-CG1 3.81Å; V146-V236 HydrophobicContact CG2-CG2 4.33Å; V146-V238 PolarHBondContact N-O 3.38Å; V146-V239 HydrophobicContact CB-CG2 4.25Å; V146-V239 CarbonylContact O-C 3.55Å; V146-V239 VanDerWaalsContact O-CA 3.23Å; V146-V239 WeakPolarHBondContact O-CA 3.46Å; V146-T240 PolarHBondContact O-N 3Å; V146-L272 HydrophobicContact CG1-CD1 4.05Å
147	H	98.7	Very high	95.2	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-118	112.4	-176.3	-57.4	-91.4	0	0	0	110.4	S145 E150 I156 V177 A178 N179 T240	S145-H147 PolarHBondContact OG-NE2 3.27Å; H147-E150 HydrophobicContact CB-CB 3.71Å; H147-E150 HydrophobicContact CB-CG 3.56Å; H147-I156 HydrophobicContact CB-CG1 4.14Å; H147-V177 PolarHBondContact N-O 2.93Å; H147-A178 HydrophobicContact CB-CB 4.19Å; H147-A178 CarbonylContact O-C 3.58Å; H147-A178 VanDerWaalsContact O-CA 3.22Å; H147-A178 WeakPolarHBondContact O-CA 3.36Å; H147-N179 PolarHBondContact O-N 2.86Å; H147-T240 PolarHBondContact ND1-OG1 3.46Å
148	L	98.6	Very high	95.5	Very high	0 Å²	0	22.6 Å²	22.6	0%	0	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.9	140.3	-178	-53.3	179.1	0	0	0	110.4	V146 E150 N179 I217 L226 V239 T240 A241 D242 E265 A268	V146-L148 HydrophobicContact CG1-CD2 3.98Å; L148-E150 PolarHBondContact O-N 2.9Å; L148-N179 HydrophobicContact CD2-CB 4.44Å; L148-I217 HydrophobicContact CD2-CD1 4.47Å; L148-L226 HydrophobicContact CD2-CD2 3.81Å; L148-V239 HydrophobicContact CD1-CG1 4.04Å; L148-V239 HydrophobicContact CG-CG1 4.23Å; L148-T240 PolarHBondContact N-O 3.02Å; L148-A241 HydrophobicContact CB-CB 4.3Å; L148-D242 PolarHBondContact O-N 3.04Å; L148-E265 HydrophobicContact CB-CG 4.5Å; L148-E265 HydrophobicContact CD1-CB 4.3Å; L148-E265 HydrophobicContact CD1-CG 4.42Å; L148-A268 HydrophobicContact CD1-CB 3.65Å
149	C	96.1	Very high	95.8	Very high	27 Å²	27	20.5 Å²	20.5	18%	0.182	11%	0.113	C	C	.	.	S	Bend	trans	51	41	-178.9	-57.3	0	0	0	0	113.5	N179 E265	C149-N179 WeakPolarHBondContact CA-O 3.37Å; C149-N179 PolarHBondContact N-O 3.08Å; C149-E265 WeakPolarHBondContact CB-OE1 3.36Å; C149-E265 PolarHBondContact SG-OE1 3.25Å
150	E	94.7	Very high	96.1	Very high	5 Å²	5	13.5 Å²	13.5	2%	0.023	8%	0.081	C	C	.	.			trans	-88.3	-9.3	-158.4	174.3	53.3	-149.9	0	0	115.1	H147 L148 G153 A154 F155 I156 A178 N179 W207	H147-E150 HydrophobicContact CB-CB 3.71Å; H147-E150 HydrophobicContact CB-CG 3.56Å; L148-E150 PolarHBondContact O-N 2.9Å; E150-G153 WeakPolarHBondContact O-CA 3.45Å; E150-G153 PolarHBondContact O-N 2.98Å; E150-G153 VanDerWaalsContact OE1-CA 3.28Å; E150-G153 WeakPolarHBondContact OE1-CA 3.4Å; E150-A154 PolarHBondContact OE1-N 3.3Å; E150-A154 VanDerWaalsContact OE1-N 3.09Å; E150-F155 WeakPolarHBondContact OE1-CA 3.48Å; E150-F155 WeakPolarHBondContact OE1-CB 3.44Å; E150-F155 PolarHBondContact OE1-N 2.78Å; E150-F155 WeakPolarHBondContact OE2-CB 3.37Å; E150-I156 HydrophobicContact CG-CD1 3.36Å; E150-I156 HydrophobicContact CG-CG1 3.58Å; E150-I156 PolarHBondContact OE1-N 3.28Å; E150-I156 VanDerWaalsContact OE1-N 3.15Å; E150-A178 HydrophobicContact CB-CB 4.39Å; E150-A178 HydrophobicContact CG-CB 4.46Å; E150-N179 PolarHBondContact N-O 3.35Å; E150-W207 HydrophobicContact CB-CH2 4.29Å; E150-W207 HydrophobicContact CB-CZ3 4.23Å; E150-W207 HydrophobicContact CG-CH2 4.18Å
151	A	90.6	Very high	96.4	Very high	8 Å²	8	7.7 Å²	7.7	7%	0.066	5%	0.05	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.1	138.8	-176.9	0	0	0	0	0	111.6	T180 I194 I200	A151-T180 HydrophobicContact CB-CG2 4Å; A151-T180 VanDerWaalsContact CB-OG1 3.25Å; A151-T180 WeakPolarHBondContact CB-OG1 3.23Å; A151-I194 HydrophobicContact CB-CB 3.95Å; A151-I194 HydrophobicContact CB-CD1 4.18Å; A151-I194 HydrophobicContact CB-CG2 4.41Å; A151-I194 WeakPolarHBondContact O-CD1 3.33Å; A151-I200 HydrophobicContact CB-CD1 4.19Å
152	P	90.3	Very high	96.6	Very high	19 Å²	19	8 Å²	8	12%	0.123	4%	0.043	C	C	.	.	T	Hydrogen-bonded Turn	cis	-85	5.1	4.4	37.4	-37.8	0	0	0	114.7	I115 I194 D196 L199	I115-P152 HydrophobicContact CG2-CG 4.08Å; P152-I194 HydrophobicContact CB-CG2 4.18Å; P152-D196 HydrophobicContact CB-CB 3.88Å; P152-D196 WeakPolarHBondContact CB-O 3.47Å; P152-L199 WeakPolarHBondContact O-CB 3.22Å
153	G	94.4	Very high	96.7	Very high	0 Å²	0	5.6 Å²	5.6	0%	0	3%	0.032	C	C	.	.	T	Hydrogen-bonded Turn	trans	108	26.5	-177.3	0	0	0	0	0	115.5	E150 I156 T157	E150-G153 WeakPolarHBondContact O-CA 3.45Å; E150-G153 PolarHBondContact O-N 2.98Å; E150-G153 VanDerWaalsContact OE1-CA 3.28Å; E150-G153 WeakPolarHBondContact OE1-CA 3.4Å; G153-I156 PolarHBondContact O-N 3.15Å; G153-T157 WeakPolarHBondContact O-CG2 3.36Å; G153-T157 PolarHBondContact O-N 3.04Å; G153-T157 PolarHBondContact O-OG1 3.17Å
154	A	95.4	Very high	96.6	Very high	2 Å²	2	7.9 Å²	7.9	2%	0.017	4%	0.042	C	C	.	.	H	α-helix	trans	-71.2	-34.7	-173.1	0	0	0	0	0	113.5	T117 A119 W120 E150 T157 A158	T117-A154 VanDerWaalsContact OG1-CB 3.28Å; T117-A154 WeakPolarHBondContact OG1-CB 3.15Å; A119-A154 HydrophobicContact CB-CB 3.81Å; W120-A154 HydrophobicContact CB-CB 4.3Å; E150-A154 PolarHBondContact OE1-N 3.3Å; E150-A154 VanDerWaalsContact OE1-N 3.09Å; A154-T157 PolarHBondContact O-OG1 3.23Å; A154-A158 VanDerWaalsContact O-CB 3.24Å; A154-A158 WeakPolarHBondContact O-CB 3.34Å; A154-A158 PolarHBondContact O-N 3.21Å
155	F	98.2	Very high	96.4	Very high	0 Å²	0	8.8 Å²	8.8	0%	0	5%	0.048	C	C	.	.	H	α-helix	trans	-74	-37.2	175.3	-72.5	18.1	0	0	0	110	A119 F123 E150 A158 L159 T240 D242 Y321	A119-F155 HydrophobicContact CB-CD1 4.38Å; A119-F155 HydrophobicContact CB-CE1 4.04Å; A119-F155 WeakPolarHBondContact O-CE1 3.48Å; F123-F155 HydrophobicContact CB-CB 4.29Å; F123-F155 HydrophobicContact CB-CD1 3.41Å; F123-F155 VanDerWaalsContact CB-CD1 3.41Å; F123-F155 HydrophobicContact CB-CD2 4.07Å; F123-F155 HydrophobicContact CB-CE1 3.56Å; F123-F155 HydrophobicContact CB-CE2 4.2Å; F123-F155 HydrophobicContact CB-CG 3.66Å; F123-F155 HydrophobicContact CB-CZ 3.94Å; F123-F155 HydrophobicContact CD1-CB 3.75Å; F123-F155 HydrophobicContact CD1-CD1 4.49Å; F123-F155 HydrophobicContact CD1-CD2 4.29Å; F123-F155 AromaticContact CD1-CG 3.96Å; F123-F155 HydrophobicContact CD1-CG 3.96Å; F123-F155 HydrophobicContact CD2-CB 4.32Å; F123-F155 HydrophobicContact CD2-CD1 4.27Å; F123-F155 AromaticContact CD2-CD2 3.32Å; F123-F155 HydrophobicContact CD2-CD2 3.32Å; F123-F155 HydrophobicContact CD2-CE1 4.39Å; F123-F155 AromaticContact CD2-CE2 3.46Å; F123-F155 HydrophobicContact CD2-CE2 3.46Å; F123-F155 VanDerWaalsContact CD2-CE2 3.46Å; F123-F155 AromaticContact CD2-CG 3.74Å; F123-F155 HydrophobicContact CD2-CG 3.74Å; F123-F155 AromaticContact CD2-CZ 4Å; F123-F155 HydrophobicContact CD2-CZ 4Å; F123-F155 HydrophobicContact CE1-CB 4.14Å; F123-F155 AromaticContact CE2-CD2 3.76Å; F123-F155 HydrophobicContact CE2-CD2 3.76Å; F123-F155 HydrophobicContact CE2-CE2 4.11Å; F123-F155 HydrophobicContact CE2-CG 4.39Å; F123-F155 HydrophobicContact CG-CB 3.85Å; F123-F155 AromaticContact CG-CD1 3.83Å; F123-F155 HydrophobicContact CG-CD1 3.83Å; F123-F155 AromaticContact CG-CD2 3.63Å; F123-F155 HydrophobicContact CG-CD2 3.63Å; F123-F155 HydrophobicContact CG-CE1 4.21Å; F123-F155 HydrophobicContact CG-CE2 4.02Å; F123-F155 AromaticContact CG-CG 3.5Å; F123-F155 HydrophobicContact CG-CG 3.5Å; F123-F155 VanDerWaalsContact CG-CG 3.5Å; F123-F155 HydrophobicContact CG-CZ 4.27Å; F123-F155 HydrophobicContact CZ-CD2 4.41Å; E150-F155 WeakPolarHBondContact OE1-CA 3.48Å; E150-F155 WeakPolarHBondContact OE1-CB 3.44Å; E150-F155 PolarHBondContact OE1-N 2.78Å; E150-F155 WeakPolarHBondContact OE2-CB 3.37Å; F155-A158 PolarHBondContact O-N 2.85Å; F155-L159 WeakPolarHBondContact O-CB 3.48Å; F155-L159 PolarHBondContact O-N 2.92Å; F155-T240 HydrophobicContact CD2-CG2 4.16Å; F155-D242 HydrophobicContact CE2-CB 4.19Å; F155-D242 HydrophobicContact CZ-CB 4.15Å; F155-Y321 HydrophobicContact CE2-CE1 4.16Å; F155-Y321 HydrophobicContact CZ-CD1 4.46Å; F155-Y321 AromaticContact CZ-CE1 3.59Å; F155-Y321 HydrophobicContact CZ-CE1 3.59Å
156	I	98.4	Very high	96.1	Very high	0 Å²	0	10.7 Å²	10.7	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-57.6	-51.7	174.5	-59.5	163.8	0	0	0	110.2	H147 E150 G153 A158 L159 N160 W174 W176 A178 L199 W207 I427	H147-I156 HydrophobicContact CB-CG1 4.14Å; E150-I156 HydrophobicContact CG-CD1 3.36Å; E150-I156 HydrophobicContact CG-CG1 3.58Å; E150-I156 PolarHBondContact OE1-N 3.28Å; E150-I156 VanDerWaalsContact OE1-N 3.15Å; G153-I156 PolarHBondContact O-N 3.15Å; I156-A158 VanDerWaalsContact C-N 3.34Å; I156-A158 PolarHBondContact O-N 3.48Å; I156-L159 PolarHBondContact O-N 3.25Å; I156-N160 PolarHBondContact O-N 3.47Å; I156-W174 HydrophobicContact CG2-CH2 3.71Å; I156-W174 HydrophobicContact CG2-CZ2 4.27Å; I156-W174 VanDerWaalsContact O-CH2 3.32Å; I156-W174 WeakPolarHBondContact O-CH2 3.44Å; I156-W176 HydrophobicContact CD1-CE3 3.85Å; I156-W176 HydrophobicContact CD1-CH2 4.23Å; I156-W176 HydrophobicContact CD1-CZ3 3.59Å; I156-W176 HydrophobicContact CG1-CE3 4.26Å; I156-W176 HydrophobicContact CG1-CZ3 4.46Å; I156-W176 HydrophobicContact CG2-CD2 3.86Å; I156-W176 HydrophobicContact CG2-CE3 4.03Å; I156-W176 HydrophobicContact CG2-CG 4.34Å; I156-W176 HydrophobicContact CG2-CH2 4.39Å; I156-W176 HydrophobicContact CG2-CZ2 4.23Å; I156-W176 HydrophobicContact CG2-CZ3 4.31Å; I156-A178 HydrophobicContact CD1-CB 3.69Å; I156-L199 HydrophobicContact CB-CD2 4.09Å; I156-L199 HydrophobicContact CD1-CD2 4.01Å; I156-L199 HydrophobicContact CG2-CD2 4.11Å; I156-W207 HydrophobicContact CD1-CH2 3.95Å; I156-W207 HydrophobicContact CD1-CZ2 3.86Å; I156-I427 HydrophobicContact CG2-CD1 3.53Å
157	T	97.4	Very high	95.6	Very high	2 Å²	2	18.4 Å²	18.4	1%	0.012	9%	0.094	C	C	.	.	H	α-helix	trans	-72.1	-28.2	-178.3	62.7	0	0	0	0	112.8	E114 I115 W120 G153 A154 H161 L199 I427	E114-T157 HydrophobicContact CB-CG2 4.22Å; E114-T157 HydrophobicContact CG-CG2 3.83Å; E114-T157 VanDerWaalsContact O-CB 3.29Å; E114-T157 WeakPolarHBondContact O-CB 3.26Å; E114-T157 PolarHBondContact O-OG1 3.42Å; I115-T157 HydrophobicContact CB-CG2 4.39Å; I115-T157 HydrophobicContact CD1-CG2 4.25Å; W120-T157 VanDerWaalsContact CD1-OG1 3.3Å; G153-T157 WeakPolarHBondContact O-CG2 3.36Å; G153-T157 PolarHBondContact O-N 3.04Å; G153-T157 PolarHBondContact O-OG1 3.17Å; A154-T157 PolarHBondContact O-OG1 3.23Å; T157-H161 WeakPolarHBondContact O-CB 3.39Å; T157-H161 PolarHBondContact O-N 3.03Å; T157-L199 HydrophobicContact CG2-CD1 4.12Å; T157-L199 HydrophobicContact CG2-CD2 3.91Å; T157-I427 HydrophobicContact CG2-CD1 4.19Å
158	A	98.1	Very high	95.1	Very high	0 Å²	0	22.2 Å²	22.2	0%	0	12%	0.12	C	C	.	.	H	α-helix	trans	-66.9	-43	170.3	0	0	0	0	0	111.9	W120 F123 A154 F155 I156 H161 Y162	W120-A158 HydrophobicContact CD2-CB 3.97Å; W120-A158 HydrophobicContact CG-CB 3.84Å; W120-A158 HydrophobicContact CZ2-CB 4.49Å; F123-A158 HydrophobicContact CB-CB 4.37Å; F123-A158 HydrophobicContact CD1-CB 3.95Å; A154-A158 VanDerWaalsContact O-CB 3.24Å; A154-A158 WeakPolarHBondContact O-CB 3.34Å; A154-A158 PolarHBondContact O-N 3.21Å; F155-A158 PolarHBondContact O-N 2.85Å; I156-A158 VanDerWaalsContact C-N 3.34Å; I156-A158 PolarHBondContact O-N 3.48Å; A158-H161 WeakPolarHBondContact O-CB 3.3Å; A158-H161 PolarHBondContact O-N 3.17Å; A158-Y162 WeakPolarHBondContact O-CB 3.33Å; A158-Y162 PolarHBondContact O-N 2.59Å
159	L	98.3	Very high	94.9	Very high	1 Å²	1	22.2 Å²	22.2	1%	0.005	12%	0.121	C	C	.	.	H	α-helix	trans	-63.1	-47.1	174.9	-172.1	50.3	0	0	0	110.9	F123 L127 L133 F155 I156 H161 Y162 M163 W174	F123-L159 HydrophobicContact CE1-CB 4.04Å; L127-L159 HydrophobicContact CD1-CD1 4.19Å; L127-L159 HydrophobicContact CD2-CD1 4.04Å; L133-L159 HydrophobicContact CD2-CD1 4.07Å; F155-L159 WeakPolarHBondContact O-CB 3.48Å; F155-L159 PolarHBondContact O-N 2.92Å; I156-L159 PolarHBondContact O-N 3.25Å; L159-H161 VanDerWaalsContact C-N 3.27Å; L159-H161 PolarHBondContact O-N 3.47Å; L159-Y162 PolarHBondContact O-N 2.8Å; L159-M163 HydrophobicContact CD1-CG 3.95Å; L159-M163 HydrophobicContact CD1-SD 4.38Å; L159-M163 HydrophobicContact CG-CG 4.14Å; L159-M163 WeakPolarHBondContact O-CB 3.06Å; L159-M163 WeakPolarHBondContact O-CG 3.37Å; L159-M163 PolarHBondContact O-N 3.31Å; L159-W174 HydrophobicContact CB-CH2 4.39Å; L159-W174 HydrophobicContact CB-CZ2 4.01Å; L159-W174 HydrophobicContact CD2-CZ2 3.73Å; L159-W174 HydrophobicContact CG-CZ2 3.88Å
160	N	97.6	Very high	94.5	Very high	8 Å²	8	26.2 Å²	26.2	4%	0.043	13%	0.132	C	C	.	.	H	α-helix	trans	-54.5	-47.1	174	-176.9	53.8	0	0	0	111.4	I156 Y162 M163 K164 W174 R425 I427	I156-N160 PolarHBondContact O-N 3.47Å; N160-Y162 PolarHBondContact O-N 3.35Å; N160-M163 PolarHBondContact O-N 3.09Å; N160-K164 WeakPolarHBondContact O-CB 3.32Å; N160-K164 VanDerWaalsContact O-CG 3.24Å; N160-K164 WeakPolarHBondContact O-CG 3.25Å; N160-K164 PolarHBondContact O-N 3.37Å; N160-W174 HydrophobicContact CB-CE3 4.27Å; N160-W174 HydrophobicContact CB-CH2 3.92Å; N160-W174 HydrophobicContact CB-CZ3 3.43Å; N160-W174 VanDerWaalsContact CB-CZ3 3.43Å; N160-R425 PolarHBondContact ND2-O 3.45Å; N160-I427 HydrophobicContact CB-CD1 3.78Å; N160-I427 HydrophobicContact CB-CG1 3.86Å
161	H	97.3	Very high	94.1	Very high	1 Å²	1	34.5 Å²	34.5	1%	0.005	16%	0.164	C	C	.	.	H	α-helix	trans	-58.4	-52.9	179.9	-164.2	106.6	0	0	0	110.8	A111 W120 Y124 T157 A158 L159 M163 K164 T165 S419 L421	A111-H161 PolarHBondContact O-CE1 3.24Å; W120-H161 HydrophobicContact CZ2-CB 3.69Å; W120-H161 AromaticContact CZ2-CG 3.64Å; W120-H161 AromaticContact CZ2-ND1 3.93Å; Y124-H161 HydrophobicContact CE2-CB 4.38Å; Y124-H161 AromaticContact CE2-CD2 3.77Å; T157-H161 WeakPolarHBondContact O-CB 3.39Å; T157-H161 PolarHBondContact O-N 3.03Å; A158-H161 WeakPolarHBondContact O-CB 3.3Å; A158-H161 PolarHBondContact O-N 3.17Å; L159-H161 VanDerWaalsContact C-N 3.27Å; L159-H161 PolarHBondContact O-N 3.47Å; H161-M163 PolarHBondContact O-N 2.91Å; H161-K164 PolarHBondContact O-N 2.98Å; H161-T165 WeakPolarHBondContact O-CB 3.48Å; H161-T165 WeakPolarHBondContact O-CG2 3.44Å; H161-T165 PolarHBondContact O-N 3.25Å; H161-T165 PolarHBondContact O-OG1 3.35Å; H161-S419 PolarHBondContact CE1-O 3.28Å; H161-S419 VanDerWaalsContact CE1-O 3.29Å; H161-S419 PolarHBondContact NE2-O 2.76Å; H161-L421 HydrophobicContact CB-CD2 4.41Å; H161-L421 VanDerWaalsContact CE1-CB 3.41Å; H161-L421 WeakPolarHBondContact CE1-CB 3.42Å
162	Y	97.2	Very high	94.3	Very high	33 Å²	33	34.4 Å²	34.4	13%	0.129	16%	0.163	C	C	.	.	H	α-helix	trans	-56.8	-49.8	177.5	-170.9	-83.8	0	0	0	111.7	Y124 L127 L133 A158 L159 N160 K164 T165 N166 T169	Y124-Y162 HydrophobicContact CE1-CD2 4.47Å; Y124-Y162 HydrophobicContact CE2-CD2 4.06Å; Y124-Y162 HydrophobicContact CE2-CG 4.49Å; L127-Y162 HydrophobicContact CB-CD2 3.75Å; L127-Y162 HydrophobicContact CB-CE2 3.77Å; L127-Y162 HydrophobicContact CB-CG 4.25Å; L127-Y162 HydrophobicContact CD1-CD2 4.12Å; L127-Y162 HydrophobicContact CD1-CG 3.94Å; L127-Y162 PolarHBondContact O-OH 3.42Å; L133-Y162 HydrophobicContact CD1-CD1 4.21Å; L133-Y162 HydrophobicContact CD1-CE1 3.98Å; A158-Y162 WeakPolarHBondContact O-CB 3.33Å; A158-Y162 PolarHBondContact O-N 2.59Å; L159-Y162 PolarHBondContact O-N 2.8Å; N160-Y162 PolarHBondContact O-N 3.35Å; Y162-K164 VanDerWaalsContact C-N 3.28Å; Y162-K164 PolarHBondContact O-N 3.11Å; Y162-T165 PolarHBondContact O-N 3.33Å; Y162-N166 HydrophobicContact CD1-CB 4.23Å; Y162-N166 HydrophobicContact CE1-CB 4.1Å; Y162-N166 WeakPolarHBondContact CE1-ND2 3.36Å; Y162-N166 VanDerWaalsContact O-CB 3.25Å; Y162-N166 WeakPolarHBondContact O-CB 3.17Å; Y162-N166 PolarHBondContact O-N 2.95Å; Y162-N166 PolarHBondContact OH-ND2 2.83Å; Y162-N166 VanDerWaalsContact OH-ND2 3.11Å; Y162-T169 HydrophobicContact CD1-CG2 4.43Å; Y162-T169 HydrophobicContact CE1-CG2 4.14Å; Y162-T169 PolarHBondContact O-OG1 2.91Å
163	M	96.1	Very high	94.5	Very high	1 Å²	1	39.2 Å²	39.2	1%	0.005	19%	0.188	C	C	.	.	H	α-helix	trans	-55.6	-43.9	179.6	-73.4	-58.5	-71.5	0	0	111.2	L133 L143 L159 N160 H161 T169 R170 C172 W174	L133-M163 HydrophobicContact CD1-SD 3.73Å; L143-M163 HydrophobicContact CB-CE 4.2Å; L143-M163 HydrophobicContact CD2-CE 3.99Å; L143-M163 HydrophobicContact CD2-SD 3.92Å; L159-M163 HydrophobicContact CD1-CG 3.95Å; L159-M163 HydrophobicContact CD1-SD 4.38Å; L159-M163 HydrophobicContact CG-CG 4.14Å; L159-M163 WeakPolarHBondContact O-CB 3.06Å; L159-M163 WeakPolarHBondContact O-CG 3.37Å; L159-M163 PolarHBondContact O-N 3.31Å; N160-M163 PolarHBondContact O-N 3.09Å; H161-M163 PolarHBondContact O-N 2.91Å; M163-T169 VanDerWaalsContact CA-OG1 3.3Å; M163-T169 WeakPolarHBondContact CA-OG1 3.48Å; M163-T169 CarbonylContact O-C 3.57Å; M163-T169 PolarHBondContact O-OG1 3.11Å; M163-T169 HydrophobicContact SD-CG2 3.88Å; M163-R170 WeakPolarHBondContact O-CA 3.49Å; M163-R170 PolarHBondContact O-N 3.34Å; M163-R170 VanDerWaalsContact O-N 3.16Å; M163-C172 HydrophobicContact CE-CB 3.68Å; M163-W174 HydrophobicContact CE-CB 4.26Å; M163-W174 HydrophobicContact CG-CG 4.46Å
164	K	95.5	Very high	94.6	Very high	49 Å²	49	41 Å²	41	21%	0.213	19%	0.194	C	C	.	.	H	α-helix	trans	-82.6	-21.8	-175	-62.6	-50.7	176.2	-166.3	0	114.3	N160 H161 Y162 L421 R425	N160-K164 WeakPolarHBondContact O-CB 3.32Å; N160-K164 VanDerWaalsContact O-CG 3.24Å; N160-K164 WeakPolarHBondContact O-CG 3.25Å; N160-K164 PolarHBondContact O-N 3.37Å; H161-K164 PolarHBondContact O-N 2.98Å; Y162-K164 VanDerWaalsContact C-N 3.28Å; Y162-K164 PolarHBondContact O-N 3.11Å; K164-L421 HydrophobicContact CB-CD1 3.59Å; K164-L421 HydrophobicContact CG-CD1 4.38Å; K164-R425 PolarHBondContact O-NH1 2.84Å
165	T	95	Very high	94.6	Very high	29 Å²	29	42 Å²	42	18%	0.178	21%	0.205	C	C	.	.	H	α-helix	trans	-103.6	-29.5	-176.3	59.2	0	0	0	0	114.5	H161 Y162 S419 L421	H161-T165 WeakPolarHBondContact O-CB 3.48Å; H161-T165 WeakPolarHBondContact O-CG2 3.44Å; H161-T165 PolarHBondContact O-N 3.25Å; H161-T165 PolarHBondContact O-OG1 3.35Å; Y162-T165 PolarHBondContact O-N 3.33Å; T165-S419 VanDerWaalsContact CB-OG 3.25Å; T165-S419 WeakPolarHBondContact CB-OG 3.32Å; T165-S419 WeakPolarHBondContact CG2-OG 3.34Å; T165-L421 HydrophobicContact CG2-CB 4.35Å; T165-L421 HydrophobicContact CG2-CD1 4.12Å
166	N	92.3	Very high	94.6	Very high	39 Å²	39	42.8 Å²	42.8	21%	0.209	21%	0.208	C	C	.	.	S	Bend	trans	-76.9	133.5	179.9	-172.4	-37.1	0	0	0	110.7	Y162 S168 T169 R170	Y162-N166 HydrophobicContact CD1-CB 4.23Å; Y162-N166 HydrophobicContact CE1-CB 4.1Å; Y162-N166 WeakPolarHBondContact CE1-ND2 3.36Å; Y162-N166 VanDerWaalsContact O-CB 3.25Å; Y162-N166 WeakPolarHBondContact O-CB 3.17Å; Y162-N166 PolarHBondContact O-N 2.95Å; Y162-N166 PolarHBondContact OH-ND2 2.83Å; Y162-N166 VanDerWaalsContact OH-ND2 3.11Å; N166-S168 PolarHBondContact O-N 3.14Å; N166-S168 PolarHBondContact OD1-N 3.32Å; N166-S168 PolarHBondContact OD1-OG 2.9Å; N166-T169 WeakPolarHBondContact CB-OG1 3.21Å; N166-T169 PolarHBondContact O-N 3.42Å; N166-T169 PolarHBondContact O-OG1 3.16Å; N166-R170 WeakPolarHBondContact O-CB 3.5Å; N166-R170 PolarHBondContact O-N 3.24Å
167	E	88.4	Confident	94.6	Very high	163 Å²	163	43.3 Å²	43.3	76%	0.762	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.2	-34.1	-177.2	-64.7	-168.4	158	0	0	112.9	T169	E167-T169 VanDerWaalsContact C-N 3.28Å; E167-T169 PolarHBondContact O-N 3.37Å
168	S	88.3	Confident	94.6	Very high	79 Å²	79	43.2 Å²	43.2	55%	0.552	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-19.5	-179.1	62	0	0	0	0	114	N166	N166-S168 PolarHBondContact O-N 3.14Å; N166-S168 PolarHBondContact OD1-N 3.32Å; N166-S168 PolarHBondContact OD1-OG 2.9Å
169	T	92.6	Very high	94.6	Very high	1 Å²	1	43.2 Å²	43.2	1%	0.006	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-121.2	-15.3	-171.7	58.4	0	0	0	0	114	L133 L138 Y162 M163 N166 E167 Y171 C172	L133-T169 HydrophobicContact CD1-CG2 3.71Å; L138-T169 HydrophobicContact CD1-CG2 4.3Å; L138-T169 HydrophobicContact CD2-CG2 3.95Å; Y162-T169 HydrophobicContact CD1-CG2 4.43Å; Y162-T169 HydrophobicContact CE1-CG2 4.14Å; Y162-T169 PolarHBondContact O-OG1 2.91Å; M163-T169 VanDerWaalsContact CA-OG1 3.3Å; M163-T169 WeakPolarHBondContact CA-OG1 3.48Å; M163-T169 CarbonylContact O-C 3.57Å; M163-T169 PolarHBondContact O-OG1 3.11Å; M163-T169 HydrophobicContact SD-CG2 3.88Å; N166-T169 WeakPolarHBondContact CB-OG1 3.21Å; N166-T169 PolarHBondContact O-N 3.42Å; N166-T169 PolarHBondContact O-OG1 3.16Å; E167-T169 VanDerWaalsContact C-N 3.28Å; E167-T169 PolarHBondContact O-N 3.37Å; T169-Y171 PolarHBondContact O-N 3.48Å; T169-C172 VanDerWaalsContact O-CB 3.3Å; T169-C172 WeakPolarHBondContact O-CB 3.45Å; T169-C172 PolarHBondContact O-N 3.37Å
170	R	87.8	Confident	94.4	Very high	110 Å²	110	43.7 Å²	43.7	42%	0.415	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-15.4	-169	72	-178.8	-158.6	171.4	-1.2	116.5	M163 N166	M163-R170 WeakPolarHBondContact O-CA 3.49Å; M163-R170 PolarHBondContact O-N 3.34Å; M163-R170 VanDerWaalsContact O-N 3.16Å; N166-R170 WeakPolarHBondContact O-CB 3.5Å; N166-R170 PolarHBondContact O-N 3.24Å
171	Y	87.7	Confident	94.2	Very high	179 Å²	179	45.1 Å²	45.1	70%	0.702	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-107.7	-1.4	179	-59.9	-66.4	0	0	0	113.6	T169	T169-Y171 PolarHBondContact O-N 3.48Å
172	C	93.6	Very high	94	Very high	6 Å²	6	45.1 Å²	45.1	4%	0.041	22%	0.221	C	C	.	.	S	Bend	trans	-81.6	131.9	176.9	-173.6	0	0	0	0	109.5	L138 M163 T169	L138-C172 HydrophobicContact CD2-CB 4.47Å; M163-C172 HydrophobicContact CE-CB 3.68Å; T169-C172 VanDerWaalsContact O-CB 3.3Å; T169-C172 WeakPolarHBondContact O-CB 3.45Å; T169-C172 PolarHBondContact O-N 3.37Å
173	D	94.2	Very high	93.6	Very high	121 Å²	121	44.1 Å²	44.1	65%	0.647	22%	0.219	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-72	136.9	169.3	-74.4	-31.3	0	0	0	109	G141 E142 L143	G141-D173 PolarHBondContact O-N 3.24Å; E142-D173 WeakPolarHBondContact CA-O 3.43Å; L143-D173 PolarHBondContact N-O 3.22Å
174	W	96.3	Very high	93.3	Very high	37 Å²	37	44.3 Å²	44.3	14%	0.14	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.2	115.1	-174.5	174.6	46	0	0	0	110.7	L143 S145 I156 L159 N160 M163 W176 I427	L143-W174 HydrophobicContact CD2-CG 4.5Å; L143-W174 VanDerWaalsContact O-CA 3.31Å; L143-W174 WeakPolarHBondContact O-CA 3.45Å; S145-W174 PolarHBondContact OG-NE1 3.46Å; I156-W174 HydrophobicContact CG2-CH2 3.71Å; I156-W174 HydrophobicContact CG2-CZ2 4.27Å; I156-W174 VanDerWaalsContact O-CH2 3.32Å; I156-W174 WeakPolarHBondContact O-CH2 3.44Å; L159-W174 HydrophobicContact CB-CH2 4.39Å; L159-W174 HydrophobicContact CB-CZ2 4.01Å; L159-W174 HydrophobicContact CD2-CZ2 3.73Å; L159-W174 HydrophobicContact CG-CZ2 3.88Å; N160-W174 HydrophobicContact CB-CE3 4.27Å; N160-W174 HydrophobicContact CB-CH2 3.92Å; N160-W174 HydrophobicContact CB-CZ3 3.43Å; N160-W174 VanDerWaalsContact CB-CZ3 3.43Å; M163-W174 HydrophobicContact CE-CB 4.26Å; M163-W174 HydrophobicContact CG-CG 4.46Å; W174-W176 HydrophobicContact CH2-CB 4.39Å; W174-W176 AromaticContact CH2-CD1 3.68Å; W174-W176 HydrophobicContact CH2-CG 4.04Å; W174-W176 HydrophobicContact CZ2-CB 3.69Å; W174-W176 AromaticContact CZ2-CD1 3.8Å; W174-W176 AromaticContact CZ2-CG 3.84Å; W174-W176 HydrophobicContact CZ2-CG 3.84Å; W174-W176 AromaticContact CZ3-CD1 3.85Å; W174-I427 HydrophobicContact CH2-CD1 4.03Å; W174-I427 HydrophobicContact CZ3-CD1 4Å
175	G	96.5	Very high	93.1	Very high	23 Å²	23	42.3 Å²	42.3	24%	0.237	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	144.5	167.7	0	0	0	0	0	110.6	L143 N144 S145	L143-G175 PolarHBondContact O-N 3.13Å; N144-G175 VanDerWaalsContact CA-O 3.31Å; N144-G175 WeakPolarHBondContact CA-O 3.41Å; S145-G175 PolarHBondContact N-O 3.05Å
176	W	97.7	Very high	93	Very high	16 Å²	16	41 Å²	41	6%	0.061	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.5	151.2	175.1	65.6	-86	0	0	0	111.4	S145 I156 W174 A178 T203 W206 W207 I427	S145-W176 CarbonylContact O-C 3.53Å; S145-W176 VanDerWaalsContact O-CA 3.24Å; S145-W176 WeakPolarHBondContact O-CA 3.41Å; I156-W176 HydrophobicContact CD1-CE3 3.85Å; I156-W176 HydrophobicContact CD1-CH2 4.23Å; I156-W176 HydrophobicContact CD1-CZ3 3.59Å; I156-W176 HydrophobicContact CG1-CE3 4.26Å; I156-W176 HydrophobicContact CG1-CZ3 4.46Å; I156-W176 HydrophobicContact CG2-CD2 3.86Å; I156-W176 HydrophobicContact CG2-CE3 4.03Å; I156-W176 HydrophobicContact CG2-CG 4.34Å; I156-W176 HydrophobicContact CG2-CH2 4.39Å; I156-W176 HydrophobicContact CG2-CZ2 4.23Å; I156-W176 HydrophobicContact CG2-CZ3 4.31Å; W174-W176 HydrophobicContact CH2-CB 4.39Å; W174-W176 AromaticContact CH2-CD1 3.68Å; W174-W176 HydrophobicContact CH2-CG 4.04Å; W174-W176 HydrophobicContact CZ2-CB 3.69Å; W174-W176 AromaticContact CZ2-CD1 3.8Å; W174-W176 AromaticContact CZ2-CG 3.84Å; W174-W176 HydrophobicContact CZ2-CG 3.84Å; W174-W176 AromaticContact CZ3-CD1 3.85Å; W176-A178 HydrophobicContact CE3-CB 4Å; W176-A178 HydrophobicContact CZ3-CB 3.68Å; W176-T203 HydrophobicContact CH2-CG2 4.33Å; W176-T203 HydrophobicContact CZ2-CG2 3.99Å; W176-W206 HydrophobicContact CD2-CB 4.3Å; W176-W206 HydrophobicContact CE3-CB 4.06Å; W176-W206 HydrophobicContact CH2-CB 3.45Å; W176-W206 VanDerWaalsContact CH2-CB 3.45Å; W176-W206 HydrophobicContact CH2-CG 4.22Å; W176-W206 HydrophobicContact CZ2-CB 3.7Å; W176-W206 HydrophobicContact CZ2-CD2 4.41Å; W176-W206 AromaticContact CZ2-CG 3.96Å; W176-W206 HydrophobicContact CZ2-CG 3.96Å; W176-W206 HydrophobicContact CZ3-CB 3.62Å; W176-W206 VanDerWaalsContact O-CD1 3.29Å; W176-W207 AromaticContact CH2-NE1 3.75Å; W176-I427 HydrophobicContact CZ2-CG2 4.16Å
177	V	98.3	Very high	92.9	Very high	11 Å²	11	40.1 Å²	40.1	7%	0.067	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	145	168	162.1	0	0	0	0	107.9	S145 V146 H147 F208 L226 F229 V230 M233	S145-V177 PolarHBondContact O-N 3.31Å; V146-V177 CarbonylContact C-O 3.51Å; V146-V177 VanDerWaalsContact CA-O 3.28Å; V146-V177 WeakPolarHBondContact CA-O 3.49Å; H147-V177 PolarHBondContact N-O 2.93Å; V177-F208 HydrophobicContact CG1-CB 4.4Å; V177-L226 HydrophobicContact CG1-CD1 4.11Å; V177-F229 HydrophobicContact CB-CE1 4.39Å; V177-F229 HydrophobicContact CG1-CD1 3.79Å; V177-F229 HydrophobicContact CG1-CE1 3.75Å; V177-F229 HydrophobicContact CG2-CD1 4.03Å; V177-F229 HydrophobicContact CG2-CE1 3.67Å; V177-V230 HydrophobicContact CB-CG1 4.18Å; V177-V230 HydrophobicContact CG1-CG1 4.01Å; V177-V230 HydrophobicContact CG2-CG1 4.37Å; V177-M233 HydrophobicContact CB-CE 3.84Å; V177-M233 HydrophobicContact CG2-CE 3.35Å
178	A	97.9	Very high	92.8	Very high	0 Å²	0	33.3 Å²	33.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.9	176.8	0	0	0	0	0	112.2	H147 E150 I156 W176 W206 W207 F208	H147-A178 HydrophobicContact CB-CB 4.19Å; H147-A178 CarbonylContact O-C 3.58Å; H147-A178 VanDerWaalsContact O-CA 3.22Å; H147-A178 WeakPolarHBondContact O-CA 3.36Å; E150-A178 HydrophobicContact CB-CB 4.39Å; E150-A178 HydrophobicContact CG-CB 4.46Å; I156-A178 HydrophobicContact CD1-CB 3.69Å; W176-A178 HydrophobicContact CE3-CB 4Å; W176-A178 HydrophobicContact CZ3-CB 3.68Å; A178-W206 PolarHBondContact N-O 2.61Å; A178-W207 HydrophobicContact CB-CD2 3.96Å; A178-W207 HydrophobicContact CB-CE3 3.62Å; A178-W207 HydrophobicContact CB-CH2 4.01Å; A178-W207 HydrophobicContact CB-CZ2 4.29Å; A178-W207 HydrophobicContact CB-CZ3 3.65Å; A178-W207 CarbonylContact O-C 3.44Å; A178-W207 WeakPolarHBondContact O-CA 3.43Å; A178-F208 PolarHBondContact O-N 3.14Å
179	N	97.5	Very high	91.9	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	148.1	169.8	165	-93.6	0	0	0	109.4	H147 L148 C149 E150 F208 G215 I217	H147-N179 PolarHBondContact O-N 2.86Å; L148-N179 HydrophobicContact CD2-CB 4.44Å; C149-N179 WeakPolarHBondContact CA-O 3.37Å; C149-N179 PolarHBondContact N-O 3.08Å; E150-N179 PolarHBondContact N-O 3.35Å; N179-F208 HydrophobicContact CB-CD1 4.44Å; N179-F208 PolarHBondContact ND2-O 3.19Å; N179-G215 PolarHBondContact ND2-O 2.97Å; N179-G215 VanDerWaalsContact ND2-O 3.1Å; N179-I217 WeakPolarHBondContact OD1-CB 3.39Å
180	T	95.3	Very high	90.2	Very high	11 Å²	11	31.9 Å²	31.9	7%	0.067	17%	0.168	C	C	.	.			trans	-161.5	163.3	169	-178.1	0	0	0	0	107.9	A151 N182 I200 W207 F209 G215	A151-T180 HydrophobicContact CB-CG2 4Å; A151-T180 VanDerWaalsContact CB-OG1 3.25Å; A151-T180 WeakPolarHBondContact CB-OG1 3.23Å; T180-N182 PolarHBondContact O-N 2.89Å; T180-I200 HydrophobicContact CG2-CD1 4.14Å; T180-W207 HydrophobicContact CG2-CE3 3.57Å; T180-W207 HydrophobicContact CG2-CZ3 3.46Å; T180-W207 VanDerWaalsContact CG2-CZ3 3.46Å; T180-F209 HydrophobicContact CG2-CE1 3.91Å; T180-F209 WeakPolarHBondContact O-CD1 3.43Å; T180-G215 CarbonylContact C-O 3.55Å; T180-G215 VanDerWaalsContact O-CA 3.27Å; T180-G215 WeakPolarHBondContact O-CA 3.33Å
181	L	93.2	Very high	88.8	Confident	38 Å²	38	29.1 Å²	29.1	20%	0.199	17%	0.165	C	C	.	.			trans	-53	126.9	162.1	-69.4	176.5	0	0	0	109.2	P183 T193 T214 N216	L181-P183 WeakPolarHBondContact O-CD 3.45Å; L181-T193 HydrophobicContact CB-CG2 3.98Å; L181-T193 HydrophobicContact CD1-CG2 4.39Å; L181-T214 WeakPolarHBondContact CA-O 3.36Å; L181-N216 HydrophobicContact CD2-CB 3.9Å
182	N	92.1	Very high	87.5	Confident	2 Å²	2	23.3 Å²	23.3	1%	0.011	15%	0.149	C	C	.	.			trans	-65.6	116.8	-176	-174.4	-12.6	0	0	0	110.1	T180 Y184 H185 N188 F209 N213 T214	T180-N182 PolarHBondContact O-N 2.89Å; N182-Y184 PolarHBondContact O-N 3.38Å; N182-Y184 WeakPolarHBondContact OD1-CB 3.49Å; N182-Y184 WeakPolarHBondContact OD1-CD2 3.45Å; N182-Y184 PolarHBondContact OD1-N 2.83Å; N182-H185 HydrophobicContact CB-CB 3.91Å; N182-H185 PolarHBondContact O-N 3.31Å; N182-N188 PolarHBondContact N-ND2 2.84Å; N182-N188 PolarHBondContact O-ND2 3.08Å; N182-F209 HydrophobicContact CB-CB 4.24Å; N182-F209 HydrophobicContact CB-CD1 3.46Å; N182-F209 VanDerWaalsContact CB-CD1 3.46Å; N182-F209 HydrophobicContact CB-CE1 3.87Å; N182-F209 HydrophobicContact CB-CG 3.83Å; N182-N213 WeakPolarHBondContact CB-O 3.4Å; N182-N213 VanDerWaalsContact ND2-CG 3.34Å; N182-N213 PolarHBondContact ND2-O 3.26Å; N182-N213 PolarHBondContact ND2-OD1 2.96Å; N182-T214 PolarHBondContact N-O 2.92Å
183	P	88.3	Confident	86.3	Confident	12 Å²	12	24.1 Å²	24.1	8%	0.078	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-10.4	-179.3	30.6	-37	0	0	0	113.1	L181 D197 I200 N517	L181-P183 WeakPolarHBondContact O-CD 3.45Å; P183-D197 HydrophobicContact CG-CB 4.29Å; P183-I200 HydrophobicContact CG-CD1 3.94Å; P183-I200 HydrophobicContact CG-CG2 4.47Å; P183-N517 PolarHBondContact O-ND2 3.09Å
184	Y	89.9	Confident	85.3	Confident	4 Å²	4	22.1 Å²	22.1	2%	0.016	14%	0.142	C	C	.	.	T	Hydrogen-bonded Turn	trans	-102	-6.4	178.8	-46	-57.6	0	0	0	113.3	N182 D197 I200 L204 A435 P519 R648 M731 L735	N182-Y184 PolarHBondContact O-N 3.38Å; N182-Y184 WeakPolarHBondContact OD1-CB 3.49Å; N182-Y184 WeakPolarHBondContact OD1-CD2 3.45Å; N182-Y184 PolarHBondContact OD1-N 2.83Å; Y184-D197 HydrophobicContact CE1-CB 4.41Å; Y184-D197 WeakPolarHBondContact CE1-OD2 3.25Å; Y184-D197 VanDerWaalsContact CZ-OD2 3.3Å; Y184-D197 WeakPolarHBondContact OH-CB 3.45Å; Y184-D197 PolarHBondContact OH-OD2 3.44Å; Y184-I200 HydrophobicContact CE2-CG2 4.06Å; Y184-L204 HydrophobicContact CE2-CD2 4Å; Y184-A435 HydrophobicContact CE1-CB 4.2Å; Y184-P519 HydrophobicContact CD1-CB 4.2Å; Y184-P519 HydrophobicContact CD1-CG 4.14Å; Y184-R648 WeakPolarHBondContact O-CD 3.42Å; Y184-R648 PolarHBondContact O-NE 3.07Å; Y184-R648 VanDerWaalsContact O-NE 3.1Å; Y184-M731 HydrophobicContact CD1-CE 3.59Å; Y184-M731 HydrophobicContact CD2-CB 4.44Å; Y184-M731 HydrophobicContact CD2-CE 4.44Å; Y184-M731 HydrophobicContact CD2-CG 3.95Å; Y184-M731 HydrophobicContact CE1-CE 4.05Å; Y184-M731 HydrophobicContact CG-CE 3.8Å; Y184-M731 HydrophobicContact CG-CG 4.01Å; Y184-M731 HydrophobicContact CG-SD 4.23Å; Y184-L735 HydrophobicContact CE1-CD1 3.95Å
185	H	92	Very high	83.9	Confident	8 Å²	8	22 Å²	22	4%	0.037	15%	0.148	C	C	.	.			trans	-81.1	124.1	176.7	-171.6	-71.5	0	0	0	110.3	N182 A187 N188 N213	N182-H185 HydrophobicContact CB-CB 3.91Å; N182-H185 PolarHBondContact O-N 3.31Å; H185-A187 VanDerWaalsContact C-N 3.33Å; H185-A187 PolarHBondContact ND1-N 3.37Å; H185-A187 PolarHBondContact O-N 2.79Å; H185-N188 HydrophobicContact CB-CB 4.38Å; H185-N188 VanDerWaalsContact O-CB 3.3Å; H185-N188 WeakPolarHBondContact O-CB 3.27Å; H185-N188 PolarHBondContact O-N 2.64Å; H185-N213 PolarHBondContact CD2-O 3.27Å
186	E	92.3	Very high	83.1	Confident	1 Å²	1	21.4 Å²	21.4	1%	0.005	14%	0.14	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.2	-30	-163.4	-64.8	84.4	168.2	0	0	112.9	N188 L512 V515 R516 N517 T647 R648	E186-N188 VanDerWaalsContact C-N 3.29Å; E186-L512 HydrophobicContact CB-CD1 3.88Å; E186-L512 HydrophobicContact CB-CD2 4.11Å; E186-L512 HydrophobicContact CG-CD1 4.45Å; E186-V515 HydrophobicContact CB-CG1 4.22Å; E186-V515 HydrophobicContact CB-CG2 4.19Å; E186-R516 PolarHBondContact O-N 2.94Å; E186-N517 WeakPolarHBondContact CA-O 3.46Å; E186-N517 PolarHBondContact O-N 2.87Å; E186-T647 HydrophobicContact CG-CG2 4.23Å; E186-R648 WeakPolarHBondContact OE1-CB 3.11Å; E186-R648 VanDerWaalsContact OE1-CG 3.3Å; E186-R648 WeakPolarHBondContact OE1-CG 3.4Å; E186-R648 IonicContact OE1-CZ 2.68Å; E186-R648 PolarHBondContact OE1-N 3.46Å; E186-R648 IonicContact OE1-NE 3.23Å; E186-R648 PolarHBondContact OE1-NE 3.11Å; E186-R648 IonicContact OE1-NH2 3.39Å; E186-R648 IonicContact OE2-CZ 2.76Å; E186-R648 IonicContact OE2-NE 3.39Å; E186-R648 PolarHBondContact OE2-NE 2.92Å; E186-R648 IonicContact OE2-NH2 2.65Å; E186-R648 PolarHBondContact OE2-NH2 3.19Å
187	A	90.8	Very high	82.4	Confident	21 Å²	21	20.8 Å²	20.8	17%	0.174	14%	0.138	C	C	.	.	T	Hydrogen-bonded Turn	trans	-76.1	-17.4	174.2	0	0	0	0	0	113.5	H185 G189 L512 P513 A514	H185-A187 VanDerWaalsContact C-N 3.33Å; H185-A187 PolarHBondContact ND1-N 3.37Å; H185-A187 PolarHBondContact O-N 2.79Å; A187-G189 VanDerWaalsContact C-N 3.31Å; A187-G189 PolarHBondContact O-N 2.85Å; A187-L512 HydrophobicContact CB-CD2 3.68Å; A187-P513 HydrophobicContact CB-CG 4.19Å; A187-A514 WeakPolarHBondContact CA-O 3.45Å
188	N	87.3	Confident	81.8	Confident	19 Å²	19	24.2 Å²	24.2	10%	0.102	15%	0.149	C	C	.	.			trans	-79.6	82.9	178.7	-68.6	-8.4	0	0	0	108.7	N182 H185 E186 T193 T214 N517	N182-N188 PolarHBondContact N-ND2 2.84Å; N182-N188 PolarHBondContact O-ND2 3.08Å; H185-N188 HydrophobicContact CB-CB 4.38Å; H185-N188 VanDerWaalsContact O-CB 3.3Å; H185-N188 WeakPolarHBondContact O-CB 3.27Å; H185-N188 PolarHBondContact O-N 2.64Å; E186-N188 VanDerWaalsContact C-N 3.29Å; N188-T193 HydrophobicContact CB-CG2 3.66Å; N188-T214 PolarHBondContact ND2-O 2.97Å; N188-N517 WeakPolarHBondContact O-CB 3.38Å; N188-N517 PolarHBondContact O-ND2 2.9Å
189	G	68.3	Low	81.4	Confident	11 Å²	11	24.2 Å²	24.2	11%	0.113	15%	0.149	C	C	.	.			trans	-130.8	-179.8	174.6	0	0	0	0	0	113.3	A187 T192	A187-G189 VanDerWaalsContact C-N 3.31Å; A187-G189 PolarHBondContact O-N 2.85Å; G189-T192 PolarHBondContact O-OG1 2.77Å
190	G	57.9	Low	81.1	Confident	40 Å²	40	24.2 Å²	24.2	41%	0.412	15%	0.149	S	C	.	.	S	Bend	trans	96.4	-154.9	-168.2	0	0	0	0	0	111.8	T192	G190-T192 VanDerWaalsContact C-N 3.31Å
191	S	57.4	Low	80.8	Confident	52 Å²	52	24.3 Å²	24.3	36%	0.364	15%	0.152	S	C	.	.	S	Bend	trans	-93	17.6	178.9	39	0	0	0	0	114.1	D246 K448	S191-D246 VanDerWaalsContact CB-CB 3.43Å; S191-D246 WeakPolarHBondContact CB-OD2 3.25Å; S191-D246 WeakPolarHBondContact OG-CB 3.22Å; S191-D246 PolarHBondContact OG-OD2 3.01Å; S191-K448 PolarHBondContact OG-NZ 3.06Å
192	T	60	Low	80.5	Confident	57 Å²	57	24.1 Å²	24.1	35%	0.35	15%	0.151	S	C	.	.	S	Bend	trans	-93.4	-28.1	-175.8	51.9	0	0	0	0	113.4	G189 G190 F245	G189-T192 PolarHBondContact O-OG1 2.77Å; G190-T192 VanDerWaalsContact C-N 3.31Å; T192-F245 HydrophobicContact CG2-CD1 4.33Å
193	T	69.3	Low	80.5	Confident	23 Å²	23	24.2 Å²	24.2	14%	0.141	15%	0.151	C	C	.	.	S	Bend	trans	-96.5	138.4	178.8	50.3	0	0	0	0	112.3	L181 N188	L181-T193 HydrophobicContact CB-CG2 3.98Å; L181-T193 HydrophobicContact CD1-CG2 4.39Å; N188-T193 HydrophobicContact CB-CG2 3.66Å
194	I	73.7	Confident	80.6	Confident	79 Å²	79	24.5 Å²	24.5	41%	0.405	15%	0.152	S	C	.	.			trans	-87.2	124.8	173.1	-68	168.2	0	0	0	109.2	A151 P152 D196	A151-I194 HydrophobicContact CB-CB 3.95Å; A151-I194 HydrophobicContact CB-CD1 4.18Å; A151-I194 HydrophobicContact CB-CG2 4.41Å; A151-I194 WeakPolarHBondContact O-CD1 3.33Å; P152-I194 HydrophobicContact CB-CG2 4.18Å; I194-D196 HydrophobicContact CG2-CB 4.38Å
195	A	66.6	Low	80.6	Confident	33 Å²	33	28.6 Å²	28.6	27%	0.273	18%	0.179	S	C	.	.			trans	-74.9	-26.3	-174.3	0	0	0	0	0	113.7	D197 C436	A195-D197 PolarHBondContact O-N 2.94Å; A195-C436 PolarHBondContact O-SG 2.6Å
196	D	78.6	Confident	80.7	Confident	12 Å²	12	34 Å²	34	6%	0.064	20%	0.199	C	C	.	.			trans	-72.5	100.7	178.7	-174.2	1.9	0	0	0	110.7	P152 I194 R198 L445	P152-D196 HydrophobicContact CB-CB 3.88Å; P152-D196 WeakPolarHBondContact CB-O 3.47Å; I194-D196 HydrophobicContact CG2-CB 4.38Å; D196-R198 WeakPolarHBondContact OD1-CG 3.38Å; D196-R198 IonicContact OD1-CZ 3.67Å; D196-R198 IonicContact OD1-NE 2.83Å; D196-R198 PolarHBondContact OD1-NE 3.08Å; D196-R198 IonicContact OD1-NH2 2.77Å; D196-R198 PolarHBondContact OD1-NH2 2.94Å; D196-R198 IonicContact OD2-CZ 2.72Å; D196-R198 IonicContact OD2-NE 3.31Å; D196-R198 IonicContact OD2-NH2 3.69Å; D196-R198 PolarHBondContact OD2-NH2 2.96Å; D196-L445 HydrophobicContact CB-CD2 4.21Å
197	D	83.5	Confident	80.9	Confident	3 Å²	3	34.5 Å²	34.5	2%	0.016	20%	0.201	C	C	.	.			trans	-107.3	11	-172.9	72.5	-34.1	0	0	0	113.2	P183 Y184 A195 L199 I200 A201 P434 A435	P183-D197 HydrophobicContact CG-CB 4.29Å; Y184-D197 HydrophobicContact CE1-CB 4.41Å; Y184-D197 WeakPolarHBondContact CE1-OD2 3.25Å; Y184-D197 VanDerWaalsContact CZ-OD2 3.3Å; Y184-D197 WeakPolarHBondContact OH-CB 3.45Å; Y184-D197 PolarHBondContact OH-OD2 3.44Å; A195-D197 PolarHBondContact O-N 2.94Å; D197-L199 PolarHBondContact O-N 3.29Å; D197-I200 HydrophobicContact CB-CB 4.41Å; D197-I200 HydrophobicContact CB-CD1 4.5Å; D197-I200 CarbonylContact O-C 3.54Å; D197-I200 WeakPolarHBondContact O-CA 3.13Å; D197-I200 WeakPolarHBondContact O-CB 3.28Å; D197-I200 PolarHBondContact O-N 3.39Å; D197-A201 WeakPolarHBondContact O-CB 3.41Å; D197-A201 PolarHBondContact O-N 2.98Å; D197-P434 WeakPolarHBondContact OD1-CA 3.41Å; D197-P434 WeakPolarHBondContact OD1-CB 3.16Å; D197-A435 PolarHBondContact OD1-N 3.34Å; D197-A435 WeakPolarHBondContact OD2-CB 3.31Å
198	R	85.8	Confident	81.2	Confident	82 Å²	82	34.1 Å²	34.1	31%	0.309	20%	0.196	S	C	.	.	H	α-helix	trans	-58	-42.3	-170.6	-70.5	176	-70.6	170.5	2.5	113.7	D196 N202 P434	D196-R198 WeakPolarHBondContact OD1-CG 3.38Å; D196-R198 IonicContact OD1-CZ 3.67Å; D196-R198 IonicContact OD1-NE 2.83Å; D196-R198 PolarHBondContact OD1-NE 3.08Å; D196-R198 IonicContact OD1-NH2 2.77Å; D196-R198 PolarHBondContact OD1-NH2 2.94Å; D196-R198 IonicContact OD2-CZ 2.72Å; D196-R198 IonicContact OD2-NE 3.31Å; D196-R198 IonicContact OD2-NH2 3.69Å; D196-R198 PolarHBondContact OD2-NH2 2.96Å; R198-N202 PolarHBondContact O-N 2.84Å; R198-N202 PolarHBondContact O-ND2 3.2Å; R198-P434 HydrophobicContact CG-CB 4.06Å; R198-P434 HydrophobicContact CG-CG 3.72Å
199	L	90.6	Very high	81.5	Confident	0 Å²	0	34.1 Å²	34.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-68.8	-47.3	174.6	-169.2	62	0	0	0	110.1	I115 P152 I156 T157 D197 A201 N202 T203 W207 I427 S428	I115-L199 HydrophobicContact CD1-CB 3.56Å; I115-L199 HydrophobicContact CD1-CG 4.43Å; P152-L199 WeakPolarHBondContact O-CB 3.22Å; I156-L199 HydrophobicContact CB-CD2 4.09Å; I156-L199 HydrophobicContact CD1-CD2 4.01Å; I156-L199 HydrophobicContact CG2-CD2 4.11Å; T157-L199 HydrophobicContact CG2-CD1 4.12Å; T157-L199 HydrophobicContact CG2-CD2 3.91Å; D197-L199 PolarHBondContact O-N 3.29Å; L199-A201 PolarHBondContact O-N 3.19Å; L199-N202 PolarHBondContact O-N 3.27Å; L199-T203 HydrophobicContact CD1-CG2 4.07Å; L199-T203 HydrophobicContact CG-CG2 4.48Å; L199-T203 WeakPolarHBondContact O-CB 3.35Å; L199-T203 PolarHBondContact O-N 3.37Å; L199-T203 PolarHBondContact O-OG1 2.88Å; L199-W207 HydrophobicContact CD2-CZ2 4.23Å; L199-W207 HydrophobicContact CG-CZ2 4.47Å; L199-I427 HydrophobicContact CD1-CB 3.96Å; L199-I427 HydrophobicContact CD1-CD1 4.47Å; L199-I427 HydrophobicContact CD1-CG2 3.98Å; L199-S428 WeakPolarHBondContact CD1-OG 3.21Å
200	I	91.3	Very high	82.6	Confident	0 Å²	0	34.3 Å²	34.3	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-52	-56.8	-178.4	-56.2	172.5	0	0	0	109.9	A151 T180 P183 Y184 D197 N202 T203 L204 W207 F209	A151-I200 HydrophobicContact CB-CD1 4.19Å; T180-I200 HydrophobicContact CG2-CD1 4.14Å; P183-I200 HydrophobicContact CG-CD1 3.94Å; P183-I200 HydrophobicContact CG-CG2 4.47Å; Y184-I200 HydrophobicContact CE2-CG2 4.06Å; D197-I200 HydrophobicContact CB-CB 4.41Å; D197-I200 HydrophobicContact CB-CD1 4.5Å; D197-I200 CarbonylContact O-C 3.54Å; D197-I200 WeakPolarHBondContact O-CA 3.13Å; D197-I200 WeakPolarHBondContact O-CB 3.28Å; D197-I200 PolarHBondContact O-N 3.39Å; I200-N202 PolarHBondContact O-N 3.29Å; I200-N202 VanDerWaalsContact O-N 3.15Å; I200-T203 CarbonylContact O-C 3.52Å; I200-T203 PolarHBondContact O-N 3.14Å; I200-L204 HydrophobicContact CG2-CD2 4.03Å; I200-L204 WeakPolarHBondContact O-CA 3.43Å; I200-L204 WeakPolarHBondContact O-CG 3.48Å; I200-L204 PolarHBondContact O-N 2.77Å; I200-W207 HydrophobicContact CB-CZ2 4.44Å; I200-W207 HydrophobicContact CD1-CH2 4.34Å; I200-W207 HydrophobicContact CD1-CZ2 4.48Å; I200-W207 HydrophobicContact CD1-CZ3 4.46Å; I200-W207 HydrophobicContact CG1-CD2 4.01Å; I200-W207 HydrophobicContact CG1-CE3 4.31Å; I200-W207 HydrophobicContact CG1-CH2 3.82Å; I200-W207 HydrophobicContact CG1-CZ2 3.49Å; I200-W207 VanDerWaalsContact CG1-CZ2 3.49Å; I200-W207 HydrophobicContact CG1-CZ3 4.22Å; I200-W207 HydrophobicContact CG2-CD2 4.29Å; I200-W207 HydrophobicContact CG2-CG 4.17Å; I200-F209 HydrophobicContact CG2-CZ 3.9Å
201	A	88	Confident	84	Confident	14 Å²	14	35 Å²	35	12%	0.116	20%	0.195	C	C	.	.	H	α-helix	trans	-56.9	-31.9	179.1	0	0	0	0	0	114	D197 L199 V432 L735	D197-A201 WeakPolarHBondContact O-CB 3.41Å; D197-A201 PolarHBondContact O-N 2.98Å; L199-A201 PolarHBondContact O-N 3.19Å; A201-V432 HydrophobicContact CB-CG1 3.98Å; A201-L735 HydrophobicContact CB-CD1 3.82Å
202	N	87.5	Confident	85.4	Confident	34 Å²	34	34 Å²	34	18%	0.182	19%	0.186	C	C	.	.	H	α-helix	trans	-83.4	-15.1	177.5	-82.7	-84.5	0	0	0	113.7	R198 L199 I200 N430 V432	R198-N202 PolarHBondContact O-N 2.84Å; R198-N202 PolarHBondContact O-ND2 3.2Å; L199-N202 PolarHBondContact O-N 3.27Å; I200-N202 PolarHBondContact O-N 3.29Å; I200-N202 VanDerWaalsContact O-N 3.15Å; N202-N430 WeakPolarHBondContact OD1-CB 3.23Å; N202-N430 PolarHBondContact OD1-N 3.02Å; N202-N430 PolarHBondContact OD1-O 3.09Å; N202-V432 WeakPolarHBondContact ND2-CB 3.4Å; N202-V432 WeakPolarHBondContact ND2-CG2 3.49Å
203	T	92	Very high	86.9	Confident	3 Å²	3	32.3 Å²	32.3	2%	0.018	18%	0.175	C	C	.	.	H	α-helix	trans	-137.7	23.2	-167.4	59.7	0	0	0	0	112.8	W176 L199 I200 P205 W206 W207 I427	W176-T203 HydrophobicContact CH2-CG2 4.33Å; W176-T203 HydrophobicContact CZ2-CG2 3.99Å; L199-T203 HydrophobicContact CD1-CG2 4.07Å; L199-T203 HydrophobicContact CG-CG2 4.48Å; L199-T203 WeakPolarHBondContact O-CB 3.35Å; L199-T203 PolarHBondContact O-N 3.37Å; L199-T203 PolarHBondContact O-OG1 2.88Å; I200-T203 CarbonylContact O-C 3.52Å; I200-T203 PolarHBondContact O-N 3.14Å; T203-P205 VanDerWaalsContact C-N 3.27Å; T203-W206 HydrophobicContact CG2-CE3 4.39Å; T203-W206 PolarHBondContact O-N 2.89Å; T203-W207 PolarHBondContact OG1-NE1 2.8Å; T203-I427 HydrophobicContact CG2-CG2 3.57Å
204	L	90.1	Very high	88	Confident	19 Å²	19	32.2 Å²	32.2	10%	0.099	17%	0.174	C	C	.	.	G	3₁₀ helix	trans	-43.3	-41.8	-177.3	-89.5	169.5	0	0	0	114.9	Y184 I200 W206 W207 F209 M731 E732	Y184-L204 HydrophobicContact CE2-CD2 4Å; I200-L204 HydrophobicContact CG2-CD2 4.03Å; I200-L204 WeakPolarHBondContact O-CA 3.43Å; I200-L204 WeakPolarHBondContact O-CG 3.48Å; I200-L204 PolarHBondContact O-N 2.77Å; L204-W206 PolarHBondContact O-N 2.8Å; L204-W206 VanDerWaalsContact O-N 3.09Å; L204-W207 PolarHBondContact O-N 2.97Å; L204-F209 HydrophobicContact CD2-CE2 3.77Å; L204-F209 HydrophobicContact CD2-CZ 4.33Å; L204-M731 HydrophobicContact CD1-CB 3.85Å; L204-E732 WeakPolarHBondContact CB-OE1 3.47Å; L204-E732 HydrophobicContact CD1-CG 3.79Å; L204-E732 WeakPolarHBondContact CD1-OE1 3.28Å
205	P	90.5	Very high	88.9	Confident	89 Å²	89	28.5 Å²	28.5	58%	0.578	16%	0.155	S	C	*	.	G	3₁₀ helix	trans	-60.1	-19.9	177.3	-27.3	36.4	0	0	0	115.9	T203	T203-P205 VanDerWaalsContact C-N 3.27Å
206	W	94.3	Very high	90.3	Very high	123 Å²	123	29.3 Å²	29.3	47%	0.466	16%	0.155	S	C	.	.	G	3₁₀ helix	trans	-94.7	-2.8	178.2	-66.1	-88.3	0	0	0	113.1	W176 A178 T203 L204	W176-W206 HydrophobicContact CD2-CB 4.3Å; W176-W206 HydrophobicContact CE3-CB 4.06Å; W176-W206 HydrophobicContact CH2-CB 3.45Å; W176-W206 VanDerWaalsContact CH2-CB 3.45Å; W176-W206 HydrophobicContact CH2-CG 4.22Å; W176-W206 HydrophobicContact CZ2-CB 3.7Å; W176-W206 HydrophobicContact CZ2-CD2 4.41Å; W176-W206 AromaticContact CZ2-CG 3.96Å; W176-W206 HydrophobicContact CZ2-CG 3.96Å; W176-W206 HydrophobicContact CZ3-CB 3.62Å; W176-W206 VanDerWaalsContact O-CD1 3.29Å; A178-W206 PolarHBondContact N-O 2.61Å; T203-W206 HydrophobicContact CG2-CE3 4.39Å; T203-W206 PolarHBondContact O-N 2.89Å; L204-W206 PolarHBondContact O-N 2.8Å; L204-W206 VanDerWaalsContact O-N 3.09Å
207	W	95.4	Very high	91.1	Very high	10 Å²	10	29 Å²	29	4%	0.038	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	124.1	177	-66.3	84.7	0	0	0	111.5	E150 I156 W176 A178 T180 L199 I200 T203 L204 F209	E150-W207 HydrophobicContact CB-CH2 4.29Å; E150-W207 HydrophobicContact CB-CZ3 4.23Å; E150-W207 HydrophobicContact CG-CH2 4.18Å; I156-W207 HydrophobicContact CD1-CH2 3.95Å; I156-W207 HydrophobicContact CD1-CZ2 3.86Å; W176-W207 AromaticContact CH2-NE1 3.75Å; A178-W207 HydrophobicContact CB-CD2 3.96Å; A178-W207 HydrophobicContact CB-CE3 3.62Å; A178-W207 HydrophobicContact CB-CH2 4.01Å; A178-W207 HydrophobicContact CB-CZ2 4.29Å; A178-W207 HydrophobicContact CB-CZ3 3.65Å; A178-W207 CarbonylContact O-C 3.44Å; A178-W207 WeakPolarHBondContact O-CA 3.43Å; T180-W207 HydrophobicContact CG2-CE3 3.57Å; T180-W207 HydrophobicContact CG2-CZ3 3.46Å; T180-W207 VanDerWaalsContact CG2-CZ3 3.46Å; L199-W207 HydrophobicContact CD2-CZ2 4.23Å; L199-W207 HydrophobicContact CG-CZ2 4.47Å; I200-W207 HydrophobicContact CB-CZ2 4.44Å; I200-W207 HydrophobicContact CD1-CH2 4.34Å; I200-W207 HydrophobicContact CD1-CZ2 4.48Å; I200-W207 HydrophobicContact CD1-CZ3 4.46Å; I200-W207 HydrophobicContact CG1-CD2 4.01Å; I200-W207 HydrophobicContact CG1-CE3 4.31Å; I200-W207 HydrophobicContact CG1-CH2 3.82Å; I200-W207 HydrophobicContact CG1-CZ2 3.49Å; I200-W207 VanDerWaalsContact CG1-CZ2 3.49Å; I200-W207 HydrophobicContact CG1-CZ3 4.22Å; I200-W207 HydrophobicContact CG2-CD2 4.29Å; I200-W207 HydrophobicContact CG2-CG 4.17Å; T203-W207 PolarHBondContact OG1-NE1 2.8Å; L204-W207 PolarHBondContact O-N 2.97Å; W207-F209 HydrophobicContact CB-CD2 4.49Å; W207-F209 HydrophobicContact CB-CE1 4.17Å; W207-F209 HydrophobicContact CB-CE2 3.75Å; W207-F209 HydrophobicContact CB-CZ 3.57Å; W207-F209 HydrophobicContact CG-CZ 4.22Å
208	F	96.3	Very high	91.7	Very high	14 Å²	14	29.3 Å²	29.3	6%	0.061	16%	0.155	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94.3	112.8	175.7	176.4	-97.6	0	0	0	110.5	V177 A178 N179 G210 H222 D225 L226 F229	V177-F208 HydrophobicContact CG1-CB 4.4Å; A178-F208 PolarHBondContact O-N 3.14Å; N179-F208 HydrophobicContact CB-CD1 4.44Å; N179-F208 PolarHBondContact ND2-O 3.19Å; F208-G210 VanDerWaalsContact CZ-CA 3.48Å; F208-H222 HydrophobicContact CE1-CB 4.24Å; F208-H222 WeakPolarHBondContact CE1-O 3.34Å; F208-D225 HydrophobicContact CE2-CB 3.98Å; F208-D225 HydrophobicContact CZ-CB 3.55Å; F208-L226 HydrophobicContact CB-CD1 4.08Å; F208-L226 HydrophobicContact CD1-CB 3.99Å; F208-L226 HydrophobicContact CD1-CD1 3.78Å; F208-L226 HydrophobicContact CD1-CG 4.35Å; F208-L226 HydrophobicContact CD2-CD1 4.46Å; F208-L226 HydrophobicContact CE1-CB 3.68Å; F208-L226 HydrophobicContact CE1-CD1 4.36Å; F208-L226 HydrophobicContact CG-CD1 3.84Å; F208-L226 HydrophobicContact CZ-CB 4.01Å; F208-F229 HydrophobicContact CB-CD1 4.25Å; F208-F229 HydrophobicContact CB-CE1 4.31Å; F208-F229 HydrophobicContact CD2-CB 3.91Å; F208-F229 HydrophobicContact CD2-CD1 4.2Å; F208-F229 AromaticContact CD2-CD2 3.95Å; F208-F229 HydrophobicContact CD2-CD2 3.95Å; F208-F229 AromaticContact CD2-CG 3.76Å; F208-F229 HydrophobicContact CD2-CG 3.76Å; F208-F229 HydrophobicContact CE2-CB 4.17Å; F208-F229 HydrophobicContact CE2-CG 4.43Å
209	F	94.6	Very high	92.2	Very high	18 Å²	18	28.3 Å²	28.3	8%	0.079	16%	0.155	C	C	.	.			trans	-105.7	11.1	178.4	-60.4	-58.1	0	0	0	114.1	T180 N182 I200 L204 W207 N213 T214 G215	T180-F209 HydrophobicContact CG2-CE1 3.91Å; T180-F209 WeakPolarHBondContact O-CD1 3.43Å; N182-F209 HydrophobicContact CB-CB 4.24Å; N182-F209 HydrophobicContact CB-CD1 3.46Å; N182-F209 VanDerWaalsContact CB-CD1 3.46Å; N182-F209 HydrophobicContact CB-CE1 3.87Å; N182-F209 HydrophobicContact CB-CG 3.83Å; I200-F209 HydrophobicContact CG2-CZ 3.9Å; L204-F209 HydrophobicContact CD2-CE2 3.77Å; L204-F209 HydrophobicContact CD2-CZ 4.33Å; W207-F209 HydrophobicContact CB-CD2 4.49Å; W207-F209 HydrophobicContact CB-CE1 4.17Å; W207-F209 HydrophobicContact CB-CE2 3.75Å; W207-F209 HydrophobicContact CB-CZ 3.57Å; W207-F209 HydrophobicContact CG-CZ 4.22Å; F209-N213 WeakPolarHBondContact CB-OD1 3.47Å; F209-N213 CarbonylContact O-C 3.52Å; F209-N213 VanDerWaalsContact O-C 3.3Å; F209-N213 VanDerWaalsContact O-CA 3.26Å; F209-N213 WeakPolarHBondContact O-CA 3.48Å; F209-N213 PolarHBondContact O-N 2.91Å; F209-T214 PolarHBondContact O-N 3.47Å; F209-G215 VanDerWaalsContact O-CA 3.31Å; F209-G215 WeakPolarHBondContact O-CA 3.45Å; F209-G215 PolarHBondContact O-N 2.88Å
210	G	92.3	Very high	92.4	Very high	16 Å²	16	32 Å²	32	17%	0.165	17%	0.172	C	C	.	.			trans	72.3	169.1	-175.7	0	0	0	0	0	113.5	F208 D212 N213	F208-G210 VanDerWaalsContact CZ-CA 3.48Å; G210-D212 PolarHBondContact O-N 3.12Å; G210-N213 PolarHBondContact O-N 2.83Å; G210-N213 VanDerWaalsContact O-N 3.16Å
211	S	86.6	Confident	92.6	Very high	54 Å²	54	38 Å²	38	38%	0.378	20%	0.198	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71	-16.8	-177.2	44.9	0	0	0	0	114.1	K221 D225	S211-K221 WeakPolarHBondContact OG-CE 3.36Å; S211-K221 PolarHBondContact OG-NZ 3.13Å; S211-D225 VanDerWaalsContact CB-OD2 3.28Å; S211-D225 WeakPolarHBondContact CB-OD2 3.44Å; S211-D225 PolarHBondContact OG-OD2 2.88Å
212	D	86.4	Confident	93	Very high	32 Å²	32	37.4 Å²	37.4	17%	0.171	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-98.3	0.7	172.3	70.3	11.2	0	0	0	113.7	G210 T214 H222	G210-D212 PolarHBondContact O-N 3.12Å; D212-T214 HydrophobicContact CB-CG2 4.47Å; D212-T214 PolarHBondContact O-N 2.78Å; D212-T214 VanDerWaalsContact OD1-CB 3.29Å; D212-T214 WeakPolarHBondContact OD1-CB 3.38Å; D212-T214 VanDerWaalsContact OD1-CG2 3.28Å; D212-T214 WeakPolarHBondContact OD1-CG2 3.41Å; D212-T214 PolarHBondContact OD1-N 3.01Å; D212-T214 PolarHBondContact OD1-OG1 3.41Å; D212-T214 PolarHBondContact OD2-OG1 2.91Å; D212-H222 VanDerWaalsContact CG-CE1 3.47Å; D212-H222 IonicContact OD1-CE1 3.54Å; D212-H222 PolarHBondContact OD1-CE1 3.3Å; D212-H222 IonicContact OD1-NE2 2.76Å; D212-H222 PolarHBondContact OD1-NE2 3.03Å; D212-H222 IonicContact OD2-CE1 3.11Å; D212-H222 IonicContact OD2-NE2 2.61Å
213	N	91.1	Very high	93.5	Very high	21 Å²	21	35.8 Å²	35.8	11%	0.112	19%	0.185	C	C	.	.	S	Bend	trans	65	12.3	179.4	-151.7	19.3	0	0	0	115.4	N182 H185 F209 G210 V507 R648	N182-N213 WeakPolarHBondContact CB-O 3.4Å; N182-N213 VanDerWaalsContact ND2-CG 3.34Å; N182-N213 PolarHBondContact ND2-O 3.26Å; N182-N213 PolarHBondContact ND2-OD1 2.96Å; H185-N213 PolarHBondContact CD2-O 3.27Å; F209-N213 WeakPolarHBondContact CB-OD1 3.47Å; F209-N213 CarbonylContact O-C 3.52Å; F209-N213 VanDerWaalsContact O-C 3.3Å; F209-N213 VanDerWaalsContact O-CA 3.26Å; F209-N213 WeakPolarHBondContact O-CA 3.48Å; F209-N213 PolarHBondContact O-N 2.91Å; G210-N213 PolarHBondContact O-N 2.83Å; G210-N213 VanDerWaalsContact O-N 3.16Å; N213-V507 HydrophobicContact CB-CG1 4.09Å; N213-R648 PolarHBondContact ND2-NH1 3.45Å
214	T	92.4	Very high	93.7	Very high	20 Å²	20	38.8 Å²	38.8	12%	0.123	20%	0.2	C	C	.	.			trans	-77.8	-29.4	176.5	63.1	0	0	0	0	112.4	L181 N182 N188 F209 D212 N216 H222	L181-T214 WeakPolarHBondContact CA-O 3.36Å; N182-T214 PolarHBondContact N-O 2.92Å; N188-T214 PolarHBondContact ND2-O 2.97Å; F209-T214 PolarHBondContact O-N 3.47Å; D212-T214 HydrophobicContact CB-CG2 4.47Å; D212-T214 PolarHBondContact O-N 2.78Å; D212-T214 VanDerWaalsContact OD1-CB 3.29Å; D212-T214 WeakPolarHBondContact OD1-CB 3.38Å; D212-T214 VanDerWaalsContact OD1-CG2 3.28Å; D212-T214 WeakPolarHBondContact OD1-CG2 3.41Å; D212-T214 PolarHBondContact OD1-N 3.01Å; D212-T214 PolarHBondContact OD1-OG1 3.41Å; D212-T214 PolarHBondContact OD2-OG1 2.91Å; T214-N216 PolarHBondContact O-N 3.12Å; T214-N216 PolarHBondContact OG1-N 3.29Å; T214-H222 PolarHBondContact OG1-CE1 2.87Å
215	G	93.8	Very high	94	Very high	1 Å²	1	40.1 Å²	40.1	1%	0.01	21%	0.208	C	C	.	.			trans	73.2	9.8	-175.2	0	0	0	0	0	115	N179 T180 F209 I217	N179-G215 PolarHBondContact ND2-O 2.97Å; N179-G215 VanDerWaalsContact ND2-O 3.1Å; T180-G215 CarbonylContact C-O 3.55Å; T180-G215 VanDerWaalsContact O-CA 3.27Å; T180-G215 WeakPolarHBondContact O-CA 3.33Å; F209-G215 VanDerWaalsContact O-CA 3.31Å; F209-G215 WeakPolarHBondContact O-CA 3.45Å; F209-G215 PolarHBondContact O-N 2.88Å; G215-I217 PolarHBondContact O-N 3.1Å; G215-I217 VanDerWaalsContact O-N 3.09Å
216	N	94.3	Very high	94.3	Very high	51 Å²	51	35.9 Å²	35.9	27%	0.273	18%	0.18	S	C	.	.			trans	-71.9	103.2	179	-176.5	-1	0	0	0	111.2	L181 T214 M218 L219 H222	L181-N216 HydrophobicContact CD2-CB 3.9Å; T214-N216 PolarHBondContact O-N 3.12Å; T214-N216 PolarHBondContact OG1-N 3.29Å; N216-M218 PolarHBondContact O-N 3.38Å; N216-M218 WeakPolarHBondContact OD1-CB 3.18Å; N216-M218 PolarHBondContact OD1-N 2.94Å; N216-L219 HydrophobicContact CB-CD1 4.21Å; N216-L219 HydrophobicContact CB-CG 4.21Å; N216-L219 PolarHBondContact O-N 3.32Å; N216-H222 PolarHBondContact O-ND1 2.84Å
217	I	95.7	Very high	94.4	Very high	4 Å²	4	33.9 Å²	33.9	2%	0.021	18%	0.176	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.6	-17.2	-178.9	-162.5	54.4	0	0	0	113.4	L148 N179 G215 L219 L226 L261 Y344	L148-I217 HydrophobicContact CD2-CD1 4.47Å; N179-I217 WeakPolarHBondContact OD1-CB 3.39Å; G215-I217 PolarHBondContact O-N 3.1Å; G215-I217 VanDerWaalsContact O-N 3.09Å; I217-L219 PolarHBondContact O-N 2.9Å; I217-L226 HydrophobicContact CD1-CD2 3.88Å; I217-L261 HydrophobicContact CG2-CD1 3.9Å; I217-Y344 WeakPolarHBondContact O-CE1 3.49Å; I217-Y344 VanDerWaalsContact O-CZ 3.3Å; I217-Y344 PolarHBondContact O-OH 2.83Å
218	M	96.1	Very high	94.4	Very high	11 Å²	11	38.1 Å²	38.1	5%	0.054	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-77.3	-0.2	179.5	-52.9	-175.6	81.2	0	0	113.1	N216 F245 S260 L261 C264 Y344 G345 P346	N216-M218 PolarHBondContact O-N 3.38Å; N216-M218 WeakPolarHBondContact OD1-CB 3.18Å; N216-M218 PolarHBondContact OD1-N 2.94Å; M218-F245 HydrophobicContact SD-CE2 4.24Å; M218-F245 HydrophobicContact SD-CZ 3.68Å; M218-S260 VanDerWaalsContact CE-C 3.45Å; M218-L261 HydrophobicContact CE-CB 4.14Å; M218-L261 HydrophobicContact CG-CD1 3.91Å; M218-L261 HydrophobicContact SD-CB 4.32Å; M218-L261 HydrophobicContact SD-CD1 4.24Å; M218-C264 HydrophobicContact CG-CB 4.46Å; M218-Y344 VanDerWaalsContact C-CE1 3.49Å; M218-G345 WeakPolarHBondContact O-CA 3.35Å; M218-P346 VanDerWaalsContact CE-CA 3.49Å; M218-P346 HydrophobicContact CE-CB 4.33Å
219	L	96	Very high	94.4	Very high	60 Å²	60	41.2 Å²	41.2	31%	0.314	22%	0.216	S	C	.	.	S	Bend	trans	-86.6	123.2	171.6	-61.6	-179.7	0	0	0	109.9	N216 I217 K221 H222 L223	N216-L219 HydrophobicContact CB-CD1 4.21Å; N216-L219 HydrophobicContact CB-CG 4.21Å; N216-L219 PolarHBondContact O-N 3.32Å; I217-L219 PolarHBondContact O-N 2.9Å; L219-K221 PolarHBondContact O-N 2.91Å; L219-H222 HydrophobicContact CB-CB 4.29Å; L219-H222 WeakPolarHBondContact O-CA 3.42Å; L219-H222 WeakPolarHBondContact O-CB 3.38Å; L219-H222 PolarHBondContact O-N 3.25Å; L219-L223 PolarHBondContact O-N 3.32Å
220	Q	96.4	Very high	94.4	Very high	77 Å²	77	40.7 Å²	40.7	36%	0.36	22%	0.215	S	C	.	.	H	α-helix	trans	-53.7	-40.1	-179.7	-176.3	-164	65	0	0	112.1	H222 L223 L224 I341 Y344	Q220-H222 VanDerWaalsContact C-N 3.29Å; Q220-H222 PolarHBondContact O-N 3.28Å; Q220-L223 WeakPolarHBondContact O-CB 3.36Å; Q220-L223 PolarHBondContact O-N 2.85Å; Q220-L224 PolarHBondContact O-N 2.97Å; Q220-I341 HydrophobicContact CG-CG2 4.29Å; Q220-I341 PolarHBondContact NE2-O 3.27Å; Q220-Y344 HydrophobicContact CB-CD1 4.08Å
221	K	95.4	Very high	94.5	Very high	126 Å²	126	43.8 Å²	43.8	55%	0.548	23%	0.233	S	C	.	.	H	α-helix	trans	-57.6	-42	175.8	-170.4	-174.4	-178.5	-158.1	0	111.9	S211 L219 L223 L224 D225	S211-K221 WeakPolarHBondContact OG-CE 3.36Å; S211-K221 PolarHBondContact OG-NZ 3.13Å; L219-K221 PolarHBondContact O-N 2.91Å; K221-L223 PolarHBondContact O-N 3.48Å; K221-L224 PolarHBondContact O-N 3.14Å; K221-D225 WeakPolarHBondContact O-CB 3.13Å; K221-D225 VanDerWaalsContact O-CG 3.24Å; K221-D225 PolarHBondContact O-N 2.96Å
222	H	96.1	Very high	94.6	Very high	2 Å²	2	48.4 Å²	48.4	1%	0.009	25%	0.254	C	S	.	.	H	α-helix	trans	-68.7	-33.9	179.5	-67.2	172.6	0	0	0	113	F208 D212 T214 N216 L219 Q220 L224 L226	F208-H222 HydrophobicContact CE1-CB 4.24Å; F208-H222 WeakPolarHBondContact CE1-O 3.34Å; D212-H222 VanDerWaalsContact CG-CE1 3.47Å; D212-H222 IonicContact OD1-CE1 3.54Å; D212-H222 PolarHBondContact OD1-CE1 3.3Å; D212-H222 IonicContact OD1-NE2 2.76Å; D212-H222 PolarHBondContact OD1-NE2 3.03Å; D212-H222 IonicContact OD2-CE1 3.11Å; D212-H222 IonicContact OD2-NE2 2.61Å; T214-H222 PolarHBondContact OG1-CE1 2.87Å; N216-H222 PolarHBondContact O-ND1 2.84Å; L219-H222 HydrophobicContact CB-CB 4.29Å; L219-H222 WeakPolarHBondContact O-CA 3.42Å; L219-H222 WeakPolarHBondContact O-CB 3.38Å; L219-H222 PolarHBondContact O-N 3.25Å; Q220-H222 VanDerWaalsContact C-N 3.29Å; Q220-H222 PolarHBondContact O-N 3.28Å; H222-L224 VanDerWaalsContact C-N 3.33Å; H222-L226 WeakPolarHBondContact O-CB 3.46Å; H222-L226 PolarHBondContact O-N 2.97Å
223	L	97.3	Very high	94.9	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-58.6	-46.8	171.1	172.2	66.5	0	0	0	111.3	L219 Q220 K221 L226 Q227 A268 L271 I341 Y344	L219-L223 PolarHBondContact O-N 3.32Å; Q220-L223 WeakPolarHBondContact O-CB 3.36Å; Q220-L223 PolarHBondContact O-N 2.85Å; K221-L223 PolarHBondContact O-N 3.48Å; L223-L226 PolarHBondContact O-N 2.85Å; L223-Q227 PolarHBondContact O-N 3.22Å; L223-Q227 VanDerWaalsContact O-N 3.08Å; L223-A268 HydrophobicContact CD1-CB 3.62Å; L223-L271 HydrophobicContact CD1-CD2 3.71Å; L223-L271 HydrophobicContact CD2-CD2 4.13Å; L223-L271 HydrophobicContact CG-CD2 3.76Å; L223-I341 HydrophobicContact CD2-CG1 3.91Å; L223-Y344 HydrophobicContact CB-CE1 4.23Å; L223-Y344 HydrophobicContact CB-CE2 4.47Å; L223-Y344 HydrophobicContact CD2-CD2 3.76Å; L223-Y344 HydrophobicContact CD2-CE2 3.63Å; L223-Y344 HydrophobicContact CD2-CG 4.31Å; L223-Y344 HydrophobicContact CG-CE2 4.45Å
224	L	96.7	Very high	94.9	Very high	67 Å²	67	57.5 Å²	57.5	35%	0.351	29%	0.286	S	S	.	.	H	α-helix	trans	-70.1	-43.5	-179.9	-60.3	179	0	0	0	111.8	Q220 K221 H222 L226 Q227 V228 I341	Q220-L224 PolarHBondContact O-N 2.97Å; K221-L224 PolarHBondContact O-N 3.14Å; H222-L224 VanDerWaalsContact C-N 3.33Å; L224-L226 VanDerWaalsContact C-N 3.28Å; L224-L226 PolarHBondContact O-N 2.95Å; L224-Q227 WeakPolarHBondContact O-CB 3.47Å; L224-Q227 PolarHBondContact O-N 2.74Å; L224-V228 PolarHBondContact O-N 2.87Å; L224-V228 VanDerWaalsContact O-N 3.13Å; L224-I341 HydrophobicContact CD2-CG2 4.44Å
225	D	96.3	Very high	95	Very high	47 Å²	47	58.7 Å²	58.7	25%	0.251	29%	0.288	S	S	.	.	H	α-helix	trans	-60	-38.9	174.5	-72.3	-11.7	0	0	0	110.7	F208 S211 K221 V228 F229	F208-D225 HydrophobicContact CE2-CB 3.98Å; F208-D225 HydrophobicContact CZ-CB 3.55Å; S211-D225 VanDerWaalsContact CB-OD2 3.28Å; S211-D225 WeakPolarHBondContact CB-OD2 3.44Å; S211-D225 PolarHBondContact OG-OD2 2.88Å; K221-D225 WeakPolarHBondContact O-CB 3.13Å; K221-D225 VanDerWaalsContact O-CG 3.24Å; K221-D225 PolarHBondContact O-N 2.96Å; D225-V228 PolarHBondContact O-N 3.09Å; D225-F229 WeakPolarHBondContact O-CB 3.46Å; D225-F229 PolarHBondContact O-N 3.27Å
226	L	97.2	Very high	95.2	Very high	0 Å²	0	59 Å²	59	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65	-41.6	176	178.3	60.3	0	0	0	111.6	L148 V177 F208 I217 H222 L223 L224 V228 F229 V230 L272	L148-L226 HydrophobicContact CD2-CD2 3.81Å; V177-L226 HydrophobicContact CG1-CD1 4.11Å; F208-L226 HydrophobicContact CB-CD1 4.08Å; F208-L226 HydrophobicContact CD1-CB 3.99Å; F208-L226 HydrophobicContact CD1-CD1 3.78Å; F208-L226 HydrophobicContact CD1-CG 4.35Å; F208-L226 HydrophobicContact CD2-CD1 4.46Å; F208-L226 HydrophobicContact CE1-CB 3.68Å; F208-L226 HydrophobicContact CE1-CD1 4.36Å; F208-L226 HydrophobicContact CG-CD1 3.84Å; F208-L226 HydrophobicContact CZ-CB 4.01Å; I217-L226 HydrophobicContact CD1-CD2 3.88Å; H222-L226 WeakPolarHBondContact O-CB 3.46Å; H222-L226 PolarHBondContact O-N 2.97Å; L223-L226 PolarHBondContact O-N 2.85Å; L224-L226 VanDerWaalsContact C-N 3.28Å; L224-L226 PolarHBondContact O-N 2.95Å; L226-V228 VanDerWaalsContact C-N 3.27Å; L226-V228 PolarHBondContact O-N 3.16Å; L226-F229 WeakPolarHBondContact O-CB 3.3Å; L226-F229 PolarHBondContact O-N 2.77Å; L226-F229 VanDerWaalsContact O-N 3.14Å; L226-V230 HydrophobicContact CD1-CG1 3.94Å; L226-V230 WeakPolarHBondContact O-CG2 3.48Å; L226-V230 PolarHBondContact O-N 2.85Å; L226-L272 HydrophobicContact CD2-CD1 3.85Å; L226-L272 HydrophobicContact CG-CD1 4.12Å
227	Q	96.3	Very high	95.4	Very high	81 Å²	81	56.6 Å²	56.6	38%	0.379	28%	0.277	S	S	.	.	H	α-helix	trans	-57.3	-42.9	174.5	-175.5	-174.3	38.9	0	0	111.3	L223 L224 S231 L271 L272	L223-Q227 PolarHBondContact O-N 3.22Å; L223-Q227 VanDerWaalsContact O-N 3.08Å; L224-Q227 WeakPolarHBondContact O-CB 3.47Å; L224-Q227 PolarHBondContact O-N 2.74Å; Q227-S231 PolarHBondContact O-N 3.46Å; Q227-L271 HydrophobicContact CB-CD2 4.21Å; Q227-L271 HydrophobicContact CG-CD2 4.45Å; Q227-L272 HydrophobicContact CB-CD2 4.09Å; Q227-L272 HydrophobicContact CG-CD2 4.34Å
228	V	96	Very high	95.5	Very high	98 Å²	98	56.4 Å²	56.4	59%	0.594	28%	0.276	S	S	*	.	H	α-helix	trans	-66.5	-43.6	175.1	177.1	0	0	0	0	110.6	L224 D225 L226 V230 S231	L224-V228 PolarHBondContact O-N 2.87Å; L224-V228 VanDerWaalsContact O-N 3.13Å; D225-V228 PolarHBondContact O-N 3.09Å; L226-V228 VanDerWaalsContact C-N 3.27Å; L226-V228 PolarHBondContact O-N 3.16Å; V228-V230 VanDerWaalsContact C-N 3.32Å; V228-V230 PolarHBondContact O-N 3.43Å; V228-S231 VanDerWaalsContact O-CB 3.25Å; V228-S231 WeakPolarHBondContact O-CB 3.46Å; V228-S231 PolarHBondContact O-N 3.34Å; V228-S231 VanDerWaalsContact O-N 3.08Å; V228-S231 PolarHBondContact O-OG 3.1Å
229	F	94.7	Very high	95.7	Very high	79 Å²	79	55.9 Å²	55.9	35%	0.346	27%	0.274	S	S	.	.	H	α-helix	trans	-59.2	-41.6	-179	-170.1	-96.5	0	0	0	112.6	V177 F208 D225 L226 S231	V177-F229 HydrophobicContact CB-CE1 4.39Å; V177-F229 HydrophobicContact CG1-CD1 3.79Å; V177-F229 HydrophobicContact CG1-CE1 3.75Å; V177-F229 HydrophobicContact CG2-CD1 4.03Å; V177-F229 HydrophobicContact CG2-CE1 3.67Å; F208-F229 HydrophobicContact CB-CD1 4.25Å; F208-F229 HydrophobicContact CB-CE1 4.31Å; F208-F229 HydrophobicContact CD2-CB 3.91Å; F208-F229 HydrophobicContact CD2-CD1 4.2Å; F208-F229 AromaticContact CD2-CD2 3.95Å; F208-F229 HydrophobicContact CD2-CD2 3.95Å; F208-F229 AromaticContact CD2-CG 3.76Å; F208-F229 HydrophobicContact CD2-CG 3.76Å; F208-F229 HydrophobicContact CE2-CB 4.17Å; F208-F229 HydrophobicContact CE2-CG 4.43Å; D225-F229 WeakPolarHBondContact O-CB 3.46Å; D225-F229 PolarHBondContact O-N 3.27Å; L226-F229 WeakPolarHBondContact O-CB 3.3Å; L226-F229 PolarHBondContact O-N 2.77Å; L226-F229 VanDerWaalsContact O-N 3.14Å; F229-S231 VanDerWaalsContact C-N 3.33Å
230	V	96.3	Very high	95.8	Very high	8 Å²	8	53 Å²	53	5%	0.048	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-84.4	-2.8	178.4	-53.2	0	0	0	0	113.8	V146 V177 L226 V228 N232 M233 V236 L272	V146-V230 HydrophobicContact CG2-CG1 3.89Å; V177-V230 HydrophobicContact CB-CG1 4.18Å; V177-V230 HydrophobicContact CG1-CG1 4.01Å; V177-V230 HydrophobicContact CG2-CG1 4.37Å; L226-V230 HydrophobicContact CD1-CG1 3.94Å; L226-V230 WeakPolarHBondContact O-CG2 3.48Å; L226-V230 PolarHBondContact O-N 2.85Å; V228-V230 VanDerWaalsContact C-N 3.32Å; V228-V230 PolarHBondContact O-N 3.43Å; V230-N232 PolarHBondContact O-N 2.8Å; V230-N232 VanDerWaalsContact O-N 3.11Å; V230-M233 HydrophobicContact CB-SD 4.13Å; V230-M233 VanDerWaalsContact O-CB 3.27Å; V230-M233 WeakPolarHBondContact O-CB 3.39Å; V230-M233 PolarHBondContact O-N 2.75Å; V230-V236 HydrophobicContact CG2-CG2 4.31Å; V230-L272 HydrophobicContact CG2-CD2 3.68Å
231	S	93.1	Very high	95.9	Very high	80 Å²	80	49.4 Å²	49.4	56%	0.559	24%	0.242	S	C	*	.	G	3₁₀ helix	trans	-64	-17	-179.2	70.3	0	0	0	0	114.2	Q227 V228 F229 M233	Q227-S231 PolarHBondContact O-N 3.46Å; V228-S231 VanDerWaalsContact O-CB 3.25Å; V228-S231 WeakPolarHBondContact O-CB 3.46Å; V228-S231 PolarHBondContact O-N 3.34Å; V228-S231 VanDerWaalsContact O-N 3.08Å; V228-S231 PolarHBondContact O-OG 3.1Å; F229-S231 VanDerWaalsContact C-N 3.33Å; S231-M233 PolarHBondContact O-N 2.81Å
232	N	88.8	Confident	95.9	Very high	152 Å²	152	44.8 Å²	44.8	81%	0.813	22%	0.223	S	C	*	.	G	3₁₀ helix	trans	-73.1	-15.9	171.9	-67	-48.6	0	0	0	113	V230	V230-N232 PolarHBondContact O-N 2.8Å; V230-N232 VanDerWaalsContact O-N 3.11Å
233	M	93.9	Very high	95.6	Very high	32 Å²	32	44.9 Å²	44.9	16%	0.158	22%	0.224	C	C	.	.	S	Bend	trans	-78.1	138	170.7	-60	176.5	173.4	0	0	109.4	N144 V146 V177 V230 S231 R235 V236	N144-M233 HydrophobicContact CB-CB 4.35Å; N144-M233 HydrophobicContact CB-CG 4.35Å; N144-M233 HydrophobicContact CB-SD 3.9Å; V146-M233 HydrophobicContact CG2-SD 4.48Å; V177-M233 HydrophobicContact CB-CE 3.84Å; V177-M233 HydrophobicContact CG2-CE 3.35Å; V230-M233 HydrophobicContact CB-SD 4.13Å; V230-M233 VanDerWaalsContact O-CB 3.27Å; V230-M233 WeakPolarHBondContact O-CB 3.39Å; V230-M233 PolarHBondContact O-N 2.75Å; S231-M233 PolarHBondContact O-N 2.81Å; M233-R235 VanDerWaalsContact C-N 3.27Å; M233-R235 PolarHBondContact O-N 3.26Å; M233-V236 HydrophobicContact SD-CG2 4.25Å
234	R	91.1	Very high	95	Very high	211 Å²	211	46.8 Å²	46.8	80%	0.796	24%	0.238	S	C	*	.	S	Bend	trans	-62.6	-36.9	177.3	-69.6	-177.3	175.7	165.7	-9.5	112.9	E142	E142-R234 WeakPolarHBondContact OE2-CD 3.28Å; E142-R234 IonicContact OE2-CZ 3.16Å; E142-R234 IonicContact OE2-NE 3.1Å; E142-R234 IonicContact OE2-NH1 3.1Å; E142-R234 PolarHBondContact OE2-NH1 3.03Å
235	R	94.1	Very high	94.2	Very high	46 Å²	46	46.8 Å²	46.8	17%	0.174	24%	0.235	C	C	.	.			trans	-154.2	158.5	178.9	57.3	-175.8	-69.3	171.8	-1.9	108.5	E136 N144 M233 D237 S274 P275	E136-R235 IonicContact OE2-NH1 2.94Å; E136-R235 PolarHBondContact OE2-NH1 2.87Å; E136-R235 VanDerWaalsContact OE2-NH1 3.1Å; N144-R235 WeakPolarHBondContact CB-O 3.24Å; N144-R235 PolarHBondContact ND2-O 3.31Å; M233-R235 VanDerWaalsContact C-N 3.27Å; M233-R235 PolarHBondContact O-N 3.26Å; R235-D237 WeakPolarHBondContact CD-OD1 3.31Å; R235-D237 IonicContact CZ-OD1 3.74Å; R235-D237 IonicContact NE-OD1 2.68Å; R235-D237 PolarHBondContact NE-OD1 3.44Å; R235-D237 IonicContact NH2-OD1 3.64Å; R235-D237 PolarHBondContact NH2-OD1 3.47Å; R235-D237 VanDerWaalsContact NH2-OD1 3.1Å; R235-S274 WeakPolarHBondContact CA-OG 3.45Å; R235-S274 WeakPolarHBondContact CB-OG 3.3Å; R235-P275 PolarHBondContact NH2-O 3.15Å
236	V	97.7	Very high	93.2	Very high	7 Å²	7	46.7 Å²	46.7	4%	0.042	24%	0.235	C	C	.	.			trans	-112.3	116.1	170.6	178.4	0	0	0	0	107.3	V146 V230 M233 V239 L272 L273 S274	V146-V236 HydrophobicContact CB-CG1 4.42Å; V146-V236 HydrophobicContact CG2-CG1 3.81Å; V146-V236 HydrophobicContact CG2-CG2 4.33Å; V230-V236 HydrophobicContact CG2-CG2 4.31Å; M233-V236 HydrophobicContact SD-CG2 4.25Å; V236-V239 HydrophobicContact CG1-CG2 3.83Å; V236-L272 HydrophobicContact CG1-CB 4.5Å; V236-L273 HydrophobicContact CG1-CD2 4.39Å; V236-S274 PolarHBondContact N-OG 2.9Å; V236-S274 VanDerWaalsContact N-OG 3.1Å; V236-S274 PolarHBondContact O-N 2.83Å
237	D	98.2	Very high	92.3	Very high	0 Å²	0	47.1 Å²	47.1	0%	0	24%	0.237	C	C	.	.			trans	-95.9	-37.8	-170.1	-63.7	-55.9	0	0	0	113.1	P134 L143 N144 R235 G277 S278	P134-D237 HydrophobicContact CG-CB 4.06Å; L143-D237 HydrophobicContact CD1-CB 4.1Å; L143-D237 HydrophobicContact CG-CB 4.43Å; N144-D237 PolarHBondContact N-OD2 3.02Å; N144-D237 WeakPolarHBondContact O-CB 3.28Å; N144-D237 PolarHBondContact O-N 3.09Å; R235-D237 WeakPolarHBondContact CD-OD1 3.31Å; R235-D237 IonicContact CZ-OD1 3.74Å; R235-D237 IonicContact NE-OD1 2.68Å; R235-D237 PolarHBondContact NE-OD1 3.44Å; R235-D237 IonicContact NH2-OD1 3.64Å; R235-D237 PolarHBondContact NH2-OD1 3.47Å; R235-D237 VanDerWaalsContact NH2-OD1 3.1Å; D237-G277 CarbonylContact O-C 3.54Å; D237-G277 WeakPolarHBondContact O-CA 3.32Å; D237-S278 PolarHBondContact O-N 3.35Å
238	V	98.7	Very high	91.3	Very high	1 Å²	1	47.2 Å²	47.2	1%	0.006	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.8	128.2	-176.5	-177.6	0	0	0	0	108.8	L132 L133 N144 S145 V146 T240 S278	L132-V238 HydrophobicContact CD2-CG1 4.05Å; L132-V238 HydrophobicContact CG-CG1 4.3Å; L133-V238 HydrophobicContact CD2-CG2 3.98Å; N144-V238 PolarHBondContact O-N 2.96Å; S145-V238 CarbonylContact C-O 3.46Å; S145-V238 WeakPolarHBondContact CA-O 3.4Å; V146-V238 PolarHBondContact N-O 3.38Å; V238-T240 HydrophobicContact CG1-CG2 4.06Å; V238-S278 WeakPolarHBondContact CA-O 3.43Å
239	V	98.9	Very high	90.2	Very high	0 Å²	0	47.9 Å²	47.9	0%	0	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	135.1	165.5	178.9	0	0	0	0	108.4	V146 L148 V236 A269 L272 L273 S278 F279 V280	V146-V239 HydrophobicContact CB-CG2 4.25Å; V146-V239 CarbonylContact O-C 3.55Å; V146-V239 VanDerWaalsContact O-CA 3.23Å; V146-V239 WeakPolarHBondContact O-CA 3.46Å; L148-V239 HydrophobicContact CD1-CG1 4.04Å; L148-V239 HydrophobicContact CG-CG1 4.23Å; V236-V239 HydrophobicContact CG1-CG2 3.83Å; V239-A269 HydrophobicContact CB-CB 4.09Å; V239-A269 HydrophobicContact CG1-CB 3.81Å; V239-L272 HydrophobicContact CG2-CB 4.46Å; V239-L273 HydrophobicContact CB-CD1 4.35Å; V239-L273 HydrophobicContact CB-CD2 4.21Å; V239-L273 HydrophobicContact CB-CG 4.16Å; V239-L273 HydrophobicContact CG2-CD1 4.28Å; V239-L273 HydrophobicContact CG2-CD2 3.67Å; V239-L273 HydrophobicContact CG2-CG 3.58Å; V239-S278 PolarHBondContact N-O 2.92Å; V239-F279 HydrophobicContact CB-CD2 3.97Å; V239-F279 HydrophobicContact CG1-CD2 3.92Å; V239-F279 HydrophobicContact CG1-CE2 3.99Å; V239-F279 CarbonylContact O-C 3.48Å; V239-F279 WeakPolarHBondContact O-CA 3.39Å; V239-F279 WeakPolarHBondContact O-CD2 3.31Å; V239-V280 PolarHBondContact O-N 2.74Å
240	T	98.9	Very high	89.7	Confident	0 Å²	0	47.5 Å²	47.5	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	149.9	169.6	71.3	0	0	0	0	110.3	F123 V146 H147 L148 F155 V238 V280	F123-T240 HydrophobicContact CE2-CG2 3.64Å; F123-T240 HydrophobicContact CZ-CG2 3.7Å; V146-T240 PolarHBondContact O-N 3Å; H147-T240 PolarHBondContact ND1-OG1 3.46Å; L148-T240 PolarHBondContact N-O 3.02Å; F155-T240 HydrophobicContact CD2-CG2 4.16Å; V238-T240 HydrophobicContact CG1-CG2 4.06Å; T240-V280 CarbonylContact C-O 3.44Å; T240-V280 WeakPolarHBondContact CA-O 3.26Å; T240-V280 HydrophobicContact CG2-CB 4.28Å
241	A	98.4	Very high	89	Confident	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	112.2	176.6	0	0	0	0	0	108.9	L148 E265 F279 V280 L281 K282	L148-A241 HydrophobicContact CB-CB 4.3Å; A241-E265 HydrophobicContact CB-CB 3.84Å; A241-E265 HydrophobicContact CB-CG 4.01Å; A241-F279 HydrophobicContact CB-CE2 3.92Å; A241-F279 HydrophobicContact CB-CZ 4.23Å; A241-V280 PolarHBondContact N-O 3.03Å; A241-L281 HydrophobicContact CB-CD1 3.65Å; A241-K282 PolarHBondContact O-N 3.44Å
242	D	95.2	Very high	88.7	Confident	30 Å²	30	47.9 Å²	47.9	16%	0.16	23%	0.234	C	C	.	.			trans	-115.7	22.4	178.2	-159.8	44.5	0	0	0	111.5	L148 F155 K282 Y321	L148-D242 PolarHBondContact O-N 3.04Å; F155-D242 HydrophobicContact CE2-CB 4.19Å; F155-D242 HydrophobicContact CZ-CB 4.15Å; D242-K282 WeakPolarHBondContact OD1-CD 3.3Å; D242-Y321 WeakPolarHBondContact OD1-CE1 3.3Å; D242-Y321 PolarHBondContact OD1-OH 3.04Å
243	G	90.2	Very high	88.8	Confident	3 Å²	3	43.6 Å²	43.6	3%	0.031	21%	0.21	C	C	.	.			trans	-69.9	145.6	-175.5	0	0	0	0	0	114.7	E265	G243-E265 WeakPolarHBondContact CA-OE1 3.42Å; G243-E265 PolarHBondContact N-OE1 3.04Å
244	S	85.1	Confident	88.7	Confident	40 Å²	40	44 Å²	44	28%	0.28	21%	0.211	S	C	.	.			trans	-165.4	158.4	171.3	-179	0	0	0	0	109.3	F284	S244-F284 WeakPolarHBondContact OG-CZ 3.31Å
245	F	79.9	Confident	88.8	Confident	67 Å²	67	34.2 Å²	34.2	29%	0.294	17%	0.174	S	C	.	.			trans	-104.4	164.2	167.2	-48	-67.6	0	0	0	110.9	T192 M218 C247 V258 L261	T192-F245 HydrophobicContact CG2-CD1 4.33Å; M218-F245 HydrophobicContact SD-CE2 4.24Å; M218-F245 HydrophobicContact SD-CZ 3.68Å; F245-C247 PolarHBondContact O-N 3.49Å; F245-C247 VanDerWaalsContact O-N 3.11Å; F245-C247 PolarHBondContact O-SG 3.43Å; F245-C247 VanDerWaalsContact O-SG 3.36Å; F245-V258 HydrophobicContact CD2-CG1 4.2Å; F245-L261 HydrophobicContact CD2-CD2 4.42Å; F245-L261 HydrophobicContact CE1-CD2 4.31Å; F245-L261 HydrophobicContact CE2-CB 3.71Å; F245-L261 HydrophobicContact CE2-CD2 3.74Å; F245-L261 HydrophobicContact CE2-CG 4.25Å; F245-L261 HydrophobicContact CZ-CB 4Å; F245-L261 HydrophobicContact CZ-CD1 4.2Å; F245-L261 HydrophobicContact CZ-CD2 3.68Å; F245-L261 HydrophobicContact CZ-CG 4.17Å
246	D	74.3	Confident	88.7	Confident	46 Å²	46	33.8 Å²	33.8	25%	0.246	18%	0.18	C	C	.	.			trans	-69.8	103.8	173.3	-178.6	13.3	0	0	0	110.5	S191 Q248 K448	S191-D246 VanDerWaalsContact CB-CB 3.43Å; S191-D246 WeakPolarHBondContact CB-OD2 3.25Å; S191-D246 WeakPolarHBondContact OG-CB 3.22Å; S191-D246 PolarHBondContact OG-OD2 3.01Å; D246-Q248 VanDerWaalsContact OD1-CB 3.22Å; D246-Q248 WeakPolarHBondContact OD1-CB 3.42Å; D246-Q248 VanDerWaalsContact OD1-CD 3.31Å; D246-Q248 WeakPolarHBondContact OD1-CG 3.39Å; D246-Q248 PolarHBondContact OD1-N 3.02Å; D246-Q248 VanDerWaalsContact OD1-N 3.1Å; D246-Q248 PolarHBondContact OD1-OE1 3.25Å; D246-K448 IonicContact OD2-NZ 3.7Å; D246-K448 PolarHBondContact OD2-NZ 3.02Å
247	C	79.3	Confident	88.5	Confident	9 Å²	9	37.8 Å²	37.8	6%	0.061	20%	0.201	C	C	.	.			trans	-99.2	17.1	179.1	-55.8	0	0	0	0	112.1	F245 E249 N250 P251 Q254 L257	F245-C247 PolarHBondContact O-N 3.49Å; F245-C247 VanDerWaalsContact O-N 3.11Å; F245-C247 PolarHBondContact O-SG 3.43Å; F245-C247 VanDerWaalsContact O-SG 3.36Å; C247-E249 PolarHBondContact O-N 3.43Å; C247-N250 CarbonylContact O-C 3.58Å; C247-N250 PolarHBondContact O-N 3.4Å; C247-N250 VanDerWaalsContact O-N 3.07Å; C247-P251 VanDerWaalsContact O-CA 3.32Å; C247-P251 WeakPolarHBondContact O-CA 3.29Å; C247-Q254 HydrophobicContact CB-CB 4.08Å; C247-Q254 HydrophobicContact CB-CG 4.09Å; C247-L257 HydrophobicContact CB-CD1 4.25Å
248	Q	73.5	Confident	88.3	Confident	83 Å²	83	37.8 Å²	37.8	39%	0.388	20%	0.201	S	C	.	.	T	Hydrogen-bonded Turn	trans	-65.9	-22.6	-174.5	-72.3	172.7	-10.5	0	0	114.1	D246 N250 F454	D246-Q248 VanDerWaalsContact OD1-CB 3.22Å; D246-Q248 WeakPolarHBondContact OD1-CB 3.42Å; D246-Q248 VanDerWaalsContact OD1-CD 3.31Å; D246-Q248 WeakPolarHBondContact OD1-CG 3.39Å; D246-Q248 PolarHBondContact OD1-N 3.02Å; D246-Q248 VanDerWaalsContact OD1-N 3.1Å; D246-Q248 PolarHBondContact OD1-OE1 3.25Å; Q248-N250 VanDerWaalsContact C-N 3.34Å; Q248-F454 WeakPolarHBondContact O-CE2 3.13Å
249	E	74.8	Confident	88.1	Confident	111 Å²	111	38 Å²	38	52%	0.519	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.5	-33	173.5	-65.1	-68.4	150.2	0	0	112	C247 Q461	C247-E249 PolarHBondContact O-N 3.43Å; E249-Q461 PolarHBondContact OE1-NE2 2.67Å; E249-Q461 PolarHBondContact OE2-NE2 3.34Å; E249-Q461 PolarHBondContact OE2-OE1 2.87Å
250	N	82.6	Confident	88	Confident	71 Å²	71	38.2 Å²	38.2	38%	0.38	21%	0.205	S	C	.	.	S	Bend	trans	-142.1	69.7	-179.4	-166.6	-0.7	0	0	0	110.6	C247 Q248 D252 E253 L257	C247-N250 CarbonylContact O-C 3.58Å; C247-N250 PolarHBondContact O-N 3.4Å; C247-N250 VanDerWaalsContact O-N 3.07Å; Q248-N250 VanDerWaalsContact C-N 3.34Å; N250-D252 PolarHBondContact O-N 2.9Å; N250-E253 WeakPolarHBondContact ND2-CG 3.29Å; N250-E253 PolarHBondContact O-N 2.73Å; N250-L257 HydrophobicContact CB-CD1 4.21Å
251	P	83.4	Confident	87.9	Confident	52 Å²	52	38.4 Å²	38.4	34%	0.338	21%	0.206	S	C	.	.	G	3₁₀ helix	trans	-68.9	-20.8	-173.5	28.1	-35.3	0	0	0	113	C247 E253	C247-P251 VanDerWaalsContact O-CA 3.32Å; C247-P251 WeakPolarHBondContact O-CA 3.29Å; P251-E253 VanDerWaalsContact C-N 3.3Å
252	D	86.4	Confident	87.9	Confident	44 Å²	44	38.6 Å²	38.6	24%	0.235	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-72	-25.9	179.3	-75	-1	0	0	0	112.3	N76 N250	N76-D252 WeakPolarHBondContact ND2-CB 3.44Å; N76-D252 PolarHBondContact ND2-O 2.98Å; N250-D252 PolarHBondContact O-N 2.9Å
253	E	90.1	Very high	88	Confident	63 Å²	63	37.5 Å²	37.5	29%	0.294	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-108.3	17.1	-178.7	-61.2	-55.8	140.1	0	0	113	K72 N250 P251 E255 A256 L257	K72-E253 WeakPolarHBondContact CE-OE1 3.27Å; K72-E253 VanDerWaalsContact NZ-CD 3.31Å; K72-E253 IonicContact NZ-OE1 3.89Å; K72-E253 PolarHBondContact NZ-OE1 3.24Å; K72-E253 VanDerWaalsContact NZ-OE1 3.11Å; K72-E253 IonicContact NZ-OE2 3.82Å; K72-E253 PolarHBondContact NZ-OE2 3.41Å; N250-E253 WeakPolarHBondContact ND2-CG 3.29Å; N250-E253 PolarHBondContact O-N 2.73Å; P251-E253 VanDerWaalsContact C-N 3.3Å; E253-E255 PolarHBondContact O-N 2.93Å; E253-E255 VanDerWaalsContact O-N 3.17Å; E253-A256 PolarHBondContact O-N 2.77Å; E253-A256 VanDerWaalsContact O-N 3.17Å; E253-L257 HydrophobicContact CB-CD1 4.44Å; E253-L257 HydrophobicContact CB-CG 4.45Å; E253-L257 WeakPolarHBondContact O-CG 3.28Å; E253-L257 PolarHBondContact O-N 3.01Å
254	Q	91.6	Very high	88.4	Confident	40 Å²	40	37.3 Å²	37.3	19%	0.187	20%	0.199	C	C	.	.	H	α-helix	trans	-50.9	-44.1	-176.6	174.5	172.4	53.1	0	0	112.6	C247 L257 V258 F284	C247-Q254 HydrophobicContact CB-CB 4.08Å; C247-Q254 HydrophobicContact CB-CG 4.09Å; Q254-L257 PolarHBondContact O-N 2.65Å; Q254-V258 WeakPolarHBondContact O-CG2 3.48Å; Q254-V258 PolarHBondContact O-N 2.68Å; Q254-F284 VanDerWaalsContact CD-CG 3.46Å; Q254-F284 HydrophobicContact CG-CB 4.36Å; Q254-F284 HydrophobicContact CG-CD1 4.28Å; Q254-F284 HydrophobicContact CG-CD2 3.67Å; Q254-F284 HydrophobicContact CG-CE2 3.95Å; Q254-F284 HydrophobicContact CG-CG 3.84Å; Q254-F284 HydrophobicContact CG-CZ 4.37Å; Q254-F284 VanDerWaalsContact NE2-CZ 3.27Å
255	E	94.1	Very high	89.1	Confident	5 Å²	5	35.4 Å²	35.4	2%	0.023	19%	0.185	C	C	.	.	H	α-helix	trans	-61.2	-47.4	-178.8	-179.8	177.3	173.9	0	0	112.8	E253 A259 T285 L286 Y287 E288 S291	E253-E255 PolarHBondContact O-N 2.93Å; E253-E255 VanDerWaalsContact O-N 3.17Å; E255-A259 PolarHBondContact O-N 3.21Å; E255-T285 WeakPolarHBondContact CB-OG1 3.49Å; E255-T285 WeakPolarHBondContact CG-O 3.38Å; E255-T285 WeakPolarHBondContact OE2-CB 3.44Å; E255-T285 PolarHBondContact OE2-OG1 2.89Å; E255-L286 VanDerWaalsContact OE1-CA 3.25Å; E255-L286 WeakPolarHBondContact OE1-CA 3.37Å; E255-L286 PolarHBondContact OE2-N 2.96Å; E255-Y287 VanDerWaalsContact CD-N 3.28Å; E255-Y287 PolarHBondContact OE1-N 2.73Å; E255-Y287 PolarHBondContact OE2-N 3.19Å; E255-E288 HydrophobicContact CB-CG 4.14Å; E255-E288 VanDerWaalsContact CD-CG 3.49Å; E255-E288 HydrophobicContact CG-CB 4.04Å; E255-E288 HydrophobicContact CG-CG 3.68Å; E255-E288 WeakPolarHBondContact OE1-CB 3.35Å; E255-E288 PolarHBondContact OE1-N 2.87Å; E255-S291 WeakPolarHBondContact OE1-CB 3.38Å; E255-S291 PolarHBondContact OE1-OG 2.94Å
256	A	92.5	Very high	89.9	Confident	37 Å²	37	32.3 Å²	32.3	31%	0.306	17%	0.172	S	C	.	.	H	α-helix	trans	-65.2	-42.4	178.5	0	0	0	0	0	111.4	E253 V258 A259 E288	E253-A256 PolarHBondContact O-N 2.77Å; E253-A256 VanDerWaalsContact O-N 3.17Å; A256-V258 VanDerWaalsContact C-N 3.27Å; A256-V258 PolarHBondContact O-N 3Å; A256-A259 WeakPolarHBondContact O-CB 3.47Å; A256-A259 PolarHBondContact O-N 3.48Å; A256-E288 HydrophobicContact CB-CG 4.44Å
257	L	91.8	Very high	91.1	Very high	92 Å²	92	30.2 Å²	30.2	48%	0.482	16%	0.161	S	C	.	.	H	α-helix	trans	-63	-29.5	-178.1	-70.7	172.1	0	0	0	113.8	C247 N250 E253 Q254	C247-L257 HydrophobicContact CB-CD1 4.25Å; N250-L257 HydrophobicContact CB-CD1 4.21Å; E253-L257 HydrophobicContact CB-CD1 4.44Å; E253-L257 HydrophobicContact CB-CG 4.45Å; E253-L257 WeakPolarHBondContact O-CG 3.28Å; E253-L257 PolarHBondContact O-N 3.01Å; Q254-L257 PolarHBondContact O-N 2.65Å
258	V	94.1	Very high	92	Very high	0 Å²	0	29.8 Å²	29.8	0%	0	16%	0.158	C	C	.	.	H	α-helix	trans	-100.3	-2.2	179.2	-56.2	0	0	0	0	113.5	F245 Q254 A256 S260 L261 H262 F284	F245-V258 HydrophobicContact CD2-CG1 4.2Å; Q254-V258 WeakPolarHBondContact O-CG2 3.48Å; Q254-V258 PolarHBondContact O-N 2.68Å; A256-V258 VanDerWaalsContact C-N 3.27Å; A256-V258 PolarHBondContact O-N 3Å; V258-S260 VanDerWaalsContact C-N 3.35Å; V258-S260 PolarHBondContact O-N 3.17Å; V258-L261 WeakPolarHBondContact O-CA 3.39Å; V258-L261 WeakPolarHBondContact O-CB 3.34Å; V258-L261 PolarHBondContact O-N 3.32Å; V258-H262 WeakPolarHBondContact CG2-CE1 3.39Å; V258-H262 PolarHBondContact O-N 3.31Å; V258-F284 HydrophobicContact CG1-CE2 4.29Å; V258-F284 HydrophobicContact CG2-CD2 3.85Å; V258-F284 HydrophobicContact CG2-CE2 4Å
259	A	95.8	Very high	93.2	Very high	5 Å²	5	25.8 Å²	25.8	4%	0.041	14%	0.139	C	C	.	.	H	α-helix	trans	-57.3	-44.4	-172.4	0	0	0	0	0	112.9	E255 A256 L261 H262 Y263 A349	E255-A259 PolarHBondContact O-N 3.21Å; A256-A259 WeakPolarHBondContact O-CB 3.47Å; A256-A259 PolarHBondContact O-N 3.48Å; A259-L261 VanDerWaalsContact C-N 3.26Å; A259-L261 PolarHBondContact O-N 3.15Å; A259-H262 PolarHBondContact O-N 3.33Å; A259-Y263 WeakPolarHBondContact O-CD1 3.44Å; A259-Y263 PolarHBondContact O-N 3.44Å; A259-A349 HydrophobicContact CB-CB 3.58Å
260	S	96.4	Very high	94.3	Very high	5 Å²	5	20.6 Å²	20.6	4%	0.035	12%	0.115	C	C	.	.	H	α-helix	trans	-61.3	-34.4	176.2	-68.5	0	0	0	0	112.3	M218 V258 C264 P346 L348 A349	M218-S260 VanDerWaalsContact CE-C 3.45Å; V258-S260 VanDerWaalsContact C-N 3.35Å; V258-S260 PolarHBondContact O-N 3.17Å; S260-C264 WeakPolarHBondContact O-CB 3.23Å; S260-C264 PolarHBondContact O-N 3.5Å; S260-C264 PolarHBondContact O-SG 3.13Å; S260-P346 WeakPolarHBondContact CB-O 3.35Å; S260-P346 PolarHBondContact OG-O 2.73Å; S260-L348 PolarHBondContact OG-N 3.37Å; S260-A349 WeakPolarHBondContact OG-CB 3.41Å; S260-A349 PolarHBondContact OG-N 3.48Å
261	L	96.9	Very high	95	Very high	4 Å²	4	18.1 Å²	18.1	2%	0.021	10%	0.102	C	C	.	.	H	α-helix	trans	-69.4	-46.9	176.5	176.7	65	0	0	0	110.7	I217 M218 F245 V258 A259 Y263 C264 E265	I217-L261 HydrophobicContact CG2-CD1 3.9Å; M218-L261 HydrophobicContact CE-CB 4.14Å; M218-L261 HydrophobicContact CG-CD1 3.91Å; M218-L261 HydrophobicContact SD-CB 4.32Å; M218-L261 HydrophobicContact SD-CD1 4.24Å; F245-L261 HydrophobicContact CD2-CD2 4.42Å; F245-L261 HydrophobicContact CE1-CD2 4.31Å; F245-L261 HydrophobicContact CE2-CB 3.71Å; F245-L261 HydrophobicContact CE2-CD2 3.74Å; F245-L261 HydrophobicContact CE2-CG 4.25Å; F245-L261 HydrophobicContact CZ-CB 4Å; F245-L261 HydrophobicContact CZ-CD1 4.2Å; F245-L261 HydrophobicContact CZ-CD2 3.68Å; F245-L261 HydrophobicContact CZ-CG 4.17Å; V258-L261 WeakPolarHBondContact O-CA 3.39Å; V258-L261 WeakPolarHBondContact O-CB 3.34Å; V258-L261 PolarHBondContact O-N 3.32Å; A259-L261 VanDerWaalsContact C-N 3.26Å; A259-L261 PolarHBondContact O-N 3.15Å; L261-Y263 VanDerWaalsContact C-N 3.26Å; L261-Y263 PolarHBondContact O-N 3.21Å; L261-C264 CarbonylContact O-C 3.3Å; L261-C264 WeakPolarHBondContact O-CA 3.46Å; L261-C264 WeakPolarHBondContact O-CB 2.9Å; L261-C264 PolarHBondContact O-N 2.88Å; L261-E265 HydrophobicContact CD1-CG 4.1Å; L261-E265 HydrophobicContact CG-CG 4.3Å; L261-E265 WeakPolarHBondContact O-CG 3.1Å; L261-E265 PolarHBondContact O-N 2.99Å
262	H	98	Very high	95.7	Very high	3 Å²	3	16 Å²	16	1%	0.014	9%	0.087	C	C	.	.	H	α-helix	trans	-59.2	-38.6	176.7	-64.8	157.3	0	0	0	112.1	V258 A259 E265 A266 L281 K282 L294	V258-H262 WeakPolarHBondContact CG2-CE1 3.39Å; V258-H262 PolarHBondContact O-N 3.31Å; A259-H262 PolarHBondContact O-N 3.33Å; H262-E265 IonicContact CD2-OE2 3.02Å; H262-E265 PolarHBondContact O-N 3.36Å; H262-A266 VanDerWaalsContact O-CB 3.26Å; H262-A266 WeakPolarHBondContact O-CB 3.36Å; H262-A266 PolarHBondContact O-N 3.11Å; H262-L281 HydrophobicContact CB-CD2 4.46Å; H262-K282 PolarHBondContact CD2-O 3.31Å; H262-K282 PolarHBondContact NE2-O 3.31Å; H262-K282 VanDerWaalsContact NE2-O 3.12Å; H262-L294 HydrophobicContact CB-CD2 3.86Å
263	Y	97.9	Very high	96.2	Very high	7 Å²	7	13.9 Å²	13.9	3%	0.027	8%	0.076	C	C	.	.	H	α-helix	trans	-66	-40.8	175.5	-80	24.9	0	0	0	111.5	A259 L261 A267 S290 L294 L348 A349 L354	A259-Y263 WeakPolarHBondContact O-CD1 3.44Å; A259-Y263 PolarHBondContact O-N 3.44Å; L261-Y263 VanDerWaalsContact C-N 3.26Å; L261-Y263 PolarHBondContact O-N 3.21Å; Y263-A267 VanDerWaalsContact O-CB 3.26Å; Y263-A267 WeakPolarHBondContact O-CB 3.44Å; Y263-A267 PolarHBondContact O-N 3.36Å; Y263-S290 VanDerWaalsContact CE1-O 3.24Å; Y263-S290 WeakPolarHBondContact CE1-O 3.3Å; Y263-S290 VanDerWaalsContact OH-C 3.28Å; Y263-S290 WeakPolarHBondContact OH-CA 3.02Å; Y263-S290 PolarHBondContact OH-O 3.01Å; Y263-L294 HydrophobicContact CD1-CB 4.25Å; Y263-L294 HydrophobicContact CD1-CD1 4.32Å; Y263-L294 HydrophobicContact CD1-CD2 4.04Å; Y263-L294 HydrophobicContact CD1-CG 4.44Å; Y263-L294 HydrophobicContact CE1-CB 3.7Å; Y263-L294 HydrophobicContact CE1-CD2 4.25Å; Y263-L294 HydrophobicContact CE1-CG 4.38Å; Y263-L348 HydrophobicContact CD2-CD2 4.08Å; Y263-L348 HydrophobicContact CD2-CG 3.92Å; Y263-L348 HydrophobicContact CG-CD2 4.33Å; Y263-A349 HydrophobicContact CD2-CB 4.41Å; Y263-A349 HydrophobicContact CE2-CB 4.4Å; Y263-L354 HydrophobicContact CE2-CB 3.84Å; Y263-L354 HydrophobicContact CE2-CD2 4.38Å
264	C	98.3	Very high	96.5	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	7%	0.069	C	C	.	.	H	α-helix	trans	-62.3	-47.8	175.3	-73.1	0	0	0	0	111.6	M218 S260 L261 A267 A268 Y344	M218-C264 HydrophobicContact CG-CB 4.46Å; S260-C264 WeakPolarHBondContact O-CB 3.23Å; S260-C264 PolarHBondContact O-N 3.5Å; S260-C264 PolarHBondContact O-SG 3.13Å; L261-C264 CarbonylContact O-C 3.3Å; L261-C264 WeakPolarHBondContact O-CA 3.46Å; L261-C264 WeakPolarHBondContact O-CB 2.9Å; L261-C264 PolarHBondContact O-N 2.88Å; C264-A267 PolarHBondContact O-N 3.11Å; C264-A268 WeakPolarHBondContact O-CB 3.5Å; C264-A268 PolarHBondContact O-N 2.77Å; C264-Y344 VanDerWaalsContact CA-CE2 3.43Å; C264-Y344 HydrophobicContact CB-CE1 4.17Å; C264-Y344 HydrophobicContact CB-CE2 3.69Å; C264-Y344 VanDerWaalsContact CB-CZ 3.46Å; C264-Y344 WeakPolarHBondContact CB-OH 3.46Å; C264-Y344 WeakPolarHBondContact O-CE2 3.45Å; C264-Y344 PolarHBondContact O-OH 3.02Å; C264-Y344 VanDerWaalsContact SG-CZ 3.58Å
265	E	98.6	Very high	96.7	Very high	0 Å²	0	13.5 Å²	13.5	0%	0	8%	0.083	C	C	.	.	H	α-helix	trans	-64.1	-40.9	178.4	-70.8	176.9	139.7	0	0	112.2	L148 C149 A241 G243 L261 H262 A268 A269 L281	L148-E265 HydrophobicContact CB-CG 4.5Å; L148-E265 HydrophobicContact CD1-CB 4.3Å; L148-E265 HydrophobicContact CD1-CG 4.42Å; C149-E265 WeakPolarHBondContact CB-OE1 3.36Å; C149-E265 PolarHBondContact SG-OE1 3.25Å; A241-E265 HydrophobicContact CB-CB 3.84Å; A241-E265 HydrophobicContact CB-CG 4.01Å; G243-E265 WeakPolarHBondContact CA-OE1 3.42Å; G243-E265 PolarHBondContact N-OE1 3.04Å; L261-E265 HydrophobicContact CD1-CG 4.1Å; L261-E265 HydrophobicContact CG-CG 4.3Å; L261-E265 WeakPolarHBondContact O-CG 3.1Å; L261-E265 PolarHBondContact O-N 2.99Å; H262-E265 IonicContact CD2-OE2 3.02Å; H262-E265 PolarHBondContact O-N 3.36Å; E265-A268 PolarHBondContact O-N 2.88Å; E265-A269 WeakPolarHBondContact O-CB 3.42Å; E265-A269 PolarHBondContact O-N 3.36Å; E265-L281 HydrophobicContact CB-CD1 4.16Å; E265-L281 WeakPolarHBondContact OE2-CD1 3.33Å
266	A	98.5	Very high	96.8	Very high	2 Å²	2	14.3 Å²	14.3	2%	0.017	9%	0.093	C	C	.	.	H	α-helix	trans	-68.1	-42.7	175.8	0	0	0	0	0	112.4	H262 A268 A269 L270 F279 L294	H262-A266 VanDerWaalsContact O-CB 3.26Å; H262-A266 WeakPolarHBondContact O-CB 3.36Å; H262-A266 PolarHBondContact O-N 3.11Å; A266-A268 VanDerWaalsContact C-N 3.29Å; A266-A268 PolarHBondContact O-N 2.94Å; A266-A269 PolarHBondContact O-N 3.07Å; A266-L270 WeakPolarHBondContact O-CB 3.34Å; A266-L270 VanDerWaalsContact O-CG 3.27Å; A266-L270 WeakPolarHBondContact O-CG 3.47Å; A266-L270 PolarHBondContact O-N 3.14Å; A266-F279 HydrophobicContact CB-CE1 4.17Å; A266-L294 HydrophobicContact CB-CD1 3.53Å
267	A	98	Very high	97	Very high	1 Å²	1	12.5 Å²	12.5	1%	0.008	8%	0.078	C	C	.	.	H	α-helix	trans	-62.2	-39	174.3	0	0	0	0	0	111.4	Y263 C264 L271 L337 Y344	Y263-A267 VanDerWaalsContact O-CB 3.26Å; Y263-A267 WeakPolarHBondContact O-CB 3.44Å; Y263-A267 PolarHBondContact O-N 3.36Å; C264-A267 PolarHBondContact O-N 3.11Å; A267-L271 VanDerWaalsContact O-CB 3.32Å; A267-L271 WeakPolarHBondContact O-CB 3.32Å; A267-L271 PolarHBondContact O-N 2.96Å; A267-L337 HydrophobicContact CB-CD1 4.18Å; A267-Y344 HydrophobicContact CB-CD2 4.21Å; A267-Y344 HydrophobicContact CB-CE2 4.06Å
268	A	98.3	Very high	97.4	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-61.9	-48.1	172.2	0	0	0	0	0	111.8	L148 L223 C264 E265 A266 L270 L271 L272	L148-A268 HydrophobicContact CD1-CB 3.65Å; L223-A268 HydrophobicContact CD1-CB 3.62Å; C264-A268 WeakPolarHBondContact O-CB 3.5Å; C264-A268 PolarHBondContact O-N 2.77Å; E265-A268 PolarHBondContact O-N 2.88Å; A266-A268 VanDerWaalsContact C-N 3.29Å; A266-A268 PolarHBondContact O-N 2.94Å; A268-L270 PolarHBondContact O-N 2.84Å; A268-L271 PolarHBondContact O-N 3.1Å; A268-L272 WeakPolarHBondContact O-CB 3.34Å; A268-L272 WeakPolarHBondContact O-CG 3.46Å; A268-L272 PolarHBondContact O-N 3.12Å
269	A	98.5	Very high	97.6	Very high	0 Å²	0	8.2 Å²	8.2	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-58.5	-48	177.6	0	0	0	0	0	112.3	V239 E265 A266 L271 L272 L273 F279	V239-A269 HydrophobicContact CB-CB 4.09Å; V239-A269 HydrophobicContact CG1-CB 3.81Å; E265-A269 WeakPolarHBondContact O-CB 3.42Å; E265-A269 PolarHBondContact O-N 3.36Å; A266-A269 PolarHBondContact O-N 3.07Å; A269-L271 VanDerWaalsContact C-N 3.31Å; A269-L271 PolarHBondContact O-N 2.78Å; A269-L272 PolarHBondContact O-N 3.07Å; A269-L273 HydrophobicContact CB-CD1 4.2Å; A269-L273 VanDerWaalsContact O-CB 3.26Å; A269-L273 WeakPolarHBondContact O-CB 3.48Å; A269-L273 VanDerWaalsContact O-CG 3.29Å; A269-L273 WeakPolarHBondContact O-CG 3.48Å; A269-L273 PolarHBondContact O-N 3.45Å; A269-F279 HydrophobicContact CB-CB 4.49Å; A269-F279 HydrophobicContact CB-CD1 3.96Å; A269-F279 HydrophobicContact CB-CD2 3.44Å; A269-F279 VanDerWaalsContact CB-CD2 3.44Å; A269-F279 HydrophobicContact CB-CE1 3.94Å; A269-F279 HydrophobicContact CB-CE2 3.46Å; A269-F279 VanDerWaalsContact CB-CE2 3.46Å; A269-F279 HydrophobicContact CB-CG 3.71Å; A269-F279 HydrophobicContact CB-CZ 3.69Å
270	L	98.2	Very high	97.7	Very high	1 Å²	1	8 Å²	8	1%	0.005	5%	0.054	C	C	.	.	H	α-helix	trans	-63.5	-34.7	178.2	-66.9	172.2	0	0	0	112.6	A266 A268 L297 C301 F302 Y327 V333 L337	A266-L270 WeakPolarHBondContact O-CB 3.34Å; A266-L270 VanDerWaalsContact O-CG 3.27Å; A266-L270 WeakPolarHBondContact O-CG 3.47Å; A266-L270 PolarHBondContact O-N 3.14Å; A268-L270 PolarHBondContact O-N 2.84Å; L270-L297 HydrophobicContact CD1-CD2 4.11Å; L270-L297 HydrophobicContact CD1-CG 4.43Å; L270-C301 HydrophobicContact CD2-CB 3.76Å; L270-F302 HydrophobicContact CD2-CE2 3.81Å; L270-F302 HydrophobicContact CD2-CZ 4.32Å; L270-Y327 HydrophobicContact CD2-CD2 4.21Å; L270-Y327 HydrophobicContact CD2-CE2 3.54Å; L270-Y327 PolarHBondContact O-OH 3.26Å; L270-V333 HydrophobicContact CD1-CG2 4.33Å; L270-L337 HydrophobicContact CB-CD1 4.35Å; L270-L337 HydrophobicContact CB-CD2 4.46Å
271	L	97.3	Very high	97.8	Very high	19 Å²	19	7.8 Å²	7.8	10%	0.099	5%	0.052	C	C	.	.	H	α-helix	trans	-68.9	-42.1	175.6	-176.6	64	0	0	0	112	L223 Q227 A267 A268 A269 K330 L337 I341	L223-L271 HydrophobicContact CD1-CD2 3.71Å; L223-L271 HydrophobicContact CD2-CD2 4.13Å; L223-L271 HydrophobicContact CG-CD2 3.76Å; Q227-L271 HydrophobicContact CB-CD2 4.21Å; Q227-L271 HydrophobicContact CG-CD2 4.45Å; A267-L271 VanDerWaalsContact O-CB 3.32Å; A267-L271 WeakPolarHBondContact O-CB 3.32Å; A267-L271 PolarHBondContact O-N 2.96Å; A268-L271 PolarHBondContact O-N 3.1Å; A269-L271 VanDerWaalsContact C-N 3.31Å; A269-L271 PolarHBondContact O-N 2.78Å; L271-K330 PolarHBondContact O-NZ 3.01Å; L271-L337 HydrophobicContact CB-CD2 4.14Å; L271-L337 HydrophobicContact CD1-CD2 4.05Å; L271-I341 HydrophobicContact CD1-CD1 4.1Å; L271-I341 HydrophobicContact CD2-CD1 4.36Å
272	L	97.6	Very high	97.9	Very high	7 Å²	7	8.7 Å²	8.7	4%	0.037	6%	0.056	C	C	.	.	H	α-helix	trans	-85.8	-47.3	-170.2	-62.7	179.6	0	0	0	112.8	V146 L226 Q227 V230 V236 V239 A268 A269 S274 K330	V146-L272 HydrophobicContact CG1-CD1 4.05Å; L226-L272 HydrophobicContact CD2-CD1 3.85Å; L226-L272 HydrophobicContact CG-CD1 4.12Å; Q227-L272 HydrophobicContact CB-CD2 4.09Å; Q227-L272 HydrophobicContact CG-CD2 4.34Å; V230-L272 HydrophobicContact CG2-CD2 3.68Å; V236-L272 HydrophobicContact CG1-CB 4.5Å; V239-L272 HydrophobicContact CG2-CB 4.46Å; A268-L272 WeakPolarHBondContact O-CB 3.34Å; A268-L272 WeakPolarHBondContact O-CG 3.46Å; A268-L272 PolarHBondContact O-N 3.12Å; A269-L272 PolarHBondContact O-N 3.07Å; L272-S274 PolarHBondContact O-N 3.23Å; L272-K330 PolarHBondContact O-NZ 3.18Å
273	L	97.7	Very high	97.9	Very high	0 Å²	0	8.6 Å²	8.6	0%	0	6%	0.055	C	C	.	.	P	Polyproline II helix	trans	-57.4	131.2	-170.6	-81.1	168.2	0	0	0	114.2	V236 V239 A269 S278 F279 F302 Y327 K330	V236-L273 HydrophobicContact CG1-CD2 4.39Å; V239-L273 HydrophobicContact CB-CD1 4.35Å; V239-L273 HydrophobicContact CB-CD2 4.21Å; V239-L273 HydrophobicContact CB-CG 4.16Å; V239-L273 HydrophobicContact CG2-CD1 4.28Å; V239-L273 HydrophobicContact CG2-CD2 3.67Å; V239-L273 HydrophobicContact CG2-CG 3.58Å; A269-L273 HydrophobicContact CB-CD1 4.2Å; A269-L273 VanDerWaalsContact O-CB 3.26Å; A269-L273 WeakPolarHBondContact O-CB 3.48Å; A269-L273 VanDerWaalsContact O-CG 3.29Å; A269-L273 WeakPolarHBondContact O-CG 3.48Å; A269-L273 PolarHBondContact O-N 3.45Å; L273-S278 WeakPolarHBondContact CD2-O 3.47Å; L273-F279 HydrophobicContact CD1-CB 3.88Å; L273-F302 HydrophobicContact CD1-CE1 3.96Å; L273-F302 HydrophobicContact CD1-CZ 3.78Å; L273-Y327 HydrophobicContact CB-CD1 3.83Å; L273-Y327 HydrophobicContact CB-CE1 4.28Å; L273-Y327 HydrophobicContact CB-CG 4.42Å; L273-Y327 WeakPolarHBondContact O-CD1 3.41Å; L273-Y327 WeakPolarHBondContact O-CE1 3.23Å; L273-K330 WeakPolarHBondContact O-CE 3.45Å; L273-K330 PolarHBondContact O-NZ 3.18Å
274	S	95.8	Very high	97.8	Very high	22 Å²	22	8.8 Å²	8.8	15%	0.154	6%	0.057	C	C	.	.	P	Polyproline II helix	trans	-76	156.6	169.9	-58.5	0	0	0	0	111.3	R235 V236 L272 G276 G277	R235-S274 WeakPolarHBondContact CA-OG 3.45Å; R235-S274 WeakPolarHBondContact CB-OG 3.3Å; V236-S274 PolarHBondContact N-OG 2.9Å; V236-S274 VanDerWaalsContact N-OG 3.1Å; V236-S274 PolarHBondContact O-N 2.83Å; L272-S274 PolarHBondContact O-N 3.23Å; S274-G276 PolarHBondContact O-N 2.94Å; S274-G277 PolarHBondContact O-N 3.44Å
275	P	95.8	Very high	97.7	Very high	74 Å²	74	9.8 Å²	9.8	48%	0.481	6%	0.062	S	C	.	.	T	Hydrogen-bonded Turn	trans	-50.8	140.6	173.4	-27	35.5	0	0	0	112.1	R235 G277 Y327	R235-P275 PolarHBondContact NH2-O 3.15Å; P275-G277 PolarHBondContact O-N 3.24Å; P275-Y327 CarbonylContact C-O 3.05Å; P275-Y327 WeakPolarHBondContact CA-O 3.31Å
276	G	96.3	Very high	97.7	Very high	21 Å²	21	10 Å²	10	22%	0.216	6%	0.064	C	C	.	.	T	Hydrogen-bonded Turn	trans	78.6	-5.1	-172.4	0	0	0	0	0	115	S274 Y327	S274-G276 PolarHBondContact O-N 2.94Å; G276-Y327 PolarHBondContact N-O 3.39Å
277	G	97.8	Very high	97.7	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	6%	0.064	C	C	.	.			trans	-70.4	171	178.2	0	0	0	0	0	114.3	D237 S274 P275 N326 Y327	D237-G277 CarbonylContact O-C 3.54Å; D237-G277 WeakPolarHBondContact O-CA 3.32Å; S274-G277 PolarHBondContact O-N 3.44Å; P275-G277 PolarHBondContact O-N 3.24Å; G277-N326 WeakPolarHBondContact O-CA 3.18Å; G277-N326 PolarHBondContact O-N 3.4Å; G277-Y327 PolarHBondContact O-N 3.31Å
278	S	98.8	Very high	97.6	Very high	2 Å²	2	11.5 Å²	11.5	1%	0.014	7%	0.07	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	148.4	-177.1	-59.2	0	0	0	0	112.2	L132 D237 V238 V239 L273 C324	L132-S278 WeakPolarHBondContact O-CB 3.39Å; L132-S278 PolarHBondContact O-OG 2.85Å; D237-S278 PolarHBondContact O-N 3.35Å; V238-S278 WeakPolarHBondContact CA-O 3.43Å; V239-S278 PolarHBondContact N-O 2.92Å; L273-S278 WeakPolarHBondContact CD2-O 3.47Å; S278-C324 CarbonylContact C-O 3.56Å; S278-C324 VanDerWaalsContact CA-O 3.31Å; S278-C324 WeakPolarHBondContact CA-O 3.19Å
279	F	98.9	Very high	97.5	Very high	0 Å²	0	11.7 Å²	11.7	0%	0	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126	135.1	177.5	-178.4	-141.1	0	0	0	110.8	V239 A241 A266 A269 L273 L281 L298 F302 C324	V239-F279 HydrophobicContact CB-CD2 3.97Å; V239-F279 HydrophobicContact CG1-CD2 3.92Å; V239-F279 HydrophobicContact CG1-CE2 3.99Å; V239-F279 CarbonylContact O-C 3.48Å; V239-F279 WeakPolarHBondContact O-CA 3.39Å; V239-F279 WeakPolarHBondContact O-CD2 3.31Å; A241-F279 HydrophobicContact CB-CE2 3.92Å; A241-F279 HydrophobicContact CB-CZ 4.23Å; A266-F279 HydrophobicContact CB-CE1 4.17Å; A269-F279 HydrophobicContact CB-CB 4.49Å; A269-F279 HydrophobicContact CB-CD1 3.96Å; A269-F279 HydrophobicContact CB-CD2 3.44Å; A269-F279 VanDerWaalsContact CB-CD2 3.44Å; A269-F279 HydrophobicContact CB-CE1 3.94Å; A269-F279 HydrophobicContact CB-CE2 3.46Å; A269-F279 VanDerWaalsContact CB-CE2 3.46Å; A269-F279 HydrophobicContact CB-CG 3.71Å; A269-F279 HydrophobicContact CB-CZ 3.69Å; L273-F279 HydrophobicContact CD1-CB 3.88Å; F279-L281 HydrophobicContact CD1-CB 4.4Å; F279-L281 HydrophobicContact CE1-CB 3.71Å; F279-L281 HydrophobicContact CE1-CD2 4.08Å; F279-L281 HydrophobicContact CE1-CG 4.35Å; F279-L281 HydrophobicContact CE2-CB 4.27Å; F279-L281 HydrophobicContact CZ-CB 3.64Å; F279-L281 HydrophobicContact CZ-CD1 4Å; F279-L281 HydrophobicContact CZ-CD2 4.24Å; F279-L281 HydrophobicContact CZ-CG 4.16Å; F279-L298 HydrophobicContact CD1-CD2 4.1Å; F279-L298 HydrophobicContact CE1-CD2 4.26Å; F279-F302 HydrophobicContact CB-CE1 3.94Å; F279-F302 HydrophobicContact CB-CZ 3.66Å; F279-F302 HydrophobicContact CD1-CZ 4.49Å; F279-C324 HydrophobicContact CB-CB 4.12Å; F279-C324 PolarHBondContact N-O 2.99Å; F279-C324 PolarHBondContact O-N 3.42Å
280	V	98.9	Very high	97.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	119.8	170.2	-179	0	0	0	0	108.7	F123 I126 L132 V239 T240 A241 Y321 V322	F123-V280 HydrophobicContact CE2-CG2 4.28Å; I126-V280 HydrophobicContact CD1-CG1 3.99Å; I126-V280 HydrophobicContact CG2-CG2 4.19Å; L132-V280 HydrophobicContact CD1-CG2 3.47Å; L132-V280 VanDerWaalsContact CD1-CG2 3.47Å; L132-V280 HydrophobicContact CD2-CG2 3.93Å; L132-V280 HydrophobicContact CG-CG2 4.38Å; V239-V280 PolarHBondContact O-N 2.74Å; T240-V280 CarbonylContact C-O 3.44Å; T240-V280 WeakPolarHBondContact CA-O 3.26Å; T240-V280 HydrophobicContact CG2-CB 4.28Å; A241-V280 PolarHBondContact N-O 3.03Å; V280-Y321 HydrophobicContact CG1-CD1 3.89Å; V280-V322 WeakPolarHBondContact CA-O 3.1Å
281	L	98.8	Very high	97.5	Very high	0 Å²	0	12.6 Å²	12.6	0%	0	8%	0.077	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	122.9	179.1	178.1	61.4	0	0	0	110	A241 H262 E265 F279 M283 L294 Y321 V322	A241-L281 HydrophobicContact CB-CD1 3.65Å; H262-L281 HydrophobicContact CB-CD2 4.46Å; E265-L281 HydrophobicContact CB-CD1 4.16Å; E265-L281 WeakPolarHBondContact OE2-CD1 3.33Å; F279-L281 HydrophobicContact CD1-CB 4.4Å; F279-L281 HydrophobicContact CE1-CB 3.71Å; F279-L281 HydrophobicContact CE1-CD2 4.08Å; F279-L281 HydrophobicContact CE1-CG 4.35Å; F279-L281 HydrophobicContact CE2-CB 4.27Å; F279-L281 HydrophobicContact CZ-CB 3.64Å; F279-L281 HydrophobicContact CZ-CD1 4Å; F279-L281 HydrophobicContact CZ-CD2 4.24Å; F279-L281 HydrophobicContact CZ-CG 4.16Å; L281-M283 HydrophobicContact CD2-CG 4Å; L281-M283 HydrophobicContact CD2-SD 3.99Å; L281-M283 HydrophobicContact CG-CG 3.92Å; L281-L294 HydrophobicContact CD2-CD2 3.94Å; L281-Y321 CarbonylContact O-C 3.57Å; L281-Y321 WeakPolarHBondContact O-CA 3.2Å; L281-V322 HydrophobicContact CB-CB 4.38Å; L281-V322 PolarHBondContact N-O 3.22Å; L281-V322 PolarHBondContact O-N 3.24Å
282	K	98.4	Very high	97.5	Very high	23 Å²	23	11.7 Å²	11.7	10%	0.1	7%	0.073	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	134.9	165.6	174.2	168	155.3	170.2	0	109.9	A241 D242 H262 E319 Y321	A241-K282 PolarHBondContact O-N 3.44Å; D242-K282 WeakPolarHBondContact OD1-CD 3.3Å; H262-K282 PolarHBondContact CD2-O 3.31Å; H262-K282 PolarHBondContact NE2-O 3.31Å; H262-K282 VanDerWaalsContact NE2-O 3.12Å; K282-E319 HydrophobicContact CD-CG 4.07Å; K282-E319 VanDerWaalsContact CE-OE2 3.3Å; K282-E319 WeakPolarHBondContact CE-OE2 3.48Å; K282-E319 HydrophobicContact CG-CG 4.1Å; K282-E319 IonicContact NZ-OE2 2.83Å; K282-E319 PolarHBondContact NZ-OE2 3.4Å; K282-Y321 HydrophobicContact CB-CD1 4.07Å; K282-Y321 HydrophobicContact CB-CE1 3.69Å; K282-Y321 HydrophobicContact CD-CE1 4.43Å; K282-Y321 HydrophobicContact CG-CE1 4.26Å
283	M	97.7	Very high	97.5	Very high	1 Å²	1	11.4 Å²	11.4	1%	0.005	7%	0.071	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.8	179.2	169.8	-63.8	-168.3	75.7	0	0	110	L281 L286 L294 L295 E319 V320 V322	L281-M283 HydrophobicContact CD2-CG 4Å; L281-M283 HydrophobicContact CD2-SD 3.99Å; L281-M283 HydrophobicContact CG-CG 3.92Å; M283-L286 HydrophobicContact CB-CD2 3.9Å; M283-L286 HydrophobicContact CE-CD2 3.63Å; M283-L286 HydrophobicContact CG-CD2 4.45Å; M283-L286 HydrophobicContact SD-CD2 3.74Å; M283-L294 HydrophobicContact CE-CD2 4.03Å; M283-L294 HydrophobicContact SD-CD2 4.32Å; M283-L295 HydrophobicContact CE-CD2 4Å; M283-L295 HydrophobicContact SD-CD2 3.74Å; M283-E319 WeakPolarHBondContact O-CA 3.25Å; M283-V320 HydrophobicContact CB-CG2 4.3Å; M283-V320 PolarHBondContact N-O 2.66Å; M283-V320 PolarHBondContact O-N 3.43Å; M283-V322 HydrophobicContact CB-CG2 4.44Å; M283-V322 HydrophobicContact CG-CG2 3.95Å; M283-V322 HydrophobicContact SD-CG2 3.55Å; M283-V322 VanDerWaalsContact SD-CG2 3.55Å
284	F	95.7	Very high	97.6	Very high	12 Å²	12	11.5 Å²	11.5	5%	0.053	7%	0.072	C	C	.	.			trans	-116.9	-125.2	179.4	-62.1	-74.3	0	0	0	110.7	S244 Q254 V258 S318 E319 V320	S244-F284 WeakPolarHBondContact OG-CZ 3.31Å; Q254-F284 VanDerWaalsContact CD-CG 3.46Å; Q254-F284 HydrophobicContact CG-CB 4.36Å; Q254-F284 HydrophobicContact CG-CD1 4.28Å; Q254-F284 HydrophobicContact CG-CD2 3.67Å; Q254-F284 HydrophobicContact CG-CE2 3.95Å; Q254-F284 HydrophobicContact CG-CG 3.84Å; Q254-F284 HydrophobicContact CG-CZ 4.37Å; Q254-F284 VanDerWaalsContact NE2-CZ 3.27Å; V258-F284 HydrophobicContact CG1-CE2 4.29Å; V258-F284 HydrophobicContact CG2-CD2 3.85Å; V258-F284 HydrophobicContact CG2-CE2 4Å; F284-S318 CarbonylContact C-O 3.54Å; F284-S318 WeakPolarHBondContact CA-O 3.46Å; F284-S318 VanDerWaalsContact O-O 3.05Å; F284-E319 HydrophobicContact CD1-CB 4.27Å; F284-E319 HydrophobicContact CE1-CB 4.32Å; F284-V320 WeakPolarHBondContact O-CG2 3.41Å
285	T	96.5	Very high	97.7	Very high	20 Å²	20	10.5 Å²	10.5	12%	0.123	6%	0.064	C	C	.	.			trans	-62.3	162.3	161.6	51.7	0	0	0	0	109.7	L75 E255 Y287	L75-T285 HydrophobicContact CD2-CG2 3.73Å; E255-T285 WeakPolarHBondContact CB-OG1 3.49Å; E255-T285 WeakPolarHBondContact CG-O 3.38Å; E255-T285 WeakPolarHBondContact OE2-CB 3.44Å; E255-T285 PolarHBondContact OE2-OG1 2.89Å; T285-Y287 HydrophobicContact CG2-CD2 3.98Å; T285-Y287 HydrophobicContact CG2-CE2 3.5Å
286	L	97.9	Very high	97.8	Very high	6 Å²	6	7.2 Å²	7.2	3%	0.031	4%	0.042	C	C	.	.			trans	-130.8	36.1	-175.3	-59.9	175.9	0	0	0	110.1	E255 M283 L295 V307 H368 L371 C372	E255-L286 VanDerWaalsContact OE1-CA 3.25Å; E255-L286 WeakPolarHBondContact OE1-CA 3.37Å; E255-L286 PolarHBondContact OE2-N 2.96Å; M283-L286 HydrophobicContact CB-CD2 3.9Å; M283-L286 HydrophobicContact CE-CD2 3.63Å; M283-L286 HydrophobicContact CG-CD2 4.45Å; M283-L286 HydrophobicContact SD-CD2 3.74Å; L286-L295 HydrophobicContact CD2-CD2 3.81Å; L286-V307 HydrophobicContact CD1-CG1 4.06Å; L286-V307 HydrophobicContact CD1-CG2 4.04Å; L286-H368 PolarHBondContact O-NE2 3.45Å; L286-L371 HydrophobicContact CD1-CD2 3.96Å; L286-C372 PolarHBondContact O-SG 2.91Å
287	Y	97.9	Very high	97.9	Very high	6 Å²	6	6.3 Å²	6.3	2%	0.024	3%	0.033	C	C	.	.			trans	-94.4	-25.5	-172.1	-53.6	-32.6	0	0	0	113.3	L68 L71 K72 L75 E255 T285 C372	L68-Y287 WeakPolarHBondContact CB-O 3.49Å; L68-Y287 HydrophobicContact CD2-CD1 4.43Å; L71-Y287 HydrophobicContact CB-CD1 4.4Å; L71-Y287 HydrophobicContact CB-CE1 4.05Å; L71-Y287 HydrophobicContact CB-CE2 4.42Å; L71-Y287 HydrophobicContact CD1-CE1 4.16Å; K72-Y287 HydrophobicContact CB-CD2 3.66Å; K72-Y287 HydrophobicContact CB-CE2 4.36Å; K72-Y287 HydrophobicContact CB-CG 4.35Å; K72-Y287 HydrophobicContact CG-CD2 4.22Å; L75-Y287 HydrophobicContact CD2-CE2 4.09Å; E255-Y287 VanDerWaalsContact CD-N 3.28Å; E255-Y287 PolarHBondContact OE1-N 2.73Å; E255-Y287 PolarHBondContact OE2-N 3.19Å; T285-Y287 HydrophobicContact CG2-CD2 3.98Å; T285-Y287 HydrophobicContact CG2-CE2 3.5Å; Y287-C372 HydrophobicContact CD1-CB 4.13Å; Y287-C372 HydrophobicContact CE1-CB 3.83Å
288	E	96.8	Very high	97.9	Very high	28 Å²	28	6.3 Å²	6.3	13%	0.131	3%	0.033	C	C	.	.	S	Bend	trans	-73.9	147.3	-178.4	-63.1	-57.4	152.9	0	0	111.2	K72 E255 A256 S290 S291 V292	K72-E288 WeakPolarHBondContact CE-OE1 3.34Å; K72-E288 IonicContact NZ-OE1 3.91Å; K72-E288 PolarHBondContact NZ-OE1 3.16Å; E255-E288 HydrophobicContact CB-CG 4.14Å; E255-E288 VanDerWaalsContact CD-CG 3.49Å; E255-E288 HydrophobicContact CG-CB 4.04Å; E255-E288 HydrophobicContact CG-CG 3.68Å; E255-E288 WeakPolarHBondContact OE1-CB 3.35Å; E255-E288 PolarHBondContact OE1-N 2.87Å; A256-E288 HydrophobicContact CB-CG 4.44Å; E288-S290 PolarHBondContact O-N 3.37Å; E288-S290 VanDerWaalsContact O-N 3.13Å; E288-S291 WeakPolarHBondContact O-CB 3.48Å; E288-S291 PolarHBondContact O-N 2.9Å; E288-V292 PolarHBondContact O-N 2.98Å; E288-V292 VanDerWaalsContact O-N 3.08Å
289	H	97.3	Very high	97.9	Very high	4 Å²	4	6.2 Å²	6.2	2%	0.019	3%	0.032	C	C	.	.	H	α-helix	trans	-55.2	-34.6	177.6	-166.8	81.6	0	0	0	112.5	A62 E63 H65 V292 C293 F355 S357	A62-H289 HydrophobicContact CB-CB 4.09Å; E63-H289 VanDerWaalsContact O-CB 3.3Å; E63-H289 WeakPolarHBondContact O-CB 3.32Å; E63-H289 PolarHBondContact O-ND1 3.37Å; H65-H289 AromaticContact CD2-ND1 3.71Å; H65-H289 AromaticContact NE2-CE1 3.72Å; H65-H289 AromaticContact NE2-ND1 3.06Å; H65-H289 PolarHBondContact NE2-ND1 3.1Å; H289-V292 PolarHBondContact O-N 3.23Å; H289-C293 VanDerWaalsContact CD2-SG 3.56Å; H289-C293 PolarHBondContact NE2-SG 3.46Å; H289-C293 VanDerWaalsContact NE2-SG 3.41Å; H289-C293 PolarHBondContact O-N 3.4Å; H289-C293 PolarHBondContact O-SG 3.36Å; H289-F355 PolarHBondContact NE2-O 3.19Å; H289-S357 PolarHBondContact CE1-OG 2.89Å
290	S	97.2	Very high	97.7	Very high	18 Å²	18	6.6 Å²	6.6	13%	0.126	4%	0.035	C	C	.	.	H	α-helix	trans	-61.7	-44.7	177.3	57.3	0	0	0	0	111.7	Y263 E288 C293 L294	Y263-S290 VanDerWaalsContact CE1-O 3.24Å; Y263-S290 WeakPolarHBondContact CE1-O 3.3Å; Y263-S290 VanDerWaalsContact OH-C 3.28Å; Y263-S290 WeakPolarHBondContact OH-CA 3.02Å; Y263-S290 PolarHBondContact OH-O 3.01Å; E288-S290 PolarHBondContact O-N 3.37Å; E288-S290 VanDerWaalsContact O-N 3.13Å; S290-C293 PolarHBondContact O-N 3.02Å; S290-L294 WeakPolarHBondContact O-CB 3.4Å; S290-L294 PolarHBondContact O-N 2.78Å
291	S	97.9	Very high	97.7	Very high	2 Å²	2	6.8 Å²	6.8	1%	0.014	4%	0.036	C	C	.	.	H	α-helix	trans	-64.4	-44.2	174.7	-63.2	0	0	0	0	111.8	E255 E288 C293 L294 L295	E255-S291 WeakPolarHBondContact OE1-CB 3.38Å; E255-S291 PolarHBondContact OE1-OG 2.94Å; E288-S291 WeakPolarHBondContact O-CB 3.48Å; E288-S291 PolarHBondContact O-N 2.9Å; S291-C293 VanDerWaalsContact C-N 3.34Å; S291-C293 PolarHBondContact O-N 3.28Å; S291-L294 PolarHBondContact O-N 3.46Å; S291-L295 WeakPolarHBondContact O-CD2 3.49Å; S291-L295 PolarHBondContact O-N 2.87Å
292	V	98.4	Very high	97.6	Very high	0 Å²	0	6.8 Å²	6.8	0%	0	4%	0.036	C	C	.	.	H	α-helix	trans	-55.7	-49.8	176.8	179.4	0	0	0	0	110.6	L68 E288 H289 L294 L295 Y296 I360 F364 L365	L68-V292 HydrophobicContact CD1-CG2 3.66Å; E288-V292 PolarHBondContact O-N 2.98Å; E288-V292 VanDerWaalsContact O-N 3.08Å; H289-V292 PolarHBondContact O-N 3.23Å; V292-L294 VanDerWaalsContact C-N 3.35Å; V292-L294 PolarHBondContact O-N 3.16Å; V292-L295 PolarHBondContact O-N 3.19Å; V292-Y296 WeakPolarHBondContact O-CB 3.3Å; V292-Y296 PolarHBondContact O-N 3.28Å; V292-I360 HydrophobicContact CG1-CD1 4.07Å; V292-F364 HydrophobicContact CG1-CE1 4.06Å; V292-L365 HydrophobicContact CG1-CD2 3.58Å
293	C	98.2	Very high	97.5	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-62.1	-41.5	178.5	-67.3	0	0	0	0	112.6	H289 S290 S291 Y296 L297 L354 F355	H289-C293 VanDerWaalsContact CD2-SG 3.56Å; H289-C293 PolarHBondContact NE2-SG 3.46Å; H289-C293 VanDerWaalsContact NE2-SG 3.41Å; H289-C293 PolarHBondContact O-N 3.4Å; H289-C293 PolarHBondContact O-SG 3.36Å; S290-C293 PolarHBondContact O-N 3.02Å; S291-C293 VanDerWaalsContact C-N 3.34Å; S291-C293 PolarHBondContact O-N 3.28Å; C293-Y296 PolarHBondContact O-N 2.95Å; C293-L297 PolarHBondContact O-N 3.27Å; C293-L354 HydrophobicContact CB-CB 3.76Å; C293-L354 HydrophobicContact CB-CD2 4.14Å; C293-L354 HydrophobicContact CB-CG 4.26Å; C293-F355 HydrophobicContact CB-CD2 3.98Å; C293-F355 PolarHBondContact SG-O 3.12Å; C293-F355 VanDerWaalsContact SG-O 3.33Å
294	L	98.4	Very high	97.5	Very high	3 Å²	3	15.9 Å²	15.9	2%	0.016	8%	0.075	C	C	.	.	H	α-helix	trans	-66	-47.3	-179.5	179	60.8	0	0	0	111.7	H262 Y263 A266 L281 M283 S290 S291 V292 Y296 L297 L298	H262-L294 HydrophobicContact CB-CD2 3.86Å; Y263-L294 HydrophobicContact CD1-CB 4.25Å; Y263-L294 HydrophobicContact CD1-CD1 4.32Å; Y263-L294 HydrophobicContact CD1-CD2 4.04Å; Y263-L294 HydrophobicContact CD1-CG 4.44Å; Y263-L294 HydrophobicContact CE1-CB 3.7Å; Y263-L294 HydrophobicContact CE1-CD2 4.25Å; Y263-L294 HydrophobicContact CE1-CG 4.38Å; A266-L294 HydrophobicContact CB-CD1 3.53Å; L281-L294 HydrophobicContact CD2-CD2 3.94Å; M283-L294 HydrophobicContact CE-CD2 4.03Å; M283-L294 HydrophobicContact SD-CD2 4.32Å; S290-L294 WeakPolarHBondContact O-CB 3.4Å; S290-L294 PolarHBondContact O-N 2.78Å; S291-L294 PolarHBondContact O-N 3.46Å; V292-L294 VanDerWaalsContact C-N 3.35Å; V292-L294 PolarHBondContact O-N 3.16Å; L294-Y296 VanDerWaalsContact C-N 3.26Å; L294-Y296 PolarHBondContact O-N 3.25Å; L294-L297 WeakPolarHBondContact O-CB 3.39Å; L294-L297 PolarHBondContact O-N 3.11Å; L294-L298 HydrophobicContact CD1-CD1 4.4Å; L294-L298 HydrophobicContact CD1-CG 4.35Å; L294-L298 HydrophobicContact CG-CD1 4.21Å; L294-L298 WeakPolarHBondContact O-CG 3.34Å; L294-L298 PolarHBondContact O-N 3.09Å
295	L	98.6	Very high	97.6	Very high	0 Å²	0	15.3 Å²	15.3	0%	0	7%	0.073	C	C	.	.	H	α-helix	trans	-63.5	-35.2	177.6	-85.3	-46.7	0	0	0	111.5	M283 L286 S291 V292 L298 N299 V322 F364	M283-L295 HydrophobicContact CE-CD2 4Å; M283-L295 HydrophobicContact SD-CD2 3.74Å; L286-L295 HydrophobicContact CD2-CD2 3.81Å; S291-L295 WeakPolarHBondContact O-CD2 3.49Å; S291-L295 PolarHBondContact O-N 2.87Å; V292-L295 PolarHBondContact O-N 3.19Å; L295-L298 HydrophobicContact CD1-CD1 4.36Å; L295-L298 PolarHBondContact O-N 2.87Å; L295-N299 WeakPolarHBondContact O-CB 3.48Å; L295-N299 PolarHBondContact O-N 3.46Å; L295-N299 PolarHBondContact O-ND2 3.32Å; L295-V322 HydrophobicContact CD1-CB 4.29Å; L295-V322 HydrophobicContact CD1-CG1 3.56Å; L295-V322 HydrophobicContact CD1-CG2 3.7Å; L295-F364 HydrophobicContact CB-CZ 3.95Å
296	Y	98.3	Very high	97.7	Very high	5 Å²	5	14.5 Å²	14.5	2%	0.02	7%	0.068	C	C	.	.	H	α-helix	trans	-64.4	-47.4	173.5	-176.8	-117.9	0	0	0	111.6	W49 R50 P52 V292 C293 L294 L298 N299 C300 F355 I360 P361 F364	W49-Y296 HydrophobicContact CB-CE2 4.23Å; W49-Y296 HydrophobicContact CG-CE2 4.23Å; R50-Y296 PolarHBondContact N-OH 3.29Å; R50-Y296 PolarHBondContact O-OH 2.9Å; R50-Y296 VanDerWaalsContact O-OH 3.14Å; P52-Y296 HydrophobicContact CG-CD1 4.24Å; P52-Y296 HydrophobicContact CG-CE1 3.64Å; V292-Y296 WeakPolarHBondContact O-CB 3.3Å; V292-Y296 PolarHBondContact O-N 3.28Å; C293-Y296 PolarHBondContact O-N 2.95Å; L294-Y296 VanDerWaalsContact C-N 3.26Å; L294-Y296 PolarHBondContact O-N 3.25Å; Y296-L298 VanDerWaalsContact C-N 3.32Å; Y296-L298 PolarHBondContact O-N 2.92Å; Y296-N299 PolarHBondContact O-N 2.91Å; Y296-N299 VanDerWaalsContact O-N 3.16Å; Y296-C300 PolarHBondContact O-N 3.26Å; Y296-C300 PolarHBondContact O-SG 2.93Å; Y296-F355 HydrophobicContact CD1-CD2 4.16Å; Y296-F355 HydrophobicContact CD1-CE2 4.18Å; Y296-I360 HydrophobicContact CD1-CG1 4.33Å; Y296-I360 HydrophobicContact CD2-CG2 4.35Å; Y296-I360 HydrophobicContact CG-CG2 4.2Å; Y296-P361 HydrophobicContact CE2-CG 3.96Å; Y296-P361 WeakPolarHBondContact OH-CD 3.46Å; Y296-P361 WeakPolarHBondContact OH-CG 3.32Å; Y296-F364 HydrophobicContact CD2-CB 4.15Å; Y296-F364 AromaticContact CD2-CD1 3.87Å; Y296-F364 HydrophobicContact CD2-CD1 3.87Å; Y296-F364 AromaticContact CD2-CD2 3.87Å; Y296-F364 HydrophobicContact CD2-CD2 3.87Å; Y296-F364 HydrophobicContact CD2-CE1 4.26Å; Y296-F364 HydrophobicContact CD2-CE2 4.26Å; Y296-F364 AromaticContact CD2-CG 3.66Å; Y296-F364 HydrophobicContact CD2-CG 3.66Å; Y296-F364 HydrophobicContact CD2-CZ 4.44Å; Y296-F364 HydrophobicContact CE2-CB 4.38Å; Y296-F364 HydrophobicContact CE2-CG 4.37Å; Y296-F364 HydrophobicContact CG-CD1 4.33Å; Y296-F364 HydrophobicContact CG-CE1 4.37Å
297	L	97.9	Very high	97.8	Very high	2 Å²	2	14.2 Å²	14.2	1%	0.01	7%	0.066	C	C	.	.	H	α-helix	trans	-56.3	-46.7	175.4	176.1	57.4	0	0	0	111.6	L270 C293 L294 N299 C300 C301 V333 L336 L340 L354 F355	L270-L297 HydrophobicContact CD1-CD2 4.11Å; L270-L297 HydrophobicContact CD1-CG 4.43Å; C293-L297 PolarHBondContact O-N 3.27Å; L294-L297 WeakPolarHBondContact O-CB 3.39Å; L294-L297 PolarHBondContact O-N 3.11Å; L297-N299 VanDerWaalsContact C-N 3.32Å; L297-N299 PolarHBondContact O-N 3Å; L297-C300 WeakPolarHBondContact O-CB 3.24Å; L297-C300 PolarHBondContact O-N 2.81Å; L297-C301 PolarHBondContact O-N 3.17Å; L297-C301 PolarHBondContact O-SG 3.07Å; L297-V333 HydrophobicContact CD1-CG2 4.3Å; L297-L336 HydrophobicContact CD1-CD2 3.53Å; L297-L336 HydrophobicContact CD2-CD2 4.22Å; L297-L340 HydrophobicContact CD2-CD1 4.12Å; L297-L354 HydrophobicContact CB-CD2 4.42Å; L297-L354 HydrophobicContact CD2-CD2 4.02Å; L297-F355 HydrophobicContact CB-CE2 4.01Å; L297-F355 HydrophobicContact CB-CZ 4.37Å; L297-F355 HydrophobicContact CD1-CZ 4.35Å
298	L	98.3	Very high	97.8	Very high	0 Å²	0	13.9 Å²	13.9	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-62.6	-40	178.7	-67.2	174.8	0	0	0	111.4	F279 L294 L295 Y296 C300 C301 F302 V305 V322	F279-L298 HydrophobicContact CD1-CD2 4.1Å; F279-L298 HydrophobicContact CE1-CD2 4.26Å; L294-L298 HydrophobicContact CD1-CD1 4.4Å; L294-L298 HydrophobicContact CD1-CG 4.35Å; L294-L298 HydrophobicContact CG-CD1 4.21Å; L294-L298 WeakPolarHBondContact O-CG 3.34Å; L294-L298 PolarHBondContact O-N 3.09Å; L295-L298 HydrophobicContact CD1-CD1 4.36Å; L295-L298 PolarHBondContact O-N 2.87Å; Y296-L298 VanDerWaalsContact C-N 3.32Å; Y296-L298 PolarHBondContact O-N 2.92Å; L298-C300 PolarHBondContact O-N 3.27Å; L298-C301 PolarHBondContact O-N 3.2Å; L298-C301 VanDerWaalsContact O-N 3.11Å; L298-F302 HydrophobicContact CD2-CD2 4.25Å; L298-F302 HydrophobicContact CD2-CE2 3.81Å; L298-F302 WeakPolarHBondContact O-CD2 3.28Å; L298-F302 PolarHBondContact O-N 2.92Å; L298-V305 HydrophobicContact CB-CG2 4.44Å; L298-V322 HydrophobicContact CD1-CG1 4.13Å
299	N	97.6	Very high	97.9	Very high	1 Å²	1	13.1 Å²	13.1	1%	0.005	6%	0.061	C	C	.	.	H	α-helix	trans	-64.7	-27.4	173.6	-87.6	-81.5	0	0	0	113.2	F41 K43 W49 L295 Y296 L297 F364	F41-N299 WeakPolarHBondContact CB-OD1 3.42Å; F41-N299 VanDerWaalsContact CD2-ND2 3.33Å; F41-N299 WeakPolarHBondContact CD2-ND2 3.38Å; K43-N299 WeakPolarHBondContact CE-O 3.42Å; K43-N299 PolarHBondContact NZ-O 3.3Å; W49-N299 HydrophobicContact CE3-CB 4.11Å; W49-N299 HydrophobicContact CZ3-CB 4.29Å; L295-N299 WeakPolarHBondContact O-CB 3.48Å; L295-N299 PolarHBondContact O-N 3.46Å; L295-N299 PolarHBondContact O-ND2 3.32Å; Y296-N299 PolarHBondContact O-N 2.91Å; Y296-N299 VanDerWaalsContact O-N 3.16Å; L297-N299 VanDerWaalsContact C-N 3.32Å; L297-N299 PolarHBondContact O-N 3Å; N299-F364 HydrophobicContact CB-CE2 4.43Å
300	C	95.9	Very high	97.9	Very high	8 Å²	8	12.9 Å²	12.9	5%	0.054	6%	0.06	C	C	.	.	H	α-helix	trans	-78.1	-25.6	173.1	-61	0	0	0	0	112.7	R50 I51 Y296 L297 L298	R50-C300 PolarHBondContact O-SG 2.82Å; R50-C300 VanDerWaalsContact O-SG 3.38Å; I51-C300 HydrophobicContact CG1-CB 3.65Å; Y296-C300 PolarHBondContact O-N 3.26Å; Y296-C300 PolarHBondContact O-SG 2.93Å; L297-C300 WeakPolarHBondContact O-CB 3.24Å; L297-C300 PolarHBondContact O-N 2.81Å; L298-C300 PolarHBondContact O-N 3.27Å
301	C	97	Very high	97.9	Very high	3 Å²	3	12.1 Å²	12.1	2%	0.02	6%	0.055	C	C	.	.	H	α-helix	trans	-96.2	-24.8	-173.3	-67.1	0	0	0	0	114.3	L270 L297 L298 Y327 E328	L270-C301 HydrophobicContact CD2-CB 3.76Å; L297-C301 PolarHBondContact O-N 3.17Å; L297-C301 PolarHBondContact O-SG 3.07Å; L298-C301 PolarHBondContact O-N 3.2Å; L298-C301 VanDerWaalsContact O-N 3.11Å; C301-Y327 HydrophobicContact CB-CD2 4.31Å; C301-Y327 HydrophobicContact CB-CE2 4.03Å; C301-Y327 VanDerWaalsContact O-CD2 3.27Å; C301-Y327 WeakPolarHBondContact O-CD2 3.44Å; C301-E328 PolarHBondContact O-N 2.87Å
302	F	97.4	Very high	97.8	Very high	0 Å²	0	12.1 Å²	12.1	0%	0	6%	0.055	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	144.6	-174.3	-68.1	-98	0	0	0	110.9	K43 L270 L273 F279 L298 S304 V305 C324 Y327	K43-F302 VanDerWaalsContact CE-O 3.24Å; K43-F302 WeakPolarHBondContact CE-O 3.2Å; K43-F302 PolarHBondContact NZ-O 2.97Å; L270-F302 HydrophobicContact CD2-CE2 3.81Å; L270-F302 HydrophobicContact CD2-CZ 4.32Å; L273-F302 HydrophobicContact CD1-CE1 3.96Å; L273-F302 HydrophobicContact CD1-CZ 3.78Å; F279-F302 HydrophobicContact CB-CE1 3.94Å; F279-F302 HydrophobicContact CB-CZ 3.66Å; F279-F302 HydrophobicContact CD1-CZ 4.49Å; L298-F302 HydrophobicContact CD2-CD2 4.25Å; L298-F302 HydrophobicContact CD2-CE2 3.81Å; L298-F302 WeakPolarHBondContact O-CD2 3.28Å; L298-F302 PolarHBondContact O-N 2.92Å; F302-S304 VanDerWaalsContact C-N 3.31Å; F302-S304 PolarHBondContact O-N 3.41Å; F302-V305 HydrophobicContact CB-CG2 4.03Å; F302-C324 HydrophobicContact CB-CB 3.92Å; F302-C324 HydrophobicContact CD1-CB 3.47Å; F302-C324 VanDerWaalsContact CD1-CB 3.47Å; F302-C324 HydrophobicContact CD2-CB 3.67Å; F302-C324 HydrophobicContact CE1-CB 3.77Å; F302-C324 HydrophobicContact CE2-CB 3.97Å; F302-C324 HydrophobicContact CG-CB 3.42Å; F302-C324 VanDerWaalsContact CG-CB 3.42Å; F302-C324 HydrophobicContact CZ-CB 4.02Å; F302-Y327 HydrophobicContact CD1-CD2 4.31Å; F302-Y327 HydrophobicContact CD2-CD2 4.42Å; F302-Y327 HydrophobicContact CE1-CD2 4.05Å; F302-Y327 HydrophobicContact CE1-CG 4.14Å; F302-Y327 HydrophobicContact CE2-CD2 4.15Å; F302-Y327 HydrophobicContact CG-CD2 4.49Å; F302-Y327 AromaticContact CZ-CD2 3.94Å; F302-Y327 HydrophobicContact CZ-CD2 3.94Å; F302-Y327 HydrophobicContact CZ-CG 4.35Å
303	R	95.9	Very high	97.7	Very high	178 Å²	178	12.1 Å²	12.1	67%	0.672	6%	0.055	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-61.7	-38.5	-179.7	-171.8	175.6	175.2	170.4	0.8	113.1	K43 L325 N326	K43-R303 WeakPolarHBondContact CE-O 3.1Å; R303-L325 PolarHBondContact N-O 3.34Å; R303-N326 HydrophobicContact CB-CB 3.88Å; R303-N326 PolarHBondContact N-O 3.44Å
304	S	97.6	Very high	97.4	Very high	37 Å²	37	15.1 Å²	15.1	26%	0.259	7%	0.068	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.4	132.6	-179.8	-177.7	0	0	0	0	110.1	F302 C324 L325	F302-S304 VanDerWaalsContact C-N 3.31Å; F302-S304 PolarHBondContact O-N 3.41Å; S304-C324 CarbonylContact O-C 3.59Å; S304-C324 WeakPolarHBondContact O-CA 3.39Å; S304-L325 PolarHBondContact N-O 3.42Å; S304-L325 PolarHBondContact O-N 3.27Å
305	V	98.7	Very high	97.2	Very high	0 Å²	0	16.3 Å²	16.3	0%	0	8%	0.078	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	127	174.7	-178.3	0	0	0	0	109.2	F41 L298 F302 V322 V323 C324	F41-V305 HydrophobicContact CD2-CB 4.27Å; F41-V305 HydrophobicContact CD2-CG1 4.11Å; F41-V305 HydrophobicContact CE2-CG1 4.41Å; F41-V305 PolarHBondContact N-O 2.98Å; L298-V305 HydrophobicContact CB-CG2 4.44Å; F302-V305 HydrophobicContact CB-CG2 4.03Å; V305-V322 HydrophobicContact CG1-CG1 3.68Å; V305-V323 WeakPolarHBondContact CA-O 3.17Å; V305-C324 HydrophobicContact CG2-CB 4.29Å
306	S	98.8	Very high	96.9	Very high	3 Å²	3	17.6 Å²	17.6	2%	0.021	9%	0.091	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	142.4	179.4	-57.4	0	0	0	0	110.6	K39 T40 V322 V323	K39-S306 CarbonylContact O-C 3.56Å; K39-S306 VanDerWaalsContact O-CA 3.3Å; K39-S306 WeakPolarHBondContact O-CA 3.26Å; T40-S306 WeakPolarHBondContact CG2-OG 3.43Å; T40-S306 PolarHBondContact OG1-OG 3.47Å; S306-V322 CarbonylContact O-C 3.47Å; S306-V322 WeakPolarHBondContact O-CA 3.33Å; S306-V323 PolarHBondContact N-O 2.79Å; S306-V323 PolarHBondContact O-N 3.24Å
307	V	98.8	Very high	96.6	Very high	0 Å²	0	19.6 Å²	19.6	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	127.3	166.1	-175.3	0	0	0	0	108	V38 K39 F41 L286 V320 Y321 V322 L371 F375	V38-V307 WeakPolarHBondContact CA-O 3.05Å; K39-V307 PolarHBondContact N-O 3.39Å; K39-V307 PolarHBondContact O-N 2.92Å; F41-V307 HydrophobicContact CE2-CG2 4.15Å; L286-V307 HydrophobicContact CD1-CG1 4.06Å; L286-V307 HydrophobicContact CD1-CG2 4.04Å; V307-V320 HydrophobicContact CG1-CB 3.85Å; V307-V320 HydrophobicContact CG1-CG1 4.36Å; V307-V320 HydrophobicContact CG1-CG2 3.75Å; V307-Y321 CarbonylContact C-O 3.6Å; V307-Y321 WeakPolarHBondContact CA-O 3.41Å; V307-V322 HydrophobicContact CG2-CG2 4.45Å; V307-L371 HydrophobicContact CB-CD1 3.92Å; V307-L371 HydrophobicContact CB-CD2 4.07Å; V307-L371 HydrophobicContact CB-CG 4.43Å; V307-L371 HydrophobicContact CG1-CD2 4.26Å; V307-L371 HydrophobicContact CG2-CD1 3.67Å; V307-L371 HydrophobicContact CG2-CD2 3.93Å; V307-L371 HydrophobicContact CG2-CG 4.42Å; V307-F375 HydrophobicContact CB-CE2 3.87Å; V307-F375 HydrophobicContact CB-CZ 4.29Å; V307-F375 HydrophobicContact CG1-CD2 4.25Å; V307-F375 HydrophobicContact CG1-CE2 3.57Å; V307-F375 HydrophobicContact CG1-CZ 3.93Å; V307-F375 WeakPolarHBondContact O-CZ 3.32Å
308	F	98.8	Very high	96.5	Very high	0 Å²	0	19.9 Å²	19.9	0%	0	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	133.2	-172.5	-179.9	-127.5	0	0	0	111.3	K37 V38 E125 I126 F130 P310 V320 Y321	K37-F308 WeakPolarHBondContact O-CD2 3.35Å; V38-F308 HydrophobicContact CB-CD2 3.86Å; V38-F308 HydrophobicContact CG2-CB 4.44Å; V38-F308 HydrophobicContact CG2-CD2 4.32Å; E125-F308 HydrophobicContact CG-CE1 4.02Å; E125-F308 HydrophobicContact CG-CZ 3.92Å; E125-F308 WeakPolarHBondContact OE1-CZ 3.25Å; I126-F308 HydrophobicContact CG1-CD1 3.85Å; I126-F308 HydrophobicContact CG1-CE1 4.02Å; F130-F308 HydrophobicContact CE2-CB 4.04Å; F130-F308 AromaticContact CE2-CD1 3.77Å; F130-F308 HydrophobicContact CE2-CD1 3.77Å; F130-F308 HydrophobicContact CE2-CD2 4.39Å; F130-F308 HydrophobicContact CE2-CE1 4.28Å; F130-F308 AromaticContact CE2-CG 3.82Å; F130-F308 HydrophobicContact CE2-CG 3.82Å; F130-F308 HydrophobicContact CZ-CB 3.95Å; F130-F308 HydrophobicContact CZ-CD1 4.47Å; F130-F308 HydrophobicContact CZ-CD2 4.45Å; F130-F308 HydrophobicContact CZ-CG 4.06Å; F308-P310 HydrophobicContact CD1-CG 3.78Å; F308-P310 HydrophobicContact CE1-CB 3.96Å; F308-P310 HydrophobicContact CE1-CG 3.63Å; F308-P310 HydrophobicContact CZ-CB 4.4Å; F308-P310 HydrophobicContact CZ-CG 4.46Å; F308-P310 WeakPolarHBondContact O-CD 3.12Å; F308-V320 CarbonylContact O-C 3.21Å; F308-Y321 PolarHBondContact N-O 2.92Å; F308-Y321 PolarHBondContact O-N 3.18Å
309	K	98.4	Very high	96.4	Very high	11 Å²	11	20.3 Å²	20.3	5%	0.048	11%	0.106	C	C	.	.			trans	-109.7	98.4	169	-172.1	175	-174.6	76.5	0	109.1	K37 A311 K314 A315 N317 E319 V320 F375	K37-K309 HydrophobicContact CB-CB 4.09Å; K37-K309 WeakPolarHBondContact CE-O 2.95Å; K37-K309 PolarHBondContact O-N 2.84Å; K309-A311 PolarHBondContact O-N 3.15Å; K309-K314 PolarHBondContact NZ-O 3.33Å; K309-A315 WeakPolarHBondContact CE-O 3.34Å; K309-N317 PolarHBondContact NZ-O 2.83Å; K309-N317 PolarHBondContact NZ-OD1 3.09Å; K309-E319 PolarHBondContact NZ-O 3.21Å; K309-V320 HydrophobicContact CB-CG1 4.28Å; K309-F375 HydrophobicContact CB-CD1 4.22Å; K309-F375 HydrophobicContact CB-CE1 3.74Å
310	P	98	Very high	96.5	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	11%	0.108	C	C	.	.			trans	-51.3	141.6	176.9	-24.9	31.2	0	0	0	112	K122 E125 F308 T312 S313 Y321	K122-P310 HydrophobicContact CB-CB 4.23Å; K122-P310 HydrophobicContact CB-CG 4.07Å; K122-P310 HydrophobicContact CG-CB 4.18Å; K122-P310 HydrophobicContact CG-CG 4.3Å; E125-P310 HydrophobicContact CG-CB 4.31Å; E125-P310 WeakPolarHBondContact OE1-CA 3.32Å; E125-P310 WeakPolarHBondContact OE2-CB 3.48Å; F308-P310 HydrophobicContact CD1-CG 3.78Å; F308-P310 HydrophobicContact CE1-CB 3.96Å; F308-P310 HydrophobicContact CE1-CG 3.63Å; F308-P310 HydrophobicContact CZ-CB 4.4Å; F308-P310 HydrophobicContact CZ-CG 4.46Å; F308-P310 WeakPolarHBondContact O-CD 3.12Å; P310-T312 PolarHBondContact O-N 2.91Å; P310-S313 PolarHBondContact O-N 2.9Å; P310-Y321 HydrophobicContact CG-CD2 3.84Å; P310-Y321 HydrophobicContact CG-CE2 4.18Å
311	A	97.4	Very high	96.6	Very high	1 Å²	1	20.2 Å²	20.2	1%	0.008	11%	0.105	C	C	.	.	T	Hydrogen-bonded Turn	trans	-51.9	-36.4	170.5	0	0	0	0	0	111.6	L34 F35 A100 E125 K309 S313	L34-A311 HydrophobicContact CD1-CB 4.42Å; L34-A311 HydrophobicContact CD2-CB 4.11Å; L34-A311 HydrophobicContact CG-CB 3.72Å; F35-A311 HydrophobicContact CD1-CB 3.44Å; F35-A311 VanDerWaalsContact CD1-CB 3.44Å; F35-A311 HydrophobicContact CE1-CB 3.35Å; F35-A311 HydrophobicContact CE2-CB 4.47Å; F35-A311 HydrophobicContact CG-CB 4.05Å; F35-A311 HydrophobicContact CZ-CB 3.91Å; A100-A311 WeakPolarHBondContact CB-O 3.28Å; E125-A311 VanDerWaalsContact CD-N 3.32Å; E125-A311 WeakPolarHBondContact OE1-CB 3.44Å; E125-A311 PolarHBondContact OE1-N 2.74Å; E125-A311 PolarHBondContact OE2-N 2.86Å; K309-A311 PolarHBondContact O-N 3.15Å; A311-S313 VanDerWaalsContact C-N 3.34Å
312	T	96.1	Very high	96.7	Very high	3 Å²	3	20 Å²	20	2%	0.018	10%	0.104	C	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-6	-180	54.9	0	0	0	0	114.3	A100 V103 Q118 C121 K122 E125 P310 Y412	A100-T312 HydrophobicContact CB-CG2 4.33Å; V103-T312 HydrophobicContact CB-CG2 4.25Å; V103-T312 HydrophobicContact CG1-CG2 3.87Å; V103-T312 HydrophobicContact CG2-CG2 4.48Å; Q118-T312 WeakPolarHBondContact CG-O 3.25Å; Q118-T312 PolarHBondContact NE2-O 3.47Å; C121-T312 HydrophobicContact CB-CG2 3.89Å; K122-T312 WeakPolarHBondContact CA-OG1 3.45Å; K122-T312 PolarHBondContact N-OG1 2.85Å; E125-T312 PolarHBondContact OE2-N 2.87Å; E125-T312 PolarHBondContact OE2-OG1 3.24Å; P310-T312 PolarHBondContact O-N 2.91Å; T312-Y412 HydrophobicContact CG2-CD2 3.81Å; T312-Y412 HydrophobicContact CG2-CE2 3.46Å; T312-Y412 VanDerWaalsContact CG2-CE2 3.46Å
313	S	95.3	Very high	96.8	Very high	0 Å²	0	20 Å²	20	0%	0	10%	0.104	C	C	.	.	S	Bend	trans	-79.2	149.5	166.4	-172.6	0	0	0	0	111.1	P310 A311 A315 E319	P310-S313 PolarHBondContact O-N 2.9Å; A311-S313 VanDerWaalsContact C-N 3.34Å; S313-A315 PolarHBondContact O-N 3.06Å; S313-A315 VanDerWaalsContact O-N 3.1Å; S313-E319 PolarHBondContact OG-OE1 3.43Å
314	K	93.3	Very high	96.9	Very high	63 Å²	63	11.6 Å²	11.6	27%	0.274	7%	0.072	S	C	.	.			trans	-64.2	117.5	-178	-67.6	-172.1	179.3	-179.5	0	109.1	K309 G316 N317	K309-K314 PolarHBondContact NZ-O 3.33Å; K314-G316 PolarHBondContact O-N 2.76Å; K314-G316 VanDerWaalsContact O-N 3.14Å; K314-N317 HydrophobicContact CB-CB 4.38Å; K314-N317 PolarHBondContact O-N 3.42Å; K314-N317 VanDerWaalsContact O-N 3.07Å; K314-N317 PolarHBondContact O-OD1 2.92Å
315	A	92.6	Very high	96.9	Very high	27 Å²	27	10.7 Å²	10.7	22%	0.223	7%	0.065	C	C	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-32.8	-172.5	0	0	0	0	0	114	K309 S313 T382	K309-A315 WeakPolarHBondContact CE-O 3.34Å; S313-A315 PolarHBondContact O-N 3.06Å; S313-A315 VanDerWaalsContact O-N 3.1Å; A315-T382 HydrophobicContact CB-CG2 3.65Å
316	G	92.8	Very high	96.9	Very high	27 Å²	27	14.3 Å²	14.3	28%	0.278	8%	0.084	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.1	-3.8	179.2	0	0	0	0	0	115.9	K314 Q379	K314-G316 PolarHBondContact O-N 2.76Å; K314-G316 VanDerWaalsContact O-N 3.14Å; G316-Q379 PolarHBondContact O-NE2 2.77Å
317	N	92.7	Very high	96.8	Very high	47 Å²	47	14.2 Å²	14.2	25%	0.251	8%	0.083	S	C	.	.	S	Bend	trans	-90.6	165.9	175.1	78.9	6.6	0	0	0	111.3	K309 K314 E319 Q379	K309-N317 PolarHBondContact NZ-O 2.83Å; K309-N317 PolarHBondContact NZ-OD1 3.09Å; K314-N317 HydrophobicContact CB-CB 4.38Å; K314-N317 PolarHBondContact O-N 3.42Å; K314-N317 VanDerWaalsContact O-N 3.07Å; K314-N317 PolarHBondContact O-OD1 2.92Å; N317-E319 VanDerWaalsContact C-N 3.3Å; N317-E319 WeakPolarHBondContact ND2-CB 3.41Å; N317-E319 WeakPolarHBondContact OD1-CB 3.37Å; N317-E319 PolarHBondContact OD1-N 3.31Å; N317-E319 VanDerWaalsContact OD1-N 3.11Å; N317-Q379 PolarHBondContact O-NE2 3.06Å
318	S	95.3	Very high	96.5	Very high	8 Å²	8	18.7 Å²	18.7	6%	0.056	10%	0.104	C	C	.	.			trans	-86.3	1.2	178.3	-61.3	0	0	0	0	113.4	K79 F284 V320 Q379	K79-S318 WeakPolarHBondContact CE-OG 3.27Å; K79-S318 PolarHBondContact NZ-OG 3.39Å; F284-S318 CarbonylContact C-O 3.54Å; F284-S318 WeakPolarHBondContact CA-O 3.46Å; F284-S318 VanDerWaalsContact O-O 3.05Å; S318-V320 PolarHBondContact O-N 2.92Å; S318-Q379 PolarHBondContact OG-NE2 3.38Å; S318-Q379 PolarHBondContact OG-OE1 2.96Å
319	E	96.8	Very high	95.7	Very high	10 Å²	10	20.6 Å²	20.6	5%	0.047	12%	0.117	C	C	.	.			trans	-67.2	131.3	-176.6	-171.1	-168.1	70.7	0	0	111.6	K122 K282 M283 F284 K309 S313 N317 Y321	K122-E319 VanDerWaalsContact CE-OE1 3.23Å; K122-E319 WeakPolarHBondContact CE-OE1 3.32Å; K122-E319 IonicContact NZ-OE1 2.67Å; K122-E319 PolarHBondContact NZ-OE1 2.77Å; K122-E319 IonicContact NZ-OE2 2.6Å; K122-E319 PolarHBondContact NZ-OE2 2.98Å; K282-E319 HydrophobicContact CD-CG 4.07Å; K282-E319 VanDerWaalsContact CE-OE2 3.3Å; K282-E319 WeakPolarHBondContact CE-OE2 3.48Å; K282-E319 HydrophobicContact CG-CG 4.1Å; K282-E319 IonicContact NZ-OE2 2.83Å; K282-E319 PolarHBondContact NZ-OE2 3.4Å; M283-E319 WeakPolarHBondContact O-CA 3.25Å; F284-E319 HydrophobicContact CD1-CB 4.27Å; F284-E319 HydrophobicContact CE1-CB 4.32Å; K309-E319 PolarHBondContact NZ-O 3.21Å; S313-E319 PolarHBondContact OG-OE1 3.43Å; N317-E319 VanDerWaalsContact C-N 3.3Å; N317-E319 WeakPolarHBondContact ND2-CB 3.41Å; N317-E319 WeakPolarHBondContact OD1-CB 3.37Å; N317-E319 PolarHBondContact OD1-N 3.31Å; N317-E319 VanDerWaalsContact OD1-N 3.11Å; E319-Y321 HydrophobicContact CG-CE2 4.3Å
320	V	98.3	Very high	95.1	Very high	6 Å²	6	23.2 Å²	23.2	4%	0.036	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	166.7	173.4	-61	0	0	0	0	109.3	M283 F284 V307 F308 K309 S318 F375	M283-V320 HydrophobicContact CB-CG2 4.3Å; M283-V320 PolarHBondContact N-O 2.66Å; M283-V320 PolarHBondContact O-N 3.43Å; F284-V320 WeakPolarHBondContact O-CG2 3.41Å; V307-V320 HydrophobicContact CG1-CB 3.85Å; V307-V320 HydrophobicContact CG1-CG1 4.36Å; V307-V320 HydrophobicContact CG1-CG2 3.75Å; F308-V320 CarbonylContact O-C 3.21Å; K309-V320 HydrophobicContact CB-CG1 4.28Å; S318-V320 PolarHBondContact O-N 2.92Å; V320-F375 HydrophobicContact CG1-CD1 4.24Å; V320-F375 HydrophobicContact CG1-CE1 4.43Å; V320-F375 HydrophobicContact CG1-CG 4.49Å
321	Y	98.8	Very high	94.7	Very high	0 Å²	0	29.3 Å²	29.3	0%	0	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	126.9	176.1	-70.5	-90.4	0	0	0	110	K122 I126 F155 D242 V280 L281 K282 V307 F308 P310 E319	K122-Y321 HydrophobicContact CB-CE2 4.32Å; K122-Y321 HydrophobicContact CD-CE2 3.83Å; K122-Y321 WeakPolarHBondContact CD-OH 2.93Å; I126-Y321 HydrophobicContact CD1-CD1 3.94Å; I126-Y321 HydrophobicContact CD1-CD2 4.17Å; I126-Y321 HydrophobicContact CD1-CG 3.72Å; F155-Y321 HydrophobicContact CE2-CE1 4.16Å; F155-Y321 HydrophobicContact CZ-CD1 4.46Å; F155-Y321 AromaticContact CZ-CE1 3.59Å; F155-Y321 HydrophobicContact CZ-CE1 3.59Å; D242-Y321 WeakPolarHBondContact OD1-CE1 3.3Å; D242-Y321 PolarHBondContact OD1-OH 3.04Å; V280-Y321 HydrophobicContact CG1-CD1 3.89Å; L281-Y321 CarbonylContact O-C 3.57Å; L281-Y321 WeakPolarHBondContact O-CA 3.2Å; K282-Y321 HydrophobicContact CB-CD1 4.07Å; K282-Y321 HydrophobicContact CB-CE1 3.69Å; K282-Y321 HydrophobicContact CD-CE1 4.43Å; K282-Y321 HydrophobicContact CG-CE1 4.26Å; V307-Y321 CarbonylContact C-O 3.6Å; V307-Y321 WeakPolarHBondContact CA-O 3.41Å; F308-Y321 PolarHBondContact N-O 2.92Å; F308-Y321 PolarHBondContact O-N 3.18Å; P310-Y321 HydrophobicContact CG-CD2 3.84Å; P310-Y321 HydrophobicContact CG-CE2 4.18Å; E319-Y321 HydrophobicContact CG-CE2 4.3Å
322	V	98.9	Very high	94.2	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.186	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	117.7	167.7	-173.3	0	0	0	0	107.6	V280 L281 M283 L295 L298 V305 S306 V307	V280-V322 WeakPolarHBondContact CA-O 3.1Å; L281-V322 HydrophobicContact CB-CB 4.38Å; L281-V322 PolarHBondContact N-O 3.22Å; L281-V322 PolarHBondContact O-N 3.24Å; M283-V322 HydrophobicContact CB-CG2 4.44Å; M283-V322 HydrophobicContact CG-CG2 3.95Å; M283-V322 HydrophobicContact SD-CG2 3.55Å; M283-V322 VanDerWaalsContact SD-CG2 3.55Å; L295-V322 HydrophobicContact CD1-CB 4.29Å; L295-V322 HydrophobicContact CD1-CG1 3.56Å; L295-V322 HydrophobicContact CD1-CG2 3.7Å; L298-V322 HydrophobicContact CD1-CG1 4.13Å; V305-V322 HydrophobicContact CG1-CG1 3.68Å; S306-V322 CarbonylContact O-C 3.47Å; S306-V322 WeakPolarHBondContact O-CA 3.33Å; V307-V322 HydrophobicContact CG2-CG2 4.45Å
323	V	98.9	Very high	94.1	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.185	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	111.9	178.9	-175.9	0	0	0	0	108	I126 F130 L132 V305 S306 L325	I126-V323 HydrophobicContact CG2-CG2 4.13Å; F130-V323 HydrophobicContact CB-CG1 4.15Å; F130-V323 HydrophobicContact CD1-CB 4.44Å; F130-V323 HydrophobicContact CD1-CG1 4Å; F130-V323 HydrophobicContact CD2-CB 4.47Å; F130-V323 HydrophobicContact CD2-CG1 4.11Å; F130-V323 HydrophobicContact CD2-CG2 4.11Å; F130-V323 HydrophobicContact CE1-CB 4.38Å; F130-V323 HydrophobicContact CE1-CG1 4.43Å; F130-V323 HydrophobicContact CE2-CB 4.43Å; F130-V323 HydrophobicContact CE2-CG2 3.91Å; F130-V323 HydrophobicContact CG-CB 4.48Å; F130-V323 HydrophobicContact CG-CG1 3.82Å; F130-V323 HydrophobicContact CZ-CB 4.37Å; F130-V323 HydrophobicContact CZ-CG2 4.21Å; L132-V323 HydrophobicContact CD1-CG1 4.22Å; V305-V323 WeakPolarHBondContact CA-O 3.17Å; S306-V323 PolarHBondContact N-O 2.79Å; S306-V323 PolarHBondContact O-N 3.24Å; V323-L325 HydrophobicContact CG1-CD2 3.92Å; V323-L325 HydrophobicContact CG1-CG 4.26Å
324	C	98.8	Very high	94.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	126.4	179	-48.3	0	0	0	0	109.6	S278 F279 F302 S304 V305	S278-C324 CarbonylContact C-O 3.56Å; S278-C324 VanDerWaalsContact CA-O 3.31Å; S278-C324 WeakPolarHBondContact CA-O 3.19Å; F279-C324 HydrophobicContact CB-CB 4.12Å; F279-C324 PolarHBondContact N-O 2.99Å; F279-C324 PolarHBondContact O-N 3.42Å; F302-C324 HydrophobicContact CB-CB 3.92Å; F302-C324 HydrophobicContact CD1-CB 3.47Å; F302-C324 VanDerWaalsContact CD1-CB 3.47Å; F302-C324 HydrophobicContact CD2-CB 3.67Å; F302-C324 HydrophobicContact CE1-CB 3.77Å; F302-C324 HydrophobicContact CE2-CB 3.97Å; F302-C324 HydrophobicContact CG-CB 3.42Å; F302-C324 VanDerWaalsContact CG-CB 3.42Å; F302-C324 HydrophobicContact CZ-CB 4.02Å; S304-C324 CarbonylContact O-C 3.59Å; S304-C324 WeakPolarHBondContact O-CA 3.39Å; V305-C324 HydrophobicContact CG2-CB 4.29Å
325	L	98.6	Very high	94.2	Very high	18 Å²	18	43.2 Å²	43.2	9%	0.094	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	142.8	-175.2	-55.8	178.3	0	0	0	111.2	F130 L132 R303 S304 V323	F130-L325 HydrophobicContact CB-CD1 4.41Å; F130-L325 HydrophobicContact CD1-CD1 4.39Å; L132-L325 HydrophobicContact CD1-CD2 3.93Å; R303-L325 PolarHBondContact N-O 3.34Å; S304-L325 PolarHBondContact N-O 3.42Å; S304-L325 PolarHBondContact O-N 3.27Å; V323-L325 HydrophobicContact CG1-CD2 3.92Å; V323-L325 HydrophobicContact CG1-CG 4.26Å
326	N	97.5	Very high	94.4	Very high	76 Å²	76	42 Å²	42	41%	0.406	21%	0.212	S	C	.	.	E	Extended strand (participates in β ladder)	trans	57.5	76.4	178.7	-45.3	-83.5	0	0	0	112.1	G277 R303 E328	G277-N326 WeakPolarHBondContact O-CA 3.18Å; G277-N326 PolarHBondContact O-N 3.4Å; R303-N326 HydrophobicContact CB-CB 3.88Å; R303-N326 PolarHBondContact N-O 3.44Å; N326-E328 PolarHBondContact O-N 3.28Å
327	Y	97.4	Very high	94.5	Very high	2 Å²	2	41.3 Å²	41.3	1%	0.008	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.5	124	171.4	-177	-134.5	0	0	0	110.7	L270 L273 P275 G276 G277 C301 F302 K330 V333	L270-Y327 HydrophobicContact CD2-CD2 4.21Å; L270-Y327 HydrophobicContact CD2-CE2 3.54Å; L270-Y327 PolarHBondContact O-OH 3.26Å; L273-Y327 HydrophobicContact CB-CD1 3.83Å; L273-Y327 HydrophobicContact CB-CE1 4.28Å; L273-Y327 HydrophobicContact CB-CG 4.42Å; L273-Y327 WeakPolarHBondContact O-CD1 3.41Å; L273-Y327 WeakPolarHBondContact O-CE1 3.23Å; P275-Y327 CarbonylContact C-O 3.05Å; P275-Y327 WeakPolarHBondContact CA-O 3.31Å; G276-Y327 PolarHBondContact N-O 3.39Å; G277-Y327 PolarHBondContact O-N 3.31Å; C301-Y327 HydrophobicContact CB-CD2 4.31Å; C301-Y327 HydrophobicContact CB-CE2 4.03Å; C301-Y327 VanDerWaalsContact O-CD2 3.27Å; C301-Y327 WeakPolarHBondContact O-CD2 3.44Å; F302-Y327 HydrophobicContact CD1-CD2 4.31Å; F302-Y327 HydrophobicContact CD2-CD2 4.42Å; F302-Y327 HydrophobicContact CE1-CD2 4.05Å; F302-Y327 HydrophobicContact CE1-CG 4.14Å; F302-Y327 HydrophobicContact CE2-CD2 4.15Å; F302-Y327 HydrophobicContact CG-CD2 4.49Å; F302-Y327 AromaticContact CZ-CD2 3.94Å; F302-Y327 HydrophobicContact CZ-CD2 3.94Å; F302-Y327 HydrophobicContact CZ-CG 4.35Å; Y327-K330 HydrophobicContact CE1-CG 3.59Å; Y327-K330 WeakPolarHBondContact OH-CA 3.03Å; Y327-V333 WeakPolarHBondContact OH-CG1 3.3Å
328	E	91.8	Very high	94.7	Very high	94 Å²	94	41.2 Å²	41.2	44%	0.439	21%	0.205	S	C	.	.			trans	-80.3	-62.5	-166.5	-67	-174.2	152.9	0	0	112.6	C301 N326	C301-E328 PolarHBondContact O-N 2.87Å; N326-E328 PolarHBondContact O-N 3.28Å
329	S	82.4	Confident	94.6	Very high	39 Å²	39	42.9 Å²	42.9	27%	0.273	21%	0.211	S	C	.	.			trans	-153.2	134.9	-178.2	-179	0	0	0	0	113	E331	S329-E331 VanDerWaalsContact C-N 3.35Å; S329-E331 PolarHBondContact OG-N 2.92Å
330	K	85.4	Confident	94.6	Very high	66 Å²	66	42.7 Å²	42.7	29%	0.287	21%	0.211	S	C	.	.	H	α-helix	trans	-67.7	-34.7	170.4	-74.7	-167.1	-176.7	-169.6	0	112.6	L271 L272 L273 Y327 E332 V333 R334	L271-K330 PolarHBondContact O-NZ 3.01Å; L272-K330 PolarHBondContact O-NZ 3.18Å; L273-K330 WeakPolarHBondContact O-CE 3.45Å; L273-K330 PolarHBondContact O-NZ 3.18Å; Y327-K330 HydrophobicContact CE1-CG 3.59Å; Y327-K330 WeakPolarHBondContact OH-CA 3.03Å; K330-E332 PolarHBondContact O-N 3.35Å; K330-V333 WeakPolarHBondContact O-CG1 3.49Å; K330-V333 PolarHBondContact O-N 3.3Å; K330-R334 WeakPolarHBondContact O-CB 2.95Å; K330-R334 PolarHBondContact O-N 3.21Å
331	E	89.3	Confident	94.5	Very high	129 Å²	129	43.8 Å²	43.8	60%	0.603	22%	0.216	S	C	*	.	H	α-helix	trans	-68.6	-35.7	-170.1	-65.6	-54.1	138.7	0	0	112.4	S329 R334	S329-E331 VanDerWaalsContact C-N 3.35Å; S329-E331 PolarHBondContact OG-N 2.92Å; E331-R334 WeakPolarHBondContact O-CB 3.33Å; E331-R334 PolarHBondContact O-N 2.98Å
332	E	88.3	Confident	94.3	Very high	132 Å²	132	53.2 Å²	53.2	62%	0.617	25%	0.251	S	S	*	.	H	α-helix	trans	-70.5	-40.4	180	-63.4	-171	-178.4	0	0	112.2	I51 K330 P335	I51-E332 HydrophobicContact CD1-CB 4.03Å; K330-E332 PolarHBondContact O-N 3.35Å; E332-P335 WeakPolarHBondContact O-CD 3.16Å
333	V	94.1	Very high	94.1	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-80.5	-19	178.5	74.2	0	0	0	0	112.7	I51 L270 L297 Y327 K330 P335 L336 L337	I51-V333 HydrophobicContact CD1-CB 3.74Å; I51-V333 HydrophobicContact CD1-CG2 4.17Å; L270-V333 HydrophobicContact CD1-CG2 4.33Å; L297-V333 HydrophobicContact CD1-CG2 4.3Å; Y327-V333 WeakPolarHBondContact OH-CG1 3.3Å; K330-V333 WeakPolarHBondContact O-CG1 3.49Å; K330-V333 PolarHBondContact O-N 3.3Å; V333-P335 VanDerWaalsContact C-CD 3.42Å; V333-P335 VanDerWaalsContact C-N 3.34Å; V333-P335 VanDerWaalsContact O-N 3.14Å; V333-L336 PolarHBondContact O-N 3.42Å; V333-L337 HydrophobicContact CG2-CB 4.48Å; V333-L337 WeakPolarHBondContact O-CB 3.23Å; V333-L337 PolarHBondContact O-N 3.42Å
334	R	94.6	Very high	94	Very high	156 Å²	156	57.7 Å²	57.7	59%	0.589	27%	0.274	S	S	*	.	H	α-helix	trans	-48.1	-43.6	-173.5	-172.5	-177.8	123.7	116.4	2.2	114.3	K330 E331 S338	K330-R334 WeakPolarHBondContact O-CB 2.95Å; K330-R334 PolarHBondContact O-N 3.21Å; E331-R334 WeakPolarHBondContact O-CB 3.33Å; E331-R334 PolarHBondContact O-N 2.98Å; R334-S338 WeakPolarHBondContact O-CB 3.48Å; R334-S338 PolarHBondContact O-N 3.15Å; R334-S338 PolarHBondContact O-OG 3.37Å
335	P	95.5	Very high	93.8	Very high	71 Å²	71	58 Å²	58	46%	0.461	28%	0.278	S	S	.	.	H	α-helix	trans	-63.7	-43.4	178.2	-25.1	38.4	0	0	0	113.1	P54 E332 V333 K339	P54-P335 HydrophobicContact CB-CB 4.39Å; P54-P335 HydrophobicContact CG-CB 3.54Å; E332-P335 WeakPolarHBondContact O-CD 3.16Å; V333-P335 VanDerWaalsContact C-CD 3.42Å; V333-P335 VanDerWaalsContact C-N 3.34Å; V333-P335 VanDerWaalsContact O-N 3.14Å; P335-K339 PolarHBondContact O-N 2.7Å
336	L	96	Very high	93.5	Very high	1 Å²	1	61.2 Å²	61.2	1%	0.005	30%	0.3	C	S	.	.	H	α-helix	trans	-70.5	-43.4	176.8	178.8	65.2	0	0	0	111.2	I51 P54 A57 L297 V333 S338 K339 L340 L354 F355	I51-L336 HydrophobicContact CG2-CB 4.33Å; I51-L336 HydrophobicContact CG2-CD2 3.86Å; P54-L336 HydrophobicContact CG-CB 4.35Å; A57-L336 HydrophobicContact CB-CD1 3.59Å; L297-L336 HydrophobicContact CD1-CD2 3.53Å; L297-L336 HydrophobicContact CD2-CD2 4.22Å; V333-L336 PolarHBondContact O-N 3.42Å; L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.17Å; L336-K339 CarbonylContact O-C 3.59Å; L336-K339 WeakPolarHBondContact O-CA 3.09Å; L336-K339 WeakPolarHBondContact O-CB 3.22Å; L336-K339 PolarHBondContact O-N 3.1Å; L336-L340 HydrophobicContact CG-CD1 4.5Å; L336-L340 PolarHBondContact O-N 3.07Å; L336-L354 HydrophobicContact CD1-CD1 4.34Å; L336-F355 HydrophobicContact CD1-CE1 4.1Å; L336-F355 HydrophobicContact CD2-CE1 3.88Å; L336-F355 HydrophobicContact CD2-CZ 3.6Å
337	L	95.8	Very high	93.2	Very high	12 Å²	12	59.7 Å²	59.7	6%	0.063	30%	0.295	C	S	.	.	H	α-helix	trans	-59.1	-39	176.7	-178.1	59.7	0	0	0	111.2	A267 L270 L271 V333 K339 L340 I341	A267-L337 HydrophobicContact CB-CD1 4.18Å; L270-L337 HydrophobicContact CB-CD1 4.35Å; L270-L337 HydrophobicContact CB-CD2 4.46Å; L271-L337 HydrophobicContact CB-CD2 4.14Å; L271-L337 HydrophobicContact CD1-CD2 4.05Å; V333-L337 HydrophobicContact CG2-CB 4.48Å; V333-L337 WeakPolarHBondContact O-CB 3.23Å; V333-L337 PolarHBondContact O-N 3.42Å; L337-K339 VanDerWaalsContact C-N 3.26Å; L337-K339 PolarHBondContact O-N 2.99Å; L337-L340 PolarHBondContact O-N 3.05Å; L337-I341 HydrophobicContact CD1-CD1 4.22Å; L337-I341 HydrophobicContact CD1-CG1 4.26Å; L337-I341 HydrophobicContact CG-CD1 3.91Å; L337-I341 HydrophobicContact CG-CG1 4.4Å; L337-I341 WeakPolarHBondContact O-CB 3.49Å; L337-I341 VanDerWaalsContact O-CG1 3.23Å; L337-I341 WeakPolarHBondContact O-CG1 3.33Å; L337-I341 PolarHBondContact O-N 3.4Å
338	S	95.8	Very high	93	Very high	46 Å²	46	60 Å²	60	32%	0.322	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-36.5	173.7	-60.3	0	0	0	0	112.1	R334 L336 R342	R334-S338 WeakPolarHBondContact O-CB 3.48Å; R334-S338 PolarHBondContact O-N 3.15Å; R334-S338 PolarHBondContact O-OG 3.37Å; L336-S338 VanDerWaalsContact C-N 3.26Å; L336-S338 PolarHBondContact O-N 3.17Å; S338-R342 VanDerWaalsContact O-CG 3.25Å; S338-R342 WeakPolarHBondContact O-CG 3.38Å; S338-R342 PolarHBondContact O-N 2.96Å; S338-R342 VanDerWaalsContact O-N 3.1Å
339	K	94.8	Very high	92.9	Very high	42 Å²	42	56.7 Å²	56.7	18%	0.183	29%	0.285	C	S	.	.	H	α-helix	trans	-72.9	-40.6	176.2	-166.5	175	-169.3	175.2	0	112.2	P54 A57 P335 L336 L337 R342 N343	P54-K339 WeakPolarHBondContact O-CD 3.46Å; P54-K339 PolarHBondContact O-NZ 2.97Å; A57-K339 HydrophobicContact CB-CD 4.26Å; A57-K339 WeakPolarHBondContact O-CE 3.49Å; A57-K339 PolarHBondContact O-NZ 3.07Å; P335-K339 PolarHBondContact O-N 2.7Å; L336-K339 CarbonylContact O-C 3.59Å; L336-K339 WeakPolarHBondContact O-CA 3.09Å; L336-K339 WeakPolarHBondContact O-CB 3.22Å; L336-K339 PolarHBondContact O-N 3.1Å; L337-K339 VanDerWaalsContact C-N 3.26Å; L337-K339 PolarHBondContact O-N 2.99Å; K339-R342 PolarHBondContact O-N 3.48Å; K339-N343 PolarHBondContact O-N 3.39Å; K339-N343 PolarHBondContact O-ND2 3.41Å
340	L	95.5	Very high	93	Very high	7 Å²	7	60.2 Å²	60.2	4%	0.037	30%	0.301	C	S	.	.	H	α-helix	trans	-59.7	-48	172.4	-75.1	173.6	0	0	0	110.9	L297 L336 L337 R342 N343 Y344 L354	L297-L340 HydrophobicContact CD2-CD1 4.12Å; L336-L340 HydrophobicContact CG-CD1 4.5Å; L336-L340 PolarHBondContact O-N 3.07Å; L337-L340 PolarHBondContact O-N 3.05Å; L340-R342 VanDerWaalsContact C-N 3.34Å; L340-R342 PolarHBondContact O-N 2.8Å; L340-N343 CarbonylContact O-C 3.58Å; L340-N343 PolarHBondContact O-N 3.3Å; L340-N343 VanDerWaalsContact O-N 3.15Å; L340-Y344 WeakPolarHBondContact O-CA 3.33Å; L340-Y344 WeakPolarHBondContact O-CB 3.28Å; L340-Y344 PolarHBondContact O-N 3.23Å; L340-L354 HydrophobicContact CD2-CD1 3.66Å; L340-L354 HydrophobicContact CG-CD1 4.41Å
341	I	95.9	Very high	92.7	Very high	28 Å²	28	66.7 Å²	66.7	14%	0.144	32%	0.324	C	S	.	.	H	α-helix	trans	-58.2	-47	177.8	-69.4	168.3	0	0	0	109.9	Q220 L223 L224 L271 L337 N343 Y344	Q220-I341 HydrophobicContact CG-CG2 4.29Å; Q220-I341 PolarHBondContact NE2-O 3.27Å; L223-I341 HydrophobicContact CD2-CG1 3.91Å; L224-I341 HydrophobicContact CD2-CG2 4.44Å; L271-I341 HydrophobicContact CD1-CD1 4.1Å; L271-I341 HydrophobicContact CD2-CD1 4.36Å; L337-I341 HydrophobicContact CD1-CD1 4.22Å; L337-I341 HydrophobicContact CD1-CG1 4.26Å; L337-I341 HydrophobicContact CG-CD1 3.91Å; L337-I341 HydrophobicContact CG-CG1 4.4Å; L337-I341 WeakPolarHBondContact O-CB 3.49Å; L337-I341 VanDerWaalsContact O-CG1 3.23Å; L337-I341 WeakPolarHBondContact O-CG1 3.33Å; L337-I341 PolarHBondContact O-N 3.4Å; I341-N343 PolarHBondContact O-N 2.67Å; I341-Y344 WeakPolarHBondContact O-CB 3.47Å; I341-Y344 PolarHBondContact O-N 2.72Å; I341-Y344 VanDerWaalsContact O-N 3.09Å
342	R	94.9	Very high	92.8	Very high	198 Å²	198	64.2 Å²	64.2	75%	0.747	31%	0.312	S	S	*	.	H	α-helix	trans	-58.4	-32.1	178.7	-75.9	171.3	-172.5	-179.2	2.7	114.2	S338 K339 L340	S338-R342 VanDerWaalsContact O-CG 3.25Å; S338-R342 WeakPolarHBondContact O-CG 3.38Å; S338-R342 PolarHBondContact O-N 2.96Å; S338-R342 VanDerWaalsContact O-N 3.1Å; K339-R342 PolarHBondContact O-N 3.48Å; L340-R342 VanDerWaalsContact C-N 3.34Å; L340-R342 PolarHBondContact O-N 2.8Å
343	N	94.3	Very high	93.1	Very high	78 Å²	78	58.2 Å²	58.2	42%	0.417	29%	0.285	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.9	6.2	180	-64.2	-75.8	0	0	0	113	L58 K339 L340 I341 G345 L348	L58-N343 HydrophobicContact CD1-CB 3.75Å; K339-N343 PolarHBondContact O-N 3.39Å; K339-N343 PolarHBondContact O-ND2 3.41Å; L340-N343 CarbonylContact O-C 3.58Å; L340-N343 PolarHBondContact O-N 3.3Å; L340-N343 VanDerWaalsContact O-N 3.15Å; I341-N343 PolarHBondContact O-N 2.67Å; N343-G345 PolarHBondContact O-N 2.74Å; N343-L348 HydrophobicContact CB-CD1 3.87Å; N343-L348 WeakPolarHBondContact O-CD1 3.41Å
344	Y	96.3	Very high	93.2	Very high	16 Å²	16	58.3 Å²	58.3	6%	0.063	29%	0.286	C	S	.	.			trans	-61.2	131.1	-172.6	-169.6	-83.1	0	0	0	111.5	I217 M218 Q220 L223 C264 A267 L340 I341	I217-Y344 WeakPolarHBondContact O-CE1 3.49Å; I217-Y344 VanDerWaalsContact O-CZ 3.3Å; I217-Y344 PolarHBondContact O-OH 2.83Å; M218-Y344 VanDerWaalsContact C-CE1 3.49Å; Q220-Y344 HydrophobicContact CB-CD1 4.08Å; L223-Y344 HydrophobicContact CB-CE1 4.23Å; L223-Y344 HydrophobicContact CB-CE2 4.47Å; L223-Y344 HydrophobicContact CD2-CD2 3.76Å; L223-Y344 HydrophobicContact CD2-CE2 3.63Å; L223-Y344 HydrophobicContact CD2-CG 4.31Å; L223-Y344 HydrophobicContact CG-CE2 4.45Å; C264-Y344 VanDerWaalsContact CA-CE2 3.43Å; C264-Y344 HydrophobicContact CB-CE1 4.17Å; C264-Y344 HydrophobicContact CB-CE2 3.69Å; C264-Y344 VanDerWaalsContact CB-CZ 3.46Å; C264-Y344 WeakPolarHBondContact CB-OH 3.46Å; C264-Y344 WeakPolarHBondContact O-CE2 3.45Å; C264-Y344 PolarHBondContact O-OH 3.02Å; C264-Y344 VanDerWaalsContact SG-CZ 3.58Å; A267-Y344 HydrophobicContact CB-CD2 4.21Å; A267-Y344 HydrophobicContact CB-CE2 4.06Å; L340-Y344 WeakPolarHBondContact O-CA 3.33Å; L340-Y344 WeakPolarHBondContact O-CB 3.28Å; L340-Y344 PolarHBondContact O-N 3.23Å; I341-Y344 WeakPolarHBondContact O-CB 3.47Å; I341-Y344 PolarHBondContact O-N 2.72Å; I341-Y344 VanDerWaalsContact O-N 3.09Å
345	G	95.1	Very high	93.3	Very high	7 Å²	7	50.9 Å²	50.9	7%	0.072	26%	0.258	C	S	.	.	S	Bend	trans	167	177.4	-175.8	0	0	0	0	0	115.2	M218 N343 S347 L348	M218-G345 WeakPolarHBondContact O-CA 3.35Å; N343-G345 PolarHBondContact O-N 2.74Å; G345-S347 PolarHBondContact O-N 3.19Å; G345-L348 WeakPolarHBondContact O-CB 3.42Å; G345-L348 PolarHBondContact O-N 3.29Å
346	P	92.7	Very high	93.3	Very high	86 Å²	86	47.9 Å²	47.9	56%	0.558	24%	0.238	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.1	177.5	25.7	-34.7	0	0	0	114.5	M218 S260	M218-P346 VanDerWaalsContact CE-CA 3.49Å; M218-P346 HydrophobicContact CE-CB 4.33Å; S260-P346 WeakPolarHBondContact CB-O 3.35Å; S260-P346 PolarHBondContact OG-O 2.73Å
347	S	92.1	Very high	93.2	Very high	44 Å²	44	49 Å²	49	31%	0.308	25%	0.246	S	C	.	.	T	Hydrogen-bonded Turn	trans	-111.3	20.2	-177.7	62.2	0	0	0	0	113.4	G345 A349 D350	G345-S347 PolarHBondContact O-N 3.19Å; S347-A349 VanDerWaalsContact C-N 3.25Å; S347-A349 PolarHBondContact O-N 2.89Å; S347-D350 WeakPolarHBondContact CA-OD2 3.44Å; S347-D350 WeakPolarHBondContact CB-OD2 3.24Å; S347-D350 PolarHBondContact O-N 3.23Å
348	L	91.6	Very high	93.1	Very high	8 Å²	8	54.4 Å²	54.4	4%	0.042	28%	0.279	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.9	-31.6	-175	174.3	61.6	0	0	0	112.3	L58 S260 Y263 N343 G345	L58-L348 HydrophobicContact CD1-CD1 4.13Å; L58-L348 HydrophobicContact CD2-CD1 4.43Å; S260-L348 PolarHBondContact OG-N 3.37Å; Y263-L348 HydrophobicContact CD2-CD2 4.08Å; Y263-L348 HydrophobicContact CD2-CG 3.92Å; Y263-L348 HydrophobicContact CG-CD2 4.33Å; N343-L348 HydrophobicContact CB-CD1 3.87Å; N343-L348 WeakPolarHBondContact O-CD1 3.41Å; G345-L348 WeakPolarHBondContact O-CB 3.42Å; G345-L348 PolarHBondContact O-N 3.29Å
349	A	90.7	Very high	93.1	Very high	24 Å²	24	54.4 Å²	54.4	20%	0.198	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.7	-5.7	177.2	0	0	0	0	0	114.2	A259 S260 Y263 S347	A259-A349 HydrophobicContact CB-CB 3.58Å; S260-A349 WeakPolarHBondContact OG-CB 3.41Å; S260-A349 PolarHBondContact OG-N 3.48Å; Y263-A349 HydrophobicContact CD2-CB 4.41Å; Y263-A349 HydrophobicContact CE2-CB 4.4Å; S347-A349 VanDerWaalsContact C-N 3.25Å; S347-A349 PolarHBondContact O-N 2.89Å
350	D	85.3	Confident	93.1	Very high	113 Å²	113	52.8 Å²	52.8	60%	0.604	27%	0.271	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.7	-24.2	-168.7	-59.7	-5	0	0	0	113.7	S347	S347-D350 WeakPolarHBondContact CA-OD2 3.44Å; S347-D350 WeakPolarHBondContact CB-OD2 3.24Å; S347-D350 PolarHBondContact O-N 3.23Å
351	R	77.8	Confident	93.2	Very high	202 Å²	202	53.4 Å²	53.4	76%	0.762	28%	0.275	S	S	*	.	S	Bend	trans	-101.6	-60.9	-168.2	-63.6	-174.1	178.7	-157	-0.1	113.1
352	E	91.4	Very high	93.1	Very high	78 Å²	78	60 Å²	60	36%	0.364	31%	0.305	S	S	.	.	S	Bend	trans	-131.7	140.1	-169.7	-64.7	170.6	142.3	0	0	108.7	L58 H60	L58-E352 HydrophobicContact CB-CB 4.31Å; L58-E352 WeakPolarHBondContact CD2-O 3.23Å; H60-E352 CarbonylContact O-C 3.51Å; H60-E352 WeakPolarHBondContact O-CA 3.42Å
353	A	94.5	Very high	93.2	Very high	6 Å²	6	53 Å²	53	5%	0.05	29%	0.285	C	S	.	.			trans	-62	142.5	175.4	0	0	0	0	0	111	L58 H60 F355	L58-A353 WeakPolarHBondContact CA-O 3.39Å; L58-A353 PolarHBondContact N-O 3.06Å; H60-A353 PolarHBondContact O-N 2.87Å; A353-F355 VanDerWaalsContact C-N 3.25Å; A353-F355 PolarHBondContact O-N 3.32Å
354	L	96.6	Very high	93.3	Very high	2 Å²	2	49.3 Å²	49.3	1%	0.01	27%	0.265	C	S	.	.	S	Bend	trans	-59.7	-39.7	172.5	175.2	59.4	0	0	0	111	A57 L58 Y263 C293 L297 L336 L340	A57-L354 WeakPolarHBondContact CA-O 3.42Å; A57-L354 HydrophobicContact CB-CD1 4.38Å; A57-L354 WeakPolarHBondContact CB-O 3.25Å; L58-L354 PolarHBondContact N-O 2.76Å; Y263-L354 HydrophobicContact CE2-CB 3.84Å; Y263-L354 HydrophobicContact CE2-CD2 4.38Å; C293-L354 HydrophobicContact CB-CB 3.76Å; C293-L354 HydrophobicContact CB-CD2 4.14Å; C293-L354 HydrophobicContact CB-CG 4.26Å; L297-L354 HydrophobicContact CB-CD2 4.42Å; L297-L354 HydrophobicContact CD2-CD2 4.02Å; L336-L354 HydrophobicContact CD1-CD1 4.34Å; L340-L354 HydrophobicContact CD2-CD1 3.66Å; L340-L354 HydrophobicContact CG-CD1 4.41Å
355	F	96.9	Very high	93.4	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.269	C	S	.	.	S	Bend	trans	-141.1	145.2	173	-54.8	-55	0	0	0	110.2	P52 A57 H289 C293 Y296 L297 L336 A353 V359 I360	P52-F355 HydrophobicContact CB-CD1 3.7Å; P52-F355 HydrophobicContact CB-CE1 3.68Å; P52-F355 HydrophobicContact CB-CG 4.4Å; P52-F355 HydrophobicContact CB-CZ 4.33Å; P52-F355 HydrophobicContact CG-CD1 3.7Å; P52-F355 HydrophobicContact CG-CD2 4.16Å; P52-F355 HydrophobicContact CG-CE1 3.62Å; P52-F355 HydrophobicContact CG-CE2 4.07Å; P52-F355 HydrophobicContact CG-CG 3.99Å; P52-F355 HydrophobicContact CG-CZ 3.8Å; A57-F355 HydrophobicContact CB-CD1 4.21Å; A57-F355 HydrophobicContact CB-CE1 4.18Å; H289-F355 PolarHBondContact NE2-O 3.19Å; C293-F355 HydrophobicContact CB-CD2 3.98Å; C293-F355 PolarHBondContact SG-O 3.12Å; C293-F355 VanDerWaalsContact SG-O 3.33Å; Y296-F355 HydrophobicContact CD1-CD2 4.16Å; Y296-F355 HydrophobicContact CD1-CE2 4.18Å; L297-F355 HydrophobicContact CB-CE2 4.01Å; L297-F355 HydrophobicContact CB-CZ 4.37Å; L297-F355 HydrophobicContact CD1-CZ 4.35Å; L336-F355 HydrophobicContact CD1-CE1 4.1Å; L336-F355 HydrophobicContact CD2-CE1 3.88Å; L336-F355 HydrophobicContact CD2-CZ 3.6Å; A353-F355 VanDerWaalsContact C-N 3.25Å; A353-F355 PolarHBondContact O-N 3.32Å; F355-V359 HydrophobicContact CB-CG2 3.71Å; F355-V359 HydrophobicContact CG-CG2 4.32Å; F355-I360 HydrophobicContact CB-CG1 4.39Å
356	P	95.3	Very high	93.5	Very high	8 Å²	8	55.8 Å²	55.8	5%	0.052	29%	0.293	C	S	.	.			trans	-69.1	154.4	166.2	29.7	-33.8	0	0	0	110.9	V56 H60 T358 V359	V56-P356 HydrophobicContact CB-CG 4.49Å; H60-P356 HydrophobicContact CB-CB 4.28Å; P356-T358 PolarHBondContact O-N 3.24Å; P356-T358 VanDerWaalsContact O-N 3.08Å; P356-V359 HydrophobicContact CG-CG1 4.24Å; P356-V359 HydrophobicContact CG-CG2 4.09Å; P356-V359 WeakPolarHBondContact O-CG2 3.47Å; P356-V359 PolarHBondContact O-N 2.98Å
357	S	93.4	Very high	93.7	Very high	23 Å²	23	53.7 Å²	53.7	16%	0.161	28%	0.276	C	S	.	.	G	3₁₀ helix	trans	-59.1	-28.3	-179.1	-55.7	0	0	0	0	112.7	E63 H289 V359 I360	E63-S357 PolarHBondContact OE1-N 3.47Å; E63-S357 PolarHBondContact OE1-OG 3.19Å; E63-S357 WeakPolarHBondContact OE2-CB 3.47Å; E63-S357 PolarHBondContact OE2-OG 2.96Å; H289-S357 PolarHBondContact CE1-OG 2.89Å; S357-V359 PolarHBondContact O-N 3.19Å; S357-V359 VanDerWaalsContact O-N 3.16Å; S357-I360 PolarHBondContact O-N 3.27Å
358	T	93.9	Very high	94	Very high	126 Å²	126	51.7 Å²	51.7	77%	0.773	26%	0.261	S	S	*	.	G	3₁₀ helix	trans	-63.8	-20	-177.8	58.3	0	0	0	0	114.4	P356	P356-T358 PolarHBondContact O-N 3.24Å; P356-T358 VanDerWaalsContact O-N 3.08Å
359	V	95.3	Very high	94.3	Very high	47 Å²	47	54.2 Å²	54.2	29%	0.285	27%	0.273	S	S	.	.	G	3₁₀ helix	trans	-102	0.2	177.6	-55	0	0	0	0	112.8	P52 V56 F355 P356 S357	P52-V359 HydrophobicContact CB-CB 4.43Å; P52-V359 HydrophobicContact CB-CG2 3.99Å; P52-V359 HydrophobicContact CG-CG2 4.08Å; V56-V359 HydrophobicContact CG2-CG1 4.22Å; V56-V359 HydrophobicContact CG2-CG2 4.32Å; F355-V359 HydrophobicContact CB-CG2 3.71Å; F355-V359 HydrophobicContact CG-CG2 4.32Å; P356-V359 HydrophobicContact CG-CG1 4.24Å; P356-V359 HydrophobicContact CG-CG2 4.09Å; P356-V359 WeakPolarHBondContact O-CG2 3.47Å; P356-V359 PolarHBondContact O-N 2.98Å; S357-V359 PolarHBondContact O-N 3.19Å; S357-V359 VanDerWaalsContact O-N 3.16Å
360	I	95.9	Very high	94.7	Very high	7 Å²	7	58.4 Å²	58.4	4%	0.036	29%	0.288	C	S	.	.	S	Bend	trans	-95.8	116.9	175.7	-55.1	177	0	0	0	107.5	V292 Y296 F355 S357 F364 L365	V292-I360 HydrophobicContact CG1-CD1 4.07Å; Y296-I360 HydrophobicContact CD1-CG1 4.33Å; Y296-I360 HydrophobicContact CD2-CG2 4.35Å; Y296-I360 HydrophobicContact CG-CG2 4.2Å; F355-I360 HydrophobicContact CB-CG1 4.39Å; S357-I360 PolarHBondContact O-N 3.27Å; I360-F364 HydrophobicContact CG2-CD1 3.49Å; I360-F364 VanDerWaalsContact CG2-CD1 3.49Å; I360-F364 HydrophobicContact CG2-CE1 4.08Å; I360-F364 HydrophobicContact CG2-CG 4.43Å; I360-L365 HydrophobicContact CB-CG 4.47Å; I360-L365 HydrophobicContact CG2-CD1 4.34Å; I360-L365 HydrophobicContact CG2-CD2 3.79Å; I360-L365 HydrophobicContact CG2-CG 3.77Å
361	P	96.4	Very high	95.3	Very high	20 Å²	20	53.4 Å²	53.4	13%	0.13	26%	0.261	C	S	.	.			trans	-61.1	140.5	-177.3	-24.7	34.6	0	0	0	112.9	E48 Y296 T363 F364 L365	E48-P361 HydrophobicContact CG-CB 4.23Å; E48-P361 HydrophobicContact CG-CG 4.41Å; Y296-P361 HydrophobicContact CE2-CG 3.96Å; Y296-P361 WeakPolarHBondContact OH-CD 3.46Å; Y296-P361 WeakPolarHBondContact OH-CG 3.32Å; P361-T363 PolarHBondContact O-N 3.11Å; P361-F364 WeakPolarHBondContact O-CB 3.19Å; P361-F364 PolarHBondContact O-N 2.93Å; P361-L365 PolarHBondContact O-N 3.29Å
362	E	94.8	Very high	96.3	Very high	166 Å²	166	44 Å²	44	78%	0.776	23%	0.226	S	C	*	.	H	α-helix	trans	-58.5	-33.4	176.1	-67.6	-177.3	178.8	0	0	112.1	F364 L365 K366	E362-F364 VanDerWaalsContact C-N 3.27Å; E362-F364 PolarHBondContact O-N 3.45Å; E362-L365 PolarHBondContact O-N 3.48Å; E362-K366 WeakPolarHBondContact O-CB 3.25Å; E362-K366 PolarHBondContact O-N 2.96Å
363	T	96.3	Very high	96.7	Very high	52 Å²	52	41.8 Å²	41.8	32%	0.319	22%	0.22	S	C	.	.	H	α-helix	trans	-62.8	-33.2	176.2	54.5	0	0	0	0	112.7	E48 W49 P361 Q367	E48-T363 VanDerWaalsContact OE1-CG2 3.25Å; E48-T363 WeakPolarHBondContact OE1-CG2 3.01Å; E48-T363 PolarHBondContact OE1-OG1 2.96Å; E48-T363 PolarHBondContact OE2-OG1 2.76Å; W49-T363 PolarHBondContact NE1-OG1 3.33Å; P361-T363 PolarHBondContact O-N 3.11Å; T363-Q367 WeakPolarHBondContact O-CG 3.39Å; T363-Q367 PolarHBondContact O-NE2 3.42Å
364	F	97.7	Very high	96.9	Very high	0 Å²	0	44.7 Å²	44.7	0%	0	23%	0.23	C	C	.	.	H	α-helix	trans	-75.5	-50.2	172.3	170.9	-93.6	0	0	0	110.8	F41 W49 V292 L295 Y296 N299 I360 P361 E362 K366 Q367 H368	F41-F364 HydrophobicContact CD1-CD2 4.13Å; F41-F364 AromaticContact CD1-CE2 3.89Å; F41-F364 HydrophobicContact CD1-CE2 3.89Å; F41-F364 HydrophobicContact CE1-CD2 4.13Å; F41-F364 AromaticContact CE1-CE2 3.58Å; F41-F364 HydrophobicContact CE1-CE2 3.58Å; F41-F364 HydrophobicContact CE1-CZ 4.16Å; F41-F364 HydrophobicContact CZ-CE2 4.08Å; F41-F364 HydrophobicContact CZ-CZ 4.42Å; W49-F364 HydrophobicContact CD2-CB 4.34Å; W49-F364 HydrophobicContact CE3-CD2 4.39Å; W49-F364 HydrophobicContact CH2-CB 4.31Å; W49-F364 HydrophobicContact CH2-CD2 4.03Å; W49-F364 VanDerWaalsContact CZ2-CA 3.46Å; W49-F364 HydrophobicContact CZ2-CB 3.7Å; W49-F364 HydrophobicContact CZ2-CD2 4.28Å; W49-F364 HydrophobicContact CZ3-CD2 4.09Å; V292-F364 HydrophobicContact CG1-CE1 4.06Å; L295-F364 HydrophobicContact CB-CZ 3.95Å; Y296-F364 HydrophobicContact CD2-CB 4.15Å; Y296-F364 AromaticContact CD2-CD1 3.87Å; Y296-F364 HydrophobicContact CD2-CD1 3.87Å; Y296-F364 AromaticContact CD2-CD2 3.87Å; Y296-F364 HydrophobicContact CD2-CD2 3.87Å; Y296-F364 HydrophobicContact CD2-CE1 4.26Å; Y296-F364 HydrophobicContact CD2-CE2 4.26Å; Y296-F364 AromaticContact CD2-CG 3.66Å; Y296-F364 HydrophobicContact CD2-CG 3.66Å; Y296-F364 HydrophobicContact CD2-CZ 4.44Å; Y296-F364 HydrophobicContact CE2-CB 4.38Å; Y296-F364 HydrophobicContact CE2-CG 4.37Å; Y296-F364 HydrophobicContact CG-CD1 4.33Å; Y296-F364 HydrophobicContact CG-CE1 4.37Å; N299-F364 HydrophobicContact CB-CE2 4.43Å; I360-F364 HydrophobicContact CG2-CD1 3.49Å; I360-F364 VanDerWaalsContact CG2-CD1 3.49Å; I360-F364 HydrophobicContact CG2-CE1 4.08Å; I360-F364 HydrophobicContact CG2-CG 4.43Å; P361-F364 WeakPolarHBondContact O-CB 3.19Å; P361-F364 PolarHBondContact O-N 2.93Å; E362-F364 VanDerWaalsContact C-N 3.27Å; E362-F364 PolarHBondContact O-N 3.45Å; F364-K366 VanDerWaalsContact C-N 3.29Å; F364-K366 PolarHBondContact O-N 3.45Å; F364-Q367 PolarHBondContact O-N 3.09Å; F364-Q367 VanDerWaalsContact O-N 3.11Å; F364-H368 HydrophobicContact CE1-CB 4.27Å; F364-H368 HydrophobicContact CZ-CB 4.41Å; F364-H368 PolarHBondContact O-N 3.46Å
365	L	97.1	Very high	96.9	Very high	30 Å²	30	45.6 Å²	45.6	16%	0.157	23%	0.234	C	C	.	.	H	α-helix	trans	-56.2	-44.2	-177.7	-73.5	173.4	0	0	0	111.7	V292 I360 P361 E362 Q367 H368 E369	V292-L365 HydrophobicContact CG1-CD2 3.58Å; I360-L365 HydrophobicContact CB-CG 4.47Å; I360-L365 HydrophobicContact CG2-CD1 4.34Å; I360-L365 HydrophobicContact CG2-CD2 3.79Å; I360-L365 HydrophobicContact CG2-CG 3.77Å; P361-L365 PolarHBondContact O-N 3.29Å; E362-L365 PolarHBondContact O-N 3.48Å; L365-Q367 PolarHBondContact O-N 3.31Å; L365-H368 WeakPolarHBondContact O-CB 3.34Å; L365-H368 PolarHBondContact O-N 3.05Å; L365-H368 VanDerWaalsContact O-N 3.17Å; L365-E369 WeakPolarHBondContact O-CG 3.33Å; L365-E369 PolarHBondContact O-N 3.49Å
366	K	97.1	Very high	97	Very high	130 Å²	130	46.6 Å²	46.6	57%	0.565	24%	0.239	S	C	*	.	H	α-helix	trans	-60	-45.6	177	-175.5	178.3	177.2	-177.8	0	112.5	E362 F364 H368 E369 E370	E362-K366 WeakPolarHBondContact O-CB 3.25Å; E362-K366 PolarHBondContact O-N 2.96Å; F364-K366 VanDerWaalsContact C-N 3.29Å; F364-K366 PolarHBondContact O-N 3.45Å; K366-H368 VanDerWaalsContact C-N 3.29Å; K366-H368 PolarHBondContact O-N 3.38Å; K366-E369 PolarHBondContact O-N 2.94Å; K366-E370 WeakPolarHBondContact CE-OE1 3.4Å; K366-E370 WeakPolarHBondContact O-CG 3.38Å; K366-E370 PolarHBondContact O-N 3.2Å
367	Q	98	Very high	97.2	Very high	42 Å²	42	49.2 Å²	49.2	20%	0.196	25%	0.254	C	S	.	.	H	α-helix	trans	-64.4	-37.3	176.7	-71.7	-176.5	55.4	0	0	111.8	F41 L42 T363 F364 L365 L371	F41-Q367 HydrophobicContact CD1-CB 4.15Å; F41-Q367 HydrophobicContact CE1-CB 4.45Å; L42-Q367 PolarHBondContact O-NE2 2.94Å; L42-Q367 PolarHBondContact O-OE1 3.23Å; T363-Q367 WeakPolarHBondContact O-CG 3.39Å; T363-Q367 PolarHBondContact O-NE2 3.42Å; F364-Q367 PolarHBondContact O-N 3.09Å; F364-Q367 VanDerWaalsContact O-N 3.11Å; L365-Q367 PolarHBondContact O-N 3.31Å; Q367-L371 VanDerWaalsContact O-CB 3.25Å; Q367-L371 WeakPolarHBondContact O-CB 3.48Å; Q367-L371 PolarHBondContact O-N 3.01Å
368	H	98.5	Very high	97.4	Very high	1 Å²	1	50.1 Å²	50.1	1%	0.005	26%	0.257	C	S	.	.	H	α-helix	trans	-64.5	-44.1	176.3	-172.1	81	0	0	0	112	F41 L286 F364 L365 K366 L371 C372	F41-H368 HydrophobicContact CE1-CB 4.19Å; F41-H368 AromaticContact CZ-ND1 3.9Å; L286-H368 PolarHBondContact O-NE2 3.45Å; F364-H368 HydrophobicContact CE1-CB 4.27Å; F364-H368 HydrophobicContact CZ-CB 4.41Å; F364-H368 PolarHBondContact O-N 3.46Å; L365-H368 WeakPolarHBondContact O-CB 3.34Å; L365-H368 PolarHBondContact O-N 3.05Å; L365-H368 VanDerWaalsContact O-N 3.17Å; K366-H368 VanDerWaalsContact C-N 3.29Å; K366-H368 PolarHBondContact O-N 3.38Å; H368-L371 PolarHBondContact O-N 2.72Å; H368-C372 WeakPolarHBondContact O-CB 3.15Å; H368-C372 PolarHBondContact O-N 2.93Å; H368-C372 PolarHBondContact O-SG 3.28Å
369	E	98.4	Very high	97.5	Very high	61 Å²	61	44.6 Å²	44.6	29%	0.285	22%	0.223	S	C	.	.	H	α-helix	trans	-63.1	-43.2	175.5	-73.9	-179.3	163.6	0	0	112.8	L68 L365 K366 C372 S373	L68-E369 HydrophobicContact CD2-CG 3.93Å; L68-E369 HydrophobicContact CG-CG 4.39Å; L365-E369 WeakPolarHBondContact O-CG 3.33Å; L365-E369 PolarHBondContact O-N 3.49Å; K366-E369 PolarHBondContact O-N 2.94Å; E369-C372 PolarHBondContact O-N 2.88Å; E369-S373 WeakPolarHBondContact O-CB 3.46Å; E369-S373 PolarHBondContact O-N 2.87Å; E369-S373 PolarHBondContact O-OG 2.87Å
370	E	98.4	Very high	97.7	Very high	112 Å²	112	44.2 Å²	44.2	52%	0.523	22%	0.22	S	C	.	.	H	α-helix	trans	-62.4	-43.8	175.8	-73.7	173.2	-173.5	0	0	111.3	K366 S373 Y374	K366-E370 WeakPolarHBondContact CE-OE1 3.4Å; K366-E370 WeakPolarHBondContact O-CG 3.38Å; K366-E370 PolarHBondContact O-N 3.2Å; E370-S373 PolarHBondContact O-N 3.25Å; E370-Y374 PolarHBondContact O-N 3.5Å
371	L	98.3	Very high	97.8	Very high	8 Å²	8	49.6 Å²	49.6	4%	0.042	25%	0.246	C	C	.	.	H	α-helix	trans	-62.2	-45.9	175.5	-177.7	153.7	0	0	0	111.5	K39 F41 L286 V307 Q367 H368 S373 Y374 F375	K39-L371 HydrophobicContact CB-CB 4.42Å; K39-L371 HydrophobicContact CB-CD1 3.5Å; K39-L371 HydrophobicContact CB-CG 3.73Å; K39-L371 HydrophobicContact CG-CD1 4.49Å; K39-L371 HydrophobicContact CG-CG 4.2Å; F41-L371 HydrophobicContact CE1-CD1 4.49Å; F41-L371 HydrophobicContact CE2-CD1 3.98Å; F41-L371 HydrophobicContact CZ-CD1 3.93Å; L286-L371 HydrophobicContact CD1-CD2 3.96Å; V307-L371 HydrophobicContact CB-CD1 3.92Å; V307-L371 HydrophobicContact CB-CD2 4.07Å; V307-L371 HydrophobicContact CB-CG 4.43Å; V307-L371 HydrophobicContact CG1-CD2 4.26Å; V307-L371 HydrophobicContact CG2-CD1 3.67Å; V307-L371 HydrophobicContact CG2-CD2 3.93Å; V307-L371 HydrophobicContact CG2-CG 4.42Å; Q367-L371 VanDerWaalsContact O-CB 3.25Å; Q367-L371 WeakPolarHBondContact O-CB 3.48Å; Q367-L371 PolarHBondContact O-N 3.01Å; H368-L371 PolarHBondContact O-N 2.72Å; L371-S373 VanDerWaalsContact C-N 3.33Å; L371-S373 PolarHBondContact O-N 2.97Å; L371-Y374 WeakPolarHBondContact O-CB 3.41Å; L371-Y374 PolarHBondContact O-N 3.43Å; L371-F375 HydrophobicContact CD2-CD2 3.7Å; L371-F375 HydrophobicContact CD2-CE2 3.77Å; L371-F375 HydrophobicContact CG-CD2 4.12Å; L371-F375 HydrophobicContact CG-CE2 3.9Å; L371-F375 VanDerWaalsContact O-CD2 3.32Å; L371-F375 WeakPolarHBondContact O-CD2 3.38Å; L371-F375 PolarHBondContact O-N 2.61Å; L371-F375 VanDerWaalsContact O-N 3.15Å
372	C	98.6	Very high	97.8	Very high	4 Å²	4	49.9 Å²	49.9	3%	0.027	25%	0.247	C	C	.	.	H	α-helix	trans	-60.7	-43	177.1	-77.6	0	0	0	0	111.9	L68 L71 L286 Y287 H368 E369 Y374 F375 H376	L68-C372 HydrophobicContact CD2-CB 3.86Å; L71-C372 HydrophobicContact CD1-CB 3.91Å; L286-C372 PolarHBondContact O-SG 2.91Å; Y287-C372 HydrophobicContact CD1-CB 4.13Å; Y287-C372 HydrophobicContact CE1-CB 3.83Å; H368-C372 WeakPolarHBondContact O-CB 3.15Å; H368-C372 PolarHBondContact O-N 2.93Å; H368-C372 PolarHBondContact O-SG 3.28Å; E369-C372 PolarHBondContact O-N 2.88Å; C372-Y374 VanDerWaalsContact C-N 3.32Å; C372-Y374 PolarHBondContact O-N 3.41Å; C372-F375 PolarHBondContact O-N 2.94Å; C372-H376 WeakPolarHBondContact O-CB 3.35Å; C372-H376 PolarHBondContact O-N 3.02Å
373	S	98.7	Very high	97.9	Very high	33 Å²	33	42.1 Å²	42.1	23%	0.231	21%	0.211	C	C	.	.	H	α-helix	trans	-64.3	-37.2	177.5	-55.6	0	0	0	0	111.6	H67 E369 E370 L371 T377	H67-S373 PolarHBondContact NE2-OG 2.95Å; E369-S373 WeakPolarHBondContact O-CB 3.46Å; E369-S373 PolarHBondContact O-N 2.87Å; E369-S373 PolarHBondContact O-OG 2.87Å; E370-S373 PolarHBondContact O-N 3.25Å; L371-S373 VanDerWaalsContact C-N 3.33Å; L371-S373 PolarHBondContact O-N 2.97Å; S373-T377 WeakPolarHBondContact O-CB 3.4Å; S373-T377 PolarHBondContact O-N 2.8Å; S373-T377 PolarHBondContact O-OG1 3.13Å
374	Y	98.6	Very high	97.9	Very high	66 Å²	66	40.5 Å²	40.5	26%	0.259	20%	0.204	S	C	.	.	H	α-helix	trans	-63.4	-51.6	176.1	172.3	-101.1	0	0	0	112.3	K39 E370 L371 C372 T377 L378	K39-Y374 HydrophobicContact CD-CD1 4.17Å; K39-Y374 HydrophobicContact CD-CE1 4.44Å; K39-Y374 HydrophobicContact CD-CG 4.37Å; K39-Y374 VanDerWaalsContact CE-CD1 3.42Å; K39-Y374 VanDerWaalsContact CE-CD2 3.43Å; K39-Y374 HydrophobicContact CG-CD1 3.63Å; K39-Y374 HydrophobicContact CG-CE1 4.01Å; K39-Y374 HydrophobicContact CG-CG 4.22Å; E370-Y374 PolarHBondContact O-N 3.5Å; L371-Y374 WeakPolarHBondContact O-CB 3.41Å; L371-Y374 PolarHBondContact O-N 3.43Å; C372-Y374 VanDerWaalsContact C-N 3.32Å; C372-Y374 PolarHBondContact O-N 3.41Å; Y374-T377 PolarHBondContact O-N 3.12Å; Y374-L378 HydrophobicContact CD1-CD1 4.18Å; Y374-L378 HydrophobicContact CE1-CD1 3.59Å; Y374-L378 HydrophobicContact CE2-CD1 4.28Å; Y374-L378 WeakPolarHBondContact O-CG 3.45Å; Y374-L378 PolarHBondContact O-N 2.91Å
375	F	98.4	Very high	97.8	Very high	21 Å²	21	42.8 Å²	42.8	9%	0.092	22%	0.215	C	C	.	.	H	α-helix	trans	-70.5	-32.9	179.7	-72.5	-68.7	0	0	0	112.9	K37 K39 V307 K309 V320 L371 C372 L378 Q379	K37-F375 HydrophobicContact CB-CE1 4.45Å; K39-F375 HydrophobicContact CB-CE2 4.3Å; K39-F375 HydrophobicContact CG-CE2 4.17Å; K39-F375 HydrophobicContact CG-CZ 4.48Å; V307-F375 HydrophobicContact CB-CE2 3.87Å; V307-F375 HydrophobicContact CB-CZ 4.29Å; V307-F375 HydrophobicContact CG1-CD2 4.25Å; V307-F375 HydrophobicContact CG1-CE2 3.57Å; V307-F375 HydrophobicContact CG1-CZ 3.93Å; V307-F375 WeakPolarHBondContact O-CZ 3.32Å; K309-F375 HydrophobicContact CB-CD1 4.22Å; K309-F375 HydrophobicContact CB-CE1 3.74Å; V320-F375 HydrophobicContact CG1-CD1 4.24Å; V320-F375 HydrophobicContact CG1-CE1 4.43Å; V320-F375 HydrophobicContact CG1-CG 4.49Å; L371-F375 HydrophobicContact CD2-CD2 3.7Å; L371-F375 HydrophobicContact CD2-CE2 3.77Å; L371-F375 HydrophobicContact CG-CD2 4.12Å; L371-F375 HydrophobicContact CG-CE2 3.9Å; L371-F375 VanDerWaalsContact O-CD2 3.32Å; L371-F375 WeakPolarHBondContact O-CD2 3.38Å; L371-F375 PolarHBondContact O-N 2.61Å; L371-F375 VanDerWaalsContact O-N 3.15Å; C372-F375 PolarHBondContact O-N 2.94Å; F375-L378 HydrophobicContact CD1-CD1 4.25Å; F375-Q379 PolarHBondContact O-N 3.02Å; F375-Q379 VanDerWaalsContact O-N 3.1Å
376	H	98.5	Very high	97.8	Very high	22 Å²	22	41.9 Å²	41.9	10%	0.102	21%	0.21	C	C	.	.	H	α-helix	trans	-54.7	-53.2	169.4	168.7	-83.3	0	0	0	111	L71 S74 C372 L378 Q379 V380	L71-H376 HydrophobicContact CD2-CB 4.29Å; S74-H376 PolarHBondContact OG-NE2 2.84Å; S74-H376 VanDerWaalsContact OG-NE2 3.09Å; C372-H376 WeakPolarHBondContact O-CB 3.35Å; C372-H376 PolarHBondContact O-N 3.02Å; H376-L378 PolarHBondContact O-N 3.23Å; H376-Q379 PolarHBondContact O-N 3.42Å; H376-Q379 VanDerWaalsContact O-N 3.12Å; H376-V380 WeakPolarHBondContact O-CG2 3.45Å; H376-V380 PolarHBondContact O-N 3Å
377	T	98.4	Very high	97.7	Very high	62 Å²	62	36.7 Å²	36.7	38%	0.38	19%	0.188	S	C	.	.	H	α-helix	trans	-54.9	-51.5	-178.8	-58.6	0	0	0	0	111.1	S373 Y374 Q379 V380 E381	S373-T377 WeakPolarHBondContact O-CB 3.4Å; S373-T377 PolarHBondContact O-N 2.8Å; S373-T377 PolarHBondContact O-OG1 3.13Å; Y374-T377 PolarHBondContact O-N 3.12Å; T377-Q379 VanDerWaalsContact C-N 3.29Å; T377-Q379 PolarHBondContact O-N 3.38Å; T377-V380 PolarHBondContact O-N 3.01Å; T377-E381 HydrophobicContact CG2-CG 4.33Å; T377-E381 WeakPolarHBondContact CG2-OE1 3.41Å; T377-E381 WeakPolarHBondContact O-CB 3.07Å; T377-E381 VanDerWaalsContact O-CG 3.3Å; T377-E381 WeakPolarHBondContact O-CG 3.44Å; T377-E381 PolarHBondContact O-N 3.13Å
378	L	97.6	Very high	97.6	Very high	42 Å²	42	41.8 Å²	41.8	22%	0.22	21%	0.206	C	C	.	.	H	α-helix	trans	-57.3	-41.3	179.1	-67.6	176.1	0	0	0	112.8	K37 Y374 F375 H376 T382	K37-L378 HydrophobicContact CB-CD1 4.29Å; K37-L378 HydrophobicContact CD-CD1 4.06Å; K37-L378 HydrophobicContact CG-CD1 3.98Å; Y374-L378 HydrophobicContact CD1-CD1 4.18Å; Y374-L378 HydrophobicContact CE1-CD1 3.59Å; Y374-L378 HydrophobicContact CE2-CD1 4.28Å; Y374-L378 WeakPolarHBondContact O-CG 3.45Å; Y374-L378 PolarHBondContact O-N 2.91Å; F375-L378 HydrophobicContact CD1-CD1 4.25Å; H376-L378 PolarHBondContact O-N 3.23Å; L378-T382 WeakPolarHBondContact O-CB 3.4Å; L378-T382 PolarHBondContact O-N 3.44Å; L378-T382 VanDerWaalsContact O-N 3.12Å; L378-T382 PolarHBondContact O-OG1 3.05Å
379	Q	97.7	Very high	97.4	Very high	11 Å²	11	42.2 Å²	42.2	5%	0.051	21%	0.208	C	C	.	.	H	α-helix	trans	-72	-45.5	-178.5	-170.1	175.9	5.1	0	0	111.5	L75 G316 N317 S318 F375 H376 T377 T382 I383	L75-Q379 HydrophobicContact CD1-CB 4.29Å; L75-Q379 HydrophobicContact CD1-CG 3.97Å; G316-Q379 PolarHBondContact O-NE2 2.77Å; N317-Q379 PolarHBondContact O-NE2 3.06Å; S318-Q379 PolarHBondContact OG-NE2 3.38Å; S318-Q379 PolarHBondContact OG-OE1 2.96Å; F375-Q379 PolarHBondContact O-N 3.02Å; F375-Q379 VanDerWaalsContact O-N 3.1Å; H376-Q379 PolarHBondContact O-N 3.42Å; H376-Q379 VanDerWaalsContact O-N 3.12Å; T377-Q379 VanDerWaalsContact C-N 3.29Å; T377-Q379 PolarHBondContact O-N 3.38Å; Q379-T382 PolarHBondContact O-N 3.45Å; Q379-I383 HydrophobicContact CG-CD1 3.93Å; Q379-I383 HydrophobicContact CG-CG1 4.49Å; Q379-I383 WeakPolarHBondContact O-CG1 3.5Å; Q379-I383 PolarHBondContact O-N 3.45Å
380	V	98.3	Very high	97.1	Very high	38 Å²	38	42.7 Å²	42.7	23%	0.23	21%	0.209	C	C	.	.	H	α-helix	trans	-61.3	-46.2	178.1	168	0	0	0	0	110.9	L75 V78 H376 T377 T382 I383 G384	L75-V380 HydrophobicContact CD1-CG2 4.01Å; V78-V380 HydrophobicContact CG2-CG1 4.13Å; V78-V380 HydrophobicContact CG2-CG2 4.2Å; H376-V380 WeakPolarHBondContact O-CG2 3.45Å; H376-V380 PolarHBondContact O-N 3Å; T377-V380 PolarHBondContact O-N 3.01Å; V380-T382 VanDerWaalsContact C-N 3.34Å; V380-T382 PolarHBondContact O-N 2.93Å; V380-I383 PolarHBondContact O-N 3.42Å; V380-G384 PolarHBondContact O-N 3.48Å
381	E	97.4	Very high	96.7	Very high	121 Å²	121	45.5 Å²	45.5	57%	0.565	22%	0.223	S	C	*	.	H	α-helix	trans	-59.8	-44.6	176.8	-73.7	176.8	167.4	0	0	111.6	T377 G384 E385	T377-E381 HydrophobicContact CG2-CG 4.33Å; T377-E381 WeakPolarHBondContact CG2-OE1 3.41Å; T377-E381 WeakPolarHBondContact O-CB 3.07Å; T377-E381 VanDerWaalsContact O-CG 3.3Å; T377-E381 WeakPolarHBondContact O-CG 3.44Å; T377-E381 PolarHBondContact O-N 3.13Å; E381-G384 PolarHBondContact O-N 2.83Å; E381-E385 VanDerWaalsContact O-CB 3.31Å; E381-E385 WeakPolarHBondContact O-CB 3.42Å; E381-E385 PolarHBondContact O-N 2.79Å
382	T	96.5	Very high	96.3	Very high	25 Å²	25	47.5 Å²	47.5	15%	0.153	25%	0.245	C	C	.	.	H	α-helix	trans	-63.6	-45	178.2	-63.4	0	0	0	0	112.3	A315 L378 Q379 V380 N386	A315-T382 HydrophobicContact CB-CG2 3.65Å; L378-T382 WeakPolarHBondContact O-CB 3.4Å; L378-T382 PolarHBondContact O-N 3.44Å; L378-T382 VanDerWaalsContact O-N 3.12Å; L378-T382 PolarHBondContact O-OG1 3.05Å; Q379-T382 PolarHBondContact O-N 3.45Å; V380-T382 VanDerWaalsContact C-N 3.34Å; V380-T382 PolarHBondContact O-N 2.93Å; T382-N386 WeakPolarHBondContact CG2-ND2 3.29Å; T382-N386 WeakPolarHBondContact O-CB 3.49Å; T382-N386 PolarHBondContact O-N 3.36Å; T382-N386 PolarHBondContact O-ND2 3.33Å
383	I	97	Very high	95.9	Very high	4 Å²	4	49 Å²	49	2%	0.021	25%	0.252	C	S	.	.	H	α-helix	trans	-65.8	-45.8	179.2	-65.4	167.7	0	0	0	109.5	V78 K79 L82 Q379 V380 E385 N386 L387	V78-I383 HydrophobicContact CG1-CB 3.85Å; V78-I383 HydrophobicContact CG1-CD1 4.21Å; V78-I383 HydrophobicContact CG1-CG2 3.62Å; K79-I383 HydrophobicContact CG-CD1 4.15Å; L82-I383 HydrophobicContact CD1-CG2 4.15Å; L82-I383 HydrophobicContact CD2-CG2 4.14Å; L82-I383 HydrophobicContact CG-CG2 4.34Å; Q379-I383 HydrophobicContact CG-CD1 3.93Å; Q379-I383 HydrophobicContact CG-CG1 4.49Å; Q379-I383 WeakPolarHBondContact O-CG1 3.5Å; Q379-I383 PolarHBondContact O-N 3.45Å; V380-I383 PolarHBondContact O-N 3.42Å; I383-E385 PolarHBondContact O-N 2.93Å; I383-N386 PolarHBondContact O-N 2.93Å; I383-L387 HydrophobicContact CG2-CD1 4.05Å; I383-L387 HydrophobicContact CG2-CG 4.5Å; I383-L387 WeakPolarHBondContact O-CG 3.25Å; I383-L387 PolarHBondContact O-N 3.41Å
384	G	97.3	Very high	95.6	Very high	17 Å²	17	49.7 Å²	49.7	18%	0.175	26%	0.257	C	S	.	.	H	α-helix	trans	-61.4	-40.9	177.9	0	0	0	0	0	113.1	V380 E381 L387 R388	V380-G384 PolarHBondContact O-N 3.48Å; E381-G384 PolarHBondContact O-N 2.83Å; G384-L387 PolarHBondContact O-N 3.36Å; G384-R388 WeakPolarHBondContact O-CG 3.45Å; G384-R388 PolarHBondContact O-N 3Å; G384-R388 VanDerWaalsContact O-N 3.1Å; G384-R388 PolarHBondContact O-NH1 3.1Å
385	E	95.8	Very high	95.2	Very high	48 Å²	48	50.3 Å²	50.3	22%	0.224	27%	0.268	C	S	.	.	H	α-helix	trans	-62.2	-47.7	173.6	-173.2	-167.5	-161.3	0	0	111.3	R99 E381 I383 L387 R388 L389	R99-E385 IonicContact CZ-OE1 3.6Å; R99-E385 IonicContact CZ-OE2 3.52Å; R99-E385 IonicContact NH1-OE1 3.85Å; R99-E385 IonicContact NH1-OE2 3.56Å; R99-E385 PolarHBondContact NH1-OE2 3.2Å; R99-E385 IonicContact NH2-OE1 3.51Å; R99-E385 PolarHBondContact NH2-OE1 2.58Å; R99-E385 IonicContact NH2-OE2 3.52Å; R99-E385 PolarHBondContact NH2-OE2 3.41Å; E381-E385 VanDerWaalsContact O-CB 3.31Å; E381-E385 WeakPolarHBondContact O-CB 3.42Å; E381-E385 PolarHBondContact O-N 2.79Å; I383-E385 PolarHBondContact O-N 2.93Å; E385-L387 VanDerWaalsContact C-N 3.3Å; E385-L387 PolarHBondContact O-N 3.34Å; E385-R388 PolarHBondContact O-N 2.79Å; E385-L389 HydrophobicContact CG-CD1 3.9Å; E385-L389 HydrophobicContact CG-CG 4.29Å; E385-L389 WeakPolarHBondContact O-CB 3.44Å; E385-L389 WeakPolarHBondContact O-CG 3.48Å; E385-L389 PolarHBondContact O-N 3.41Å
386	N	96.3	Very high	94.9	Very high	11 Å²	11	55.4 Å²	55.4	6%	0.059	29%	0.292	C	S	.	.	H	α-helix	trans	-61.7	-38.3	179.4	-79.2	-55.7	0	0	0	112.3	W90 H93 T94 T97 T382 I383 L389 F390	W90-N386 HydrophobicContact CH2-CB 3.78Å; W90-N386 HydrophobicContact CZ2-CB 4.05Å; H93-N386 PolarHBondContact NE2-O 3.09Å; T94-N386 HydrophobicContact CG2-CB 4.38Å; T97-N386 WeakPolarHBondContact CB-OD1 3.5Å; T97-N386 PolarHBondContact OG1-OD1 3.03Å; T382-N386 WeakPolarHBondContact CG2-ND2 3.29Å; T382-N386 WeakPolarHBondContact O-CB 3.49Å; T382-N386 PolarHBondContact O-N 3.36Å; T382-N386 PolarHBondContact O-ND2 3.33Å; I383-N386 PolarHBondContact O-N 2.93Å; N386-L389 PolarHBondContact O-N 3.45Å; N386-F390 VanDerWaalsContact O-CB 3.28Å; N386-F390 WeakPolarHBondContact O-CB 3.3Å; N386-F390 PolarHBondContact O-N 2.92Å
387	L	95.4	Very high	94.5	Very high	22 Å²	22	61.4 Å²	61.4	12%	0.115	31%	0.314	C	S	.	.	H	α-helix	trans	-61.3	-49.4	174.6	-78.8	168.5	0	0	0	111.4	Q81 L82 W90 I383 G384 E385 L389 F390 E391	Q81-L387 HydrophobicContact CB-CD1 4.06Å; L82-L387 HydrophobicContact CD2-CD1 4.33Å; L82-L387 HydrophobicContact CD2-CD2 3.76Å; L82-L387 HydrophobicContact CD2-CG 4.08Å; W90-L387 HydrophobicContact CH2-CD2 3.92Å; W90-L387 HydrophobicContact CH2-CG 4.04Å; W90-L387 HydrophobicContact CZ3-CD2 4.19Å; I383-L387 HydrophobicContact CG2-CD1 4.05Å; I383-L387 HydrophobicContact CG2-CG 4.5Å; I383-L387 WeakPolarHBondContact O-CG 3.25Å; I383-L387 PolarHBondContact O-N 3.41Å; G384-L387 PolarHBondContact O-N 3.36Å; E385-L387 VanDerWaalsContact C-N 3.3Å; E385-L387 PolarHBondContact O-N 3.34Å; L387-L389 PolarHBondContact O-N 2.88Å; L387-F390 WeakPolarHBondContact O-CB 3.37Å; L387-F390 PolarHBondContact O-N 3.15Å; L387-F390 VanDerWaalsContact O-N 3.11Å; L387-E391 PolarHBondContact O-N 3.15Å
388	R	95.1	Very high	94.2	Very high	149 Å²	149	65.4 Å²	65.4	56%	0.562	32%	0.322	S	S	*	.	H	α-helix	trans	-60.1	-43.8	176.4	-70	-174.6	-63.2	-91.3	4.6	112.3	G384 E385 F390 E391 G392	G384-R388 WeakPolarHBondContact O-CG 3.45Å; G384-R388 PolarHBondContact O-N 3Å; G384-R388 VanDerWaalsContact O-N 3.1Å; G384-R388 PolarHBondContact O-NH1 3.1Å; E385-R388 PolarHBondContact O-N 2.79Å; R388-F390 PolarHBondContact O-N 3.21Å; R388-E391 PolarHBondContact O-N 3.36Å; R388-G392 PolarHBondContact O-N 3.09Å
389	L	94.1	Very high	93.9	Very high	10 Å²	10	69.5 Å²	69.5	5%	0.052	34%	0.34	C	S	.	.	H	α-helix	trans	-68.7	-23.7	178.4	-68.2	176.6	0	0	0	112.8	T97 E385 N386 L387 G392 M393 L401	T97-L389 HydrophobicContact CG2-CD1 4.11Å; E385-L389 HydrophobicContact CG-CD1 3.9Å; E385-L389 HydrophobicContact CG-CG 4.29Å; E385-L389 WeakPolarHBondContact O-CB 3.44Å; E385-L389 WeakPolarHBondContact O-CG 3.48Å; E385-L389 PolarHBondContact O-N 3.41Å; N386-L389 PolarHBondContact O-N 3.45Å; L387-L389 PolarHBondContact O-N 2.88Å; L389-G392 CarbonylContact O-C 3.59Å; L389-M393 HydrophobicContact CB-CE 4.05Å; L389-M393 HydrophobicContact CD1-CE 4.18Å; L389-M393 HydrophobicContact CD2-CE 4.28Å; L389-M393 HydrophobicContact CD2-CG 4.46Å; L389-M393 HydrophobicContact CG-CE 4.4Å; L389-L401 HydrophobicContact CD1-CD1 4.25Å
390	F	93.1	Very high	93.7	Very high	70 Å²	70	74.4 Å²	74.4	31%	0.307	36%	0.358	S	S	.	.	H	α-helix	trans	-73.6	-34.7	177.1	-169.8	-101.2	0	0	0	112	K85 V89 W90 H93 N386 L387 R388 G392	K85-F390 HydrophobicContact CD-CD1 4.45Å; K85-F390 HydrophobicContact CD-CE1 4.03Å; V89-F390 HydrophobicContact CG1-CE2 3.99Å; V89-F390 HydrophobicContact CG1-CZ 4.02Å; W90-F390 AromaticContact CE3-CD2 3.79Å; W90-F390 HydrophobicContact CE3-CD2 3.79Å; W90-F390 HydrophobicContact CE3-CE2 4.05Å; W90-F390 HydrophobicContact CE3-CG 4.09Å; W90-F390 HydrophobicContact CZ3-CB 3.83Å; W90-F390 HydrophobicContact CZ3-CD1 4.42Å; W90-F390 AromaticContact CZ3-CD2 3.89Å; W90-F390 HydrophobicContact CZ3-CD2 3.89Å; W90-F390 AromaticContact CZ3-CG 3.79Å; W90-F390 HydrophobicContact CZ3-CG 3.79Å; H93-F390 HydrophobicContact CB-CD2 3.82Å; H93-F390 HydrophobicContact CB-CE2 4.07Å; H93-F390 AromaticContact CD2-CD2 3.59Å; H93-F390 PolarHBondContact CE1-N 2.68Å; H93-F390 AromaticContact CG-CD2 3.57Å; H93-F390 PolarHBondContact NE2-N 2.89Å; N386-F390 VanDerWaalsContact O-CB 3.28Å; N386-F390 WeakPolarHBondContact O-CB 3.3Å; N386-F390 PolarHBondContact O-N 2.92Å; L387-F390 WeakPolarHBondContact O-CB 3.37Å; L387-F390 PolarHBondContact O-N 3.15Å; L387-F390 VanDerWaalsContact O-N 3.11Å; R388-F390 PolarHBondContact O-N 3.21Å; F390-G392 VanDerWaalsContact C-N 3.32Å
391	E	90.7	Very high	93.4	Very high	172 Å²	172	73.4 Å²	73.4	80%	0.804	35%	0.351	S	S	*	.	H	α-helix	trans	-65.8	-36.2	174.5	-66.8	173.4	175.7	0	0	111.9	L387 R388	L387-E391 PolarHBondContact O-N 3.15Å; R388-E391 PolarHBondContact O-N 3.36Å
392	G	88.1	Confident	93.3	Very high	50 Å²	50	71.1 Å²	71.1	52%	0.515	34%	0.343	S	S	.	.			trans	-177.3	130.4	174.3	0	0	0	0	0	113.1	R388 L389 F390	R388-G392 PolarHBondContact O-N 3.09Å; L389-G392 CarbonylContact O-C 3.59Å; F390-G392 VanDerWaalsContact C-N 3.32Å
393	M	91.2	Very high	93.1	Very high	35 Å²	35	73.2 Å²	73.2	17%	0.172	35%	0.35	C	S	.	.			trans	-119	119.1	175.6	-178.3	-172.8	-66.4	0	0	110.3	T97 L389 R397 R398 L401	T97-M393 HydrophobicContact CG2-CE 3.65Å; L389-M393 HydrophobicContact CB-CE 4.05Å; L389-M393 HydrophobicContact CD1-CE 4.18Å; L389-M393 HydrophobicContact CD2-CE 4.28Å; L389-M393 HydrophobicContact CD2-CG 4.46Å; L389-M393 HydrophobicContact CG-CE 4.4Å; M393-R397 HydrophobicContact CG-CB 4.28Å; M393-R398 HydrophobicContact CG-CB 4.28Å; M393-R398 HydrophobicContact SD-CB 3.7Å; M393-R398 HydrophobicContact SD-CG 4.02Å; M393-L401 HydrophobicContact CE-CD1 3.86Å; M393-L401 HydrophobicContact SD-CD1 4.25Å
394	S	91.6	Very high	93	Very high	48 Å²	48	73.1 Å²	73.1	34%	0.336	35%	0.35	S	S	.	.			trans	-67	156.8	174.6	91.6	0	0	0	0	111.7	E396 R397 R398	S394-E396 VanDerWaalsContact C-N 3.29Å; S394-E396 VanDerWaalsContact CB-OE2 3.23Å; S394-E396 WeakPolarHBondContact CB-OE2 3.49Å; S394-E396 PolarHBondContact O-N 3.24Å; S394-E396 PolarHBondContact OG-OE2 3.06Å; S394-R397 PolarHBondContact O-N 3.1Å; S394-R397 PolarHBondContact OG-N 3.48Å; S394-R398 PolarHBondContact O-N 2.99Å
395	T	91.3	Very high	93	Very high	79 Å²	79	73.6 Å²	73.6	49%	0.485	35%	0.346	S	S	.	.	H	α-helix	trans	-61.3	-39.7	179.4	-55	0	0	0	0	111.6	R398 Q399	T395-R398 WeakPolarHBondContact O-CB 3.46Å; T395-R398 PolarHBondContact O-N 2.75Å; T395-Q399 WeakPolarHBondContact O-CG 3.35Å; T395-Q399 PolarHBondContact O-N 3.03Å
396	E	91.4	Very high	92.9	Very high	127 Å²	127	74.3 Å²	74.3	59%	0.593	35%	0.352	S	S	*	.	H	α-helix	trans	-65.4	-44.2	-179.9	-54.6	70.3	-149	0	0	110.7	S394 R398 Q399 R400	S394-E396 VanDerWaalsContact C-N 3.29Å; S394-E396 VanDerWaalsContact CB-OE2 3.23Å; S394-E396 WeakPolarHBondContact CB-OE2 3.49Å; S394-E396 PolarHBondContact O-N 3.24Å; S394-E396 PolarHBondContact OG-OE2 3.06Å; E396-R398 VanDerWaalsContact C-N 3.33Å; E396-R398 PolarHBondContact O-N 2.79Å; E396-Q399 PolarHBondContact O-N 3.09Å; E396-R400 PolarHBondContact O-N 3.1Å
397	R	89.7	Confident	92.9	Very high	149 Å²	149	74 Å²	74	56%	0.562	35%	0.351	S	S	*	.	H	α-helix	trans	-62.6	-41.4	175.3	-74.9	-174	177.2	-168.2	-0.3	111.6	M393 S394 Q399 R400 L401	M393-R397 HydrophobicContact CG-CB 4.28Å; S394-R397 PolarHBondContact O-N 3.1Å; S394-R397 PolarHBondContact OG-N 3.48Å; R397-Q399 VanDerWaalsContact C-N 3.35Å; R397-R400 PolarHBondContact O-N 2.74Å; R397-L401 WeakPolarHBondContact O-CB 3.07Å; R397-L401 WeakPolarHBondContact O-CG 3.37Å; R397-L401 PolarHBondContact O-N 2.83Å
398	R	92.3	Very high	93	Very high	146 Å²	146	73 Å²	73	55%	0.551	35%	0.345	S	S	*	.	H	α-helix	trans	-61.3	-44.1	176.1	-172.1	176.2	-65	149.5	3.6	111.6	M393 S394 T395 E396 L401 D402	M393-R398 HydrophobicContact CG-CB 4.28Å; M393-R398 HydrophobicContact SD-CB 3.7Å; M393-R398 HydrophobicContact SD-CG 4.02Å; S394-R398 PolarHBondContact O-N 2.99Å; T395-R398 WeakPolarHBondContact O-CB 3.46Å; T395-R398 PolarHBondContact O-N 2.75Å; E396-R398 VanDerWaalsContact C-N 3.33Å; E396-R398 PolarHBondContact O-N 2.79Å; R398-L401 PolarHBondContact O-N 3.37Å; R398-D402 WeakPolarHBondContact O-CB 3.27Å; R398-D402 PolarHBondContact O-N 3.18Å
399	Q	92.7	Very high	93.1	Very high	128 Å²	128	66.2 Å²	66.2	60%	0.598	32%	0.321	S	S	*	.	H	α-helix	trans	-63.9	-43.6	176.8	-73	171.9	-8.2	0	0	111.8	T395 E396 R397 D402 H403	T395-Q399 WeakPolarHBondContact O-CG 3.35Å; T395-Q399 PolarHBondContact O-N 3.03Å; E396-Q399 PolarHBondContact O-N 3.09Å; R397-Q399 VanDerWaalsContact C-N 3.35Å; Q399-D402 PolarHBondContact O-N 2.97Å; Q399-H403 PolarHBondContact O-N 3.19Å
400	R	91.8	Very high	93.1	Very high	114 Å²	114	67.3 Å²	67.3	43%	0.43	33%	0.325	S	S	.	.	H	α-helix	trans	-59.6	-49	174.4	-177	-177.1	177.3	174.9	8.5	111.6	E26 E396 R397 D402 H403 I404	E26-R400 IonicContact OE2-NH2 3.01Å; E26-R400 PolarHBondContact OE2-NH2 3.41Å; E396-R400 PolarHBondContact O-N 3.1Å; R397-R400 PolarHBondContact O-N 2.74Å; R400-D402 VanDerWaalsContact C-N 3.3Å; R400-D402 PolarHBondContact O-N 3.28Å; R400-H403 WeakPolarHBondContact O-CB 3.25Å; R400-H403 PolarHBondContact O-N 3.42Å; R400-I404 HydrophobicContact CG-CD1 3.94Å; R400-I404 WeakPolarHBondContact O-CG1 3.48Å; R400-I404 PolarHBondContact O-N 3.45Å
401	L	93.3	Very high	93.3	Very high	17 Å²	17	66.5 Å²	66.5	9%	0.089	32%	0.323	C	S	.	.	H	α-helix	trans	-60.5	-40.5	177.8	-74.4	173.2	0	0	0	111.7	L389 M393 R397 R398 H403 I404 R405	L389-L401 HydrophobicContact CD1-CD1 4.25Å; M393-L401 HydrophobicContact CE-CD1 3.86Å; M393-L401 HydrophobicContact SD-CD1 4.25Å; R397-L401 WeakPolarHBondContact O-CB 3.07Å; R397-L401 WeakPolarHBondContact O-CG 3.37Å; R397-L401 PolarHBondContact O-N 2.83Å; R398-L401 PolarHBondContact O-N 3.37Å; L401-H403 VanDerWaalsContact C-N 3.35Å; L401-I404 PolarHBondContact O-N 3.31Å; L401-R405 WeakPolarHBondContact O-CB 3.28Å; L401-R405 WeakPolarHBondContact O-CD 3.38Å; L401-R405 WeakPolarHBondContact O-CG 3.39Å; L401-R405 PolarHBondContact O-N 2.88Å
402	D	93.8	Very high	93.6	Very high	73 Å²	73	58.4 Å²	58.4	39%	0.39	28%	0.284	S	S	.	.	H	α-helix	trans	-67.1	-37.5	179	-157	56	0	0	0	112.4	K102 R398 Q399 R400 R405 D406	K102-D402 WeakPolarHBondContact CE-OD1 3.36Å; K102-D402 PolarHBondContact NZ-O 3.46Å; K102-D402 IonicContact NZ-OD1 3.67Å; K102-D402 PolarHBondContact NZ-OD1 3.17Å; K102-D402 IonicContact NZ-OD2 3.02Å; K102-D402 PolarHBondContact NZ-OD2 2.88Å; R398-D402 WeakPolarHBondContact O-CB 3.27Å; R398-D402 PolarHBondContact O-N 3.18Å; Q399-D402 PolarHBondContact O-N 2.97Å; R400-D402 VanDerWaalsContact C-N 3.3Å; R400-D402 PolarHBondContact O-N 3.28Å; D402-R405 PolarHBondContact O-N 2.91Å; D402-D406 PolarHBondContact O-N 2.65Å; D402-D406 VanDerWaalsContact O-N 3.13Å
403	H	93.4	Very high	94	Very high	68 Å²	68	57 Å²	57	32%	0.315	27%	0.265	S	S	.	.	H	α-helix	trans	-62.4	-48.8	171.5	179.8	62.7	0	0	0	112	Q399 R400 L401 R405 D406 C407	Q399-H403 PolarHBondContact O-N 3.19Å; R400-H403 WeakPolarHBondContact O-CB 3.25Å; R400-H403 PolarHBondContact O-N 3.42Å; L401-H403 VanDerWaalsContact C-N 3.35Å; H403-R405 VanDerWaalsContact C-N 3.27Å; H403-R405 PolarHBondContact O-N 3.49Å; H403-D406 PolarHBondContact O-N 2.93Å; H403-D406 VanDerWaalsContact O-N 3.08Å; H403-C407 PolarHBondContact O-N 3.39Å
404	I	95.1	Very high	94.2	Very high	2 Å²	2	61.9 Å²	61.9	1%	0.01	29%	0.288	C	S	.	.	H	α-helix	trans	-56.7	-44.3	175.5	-68.2	161.1	0	0	0	110.2	T27 E30 R99 R400 L401 D406 C407 V408	T27-I404 HydrophobicContact CG2-CG1 4.02Å; E30-I404 WeakPolarHBondContact OE2-CD1 3.29Å; R99-I404 HydrophobicContact CB-CG2 4.32Å; R99-I404 HydrophobicContact CG-CG2 3.85Å; R400-I404 HydrophobicContact CG-CD1 3.94Å; R400-I404 WeakPolarHBondContact O-CG1 3.48Å; R400-I404 PolarHBondContact O-N 3.45Å; L401-I404 PolarHBondContact O-N 3.31Å; I404-D406 VanDerWaalsContact C-N 3.26Å; I404-D406 PolarHBondContact O-N 2.79Å; I404-C407 PolarHBondContact O-N 2.84Å; I404-V408 HydrophobicContact CG2-CG2 4.13Å; I404-V408 VanDerWaalsContact O-CG2 3.29Å; I404-V408 WeakPolarHBondContact O-CG2 3.18Å; I404-V408 PolarHBondContact O-N 2.92Å
405	R	96	Very high	94.4	Very high	27 Å²	27	63.4 Å²	63.4	10%	0.102	29%	0.286	C	S	.	.	H	α-helix	trans	-60.4	-35	178.4	-71.9	162.9	60	96.6	-2.1	112.7	N95 S96 N98 R99 K102 L401 D402 H403 V409	N95-R405 PolarHBondContact O-NH1 3.18Å; S96-R405 PolarHBondContact O-NH1 3.15Å; S96-R405 VanDerWaalsContact O-NH1 3.14Å; N98-R405 PolarHBondContact O-NH1 3.27Å; R99-R405 WeakPolarHBondContact O-CA 3.27Å; R99-R405 WeakPolarHBondContact O-CG 3.34Å; K102-R405 HydrophobicContact CD-CB 3.83Å; K102-R405 HydrophobicContact CG-CB 4.13Å; L401-R405 WeakPolarHBondContact O-CB 3.28Å; L401-R405 WeakPolarHBondContact O-CD 3.38Å; L401-R405 WeakPolarHBondContact O-CG 3.39Å; L401-R405 PolarHBondContact O-N 2.88Å; D402-R405 PolarHBondContact O-N 2.91Å; H403-R405 VanDerWaalsContact C-N 3.27Å; H403-R405 PolarHBondContact O-N 3.49Å; R405-V409 WeakPolarHBondContact O-CG2 3.28Å; R405-V409 PolarHBondContact O-N 3.02Å
406	D	95	Very high	94.6	Very high	63 Å²	63	60.1 Å²	60.1	34%	0.337	27%	0.265	S	S	.	.	H	α-helix	trans	-71.7	-44.9	174.3	-70.4	-31.5	0	0	0	111.2	K102 D402 H403 I404 V408 V409 H410	K102-D406 WeakPolarHBondContact CD-OD1 3.36Å; K102-D406 WeakPolarHBondContact CE-OD1 3.29Å; K102-D406 IonicContact NZ-OD1 2.89Å; K102-D406 PolarHBondContact NZ-OD1 3.38Å; K102-D406 IonicContact NZ-OD2 2.97Å; K102-D406 PolarHBondContact NZ-OD2 3.33Å; D402-D406 PolarHBondContact O-N 2.65Å; D402-D406 VanDerWaalsContact O-N 3.13Å; H403-D406 PolarHBondContact O-N 2.93Å; H403-D406 VanDerWaalsContact O-N 3.08Å; I404-D406 VanDerWaalsContact C-N 3.26Å; I404-D406 PolarHBondContact O-N 2.79Å; D406-V408 VanDerWaalsContact C-N 3.31Å; D406-V408 PolarHBondContact O-N 2.63Å; D406-V409 WeakPolarHBondContact O-CB 3.44Å; D406-V409 PolarHBondContact O-N 2.82Å; D406-V409 VanDerWaalsContact O-N 3.1Å; D406-H410 PolarHBondContact O-CD2 3.49Å; D406-H410 PolarHBondContact O-N 2.67Å; D406-H410 VanDerWaalsContact O-N 3.15Å
407	C	95.7	Very high	94.7	Very high	5 Å²	5	61.2 Å²	61.2	3%	0.034	27%	0.27	C	S	.	.	H	α-helix	trans	-59.5	-40.3	175.1	-66.5	0	0	0	0	112.3	I31 H403 I404 V409 H410 E411	I31-C407 HydrophobicContact CD1-CB 3.39Å; H403-C407 PolarHBondContact O-N 3.39Å; I404-C407 PolarHBondContact O-N 2.84Å; C407-V409 VanDerWaalsContact C-N 3.31Å; C407-V409 PolarHBondContact O-N 3.01Å; C407-H410 PolarHBondContact O-N 2.88Å; C407-H410 VanDerWaalsContact O-N 3.15Å; C407-E411 PolarHBondContact O-N 3.31Å
408	V	97.3	Very high	95	Very high	0 Å²	0	55 Å²	55	0%	0	25%	0.249	C	C	.	.	H	α-helix	trans	-62.6	-36	175.3	170.6	0	0	0	0	111.9	I31 L34 F35 R99 A100 V103 I404 D406 Y412	I31-V408 HydrophobicContact CG1-CG2 3.9Å; L34-V408 HydrophobicContact CD2-CG1 3.88Å; L34-V408 HydrophobicContact CD2-CG2 3.72Å; F35-V408 HydrophobicContact CE2-CG1 4.18Å; F35-V408 HydrophobicContact CZ-CG1 4.1Å; R99-V408 HydrophobicContact CB-CG2 4.35Å; A100-V408 HydrophobicContact CB-CG1 4.22Å; V103-V408 HydrophobicContact CG2-CG1 3.94Å; I404-V408 HydrophobicContact CG2-CG2 4.13Å; I404-V408 VanDerWaalsContact O-CG2 3.29Å; I404-V408 WeakPolarHBondContact O-CG2 3.18Å; I404-V408 PolarHBondContact O-N 2.92Å; D406-V408 VanDerWaalsContact C-N 3.31Å; D406-V408 PolarHBondContact O-N 2.63Å; V408-Y412 VanDerWaalsContact O-CB 3.27Å; V408-Y412 WeakPolarHBondContact O-CB 3.4Å; V408-Y412 PolarHBondContact O-N 2.82Å
409	V	97	Very high	95.1	Very high	8 Å²	8	50.4 Å²	50.4	5%	0.048	24%	0.239	C	C	.	.	H	α-helix	trans	-61.5	-46.4	173.2	166.4	0	0	0	0	110.6	K102 V103 A106 R405 D406 C407 Y412 L413	K102-V409 HydrophobicContact CB-CG2 3.49Å; K102-V409 VanDerWaalsContact CB-CG2 3.49Å; V103-V409 HydrophobicContact CG2-CG2 4.23Å; A106-V409 HydrophobicContact CB-CB 4.38Å; A106-V409 HydrophobicContact CB-CG1 3.33Å; A106-V409 HydrophobicContact CB-CG2 4.11Å; R405-V409 WeakPolarHBondContact O-CG2 3.28Å; R405-V409 PolarHBondContact O-N 3.02Å; D406-V409 WeakPolarHBondContact O-CB 3.44Å; D406-V409 PolarHBondContact O-N 2.82Å; D406-V409 VanDerWaalsContact O-N 3.1Å; C407-V409 VanDerWaalsContact C-N 3.31Å; C407-V409 PolarHBondContact O-N 3.01Å; V409-Y412 PolarHBondContact O-N 2.99Å; V409-L413 HydrophobicContact CG1-CD1 3.95Å; V409-L413 HydrophobicContact CG1-CG 4.48Å; V409-L413 VanDerWaalsContact O-CG 3.3Å; V409-L413 WeakPolarHBondContact O-CG 3.47Å; V409-L413 PolarHBondContact O-N 3.37Å
410	H	94.8	Very high	95.2	Very high	32 Å²	32	49.8 Å²	49.8	15%	0.148	23%	0.234	C	C	.	.	H	α-helix	trans	-63.8	-48.5	179.3	-69.6	-64.9	0	0	0	111.9	L16 L20 D406 C407 Y412 L413 Q414	L16-H410 PolarHBondContact O-CE1 3.24Å; L20-H410 HydrophobicContact CD1-CB 4.14Å; L20-H410 VanDerWaalsContact CD1-CD2 3.44Å; L20-H410 WeakPolarHBondContact CD1-CD2 3.16Å; D406-H410 PolarHBondContact O-CD2 3.49Å; D406-H410 PolarHBondContact O-N 2.67Å; D406-H410 VanDerWaalsContact O-N 3.15Å; C407-H410 PolarHBondContact O-N 2.88Å; C407-H410 VanDerWaalsContact O-N 3.15Å; H410-Y412 VanDerWaalsContact C-N 3.33Å; H410-Y412 PolarHBondContact O-N 3.22Å; H410-L413 PolarHBondContact O-N 2.62Å; H410-Q414 VanDerWaalsContact O-CB 3.25Å; H410-Q414 WeakPolarHBondContact O-CB 3.37Å; H410-Q414 PolarHBondContact O-N 2.91Å
411	E	96.3	Very high	95.4	Very high	54 Å²	54	44.5 Å²	44.5	25%	0.252	22%	0.215	S	C	.	.	H	α-helix	trans	-56.6	-47.8	176.2	-178	61.3	-157.5	0	0	110.8	I31 F35 C407 L413 Q414 R415	I31-E411 HydrophobicContact CG2-CB 3.86Å; I31-E411 HydrophobicContact CG2-CG 3.69Å; F35-E411 HydrophobicContact CD2-CG 3.86Å; F35-E411 HydrophobicContact CE2-CB 4.02Å; F35-E411 HydrophobicContact CE2-CG 3.6Å; F35-E411 HydrophobicContact CZ-CG 4.42Å; C407-E411 PolarHBondContact O-N 3.31Å; E411-L413 PolarHBondContact O-N 2.97Å; E411-Q414 PolarHBondContact O-N 3.45Å; E411-R415 WeakPolarHBondContact O-CB 3.28Å; E411-R415 PolarHBondContact O-N 3.4Å
412	Y	97.8	Very high	95.4	Very high	1 Å²	1	46 Å²	46	0%	0.004	23%	0.225	C	C	.	.	H	α-helix	trans	-58.3	-51.2	179	-173.3	-81.5	0	0	0	112.3	F35 V103 V107 C121 E125 T312 V408 V409 H410 Q414 F416 V418	F35-Y412 AromaticContact CE1-CD2 3.82Å; F35-Y412 HydrophobicContact CE1-CD2 3.82Å; F35-Y412 HydrophobicContact CZ-CD2 4.07Å; V103-Y412 HydrophobicContact CG1-CD1 3.63Å; V103-Y412 HydrophobicContact CG1-CD2 3.7Å; V103-Y412 HydrophobicContact CG1-CE1 3.91Å; V103-Y412 HydrophobicContact CG1-CE2 3.98Å; V103-Y412 HydrophobicContact CG1-CG 3.54Å; V103-Y412 HydrophobicContact CG2-CG 4.41Å; V107-Y412 HydrophobicContact CG2-CD1 3.98Å; V107-Y412 HydrophobicContact CG2-CE1 3.68Å; C121-Y412 VanDerWaalsContact CA-OH 3.28Å; C121-Y412 WeakPolarHBondContact CA-OH 3.41Å; C121-Y412 HydrophobicContact CB-CE2 4.48Å; C121-Y412 WeakPolarHBondContact CB-OH 3.4Å; C121-Y412 PolarHBondContact O-OH 3.07Å; E125-Y412 HydrophobicContact CB-CE2 4.2Å; T312-Y412 HydrophobicContact CG2-CD2 3.81Å; T312-Y412 HydrophobicContact CG2-CE2 3.46Å; T312-Y412 VanDerWaalsContact CG2-CE2 3.46Å; V408-Y412 VanDerWaalsContact O-CB 3.27Å; V408-Y412 WeakPolarHBondContact O-CB 3.4Å; V408-Y412 PolarHBondContact O-N 2.82Å; V409-Y412 PolarHBondContact O-N 2.99Å; H410-Y412 VanDerWaalsContact C-N 3.33Å; H410-Y412 PolarHBondContact O-N 3.22Å; Y412-Q414 VanDerWaalsContact C-N 3.32Å; Y412-Q414 PolarHBondContact O-N 3.49Å; Y412-F416 HydrophobicContact CD1-CD2 4.22Å; Y412-F416 AromaticContact CD2-CD2 3.79Å; Y412-F416 HydrophobicContact CD2-CD2 3.79Å; Y412-F416 AromaticContact CD2-CE2 3.74Å; Y412-F416 HydrophobicContact CD2-CE2 3.74Å; Y412-F416 HydrophobicContact CE1-CD2 4.24Å; Y412-F416 AromaticContact CE2-CD2 3.8Å; Y412-F416 HydrophobicContact CE2-CD2 3.8Å; Y412-F416 AromaticContact CE2-CE2 3.86Å; Y412-F416 HydrophobicContact CE2-CE2 3.86Å; Y412-F416 AromaticContact CG-CD2 3.98Å; Y412-F416 HydrophobicContact CG-CD2 3.98Å; Y412-F416 HydrophobicContact CG-CE2 4.3Å; Y412-F416 VanDerWaalsContact O-CD2 3.26Å; Y412-F416 WeakPolarHBondContact O-CD2 3.42Å; Y412-F416 PolarHBondContact O-N 3.37Å; Y412-V418 HydrophobicContact CD1-CG2 4.09Å; Y412-V418 HydrophobicContact CE1-CG2 3.79Å
413	L	96.4	Very high	95.2	Very high	22 Å²	22	48.6 Å²	48.6	12%	0.115	23%	0.23	C	C	.	.	H	α-helix	trans	-65.4	-37.7	-177.1	-67.4	175.5	0	0	0	111.6	V107 V409 H410 E411 Q417 V418	V107-L413 HydrophobicContact CG2-CD2 3.97Å; V409-L413 HydrophobicContact CG1-CD1 3.95Å; V409-L413 HydrophobicContact CG1-CG 4.48Å; V409-L413 VanDerWaalsContact O-CG 3.3Å; V409-L413 WeakPolarHBondContact O-CG 3.47Å; V409-L413 PolarHBondContact O-N 3.37Å; H410-L413 PolarHBondContact O-N 2.62Å; E411-L413 PolarHBondContact O-N 2.97Å; L413-Q417 WeakPolarHBondContact O-CA 3.41Å; L413-Q417 PolarHBondContact O-N 3.29Å; L413-Q417 VanDerWaalsContact O-N 3.13Å; L413-V418 HydrophobicContact CD2-CB 3.73Å; L413-V418 HydrophobicContact CD2-CG1 4.01Å; L413-V418 HydrophobicContact CD2-CG2 4.13Å; L413-V418 PolarHBondContact O-N 2.93Å
414	Q	95.6	Very high	95.2	Very high	137 Å²	137	50.7 Å²	50.7	64%	0.64	25%	0.252	S	S	*	.	H	α-helix	trans	-75.5	-53.7	-179.7	-178.3	176.8	-10.8	0	0	111.9	H410 E411 Y412 F416 Q417	H410-Q414 VanDerWaalsContact O-CB 3.25Å; H410-Q414 WeakPolarHBondContact O-CB 3.37Å; H410-Q414 PolarHBondContact O-N 2.91Å; E411-Q414 PolarHBondContact O-N 3.45Å; Y412-Q414 VanDerWaalsContact C-N 3.32Å; Y412-Q414 PolarHBondContact O-N 3.49Å; Q414-F416 VanDerWaalsContact C-N 3.28Å; Q414-F416 PolarHBondContact O-N 3.03Å; Q414-Q417 PolarHBondContact O-N 3.47Å; Q414-Q417 VanDerWaalsContact O-N 3.13Å
415	R	95.1	Very high	95	Very high	79 Å²	79	55.3 Å²	55.3	30%	0.298	27%	0.269	S	S	.	.	H	α-helix	trans	-57.1	-41.3	-177.4	-176.4	173	176.5	155.7	-7.1	111.9	N36 E411	N36-R415 PolarHBondContact OD1-NH2 2.91Å; E411-R415 WeakPolarHBondContact O-CB 3.28Å; E411-R415 PolarHBondContact O-N 3.4Å
416	F	95.4	Very high	94.9	Very high	10 Å²	10	56.5 Å²	56.5	4%	0.044	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	7.2	-179.2	-51.5	-55.7	0	0	0	113.9	F35 Y124 E125 Y412 Q414 V418	F35-F416 HydrophobicContact CD1-CE2 4Å; F35-F416 HydrophobicContact CD1-CZ 4.03Å; F35-F416 AromaticContact CE1-CE2 3.72Å; F35-F416 HydrophobicContact CE1-CE2 3.72Å; F35-F416 HydrophobicContact CE1-CZ 4.23Å; Y124-F416 HydrophobicContact CD1-CB 4.03Å; Y124-F416 HydrophobicContact CE1-CB 3.89Å; Y124-F416 WeakPolarHBondContact CE1-O 3.32Å; E125-F416 HydrophobicContact CB-CE2 4.18Å; E125-F416 HydrophobicContact CB-CZ 4.25Å; E125-F416 HydrophobicContact CG-CE1 4.37Å; E125-F416 HydrophobicContact CG-CE2 3.84Å; E125-F416 HydrophobicContact CG-CZ 3.6Å; Y412-F416 HydrophobicContact CD1-CD2 4.22Å; Y412-F416 AromaticContact CD2-CD2 3.79Å; Y412-F416 HydrophobicContact CD2-CD2 3.79Å; Y412-F416 AromaticContact CD2-CE2 3.74Å; Y412-F416 HydrophobicContact CD2-CE2 3.74Å; Y412-F416 HydrophobicContact CE1-CD2 4.24Å; Y412-F416 AromaticContact CE2-CD2 3.8Å; Y412-F416 HydrophobicContact CE2-CD2 3.8Å; Y412-F416 AromaticContact CE2-CE2 3.86Å; Y412-F416 HydrophobicContact CE2-CE2 3.86Å; Y412-F416 AromaticContact CG-CD2 3.98Å; Y412-F416 HydrophobicContact CG-CD2 3.98Å; Y412-F416 HydrophobicContact CG-CE2 4.3Å; Y412-F416 VanDerWaalsContact O-CD2 3.26Å; Y412-F416 WeakPolarHBondContact O-CD2 3.42Å; Y412-F416 PolarHBondContact O-N 3.37Å; Q414-F416 VanDerWaalsContact C-N 3.28Å; Q414-F416 PolarHBondContact O-N 3.03Å; F416-V418 HydrophobicContact CB-CG2 4.19Å; F416-V418 PolarHBondContact O-N 3.45Å; F416-V418 VanDerWaalsContact O-N 3.17Å
417	Q	94.6	Very high	94.8	Very high	151 Å²	151	54.9 Å²	54.9	71%	0.706	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	49	44.7	176.3	-55.5	-177.8	14.8	0	0	113.3	L413 Q414 S419	L413-Q417 WeakPolarHBondContact O-CA 3.41Å; L413-Q417 PolarHBondContact O-N 3.29Å; L413-Q417 VanDerWaalsContact O-N 3.13Å; Q414-Q417 PolarHBondContact O-N 3.47Å; Q414-Q417 VanDerWaalsContact O-N 3.13Å; Q417-S419 PolarHBondContact O-N 3.48Å; Q417-S419 VanDerWaalsContact O-N 3.12Å
418	V	94.8	Very high	94.4	Very high	18 Å²	18	55.2 Å²	55.2	11%	0.109	27%	0.268	C	S	.	.			trans	-67.8	114.6	-176.3	-176.9	0	0	0	0	109.2	V107 A111 Y124 Y412 L413 F416	V107-V418 HydrophobicContact CG1-CG1 4.33Å; A111-V418 HydrophobicContact CB-CG1 3.56Å; Y124-V418 HydrophobicContact CD1-CG2 4.07Å; Y124-V418 HydrophobicContact CE1-CG2 3.64Å; Y412-V418 HydrophobicContact CD1-CG2 4.09Å; Y412-V418 HydrophobicContact CE1-CG2 3.79Å; L413-V418 HydrophobicContact CD2-CB 3.73Å; L413-V418 HydrophobicContact CD2-CG1 4.01Å; L413-V418 HydrophobicContact CD2-CG2 4.13Å; L413-V418 PolarHBondContact O-N 2.93Å; F416-V418 HydrophobicContact CB-CG2 4.19Å; F416-V418 PolarHBondContact O-N 3.45Å; F416-V418 VanDerWaalsContact O-N 3.17Å
419	S	94.3	Very high	93.2	Very high	49 Å²	49	66 Å²	66	34%	0.343	31%	0.308	S	S	.	.			trans	-120.5	165.9	-176.5	61.7	0	0	0	0	112.7	H161 T165 Q417	H161-S419 PolarHBondContact CE1-O 3.28Å; H161-S419 VanDerWaalsContact CE1-O 3.29Å; H161-S419 PolarHBondContact NE2-O 2.76Å; T165-S419 VanDerWaalsContact CB-OG 3.25Å; T165-S419 WeakPolarHBondContact CB-OG 3.32Å; T165-S419 WeakPolarHBondContact CG2-OG 3.34Å; Q417-S419 PolarHBondContact O-N 3.48Å; Q417-S419 VanDerWaalsContact O-N 3.12Å
420	F	96.4	Very high	91.7	Very high	116 Å²	116	70.9 Å²	70.9	51%	0.509	33%	0.334	S	S	.	.			trans	-69.9	129.2	-176.7	177.2	-90.7	0	0	0	112.2	A111 N112 P422	A111-F420 WeakPolarHBondContact O-CA 3.5Å; N112-F420 HydrophobicContact CB-CD2 3.72Å; N112-F420 HydrophobicContact CB-CE2 3.42Å; N112-F420 VanDerWaalsContact CB-CE2 3.42Å; N112-F420 HydrophobicContact CB-CZ 4.24Å; F420-P422 HydrophobicContact CE1-CB 4.04Å
421	L	94.5	Very high	89.9	Confident	3 Å²	3	74.9 Å²	74.9	2%	0.016	36%	0.361	C	S	.	.			trans	-108.3	119.6	171.1	-173.4	72.9	0	0	0	110.4	A111 N112 H161 K164 T165 R425	A111-L421 PolarHBondContact O-N 3Å; N112-L421 PolarHBondContact ND2-O 3.35Å; H161-L421 HydrophobicContact CB-CD2 4.41Å; H161-L421 VanDerWaalsContact CE1-CB 3.41Å; H161-L421 WeakPolarHBondContact CE1-CB 3.42Å; K164-L421 HydrophobicContact CB-CD1 3.59Å; K164-L421 HydrophobicContact CG-CD1 4.38Å; T165-L421 HydrophobicContact CG2-CB 4.35Å; T165-L421 HydrophobicContact CG2-CD1 4.12Å; L421-R425 HydrophobicContact CD1-CB 3.8Å; L421-R425 HydrophobicContact CG-CB 4.22Å
422	P	93.6	Very high	87.9	Confident	48 Å²	48	74.1 Å²	74.1	31%	0.312	36%	0.36	S	S	.	.			trans	-66.1	145.2	176	27.5	-34.1	0	0	0	111	F420 S424 R425	F420-P422 HydrophobicContact CE1-CB 4.04Å; P422-S424 PolarHBondContact O-N 2.91Å; P422-S424 VanDerWaalsContact O-N 3.07Å; P422-R425 HydrophobicContact CG-CB 4.48Å; P422-R425 HydrophobicContact CG-CG 4.07Å; P422-R425 PolarHBondContact O-N 3.42Å
423	R	90.6	Very high	86	Confident	127 Å²	127	78.6 Å²	78.6	48%	0.479	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-56.5	-26.9	-179.6	-173.2	171	-177.9	-178.7	0.4	114	R425 W426 T431	R423-R425 PolarHBondContact O-N 3.39Å; R423-W426 HydrophobicContact CB-CD2 4.31Å; R423-W426 HydrophobicContact CG-CD2 3.89Å; R423-W426 HydrophobicContact CG-CE3 3.77Å; R423-W426 HydrophobicContact CG-CG 4.35Å; R423-W426 HydrophobicContact CG-CZ3 4.15Å; R423-W426 WeakPolarHBondContact O-CB 3.47Å; R423-W426 PolarHBondContact O-N 3.39Å; R423-W426 VanDerWaalsContact O-N 3.14Å; R423-T431 PolarHBondContact NH2-OG1 2.66Å
424	S	92.1	Very high	84.1	Confident	113 Å²	113	78.6 Å²	78.6	79%	0.79	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-65.2	-13.1	174.5	55.2	0	0	0	0	114.2	P422	P422-S424 PolarHBondContact O-N 2.91Å; P422-S424 VanDerWaalsContact O-N 3.07Å
425	R	92.5	Very high	82	Confident	99 Å²	99	72.4 Å²	72.4	37%	0.374	37%	0.365	S	S	.	.	G	3₁₀ helix	trans	-110.5	7.2	176	-59	-171.3	90.5	-167.2	7	113	N160 K164 L421 P422 R423	N160-R425 PolarHBondContact ND2-O 3.45Å; K164-R425 PolarHBondContact O-NH1 2.84Å; L421-R425 HydrophobicContact CD1-CB 3.8Å; L421-R425 HydrophobicContact CG-CB 4.22Å; P422-R425 HydrophobicContact CG-CB 4.48Å; P422-R425 HydrophobicContact CG-CG 4.07Å; P422-R425 PolarHBondContact O-N 3.42Å; R423-R425 PolarHBondContact O-N 3.39Å
426	W	93.6	Very high	79.7	Confident	52 Å²	52	70.8 Å²	70.8	20%	0.197	37%	0.365	C	S	.	.	S	Bend	trans	-67.5	158.1	167.4	-71.9	6.1	0	0	0	110.4	N112 E114 R423	N112-W426 VanDerWaalsContact ND2-CZ2 3.34Å; N112-W426 WeakPolarHBondContact ND2-CZ2 3.38Å; N112-W426 VanDerWaalsContact O-CZ2 3.24Å; N112-W426 WeakPolarHBondContact O-CZ2 3.44Å; N112-W426 PolarHBondContact O-NE1 2.88Å; N112-W426 WeakPolarHBondContact OD1-CZ2 3.36Å; E114-W426 HydrophobicContact CB-CD2 3.91Å; E114-W426 HydrophobicContact CB-CE3 4.32Å; E114-W426 HydrophobicContact CB-CG 4.06Å; E114-W426 HydrophobicContact CG-CD2 4.17Å; E114-W426 HydrophobicContact CG-CE3 4.15Å; E114-W426 HydrophobicContact CG-CG 4.39Å; E114-W426 WeakPolarHBondContact OE2-CA 3.36Å; E114-W426 WeakPolarHBondContact OE2-CB 3.16Å; R423-W426 HydrophobicContact CB-CD2 4.31Å; R423-W426 HydrophobicContact CG-CD2 3.89Å; R423-W426 HydrophobicContact CG-CE3 3.77Å; R423-W426 HydrophobicContact CG-CG 4.35Å; R423-W426 HydrophobicContact CG-CZ3 4.15Å; R423-W426 WeakPolarHBondContact O-CB 3.47Å; R423-W426 PolarHBondContact O-N 3.39Å; R423-W426 VanDerWaalsContact O-N 3.14Å
427	I	92.8	Very high	77.5	Confident	28 Å²	28	72.9 Å²	72.9	14%	0.144	38%	0.38	C	S	.	.	S	Bend	trans	-73.6	-48	175.2	-51	-179	0	0	0	109.1	E114 I156 T157 N160 W174 W176 L199 T203 R429	E114-I427 PolarHBondContact OE2-N 2.85Å; I156-I427 HydrophobicContact CG2-CD1 3.53Å; T157-I427 HydrophobicContact CG2-CD1 4.19Å; N160-I427 HydrophobicContact CB-CD1 3.78Å; N160-I427 HydrophobicContact CB-CG1 3.86Å; W174-I427 HydrophobicContact CH2-CD1 4.03Å; W174-I427 HydrophobicContact CZ3-CD1 4Å; W176-I427 HydrophobicContact CZ2-CG2 4.16Å; L199-I427 HydrophobicContact CD1-CB 3.96Å; L199-I427 HydrophobicContact CD1-CD1 4.47Å; L199-I427 HydrophobicContact CD1-CG2 3.98Å; T203-I427 HydrophobicContact CG2-CG2 3.57Å; I427-R429 PolarHBondContact O-N 2.88Å
428	S	86.1	Confident	74.8	Confident	13 Å²	13	66.9 Å²	66.9	9%	0.091	36%	0.355	C	S	.	.			trans	-74.3	109.4	179	-49.9	0	0	0	0	110.6	E114 L199	E114-S428 WeakPolarHBondContact OE1-CA 3.47Å; E114-S428 WeakPolarHBondContact OE1-CB 3.44Å; E114-S428 PolarHBondContact OE1-N 3.36Å; E114-S428 PolarHBondContact OE1-OG 3.43Å; L199-S428 WeakPolarHBondContact CD1-OG 3.21Å
429	R	72.3	Confident	71.7	Confident	226 Å²	226	72.6 Å²	72.6	85%	0.853	38%	0.382	S	S	*	.			trans	-81.2	-27.9	-179.4	-64.2	-175	179.9	-176.1	1.5	113.1	I427	I427-R429 PolarHBondContact O-N 2.88Å
430	N	66.6	Low	68.5	Low	111 Å²	111	74 Å²	74	59%	0.594	39%	0.392	S	S	*	.	S	Bend	trans	-106.8	148	-178.3	-60.4	-40.4	0	0	0	111.2	N202 V432	N202-N430 WeakPolarHBondContact OD1-CB 3.23Å; N202-N430 PolarHBondContact OD1-N 3.02Å; N202-N430 PolarHBondContact OD1-O 3.09Å; N430-V432 HydrophobicContact CB-CG2 4.17Å; N430-V432 PolarHBondContact O-N 3.48Å; N430-V432 VanDerWaalsContact O-N 3.16Å
431	T	57.4	Low	65.2	Low	115 Å²	115	74.1 Å²	74.1	71%	0.706	41%	0.414	S	S	*	.			trans	-76.5	101.4	166.5	-45.4	0	0	0	0	107	R423	R423-T431 PolarHBondContact NH2-OG1 2.66Å
432	V	54.1	Low	62.1	Low	39 Å²	39	77.5 Å²	77.5	24%	0.236	45%	0.45	C	S	.	.	P	Polyproline II helix	trans	-102.6	122.3	173.8	-179.1	0	0	0	0	107.5	A201 N202 N430	A201-V432 HydrophobicContact CB-CG1 3.98Å; N202-V432 WeakPolarHBondContact ND2-CB 3.4Å; N202-V432 WeakPolarHBondContact ND2-CG2 3.49Å; N430-V432 HydrophobicContact CB-CG2 4.17Å; N430-V432 PolarHBondContact O-N 3.48Å; N430-V432 VanDerWaalsContact O-N 3.16Å
433	S	56.4	Low	59	Low	94 Å²	94	84.1 Å²	84.1	66%	0.657	47%	0.469	S	S	*	.	P	Polyproline II helix	trans	-66.7	134.6	164.1	-63.6	0	0	0	0	107.4	A435	S433-A435 PolarHBondContact O-N 3.36Å
434	P	58.3	Low	56.1	Low	22 Å²	22	83.3 Å²	83.3	14%	0.143	48%	0.48	C	S	.	.	P	Polyproline II helix	trans	-54.7	136.8	178.5	-9.9	16.5	0	0	0	110	D197 R198 C436 C437 L445	D197-P434 WeakPolarHBondContact OD1-CA 3.41Å; D197-P434 WeakPolarHBondContact OD1-CB 3.16Å; R198-P434 HydrophobicContact CG-CB 4.06Å; R198-P434 HydrophobicContact CG-CG 3.72Å; P434-C436 PolarHBondContact O-N 3.19Å; P434-C437 HydrophobicContact CB-CB 3.8Å; P434-C437 HydrophobicContact CG-CB 3.79Å; P434-C437 PolarHBondContact O-N 3.26Å; P434-L445 HydrophobicContact CG-CD2 4.37Å
435	A	50.6	Low	53.3	Low	7 Å²	7	81.5 Å²	81.5	6%	0.058	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-35.2	-173.2	0	0	0	0	0	112.1	Y184 D197 S433 C437 P519 L735	Y184-A435 HydrophobicContact CE1-CB 4.2Å; D197-A435 PolarHBondContact OD1-N 3.34Å; D197-A435 WeakPolarHBondContact OD2-CB 3.31Å; S433-A435 PolarHBondContact O-N 3.36Å; A435-C437 VanDerWaalsContact C-N 3.28Å; A435-C437 PolarHBondContact O-N 2.9Å; A435-P519 HydrophobicContact CB-CB 3.79Å; A435-P519 VanDerWaalsContact O-O 3.06Å; A435-L735 HydrophobicContact CB-CD1 4.35Å; A435-L735 HydrophobicContact CB-CD2 3.36Å; A435-L735 HydrophobicContact CB-CG 4.46Å
436	C	47.5	Very low	50.7	Low	45 Å²	45	80 Å²	80	30%	0.304	48%	0.476	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	12.4	177.1	63.7	0	0	0	0	114.5	A195 P434	A195-C436 PolarHBondContact O-SG 2.6Å; P434-C436 PolarHBondContact O-N 3.19Å
437	C	48.2	Very low	47.9	Very low	55 Å²	55	84.4 Å²	84.4	37%	0.372	50%	0.499	S	S	.	.			trans	-137.6	54.7	-168.6	-68.3	0	0	0	0	113.6	P434 A435 M439	P434-C437 HydrophobicContact CB-CB 3.8Å; P434-C437 HydrophobicContact CG-CB 3.79Å; P434-C437 PolarHBondContact O-N 3.26Å; A435-C437 VanDerWaalsContact C-N 3.28Å; A435-C437 PolarHBondContact O-N 2.9Å; C437-M439 PolarHBondContact O-N 2.67Å
438	S	37.2	Very low	45.9	Very low	24 Å²	24	88.7 Å²	88.7	17%	0.168	52%	0.517	C	S	.	.			trans	-88.7	80.6	159.7	56.6	0	0	0	0	109.9
439	M	31.3	Very low	44.2	Very low	138 Å²	138	95 Å²	95	68%	0.68	54%	0.542	S	S	*	.	S	Bend	trans	156.1	130	144.9	-82.9	-74.6	101.1	0	0	113.2	C437	C437-M439 PolarHBondContact O-N 2.67Å
440	S	27.4	Very low	43.5	Very low	78 Å²	78	85.6 Å²	85.6	55%	0.545	51%	0.508	S	S	.	.			trans	78.3	88	175.8	-42.9	0	0	0	0	117.3	G442	S440-G442 PolarHBondContact O-N 3.4Å
441	A	27	Very low	43.3	Very low	119 Å²	119	84.1 Å²	84.1	98%	0.983	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.2	99.7	155	0	0	0	0	0	109.7
442	G	28.3	Very low	44.3	Very low	75 Å²	75	79 Å²	79	77%	0.773	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	152.1	-10.4	178.9	0	0	0	0	0	116.3	S440	S440-G442 PolarHBondContact O-N 3.4Å
443	R	29.6	Very low	45.7	Very low	186 Å²	186	77.4 Å²	77.4	70%	0.702	46%	0.464	S	S	*	.	S	Bend	trans	-100.6	130.3	177.2	-66.5	-176.6	-179.5	-162.6	2.4	111	L445	R443-L445 PolarHBondContact O-N 2.79Å
444	P	28.9	Very low	46.9	Very low	111 Å²	111	75.3 Å²	75.3	72%	0.721	44%	0.443	S	S	*	.	P	Polyproline II helix	trans	-62	134.9	177.2	-19.7	30.8	0	0	0	111.8
445	L	33.3	Very low	48.1	Very low	75 Å²	75	77 Å²	77	39%	0.393	45%	0.451	S	S	.	.	P	Polyproline II helix	trans	-67.1	145.9	-177	-73.8	135.7	0	0	0	113.2	D196 P434 R443 Q447	D196-L445 HydrophobicContact CB-CD2 4.21Å; P434-L445 HydrophobicContact CG-CD2 4.37Å; R443-L445 PolarHBondContact O-N 2.79Å; L445-Q447 PolarHBondContact O-N 3.18Å
446	G	37.2	Very low	49.6	Very low	66 Å²	66	81.3 Å²	81.3	68%	0.68	47%	0.47	S	S	*	.	S	Bend	trans	69	-4.5	146.5	0	0	0	0	0	118.7
447	Q	36.2	Very low	51.2	Low	145 Å²	145	81.2 Å²	81.2	68%	0.678	46%	0.463	S	S	*	.	S	Bend	trans	-94.2	126.5	166.5	-73.3	-175.8	-18.9	0	0	108.3	L445 K449	L445-Q447 PolarHBondContact O-N 3.18Å; Q447-K449 PolarHBondContact O-N 3.13Å
448	K	49.2	Very low	52.7	Low	119 Å²	119	84.3 Å²	84.3	52%	0.517	47%	0.47	S	S	.	.			trans	-42	115	152.8	-74.5	175.4	-178.5	164.5	0	104.9	S191 D246 Q450	S191-K448 PolarHBondContact OG-NZ 3.06Å; D246-K448 IonicContact OD2-NZ 3.7Å; D246-K448 PolarHBondContact OD2-NZ 3.02Å; K448-Q450 HydrophobicContact CB-CG 4.13Å; K448-Q450 PolarHBondContact O-N 2.85Å
449	K	50.6	Low	54.8	Low	144 Å²	144	89.6 Å²	89.6	63%	0.626	49%	0.492	S	S	*	.			trans	-67.3	79.1	170.2	-89	-172.5	178	-177.1	0	105.7	Q447 T451	Q447-K449 PolarHBondContact O-N 3.13Å; K449-T451 PolarHBondContact O-N 2.95Å
450	Q	58.6	Low	57	Low	30 Å²	30	85.5 Å²	85.5	14%	0.14	47%	0.473	C	S	.	.			trans	-61.4	125.6	171.6	-71.5	-167.3	-26.5	0	0	106.2	I87 Q88 K448	I87-Q450 HydrophobicContact CD1-CB 4.14Å; I87-Q450 VanDerWaalsContact CD1-OE1 3.27Å; I87-Q450 HydrophobicContact CG2-CB 3.88Å; I87-Q450 WeakPolarHBondContact CG2-O 3.32Å; Q88-Q450 WeakPolarHBondContact CG-O 3.13Å; Q88-Q450 PolarHBondContact NE2-O 2.82Å; K448-Q450 HydrophobicContact CB-CG 4.13Å; K448-Q450 PolarHBondContact O-N 2.85Å
451	T	62.2	Low	59.3	Low	79 Å²	79	85.7 Å²	85.7	49%	0.485	47%	0.465	S	S	.	.			trans	-107.8	151.7	173.3	48.1	0	0	0	0	107.1	Q88 K449	Q88-T451 VanDerWaalsContact NE2-CG2 3.28Å; K449-T451 PolarHBondContact O-N 2.95Å
452	G	78.3	Confident	61.9	Low	7 Å²	7	86.5 Å²	86.5	7%	0.072	45%	0.453	C	S	.	.	S	Bend	trans	79.4	-176.1	174.4	0	0	0	0	0	115.2	N86 I87 E456 R457	N86-G452 WeakPolarHBondContact ND2-CA 3.39Å; I87-G452 WeakPolarHBondContact CG2-O 3.36Å; I87-G452 PolarHBondContact N-O 3.14Å; G452-E456 WeakPolarHBondContact CA-OE2 3.15Å; G452-R457 PolarHBondContact O-NH1 2.91Å
453	S	82.8	Confident	64.5	Low	6 Å²	6	84.6 Å²	84.6	4%	0.042	43%	0.425	C	S	.	.			trans	-80	169.2	176.7	78.1	0	0	0	0	111.9	S83 D84 K85 N455 E456 R457	S83-S453 WeakPolarHBondContact O-CB 3.49Å; D84-S453 WeakPolarHBondContact O-CB 3.42Å; K85-S453 WeakPolarHBondContact O-CA 3.31Å; S453-N455 VanDerWaalsContact C-N 3.32Å; S453-N455 PolarHBondContact OG-N 2.71Å; S453-E456 PolarHBondContact N-OE2 3.47Å; S453-E456 WeakPolarHBondContact OG-CB 3.36Å; S453-E456 VanDerWaalsContact OG-CG 3.3Å; S453-E456 WeakPolarHBondContact OG-CG 3.06Å; S453-E456 PolarHBondContact OG-N 3.25Å; S453-R457 VanDerWaalsContact C-NH1 3.34Å; S453-R457 WeakPolarHBondContact O-CG 3.42Å; S453-R457 PolarHBondContact O-N 3.37Å; S453-R457 VanDerWaalsContact O-N 3.13Å; S453-R457 PolarHBondContact O-NH1 3.21Å
454	F	82.3	Confident	67.2	Low	50 Å²	50	78.1 Å²	78.1	22%	0.219	41%	0.408	C	S	.	.	H	α-helix	trans	-62	-43.2	173.5	170.7	-97.9	0	0	0	111	S83 Q248 R457 K458	S83-F454 WeakPolarHBondContact O-CB 3.48Å; S83-F454 PolarHBondContact O-N 3.37Å; Q248-F454 WeakPolarHBondContact O-CE2 3.13Å; F454-R457 PolarHBondContact O-N 3.49Å; F454-K458 PolarHBondContact O-N 2.99Å
455	N	83.3	Confident	69.9	Low	57 Å²	57	73.4 Å²	73.4	31%	0.305	38%	0.376	S	S	.	.	H	α-helix	trans	-64	-42	178.5	-71.7	-25.3	0	0	0	112.1	S83 D84 S453 R457 K458 E459	S83-N455 PolarHBondContact O-N 3.37Å; D84-N455 PolarHBondContact OD1-ND2 3.04Å; S453-N455 VanDerWaalsContact C-N 3.32Å; S453-N455 PolarHBondContact OG-N 2.71Å; N455-R457 VanDerWaalsContact C-N 3.31Å; N455-R457 PolarHBondContact O-N 2.81Å; N455-K458 WeakPolarHBondContact O-CB 3.46Å; N455-K458 PolarHBondContact O-N 3Å; N455-E459 WeakPolarHBondContact O-CG 3.48Å; N455-E459 PolarHBondContact O-N 3.1Å
456	E	81.6	Confident	72.5	Confident	98 Å²	98	73 Å²	73	46%	0.458	37%	0.369	S	S	.	.	H	α-helix	trans	-60.4	-40	173.6	-74.3	170.3	176	0	0	111.8	G452 S453 E459 L460	G452-E456 WeakPolarHBondContact CA-OE2 3.15Å; S453-E456 PolarHBondContact N-OE2 3.47Å; S453-E456 WeakPolarHBondContact OG-CB 3.36Å; S453-E456 VanDerWaalsContact OG-CG 3.3Å; S453-E456 WeakPolarHBondContact OG-CG 3.06Å; S453-E456 PolarHBondContact OG-N 3.25Å; E456-E459 WeakPolarHBondContact O-CB 3.5Å; E456-E459 PolarHBondContact O-N 2.94Å; E456-L460 WeakPolarHBondContact O-CG 2.86Å; E456-L460 PolarHBondContact O-N 3.23Å
457	R	81.1	Confident	74.8	Confident	43 Å²	43	74.5 Å²	74.5	16%	0.162	36%	0.359	C	S	.	.	H	α-helix	trans	-66.9	-38.6	176.5	-71.3	-168.8	-57.4	-79.8	2.8	112.4	G452 S453 F454 N455 E459 L460 Q461	G452-R457 PolarHBondContact O-NH1 2.91Å; S453-R457 VanDerWaalsContact C-NH1 3.34Å; S453-R457 WeakPolarHBondContact O-CG 3.42Å; S453-R457 PolarHBondContact O-N 3.37Å; S453-R457 VanDerWaalsContact O-N 3.13Å; S453-R457 PolarHBondContact O-NH1 3.21Å; F454-R457 PolarHBondContact O-N 3.49Å; N455-R457 VanDerWaalsContact C-N 3.31Å; N455-R457 PolarHBondContact O-N 2.81Å; R457-E459 VanDerWaalsContact C-N 3.29Å; R457-E459 PolarHBondContact O-N 3.24Å; R457-L460 WeakPolarHBondContact O-CB 3.18Å; R457-L460 PolarHBondContact O-N 3.3Å; R457-Q461 WeakPolarHBondContact O-CG 3.46Å; R457-Q461 PolarHBondContact O-N 2.97Å; R457-Q461 VanDerWaalsContact O-N 3.12Å
458	K	80.6	Confident	77.1	Confident	121 Å²	121	71.1 Å²	71.1	53%	0.526	34%	0.339	S	S	.	.	H	α-helix	trans	-62.7	-37.5	174.2	-167.8	177.1	-178.2	176.8	0	111.5	F454 N455 Q461	F454-K458 PolarHBondContact O-N 2.99Å; N455-K458 WeakPolarHBondContact O-CB 3.46Å; N455-K458 PolarHBondContact O-N 3Å; K458-Q461 PolarHBondContact O-N 3.25Å
459	E	81.4	Confident	78.7	Confident	135 Å²	135	65.5 Å²	65.5	63%	0.631	32%	0.315	S	S	*	.	H	α-helix	trans	-66	-41.7	171.8	-69.9	175.5	-178.8	0	0	112.3	N455 E456 R457 Q461 N462	N455-E459 WeakPolarHBondContact O-CG 3.48Å; N455-E459 PolarHBondContact O-N 3.1Å; E456-E459 WeakPolarHBondContact O-CB 3.5Å; E456-E459 PolarHBondContact O-N 2.94Å; R457-E459 VanDerWaalsContact C-N 3.29Å; R457-E459 PolarHBondContact O-N 3.24Å; E459-Q461 PolarHBondContact O-N 3.14Å; E459-N462 WeakPolarHBondContact O-CB 3.31Å; E459-N462 PolarHBondContact O-N 2.89Å; E459-N462 VanDerWaalsContact O-N 3.09Å
460	L	76.9	Confident	80.3	Confident	52 Å²	52	60.7 Å²	60.7	27%	0.272	31%	0.306	S	S	.	.	H	α-helix	trans	-62.4	-28.5	177.5	-70.7	173.8	0	0	0	113.4	E456 R457 N462 L463 R468	E456-L460 WeakPolarHBondContact O-CG 2.86Å; E456-L460 PolarHBondContact O-N 3.23Å; R457-L460 WeakPolarHBondContact O-CB 3.18Å; R457-L460 PolarHBondContact O-N 3.3Å; L460-N462 VanDerWaalsContact C-N 3.26Å; L460-N462 PolarHBondContact O-N 3.17Å; L460-L463 HydrophobicContact CD2-CD1 3.58Å; L460-L463 WeakPolarHBondContact O-CB 3.39Å; L460-L463 PolarHBondContact O-N 3.01Å; L460-R468 PolarHBondContact O-NH1 2.9Å
461	Q	75.9	Confident	81.2	Confident	81 Å²	81	67.7 Å²	67.7	38%	0.379	33%	0.332	S	S	.	.	H	α-helix	trans	-67.5	-27.9	175.3	-72.1	164.9	1.1	0	0	112.8	E249 R457 K458 E459 L463 R468	E249-Q461 PolarHBondContact OE1-NE2 2.67Å; E249-Q461 PolarHBondContact OE2-NE2 3.34Å; E249-Q461 PolarHBondContact OE2-OE1 2.87Å; R457-Q461 WeakPolarHBondContact O-CG 3.46Å; R457-Q461 PolarHBondContact O-N 2.97Å; R457-Q461 VanDerWaalsContact O-N 3.12Å; K458-Q461 PolarHBondContact O-N 3.25Å; E459-Q461 PolarHBondContact O-N 3.14Å; Q461-L463 VanDerWaalsContact C-N 3.26Å; Q461-L463 PolarHBondContact O-N 3.04Å; Q461-R468 PolarHBondContact O-NH1 3.29Å
462	N	81.7	Confident	82	Confident	137 Å²	137	65.2 Å²	65.2	73%	0.733	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.5	-9.4	177.7	-64.2	-31.1	0	0	0	113.1	E459 L460	E459-N462 WeakPolarHBondContact O-CB 3.31Å; E459-N462 PolarHBondContact O-N 2.89Å; E459-N462 VanDerWaalsContact O-N 3.09Å; L460-N462 VanDerWaalsContact C-N 3.26Å; L460-N462 PolarHBondContact O-N 3.17Å
463	L	83.1	Confident	82	Confident	34 Å²	34	71.3 Å²	71.3	18%	0.178	36%	0.358	C	S	.	.	S	Bend	trans	-73.5	156.4	175.7	-62	-179	0	0	0	111.5	L460 Q461 E467 R468	L460-L463 HydrophobicContact CD2-CD1 3.58Å; L460-L463 WeakPolarHBondContact O-CB 3.39Å; L460-L463 PolarHBondContact O-N 3.01Å; Q461-L463 VanDerWaalsContact C-N 3.26Å; Q461-L463 PolarHBondContact O-N 3.04Å; L463-E467 HydrophobicContact CB-CB 3.99Å; L463-E467 HydrophobicContact CD1-CB 4.24Å; L463-E467 HydrophobicContact CG-CB 4.48Å; L463-R468 HydrophobicContact CB-CG 4.09Å; L463-R468 PolarHBondContact O-NH1 3.42Å; L463-R468 PolarHBondContact O-NH2 3.4Å
464	S	86.1	Confident	81.8	Confident	51 Å²	51	72.1 Å²	72.1	36%	0.357	36%	0.36	S	S	.	.			trans	-66.2	159.4	165.8	65.9	0	0	0	0	111.1	R466 E467 R468	S464-R466 PolarHBondContact O-N 3.2Å; S464-E467 WeakPolarHBondContact CB-OE2 3.42Å; S464-E467 PolarHBondContact N-OE2 3.4Å; S464-E467 PolarHBondContact O-N 2.96Å; S464-E467 VanDerWaalsContact OG-CG 3.31Å; S464-E467 WeakPolarHBondContact OG-CG 3.34Å; S464-E467 PolarHBondContact OG-N 2.92Å; S464-E467 PolarHBondContact OG-OE2 3.2Å; S464-R468 PolarHBondContact O-N 3.49Å
465	W	86.6	Confident	81.9	Confident	11 Å²	11	70.3 Å²	70.3	4%	0.042	36%	0.355	C	S	.	.	H	α-helix	trans	-58.9	-33.6	176.5	69.3	-97.4	0	0	0	112.5	R468 I469 E531 A532 D535 V538 L758 L759	W465-R468 PolarHBondContact O-N 3.33Å; W465-I469 HydrophobicContact CE3-CD1 3.59Å; W465-I469 HydrophobicContact CE3-CG1 4.44Å; W465-I469 HydrophobicContact CZ3-CD1 3.68Å; W465-I469 WeakPolarHBondContact O-CG1 3.49Å; W465-I469 PolarHBondContact O-N 3.28Å; W465-E531 WeakPolarHBondContact CA-OE1 3.34Å; W465-E531 HydrophobicContact CB-CG 3.78Å; W465-E531 WeakPolarHBondContact CB-OE1 3.14Å; W465-A532 HydrophobicContact CD2-CB 3.82Å; W465-A532 HydrophobicContact CE3-CB 3.66Å; W465-A532 HydrophobicContact CH2-CB 3.84Å; W465-A532 HydrophobicContact CZ2-CB 3.97Å; W465-A532 HydrophobicContact CZ3-CB 3.69Å; W465-D535 PolarHBondContact NE1-OD2 3.15Å; W465-V538 HydrophobicContact CZ2-CG2 3.99Å; W465-L758 HydrophobicContact CH2-CB 4.03Å; W465-L759 HydrophobicContact CH2-CD2 3.92Å; W465-L759 HydrophobicContact CZ3-CD2 3.6Å; W465-L759 HydrophobicContact CZ3-CG 4.26Å
466	R	86.4	Confident	81.9	Confident	68 Å²	68	71.3 Å²	71.3	26%	0.257	37%	0.371	S	S	.	.	H	α-helix	trans	-64	-47.8	178	-62.2	-179.7	-177.2	-85.3	-3.3	111.5	S464 R468 I469 G470 L758 L759 A762	S464-R466 PolarHBondContact O-N 3.2Å; R466-R468 VanDerWaalsContact C-N 3.31Å; R466-R468 PolarHBondContact O-N 3.04Å; R466-I469 PolarHBondContact O-N 2.88Å; R466-G470 PolarHBondContact O-N 3.48Å; R466-L758 PolarHBondContact NH1-O 2.89Å; R466-L758 PolarHBondContact NH2-O 3.42Å; R466-L759 HydrophobicContact CB-CD2 4.31Å; R466-L759 HydrophobicContact CG-CD2 4.14Å; R466-A762 VanDerWaalsContact CZ-CB 3.45Å
467	E	86.3	Confident	82	Confident	97 Å²	97	70.2 Å²	70.2	45%	0.453	37%	0.368	S	S	.	.	H	α-helix	trans	-64.8	-37.4	177.3	-69.7	165.5	126.5	0	0	111.5	L463 S464 G470 R471	L463-E467 HydrophobicContact CB-CB 3.99Å; L463-E467 HydrophobicContact CD1-CB 4.24Å; L463-E467 HydrophobicContact CG-CB 4.48Å; S464-E467 WeakPolarHBondContact CB-OE2 3.42Å; S464-E467 PolarHBondContact N-OE2 3.4Å; S464-E467 PolarHBondContact O-N 2.96Å; S464-E467 VanDerWaalsContact OG-CG 3.31Å; S464-E467 WeakPolarHBondContact OG-CG 3.34Å; S464-E467 PolarHBondContact OG-N 2.92Å; S464-E467 PolarHBondContact OG-OE2 3.2Å; E467-G470 PolarHBondContact O-N 3.2Å; E467-R471 WeakPolarHBondContact O-CG 3.3Å; E467-R471 PolarHBondContact O-N 2.61Å; E467-R471 VanDerWaalsContact O-N 3.13Å
468	R	84.2	Confident	82.3	Confident	73 Å²	73	68.2 Å²	68.2	28%	0.275	36%	0.36	S	S	.	.	H	α-helix	trans	-62.9	-45.5	173.9	-77.2	-164.9	-80.1	-97.1	-1.4	112.3	L460 Q461 L463 S464 W465 R466 G470 R471 S472 E531	L460-R468 PolarHBondContact O-NH1 2.9Å; Q461-R468 PolarHBondContact O-NH1 3.29Å; L463-R468 HydrophobicContact CB-CG 4.09Å; L463-R468 PolarHBondContact O-NH1 3.42Å; L463-R468 PolarHBondContact O-NH2 3.4Å; S464-R468 PolarHBondContact O-N 3.49Å; W465-R468 PolarHBondContact O-N 3.33Å; R466-R468 VanDerWaalsContact C-N 3.31Å; R466-R468 PolarHBondContact O-N 3.04Å; R468-G470 VanDerWaalsContact C-N 3.32Å; R468-G470 PolarHBondContact O-N 2.83Å; R468-R471 PolarHBondContact O-N 2.83Å; R468-S472 PolarHBondContact O-N 3.01Å; R468-S472 VanDerWaalsContact O-N 3.11Å; R468-E531 IonicContact CZ-OE1 2.69Å; R468-E531 IonicContact NE-OE1 2.94Å; R468-E531 PolarHBondContact NE-OE1 2.94Å; R468-E531 IonicContact NE-OE2 3.03Å; R468-E531 IonicContact NH2-OE1 2.77Å; R468-E531 PolarHBondContact NH2-OE1 2.97Å
469	I	83.9	Confident	82.5	Confident	1 Å²	1	67.7 Å²	67.7	1%	0.005	36%	0.36	C	S	.	.	H	α-helix	trans	-60.4	-44.5	174.7	-70.9	178.1	0	0	0	110.5	W465 R466 R471 S472 A475 I478 H528 L755 L759	W465-I469 HydrophobicContact CE3-CD1 3.59Å; W465-I469 HydrophobicContact CE3-CG1 4.44Å; W465-I469 HydrophobicContact CZ3-CD1 3.68Å; W465-I469 WeakPolarHBondContact O-CG1 3.49Å; W465-I469 PolarHBondContact O-N 3.28Å; R466-I469 PolarHBondContact O-N 2.88Å; I469-R471 PolarHBondContact O-N 3.14Å; I469-S472 VanDerWaalsContact O-CB 3.3Å; I469-S472 WeakPolarHBondContact O-CB 3.47Å; I469-S472 PolarHBondContact O-N 3.29Å; I469-S472 PolarHBondContact O-OG 2.6Å; I469-A475 VanDerWaalsContact O-CB 3.3Å; I469-A475 WeakPolarHBondContact O-CB 3.24Å; I469-I478 HydrophobicContact CG2-CB 4.48Å; I469-I478 HydrophobicContact CG2-CD1 3.69Å; I469-I478 HydrophobicContact CG2-CG2 4.37Å; I469-H528 HydrophobicContact CD1-CB 4.08Å; I469-H528 HydrophobicContact CG1-CB 4.2Å; I469-L755 HydrophobicContact CD1-CD2 3.89Å; I469-L759 HydrophobicContact CG2-CD1 4.08Å
470	G	82.4	Confident	82.6	Confident	43 Å²	43	63.2 Å²	63.2	44%	0.443	34%	0.344	S	S	.	.	H	α-helix	trans	-59.2	-27.6	178.3	0	0	0	0	0	114.1	R466 E467 R468	R466-G470 PolarHBondContact O-N 3.48Å; E467-G470 PolarHBondContact O-N 3.2Å; R468-G470 VanDerWaalsContact C-N 3.32Å; R468-G470 PolarHBondContact O-N 2.83Å
471	R	79.2	Confident	82.9	Confident	178 Å²	178	64.6 Å²	64.6	67%	0.672	35%	0.349	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.8	-3.8	175.4	-64.4	-177.4	-175.4	-158.4	3.9	113.9	E467 R468 I469	E467-R471 WeakPolarHBondContact O-CG 3.3Å; E467-R471 PolarHBondContact O-N 2.61Å; E467-R471 VanDerWaalsContact O-N 3.13Å; R468-R471 PolarHBondContact O-N 2.83Å; I469-R471 PolarHBondContact O-N 3.14Å
472	S	79.1	Confident	82.9	Confident	27 Å²	27	61.5 Å²	61.5	19%	0.189	34%	0.335	C	S	.	.	S	Bend	trans	-78.9	157.7	-179.9	79.9	0	0	0	0	112	R468 I469 Q474 A475	R468-S472 PolarHBondContact O-N 3.01Å; R468-S472 VanDerWaalsContact O-N 3.11Å; I469-S472 VanDerWaalsContact O-CB 3.3Å; I469-S472 WeakPolarHBondContact O-CB 3.47Å; I469-S472 PolarHBondContact O-N 3.29Å; I469-S472 PolarHBondContact O-OG 2.6Å; S472-Q474 PolarHBondContact O-N 2.79Å; S472-Q474 PolarHBondContact OG-N 2.8Å; S472-A475 WeakPolarHBondContact O-CB 3.34Å; S472-A475 PolarHBondContact O-N 3.25Å; S472-A475 PolarHBondContact OG-N 2.81Å
473	C	76.4	Confident	82.5	Confident	135 Å²	135	58.5 Å²	58.5	91%	0.912	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.4	-11	171	61.4	0	0	0	0	113.6
474	Q	79.7	Confident	81.6	Confident	22 Å²	22	61.3 Å²	61.3	10%	0.103	33%	0.334	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-2.6	178.1	-69.4	173.4	-24.8	0	0	112.2	S472 A476 L477 I478 D522 L525 H528	S472-Q474 PolarHBondContact O-N 2.79Å; S472-Q474 PolarHBondContact OG-N 2.8Å; Q474-A476 PolarHBondContact O-N 3.26Å; Q474-L477 WeakPolarHBondContact O-CB 3.42Å; Q474-L477 PolarHBondContact O-N 3.27Å; Q474-L477 VanDerWaalsContact O-N 3.1Å; Q474-I478 HydrophobicContact CB-CD1 3.96Å; Q474-I478 HydrophobicContact CB-CG1 4.45Å; Q474-I478 WeakPolarHBondContact O-CG1 3.49Å; Q474-I478 PolarHBondContact O-N 2.91Å; Q474-D522 PolarHBondContact NE2-OD1 2.99Å; Q474-D522 PolarHBondContact NE2-OD2 2.62Å; Q474-L525 HydrophobicContact CB-CD2 4.31Å; Q474-L525 HydrophobicContact CG-CD2 4.3Å; Q474-H528 PolarHBondContact OE1-CD2 3.03Å
475	A	83.8	Confident	80.5	Confident	12 Å²	12	64.1 Å²	64.1	10%	0.099	35%	0.346	C	S	.	.	H	α-helix	trans	-52.6	-52.3	-178.2	0	0	0	0	0	112.6	I469 S472 L477 I478 Q479	I469-A475 VanDerWaalsContact O-CB 3.3Å; I469-A475 WeakPolarHBondContact O-CB 3.24Å; S472-A475 WeakPolarHBondContact O-CB 3.34Å; S472-A475 PolarHBondContact O-N 3.25Å; S472-A475 PolarHBondContact OG-N 2.81Å; A475-L477 VanDerWaalsContact C-N 3.27Å; A475-L477 PolarHBondContact O-N 3.35Å; A475-I478 PolarHBondContact O-N 3.48Å; A475-Q479 VanDerWaalsContact O-CB 3.29Å; A475-Q479 WeakPolarHBondContact O-CB 3.44Å; A475-Q479 VanDerWaalsContact O-CG 3.25Å; A475-Q479 WeakPolarHBondContact O-CG 3.29Å; A475-Q479 PolarHBondContact O-N 3.09Å
476	A	84.1	Confident	79.4	Confident	78 Å²	78	65.5 Å²	65.5	65%	0.645	35%	0.351	S	S	*	.	H	α-helix	trans	-61.9	-36.3	-179.4	0	0	0	0	0	112.4	Q474 S480	Q474-A476 PolarHBondContact O-N 3.26Å; A476-S480 PolarHBondContact O-N 3.3Å
477	L	83.8	Confident	78.2	Confident	76 Å²	76	62.8 Å²	62.8	40%	0.398	34%	0.344	S	S	.	.	H	α-helix	trans	-65.9	-55.1	175.2	-178.4	69.4	0	0	0	109.6	Q474 A475 Q479 S480 Q752	Q474-L477 WeakPolarHBondContact O-CB 3.42Å; Q474-L477 PolarHBondContact O-N 3.27Å; Q474-L477 VanDerWaalsContact O-N 3.1Å; A475-L477 VanDerWaalsContact C-N 3.27Å; A475-L477 PolarHBondContact O-N 3.35Å; L477-Q479 VanDerWaalsContact C-N 3.29Å; L477-Q479 PolarHBondContact O-N 2.98Å; L477-S480 WeakPolarHBondContact O-CB 3.29Å; L477-S480 PolarHBondContact O-N 3.21Å; L477-S480 VanDerWaalsContact O-N 3.14Å; L477-S480 PolarHBondContact O-OG 3.45Å; L477-Q752 VanDerWaalsContact CD1-NE2 3.27Å; L477-Q752 HydrophobicContact CG-CG 4.41Å; L477-Q752 PolarHBondContact O-NE2 3.11Å
478	I	85.9	Confident	77.3	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-61.7	-36.4	-177.5	-64.6	163.6	0	0	0	111.9	I469 Q474 A475 S480 L525 L755 H756 L759	I469-I478 HydrophobicContact CG2-CB 4.48Å; I469-I478 HydrophobicContact CG2-CD1 3.69Å; I469-I478 HydrophobicContact CG2-CG2 4.37Å; Q474-I478 HydrophobicContact CB-CD1 3.96Å; Q474-I478 HydrophobicContact CB-CG1 4.45Å; Q474-I478 WeakPolarHBondContact O-CG1 3.49Å; Q474-I478 PolarHBondContact O-N 2.91Å; A475-I478 PolarHBondContact O-N 3.48Å; I478-S480 VanDerWaalsContact C-N 3.34Å; I478-L525 HydrophobicContact CD1-CD2 4.09Å; I478-L525 HydrophobicContact CG1-CD2 4.1Å; I478-L755 HydrophobicContact CD1-CD1 3.97Å; I478-L755 HydrophobicContact CG1-CB 4.49Å; I478-L755 HydrophobicContact CG1-CD1 4.26Å; I478-L755 HydrophobicContact CG2-CB 3.61Å; I478-H756 WeakPolarHBondContact O-CB 3.37Å; I478-H756 PolarHBondContact O-ND1 3.26Å; I478-L759 HydrophobicContact CG2-CD1 3.55Å
479	Q	85.4	Confident	76.5	Confident	111 Å²	111	62.5 Å²	62.5	52%	0.519	37%	0.367	S	S	.	.	H	α-helix	trans	-77.4	-17.5	179.9	-70.7	172	-16.2	0	0	113.6	A475 L477 H756 L759	A475-Q479 VanDerWaalsContact O-CB 3.29Å; A475-Q479 WeakPolarHBondContact O-CB 3.44Å; A475-Q479 VanDerWaalsContact O-CG 3.25Å; A475-Q479 WeakPolarHBondContact O-CG 3.29Å; A475-Q479 PolarHBondContact O-N 3.09Å; L477-Q479 VanDerWaalsContact C-N 3.29Å; L477-Q479 PolarHBondContact O-N 2.98Å; Q479-H756 PolarHBondContact O-CE1 3.25Å; Q479-H756 VanDerWaalsContact O-CE1 3.28Å; Q479-H756 PolarHBondContact O-ND1 3.15Å; Q479-L759 HydrophobicContact CG-CD1 4.45Å
480	S	84.4	Confident	76.6	Confident	41 Å²	41	63.8 Å²	63.8	29%	0.287	38%	0.375	S	S	.	.	S	Bend	trans	-66.1	138.3	178.2	67.4	0	0	0	0	112	A476 L477 I478 R486 Q752 H756	A476-S480 PolarHBondContact O-N 3.3Å; L477-S480 WeakPolarHBondContact O-CB 3.29Å; L477-S480 PolarHBondContact O-N 3.21Å; L477-S480 VanDerWaalsContact O-N 3.14Å; L477-S480 PolarHBondContact O-OG 3.45Å; I478-S480 VanDerWaalsContact C-N 3.34Å; S480-R486 PolarHBondContact OG-NH2 3.35Å; S480-Q752 PolarHBondContact OG-NE2 2.97Å; S480-H756 PolarHBondContact O-CE1 3.01Å; S480-H756 PolarHBondContact O-ND1 3.45Å
481	H	82.6	Confident	77	Confident	81 Å²	81	64.6 Å²	64.6	38%	0.375	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-67.7	148	174.4	-64.4	-62.9	0	0	0	111.2	C546 H756 Q760	H481-C546 PolarHBondContact ND1-SG 3.47Å; H481-H756 AromaticContact CE1-CE1 3.96Å; H481-H756 AromaticContact CE1-NE2 3.97Å; H481-H756 AromaticContact ND1-CE1 3.44Å; H481-H756 PolarHBondContact ND1-CE1 3.45Å; H481-H756 AromaticContact ND1-NE2 3.25Å; H481-H756 PolarHBondContact ND1-NE2 3.16Å; H481-Q760 PolarHBondContact CE1-NE2 3.4Å
482	C	75.6	Confident	77.5	Confident	15 Å²	15	56.5 Å²	56.5	10%	0.101	34%	0.341	C	S	.	.	P	Polyproline II helix	trans	-70.6	137.1	175.7	-60.8	0	0	0	0	110	C549 S550	C482-C549 HydrophobicContact CB-CB 4Å; C482-C549 PolarHBondContact N-SG 3.39Å; C482-C549 WeakPolarHBondContact O-CA 3.42Å; C482-S550 PolarHBondContact O-N 3.21Å
483	T	73	Confident	78.1	Confident	75 Å²	75	61.9 Å²	61.9	46%	0.46	36%	0.364	S	S	.	.			trans	-112.9	153.7	177.6	56.5	0	0	0	0	110.7	D485 R486 S550	T483-D485 PolarHBondContact O-N 3.48Å; T483-R486 PolarHBondContact O-N 3.33Å; T483-S550 WeakPolarHBondContact CA-OG 3.35Å
484	E	64.1	Low	78.5	Confident	92 Å²	92	56.5 Å²	56.5	43%	0.43	33%	0.331	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	-30.5	178.1	-64.8	-171.3	-169.3	0	0	113.5	R486 S550	E484-R486 VanDerWaalsContact C-N 3.27Å; E484-R486 PolarHBondContact O-N 3.25Å; E484-S550 PolarHBondContact N-OG 3.06Å; E484-S550 VanDerWaalsContact N-OG 3.11Å
485	D	62.7	Low	78.4	Confident	111 Å²	111	58 Å²	58	59%	0.594	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-1.4	-177.6	-60.7	-37.2	0	0	0	114.2	T483 G487 L488	T483-D485 PolarHBondContact O-N 3.48Å; D485-G487 PolarHBondContact O-N 3.32Å; D485-L488 HydrophobicContact CB-CB 4.35Å; D485-L488 WeakPolarHBondContact O-CB 2.98Å; D485-L488 PolarHBondContact O-N 2.87Å
486	R	65.2	Low	77.8	Confident	39 Å²	39	60.7 Å²	60.7	15%	0.147	35%	0.35	C	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	124.7	179.6	-82.6	172.8	176.8	-110.8	11.3	111.2	S480 T483 E484 L488 E749 Q752	S480-R486 PolarHBondContact OG-NH2 3.35Å; T483-R486 PolarHBondContact O-N 3.33Å; E484-R486 VanDerWaalsContact C-N 3.27Å; E484-R486 PolarHBondContact O-N 3.25Å; R486-L488 PolarHBondContact O-N 2.87Å; R486-E749 VanDerWaalsContact CD-OE2 3.25Å; R486-E749 WeakPolarHBondContact CD-OE2 3.08Å; R486-E749 WeakPolarHBondContact CG-OE2 3.3Å; R486-E749 IonicContact CZ-OE2 3.68Å; R486-E749 IonicContact NE-OE2 3.85Å; R486-E749 IonicContact NH1-OE1 3.76Å; R486-E749 IonicContact NH1-OE2 2.72Å; R486-E749 PolarHBondContact NH1-OE2 3.43Å; R486-Q752 VanDerWaalsContact NH1-NE2 3.12Å
487	G	60.8	Low	76.9	Confident	11 Å²	11	63.3 Å²	63.3	11%	0.113	36%	0.364	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.5	-3.2	-171.9	0	0	0	0	0	114.3	D485 G489 C490 R667	D485-G487 PolarHBondContact O-N 3.32Å; G487-G489 PolarHBondContact O-N 2.94Å; G487-G489 VanDerWaalsContact O-N 3.15Å; G487-C490 PolarHBondContact O-N 3.03Å; G487-R667 PolarHBondContact O-NH1 3.05Å
488	L	66.9	Low	76	Confident	97 Å²	97	62.6 Å²	62.6	51%	0.508	37%	0.365	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.7	111.4	175	-155	95.8	0	0	0	109	D485 R486 R667	D485-L488 HydrophobicContact CB-CB 4.35Å; D485-L488 WeakPolarHBondContact O-CB 2.98Å; D485-L488 PolarHBondContact O-N 2.87Å; R486-L488 PolarHBondContact O-N 2.87Å; L488-R667 VanDerWaalsContact CA-NH1 3.31Å; L488-R667 VanDerWaalsContact CD1-CZ 3.49Å
489	G	68.6	Low	75.6	Confident	68 Å²	68	64.4 Å²	64.4	70%	0.701	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	104.2	-4.7	-179	0	0	0	0	0	115.9	G487 V491	G487-G489 PolarHBondContact O-N 2.94Å; G487-G489 VanDerWaalsContact O-N 3.15Å; G489-V491 PolarHBondContact O-N 2.76Å
490	C	85.6	Confident	75.4	Confident	27 Å²	27	65.1 Å²	65.1	18%	0.182	38%	0.379	C	S	.	.			trans	-85.9	100.1	168.4	-166.7	0	0	0	0	109.3	G487 F666 F742	G487-C490 PolarHBondContact O-N 3.03Å; C490-F666 HydrophobicContact CB-CE1 3.79Å; C490-F666 HydrophobicContact CB-CZ 4.5Å; C490-F742 VanDerWaalsContact SG-CD2 3.57Å
491	V	90.1	Very high	75.5	Confident	61 Å²	61	63.8 Å²	63.8	37%	0.37	37%	0.369	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.4	131	-176	-175.1	0	0	0	0	110	G489 E493 I664	G489-V491 PolarHBondContact O-N 2.76Å; V491-E493 WeakPolarHBondContact CG1-OE1 3.37Å; V491-I664 CarbonylContact C-O 2.99Å; V491-I664 WeakPolarHBondContact CA-O 3.32Å
492	L	90.7	Very high	75.7	Confident	7 Å²	7	68 Å²	68	4%	0.037	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	107.3	167.7	-72.4	175.2	0	0	0	109.9	S663 I664 G738 L739 F742	L492-S663 CarbonylContact O-C 3.59Å; L492-S663 VanDerWaalsContact O-CA 3.25Å; L492-S663 WeakPolarHBondContact O-CA 3.44Å; L492-I664 HydrophobicContact CB-CB 4.29Å; L492-I664 PolarHBondContact N-O 3.49Å; L492-I664 PolarHBondContact O-N 2.68Å; L492-G738 WeakPolarHBondContact CD2-O 3.49Å; L492-L739 HydrophobicContact CD1-CD1 3.89Å; L492-F742 HydrophobicContact CB-CD2 4.44Å; L492-F742 HydrophobicContact CD1-CB 3.65Å; L492-F742 HydrophobicContact CD1-CD1 3.37Å; L492-F742 HydrophobicContact CD1-CD2 3.82Å; L492-F742 HydrophobicContact CD1-CE1 3.89Å; L492-F742 HydrophobicContact CD1-CE2 4.25Å; L492-F742 HydrophobicContact CD1-CG 3.33Å; L492-F742 HydrophobicContact CD1-CZ 4.29Å; L492-F742 HydrophobicContact CD2-CB 3.58Å; L492-F742 HydrophobicContact CD2-CD2 4.37Å; L492-F742 HydrophobicContact CD2-CG 4.07Å; L492-F742 HydrophobicContact CG-CB 3.53Å; L492-F742 HydrophobicContact CG-CD1 4.01Å; L492-F742 HydrophobicContact CG-CD2 3.49Å; L492-F742 VanDerWaalsContact CG-CD2 3.49Å; L492-F742 HydrophobicContact CG-CE2 4.11Å; L492-F742 HydrophobicContact CG-CG 3.41Å; L492-F742 VanDerWaalsContact CG-CG 3.41Å
493	E	91.1	Very high	76.2	Confident	140 Å²	140	70.2 Å²	70.2	65%	0.654	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.1	136.1	173.7	-63.2	-61.8	151.6	0	0	111.4	V491 H658	V491-E493 WeakPolarHBondContact CG1-OE1 3.37Å; E493-H658 PolarHBondContact O-NE2 2.82Å
494	G	84.3	Confident	77.2	Confident	22 Å²	22	68 Å²	68	23%	0.227	39%	0.393	C	S	.	.			trans	-147.8	-167.5	-179.7	0	0	0	0	0	112.3	F661 R662	G494-F661 CarbonylContact C-O 3.38Å; G494-F661 WeakPolarHBondContact CA-O 3.48Å; G494-R662 CarbonylContact C-O 3.42Å; G494-R662 WeakPolarHBondContact CA-O 3.24Å; G494-R662 PolarHBondContact N-O 2.84Å; G494-R662 WeakPolarHBondContact O-CA 3.41Å
495	P	77.1	Confident	78.4	Confident	54 Å²	54	69.5 Å²	69.5	35%	0.351	40%	0.396	S	S	.	.			cis	-65.5	151.9	-14.2	30.1	-34.9	0	0	0	110.3	S497 A659 C685 A688	P495-S497 PolarHBondContact O-N 3.45Å; P495-A659 WeakPolarHBondContact CB-O 3.42Å; P495-C685 HydrophobicContact CG-CB 4.45Å; P495-A688 HydrophobicContact CB-CB 4.43Å
496	R	72.5	Confident	79.9	Confident	68 Å²	68	67 Å²	67	26%	0.257	39%	0.385	S	S	.	.			trans	-62.6	136.2	174.2	-70.6	-171.9	88	-176.9	9.7	109.6	S498 E733	R496-S498 PolarHBondContact O-N 2.88Å; R496-S498 VanDerWaalsContact O-N 3.11Å; R496-E733 IonicContact NH1-OE2 3.53Å
497	S	64.8	Low	81.1	Confident	134 Å²	134	66.2 Å²	66.2	94%	0.937	38%	0.384	S	S	*	.	S	Bend	trans	-65.6	-12.6	-178.7	38.8	0	0	0	0	114.5	P495	P495-S497 PolarHBondContact O-N 3.45Å
498	S	65.4	Low	82.6	Confident	60 Å²	60	67.5 Å²	67.5	42%	0.42	39%	0.39	S	S	.	.			trans	-153.2	125	174.3	62.6	0	0	0	0	111.8	R496	R496-S498 PolarHBondContact O-N 2.88Å; R496-S498 VanDerWaalsContact O-N 3.11Å
499	C	75.8	Confident	83.6	Confident	39 Å²	39	63 Å²	63	26%	0.264	37%	0.367	S	S	.	.			trans	-127.9	116.5	168.2	-172.5	0	0	0	0	108.7	V501 W504 M692	C499-V501 HydrophobicContact CB-CG2 4.49Å; C499-V501 PolarHBondContact O-N 3.49Å; C499-W504 WeakPolarHBondContact SG-CZ2 3.09Å; C499-M692 HydrophobicContact CB-CE 4.21Å; C499-M692 WeakPolarHBondContact SG-CE 3.32Å
500	F	82	Confident	84.6	Confident	126 Å²	126	62.5 Å²	62.5	55%	0.553	36%	0.357	S	S	*	.			trans	-92.7	74.5	-178	-61.4	-78.4	0	0	0	109.9	D502 S503 W504	F500-D502 PolarHBondContact O-N 2.83Å; F500-S503 PolarHBondContact O-N 3.21Å; F500-S503 PolarHBondContact O-OG 3.12Å; F500-W504 PolarHBondContact O-NE1 2.96Å
501	V	87.2	Confident	84.8	Confident	12 Å²	12	63 Å²	63	7%	0.073	36%	0.362	C	S	.	.	G	3₁₀ helix	trans	-63.2	-26.5	-176.2	-176.1	0	0	0	0	111.9	C499 S503 W504 P691 M692 V695	C499-V501 HydrophobicContact CB-CG2 4.49Å; C499-V501 PolarHBondContact O-N 3.49Å; V501-S503 PolarHBondContact O-N 3.47Å; V501-S503 VanDerWaalsContact O-N 3.1Å; V501-W504 HydrophobicContact CB-CD2 4.47Å; V501-W504 HydrophobicContact CG1-CD2 4.1Å; V501-W504 HydrophobicContact CG1-CE3 3.92Å; V501-W504 HydrophobicContact CG1-CG 4.5Å; V501-W504 HydrophobicContact CG1-CZ3 4.36Å; V501-W504 HydrophobicContact CG2-CH2 4.35Å; V501-W504 HydrophobicContact CG2-CZ2 4.31Å; V501-W504 HydrophobicContact CG2-CZ3 4.5Å; V501-W504 VanDerWaalsContact O-CB 3.24Å; V501-W504 WeakPolarHBondContact O-CB 3.42Å; V501-W504 PolarHBondContact O-N 3.49Å; V501-P691 HydrophobicContact CB-CB 4.44Å; V501-P691 WeakPolarHBondContact CG1-O 3.4Å; V501-P691 HydrophobicContact CG2-CB 4.12Å; V501-M692 HydrophobicContact CG2-CE 4.41Å; V501-M692 HydrophobicContact CG2-CG 4.19Å; V501-V695 HydrophobicContact CG1-CB 4.21Å; V501-V695 HydrophobicContact CG1-CG2 3.37Å
502	D	86.6	Confident	84.9	Confident	170 Å²	170	60.5 Å²	60.5	91%	0.909	35%	0.347	S	S	*	.	G	3₁₀ helix	trans	-62.1	-18.3	178	-58.9	-29.6	0	0	0	114.1	F500	F500-D502 PolarHBondContact O-N 2.83Å
503	S	86.4	Confident	84.8	Confident	62 Å²	62	65 Å²	65	43%	0.434	38%	0.376	S	S	.	.	G	3₁₀ helix	trans	-91.9	0.7	176.6	71.1	0	0	0	0	113.5	F500 V501 Y505	F500-S503 PolarHBondContact O-N 3.21Å; F500-S503 PolarHBondContact O-OG 3.12Å; V501-S503 PolarHBondContact O-N 3.47Å; V501-S503 VanDerWaalsContact O-N 3.1Å; S503-Y505 WeakPolarHBondContact O-CD1 3.37Å
504	W	92.5	Very high	84.9	Confident	27 Å²	27	58.4 Å²	58.4	10%	0.102	35%	0.346	C	S	.	.			trans	-81.6	142.3	-175.9	-66.7	11.3	0	0	0	111.1	C499 F500 V501 F655 M692 V695 F728 V729 P730	C499-W504 WeakPolarHBondContact SG-CZ2 3.09Å; F500-W504 PolarHBondContact O-NE1 2.96Å; V501-W504 HydrophobicContact CB-CD2 4.47Å; V501-W504 HydrophobicContact CG1-CD2 4.1Å; V501-W504 HydrophobicContact CG1-CE3 3.92Å; V501-W504 HydrophobicContact CG1-CG 4.5Å; V501-W504 HydrophobicContact CG1-CZ3 4.36Å; V501-W504 HydrophobicContact CG2-CH2 4.35Å; V501-W504 HydrophobicContact CG2-CZ2 4.31Å; V501-W504 HydrophobicContact CG2-CZ3 4.5Å; V501-W504 VanDerWaalsContact O-CB 3.24Å; V501-W504 WeakPolarHBondContact O-CB 3.42Å; V501-W504 PolarHBondContact O-N 3.49Å; W504-F655 AromaticContact CH2-CD1 3.96Å; W504-F655 HydrophobicContact CH2-CD1 3.96Å; W504-F655 AromaticContact CH2-CE1 3.85Å; W504-F655 HydrophobicContact CH2-CE1 3.85Å; W504-F655 HydrophobicContact CZ2-CD1 4.02Å; W504-F655 AromaticContact CZ2-CE1 3.56Å; W504-F655 HydrophobicContact CZ2-CE1 3.56Å; W504-M692 HydrophobicContact CH2-CE 3.61Å; W504-M692 HydrophobicContact CH2-SD 4.44Å; W504-M692 HydrophobicContact CZ2-CE 4.29Å; W504-M692 HydrophobicContact CZ3-CE 4.44Å; W504-V695 HydrophobicContact CE3-CB 4.47Å; W504-V695 HydrophobicContact CE3-CG1 3.93Å; W504-F728 WeakPolarHBondContact CB-O 3.06Å; W504-V729 HydrophobicContact CD2-CG2 3.9Å; W504-V729 HydrophobicContact CE3-CG2 3.71Å; W504-V729 HydrophobicContact CH2-CG2 3.72Å; W504-V729 HydrophobicContact CZ2-CG1 4.06Å; W504-V729 HydrophobicContact CZ2-CG2 3.9Å; W504-V729 HydrophobicContact CZ3-CG2 3.63Å; W504-P730 VanDerWaalsContact CD1-CD 3.43Å
505	Y	90.9	Very high	85.2	Confident	124 Å²	124	57.4 Å²	57.4	49%	0.486	34%	0.335	S	S	.	.			trans	-148.5	147.3	-178.1	60.8	-87.9	0	0	0	110.6	S503 V507 F728 P730	S503-Y505 WeakPolarHBondContact O-CD1 3.37Å; Y505-V507 HydrophobicContact CD2-CG2 3.74Å; Y505-V507 HydrophobicContact CE2-CG2 3.44Å; Y505-V507 VanDerWaalsContact CE2-CG2 3.44Å; Y505-F728 WeakPolarHBondContact O-CA 3.48Å; Y505-P730 HydrophobicContact CD1-CG 4.45Å; Y505-P730 HydrophobicContact CE1-CG 4.08Å
506	V	93	Very high	85.8	Confident	59 Å²	59	60.3 Å²	60.3	36%	0.358	34%	0.339	S	S	.	.			trans	-86.9	126.5	179.7	-174.1	0	0	0	0	110	T508 V699 V725 Q727 F728	V506-T508 HydrophobicContact CG1-CG2 4.07Å; V506-V699 HydrophobicContact CG2-CG2 3.83Å; V506-V725 HydrophobicContact CG1-CG1 3.89Å; V506-V725 HydrophobicContact CG1-CG2 3.93Å; V506-Q727 CarbonylContact C-O 3.52Å; V506-Q727 WeakPolarHBondContact CA-O 3.38Å; V506-F728 HydrophobicContact CG2-CB 4.32Å
507	V	91	Very high	86.6	Confident	23 Å²	23	57.7 Å²	57.7	14%	0.139	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	124.4	170.3	-176.2	0	0	0	0	108.6	N213 Y505 L726 Q727	N213-V507 HydrophobicContact CB-CG1 4.09Å; Y505-V507 HydrophobicContact CD2-CG2 3.74Å; Y505-V507 HydrophobicContact CE2-CG2 3.44Å; Y505-V507 VanDerWaalsContact CE2-CG2 3.44Å; V507-L726 PolarHBondContact O-N 3.34Å; V507-Q727 HydrophobicContact CB-CB 4.03Å; V507-Q727 HydrophobicContact CG2-CB 4.1Å; V507-Q727 PolarHBondContact N-O 3.12Å
508	T	91.8	Very high	87.7	Confident	37 Å²	37	51.5 Å²	51.5	23%	0.227	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	123.4	177.5	50.9	0	0	0	0	110.4	V506 L706 R723 Q724 V725	V506-T508 HydrophobicContact CG1-CG2 4.07Å; T508-L706 HydrophobicContact CG2-CD1 3.91Å; T508-R723 PolarHBondContact O-NH2 3Å; T508-R723 VanDerWaalsContact O-NH2 3.09Å; T508-R723 PolarHBondContact OG1-NH2 2.87Å; T508-Q724 WeakPolarHBondContact CA-O 3.4Å; T508-V725 HydrophobicContact CG2-CG2 4.16Å
509	G	88.9	Confident	88.7	Confident	3 Å²	3	48.9 Å²	48.9	3%	0.031	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	-167.8	-179.5	0	0	0	0	0	112	R723 Q724	G509-R723 CarbonylContact O-C 3.36Å; G509-R723 WeakPolarHBondContact O-CA 3.37Å; G509-R723 VanDerWaalsContact O-CB 3.29Å; G509-R723 WeakPolarHBondContact O-CB 3.35Å; G509-Q724 PolarHBondContact N-O 2.93Å; G509-Q724 PolarHBondContact O-N 3.03Å
510	A	88.9	Confident	89.4	Confident	58 Å²	58	47 Å²	47	48%	0.479	26%	0.256	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.8	149.8	171.5	0	0	0	0	0	110.6	L512 D722	A510-L512 PolarHBondContact O-N 3.03Å; A510-D722 CarbonylContact C-O 3.48Å; A510-D722 WeakPolarHBondContact CA-O 3.23Å
511	A	90.3	Very high	89.7	Confident	36 Å²	36	41.2 Å²	41.2	30%	0.298	23%	0.231	S	C	.	.	P	Polyproline II helix	trans	-55.4	135.9	170.9	0	0	0	0	0	110.2	P513 G721 D722	A511-P513 WeakPolarHBondContact O-CD 3.47Å; A511-G721 WeakPolarHBondContact CB-O 3.4Å; A511-D722 PolarHBondContact N-O 2.99Å
512	L	91.1	Very high	89.6	Confident	10 Å²	10	42.7 Å²	42.7	5%	0.052	24%	0.239	C	C	.	.	P	Polyproline II helix	trans	-67.8	130	179.8	-72.1	171.7	0	0	0	108.6	E186 A187 A510 A514 V515 L610 Q724 L726	E186-L512 HydrophobicContact CB-CD1 3.88Å; E186-L512 HydrophobicContact CB-CD2 4.11Å; E186-L512 HydrophobicContact CG-CD1 4.45Å; A187-L512 HydrophobicContact CB-CD2 3.68Å; A510-L512 PolarHBondContact O-N 3.03Å; L512-A514 VanDerWaalsContact C-N 3.34Å; L512-V515 HydrophobicContact CD1-CG2 4.29Å; L512-L610 HydrophobicContact CB-CD2 3.65Å; L512-L610 WeakPolarHBondContact O-CD2 3.48Å; L512-Q724 VanDerWaalsContact CD1-NE2 3.25Å; L512-L726 HydrophobicContact CD1-CD2 4.41Å; L512-L726 HydrophobicContact CD2-CD2 4.22Å; L512-L726 HydrophobicContact CG-CD2 4.05Å
513	P	90	Very high	89.3	Confident	100 Å²	100	37.1 Å²	37.1	65%	0.649	21%	0.209	S	C	*	.	S	Bend	trans	-76.7	-26.9	172.2	29.6	-34.7	0	0	0	112	A187 A511	A187-P513 HydrophobicContact CB-CG 4.19Å; A511-P513 WeakPolarHBondContact O-CD 3.47Å
514	A	91.5	Very high	89.1	Confident	3 Å²	3	36.3 Å²	36.3	3%	0.025	21%	0.205	C	C	.	.			trans	-170.6	155.9	177.1	0	0	0	0	0	109.2	A187 L512 R516 L609	A187-A514 WeakPolarHBondContact CA-O 3.45Å; L512-A514 VanDerWaalsContact C-N 3.34Å; A514-R516 HydrophobicContact CB-CG 3.95Å; A514-L609 CarbonylContact C-O 3.47Å; A514-L609 WeakPolarHBondContact CA-O 3.14Å; A514-L609 HydrophobicContact CB-CB 3.68Å
515	V	92	Very high	88.8	Confident	0 Å²	0	35.2 Å²	35.2	0%	0	20%	0.202	C	C	.	.			trans	-91	103.7	165.7	175.3	0	0	0	0	108	E186 L512 L526 N530 L609 L610 L646 T647	E186-V515 HydrophobicContact CB-CG1 4.22Å; E186-V515 HydrophobicContact CB-CG2 4.19Å; L512-V515 HydrophobicContact CD1-CG2 4.29Å; V515-L526 HydrophobicContact CG1-CD2 4.43Å; V515-N530 PolarHBondContact O-ND2 2.62Å; V515-L609 PolarHBondContact N-O 3.05Å; V515-L610 WeakPolarHBondContact CG2-O 3.41Å; V515-L646 HydrophobicContact CG1-CB 3.98Å; V515-L646 HydrophobicContact CG1-CD1 4.48Å; V515-T647 HydrophobicContact CG2-CG2 3.76Å
516	R	89.6	Confident	88.7	Confident	115 Å²	115	29.3 Å²	29.3	43%	0.434	18%	0.178	S	C	.	.			trans	-108	-11.4	-177.5	-59.3	-177	172.7	-152.6	-2.4	113	E186 A514 L523	E186-R516 PolarHBondContact O-N 2.94Å; A514-R516 HydrophobicContact CB-CG 3.95Å; R516-L523 WeakPolarHBondContact O-CD1 3.47Å
517	N	89	Confident	88.4	Confident	14 Å²	14	29.5 Å²	29.5	8%	0.075	18%	0.178	C	C	.	.			trans	-149.5	148	-178.6	-179.6	37	0	0	0	109.9	P183 E186 N188 L523	P183-N517 PolarHBondContact O-ND2 3.09Å; E186-N517 WeakPolarHBondContact CA-O 3.46Å; E186-N517 PolarHBondContact O-N 2.87Å; N188-N517 WeakPolarHBondContact O-CB 3.38Å; N188-N517 PolarHBondContact O-ND2 2.9Å; N517-L523 HydrophobicContact CB-CD1 4.41Å
518	S	88.9	Confident	88.2	Confident	3 Å²	3	29.9 Å²	29.9	2%	0.021	18%	0.178	C	C	.	.			trans	-157.6	134.8	174.7	179.1	0	0	0	0	109.3	F520 L646	S518-F520 PolarHBondContact O-N 2.8Å; S518-F520 WeakPolarHBondContact OG-CB 3.47Å; S518-F520 PolarHBondContact OG-N 3.45Å; S518-L646 VanDerWaalsContact CB-O 3.24Å; S518-L646 WeakPolarHBondContact CB-O 3.3Å; S518-L646 PolarHBondContact OG-O 3.11Å
519	P	86.4	Confident	88	Confident	5 Å²	5	28.2 Å²	28.2	3%	0.032	17%	0.167	C	C	.	.	T	Hydrogen-bonded Turn	trans	-69.1	-8.8	169.5	30.3	-33.8	0	0	0	112.2	Y184 A435 M731	Y184-P519 HydrophobicContact CD1-CB 4.2Å; Y184-P519 HydrophobicContact CD1-CG 4.14Å; A435-P519 HydrophobicContact CB-CB 3.79Å; A435-P519 VanDerWaalsContact O-O 3.06Å; P519-M731 HydrophobicContact CG-CE 4.06Å
520	F	90.2	Very high	88.1	Confident	0 Å²	0	28.4 Å²	28.4	0%	0	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.8	18.8	-171.9	-47.5	-60	0	0	0	113.1	S518 R648 A651 M731 L734 T740 L743 W744 N747	S518-F520 PolarHBondContact O-N 2.8Å; S518-F520 WeakPolarHBondContact OG-CB 3.47Å; S518-F520 PolarHBondContact OG-N 3.45Å; F520-R648 HydrophobicContact CE2-CG 4.19Å; F520-A651 HydrophobicContact CD2-CB 3.69Å; F520-A651 HydrophobicContact CE1-CB 4.22Å; F520-A651 HydrophobicContact CE2-CB 3.33Å; F520-A651 HydrophobicContact CG-CB 4.28Å; F520-A651 HydrophobicContact CZ-CB 3.63Å; F520-M731 HydrophobicContact CZ-CE 4.2Å; F520-L734 HydrophobicContact CE1-CB 4.41Å; F520-L734 HydrophobicContact CZ-CB 4.2Å; F520-L734 HydrophobicContact CZ-CD1 4.14Å; F520-T740 HydrophobicContact CD1-CG2 4.46Å; F520-L743 HydrophobicContact CB-CB 3.93Å; F520-L743 HydrophobicContact CB-CD1 4.42Å; F520-L743 HydrophobicContact CD1-CB 4.3Å; F520-L743 HydrophobicContact CD1-CD1 3.68Å; F520-L743 HydrophobicContact CE1-CD1 4.06Å; F520-L743 HydrophobicContact CG-CB 4.37Å; F520-L743 HydrophobicContact CG-CD1 4Å; F520-L743 CarbonylContact O-C 3.55Å; F520-W744 VanDerWaalsContact O-CA 3.24Å; F520-W744 WeakPolarHBondContact O-CA 3.12Å; F520-W744 PolarHBondContact O-N 2.72Å; F520-N747 WeakPolarHBondContact O-CB 3.45Å; F520-N747 PolarHBondContact O-ND2 3.2Å
521	C	87.3	Confident	88	Confident	5 Å²	5	27.8 Å²	27.8	3%	0.034	16%	0.155	C	C	.	.	S	Bend	trans	-152.5	170.9	177.4	75.4	0	0	0	0	113.7	L523 L646 W744 N747	C521-L523 PolarHBondContact O-N 3.05Å; C521-L646 HydrophobicContact CB-CD2 3.57Å; C521-W744 PolarHBondContact O-NE1 2.89Å; C521-N747 HydrophobicContact CB-CB 3.87Å
522	D	84.6	Confident	87.9	Confident	43 Å²	43	26.1 Å²	26.1	23%	0.23	14%	0.141	C	C	.	.			trans	-72.8	114.6	163.6	-175.2	-59.4	0	0	0	109.5	Q474 A524 L525 L526 W744	Q474-D522 PolarHBondContact NE2-OD1 2.99Å; Q474-D522 PolarHBondContact NE2-OD2 2.62Å; D522-A524 VanDerWaalsContact C-N 3.28Å; D522-A524 PolarHBondContact O-N 2.95Å; D522-A524 WeakPolarHBondContact OD1-CA 3.3Å; D522-A524 WeakPolarHBondContact OD1-CB 3.3Å; D522-A524 PolarHBondContact OD1-N 3.24Å; D522-L525 HydrophobicContact CB-CB 4.12Å; D522-L525 HydrophobicContact CB-CD1 3.97Å; D522-L525 HydrophobicContact CB-CG 4.07Å; D522-L525 PolarHBondContact O-N 3.15Å; D522-L525 PolarHBondContact OD1-N 3.44Å; D522-L526 PolarHBondContact O-N 2.69Å; D522-W744 HydrophobicContact CB-CZ2 3.96Å
523	L	82	Confident	87.7	Confident	53 Å²	53	26.1 Å²	26.1	28%	0.277	14%	0.141	S	C	.	.	H	α-helix	trans	-64.8	-29.7	-176.3	-173.2	62	0	0	0	112.9	R516 N517 C521 L526 N527	R516-L523 WeakPolarHBondContact O-CD1 3.47Å; N517-L523 HydrophobicContact CB-CD1 4.41Å; C521-L523 PolarHBondContact O-N 3.05Å; L523-L526 HydrophobicContact CD1-CD2 4.41Å; L523-N527 WeakPolarHBondContact O-CB 3.5Å; L523-N527 PolarHBondContact O-N 3Å; L523-N527 PolarHBondContact O-ND2 3.34Å
524	A	81.3	Confident	87.5	Confident	44 Å²	44	25.5 Å²	25.5	36%	0.364	13%	0.13	S	C	.	.	H	α-helix	trans	-71.5	-41.2	177.3	0	0	0	0	0	111.1	D522 N527 H528	D522-A524 VanDerWaalsContact C-N 3.28Å; D522-A524 PolarHBondContact O-N 2.95Å; D522-A524 WeakPolarHBondContact OD1-CA 3.3Å; D522-A524 WeakPolarHBondContact OD1-CB 3.3Å; D522-A524 PolarHBondContact OD1-N 3.24Å; A524-N527 PolarHBondContact O-N 3.23Å; A524-H528 PolarHBondContact O-CD2 3.4Å; A524-H528 VanDerWaalsContact O-CD2 3.32Å; A524-H528 PolarHBondContact O-N 3.01Å
525	L	86.1	Confident	87.1	Confident	4 Å²	4	28.1 Å²	28.1	2%	0.021	14%	0.143	C	C	.	.	H	α-helix	trans	-62	-44.5	172.7	-71.8	-179.9	0	0	0	111.7	Q474 I478 D522 N527 H528 L529 T751 L755	Q474-L525 HydrophobicContact CB-CD2 4.31Å; Q474-L525 HydrophobicContact CG-CD2 4.3Å; I478-L525 HydrophobicContact CD1-CD2 4.09Å; I478-L525 HydrophobicContact CG1-CD2 4.1Å; D522-L525 HydrophobicContact CB-CB 4.12Å; D522-L525 HydrophobicContact CB-CD1 3.97Å; D522-L525 HydrophobicContact CB-CG 4.07Å; D522-L525 PolarHBondContact O-N 3.15Å; D522-L525 PolarHBondContact OD1-N 3.44Å; L525-N527 VanDerWaalsContact C-N 3.33Å; L525-N527 PolarHBondContact O-N 3.38Å; L525-H528 PolarHBondContact O-N 3.03Å; L525-L529 PolarHBondContact O-N 2.69Å; L525-T751 HydrophobicContact CB-CG2 3.74Å; L525-T751 WeakPolarHBondContact O-CG2 3.07Å; L525-L755 HydrophobicContact CD2-CD1 4.36Å
526	L	87.9	Confident	86.2	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-60.4	-42.5	176.6	178.2	60.5	0	0	0	111.8	V515 D522 L523 L529 N530 L646	V515-L526 HydrophobicContact CG1-CD2 4.43Å; D522-L526 PolarHBondContact O-N 2.69Å; L523-L526 HydrophobicContact CD1-CD2 4.41Å; L526-L529 PolarHBondContact O-N 3.13Å; L526-N530 WeakPolarHBondContact O-CB 3.42Å; L526-N530 PolarHBondContact O-N 3.08Å; L526-L646 HydrophobicContact CD1-CD1 3.95Å
527	N	86.9	Confident	85.5	Confident	64 Å²	64	31.2 Å²	31.2	34%	0.342	19%	0.193	S	C	.	.	H	α-helix	trans	-62.1	-45.2	176.9	-75.8	-34.1	0	0	0	112	L523 A524 L525 L529 N530 E531	L523-N527 WeakPolarHBondContact O-CB 3.5Å; L523-N527 PolarHBondContact O-N 3Å; L523-N527 PolarHBondContact O-ND2 3.34Å; A524-N527 PolarHBondContact O-N 3.23Å; L525-N527 VanDerWaalsContact C-N 3.33Å; L525-N527 PolarHBondContact O-N 3.38Å; N527-L529 VanDerWaalsContact C-N 3.33Å; N527-L529 PolarHBondContact O-N 3.29Å; N527-N530 PolarHBondContact O-N 3.49Å; N527-E531 VanDerWaalsContact O-CB 3.31Å; N527-E531 WeakPolarHBondContact O-CB 3.35Å; N527-E531 PolarHBondContact O-N 2.81Å
528	H	87.3	Confident	84.8	Confident	31 Å²	31	31.6 Å²	31.6	14%	0.144	20%	0.196	C	C	.	.	H	α-helix	trans	-61.3	-40.7	175.5	-75.9	-45	0	0	0	112.4	I469 Q474 A524 L525 E531 A532 L755	I469-H528 HydrophobicContact CD1-CB 4.08Å; I469-H528 HydrophobicContact CG1-CB 4.2Å; Q474-H528 PolarHBondContact OE1-CD2 3.03Å; A524-H528 PolarHBondContact O-CD2 3.4Å; A524-H528 VanDerWaalsContact O-CD2 3.32Å; A524-H528 PolarHBondContact O-N 3.01Å; L525-H528 PolarHBondContact O-N 3.03Å; H528-E531 IonicContact ND1-OE2 3.45Å; H528-E531 PolarHBondContact O-N 2.77Å; H528-A532 PolarHBondContact O-N 3.26Å; H528-L755 HydrophobicContact CB-CD1 3.97Å; H528-L755 HydrophobicContact CB-CD2 4.36Å
529	L	88.9	Confident	84.1	Confident	1 Å²	1	34.8 Å²	34.8	1%	0.005	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-45.4	176.7	179	61.6	0	0	0	111.6	L525 L526 N527 E531 A532 L533 H611 T751 K754 L755 L758	L525-L529 PolarHBondContact O-N 2.69Å; L526-L529 PolarHBondContact O-N 3.13Å; N527-L529 VanDerWaalsContact C-N 3.33Å; N527-L529 PolarHBondContact O-N 3.29Å; L529-E531 VanDerWaalsContact C-N 3.28Å; L529-E531 PolarHBondContact O-N 3.2Å; L529-A532 PolarHBondContact O-N 3.44Å; L529-L533 HydrophobicContact CD1-CD1 3.86Å; L529-L533 HydrophobicContact CD1-CG 4.04Å; L529-L533 HydrophobicContact CD2-CD1 4.5Å; L529-L533 HydrophobicContact CG-CD1 3.83Å; L529-L533 HydrophobicContact CG-CG 4.39Å; L529-L533 WeakPolarHBondContact O-CB 3.22Å; L529-L533 VanDerWaalsContact O-CG 3.26Å; L529-L533 WeakPolarHBondContact O-CG 3.47Å; L529-L533 PolarHBondContact O-N 3.34Å; L529-H611 VanDerWaalsContact CD2-CE1 3.47Å; L529-H611 WeakPolarHBondContact CD2-CE1 3.49Å; L529-T751 HydrophobicContact CB-CG2 3.87Å; L529-T751 HydrophobicContact CD2-CG2 3.86Å; L529-T751 HydrophobicContact CG-CG2 4.46Å; L529-K754 HydrophobicContact CD1-CB 3.85Å; L529-K754 HydrophobicContact CD1-CD 4.49Å; L529-K754 HydrophobicContact CD2-CB 4.45Å; L529-K754 HydrophobicContact CD2-CD 4.04Å; L529-L755 HydrophobicContact CB-CD1 4.36Å; L529-L755 HydrophobicContact CB-CD2 4.21Å; L529-L755 HydrophobicContact CB-CG 4.16Å; L529-L755 HydrophobicContact CD1-CD2 4.25Å; L529-L755 HydrophobicContact CD1-CG 4.24Å; L529-L758 HydrophobicContact CD1-CD1 4.08Å
530	N	89.7	Confident	83.6	Confident	8 Å²	8	36 Å²	36	4%	0.043	22%	0.217	C	C	.	.	H	α-helix	trans	-61.4	-38.4	176.6	-80.2	-21.9	0	0	0	112.2	V515 L526 N527 L533 Q534 L609 H611	V515-N530 PolarHBondContact O-ND2 2.62Å; L526-N530 WeakPolarHBondContact O-CB 3.42Å; L526-N530 PolarHBondContact O-N 3.08Å; N527-N530 PolarHBondContact O-N 3.49Å; N530-L533 PolarHBondContact O-N 2.99Å; N530-Q534 WeakPolarHBondContact O-CB 3.19Å; N530-Q534 VanDerWaalsContact O-CG 3.23Å; N530-Q534 WeakPolarHBondContact O-CG 3.47Å; N530-Q534 PolarHBondContact O-N 2.88Å; N530-L609 HydrophobicContact CB-CD2 4.38Å; N530-H611 PolarHBondContact OD1-NE2 3.14Å
531	E	87.6	Confident	82.7	Confident	45 Å²	45	39.6 Å²	39.6	21%	0.21	24%	0.239	C	C	.	.	H	α-helix	trans	-64.2	-46.1	176.2	-166.4	-169.1	156.9	0	0	111.6	W465 R468 N527 H528 L529 L533 Q534	W465-E531 WeakPolarHBondContact CA-OE1 3.34Å; W465-E531 HydrophobicContact CB-CG 3.78Å; W465-E531 WeakPolarHBondContact CB-OE1 3.14Å; R468-E531 IonicContact CZ-OE1 2.69Å; R468-E531 IonicContact NE-OE1 2.94Å; R468-E531 PolarHBondContact NE-OE1 2.94Å; R468-E531 IonicContact NE-OE2 3.03Å; R468-E531 IonicContact NH2-OE1 2.77Å; R468-E531 PolarHBondContact NH2-OE1 2.97Å; N527-E531 VanDerWaalsContact O-CB 3.31Å; N527-E531 WeakPolarHBondContact O-CB 3.35Å; N527-E531 PolarHBondContact O-N 2.81Å; H528-E531 IonicContact ND1-OE2 3.45Å; H528-E531 PolarHBondContact O-N 2.77Å; L529-E531 VanDerWaalsContact C-N 3.28Å; L529-E531 PolarHBondContact O-N 3.2Å; E531-L533 PolarHBondContact O-N 3.31Å; E531-Q534 PolarHBondContact O-N 2.97Å
532	A	87.8	Confident	82	Confident	0 Å²	0	44.8 Å²	44.8	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-62.5	-40.9	176.1	0	0	0	0	0	112.1	W465 H528 L529 Q534 D535 L755 L758	W465-A532 HydrophobicContact CD2-CB 3.82Å; W465-A532 HydrophobicContact CE3-CB 3.66Å; W465-A532 HydrophobicContact CH2-CB 3.84Å; W465-A532 HydrophobicContact CZ2-CB 3.97Å; W465-A532 HydrophobicContact CZ3-CB 3.69Å; H528-A532 PolarHBondContact O-N 3.26Å; L529-A532 PolarHBondContact O-N 3.44Å; A532-Q534 VanDerWaalsContact C-N 3.31Å; A532-Q534 PolarHBondContact O-N 3.3Å; A532-D535 WeakPolarHBondContact O-CB 3.38Å; A532-D535 PolarHBondContact O-N 3Å; A532-L755 HydrophobicContact CB-CD2 4.23Å; A532-L758 HydrophobicContact CB-CD1 3.88Å
533	L	86.6	Confident	81.4	Confident	11 Å²	11	43.8 Å²	43.8	6%	0.058	26%	0.261	C	S	.	.	H	α-helix	trans	-76.4	-13	179.4	-66.4	173.8	0	0	0	114.1	L529 N530 E531 W540 L609 L758	L529-L533 HydrophobicContact CD1-CD1 3.86Å; L529-L533 HydrophobicContact CD1-CG 4.04Å; L529-L533 HydrophobicContact CD2-CD1 4.5Å; L529-L533 HydrophobicContact CG-CD1 3.83Å; L529-L533 HydrophobicContact CG-CG 4.39Å; L529-L533 WeakPolarHBondContact O-CB 3.22Å; L529-L533 VanDerWaalsContact O-CG 3.26Å; L529-L533 WeakPolarHBondContact O-CG 3.47Å; L529-L533 PolarHBondContact O-N 3.34Å; N530-L533 PolarHBondContact O-N 2.99Å; E531-L533 PolarHBondContact O-N 3.31Å; L533-W540 HydrophobicContact CD2-CB 4.09Å; L533-L609 HydrophobicContact CB-CD2 3.95Å; L533-L758 HydrophobicContact CD2-CD1 4.23Å
534	Q	86.8	Confident	80.9	Confident	87 Å²	87	45.9 Å²	45.9	41%	0.407	28%	0.276	S	S	.	.	H	α-helix	trans	-79.2	-24.6	172.1	-82.1	170.9	28	0	0	112.4	N530 E531 A532 A536 R607 L609	N530-Q534 WeakPolarHBondContact O-CB 3.19Å; N530-Q534 VanDerWaalsContact O-CG 3.23Å; N530-Q534 WeakPolarHBondContact O-CG 3.47Å; N530-Q534 PolarHBondContact O-N 2.88Å; E531-Q534 PolarHBondContact O-N 2.97Å; A532-Q534 VanDerWaalsContact C-N 3.31Å; A532-Q534 PolarHBondContact O-N 3.3Å; Q534-A536 PolarHBondContact O-N 3.03Å; Q534-R607 PolarHBondContact O-NE 2.82Å; Q534-R607 PolarHBondContact O-NH2 3.11Å; Q534-L609 HydrophobicContact CG-CD1 3.76Å; Q534-L609 HydrophobicContact CG-CD2 3.83Å; Q534-L609 HydrophobicContact CG-CG 4.41Å
535	D	82.8	Confident	80.5	Confident	58 Å²	58	47.7 Å²	47.7	31%	0.31	28%	0.284	S	S	.	.			trans	-62.5	122	177.2	-169.6	-18.1	0	0	0	110.2	W465 A532 A537 V538	W465-D535 PolarHBondContact NE1-OD2 3.15Å; A532-D535 WeakPolarHBondContact O-CB 3.38Å; A532-D535 PolarHBondContact O-N 3Å; D535-A537 PolarHBondContact O-N 3.32Å; D535-A537 WeakPolarHBondContact OD1-CB 3.48Å; D535-A537 PolarHBondContact OD1-N 2.86Å; D535-V538 HydrophobicContact CB-CB 4.38Å; D535-V538 HydrophobicContact CB-CG2 3.94Å; D535-V538 PolarHBondContact O-N 2.9Å
536	A	72.5	Confident	80.2	Confident	88 Å²	88	48.2 Å²	48.2	73%	0.727	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.5	-17.9	-177.9	0	0	0	0	0	113.1	Q534 V538	Q534-A536 PolarHBondContact O-N 3.03Å; A536-V538 VanDerWaalsContact C-N 3.31Å
537	A	74.6	Confident	79.5	Confident	91 Å²	91	54.3 Å²	54.3	75%	0.752	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82	-10	176.8	0	0	0	0	0	113.3	D535	D535-A537 PolarHBondContact O-N 3.32Å; D535-A537 WeakPolarHBondContact OD1-CB 3.48Å; D535-A537 PolarHBondContact OD1-N 2.86Å
538	V	74.4	Confident	79.2	Confident	22 Å²	22	54.7 Å²	54.7	13%	0.133	34%	0.337	C	S	.	.			trans	-94	119.8	-179.2	170.2	0	0	0	0	109.9	W465 D535 A536 L758	W465-V538 HydrophobicContact CZ2-CG2 3.99Å; D535-V538 HydrophobicContact CB-CB 4.38Å; D535-V538 HydrophobicContact CB-CG2 3.94Å; D535-V538 PolarHBondContact O-N 2.9Å; A536-V538 VanDerWaalsContact C-N 3.31Å; V538-L758 HydrophobicContact CG1-CD1 4.45Å; V538-L758 HydrophobicContact CG1-CD2 3.31Å; V538-L758 HydrophobicContact CG1-CG 4.48Å
539	D	74.8	Confident	78.8	Confident	70 Å²	70	54.1 Å²	54.1	37%	0.374	34%	0.336	S	S	.	.			trans	-115	98.5	167.6	-170.1	-16.5	0	0	0	110.2	T541 L542	D539-T541 PolarHBondContact O-N 2.9Å; D539-T541 WeakPolarHBondContact OD1-CB 3.25Å; D539-T541 PolarHBondContact OD1-N 3.31Å; D539-T541 PolarHBondContact OD1-OG1 2.94Å; D539-T541 PolarHBondContact OD2-OG1 2.91Å; D539-L542 HydrophobicContact CB-CB 4.4Å; D539-L542 HydrophobicContact CB-CD1 3.96Å; D539-L542 HydrophobicContact CB-CG 4.11Å; D539-L542 PolarHBondContact O-N 3.29Å; D539-L542 WeakPolarHBondContact OD2-CD1 3.44Å
540	W	75.5	Confident	77.8	Confident	31 Å²	31	56.5 Å²	56.5	12%	0.117	35%	0.353	C	S	.	.	G	3₁₀ helix	trans	-56.2	-25.6	179.9	174.9	-98	0	0	0	113.5	L533 L542 V543 I608 V675 K754 L757 L758	L533-W540 HydrophobicContact CD2-CB 4.09Å; W540-L542 VanDerWaalsContact C-N 3.28Å; W540-L542 PolarHBondContact O-N 3.07Å; W540-V543 HydrophobicContact CD2-CG2 4.48Å; W540-V543 HydrophobicContact CE3-CG2 3.93Å; W540-V543 HydrophobicContact CZ3-CG2 4.2Å; W540-V543 WeakPolarHBondContact O-CG2 3.05Å; W540-I608 HydrophobicContact CB-CD1 4.19Å; W540-I608 HydrophobicContact CG-CD1 4.22Å; W540-V675 HydrophobicContact CH2-CB 4Å; W540-V675 HydrophobicContact CH2-CG2 3.58Å; W540-V675 HydrophobicContact CZ2-CB 3.43Å; W540-V675 VanDerWaalsContact CZ2-CB 3.43Å; W540-V675 HydrophobicContact CZ2-CG1 4.37Å; W540-V675 HydrophobicContact CZ2-CG2 3.31Å; W540-K754 HydrophobicContact CH2-CB 3.89Å; W540-K754 HydrophobicContact CH2-CG 3.71Å; W540-K754 HydrophobicContact CZ2-CG 3.86Å; W540-K754 HydrophobicContact CZ3-CB 3.89Å; W540-K754 HydrophobicContact CZ3-CG 4.14Å; W540-K754 VanDerWaalsContact CZ3-O 3.28Å; W540-K754 WeakPolarHBondContact CZ3-O 3.46Å; W540-L757 HydrophobicContact CH2-CB 4.15Å; W540-L757 HydrophobicContact CH2-CD1 3.88Å; W540-L757 HydrophobicContact CZ3-CB 4.13Å; W540-L758 HydrophobicContact CE3-CD1 4.08Å; W540-L758 HydrophobicContact CE3-CD2 3.63Å; W540-L758 HydrophobicContact CE3-CG 3.64Å; W540-L758 HydrophobicContact CZ3-CD1 4.42Å; W540-L758 HydrophobicContact CZ3-CD2 4.16Å; W540-L758 HydrophobicContact CZ3-CG 3.78Å
541	T	71.5	Confident	76.6	Confident	76 Å²	76	59.8 Å²	59.8	47%	0.466	37%	0.373	S	S	.	.	G	3₁₀ helix	trans	-77	-15.4	-178.4	69.3	0	0	0	0	113.5	D539	D539-T541 PolarHBondContact O-N 2.9Å; D539-T541 WeakPolarHBondContact OD1-CB 3.25Å; D539-T541 PolarHBondContact OD1-N 3.31Å; D539-T541 PolarHBondContact OD1-OG1 2.94Å; D539-T541 PolarHBondContact OD2-OG1 2.91Å
542	L	72.1	Confident	75.4	Confident	114 Å²	114	58.3 Å²	58.3	60%	0.597	37%	0.368	S	S	*	.	G	3₁₀ helix	trans	-101.5	-2.1	-177.8	-59.6	-179.5	0	0	0	113.3	D539 W540 T544	D539-L542 HydrophobicContact CB-CB 4.4Å; D539-L542 HydrophobicContact CB-CD1 3.96Å; D539-L542 HydrophobicContact CB-CG 4.11Å; D539-L542 PolarHBondContact O-N 3.29Å; D539-L542 WeakPolarHBondContact OD2-CD1 3.44Å; W540-L542 VanDerWaalsContact C-N 3.28Å; W540-L542 PolarHBondContact O-N 3.07Å; L542-T544 PolarHBondContact O-N 2.94Å
543	V	72.1	Confident	74.5	Confident	21 Å²	21	61.1 Å²	61.1	13%	0.127	39%	0.388	C	S	.	.	P	Polyproline II helix	trans	-66.9	126.5	-174.9	-173.2	0	0	0	0	111	W540 L757 L758 E761	W540-V543 HydrophobicContact CD2-CG2 4.48Å; W540-V543 HydrophobicContact CE3-CG2 3.93Å; W540-V543 HydrophobicContact CZ3-CG2 4.2Å; W540-V543 WeakPolarHBondContact O-CG2 3.05Å; V543-L757 HydrophobicContact CG1-CB 3.58Å; V543-L758 HydrophobicContact CG2-CD2 3.93Å; V543-E761 WeakPolarHBondContact CG2-OE2 3.36Å
544	T	71.1	Confident	73.9	Confident	98 Å²	98	62.2 Å²	62.2	60%	0.601	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-80.8	150.8	-179.3	55.2	0	0	0	0	112.4	L542	L542-T544 PolarHBondContact O-N 2.94Å
545	P	74.1	Confident	73.2	Confident	81 Å²	81	59.2 Å²	59.2	53%	0.526	38%	0.384	S	S	.	.	P	Polyproline II helix	trans	-63.4	140.4	174.4	-19.4	31	0	0	0	112.3	C547 P671	P545-C547 PolarHBondContact O-N 2.64Å; P545-P671 HydrophobicContact CB-CG 4.1Å; P545-P671 HydrophobicContact CG-CG 4.18Å
546	C	78.7	Confident	73	Confident	15 Å²	15	59 Å²	59	10%	0.101	39%	0.387	C	S	.	.	P	Polyproline II helix	trans	-72	121.9	173.3	-180	0	0	0	0	111.3	H481 S548 C549 L757 Q760	H481-C546 PolarHBondContact ND1-SG 3.47Å; C546-S548 PolarHBondContact O-N 3.44Å; C546-C549 HydrophobicContact CB-CB 4.08Å; C546-C549 WeakPolarHBondContact CB-SG 3.48Å; C546-C549 PolarHBondContact O-N 3.45Å; C546-L757 HydrophobicContact CB-CD2 3.9Å; C546-Q760 PolarHBondContact SG-NE2 2.94Å; C546-Q760 PolarHBondContact SG-OE1 3.05Å
547	C	74.7	Confident	73.2	Confident	128 Å²	128	54.9 Å²	54.9	87%	0.865	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.7	-16.6	-179.7	62.8	0	0	0	0	115	P545	P545-C547 PolarHBondContact O-N 2.64Å
548	S	80.3	Confident	73.4	Confident	73 Å²	73	50.6 Å²	50.6	51%	0.51	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-101.2	-5.1	-178.7	-61.1	0	0	0	0	113.2	C546	C546-S548 PolarHBondContact O-N 3.44Å
549	C	77.8	Confident	73.6	Confident	19 Å²	19	53.5 Å²	53.5	13%	0.128	34%	0.339	C	S	.	.	S	Bend	trans	-79.4	133.9	171.7	-71	0	0	0	0	109.9	C482 C546	C482-C549 HydrophobicContact CB-CB 4Å; C482-C549 PolarHBondContact N-SG 3.39Å; C482-C549 WeakPolarHBondContact O-CA 3.42Å; C546-C549 HydrophobicContact CB-CB 4.08Å; C546-C549 WeakPolarHBondContact CB-SG 3.48Å; C546-C549 PolarHBondContact O-N 3.45Å
550	S	67.6	Low	73.7	Confident	51 Å²	51	52.4 Å²	52.4	36%	0.357	33%	0.332	S	S	.	.			trans	-84.5	145.6	174.4	56.9	0	0	0	0	111.7	C482 T483 E484	C482-S550 PolarHBondContact O-N 3.21Å; T483-S550 WeakPolarHBondContact CA-OG 3.35Å; E484-S550 PolarHBondContact N-OG 3.06Å; E484-S550 VanDerWaalsContact N-OG 3.11Å
551	V	64.5	Low	73.6	Confident	77 Å²	77	51 Å²	51	47%	0.467	33%	0.327	S	S	.	.			trans	-104.1	117.7	-168.8	175.7	0	0	0	0	108.3	C553 P670	V551-C553 PolarHBondContact O-N 3.25Å; V551-P670 HydrophobicContact CB-CG 3.58Å; V551-P670 HydrophobicContact CG1-CG 3.43Å; V551-P670 VanDerWaalsContact CG1-CG 3.43Å; V551-P670 HydrophobicContact CG2-CB 4.31Å; V551-P670 HydrophobicContact CG2-CG 3.29Å
552	A	63.2	Low	73.7	Confident	13 Å²	13	51.8 Å²	51.8	11%	0.107	32%	0.323	C	S	.	.			trans	-56.8	109.8	167.4	0	0	0	0	0	108.3
553	C	68.7	Low	73.2	Confident	60 Å²	60	47.8 Å²	47.8	41%	0.405	31%	0.31	S	S	.	.			trans	-67.5	140.1	-176.8	70.1	0	0	0	0	109.5	V551 A555 S556 I557	V551-C553 PolarHBondContact O-N 3.25Å; C553-A555 PolarHBondContact O-N 3.28Å; C553-A555 VanDerWaalsContact O-N 3.07Å; C553-S556 WeakPolarHBondContact O-CB 3.24Å; C553-S556 PolarHBondContact O-N 2.88Å; C553-S556 PolarHBondContact SG-N 3.03Å; C553-I557 PolarHBondContact O-N 3.19Å
554	T	73.8	Confident	72.3	Confident	33 Å²	33	55.5 Å²	55.5	20%	0.202	35%	0.349	C	S	.	.	H	α-helix	trans	-56.6	-27.9	-179.5	40.9	0	0	0	0	112.4	I557 L558 A581 W582 A585	T554-I557 PolarHBondContact O-N 3.36Å; T554-L558 WeakPolarHBondContact O-CG 3.37Å; T554-L558 PolarHBondContact O-N 2.93Å; T554-A581 WeakPolarHBondContact CG2-O 3.32Å; T554-W582 HydrophobicContact CG2-CD2 4.02Å; T554-W582 HydrophobicContact CG2-CE3 3.83Å; T554-W582 HydrophobicContact CG2-CH2 4.3Å; T554-W582 HydrophobicContact CG2-CZ2 4.48Å; T554-W582 HydrophobicContact CG2-CZ3 3.98Å; T554-A585 VanDerWaalsContact OG1-CB 3.3Å; T554-A585 WeakPolarHBondContact OG1-CB 3.39Å
555	A	72.9	Confident	71.2	Confident	24 Å²	24	57.8 Å²	57.8	20%	0.198	35%	0.353	C	S	.	.	H	α-helix	trans	-63.1	-39.6	172.2	0	0	0	0	0	113.7	C553 L558 S559 A585	C553-A555 PolarHBondContact O-N 3.28Å; C553-A555 VanDerWaalsContact O-N 3.07Å; A555-L558 PolarHBondContact O-N 3.33Å; A555-S559 PolarHBondContact O-N 3.47Å; A555-A585 HydrophobicContact CB-CB 4.39Å
556	S	77.3	Confident	70	Confident	53 Å²	53	58.1 Å²	58.1	37%	0.371	37%	0.371	S	S	.	.	H	α-helix	trans	-64.9	-41.4	176.1	-176.8	0	0	0	0	111.2	C553 S559 E560	C553-S556 WeakPolarHBondContact O-CB 3.24Å; C553-S556 PolarHBondContact O-N 2.88Å; C553-S556 PolarHBondContact SG-N 3.03Å; S556-S559 WeakPolarHBondContact O-CB 3.35Å; S556-S559 PolarHBondContact O-N 3.29Å; S556-E560 PolarHBondContact O-N 3.35Å; S556-E560 VanDerWaalsContact O-N 3.15Å
557	I	78.1	Confident	68.6	Low	3 Å²	3	60.5 Å²	60.5	2%	0.015	39%	0.388	C	S	.	.	H	α-helix	trans	-65.2	-43	177.8	-54.4	177.5	0	0	0	111.2	C553 T554 S559 E560 A561 W582 L639 R667 L678	C553-I557 PolarHBondContact O-N 3.19Å; T554-I557 PolarHBondContact O-N 3.36Å; I557-S559 VanDerWaalsContact C-N 3.3Å; I557-S559 PolarHBondContact O-N 3.04Å; I557-E560 WeakPolarHBondContact O-CB 3.5Å; I557-E560 PolarHBondContact O-N 3.27Å; I557-A561 PolarHBondContact O-N 2.94Å; I557-W582 HydrophobicContact CB-CH2 4.2Å; I557-W582 HydrophobicContact CB-CZ3 4.4Å; I557-W582 HydrophobicContact CD1-CH2 4.38Å; I557-W582 HydrophobicContact CG2-CH2 3.9Å; I557-W582 HydrophobicContact CG2-CZ3 4.44Å; I557-L639 HydrophobicContact CG2-CD2 4.34Å; I557-R667 HydrophobicContact CD1-CB 4.41Å; I557-R667 HydrophobicContact CD1-CG 4.48Å; I557-R667 HydrophobicContact CG1-CG 4.3Å; I557-L678 HydrophobicContact CD1-CD2 4.03Å; I557-L678 HydrophobicContact CG2-CD2 3.93Å
558	L	78.4	Confident	67.5	Low	0 Å²	0	65 Å²	65	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-66	-33.1	175.8	-67.9	179	0	0	0	112.7	T554 A555 E560 A561 K562 W582 A585 V589 L594 L639	T554-L558 WeakPolarHBondContact O-CG 3.37Å; T554-L558 PolarHBondContact O-N 2.93Å; A555-L558 PolarHBondContact O-N 3.33Å; L558-E560 VanDerWaalsContact C-N 3.32Å; L558-A561 PolarHBondContact O-N 3.33Å; L558-K562 PolarHBondContact O-N 3.21Å; L558-K562 VanDerWaalsContact O-N 3.15Å; L558-W582 HydrophobicContact CD1-CE3 4.33Å; L558-W582 HydrophobicContact CD1-CZ3 4.49Å; L558-W582 HydrophobicContact CD2-CE3 4.06Å; L558-W582 HydrophobicContact CD2-CZ3 3.74Å; L558-W582 HydrophobicContact CG-CE3 4.13Å; L558-W582 HydrophobicContact CG-CZ3 3.81Å; L558-A585 HydrophobicContact CD1-CB 3.78Å; L558-V589 HydrophobicContact CB-CG2 3.85Å; L558-V589 HydrophobicContact CD1-CB 4.45Å; L558-V589 HydrophobicContact CD1-CG2 3.71Å; L558-V589 HydrophobicContact CG-CG2 4.43Å; L558-L594 HydrophobicContact CD1-CD1 4.17Å; L558-L594 HydrophobicContact CD2-CD1 4.17Å; L558-L594 HydrophobicContact CD2-CD2 3.82Å; L558-L639 HydrophobicContact CD2-CD1 4.21Å
559	S	78.7	Confident	66.6	Low	83 Å²	83	69.3 Å²	69.3	58%	0.58	41%	0.405	S	S	*	.	H	α-helix	trans	-62.3	-40.8	174.2	-172.1	0	0	0	0	111.5	A555 S556 I557 K562	A555-S559 PolarHBondContact O-N 3.47Å; S556-S559 WeakPolarHBondContact O-CB 3.35Å; S556-S559 PolarHBondContact O-N 3.29Å; I557-S559 VanDerWaalsContact C-N 3.3Å; I557-S559 PolarHBondContact O-N 3.04Å; S559-K562 VanDerWaalsContact O-CB 3.26Å; S559-K562 WeakPolarHBondContact O-CB 3.41Å; S559-K562 PolarHBondContact O-N 3.47Å
560	E	77.4	Confident	66.1	Low	48 Å²	48	75.4 Å²	75.4	22%	0.224	43%	0.429	C	S	.	.	H	α-helix	trans	-65.3	-45.5	174.2	-175.2	174.1	-175.2	0	0	111.9	S556 I557 L558 K562 G563 S665 R667 T680 I682	S556-E560 PolarHBondContact O-N 3.35Å; S556-E560 VanDerWaalsContact O-N 3.15Å; I557-E560 WeakPolarHBondContact O-CB 3.5Å; I557-E560 PolarHBondContact O-N 3.27Å; L558-E560 VanDerWaalsContact C-N 3.32Å; E560-K562 PolarHBondContact O-N 3.11Å; E560-K562 VanDerWaalsContact O-N 3.11Å; E560-G563 PolarHBondContact O-N 2.74Å; E560-S665 VanDerWaalsContact OE1-CB 3.3Å; E560-S665 WeakPolarHBondContact OE1-CB 3.5Å; E560-S665 PolarHBondContact OE1-OG 2.92Å; E560-R667 VanDerWaalsContact CD-NH2 3.26Å; E560-R667 IonicContact OE1-NH2 3.2Å; E560-R667 PolarHBondContact OE1-NH2 3.41Å; E560-R667 IonicContact OE2-CZ 3.32Å; E560-R667 IonicContact OE2-NE 3.45Å; E560-R667 PolarHBondContact OE2-NE 3.05Å; E560-R667 IonicContact OE2-NH2 2.67Å; E560-R667 PolarHBondContact OE2-NH2 3.36Å; E560-T680 HydrophobicContact CG-CG2 4.42Å; E560-I682 HydrophobicContact CG-CD1 4.38Å; E560-I682 VanDerWaalsContact O-CD1 3.23Å; E560-I682 WeakPolarHBondContact O-CD1 3.26Å
561	A	73.3	Confident	66.5	Low	1 Å²	1	75.8 Å²	75.8	1%	0.008	42%	0.423	C	S	.	.	H	α-helix	trans	-60.7	-21.3	177.8	0	0	0	0	0	113.7	I557 L558 G563 L639 T680	I557-A561 PolarHBondContact O-N 2.94Å; L558-A561 PolarHBondContact O-N 3.33Å; A561-G563 VanDerWaalsContact C-N 3.27Å; A561-G563 PolarHBondContact O-N 2.97Å; A561-L639 HydrophobicContact CB-CD2 4.47Å; A561-T680 HydrophobicContact CB-CG2 4.32Å
562	K	71.9	Confident	67.6	Low	92 Å²	92	77.4 Å²	77.4	40%	0.4	42%	0.421	S	S	.	.	H	α-helix	trans	-64.3	-31.7	173.8	-166	178.1	-178	170.3	0	112.2	L558 S559 E560 R571 D591 L592	L558-K562 PolarHBondContact O-N 3.21Å; L558-K562 VanDerWaalsContact O-N 3.15Å; S559-K562 VanDerWaalsContact O-CB 3.26Å; S559-K562 WeakPolarHBondContact O-CB 3.41Å; S559-K562 PolarHBondContact O-N 3.47Å; E560-K562 PolarHBondContact O-N 3.11Å; E560-K562 VanDerWaalsContact O-N 3.11Å; K562-R571 PolarHBondContact O-NH1 3.34Å; K562-D591 WeakPolarHBondContact CE-OD2 3.42Å; K562-D591 IonicContact NZ-OD2 2.71Å; K562-D591 PolarHBondContact NZ-OD2 3.48Å; K562-L592 HydrophobicContact CB-CD1 4.02Å; K562-L592 HydrophobicContact CG-CD1 4.46Å
563	G	63.7	Low	68.9	Low	30 Å²	30	76.8 Å²	76.8	31%	0.309	42%	0.416	S	S	.	.			trans	70.5	177.2	-176.7	0	0	0	0	0	114.4	E560 A561	E560-G563 PolarHBondContact O-N 2.74Å; A561-G563 VanDerWaalsContact C-N 3.27Å; A561-G563 PolarHBondContact O-N 2.97Å
564	L	51.8	Low	70	Confident	183 Å²	183	74.7 Å²	74.7	96%	0.958	40%	0.401	S	S	*	.	S	Bend	trans	-94.3	11.7	-167.5	-93.8	161.8	0	0	0	117
565	E	48.7	Very low	70.8	Confident	147 Å²	147	73.1 Å²	73.1	69%	0.687	39%	0.391	S	S	*	.			trans	-133.1	138.5	-174.6	-73.1	-169.3	156.4	0	0	116.3	S567	E565-S567 PolarHBondContact O-N 3.48Å
566	G	48.3	Very low	71.6	Confident	87 Å²	87	72.1 Å²	72.1	90%	0.897	38%	0.382	S	S	*	.			trans	-78.2	57.9	-171.5	0	0	0	0	0	116.7
567	S	49.5	Very low	71.8	Confident	66 Å²	66	70.2 Å²	70.2	46%	0.462	37%	0.367	S	S	.	.			trans	-76.6	131.8	164.7	59.6	0	0	0	0	110.6	E565 E569	E565-S567 PolarHBondContact O-N 3.48Å; S567-E569 PolarHBondContact O-N 3.13Å
568	K	52.8	Low	71.9	Confident	222 Å²	222	74.1 Å²	74.1	97%	0.965	39%	0.389	S	S	*	.	S	Bend	trans	-73.3	-2.1	179.5	-71.5	-177	177.7	179	0	114.6
569	E	59.4	Low	72	Confident	164 Å²	164	81.3 Å²	81.3	77%	0.766	42%	0.416	S	S	*	.	S	Bend	trans	-92.4	138.1	-179.2	-70.1	-176.2	163.9	0	0	111.5	S567 R571	S567-E569 PolarHBondContact O-N 3.13Å; E569-R571 PolarHBondContact O-N 3.34Å
570	K	67.5	Low	72	Confident	146 Å²	146	80.9 Å²	80.9	64%	0.635	42%	0.417	S	S	*	.	P	Polyproline II helix	trans	-66.8	118.1	175.5	-69.9	-173.4	175	-171.4	0	109.3	V593	K570-V593 HydrophobicContact CB-CG2 4.24Å; K570-V593 HydrophobicContact CD-CG2 4.26Å
571	R	75.7	Confident	71.9	Confident	59 Å²	59	80.2 Å²	80.2	22%	0.223	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.3	143.6	175.8	-70.1	-176	-176.7	173.2	-1.3	110.4	K562 E569 D591 L592 V593	K562-R571 PolarHBondContact O-NH1 3.34Å; E569-R571 PolarHBondContact O-N 3.34Å; R571-D591 PolarHBondContact N-O 3.18Å; R571-L592 HydrophobicContact CB-CD2 4.36Å; R571-L592 WeakPolarHBondContact O-CA 3.41Å; R571-V593 PolarHBondContact O-N 3.21Å
572	R	88.7	Confident	72.1	Confident	111 Å²	111	80.2 Å²	80.2	42%	0.419	42%	0.42	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	144.2	172.5	-57.4	173.5	67.1	-172	-2.9	109	V593 D636 A637	R572-V593 WeakPolarHBondContact CA-O 3.1Å; R572-V593 HydrophobicContact CG-CB 4.46Å; R572-D636 WeakPolarHBondContact CB-OD1 3.44Å; R572-D636 PolarHBondContact N-OD1 3.18Å; R572-D636 VanDerWaalsContact N-OD1 3.13Å; R572-D636 WeakPolarHBondContact O-CB 3.32Å; R572-A637 PolarHBondContact O-N 3.24Å
573	C	89.8	Confident	72.2	Confident	1 Å²	1	78.8 Å²	78.8	1%	0.007	42%	0.424	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.3	118	174.2	172.9	0	0	0	0	108.6	L592 V593 L594 T595 A637	C573-L592 HydrophobicContact CB-CD2 3.63Å; C573-V593 PolarHBondContact N-O 3.46Å; C573-L594 HydrophobicContact CB-CD2 3.83Å; C573-L594 WeakPolarHBondContact O-CA 3Å; C573-T595 PolarHBondContact O-N 3.12Å; C573-A637 WeakPolarHBondContact CA-O 3.41Å; C573-A637 HydrophobicContact CB-CB 4.18Å
574	L	92.3	Very high	72.4	Confident	16 Å²	16	80.7 Å²	80.7	8%	0.084	44%	0.438	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.4	127.7	176.4	-178.5	61.7	0	0	0	108.8	F576 T595 A628 L632 A637 L638 L639	L574-F576 HydrophobicContact CD2-CD2 4.46Å; L574-F576 HydrophobicContact CD2-CE2 3.49Å; L574-F576 VanDerWaalsContact CD2-CE2 3.49Å; L574-F576 HydrophobicContact CD2-CZ 3.88Å; L574-F576 HydrophobicContact CG-CD2 4.24Å; L574-F576 HydrophobicContact CG-CE2 3.7Å; L574-F576 HydrophobicContact CG-CZ 4.31Å; L574-T595 WeakPolarHBondContact CA-O 3.43Å; L574-T595 HydrophobicContact CD1-CG2 4.11Å; L574-A628 HydrophobicContact CD2-CB 3.94Å; L574-L632 HydrophobicContact CB-CD2 3.92Å; L574-A637 PolarHBondContact N-O 2.9Å; L574-L638 HydrophobicContact CB-CD1 4.29Å; L574-L638 HydrophobicContact CD2-CD1 4.4Å; L574-L638 HydrophobicContact CG-CD1 4.36Å; L574-L638 WeakPolarHBondContact O-CA 3.35Å; L574-L639 PolarHBondContact O-N 3.19Å
575	V	90.4	Very high	73.3	Confident	0 Å²	0	72 Å²	72	0%	0	39%	0.392	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	116.7	-173.9	-172.5	0	0	0	0	109.6	D577 W582 L594 T595 F596 S597 L639	V575-D577 HydrophobicContact CG1-CB 3.84Å; V575-W582 HydrophobicContact CG1-CZ2 4.4Å; V575-L594 HydrophobicContact CG2-CD2 3.96Å; V575-T595 PolarHBondContact N-O 2.97Å; V575-F596 HydrophobicContact CB-CD1 3.9Å; V575-F596 HydrophobicContact CB-CE1 3.96Å; V575-F596 HydrophobicContact CG1-CD1 4.04Å; V575-F596 HydrophobicContact CG1-CE1 3.88Å; V575-F596 HydrophobicContact CG2-CE1 4.43Å; V575-F596 WeakPolarHBondContact O-CA 3.42Å; V575-S597 PolarHBondContact O-N 3.3Å; V575-L639 HydrophobicContact CB-CB 4.47Å; V575-L639 HydrophobicContact CG1-CB 4.18Å; V575-L639 HydrophobicContact CG2-CB 4.26Å; V575-L639 HydrophobicContact CG2-CD1 4.05Å; V575-L639 HydrophobicContact CG2-CG 4.44Å
576	F	89.4	Confident	74.3	Confident	3 Å²	3	68.3 Å²	68.3	1%	0.013	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	80.1	170.1	-69.4	-89.3	0	0	0	109	L574 S597 E598 C624 L627 A628 L638 L639 L640 R641	L574-F576 HydrophobicContact CD2-CD2 4.46Å; L574-F576 HydrophobicContact CD2-CE2 3.49Å; L574-F576 VanDerWaalsContact CD2-CE2 3.49Å; L574-F576 HydrophobicContact CD2-CZ 3.88Å; L574-F576 HydrophobicContact CG-CD2 4.24Å; L574-F576 HydrophobicContact CG-CE2 3.7Å; L574-F576 HydrophobicContact CG-CZ 4.31Å; F576-S597 VanDerWaalsContact CE1-CB 3.42Å; F576-E598 VanDerWaalsContact CD1-O 3.32Å; F576-E598 WeakPolarHBondContact CD1-O 3.4Å; F576-C624 HydrophobicContact CD1-CB 3.79Å; F576-C624 VanDerWaalsContact CD1-SG 3.57Å; F576-C624 HydrophobicContact CE1-CB 3.62Å; F576-C624 HydrophobicContact CE2-CB 4.37Å; F576-C624 HydrophobicContact CG-CB 4.23Å; F576-C624 HydrophobicContact CZ-CB 3.93Å; F576-C624 VanDerWaalsContact CZ-O 3.32Å; F576-C624 WeakPolarHBondContact CZ-O 3.21Å; F576-L627 HydrophobicContact CE1-CD2 4.06Å; F576-L627 HydrophobicContact CZ-CB 4.36Å; F576-L627 HydrophobicContact CZ-CD2 3.97Å; F576-L627 HydrophobicContact CZ-CG 4.5Å; F576-A628 HydrophobicContact CE2-CB 4.07Å; F576-L638 HydrophobicContact CD2-CD1 3.62Å; F576-L638 HydrophobicContact CE2-CD1 3.68Å; F576-L639 PolarHBondContact N-O 3.24Å; F576-L640 HydrophobicContact CB-CD1 3.73Å; F576-L640 HydrophobicContact CD2-CD1 4.02Å; F576-L640 HydrophobicContact CG-CD1 3.96Å; F576-R641 WeakPolarHBondContact O-CB 3.46Å; F576-R641 PolarHBondContact O-N 3.43Å
577	D	83	Confident	75.1	Confident	12 Å²	12	68.6 Å²	68.6	6%	0.064	36%	0.363	C	S	.	.	S	Bend	trans	-162.1	167.1	-178.7	-160.8	0.1	0	0	0	109.8	V575 R579 W582 R641	V575-D577 HydrophobicContact CG1-CB 3.84Å; D577-R579 PolarHBondContact O-N 3.07Å; D577-W582 PolarHBondContact OD2-NE1 3.39Å; D577-R641 VanDerWaalsContact CG-NH2 3.3Å; D577-R641 IonicContact OD1-CZ 3.67Å; D577-R641 IonicContact OD1-NE 3.45Å; D577-R641 IonicContact OD1-NH2 3.61Å; D577-R641 PolarHBondContact OD1-NH2 3.07Å; D577-R641 IonicContact OD2-CZ 3.19Å; D577-R641 IonicContact OD2-NE 2.83Å; D577-R641 IonicContact OD2-NH2 2.74Å; D577-R641 PolarHBondContact OD2-NH2 2.98Å
578	N	79.5	Confident	75.7	Confident	86 Å²	86	71.5 Å²	71.5	46%	0.46	37%	0.369	S	S	.	.			trans	-67	116.7	176.6	-175.1	-19	0	0	0	111.2	A580 A581	N578-A580 PolarHBondContact O-N 2.77Å; N578-A580 WeakPolarHBondContact OD1-CB 3.45Å; N578-A580 PolarHBondContact OD1-N 2.95Å; N578-A581 VanDerWaalsContact O-CB 3.3Å; N578-A581 WeakPolarHBondContact O-CB 3.47Å; N578-A581 PolarHBondContact O-N 3.17Å
579	R	80.3	Confident	76.4	Confident	151 Å²	151	62.3 Å²	62.3	57%	0.57	33%	0.332	S	S	*	.	H	α-helix	trans	-51.8	-33.8	178.9	-171.4	175	-172.9	-168.3	0.4	113.8	D577 A581 W582 A583 E586 F596	D577-R579 PolarHBondContact O-N 3.07Å; R579-A581 PolarHBondContact O-N 3.48Å; R579-W582 PolarHBondContact O-N 3.16Å; R579-A583 PolarHBondContact O-N 2.95Å; R579-E586 IonicContact NE-OE1 3.9Å; R579-E586 PolarHBondContact NE-OE1 2.93Å; R579-E586 IonicContact NH2-OE2 3.89Å; R579-F596 HydrophobicContact CB-CD1 4.01Å; R579-F596 HydrophobicContact CB-CE1 4.24Å; R579-F596 HydrophobicContact CB-CG 4.18Å; R579-F596 HydrophobicContact CG-CD1 4.19Å; R579-F596 HydrophobicContact CG-CD2 4Å; R579-F596 HydrophobicContact CG-CE1 4.16Å; R579-F596 HydrophobicContact CG-CE2 3.98Å; R579-F596 HydrophobicContact CG-CG 4.11Å; R579-F596 HydrophobicContact CG-CZ 4.05Å
580	A	78.4	Confident	76.5	Confident	74 Å²	74	60.9 Å²	60.9	61%	0.612	33%	0.33	S	S	*	.	H	α-helix	trans	-60.1	-30.9	178.4	0	0	0	0	0	112.6	N578 W582	N578-A580 PolarHBondContact O-N 2.77Å; N578-A580 WeakPolarHBondContact OD1-CB 3.45Å; N578-A580 PolarHBondContact OD1-N 2.95Å; A580-W582 PolarHBondContact O-N 3.41Å
581	A	74.8	Confident	76.7	Confident	33 Å²	33	57.8 Å²	57.8	27%	0.273	32%	0.32	S	S	.	.	H	α-helix	trans	-68.5	-22.3	177.7	0	0	0	0	0	113	T554 N578 R579	T554-A581 WeakPolarHBondContact CG2-O 3.32Å; N578-A581 VanDerWaalsContact O-CB 3.3Å; N578-A581 WeakPolarHBondContact O-CB 3.47Å; N578-A581 PolarHBondContact O-N 3.17Å; R579-A581 PolarHBondContact O-N 3.48Å
582	W	77.8	Confident	76.8	Confident	2 Å²	2	55.7 Å²	55.7	1%	0.008	31%	0.313	C	S	.	.	H	α-helix	trans	-104	-9.6	-172.8	-64.1	86.4	0	0	0	114.1	T554 I557 L558 V575 D577 R579 A580 A584 A585 E586 F596 L639 L678	T554-W582 HydrophobicContact CG2-CD2 4.02Å; T554-W582 HydrophobicContact CG2-CE3 3.83Å; T554-W582 HydrophobicContact CG2-CH2 4.3Å; T554-W582 HydrophobicContact CG2-CZ2 4.48Å; T554-W582 HydrophobicContact CG2-CZ3 3.98Å; I557-W582 HydrophobicContact CB-CH2 4.2Å; I557-W582 HydrophobicContact CB-CZ3 4.4Å; I557-W582 HydrophobicContact CD1-CH2 4.38Å; I557-W582 HydrophobicContact CG2-CH2 3.9Å; I557-W582 HydrophobicContact CG2-CZ3 4.44Å; L558-W582 HydrophobicContact CD1-CE3 4.33Å; L558-W582 HydrophobicContact CD1-CZ3 4.49Å; L558-W582 HydrophobicContact CD2-CE3 4.06Å; L558-W582 HydrophobicContact CD2-CZ3 3.74Å; L558-W582 HydrophobicContact CG-CE3 4.13Å; L558-W582 HydrophobicContact CG-CZ3 3.81Å; V575-W582 HydrophobicContact CG1-CZ2 4.4Å; D577-W582 PolarHBondContact OD2-NE1 3.39Å; R579-W582 PolarHBondContact O-N 3.16Å; A580-W582 PolarHBondContact O-N 3.41Å; W582-A584 PolarHBondContact O-N 3.44Å; W582-A584 VanDerWaalsContact O-N 3.09Å; W582-A585 PolarHBondContact O-N 3.4Å; W582-E586 PolarHBondContact O-N 3.42Å; W582-F596 HydrophobicContact CB-CE1 3.97Å; W582-F596 HydrophobicContact CB-CZ 3.88Å; W582-F596 AromaticContact CD1-CE1 3.87Å; W582-F596 AromaticContact CG-CE1 3.95Å; W582-F596 HydrophobicContact CG-CE1 3.95Å; W582-F596 HydrophobicContact CG-CZ 4.28Å; W582-L639 HydrophobicContact CH2-CD1 3.57Å; W582-L639 HydrophobicContact CZ2-CD1 4.1Å; W582-L639 HydrophobicContact CZ3-CD1 3.98Å; W582-L678 HydrophobicContact CH2-CD2 3.71Å; W582-L678 HydrophobicContact CZ2-CD2 3.6Å
583	A	74.3	Confident	76.6	Confident	61 Å²	61	53.5 Å²	53.5	50%	0.504	31%	0.312	S	S	.	.	H	α-helix	trans	-54.7	-34.9	-173.7	0	0	0	0	0	114.1	R579	R579-A583 PolarHBondContact O-N 2.95Å
584	A	69	Low	76.4	Confident	71 Å²	71	55.1 Å²	55.1	59%	0.587	32%	0.32	S	S	*	.	H	α-helix	trans	-74.1	-24.6	179.4	0	0	0	0	0	113.9	W582 S587 Q588	W582-A584 PolarHBondContact O-N 3.44Å; W582-A584 VanDerWaalsContact O-N 3.09Å; A584-S587 PolarHBondContact O-OG 2.87Å; A584-Q588 PolarHBondContact O-NE2 3.48Å
585	A	70.4	Confident	76.2	Confident	1 Å²	1	56.9 Å²	56.9	1%	0.008	33%	0.332	C	S	.	.	H	α-helix	trans	-99.4	-21.6	-177.3	0	0	0	0	0	113.2	T554 A555 L558 W582 S587 Q588	T554-A585 VanDerWaalsContact OG1-CB 3.3Å; T554-A585 WeakPolarHBondContact OG1-CB 3.39Å; A555-A585 HydrophobicContact CB-CB 4.39Å; L558-A585 HydrophobicContact CD1-CB 3.78Å; W582-A585 PolarHBondContact O-N 3.4Å; A585-S587 PolarHBondContact O-N 3.27Å; A585-S587 VanDerWaalsContact O-N 3.16Å; A585-Q588 PolarHBondContact O-N 3.35Å
586	E	69.1	Low	76.1	Confident	68 Å²	68	59.1 Å²	59.1	32%	0.318	34%	0.342	S	S	.	.	H	α-helix	trans	-52.6	-34.8	174.3	-81.3	-174.1	-170.5	0	0	112.4	R579 W582 Q588 L594 F596	R579-E586 IonicContact NE-OE1 3.9Å; R579-E586 PolarHBondContact NE-OE1 2.93Å; R579-E586 IonicContact NH2-OE2 3.89Å; W582-E586 PolarHBondContact O-N 3.42Å; E586-Q588 VanDerWaalsContact C-N 3.31Å; E586-Q588 PolarHBondContact O-N 3.17Å; E586-L594 HydrophobicContact CG-CD1 3.98Å; E586-F596 WeakPolarHBondContact OE1-CE2 3.42Å; E586-F596 VanDerWaalsContact OE1-CZ 3.28Å; E586-F596 WeakPolarHBondContact OE1-CZ 3.26Å
587	S	64.4	Low	76	Confident	93 Å²	93	60.7 Å²	60.7	65%	0.65	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.4	-10.6	-179.1	61.5	0	0	0	0	114.6	A584 A585	A584-S587 PolarHBondContact O-OG 2.87Å; A585-S587 PolarHBondContact O-N 3.27Å; A585-S587 VanDerWaalsContact O-N 3.16Å
588	Q	63.2	Low	76	Confident	127 Å²	127	68.5 Å²	68.5	59%	0.593	39%	0.389	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	-7.2	-170	-59.4	-175.1	8.8	0	0	113.4	A584 A585 E586	A584-Q588 PolarHBondContact O-NE2 3.48Å; A585-Q588 PolarHBondContact O-N 3.35Å; E586-Q588 VanDerWaalsContact C-N 3.31Å; E586-Q588 PolarHBondContact O-N 3.17Å
589	V	66.2	Low	76.1	Confident	30 Å²	30	67.7 Å²	67.7	18%	0.182	38%	0.383	C	S	.	.			trans	-125.5	95.9	-171.9	-170.1	0	0	0	0	111.1	L558 D591 L592	L558-V589 HydrophobicContact CB-CG2 3.85Å; L558-V589 HydrophobicContact CD1-CB 4.45Å; L558-V589 HydrophobicContact CD1-CG2 3.71Å; L558-V589 HydrophobicContact CG-CG2 4.43Å; V589-D591 VanDerWaalsContact C-N 3.32Å; V589-D591 PolarHBondContact O-N 2.92Å; V589-L592 HydrophobicContact CG1-CB 3.86Å; V589-L592 HydrophobicContact CG1-CD1 3.65Å; V589-L592 HydrophobicContact CG1-CG 4.28Å
590	N	62.8	Low	76.2	Confident	134 Å²	134	60.5 Å²	60.5	72%	0.717	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76	-14.3	-175.5	-72.8	-26.7	0	0	0	115
591	D	72.1	Confident	76.4	Confident	80 Å²	80	59.6 Å²	59.6	43%	0.428	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-108.5	-2.6	-167.1	-58.9	-29.3	0	0	0	114.2	K562 R571 V589	K562-D591 WeakPolarHBondContact CE-OD2 3.42Å; K562-D591 IonicContact NZ-OD2 2.71Å; K562-D591 PolarHBondContact NZ-OD2 3.48Å; R571-D591 PolarHBondContact N-O 3.18Å; V589-D591 VanDerWaalsContact C-N 3.32Å; V589-D591 PolarHBondContact O-N 2.92Å
592	L	77	Confident	76.4	Confident	16 Å²	16	59.4 Å²	59.4	8%	0.084	34%	0.338	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	134.7	179.5	-87.6	145.3	0	0	0	110.6	K562 R571 C573 V589	K562-L592 HydrophobicContact CB-CD1 4.02Å; K562-L592 HydrophobicContact CG-CD1 4.46Å; R571-L592 HydrophobicContact CB-CD2 4.36Å; R571-L592 WeakPolarHBondContact O-CA 3.41Å; C573-L592 HydrophobicContact CB-CD2 3.63Å; V589-L592 HydrophobicContact CG1-CB 3.86Å; V589-L592 HydrophobicContact CG1-CD1 3.65Å; V589-L592 HydrophobicContact CG1-CG 4.28Å
593	V	84.3	Confident	76	Confident	64 Å²	64	60.5 Å²	60.5	39%	0.388	35%	0.345	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.2	107.6	172.7	-179	0	0	0	0	109	K570 R571 R572 C573	K570-V593 HydrophobicContact CB-CG2 4.24Å; K570-V593 HydrophobicContact CD-CG2 4.26Å; R571-V593 PolarHBondContact O-N 3.21Å; R572-V593 WeakPolarHBondContact CA-O 3.1Å; R572-V593 HydrophobicContact CG-CB 4.46Å; C573-V593 PolarHBondContact N-O 3.46Å
594	L	85.9	Confident	75.3	Confident	35 Å²	35	64.7 Å²	64.7	18%	0.183	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	126.6	-179.9	-60	176.5	0	0	0	111.1	L558 C573 V575 E586 F596	L558-L594 HydrophobicContact CD1-CD1 4.17Å; L558-L594 HydrophobicContact CD2-CD1 4.17Å; L558-L594 HydrophobicContact CD2-CD2 3.82Å; C573-L594 HydrophobicContact CB-CD2 3.83Å; C573-L594 WeakPolarHBondContact O-CA 3Å; V575-L594 HydrophobicContact CG2-CD2 3.96Å; E586-L594 HydrophobicContact CG-CD1 3.98Å; L594-F596 HydrophobicContact CB-CE2 3.95Å; L594-F596 HydrophobicContact CB-CZ 4.3Å; L594-F596 HydrophobicContact CD1-CZ 4.42Å
595	T	88.3	Confident	74.5	Confident	54 Å²	54	72.8 Å²	72.8	33%	0.331	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	131.1	169.7	-52.8	0	0	0	0	108.2	C573 L574 V575	C573-T595 PolarHBondContact O-N 3.12Å; L574-T595 WeakPolarHBondContact CA-O 3.43Å; L574-T595 HydrophobicContact CD1-CG2 4.11Å; V575-T595 PolarHBondContact N-O 2.97Å
596	F	87.4	Confident	73.7	Confident	46 Å²	46	75.9 Å²	75.9	20%	0.202	40%	0.402	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	146.9	-178	-67.1	-90.7	0	0	0	111.4	V575 R579 W582 E586 L594	V575-F596 HydrophobicContact CB-CD1 3.9Å; V575-F596 HydrophobicContact CB-CE1 3.96Å; V575-F596 HydrophobicContact CG1-CD1 4.04Å; V575-F596 HydrophobicContact CG1-CE1 3.88Å; V575-F596 HydrophobicContact CG2-CE1 4.43Å; V575-F596 WeakPolarHBondContact O-CA 3.42Å; R579-F596 HydrophobicContact CB-CD1 4.01Å; R579-F596 HydrophobicContact CB-CE1 4.24Å; R579-F596 HydrophobicContact CB-CG 4.18Å; R579-F596 HydrophobicContact CG-CD1 4.19Å; R579-F596 HydrophobicContact CG-CD2 4Å; R579-F596 HydrophobicContact CG-CE1 4.16Å; R579-F596 HydrophobicContact CG-CE2 3.98Å; R579-F596 HydrophobicContact CG-CG 4.11Å; R579-F596 HydrophobicContact CG-CZ 4.05Å; W582-F596 HydrophobicContact CB-CE1 3.97Å; W582-F596 HydrophobicContact CB-CZ 3.88Å; W582-F596 AromaticContact CD1-CE1 3.87Å; W582-F596 AromaticContact CG-CE1 3.95Å; W582-F596 HydrophobicContact CG-CE1 3.95Å; W582-F596 HydrophobicContact CG-CZ 4.28Å; E586-F596 WeakPolarHBondContact OE1-CE2 3.42Å; E586-F596 VanDerWaalsContact OE1-CZ 3.28Å; E586-F596 WeakPolarHBondContact OE1-CZ 3.26Å; L594-F596 HydrophobicContact CB-CE2 3.95Å; L594-F596 HydrophobicContact CB-CZ 4.3Å; L594-F596 HydrophobicContact CD1-CZ 4.42Å
597	S	88.6	Confident	73.2	Confident	37 Å²	37	80.5 Å²	80.5	26%	0.259	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.1	161.7	172.9	-69.5	0	0	0	0	110	V575 F576 E599	V575-S597 PolarHBondContact O-N 3.3Å; F576-S597 VanDerWaalsContact CE1-CB 3.42Å; S597-E599 PolarHBondContact O-N 2.86Å
598	E	83.2	Confident	73.7	Confident	176 Å²	176	76.8 Å²	76.8	82%	0.822	39%	0.389	S	S	*	.	P	Polyproline II helix	trans	-64.8	128.7	-177	-66.2	-172.5	166.3	0	0	111.4	F576	F576-E598 VanDerWaalsContact CD1-O 3.32Å; F576-E598 WeakPolarHBondContact CD1-O 3.4Å
599	E	81.2	Confident	74.8	Confident	68 Å²	68	71.9 Å²	71.9	32%	0.318	37%	0.367	S	S	.	.	P	Polyproline II helix	trans	-69.7	155	174.8	66.7	-180	166.4	0	0	112	S597 S601	S597-E599 PolarHBondContact O-N 2.86Å; E599-S601 PolarHBondContact O-N 3.42Å
600	P	82.7	Confident	75.9	Confident	1 Å²	1	72.2 Å²	72.2	1%	0.006	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-56.4	134.2	169.8	-21.5	32.6	0	0	0	110.7	F602 Y617 Q620 L621	P600-F602 PolarHBondContact O-N 3.24Å; P600-Y617 HydrophobicContact CB-CD2 4.17Å; P600-Y617 HydrophobicContact CB-CE2 3.98Å; P600-Q620 HydrophobicContact CB-CB 4.13Å; P600-L621 HydrophobicContact CG-CB 4.44Å; P600-L621 HydrophobicContact CG-CD1 4.23Å
601	S	81	Confident	77.2	Confident	54 Å²	54	65.9 Å²	65.9	38%	0.378	33%	0.334	S	S	.	.	P	Polyproline II helix	trans	-68.8	120.4	177.8	68.3	0	0	0	0	109.9	E599 Q620	E599-S601 PolarHBondContact O-N 3.42Å; S601-Q620 VanDerWaalsContact OG-CD 3.24Å; S601-Q620 PolarHBondContact OG-NE2 2.82Å; S601-Q620 PolarHBondContact OG-OE1 3.37Å
602	F	76	Confident	78.2	Confident	29 Å²	29	62 Å²	62	13%	0.127	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-67.7	150.2	175.8	-66.4	-71	0	0	0	111	P600 Q604 Y617 R641 F643	P600-F602 PolarHBondContact O-N 3.24Å; F602-Q604 WeakPolarHBondContact O-CG 3.42Å; F602-Q604 PolarHBondContact O-N 3.33Å; F602-Y617 HydrophobicContact CD1-CE2 4.37Å; F602-Y617 HydrophobicContact CE1-CE2 4.47Å; F602-R641 HydrophobicContact CE2-CG 4.28Å; F602-R641 HydrophobicContact CZ-CG 3.55Å; F602-F643 HydrophobicContact CD1-CB 3.75Å; F602-F643 AromaticContact CD1-CD2 3.45Å; F602-F643 HydrophobicContact CD1-CD2 3.45Å; F602-F643 VanDerWaalsContact CD1-CD2 3.45Å; F602-F643 HydrophobicContact CD1-CE2 4.29Å; F602-F643 AromaticContact CD1-CG 3.87Å; F602-F643 HydrophobicContact CD1-CG 3.87Å; F602-F643 HydrophobicContact CE1-CB 3.7Å; F602-F643 AromaticContact CE1-CD2 3.81Å; F602-F643 HydrophobicContact CE1-CD2 3.81Å; F602-F643 HydrophobicContact CE1-CG 4.18Å; F602-F643 HydrophobicContact CG-CD2 4.44Å
603	P	68.3	Low	78.9	Confident	26 Å²	26	61.3 Å²	61.3	17%	0.169	31%	0.309	C	S	.	.			trans	-59.9	109.3	170.6	-20.9	32.2	0	0	0	110.4	I608 E614 F643	P603-I608 HydrophobicContact CB-CG2 4.23Å; P603-E614 HydrophobicContact CG-CB 4.28Å; P603-F643 HydrophobicContact CG-CE1 4.48Å
604	Q	59.8	Low	79.3	Confident	148 Å²	148	61.8 Å²	61.8	69%	0.692	31%	0.307	S	S	*	.			trans	-103.9	1.9	-172.8	-78.7	-175.8	4.5	0	0	114.7	F602	F602-Q604 WeakPolarHBondContact O-CG 3.42Å; F602-Q604 PolarHBondContact O-N 3.33Å
605	R	52.1	Low	79.5	Confident	241 Å²	241	61.1 Å²	61.1	91%	0.909	31%	0.305	S	S	*	.	S	Bend	trans	-142.4	137	-177.7	-68.5	-174.5	-178.2	179	1	113.7
606	G	53.3	Low	79.7	Confident	67 Å²	67	62.2 Å²	62.2	69%	0.691	31%	0.308	S	S	*	.	S	Bend	trans	88.7	179.9	170.2	0	0	0	0	0	114.9	I608	G606-I608 WeakPolarHBondContact O-CG1 3.45Å; G606-I608 PolarHBondContact O-N 3.17Å
607	R	59.1	Low	79.9	Confident	165 Å²	165	60.1 Å²	60.1	62%	0.623	30%	0.299	S	S	*	.			trans	-61.5	105.4	174.5	-66.4	178.3	174.3	167.6	-2.2	108.8	Q534 L609	Q534-R607 PolarHBondContact O-NE 2.82Å; Q534-R607 PolarHBondContact O-NH2 3.11Å; R607-L609 HydrophobicContact CB-CD1 4.49Å; R607-L609 HydrophobicContact CB-CG 4.2Å; R607-L609 PolarHBondContact O-N 3.46Å
608	I	74.6	Confident	80.1	Confident	15 Å²	15	58.5 Å²	58.5	8%	0.077	29%	0.287	C	S	.	.			trans	-77.1	53.1	-174.3	-43.5	177.3	0	0	0	111.1	W540 P603 G606 L610 F643	W540-I608 HydrophobicContact CB-CD1 4.19Å; W540-I608 HydrophobicContact CG-CD1 4.22Å; P603-I608 HydrophobicContact CB-CG2 4.23Å; G606-I608 WeakPolarHBondContact O-CG1 3.45Å; G606-I608 PolarHBondContact O-N 3.17Å; I608-L610 PolarHBondContact O-N 3.13Å; I608-F643 HydrophobicContact CG2-CE1 4.02Å; I608-F643 HydrophobicContact CG2-CZ 4.17Å
609	L	87.1	Confident	80.7	Confident	23 Å²	23	51.2 Å²	51.2	12%	0.12	25%	0.254	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77	-13.2	178.3	-56.3	179.8	0	0	0	112.2	A514 V515 N530 L533 Q534 R607 H611	A514-L609 CarbonylContact C-O 3.47Å; A514-L609 WeakPolarHBondContact CA-O 3.14Å; A514-L609 HydrophobicContact CB-CB 3.68Å; V515-L609 PolarHBondContact N-O 3.05Å; N530-L609 HydrophobicContact CB-CD2 4.38Å; L533-L609 HydrophobicContact CB-CD2 3.95Å; Q534-L609 HydrophobicContact CG-CD1 3.76Å; Q534-L609 HydrophobicContact CG-CD2 3.83Å; Q534-L609 HydrophobicContact CG-CG 4.41Å; R607-L609 HydrophobicContact CB-CD1 4.49Å; R607-L609 HydrophobicContact CB-CG 4.2Å; R607-L609 PolarHBondContact O-N 3.46Å; L609-H611 PolarHBondContact O-CD2 3.28Å
610	L	89.4	Confident	81.3	Confident	37 Å²	37	50.1 Å²	50.1	19%	0.194	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.8	-20.5	175.8	-74.7	171.5	0	0	0	113.3	L512 V515 I608 D612 G613	L512-L610 HydrophobicContact CB-CD2 3.65Å; L512-L610 WeakPolarHBondContact O-CD2 3.48Å; V515-L610 WeakPolarHBondContact CG2-O 3.41Å; I608-L610 PolarHBondContact O-N 3.13Å; L610-D612 PolarHBondContact O-N 3.05Å; L610-G613 VanDerWaalsContact O-CA 3.27Å; L610-G613 WeakPolarHBondContact O-CA 3.5Å; L610-G613 PolarHBondContact O-N 3.42Å
611	H	90.2	Very high	81.9	Confident	1 Å²	1	50.2 Å²	50.2	1%	0.005	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	49.5	-118.7	-174.5	-57.6	-79.9	0	0	0	112.4	L529 N530 L609 G613 F643 L646	L529-H611 VanDerWaalsContact CD2-CE1 3.47Å; L529-H611 WeakPolarHBondContact CD2-CE1 3.49Å; N530-H611 PolarHBondContact OD1-NE2 3.14Å; L609-H611 PolarHBondContact O-CD2 3.28Å; H611-G613 VanDerWaalsContact C-N 3.25Å; H611-G613 PolarHBondContact O-N 3.35Å; H611-F643 HydrophobicContact CB-CE1 4.45Å; H611-L646 HydrophobicContact CB-CD1 3.68Å
612	D	92.3	Very high	82.6	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	23%	0.231	C	C	.	.	G	3₁₀ helix	trans	-84.3	10.1	173.3	61.7	-67.3	0	0	0	114	L610 Y617 Q618 S644 L646 T647 T650	L610-D612 PolarHBondContact O-N 3.05Å; D612-Y617 HydrophobicContact CB-CD1 4.14Å; D612-Y617 HydrophobicContact CB-CE1 3.68Å; D612-Q618 VanDerWaalsContact O-CG 3.25Å; D612-Q618 WeakPolarHBondContact O-CG 3.38Å; D612-Q618 PolarHBondContact O-NE2 3.42Å; D612-Q618 VanDerWaalsContact O-NE2 3.1Å; D612-S644 WeakPolarHBondContact CB-O 3.45Å; D612-S644 WeakPolarHBondContact CB-OG 3.23Å; D612-S644 VanDerWaalsContact CG-OG 3.3Å; D612-S644 PolarHBondContact OD1-OG 2.93Å; D612-L646 VanDerWaalsContact OD1-CB 3.25Å; D612-L646 WeakPolarHBondContact OD1-CB 3.45Å; D612-L646 PolarHBondContact OD1-N 3.26Å; D612-L646 PolarHBondContact OD2-N 3Å; D612-L646 VanDerWaalsContact OD2-N 3.15Å; D612-T647 WeakPolarHBondContact OD2-CB 3.37Å; D612-T647 PolarHBondContact OD2-N 3.34Å; D612-T647 PolarHBondContact OD2-OG1 3.15Å; D612-T650 HydrophobicContact CB-CG2 4.42Å; D612-T650 PolarHBondContact O-OG1 2.93Å; D612-T650 WeakPolarHBondContact OD2-CB 3.37Å; D612-T650 PolarHBondContact OD2-OG1 3.23Å
613	G	92.8	Very high	83.5	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-88.9	0.9	179.2	0	0	0	0	0	115.6	L610 H611 P615	L610-G613 VanDerWaalsContact O-CA 3.27Å; L610-G613 WeakPolarHBondContact O-CA 3.5Å; L610-G613 PolarHBondContact O-N 3.42Å; H611-G613 VanDerWaalsContact C-N 3.25Å; H611-G613 PolarHBondContact O-N 3.35Å; G613-P615 WeakPolarHBondContact O-CD 3.24Å
614	E	91.2	Very high	84.8	Confident	75 Å²	75	50.8 Å²	50.8	35%	0.35	25%	0.245	S	C	.	.			trans	-69.4	120.2	173.8	-178.3	61.1	-122.7	0	0	110	P603 L616 Y617 Q618	P603-E614 HydrophobicContact CG-CB 4.28Å; E614-L616 VanDerWaalsContact C-N 3.29Å; E614-L616 PolarHBondContact O-N 3.11Å; E614-Y617 WeakPolarHBondContact O-CB 3.36Å; E614-Y617 PolarHBondContact O-N 3.49Å; E614-Y617 VanDerWaalsContact O-N 3.09Å; E614-Q618 PolarHBondContact O-N 2.9Å
615	P	91.8	Very high	86.6	Confident	21 Å²	21	43.8 Å²	43.8	14%	0.136	21%	0.212	C	C	.	.	H	α-helix	trans	-55.9	-38.2	-175.7	-30.7	37.5	0	0	0	114.5	G613 Q618 Q619 I707 Q724	G613-P615 WeakPolarHBondContact O-CD 3.24Å; P615-Q618 PolarHBondContact O-N 3.18Å; P615-Q619 WeakPolarHBondContact O-CB 3.35Å; P615-Q619 PolarHBondContact O-N 2.89Å; P615-I707 HydrophobicContact CB-CD1 4.06Å; P615-I707 HydrophobicContact CB-CG1 3.96Å; P615-Q724 HydrophobicContact CG-CB 3.96Å
616	L	91	Very high	88.7	Confident	76 Å²	76	33 Å²	33	40%	0.398	17%	0.173	S	C	.	.	H	α-helix	trans	-64.6	-41.9	178.4	-178.9	62.6	0	0	0	111.9	E614 Q619 Q620	E614-L616 VanDerWaalsContact C-N 3.29Å; E614-L616 PolarHBondContact O-N 3.11Å; L616-Q619 WeakPolarHBondContact O-CB 2.96Å; L616-Q619 PolarHBondContact O-N 3.16Å; L616-Q620 WeakPolarHBondContact O-CG 3.41Å; L616-Q620 PolarHBondContact O-N 3.45Å; L616-Q620 VanDerWaalsContact O-N 3.09Å
617	Y	91.9	Very high	90.7	Very high	2 Å²	2	33.1 Å²	33.1	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-63.4	-45.3	175.8	168.7	-94.3	0	0	0	110.9	P600 F602 D612 E614 Q619 Q620 L621 V642 F643	P600-Y617 HydrophobicContact CB-CD2 4.17Å; P600-Y617 HydrophobicContact CB-CE2 3.98Å; F602-Y617 HydrophobicContact CD1-CE2 4.37Å; F602-Y617 HydrophobicContact CE1-CE2 4.47Å; D612-Y617 HydrophobicContact CB-CD1 4.14Å; D612-Y617 HydrophobicContact CB-CE1 3.68Å; E614-Y617 WeakPolarHBondContact O-CB 3.36Å; E614-Y617 PolarHBondContact O-N 3.49Å; E614-Y617 VanDerWaalsContact O-N 3.09Å; Y617-Q619 VanDerWaalsContact C-N 3.33Å; Y617-Q619 PolarHBondContact O-N 2.79Å; Y617-Q620 PolarHBondContact O-N 3.36Å; Y617-L621 HydrophobicContact CE1-CD2 4.22Å; Y617-L621 WeakPolarHBondContact O-CB 3.05Å; Y617-L621 PolarHBondContact O-N 2.99Å; Y617-V642 WeakPolarHBondContact OH-CA 3.39Å; Y617-F643 HydrophobicContact CE1-CB 4.39Å; Y617-F643 HydrophobicContact CE2-CB 3.87Å; Y617-F643 PolarHBondContact OH-N 3.39Å
618	Q	94.2	Very high	92.4	Very high	3 Å²	3	25.3 Å²	25.3	1%	0.014	13%	0.127	C	C	.	.	H	α-helix	trans	-61.4	-41.3	178	-68.2	-179.5	-15.2	0	0	112	D612 E614 P615 L621 L622 T647 V649 I703	D612-Q618 VanDerWaalsContact O-CG 3.25Å; D612-Q618 WeakPolarHBondContact O-CG 3.38Å; D612-Q618 PolarHBondContact O-NE2 3.42Å; D612-Q618 VanDerWaalsContact O-NE2 3.1Å; E614-Q618 PolarHBondContact O-N 2.9Å; P615-Q618 PolarHBondContact O-N 3.18Å; Q618-L621 PolarHBondContact O-N 2.86Å; Q618-L622 WeakPolarHBondContact O-CG 3.13Å; Q618-L622 PolarHBondContact O-N 3.49Å; Q618-T647 PolarHBondContact NE2-OG1 2.85Å; Q618-V649 HydrophobicContact CB-CG1 4.2Å; Q618-V649 HydrophobicContact CG-CG1 4.18Å; Q618-I703 HydrophobicContact CB-CD1 4.36Å
619	Q	94.7	Very high	93.4	Very high	24 Å²	24	24.9 Å²	24.9	11%	0.112	13%	0.126	C	C	.	.	H	α-helix	trans	-58.9	-50.2	175.6	-169.5	-159.9	13.3	0	0	111.6	P615 L616 Y617 L622 Q623 I703 I707	P615-Q619 WeakPolarHBondContact O-CB 3.35Å; P615-Q619 PolarHBondContact O-N 2.89Å; L616-Q619 WeakPolarHBondContact O-CB 2.96Å; L616-Q619 PolarHBondContact O-N 3.16Å; Y617-Q619 VanDerWaalsContact C-N 3.33Å; Y617-Q619 PolarHBondContact O-N 2.79Å; Q619-L622 PolarHBondContact O-N 2.84Å; Q619-Q623 WeakPolarHBondContact O-CB 3.34Å; Q619-Q623 PolarHBondContact O-N 3.43Å; Q619-I703 HydrophobicContact CB-CG2 3.75Å; Q619-I703 HydrophobicContact CG-CG2 4.22Å; Q619-I707 HydrophobicContact CB-CD1 4.26Å
620	Q	94.2	Very high	93.8	Very high	45 Å²	45	29.7 Å²	29.7	21%	0.21	15%	0.147	C	C	.	.	H	α-helix	trans	-65.8	-40.4	-178.7	-71.1	171.3	-13.4	0	0	111.7	P600 S601 L616 Y617 L622 Q623 C624	P600-Q620 HydrophobicContact CB-CB 4.13Å; S601-Q620 VanDerWaalsContact OG-CD 3.24Å; S601-Q620 PolarHBondContact OG-NE2 2.82Å; S601-Q620 PolarHBondContact OG-OE1 3.37Å; L616-Q620 WeakPolarHBondContact O-CG 3.41Å; L616-Q620 PolarHBondContact O-N 3.45Å; L616-Q620 VanDerWaalsContact O-N 3.09Å; Y617-Q620 PolarHBondContact O-N 3.36Å; Q620-L622 PolarHBondContact O-N 3.26Å; Q620-Q623 WeakPolarHBondContact O-CB 3.45Å; Q620-Q623 PolarHBondContact O-N 2.9Å; Q620-C624 PolarHBondContact O-N 3.47Å; Q620-C624 PolarHBondContact O-SG 3.43Å
621	L	95.3	Very high	93.9	Very high	3 Å²	3	32.4 Å²	32.4	2%	0.016	16%	0.162	C	C	.	.	H	α-helix	trans	-59.4	-47.2	175.5	178.3	63.3	0	0	0	111.7	P600 Y617 Q618 Q623 C624 I625 L640 V642 T650 A653	P600-L621 HydrophobicContact CG-CB 4.44Å; P600-L621 HydrophobicContact CG-CD1 4.23Å; Y617-L621 HydrophobicContact CE1-CD2 4.22Å; Y617-L621 WeakPolarHBondContact O-CB 3.05Å; Y617-L621 PolarHBondContact O-N 2.99Å; Q618-L621 PolarHBondContact O-N 2.86Å; L621-Q623 VanDerWaalsContact C-N 3.3Å; L621-Q623 PolarHBondContact O-N 3.33Å; L621-C624 PolarHBondContact O-N 3.27Å; L621-I625 HydrophobicContact CD1-CD1 4.42Å; L621-I625 HydrophobicContact CG-CD1 4.27Å; L621-I625 WeakPolarHBondContact O-CG1 3.41Å; L621-I625 PolarHBondContact O-N 3.4Å; L621-L640 HydrophobicContact CD1-CD1 4.33Å; L621-L640 HydrophobicContact CD1-CD2 3.89Å; L621-L640 HydrophobicContact CD1-CG 4.31Å; L621-V642 HydrophobicContact CD1-CG1 4Å; L621-T650 HydrophobicContact CD2-CG2 3.6Å; L621-A653 HydrophobicContact CD2-CB 4.19Å
622	L	96.1	Very high	94.1	Very high	1 Å²	1	33.2 Å²	33.2	1%	0.005	17%	0.166	C	C	.	.	H	α-helix	trans	-64.5	-35.8	177	-69.9	173.5	0	0	0	111.9	Q618 Q619 Q620 I625 L626 A653 L696 V699 I703 F728	Q618-L622 WeakPolarHBondContact O-CG 3.13Å; Q618-L622 PolarHBondContact O-N 3.49Å; Q619-L622 PolarHBondContact O-N 2.84Å; Q620-L622 PolarHBondContact O-N 3.26Å; L622-I625 PolarHBondContact O-N 3.48Å; L622-L626 WeakPolarHBondContact O-CB 3.42Å; L622-L626 WeakPolarHBondContact O-CG 3.39Å; L622-L626 PolarHBondContact O-N 2.87Å; L622-A653 HydrophobicContact CD2-CB 4.06Å; L622-L696 HydrophobicContact CD2-CD2 3.83Å; L622-V699 HydrophobicContact CD1-CG1 3.72Å; L622-I703 HydrophobicContact CD1-CD1 3.65Å; L622-F728 HydrophobicContact CD2-CE1 4.4Å; L622-F728 HydrophobicContact CD2-CZ 4.12Å
623	Q	95.4	Very high	94.1	Very high	107 Å²	107	36.1 Å²	36.1	50%	0.5	19%	0.187	S	C	.	.	H	α-helix	trans	-62.5	-43.4	173.6	-175.4	178.6	2.3	0	0	111.9	Q619 Q620 L621 I625 L626 L627	Q619-Q623 WeakPolarHBondContact O-CB 3.34Å; Q619-Q623 PolarHBondContact O-N 3.43Å; Q620-Q623 WeakPolarHBondContact O-CB 3.45Å; Q620-Q623 PolarHBondContact O-N 2.9Å; L621-Q623 VanDerWaalsContact C-N 3.3Å; L621-Q623 PolarHBondContact O-N 3.33Å; Q623-I625 VanDerWaalsContact C-N 3.34Å; Q623-I625 PolarHBondContact O-N 2.99Å; Q623-L626 PolarHBondContact O-N 2.98Å; Q623-L627 WeakPolarHBondContact O-CB 3.44Å; Q623-L627 PolarHBondContact O-N 3.02Å
624	C	95.4	Very high	94.1	Very high	12 Å²	12	39.7 Å²	39.7	8%	0.081	22%	0.216	C	C	.	.	H	α-helix	trans	-61.5	-42.7	175.3	-65.7	0	0	0	0	111.6	F576 Q620 L621 L627 A628 L640	F576-C624 HydrophobicContact CD1-CB 3.79Å; F576-C624 VanDerWaalsContact CD1-SG 3.57Å; F576-C624 HydrophobicContact CE1-CB 3.62Å; F576-C624 HydrophobicContact CE2-CB 4.37Å; F576-C624 HydrophobicContact CG-CB 4.23Å; F576-C624 HydrophobicContact CZ-CB 3.93Å; F576-C624 VanDerWaalsContact CZ-O 3.32Å; F576-C624 WeakPolarHBondContact CZ-O 3.21Å; Q620-C624 PolarHBondContact O-N 3.47Å; Q620-C624 PolarHBondContact O-SG 3.43Å; L621-C624 PolarHBondContact O-N 3.27Å; C624-L627 PolarHBondContact O-N 3.39Å; C624-A628 WeakPolarHBondContact O-CB 3.42Å; C624-A628 PolarHBondContact O-N 3.22Å; C624-L640 HydrophobicContact CB-CD1 4.03Å
625	I	96.4	Very high	94	Very high	1 Å²	1	37.2 Å²	37.2	1%	0.005	21%	0.211	C	C	.	.	H	α-helix	trans	-64.2	-47.8	177	-67.4	170.1	0	0	0	110.7	L621 L622 Q623 L627 A628 L629 L640 A653 L657 L696	L621-I625 HydrophobicContact CD1-CD1 4.42Å; L621-I625 HydrophobicContact CG-CD1 4.27Å; L621-I625 WeakPolarHBondContact O-CG1 3.41Å; L621-I625 PolarHBondContact O-N 3.4Å; L622-I625 PolarHBondContact O-N 3.48Å; Q623-I625 VanDerWaalsContact C-N 3.34Å; Q623-I625 PolarHBondContact O-N 2.99Å; I625-L627 VanDerWaalsContact C-N 3.33Å; I625-L627 PolarHBondContact O-N 3.46Å; I625-A628 WeakPolarHBondContact O-CB 3.41Å; I625-A628 PolarHBondContact O-N 3.2Å; I625-A628 VanDerWaalsContact O-N 3.17Å; I625-L629 HydrophobicContact CG2-CD1 3.75Å; I625-L629 HydrophobicContact CG2-CG 4.1Å; I625-L629 VanDerWaalsContact O-CG 3.27Å; I625-L629 WeakPolarHBondContact O-CG 3.38Å; I625-L629 PolarHBondContact O-N 3.37Å; I625-L640 HydrophobicContact CD1-CD2 4.27Å; I625-L640 HydrophobicContact CG1-CD2 3.77Å; I625-A653 HydrophobicContact CD1-CB 3.63Å; I625-L657 HydrophobicContact CD1-CD1 4.22Å; I625-L657 HydrophobicContact CD1-CG 4.29Å; I625-L657 HydrophobicContact CG1-CD1 4.34Å; I625-L657 HydrophobicContact CG1-CD2 4.2Å; I625-L657 HydrophobicContact CG1-CG 4.39Å; I625-L657 HydrophobicContact CG2-CD2 4Å; I625-L696 HydrophobicContact CG2-CD1 4.08Å
626	L	96.4	Very high	94.1	Very high	16 Å²	16	36.7 Å²	36.7	8%	0.084	21%	0.207	C	C	.	.	H	α-helix	trans	-56.1	-47.9	176.2	-81.8	167.5	0	0	0	111.7	L622 Q623 A628 L629 Q630 L693 L696 Q700	L622-L626 WeakPolarHBondContact O-CB 3.42Å; L622-L626 WeakPolarHBondContact O-CG 3.39Å; L622-L626 PolarHBondContact O-N 2.87Å; Q623-L626 PolarHBondContact O-N 2.98Å; L626-A628 VanDerWaalsContact C-N 3.31Å; L626-A628 PolarHBondContact O-N 3.33Å; L626-L629 PolarHBondContact O-N 3.32Å; L626-Q630 WeakPolarHBondContact O-CB 3.12Å; L626-Q630 VanDerWaalsContact O-CG 3.24Å; L626-Q630 WeakPolarHBondContact O-CG 3.24Å; L626-Q630 PolarHBondContact O-N 3.43Å; L626-L693 HydrophobicContact CD2-CD2 4.14Å; L626-L696 HydrophobicContact CD1-CB 4.42Å; L626-L696 HydrophobicContact CD2-CB 3.5Å; L626-L696 HydrophobicContact CD2-CD1 4.43Å; L626-L696 HydrophobicContact CG-CB 3.91Å; L626-Q700 HydrophobicContact CD1-CB 3.97Å; L626-Q700 HydrophobicContact CD1-CG 4.23Å
627	L	95.2	Very high	94.2	Very high	69 Å²	69	33.2 Å²	33.2	36%	0.361	19%	0.189	S	C	.	.	H	α-helix	trans	-60.7	-41.6	177.8	-174	72.6	0	0	0	111.4	F576 Q623 C624 I625 N631	F576-L627 HydrophobicContact CE1-CD2 4.06Å; F576-L627 HydrophobicContact CZ-CB 4.36Å; F576-L627 HydrophobicContact CZ-CD2 3.97Å; F576-L627 HydrophobicContact CZ-CG 4.5Å; Q623-L627 WeakPolarHBondContact O-CB 3.44Å; Q623-L627 PolarHBondContact O-N 3.02Å; C624-L627 PolarHBondContact O-N 3.39Å; I625-L627 VanDerWaalsContact C-N 3.33Å; I625-L627 PolarHBondContact O-N 3.46Å; L627-N631 WeakPolarHBondContact CD1-ND2 3.26Å; L627-N631 WeakPolarHBondContact O-CB 3.39Å; L627-N631 PolarHBondContact O-N 3.1Å; L627-N631 PolarHBondContact O-ND2 3.04Å
628	A	95.3	Very high	94.3	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-63.3	-53.2	177.4	0	0	0	0	0	111.5	L574 F576 C624 I625 L626 Q630 N631 L632 L638	L574-A628 HydrophobicContact CD2-CB 3.94Å; F576-A628 HydrophobicContact CE2-CB 4.07Å; C624-A628 WeakPolarHBondContact O-CB 3.42Å; C624-A628 PolarHBondContact O-N 3.22Å; I625-A628 WeakPolarHBondContact O-CB 3.41Å; I625-A628 PolarHBondContact O-N 3.2Å; I625-A628 VanDerWaalsContact O-N 3.17Å; L626-A628 VanDerWaalsContact C-N 3.31Å; L626-A628 PolarHBondContact O-N 3.33Å; A628-Q630 PolarHBondContact O-N 3.31Å; A628-N631 PolarHBondContact O-N 3.28Å; A628-N631 VanDerWaalsContact O-N 3.15Å; A628-L632 HydrophobicContact CB-CD1 4.03Å; A628-L632 WeakPolarHBondContact O-CB 3.3Å; A628-L632 WeakPolarHBondContact O-CD1 3.43Å; A628-L632 WeakPolarHBondContact O-CG 3.33Å; A628-L632 PolarHBondContact O-N 3.35Å; A628-L638 HydrophobicContact CB-CD1 3.88Å; A628-L638 HydrophobicContact CB-CD2 3.91Å
629	L	95.3	Very high	94.2	Very high	7 Å²	7	33 Å²	33	4%	0.037	19%	0.188	C	C	.	.	H	α-helix	trans	-63.7	-25.1	-176.7	-62	179	0	0	0	112.8	I625 L626 C660 F661 F684 A689 L693 L696	I625-L629 HydrophobicContact CG2-CD1 3.75Å; I625-L629 HydrophobicContact CG2-CG 4.1Å; I625-L629 VanDerWaalsContact O-CG 3.27Å; I625-L629 WeakPolarHBondContact O-CG 3.38Å; I625-L629 PolarHBondContact O-N 3.37Å; L626-L629 PolarHBondContact O-N 3.32Å; L629-C660 HydrophobicContact CD2-CB 3.74Å; L629-F661 HydrophobicContact CD2-CE2 4.05Å; L629-F684 HydrophobicContact CB-CZ 4.48Å; L629-F684 HydrophobicContact CD2-CD2 4.18Å; L629-F684 HydrophobicContact CD2-CE2 3.47Å; L629-F684 VanDerWaalsContact CD2-CE2 3.47Å; L629-F684 HydrophobicContact CD2-CZ 4.23Å; L629-F684 WeakPolarHBondContact O-CZ 3.5Å; L629-A689 HydrophobicContact CB-CB 4.48Å; L629-A689 HydrophobicContact CD2-CB 4.31Å; L629-L693 HydrophobicContact CB-CD2 3.78Å; L629-L693 HydrophobicContact CD1-CD2 4.43Å; L629-L696 HydrophobicContact CD1-CD1 3.62Å
630	Q	94.8	Very high	94.1	Very high	124 Å²	124	31.8 Å²	31.8	58%	0.579	18%	0.182	S	C	*	.	H	α-helix	trans	-83.2	-26.9	176.6	-72.4	173.5	-14	0	0	114.1	L626 A628 L693	L626-Q630 WeakPolarHBondContact O-CB 3.12Å; L626-Q630 VanDerWaalsContact O-CG 3.24Å; L626-Q630 WeakPolarHBondContact O-CG 3.24Å; L626-Q630 PolarHBondContact O-N 3.43Å; A628-Q630 PolarHBondContact O-N 3.31Å; Q630-L693 HydrophobicContact CG-CD2 3.91Å
631	N	92.8	Very high	93.9	Very high	93 Å²	93	30.3 Å²	30.3	50%	0.497	18%	0.175	S	C	.	.	H	α-helix	trans	-108.7	-17.5	-171	-70.4	-60.2	0	0	0	114.6	L627 A628	L627-N631 WeakPolarHBondContact CD1-ND2 3.26Å; L627-N631 WeakPolarHBondContact O-CB 3.39Å; L627-N631 PolarHBondContact O-N 3.1Å; L627-N631 PolarHBondContact O-ND2 3.04Å; A628-N631 PolarHBondContact O-N 3.28Å; A628-N631 VanDerWaalsContact O-N 3.15Å
632	L	93.6	Very high	93.7	Very high	18 Å²	18	30.3 Å²	30.3	9%	0.094	18%	0.175	C	C	.	.	P	Polyproline II helix	trans	-75.5	143.9	178.3	-69.4	168.5	0	0	0	111.2	L574 A628 D636 L638 F661 F684	L574-L632 HydrophobicContact CB-CD2 3.92Å; A628-L632 HydrophobicContact CB-CD1 4.03Å; A628-L632 WeakPolarHBondContact O-CB 3.3Å; A628-L632 WeakPolarHBondContact O-CD1 3.43Å; A628-L632 WeakPolarHBondContact O-CG 3.33Å; A628-L632 PolarHBondContact O-N 3.35Å; L632-D636 HydrophobicContact CB-CB 4.24Å; L632-D636 HydrophobicContact CD2-CB 3.65Å; L632-D636 HydrophobicContact CG-CB 4.5Å; L632-L638 HydrophobicContact CD1-CB 4.13Å; L632-F661 HydrophobicContact CD1-CE1 4.21Å; L632-F661 HydrophobicContact CD1-CZ 3.71Å; L632-F684 HydrophobicContact CB-CB 4.31Å; L632-F684 HydrophobicContact CB-CD1 3.44Å; L632-F684 VanDerWaalsContact CB-CD1 3.44Å; L632-F684 HydrophobicContact CB-CE1 3.85Å; L632-F684 HydrophobicContact CB-CG 3.89Å; L632-F684 HydrophobicContact CD1-CG 4.41Å; L632-F684 VanDerWaalsContact O-CE1 3.26Å; L632-F684 WeakPolarHBondContact O-CE1 3.38Å
633	S	92.9	Very high	93.4	Very high	62 Å²	62	30.5 Å²	30.5	43%	0.434	18%	0.175	S	C	.	.	P	Polyproline II helix	trans	-96.5	162.4	172	-59.2	0	0	0	0	110.8	G635 D636	S633-G635 PolarHBondContact O-N 2.77Å; S633-D636 WeakPolarHBondContact CA-OD2 3.26Å; S633-D636 WeakPolarHBondContact CB-OD2 3.47Å; S633-D636 PolarHBondContact N-OD2 3.29Å; S633-D636 VanDerWaalsContact O-CB 3.28Å; S633-D636 WeakPolarHBondContact O-CB 3.48Å; S633-D636 PolarHBondContact O-N 3.46Å
634	A	92.5	Very high	93.2	Very high	74 Å²	74	25.5 Å²	25.5	61%	0.612	15%	0.152	S	C	*	.	T	Hydrogen-bonded Turn	trans	-54.3	127	179.5	0	0	0	0	0	111.5	F684 P686	A634-F684 WeakPolarHBondContact CA-O 3.29Å; A634-P686 HydrophobicContact CB-CG 3.9Å
635	G	89.3	Confident	93.2	Very high	23 Å²	23	24.9 Å²	24.9	24%	0.237	15%	0.148	C	C	.	.	T	Hydrogen-bonded Turn	trans	87.7	-6.3	-179.1	0	0	0	0	0	115.8	S633 F684	S633-G635 PolarHBondContact O-N 2.77Å; G635-F684 PolarHBondContact N-O 2.92Å
636	D	92.7	Very high	93.1	Very high	11 Å²	11	25 Å²	25	6%	0.059	15%	0.149	C	C	.	.			trans	-66.9	164	176.5	-74	-20.9	0	0	0	112.3	R572 L632 S633 G683 F684	R572-D636 WeakPolarHBondContact CB-OD1 3.44Å; R572-D636 PolarHBondContact N-OD1 3.18Å; R572-D636 VanDerWaalsContact N-OD1 3.13Å; R572-D636 WeakPolarHBondContact O-CB 3.32Å; L632-D636 HydrophobicContact CB-CB 4.24Å; L632-D636 HydrophobicContact CD2-CB 3.65Å; L632-D636 HydrophobicContact CG-CB 4.5Å; S633-D636 WeakPolarHBondContact CA-OD2 3.26Å; S633-D636 WeakPolarHBondContact CB-OD2 3.47Å; S633-D636 PolarHBondContact N-OD2 3.29Å; S633-D636 VanDerWaalsContact O-CB 3.28Å; S633-D636 WeakPolarHBondContact O-CB 3.48Å; S633-D636 PolarHBondContact O-N 3.46Å; D636-G683 PolarHBondContact O-N 3.28Å; D636-G683 VanDerWaalsContact O-N 3.16Å; D636-F684 PolarHBondContact O-N 3.03Å
637	A	93.1	Very high	93.1	Very high	2 Å²	2	24.2 Å²	24.2	2%	0.017	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112	156.2	177.9	0	0	0	0	0	112.2	R572 C573 L574 C681	R572-A637 PolarHBondContact O-N 3.24Å; C573-A637 WeakPolarHBondContact CA-O 3.41Å; C573-A637 HydrophobicContact CB-CB 4.18Å; L574-A637 PolarHBondContact N-O 2.9Å; A637-C681 CarbonylContact C-O 3.55Å; A637-C681 VanDerWaalsContact CA-O 3.29Å; A637-C681 WeakPolarHBondContact CA-O 3.46Å
638	L	94.5	Very high	93.1	Very high	0 Å²	0	21 Å²	21	0%	0	13%	0.128	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	128.4	175.2	170.1	68.1	0	0	0	109.2	L574 F576 A628 L632 L640 L657 F661 C681	L574-L638 HydrophobicContact CB-CD1 4.29Å; L574-L638 HydrophobicContact CD2-CD1 4.4Å; L574-L638 HydrophobicContact CG-CD1 4.36Å; L574-L638 WeakPolarHBondContact O-CA 3.35Å; F576-L638 HydrophobicContact CD2-CD1 3.62Å; F576-L638 HydrophobicContact CE2-CD1 3.68Å; A628-L638 HydrophobicContact CB-CD1 3.88Å; A628-L638 HydrophobicContact CB-CD2 3.91Å; L632-L638 HydrophobicContact CD1-CB 4.13Å; L638-L640 HydrophobicContact CD1-CB 4.37Å; L638-L640 HydrophobicContact CD2-CB 4.31Å; L638-L640 HydrophobicContact CG-CB 4.14Å; L638-L657 HydrophobicContact CD2-CD2 3.76Å; L638-F661 HydrophobicContact CB-CE1 3.93Å; L638-F661 HydrophobicContact CB-CZ 3.7Å; L638-F661 HydrophobicContact CD2-CE2 4.26Å; L638-F661 HydrophobicContact CD2-CZ 3.99Å; L638-C681 HydrophobicContact CB-CB 4.12Å; L638-C681 PolarHBondContact N-O 2.71Å; L638-C681 PolarHBondContact O-N 3.01Å
639	L	92.4	Very high	93.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111.7	166.3	-60.8	-177.8	0	0	0	108	I557 L558 A561 L574 V575 F576 W582 L678 L679 T680	I557-L639 HydrophobicContact CG2-CD2 4.34Å; L558-L639 HydrophobicContact CD2-CD1 4.21Å; A561-L639 HydrophobicContact CB-CD2 4.47Å; L574-L639 PolarHBondContact O-N 3.19Å; V575-L639 HydrophobicContact CB-CB 4.47Å; V575-L639 HydrophobicContact CG1-CB 4.18Å; V575-L639 HydrophobicContact CG2-CB 4.26Å; V575-L639 HydrophobicContact CG2-CD1 4.05Å; V575-L639 HydrophobicContact CG2-CG 4.44Å; F576-L639 PolarHBondContact N-O 3.24Å; W582-L639 HydrophobicContact CH2-CD1 3.57Å; W582-L639 HydrophobicContact CZ2-CD1 4.1Å; W582-L639 HydrophobicContact CZ3-CD1 3.98Å; L639-L678 HydrophobicContact CB-CD1 4.28Å; L639-L679 WeakPolarHBondContact CA-O 3.3Å; L639-T680 HydrophobicContact CD2-CG2 3.78Å
640	L	92.6	Very high	93.2	Very high	0 Å²	0	20.9 Å²	20.9	0%	0	13%	0.127	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.9	120.7	-175.5	178.3	63.3	0	0	0	110.7	F576 L621 C624 I625 L638 V642 L657 L679	F576-L640 HydrophobicContact CB-CD1 3.73Å; F576-L640 HydrophobicContact CD2-CD1 4.02Å; F576-L640 HydrophobicContact CG-CD1 3.96Å; L621-L640 HydrophobicContact CD1-CD1 4.33Å; L621-L640 HydrophobicContact CD1-CD2 3.89Å; L621-L640 HydrophobicContact CD1-CG 4.31Å; C624-L640 HydrophobicContact CB-CD1 4.03Å; I625-L640 HydrophobicContact CD1-CD2 4.27Å; I625-L640 HydrophobicContact CG1-CD2 3.77Å; L638-L640 HydrophobicContact CD1-CB 4.37Å; L638-L640 HydrophobicContact CD2-CB 4.31Å; L638-L640 HydrophobicContact CG-CB 4.14Å; L640-V642 HydrophobicContact CD2-CG1 4.47Å; L640-V642 HydrophobicContact CG-CG1 4.3Å; L640-L657 HydrophobicContact CD2-CD1 3.84Å; L640-L679 PolarHBondContact N-O 2.89Å; L640-L679 WeakPolarHBondContact O-CB 3.28Å; L640-L679 PolarHBondContact O-N 2.96Å
641	R	89.5	Confident	93.3	Very high	14 Å²	14	15 Å²	15	5%	0.053	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	132	173.6	-167.8	75.2	79	142.1	0.7	110.9	F576 D577 F602 A677 L678	F576-R641 WeakPolarHBondContact O-CB 3.46Å; F576-R641 PolarHBondContact O-N 3.43Å; D577-R641 VanDerWaalsContact CG-NH2 3.3Å; D577-R641 IonicContact OD1-CZ 3.67Å; D577-R641 IonicContact OD1-NE 3.45Å; D577-R641 IonicContact OD1-NH2 3.61Å; D577-R641 PolarHBondContact OD1-NH2 3.07Å; D577-R641 IonicContact OD2-CZ 3.19Å; D577-R641 IonicContact OD2-NE 2.83Å; D577-R641 IonicContact OD2-NH2 2.74Å; D577-R641 PolarHBondContact OD2-NH2 2.98Å; F602-R641 HydrophobicContact CE2-CG 4.28Å; F602-R641 HydrophobicContact CZ-CG 3.55Å; R641-A677 WeakPolarHBondContact CD-O 3.48Å; R641-L678 HydrophobicContact CB-CD1 4.4Å
642	V	91.3	Very high	93.5	Very high	2 Å²	2	10.6 Å²	10.6	1%	0.012	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.6	138.9	175.6	-60.8	0	0	0	0	110.8	Y617 L621 L640 G676 A677 L679 M746	Y617-V642 WeakPolarHBondContact OH-CA 3.39Å; L621-V642 HydrophobicContact CD1-CG1 4Å; L640-V642 HydrophobicContact CD2-CG1 4.47Å; L640-V642 HydrophobicContact CG-CG1 4.3Å; V642-G676 CarbonylContact O-C 3.59Å; V642-G676 VanDerWaalsContact O-CA 3.29Å; V642-G676 WeakPolarHBondContact O-CA 3.48Å; V642-A677 HydrophobicContact CG2-CB 3.91Å; V642-A677 PolarHBondContact N-O 3.22Å; V642-A677 PolarHBondContact O-N 3.06Å; V642-A677 VanDerWaalsContact O-O 3.12Å; V642-L679 HydrophobicContact CG1-CD1 3.7Å; V642-L679 HydrophobicContact CG1-CG 4.13Å; V642-L679 HydrophobicContact CG2-CD1 4.16Å; V642-L679 HydrophobicContact CG2-CD2 4.24Å; V642-L679 HydrophobicContact CG2-CG 3.89Å; V642-M746 HydrophobicContact CG2-SD 4.3Å
643	F	89.4	Confident	93.6	Very high	5 Å²	5	9.8 Å²	9.8	2%	0.022	7%	0.072	C	C	.	.	S	Bend	trans	-71.3	-44.8	-179.7	-170.5	-127.7	0	0	0	112.9	F602 P603 I608 H611 Y617 V675 G676 I750	F602-F643 HydrophobicContact CD1-CB 3.75Å; F602-F643 AromaticContact CD1-CD2 3.45Å; F602-F643 HydrophobicContact CD1-CD2 3.45Å; F602-F643 VanDerWaalsContact CD1-CD2 3.45Å; F602-F643 HydrophobicContact CD1-CE2 4.29Å; F602-F643 AromaticContact CD1-CG 3.87Å; F602-F643 HydrophobicContact CD1-CG 3.87Å; F602-F643 HydrophobicContact CE1-CB 3.7Å; F602-F643 AromaticContact CE1-CD2 3.81Å; F602-F643 HydrophobicContact CE1-CD2 3.81Å; F602-F643 HydrophobicContact CE1-CG 4.18Å; F602-F643 HydrophobicContact CG-CD2 4.44Å; P603-F643 HydrophobicContact CG-CE1 4.48Å; I608-F643 HydrophobicContact CG2-CE1 4.02Å; I608-F643 HydrophobicContact CG2-CZ 4.17Å; H611-F643 HydrophobicContact CB-CE1 4.45Å; Y617-F643 HydrophobicContact CE1-CB 4.39Å; Y617-F643 HydrophobicContact CE2-CB 3.87Å; Y617-F643 PolarHBondContact OH-N 3.39Å; F643-V675 VanDerWaalsContact CD2-O 3.26Å; F643-V675 WeakPolarHBondContact CD2-O 3.3Å; F643-V675 WeakPolarHBondContact CE2-O 3.37Å; F643-G676 WeakPolarHBondContact O-CA 3.39Å; F643-I750 WeakPolarHBondContact O-CG2 3.4Å
644	S	92.8	Very high	93.8	Very high	2 Å²	2	6.9 Å²	6.9	1%	0.014	5%	0.052	C	C	.	.			trans	-171.1	175.6	174.4	49.9	0	0	0	0	107.5	D612 T650	D612-S644 WeakPolarHBondContact CB-O 3.45Å; D612-S644 WeakPolarHBondContact CB-OG 3.23Å; D612-S644 VanDerWaalsContact CG-OG 3.3Å; D612-S644 PolarHBondContact OD1-OG 2.93Å; S644-T650 WeakPolarHBondContact O-CG2 3.4Å
645	A	95.3	Very high	93.9	Very high	0 Å²	0	3.3 Å²	3.3	0%	0	2%	0.023	C	C	.	.			trans	-132.9	54.1	169.5	0	0	0	0	0	109.9	T650 V654 L743 M746 N747	A645-T650 HydrophobicContact CB-CG2 3.91Å; A645-V654 HydrophobicContact CB-CG2 4.29Å; A645-L743 HydrophobicContact CB-CD2 3.82Å; A645-M746 HydrophobicContact CB-CE 3.47Å; A645-M746 VanDerWaalsContact CB-CE 3.47Å; A645-N747 VanDerWaalsContact C-ND2 3.33Å; A645-N747 PolarHBondContact N-OD1 3.41Å; A645-N747 PolarHBondContact O-ND2 3.15Å
646	L	94.2	Very high	94.2	Very high	2 Å²	2	2.2 Å²	2.2	1%	0.01	1%	0.012	C	C	.	.			trans	-81.4	-29.2	-179.8	-60.8	166.8	0	0	0	111	V515 S518 C521 L526 H611 D612 N747	V515-L646 HydrophobicContact CG1-CB 3.98Å; V515-L646 HydrophobicContact CG1-CD1 4.48Å; S518-L646 VanDerWaalsContact CB-O 3.24Å; S518-L646 WeakPolarHBondContact CB-O 3.3Å; S518-L646 PolarHBondContact OG-O 3.11Å; C521-L646 HydrophobicContact CB-CD2 3.57Å; L526-L646 HydrophobicContact CD1-CD1 3.95Å; H611-L646 HydrophobicContact CB-CD1 3.68Å; D612-L646 VanDerWaalsContact OD1-CB 3.25Å; D612-L646 WeakPolarHBondContact OD1-CB 3.45Å; D612-L646 PolarHBondContact OD1-N 3.26Å; D612-L646 PolarHBondContact OD2-N 3Å; D612-L646 VanDerWaalsContact OD2-N 3.15Å; L646-N747 HydrophobicContact CD2-CB 3.92Å
647	T	95.3	Very high	94.4	Very high	1 Å²	1	1.8 Å²	1.8	1%	0.006	1%	0.009	C	C	.	.	S	Bend	trans	-88.1	151.8	179.5	66.4	0	0	0	0	112.2	E186 V515 D612 Q618 V649 T650 A651	E186-T647 HydrophobicContact CG-CG2 4.23Å; V515-T647 HydrophobicContact CG2-CG2 3.76Å; D612-T647 WeakPolarHBondContact OD2-CB 3.37Å; D612-T647 PolarHBondContact OD2-N 3.34Å; D612-T647 PolarHBondContact OD2-OG1 3.15Å; Q618-T647 PolarHBondContact NE2-OG1 2.85Å; T647-V649 PolarHBondContact O-N 2.79Å; T647-T650 PolarHBondContact O-N 2.79Å; T647-T650 PolarHBondContact OG1-N 2.9Å; T647-T650 PolarHBondContact OG1-OG1 3.35Å; T647-T650 VanDerWaalsContact OG1-OG1 3.09Å; T647-A651 WeakPolarHBondContact O-CB 3.45Å; T647-A651 PolarHBondContact O-N 3.24Å
648	R	95.5	Very high	94.4	Very high	1 Å²	1	2.2 Å²	2.2	0%	0.004	1%	0.011	C	C	.	.	H	α-helix	trans	-60.3	-33.4	175.6	-72.5	173.2	-69.8	176.5	-8.7	112.7	Y184 E186 N213 F520 A652 L726 Q727 M731 L734	Y184-R648 WeakPolarHBondContact O-CD 3.42Å; Y184-R648 PolarHBondContact O-NE 3.07Å; Y184-R648 VanDerWaalsContact O-NE 3.1Å; E186-R648 WeakPolarHBondContact OE1-CB 3.11Å; E186-R648 VanDerWaalsContact OE1-CG 3.3Å; E186-R648 WeakPolarHBondContact OE1-CG 3.4Å; E186-R648 IonicContact OE1-CZ 2.68Å; E186-R648 PolarHBondContact OE1-N 3.46Å; E186-R648 IonicContact OE1-NE 3.23Å; E186-R648 PolarHBondContact OE1-NE 3.11Å; E186-R648 IonicContact OE1-NH2 3.39Å; E186-R648 IonicContact OE2-CZ 2.76Å; E186-R648 IonicContact OE2-NE 3.39Å; E186-R648 PolarHBondContact OE2-NE 2.92Å; E186-R648 IonicContact OE2-NH2 2.65Å; E186-R648 PolarHBondContact OE2-NH2 3.19Å; N213-R648 PolarHBondContact ND2-NH1 3.45Å; F520-R648 HydrophobicContact CE2-CG 4.19Å; R648-A652 WeakPolarHBondContact O-CB 3.44Å; R648-A652 PolarHBondContact O-N 3.19Å; R648-L726 WeakPolarHBondContact CB-O 3.32Å; R648-L726 PolarHBondContact NE-O 2.95Å; R648-Q727 VanDerWaalsContact NH1-OE1 3.16Å; R648-M731 WeakPolarHBondContact CD-SD 3.37Å; R648-M731 HydrophobicContact CG-SD 3.6Å; R648-L734 HydrophobicContact CB-CD1 4.47Å
649	V	96.7	Very high	94.3	Very high	3 Å²	3	2.4 Å²	2.4	2%	0.018	1%	0.013	C	C	.	.	H	α-helix	trans	-63.6	-48.9	176.3	-179.3	0	0	0	0	110.5	Q618 T647 A652 A653 V725 F728	Q618-V649 HydrophobicContact CB-CG1 4.2Å; Q618-V649 HydrophobicContact CG-CG1 4.18Å; T647-V649 PolarHBondContact O-N 2.79Å; V649-A652 WeakPolarHBondContact O-CB 3.17Å; V649-A652 PolarHBondContact O-N 2.73Å; V649-A653 PolarHBondContact O-N 3.09Å; V649-V725 HydrophobicContact CG2-CG1 4.1Å; V649-V725 WeakPolarHBondContact CG2-O 3.49Å; V649-F728 HydrophobicContact CB-CE1 4.49Å; V649-F728 HydrophobicContact CG1-CD1 4.23Å; V649-F728 HydrophobicContact CG1-CE1 3.91Å; V649-F728 WeakPolarHBondContact O-CE1 3.25Å
650	T	96.6	Very high	94.4	Very high	1 Å²	1	2.4 Å²	2.4	1%	0.006	1%	0.013	C	C	.	.	H	α-helix	trans	-72.5	-37.1	179.5	-50.5	0	0	0	0	112.4	D612 L621 S644 A645 T647 A652 A653 V654	D612-T650 HydrophobicContact CB-CG2 4.42Å; D612-T650 PolarHBondContact O-OG1 2.93Å; D612-T650 WeakPolarHBondContact OD2-CB 3.37Å; D612-T650 PolarHBondContact OD2-OG1 3.23Å; L621-T650 HydrophobicContact CD2-CG2 3.6Å; S644-T650 WeakPolarHBondContact O-CG2 3.4Å; A645-T650 HydrophobicContact CB-CG2 3.91Å; T647-T650 PolarHBondContact O-N 2.79Å; T647-T650 PolarHBondContact OG1-N 2.9Å; T647-T650 PolarHBondContact OG1-OG1 3.35Å; T647-T650 VanDerWaalsContact OG1-OG1 3.09Å; T650-A652 VanDerWaalsContact C-N 3.29Å; T650-A652 PolarHBondContact O-N 3.17Å; T650-A653 VanDerWaalsContact O-CB 3.3Å; T650-A653 WeakPolarHBondContact O-CB 3.48Å; T650-A653 PolarHBondContact O-N 2.89Å; T650-A653 VanDerWaalsContact O-N 3.12Å; T650-V654 PolarHBondContact O-N 3.27Å
651	A	96.8	Very high	94.5	Very high	0 Å²	0	2.4 Å²	2.4	0%	0	1%	0.013	C	C	.	.	H	α-helix	trans	-59.8	-40.7	171.8	0	0	0	0	0	111.6	F520 T647 A653 V654 F655 L743	F520-A651 HydrophobicContact CD2-CB 3.69Å; F520-A651 HydrophobicContact CE1-CB 4.22Å; F520-A651 HydrophobicContact CE2-CB 3.33Å; F520-A651 HydrophobicContact CG-CB 4.28Å; F520-A651 HydrophobicContact CZ-CB 3.63Å; T647-A651 WeakPolarHBondContact O-CB 3.45Å; T647-A651 PolarHBondContact O-N 3.24Å; A651-A653 VanDerWaalsContact C-N 3.34Å; A651-V654 PolarHBondContact O-N 2.97Å; A651-F655 WeakPolarHBondContact O-CB 3.39Å; A651-F655 PolarHBondContact O-N 3.36Å; A651-L743 HydrophobicContact CB-CD1 3.61Å
652	A	96.7	Very high	94.7	Very high	1 Å²	1	8.7 Å²	8.7	1%	0.008	4%	0.036	C	C	.	.	H	α-helix	trans	-65.8	-34.2	173.5	0	0	0	0	0	112.8	R648 V649 T650 F655 C656 F728 V729 L734	R648-A652 WeakPolarHBondContact O-CB 3.44Å; R648-A652 PolarHBondContact O-N 3.19Å; V649-A652 WeakPolarHBondContact O-CB 3.17Å; V649-A652 PolarHBondContact O-N 2.73Å; T650-A652 VanDerWaalsContact C-N 3.29Å; T650-A652 PolarHBondContact O-N 3.17Å; A652-F655 WeakPolarHBondContact O-CB 3.38Å; A652-F655 PolarHBondContact O-N 2.98Å; A652-C656 PolarHBondContact O-N 3.32Å; A652-C656 PolarHBondContact O-SG 3.21Å; A652-F728 HydrophobicContact CB-CD1 4.06Å; A652-F728 HydrophobicContact CB-CD2 4.44Å; A652-F728 HydrophobicContact CB-CE1 3.46Å; A652-F728 VanDerWaalsContact CB-CE1 3.46Å; A652-F728 HydrophobicContact CB-CE2 3.89Å; A652-F728 HydrophobicContact CB-CZ 3.36Å; A652-V729 HydrophobicContact CB-CB 3.77Å; A652-V729 HydrophobicContact CB-CG2 3.56Å; A652-L734 HydrophobicContact CB-CD1 4.47Å; A652-L734 HydrophobicContact CB-CD2 4.24Å
653	A	96.6	Very high	94.8	Very high	1 Å²	1	9.7 Å²	9.7	1%	0.008	4%	0.043	C	C	.	.	H	α-helix	trans	-63	-46.1	172.6	0	0	0	0	0	111.5	L621 L622 I625 V649 T650 A651 F655 C656 L657	L621-A653 HydrophobicContact CD2-CB 4.19Å; L622-A653 HydrophobicContact CD2-CB 4.06Å; I625-A653 HydrophobicContact CD1-CB 3.63Å; V649-A653 PolarHBondContact O-N 3.09Å; T650-A653 VanDerWaalsContact O-CB 3.3Å; T650-A653 WeakPolarHBondContact O-CB 3.48Å; T650-A653 PolarHBondContact O-N 2.89Å; T650-A653 VanDerWaalsContact O-N 3.12Å; A651-A653 VanDerWaalsContact C-N 3.34Å; A653-F655 VanDerWaalsContact C-N 3.31Å; A653-F655 PolarHBondContact O-N 3.06Å; A653-C656 PolarHBondContact O-N 3.43Å; A653-L657 PolarHBondContact O-N 3.44Å
654	V	96.1	Very high	95	Very high	1 Å²	1	9.4 Å²	9.4	1%	0.006	4%	0.042	C	C	.	.	H	α-helix	trans	-63.4	-37.8	173.3	-179.8	0	0	0	0	111.4	A645 T650 A651 C656 L657 H658 L679 L739 F742 L743	A645-V654 HydrophobicContact CB-CG2 4.29Å; T650-V654 PolarHBondContact O-N 3.27Å; A651-V654 PolarHBondContact O-N 2.97Å; V654-C656 PolarHBondContact O-N 2.86Å; V654-L657 WeakPolarHBondContact O-CB 3.32Å; V654-L657 PolarHBondContact O-N 3Å; V654-H658 PolarHBondContact O-N 2.91Å; V654-L679 HydrophobicContact CG2-CD1 4.01Å; V654-L739 HydrophobicContact CG1-CD1 4.33Å; V654-F742 HydrophobicContact CG1-CE1 4.19Å; V654-L743 HydrophobicContact CB-CD2 4.03Å; V654-L743 HydrophobicContact CG1-CD2 3.86Å; V654-L743 HydrophobicContact CG2-CD2 4.17Å
655	F	95.3	Very high	95	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-60.7	-42.5	174.6	178.6	-93.9	0	0	0	112.7	W504 A651 A652 A653 L657 H658 A659 M692 V729 L734 L739	W504-F655 AromaticContact CH2-CD1 3.96Å; W504-F655 HydrophobicContact CH2-CD1 3.96Å; W504-F655 AromaticContact CH2-CE1 3.85Å; W504-F655 HydrophobicContact CH2-CE1 3.85Å; W504-F655 HydrophobicContact CZ2-CD1 4.02Å; W504-F655 AromaticContact CZ2-CE1 3.56Å; W504-F655 HydrophobicContact CZ2-CE1 3.56Å; A651-F655 WeakPolarHBondContact O-CB 3.39Å; A651-F655 PolarHBondContact O-N 3.36Å; A652-F655 WeakPolarHBondContact O-CB 3.38Å; A652-F655 PolarHBondContact O-N 2.98Å; A653-F655 VanDerWaalsContact C-N 3.31Å; A653-F655 PolarHBondContact O-N 3.06Å; F655-L657 VanDerWaalsContact C-N 3.3Å; F655-L657 PolarHBondContact O-N 2.95Å; F655-H658 WeakPolarHBondContact O-CB 3.27Å; F655-H658 PolarHBondContact O-N 2.81Å; F655-H658 VanDerWaalsContact O-N 3.09Å; F655-A659 PolarHBondContact O-N 3.39Å; F655-M692 HydrophobicContact CE1-CE 4.45Å; F655-V729 HydrophobicContact CD1-CG1 4.27Å; F655-L734 HydrophobicContact CB-CD2 3.82Å; F655-L734 HydrophobicContact CD2-CD2 4.44Å; F655-L734 HydrophobicContact CG-CD2 4.04Å; F655-L739 HydrophobicContact CB-CD1 4.45Å; F655-L739 HydrophobicContact CB-CD2 3.99Å; F655-L739 HydrophobicContact CD2-CD2 3.77Å; F655-L739 HydrophobicContact CG-CD2 4.32Å
656	C	95.4	Very high	94.8	Very high	0 Å²	0	9.5 Å²	9.5	0%	0	4%	0.043	C	C	.	.	H	α-helix	trans	-62.1	-40.8	176.9	-66.2	0	0	0	0	111.1	A652 A653 V654 A659 C660 M692 L696	A652-C656 PolarHBondContact O-N 3.32Å; A652-C656 PolarHBondContact O-SG 3.21Å; A653-C656 PolarHBondContact O-N 3.43Å; V654-C656 PolarHBondContact O-N 2.86Å; C656-A659 PolarHBondContact O-N 2.92Å; C656-C660 PolarHBondContact O-N 3.33Å; C656-C660 PolarHBondContact O-SG 3.39Å; C656-M692 HydrophobicContact CB-SD 3.8Å; C656-L696 HydrophobicContact CB-CD1 4.41Å; C656-L696 HydrophobicContact CB-CD2 4.39Å
657	L	95.5	Very high	94.4	Very high	1 Å²	1	10 Å²	10	1%	0.005	5%	0.045	C	C	.	.	H	α-helix	trans	-60.9	-45.6	171.3	-63.5	173.3	0	0	0	110.7	I625 L638 L640 A653 V654 F655 A659 C660 F661 I664 L679	I625-L657 HydrophobicContact CD1-CD1 4.22Å; I625-L657 HydrophobicContact CD1-CG 4.29Å; I625-L657 HydrophobicContact CG1-CD1 4.34Å; I625-L657 HydrophobicContact CG1-CD2 4.2Å; I625-L657 HydrophobicContact CG1-CG 4.39Å; I625-L657 HydrophobicContact CG2-CD2 4Å; L638-L657 HydrophobicContact CD2-CD2 3.76Å; L640-L657 HydrophobicContact CD2-CD1 3.84Å; A653-L657 PolarHBondContact O-N 3.44Å; V654-L657 WeakPolarHBondContact O-CB 3.32Å; V654-L657 PolarHBondContact O-N 3Å; F655-L657 VanDerWaalsContact C-N 3.3Å; F655-L657 PolarHBondContact O-N 2.95Å; L657-A659 PolarHBondContact O-N 3.48Å; L657-C660 PolarHBondContact O-N 2.86Å; L657-F661 HydrophobicContact CB-CD2 4.47Å; L657-F661 HydrophobicContact CD2-CD2 4.38Å; L657-F661 HydrophobicContact CD2-CE2 3.85Å; L657-F661 VanDerWaalsContact O-CD2 3.32Å; L657-F661 WeakPolarHBondContact O-CD2 3.46Å; L657-F661 PolarHBondContact O-N 3.47Å; L657-I664 HydrophobicContact CB-CD1 3.52Å; L657-L679 HydrophobicContact CD1-CD1 4.1Å
658	H	94.3	Very high	93.7	Very high	11 Å²	11	11.2 Å²	11.2	5%	0.051	5%	0.052	C	C	.	.	H	α-helix	trans	-58.9	-35.8	-179.5	174.2	-137.9	0	0	0	112.3	E493 V654 F655 C660 I664	E493-H658 PolarHBondContact O-NE2 2.82Å; V654-H658 PolarHBondContact O-N 2.91Å; F655-H658 WeakPolarHBondContact O-CB 3.27Å; F655-H658 PolarHBondContact O-N 2.81Å; F655-H658 VanDerWaalsContact O-N 3.09Å; H658-C660 VanDerWaalsContact C-N 3.33Å; H658-I664 HydrophobicContact CB-CD1 4.01Å
659	A	93.1	Very high	92.6	Very high	5 Å²	5	11.8 Å²	11.8	4%	0.041	6%	0.056	C	C	.	.	H	α-helix	trans	-72.5	-25.3	175	0	0	0	0	0	113.6	P495 F655 C656 L657 A688 M692	P495-A659 WeakPolarHBondContact CB-O 3.42Å; F655-A659 PolarHBondContact O-N 3.39Å; C656-A659 PolarHBondContact O-N 2.92Å; L657-A659 PolarHBondContact O-N 3.48Å; A659-A688 WeakPolarHBondContact O-CB 3.37Å; A659-M692 HydrophobicContact CB-CE 3.17Å; A659-M692 HydrophobicContact CB-SD 3.95Å
660	C	94.7	Very high	90.8	Very high	0 Å²	0	12.9 Å²	12.9	0%	0	6%	0.063	C	C	.	.	H	α-helix	trans	-98.1	-10.2	-173.9	-64.5	0	0	0	0	114.6	L629 C656 L657 H658 F684 C685 A689 M692	L629-C660 HydrophobicContact CD2-CB 3.74Å; C656-C660 PolarHBondContact O-N 3.33Å; C656-C660 PolarHBondContact O-SG 3.39Å; L657-C660 PolarHBondContact O-N 2.86Å; H658-C660 VanDerWaalsContact C-N 3.33Å; C660-F684 HydrophobicContact CB-CD2 4.38Å; C660-F684 HydrophobicContact CB-CE2 4.14Å; C660-F684 WeakPolarHBondContact O-CD2 3.32Å; C660-C685 WeakPolarHBondContact O-CB 3.19Å; C660-C685 PolarHBondContact O-N 2.95Å; C660-A689 HydrophobicContact CB-CB 4.38Å; C660-A689 VanDerWaalsContact SG-CA 3.57Å; C660-M692 VanDerWaalsContact SG-SD 3.65Å
661	F	94.6	Very high	88.7	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.072	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	154.2	-175.6	-72.5	-98.2	0	0	0	111.8	G494 L629 L632 L638 L657 I664 C681 F684	G494-F661 CarbonylContact C-O 3.38Å; G494-F661 WeakPolarHBondContact CA-O 3.48Å; L629-F661 HydrophobicContact CD2-CE2 4.05Å; L632-F661 HydrophobicContact CD1-CE1 4.21Å; L632-F661 HydrophobicContact CD1-CZ 3.71Å; L638-F661 HydrophobicContact CB-CE1 3.93Å; L638-F661 HydrophobicContact CB-CZ 3.7Å; L638-F661 HydrophobicContact CD2-CE2 4.26Å; L638-F661 HydrophobicContact CD2-CZ 3.99Å; L657-F661 HydrophobicContact CB-CD2 4.47Å; L657-F661 HydrophobicContact CD2-CD2 4.38Å; L657-F661 HydrophobicContact CD2-CE2 3.85Å; L657-F661 VanDerWaalsContact O-CD2 3.32Å; L657-F661 WeakPolarHBondContact O-CD2 3.46Å; L657-F661 PolarHBondContact O-N 3.47Å; F661-I664 HydrophobicContact CB-CG1 4.39Å; F661-C681 HydrophobicContact CB-CB 4.17Å; F661-C681 HydrophobicContact CD1-CB 3.5Å; F661-C681 VanDerWaalsContact CD1-CB 3.5Å; F661-C681 HydrophobicContact CD2-CB 3.89Å; F661-C681 HydrophobicContact CE1-CB 3.72Å; F661-C681 HydrophobicContact CE2-CB 4.1Å; F661-C681 HydrophobicContact CG-CB 3.59Å; F661-C681 HydrophobicContact CZ-CB 4.01Å; F661-F684 HydrophobicContact CD1-CB 4.1Å; F661-F684 HydrophobicContact CD2-CD2 4.42Å; F661-F684 HydrophobicContact CE1-CB 3.72Å; F661-F684 HydrophobicContact CE1-CD2 4.19Å; F661-F684 HydrophobicContact CE1-CG 4.37Å; F661-F684 AromaticContact CE2-CD2 3.97Å; F661-F684 HydrophobicContact CE2-CD2 3.97Å; F661-F684 HydrophobicContact CZ-CB 4.19Å; F661-F684 AromaticContact CZ-CD2 3.85Å; F661-F684 HydrophobicContact CZ-CD2 3.85Å; F661-F684 HydrophobicContact CZ-CG 4.36Å
662	R	93.1	Very high	86.4	Confident	146 Å²	146	18.5 Å²	18.5	55%	0.551	10%	0.102	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-69.7	-33.3	176.7	-72.1	-176.9	-177.8	-163.7	0.8	112.9	G494 I682 G683	G494-R662 CarbonylContact C-O 3.42Å; G494-R662 WeakPolarHBondContact CA-O 3.24Å; G494-R662 PolarHBondContact N-O 2.84Å; G494-R662 WeakPolarHBondContact O-CA 3.41Å; R662-I682 WeakPolarHBondContact CB-O 3.29Å; R662-I682 PolarHBondContact N-O 3.44Å; R662-G683 WeakPolarHBondContact CG-O 3.38Å; R662-G683 PolarHBondContact N-O 3.02Å
663	S	92.5	Very high	84.3	Confident	22 Å²	22	22.2 Å²	22.2	15%	0.154	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-152	151.2	172.2	61.8	0	0	0	0	111.8	L492 C681 I682	L492-S663 CarbonylContact O-C 3.59Å; L492-S663 VanDerWaalsContact O-CA 3.25Å; L492-S663 WeakPolarHBondContact O-CA 3.44Å; S663-C681 WeakPolarHBondContact O-CA 3.35Å; S663-I682 PolarHBondContact N-O 2.7Å; S663-I682 PolarHBondContact O-N 3.32Å
664	I	94.1	Very high	82.6	Confident	0 Å²	0	23 Å²	23	0%	0	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	127.2	170.6	-55.8	-172.8	0	0	0	109.1	V491 L492 L657 H658 F661 L679 T680 C681 F742	V491-I664 CarbonylContact C-O 2.99Å; V491-I664 WeakPolarHBondContact CA-O 3.32Å; L492-I664 HydrophobicContact CB-CB 4.29Å; L492-I664 PolarHBondContact N-O 3.49Å; L492-I664 PolarHBondContact O-N 2.68Å; L657-I664 HydrophobicContact CB-CD1 3.52Å; H658-I664 HydrophobicContact CB-CD1 4.01Å; F661-I664 HydrophobicContact CB-CG1 4.39Å; I664-L679 HydrophobicContact CG2-CD2 4.5Å; I664-T680 WeakPolarHBondContact CA-O 3.49Å; I664-C681 HydrophobicContact CG1-CB 4.21Å; I664-F742 HydrophobicContact CG2-CE1 4.43Å; I664-F742 HydrophobicContact CG2-CE2 4.49Å; I664-F742 HydrophobicContact CG2-CZ 3.82Å; I664-F742 WeakPolarHBondContact O-CE2 3.32Å
665	S	93.1	Very high	81.5	Confident	4 Å²	4	23 Å²	23	3%	0.028	15%	0.149	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.6	174.1	166.8	67.4	0	0	0	0	110	E560 L679 T680	E560-S665 VanDerWaalsContact OE1-CB 3.3Å; E560-S665 WeakPolarHBondContact OE1-CB 3.5Å; E560-S665 PolarHBondContact OE1-OG 2.92Å; S665-L679 WeakPolarHBondContact O-CA 3.13Å; S665-T680 PolarHBondContact N-O 3.48Å; S665-T680 PolarHBondContact O-N 2.75Å
666	F	91.4	Very high	80.9	Confident	0 Å²	0	23.1 Å²	23.1	0%	0	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	154.7	173.3	74.7	-89.1	0	0	0	112.1	C490 A677 L678 L679 F742 T745 M746 E749	C490-F666 HydrophobicContact CB-CE1 3.79Å; C490-F666 HydrophobicContact CB-CZ 4.5Å; F666-A677 HydrophobicContact CB-CB 4.32Å; F666-A677 HydrophobicContact CD2-CB 4.35Å; F666-L678 WeakPolarHBondContact CA-O 3.35Å; F666-L679 HydrophobicContact CB-CD2 3.92Å; F666-F742 HydrophobicContact CB-CZ 4.19Å; F666-F742 HydrophobicContact CD1-CD2 4.21Å; F666-F742 HydrophobicContact CD1-CE1 4.35Å; F666-F742 AromaticContact CD1-CE2 3.6Å; F666-F742 HydrophobicContact CD1-CE2 3.6Å; F666-F742 AromaticContact CD1-CZ 3.67Å; F666-F742 HydrophobicContact CD1-CZ 3.67Å; F666-F742 HydrophobicContact CE1-CD2 4.48Å; F666-F742 HydrophobicContact CE1-CE2 4.28Å; F666-F742 HydrophobicContact CG-CZ 4.39Å; F666-T745 HydrophobicContact CE1-CG2 4.42Å; F666-T745 HydrophobicContact CZ-CG2 4.01Å; F666-M746 HydrophobicContact CB-CG 4.36Å; F666-M746 HydrophobicContact CB-SD 4.31Å; F666-M746 HydrophobicContact CD1-CB 3.86Å; F666-M746 HydrophobicContact CD1-CG 4.1Å; F666-M746 HydrophobicContact CD2-CB 4.17Å; F666-M746 HydrophobicContact CD2-CG 3.8Å; F666-M746 HydrophobicContact CE1-CB 3.73Å; F666-M746 HydrophobicContact CE1-CG 4.37Å; F666-M746 HydrophobicContact CE2-CB 4.07Å; F666-M746 HydrophobicContact CE2-CG 4.1Å; F666-M746 HydrophobicContact CG-CB 4.09Å; F666-M746 HydrophobicContact CG-CG 3.82Å; F666-M746 HydrophobicContact CG-SD 4.34Å; F666-M746 VanDerWaalsContact CZ-CA 3.42Å; F666-M746 HydrophobicContact CZ-CB 3.85Å; F666-M746 HydrophobicContact CZ-CG 4.38Å; F666-E749 HydrophobicContact CE2-CB 4.4Å; F666-E749 HydrophobicContact CE2-CG 4.35Å; F666-E749 HydrophobicContact CZ-CG 4.47Å
667	R	85.9	Confident	80.6	Confident	13 Å²	13	23.1 Å²	23.1	5%	0.049	15%	0.15	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.8	146.5	168.1	-64.4	-74.7	172.6	-97.6	-6.8	108.7	G487 L488 I557 E560 P669 A677 L678	G487-R667 PolarHBondContact O-NH1 3.05Å; L488-R667 VanDerWaalsContact CA-NH1 3.31Å; L488-R667 VanDerWaalsContact CD1-CZ 3.49Å; I557-R667 HydrophobicContact CD1-CB 4.41Å; I557-R667 HydrophobicContact CD1-CG 4.48Å; I557-R667 HydrophobicContact CG1-CG 4.3Å; E560-R667 VanDerWaalsContact CD-NH2 3.26Å; E560-R667 IonicContact OE1-NH2 3.2Å; E560-R667 PolarHBondContact OE1-NH2 3.41Å; E560-R667 IonicContact OE2-CZ 3.32Å; E560-R667 IonicContact OE2-NE 3.45Å; E560-R667 PolarHBondContact OE2-NE 3.05Å; E560-R667 IonicContact OE2-NH2 2.67Å; E560-R667 PolarHBondContact OE2-NH2 3.36Å; R667-P669 WeakPolarHBondContact O-CD 3.35Å; R667-A677 CarbonylContact O-C 3.57Å; R667-A677 WeakPolarHBondContact O-CA 3.45Å; R667-L678 PolarHBondContact N-O 2.97Å; R667-L678 PolarHBondContact O-N 3.2Å
668	C	80.9	Confident	80.3	Confident	25 Å²	25	23.1 Å²	23.1	17%	0.169	15%	0.15	C	C	.	.			trans	-106.9	76.4	172.4	-63.1	0	0	0	0	108.7
669	P	71.6	Confident	80.3	Confident	13 Å²	13	22.6 Å²	22.6	8%	0.084	15%	0.147	C	C	.	.			trans	-61.4	148.3	-179.6	30.3	-37.9	0	0	0	109.9	R667 L678	R667-P669 WeakPolarHBondContact O-CD 3.35Å; P669-L678 HydrophobicContact CG-CB 4.38Å
670	P	59.2	Low	80.3	Confident	26 Å²	26	22.3 Å²	22.3	17%	0.169	15%	0.145	C	C	.	.			trans	-65.1	160	178.8	23	-28.1	0	0	0	111.9	V551 S672	V551-P670 HydrophobicContact CB-CG 3.58Å; V551-P670 HydrophobicContact CG1-CG 3.43Å; V551-P670 VanDerWaalsContact CG1-CG 3.43Å; V551-P670 HydrophobicContact CG2-CB 4.31Å; V551-P670 HydrophobicContact CG2-CG 3.29Å; P670-S672 PolarHBondContact O-N 3.35Å; P670-S672 VanDerWaalsContact O-N 3.07Å
671	P	52.5	Low	80.2	Confident	28 Å²	28	22.3 Å²	22.3	18%	0.182	15%	0.145	C	C	.	.			trans	-71.6	110	-169.2	26.3	-32	0	0	0	111	P545 G673 V675 L757	P545-P671 HydrophobicContact CB-CG 4.1Å; P545-P671 HydrophobicContact CG-CG 4.18Å; P671-G673 VanDerWaalsContact C-N 3.3Å; P671-V675 HydrophobicContact CB-CG2 4.2Å; P671-V675 HydrophobicContact CG-CG2 4.42Å; P671-L757 HydrophobicContact CG-CD1 4.12Å
672	S	48.2	Very low	80.2	Confident	92 Å²	92	23.3 Å²	23.3	64%	0.643	15%	0.15	S	C	*	.	S	Bend	trans	-96.6	19.2	154	50.4	0	0	0	0	111.5	P670	P670-S672 PolarHBondContact O-N 3.35Å; P670-S672 VanDerWaalsContact O-N 3.07Å
673	G	51.6	Low	80.1	Confident	78 Å²	78	16.6 Å²	16.6	80%	0.804	13%	0.127	S	C	*	.	S	Bend	trans	154.7	-17.3	176.8	0	0	0	0	0	116.4	P671	P671-G673 VanDerWaalsContact C-N 3.3Å
674	G	62.5	Low	80.2	Confident	19 Å²	19	15.9 Å²	15.9	20%	0.196	12%	0.121	C	C	.	.			trans	-164.2	145.3	176.3	0	0	0	0	0	113.1
675	V	71.8	Confident	80.2	Confident	1 Å²	1	16.8 Å²	16.8	1%	0.006	13%	0.127	C	C	.	.			trans	-92.6	127.7	173.6	174.2	0	0	0	0	110.4	W540 F643 P671 I750 Q753 K754 L757	W540-V675 HydrophobicContact CH2-CB 4Å; W540-V675 HydrophobicContact CH2-CG2 3.58Å; W540-V675 HydrophobicContact CZ2-CB 3.43Å; W540-V675 VanDerWaalsContact CZ2-CB 3.43Å; W540-V675 HydrophobicContact CZ2-CG1 4.37Å; W540-V675 HydrophobicContact CZ2-CG2 3.31Å; F643-V675 VanDerWaalsContact CD2-O 3.26Å; F643-V675 WeakPolarHBondContact CD2-O 3.3Å; F643-V675 WeakPolarHBondContact CE2-O 3.37Å; P671-V675 HydrophobicContact CB-CG2 4.2Å; P671-V675 HydrophobicContact CG-CG2 4.42Å; V675-I750 HydrophobicContact CG1-CG2 4.46Å; V675-Q753 HydrophobicContact CG1-CB 4.21Å; V675-Q753 HydrophobicContact CG1-CG 4.04Å; V675-K754 HydrophobicContact CB-CG 3.96Å; V675-K754 HydrophobicContact CG1-CD 4.32Å; V675-K754 HydrophobicContact CG1-CG 3.46Å; V675-K754 VanDerWaalsContact CG1-CG 3.46Å; V675-K754 WeakPolarHBondContact O-CE 3.3Å; V675-L757 HydrophobicContact CG2-CD1 3.67Å
676	G	82.8	Confident	80.2	Confident	1 Å²	1	18.4 Å²	18.4	1%	0.01	14%	0.137	C	C	.	.	S	Bend	trans	-179.7	-171	-179.2	0	0	0	0	0	109.6	V642 F643	V642-G676 CarbonylContact O-C 3.59Å; V642-G676 VanDerWaalsContact O-CA 3.29Å; V642-G676 WeakPolarHBondContact O-CA 3.48Å; F643-G676 WeakPolarHBondContact O-CA 3.39Å
677	A	89.2	Confident	80.2	Confident	0 Å²	0	25.6 Å²	25.6	0%	0	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	149.1	173.9	0	0	0	0	0	111.2	R641 V642 F666 R667 M746 I750	R641-A677 WeakPolarHBondContact CD-O 3.48Å; V642-A677 HydrophobicContact CG2-CB 3.91Å; V642-A677 PolarHBondContact N-O 3.22Å; V642-A677 PolarHBondContact O-N 3.06Å; V642-A677 VanDerWaalsContact O-O 3.12Å; F666-A677 HydrophobicContact CB-CB 4.32Å; F666-A677 HydrophobicContact CD2-CB 4.35Å; R667-A677 CarbonylContact O-C 3.57Å; R667-A677 WeakPolarHBondContact O-CA 3.45Å; A677-M746 HydrophobicContact CB-CG 3.82Å; A677-M746 HydrophobicContact CB-SD 3.82Å; A677-I750 HydrophobicContact CB-CD1 3.83Å; A677-I750 HydrophobicContact CB-CG1 4.28Å
678	L	89.9	Confident	80.5	Confident	1 Å²	1	26.6 Å²	26.6	1%	0.005	18%	0.182	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	113.7	161.8	-175.8	72.8	0	0	0	107.3	I557 W582 L639 R641 F666 R667 P669	I557-L678 HydrophobicContact CD1-CD2 4.03Å; I557-L678 HydrophobicContact CG2-CD2 3.93Å; W582-L678 HydrophobicContact CH2-CD2 3.71Å; W582-L678 HydrophobicContact CZ2-CD2 3.6Å; L639-L678 HydrophobicContact CB-CD1 4.28Å; R641-L678 HydrophobicContact CB-CD1 4.4Å; F666-L678 WeakPolarHBondContact CA-O 3.35Å; R667-L678 PolarHBondContact N-O 2.97Å; R667-L678 PolarHBondContact O-N 3.2Å; P669-L678 HydrophobicContact CG-CB 4.38Å
679	L	93.3	Very high	81.1	Confident	0 Å²	0	25.4 Å²	25.4	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.4	132	172.8	-60.2	-179.5	0	0	0	109.3	L639 L640 V642 V654 L657 I664 S665 F666 F742 M746	L639-L679 WeakPolarHBondContact CA-O 3.3Å; L640-L679 PolarHBondContact N-O 2.89Å; L640-L679 WeakPolarHBondContact O-CB 3.28Å; L640-L679 PolarHBondContact O-N 2.96Å; V642-L679 HydrophobicContact CG1-CD1 3.7Å; V642-L679 HydrophobicContact CG1-CG 4.13Å; V642-L679 HydrophobicContact CG2-CD1 4.16Å; V642-L679 HydrophobicContact CG2-CD2 4.24Å; V642-L679 HydrophobicContact CG2-CG 3.89Å; V654-L679 HydrophobicContact CG2-CD1 4.01Å; L657-L679 HydrophobicContact CD1-CD1 4.1Å; I664-L679 HydrophobicContact CG2-CD2 4.5Å; S665-L679 WeakPolarHBondContact O-CA 3.13Å; F666-L679 HydrophobicContact CB-CD2 3.92Å; L679-F742 HydrophobicContact CD2-CE1 4.36Å; L679-F742 HydrophobicContact CD2-CZ 4.28Å; L679-M746 HydrophobicContact CD2-SD 3.71Å
680	T	92.7	Very high	82.1	Confident	0 Å²	0	29.5 Å²	29.5	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	100.8	173.4	-57.4	0	0	0	0	108.1	E560 A561 L639 I664 S665 I682	E560-T680 HydrophobicContact CG-CG2 4.42Å; A561-T680 HydrophobicContact CB-CG2 4.32Å; L639-T680 HydrophobicContact CD2-CG2 3.78Å; I664-T680 WeakPolarHBondContact CA-O 3.49Å; S665-T680 PolarHBondContact N-O 3.48Å; S665-T680 PolarHBondContact O-N 2.75Å; T680-I682 HydrophobicContact CG2-CD1 4.01Å; T680-I682 HydrophobicContact CG2-CG1 3.96Å
681	C	94.3	Very high	83.6	Confident	0 Å²	0	31.5 Å²	31.5	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.1	121.3	178.9	-47.9	0	0	0	0	109.4	A637 L638 F661 S663 I664	A637-C681 CarbonylContact C-O 3.55Å; A637-C681 VanDerWaalsContact CA-O 3.29Å; A637-C681 WeakPolarHBondContact CA-O 3.46Å; L638-C681 HydrophobicContact CB-CB 4.12Å; L638-C681 PolarHBondContact N-O 2.71Å; L638-C681 PolarHBondContact O-N 3.01Å; F661-C681 HydrophobicContact CB-CB 4.17Å; F661-C681 HydrophobicContact CD1-CB 3.5Å; F661-C681 VanDerWaalsContact CD1-CB 3.5Å; F661-C681 HydrophobicContact CD2-CB 3.89Å; F661-C681 HydrophobicContact CE1-CB 3.72Å; F661-C681 HydrophobicContact CE2-CB 4.1Å; F661-C681 HydrophobicContact CG-CB 3.59Å; F661-C681 HydrophobicContact CZ-CB 4.01Å; S663-C681 WeakPolarHBondContact O-CA 3.35Å; I664-C681 HydrophobicContact CG1-CB 4.21Å
682	I	92.9	Very high	85.5	Confident	21 Å²	21	30.3 Å²	30.3	11%	0.108	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	135.6	-171.6	-59.3	170.4	0	0	0	110.1	E560 R662 S663 T680	E560-I682 HydrophobicContact CG-CD1 4.38Å; E560-I682 VanDerWaalsContact O-CD1 3.23Å; E560-I682 WeakPolarHBondContact O-CD1 3.26Å; R662-I682 WeakPolarHBondContact CB-O 3.29Å; R662-I682 PolarHBondContact N-O 3.44Å; S663-I682 PolarHBondContact N-O 2.7Å; S663-I682 PolarHBondContact O-N 3.32Å; T680-I682 HydrophobicContact CG2-CD1 4.01Å; T680-I682 HydrophobicContact CG2-CG1 3.96Å
683	G	92.1	Very high	87.7	Confident	5 Å²	5	27.9 Å²	27.9	5%	0.052	18%	0.183	C	C	.	.	E	Extended strand (participates in β ladder)	trans	74.5	69.5	172	0	0	0	0	0	112.2	D636 R662	D636-G683 PolarHBondContact O-N 3.28Å; D636-G683 VanDerWaalsContact O-N 3.16Å; R662-G683 WeakPolarHBondContact CG-O 3.38Å; R662-G683 PolarHBondContact N-O 3.02Å
684	F	94.6	Very high	89.7	Confident	6 Å²	6	27.6 Å²	27.6	3%	0.026	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-57.4	136.4	176	-179.8	-124.4	0	0	0	112.1	L629 L632 A634 G635 D636 C660 F661 P686 A689	L629-F684 HydrophobicContact CB-CZ 4.48Å; L629-F684 HydrophobicContact CD2-CD2 4.18Å; L629-F684 HydrophobicContact CD2-CE2 3.47Å; L629-F684 VanDerWaalsContact CD2-CE2 3.47Å; L629-F684 HydrophobicContact CD2-CZ 4.23Å; L629-F684 WeakPolarHBondContact O-CZ 3.5Å; L632-F684 HydrophobicContact CB-CB 4.31Å; L632-F684 HydrophobicContact CB-CD1 3.44Å; L632-F684 VanDerWaalsContact CB-CD1 3.44Å; L632-F684 HydrophobicContact CB-CE1 3.85Å; L632-F684 HydrophobicContact CB-CG 3.89Å; L632-F684 HydrophobicContact CD1-CG 4.41Å; L632-F684 VanDerWaalsContact O-CE1 3.26Å; L632-F684 WeakPolarHBondContact O-CE1 3.38Å; A634-F684 WeakPolarHBondContact CA-O 3.29Å; G635-F684 PolarHBondContact N-O 2.92Å; D636-F684 PolarHBondContact O-N 3.03Å; C660-F684 HydrophobicContact CB-CD2 4.38Å; C660-F684 HydrophobicContact CB-CE2 4.14Å; C660-F684 WeakPolarHBondContact O-CD2 3.32Å; F661-F684 HydrophobicContact CD1-CB 4.1Å; F661-F684 HydrophobicContact CD2-CD2 4.42Å; F661-F684 HydrophobicContact CE1-CB 3.72Å; F661-F684 HydrophobicContact CE1-CD2 4.19Å; F661-F684 HydrophobicContact CE1-CG 4.37Å; F661-F684 AromaticContact CE2-CD2 3.97Å; F661-F684 HydrophobicContact CE2-CD2 3.97Å; F661-F684 HydrophobicContact CZ-CB 4.19Å; F661-F684 AromaticContact CZ-CD2 3.85Å; F661-F684 HydrophobicContact CZ-CD2 3.85Å; F661-F684 HydrophobicContact CZ-CG 4.36Å; F684-P686 HydrophobicContact CD1-CG 3.9Å; F684-P686 HydrophobicContact CE1-CB 4.02Å; F684-P686 HydrophobicContact CE1-CG 3.71Å; F684-P686 HydrophobicContact CZ-CB 4.42Å; F684-P686 HydrophobicContact CZ-CG 4.49Å; F684-A689 HydrophobicContact CE2-CB 3.75Å; F684-A689 HydrophobicContact CZ-CB 3.76Å
685	C	94.1	Very high	91.2	Very high	20 Å²	20	28.1 Å²	28.1	14%	0.135	17%	0.167	C	C	.	.			trans	-117.2	92.9	179.5	-64.6	0	0	0	0	109.4	P495 C660 E687 A688 A689	P495-C685 HydrophobicContact CG-CB 4.45Å; C660-C685 WeakPolarHBondContact O-CB 3.19Å; C660-C685 PolarHBondContact O-N 2.95Å; C685-E687 VanDerWaalsContact C-N 3.28Å; C685-E687 PolarHBondContact O-N 2.93Å; C685-A688 HydrophobicContact CB-CB 4.12Å; C685-A688 PolarHBondContact O-N 3.15Å; C685-A688 VanDerWaalsContact O-N 3.11Å; C685-A689 PolarHBondContact O-N 3.27Å
686	P	93.2	Very high	92.3	Very high	38 Å²	38	28.1 Å²	28.1	25%	0.247	17%	0.166	C	C	.	.	H	α-helix	trans	-56.8	-38.6	-174.2	-25.5	33.6	0	0	0	113.8	A634 F684 A688 A689 V690	A634-P686 HydrophobicContact CB-CG 3.9Å; F684-P686 HydrophobicContact CD1-CG 3.9Å; F684-P686 HydrophobicContact CE1-CB 4.02Å; F684-P686 HydrophobicContact CE1-CG 3.71Å; F684-P686 HydrophobicContact CZ-CB 4.42Å; F684-P686 HydrophobicContact CZ-CG 4.49Å; P686-A688 PolarHBondContact O-N 2.69Å; P686-A689 WeakPolarHBondContact O-CB 3.32Å; P686-A689 PolarHBondContact O-N 3.25Å; P686-V690 PolarHBondContact O-N 2.88Å
687	E	92.1	Very high	92.9	Very high	150 Å²	150	30.7 Å²	30.7	70%	0.701	19%	0.185	S	C	*	.	H	α-helix	trans	-63.2	-32.8	-178.6	-59.5	78	-171.8	0	0	112.2	C685	C685-E687 VanDerWaalsContact C-N 3.28Å; C685-E687 PolarHBondContact O-N 2.93Å
688	A	91.1	Very high	93.2	Very high	34 Å²	34	35.8 Å²	35.8	28%	0.281	21%	0.212	S	C	.	.	H	α-helix	trans	-76.7	-24	177	0	0	0	0	0	112.6	P495 A659 C685 P686	P495-A688 HydrophobicContact CB-CB 4.43Å; A659-A688 WeakPolarHBondContact O-CB 3.37Å; C685-A688 HydrophobicContact CB-CB 4.12Å; C685-A688 PolarHBondContact O-N 3.15Å; C685-A688 VanDerWaalsContact O-N 3.11Å; P686-A688 PolarHBondContact O-N 2.69Å
689	A	92.7	Very high	93.5	Very high	1 Å²	1	35.8 Å²	35.8	1%	0.008	21%	0.212	C	C	.	.	H	α-helix	trans	-82.1	-30.1	-179.8	0	0	0	0	0	113.5	L629 C660 F684 C685 P686 M692 L693	L629-A689 HydrophobicContact CB-CB 4.48Å; L629-A689 HydrophobicContact CD2-CB 4.31Å; C660-A689 HydrophobicContact CB-CB 4.38Å; C660-A689 VanDerWaalsContact SG-CA 3.57Å; F684-A689 HydrophobicContact CE2-CB 3.75Å; F684-A689 HydrophobicContact CZ-CB 3.76Å; C685-A689 PolarHBondContact O-N 3.27Å; P686-A689 WeakPolarHBondContact O-CB 3.32Å; P686-A689 PolarHBondContact O-N 3.25Å; A689-M692 WeakPolarHBondContact O-CB 3.48Å; A689-M692 PolarHBondContact O-N 2.63Å; A689-L693 PolarHBondContact O-N 3.3Å
690	V	92.9	Very high	93.5	Very high	98 Å²	98	37.2 Å²	37.2	59%	0.594	22%	0.219	S	C	*	.	T	Hydrogen-bonded Turn	trans	-49.5	-47.8	-176.6	170	0	0	0	0	113.3	P686 M692 P694	P686-V690 PolarHBondContact O-N 2.88Å; V690-M692 VanDerWaalsContact C-N 3.26Å; V690-M692 PolarHBondContact O-N 3.14Å; V690-P694 WeakPolarHBondContact O-CD 3.25Å
691	P	92	Very high	93.6	Very high	69 Å²	69	39.5 Å²	39.5	45%	0.448	23%	0.234	S	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-23.2	179.1	-18.5	32.8	0	0	0	113.8	V501	V501-P691 HydrophobicContact CB-CB 4.44Å; V501-P691 WeakPolarHBondContact CG1-O 3.4Å; V501-P691 HydrophobicContact CG2-CB 4.12Å
692	M	91.3	Very high	93.6	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.01	24%	0.243	C	C	.	.	H	α-helix	trans	-84.7	-29.3	-176.2	-62.6	-164.4	161.1	0	0	113.3	C499 V501 W504 F655 C656 A659 C660 A689 V690 V695 L696	C499-M692 HydrophobicContact CB-CE 4.21Å; C499-M692 WeakPolarHBondContact SG-CE 3.32Å; V501-M692 HydrophobicContact CG2-CE 4.41Å; V501-M692 HydrophobicContact CG2-CG 4.19Å; W504-M692 HydrophobicContact CH2-CE 3.61Å; W504-M692 HydrophobicContact CH2-SD 4.44Å; W504-M692 HydrophobicContact CZ2-CE 4.29Å; W504-M692 HydrophobicContact CZ3-CE 4.44Å; F655-M692 HydrophobicContact CE1-CE 4.45Å; C656-M692 HydrophobicContact CB-SD 3.8Å; A659-M692 HydrophobicContact CB-CE 3.17Å; A659-M692 HydrophobicContact CB-SD 3.95Å; C660-M692 VanDerWaalsContact SG-SD 3.65Å; A689-M692 WeakPolarHBondContact O-CB 3.48Å; A689-M692 PolarHBondContact O-N 2.63Å; V690-M692 VanDerWaalsContact C-N 3.26Å; V690-M692 PolarHBondContact O-N 3.14Å; M692-V695 PolarHBondContact O-N 3.1Å; M692-L696 HydrophobicContact CB-CD1 4.24Å; M692-L696 WeakPolarHBondContact O-CB 3.29Å; M692-L696 WeakPolarHBondContact O-CG 3.33Å; M692-L696 PolarHBondContact O-N 3.33Å
693	L	94.3	Very high	93.6	Very high	41 Å²	41	40 Å²	40	22%	0.215	24%	0.239	C	C	.	.	H	α-helix	trans	-55.6	-46.2	-176.1	-71.4	172.5	0	0	0	113.3	L626 L629 Q630 A689 S697	L626-L693 HydrophobicContact CD2-CD2 4.14Å; L629-L693 HydrophobicContact CB-CD2 3.78Å; L629-L693 HydrophobicContact CD1-CD2 4.43Å; Q630-L693 HydrophobicContact CG-CD2 3.91Å; A689-L693 PolarHBondContact O-N 3.3Å; L693-S697 WeakPolarHBondContact O-CB 3.26Å; L693-S697 PolarHBondContact O-N 3.25Å
694	P	94.2	Very high	93.6	Very high	73 Å²	73	44.6 Å²	44.6	47%	0.474	26%	0.259	S	S	.	.	H	α-helix	trans	-61.2	-46.1	177	-23	34.6	0	0	0	112.2	V690 L696 S697 D698	V690-P694 WeakPolarHBondContact O-CD 3.25Å; P694-L696 PolarHBondContact O-N 3.35Å; P694-S697 WeakPolarHBondContact O-CB 3.47Å; P694-S697 PolarHBondContact O-N 2.94Å; P694-D698 VanDerWaalsContact O-CG 3.27Å; P694-D698 PolarHBondContact O-N 3.28Å
695	V	93.9	Very high	93.4	Very high	30 Å²	30	50.7 Å²	50.7	18%	0.182	29%	0.288	C	S	.	.	H	α-helix	trans	-65.8	-43.7	-178.1	-179	0	0	0	0	111.7	V501 W504 M692 S697 D698 V699	V501-V695 HydrophobicContact CG1-CB 4.21Å; V501-V695 HydrophobicContact CG1-CG2 3.37Å; W504-V695 HydrophobicContact CE3-CB 4.47Å; W504-V695 HydrophobicContact CE3-CG1 3.93Å; M692-V695 PolarHBondContact O-N 3.1Å; V695-S697 VanDerWaalsContact C-N 3.28Å; V695-S697 PolarHBondContact O-N 3.44Å; V695-D698 PolarHBondContact O-N 3.26Å; V695-V699 HydrophobicContact CG1-CG2 4.24Å; V695-V699 WeakPolarHBondContact O-CG2 3.47Å; V695-V699 PolarHBondContact O-N 3.29Å
696	L	95.3	Very high	93.2	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-61.4	-38.9	175.8	-72	170.8	0	0	0	111.5	L622 I625 L626 L629 C656 M692 P694 Q700 F728	L622-L696 HydrophobicContact CD2-CD2 3.83Å; I625-L696 HydrophobicContact CG2-CD1 4.08Å; L626-L696 HydrophobicContact CD1-CB 4.42Å; L626-L696 HydrophobicContact CD2-CB 3.5Å; L626-L696 HydrophobicContact CD2-CD1 4.43Å; L626-L696 HydrophobicContact CG-CB 3.91Å; L629-L696 HydrophobicContact CD1-CD1 3.62Å; C656-L696 HydrophobicContact CB-CD1 4.41Å; C656-L696 HydrophobicContact CB-CD2 4.39Å; M692-L696 HydrophobicContact CB-CD1 4.24Å; M692-L696 WeakPolarHBondContact O-CB 3.29Å; M692-L696 WeakPolarHBondContact O-CG 3.33Å; M692-L696 PolarHBondContact O-N 3.33Å; P694-L696 PolarHBondContact O-N 3.35Å; L696-Q700 VanDerWaalsContact O-CB 3.29Å; L696-Q700 WeakPolarHBondContact O-CB 3.5Å; L696-Q700 PolarHBondContact O-N 3.42Å; L696-F728 HydrophobicContact CD2-CE2 4.1Å; L696-F728 HydrophobicContact CD2-CZ 4.32Å
697	S	95.4	Very high	93	Very high	56 Å²	56	53.1 Å²	53.1	39%	0.392	30%	0.296	S	S	.	.	H	α-helix	trans	-65.3	-43.7	175.8	-171.8	0	0	0	0	111.8	L693 P694 V695 Q700 S701	L693-S697 WeakPolarHBondContact O-CB 3.26Å; L693-S697 PolarHBondContact O-N 3.25Å; P694-S697 WeakPolarHBondContact O-CB 3.47Å; P694-S697 PolarHBondContact O-N 2.94Å; V695-S697 VanDerWaalsContact C-N 3.28Å; V695-S697 PolarHBondContact O-N 3.44Å; S697-Q700 PolarHBondContact O-N 3.39Å; S697-S701 WeakPolarHBondContact O-CB 3.42Å; S697-S701 PolarHBondContact O-N 3.23Å
698	D	94.5	Very high	92.1	Very high	107 Å²	107	49 Å²	49	57%	0.572	29%	0.294	S	S	*	.	H	α-helix	trans	-65	-42.3	178.9	-70.6	-18.1	0	0	0	111.5	P694 V695 S701 C702	P694-D698 VanDerWaalsContact O-CG 3.27Å; P694-D698 PolarHBondContact O-N 3.28Å; V695-D698 PolarHBondContact O-N 3.26Å; D698-S701 PolarHBondContact O-N 3.46Å; D698-C702 WeakPolarHBondContact O-CB 3.48Å; D698-C702 PolarHBondContact O-N 2.98Å
699	V	95.8	Very high	90.4	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-66	-44.1	177	176.5	0	0	0	0	111	V506 L622 V695 S701 C702 I703 V725 F728	V506-V699 HydrophobicContact CG2-CG2 3.83Å; L622-V699 HydrophobicContact CD1-CG1 3.72Å; V695-V699 HydrophobicContact CG1-CG2 4.24Å; V695-V699 WeakPolarHBondContact O-CG2 3.47Å; V695-V699 PolarHBondContact O-N 3.29Å; V699-S701 VanDerWaalsContact C-N 3.31Å; V699-S701 PolarHBondContact O-N 2.85Å; V699-C702 WeakPolarHBondContact O-CB 3.25Å; V699-C702 PolarHBondContact O-N 3.42Å; V699-I703 HydrophobicContact CG1-CD1 4.07Å; V699-I703 WeakPolarHBondContact O-CG1 3.16Å; V699-I703 PolarHBondContact O-N 3.3Å; V699-V725 HydrophobicContact CG1-CG1 4.47Å; V699-F728 HydrophobicContact CB-CG 4.44Å; V699-F728 HydrophobicContact CG1-CB 4.21Å; V699-F728 HydrophobicContact CG1-CD1 3.88Å; V699-F728 HydrophobicContact CG1-CE1 4.39Å; V699-F728 HydrophobicContact CG1-CG 4.02Å; V699-F728 HydrophobicContact CG2-CB 3.44Å; V699-F728 VanDerWaalsContact CG2-CB 3.44Å; V699-F728 HydrophobicContact CG2-CD1 4.37Å; V699-F728 HydrophobicContact CG2-CD2 3.89Å; V699-F728 HydrophobicContact CG2-CG 3.67Å
700	Q	94.8	Very high	88.2	Confident	31 Å²	31	53.3 Å²	53.3	15%	0.145	34%	0.342	C	S	.	.	H	α-helix	trans	-59.2	-44.6	176.4	-176.7	-80	-13.1	0	0	110.9	L626 L696 S697 I703 Q704	L626-Q700 HydrophobicContact CD1-CB 3.97Å; L626-Q700 HydrophobicContact CD1-CG 4.23Å; L696-Q700 VanDerWaalsContact O-CB 3.29Å; L696-Q700 WeakPolarHBondContact O-CB 3.5Å; L696-Q700 PolarHBondContact O-N 3.42Å; S697-Q700 PolarHBondContact O-N 3.39Å; Q700-I703 PolarHBondContact O-N 3.11Å; Q700-Q704 WeakPolarHBondContact O-CB 3.49Å; Q700-Q704 PolarHBondContact O-N 3.23Å
701	S	93.6	Very high	85.5	Confident	47 Å²	47	52.3 Å²	52.3	33%	0.329	35%	0.352	S	S	.	.	H	α-helix	trans	-63.5	-42.4	176.9	-177.8	0	0	0	0	111.3	S697 D698 V699 Q704 Q705	S697-S701 WeakPolarHBondContact O-CB 3.42Å; S697-S701 PolarHBondContact O-N 3.23Å; D698-S701 PolarHBondContact O-N 3.46Å; V699-S701 VanDerWaalsContact C-N 3.31Å; V699-S701 PolarHBondContact O-N 2.85Å; S701-Q704 PolarHBondContact O-N 3.41Å; S701-Q705 VanDerWaalsContact O-CG 3.3Å; S701-Q705 WeakPolarHBondContact O-CG 3.47Å; S701-Q705 PolarHBondContact O-N 2.94Å
702	C	94.4	Very high	83.1	Confident	28 Å²	28	56.8 Å²	56.8	19%	0.189	37%	0.372	C	S	.	.	H	α-helix	trans	-60.6	-46.7	176.4	-174.1	0	0	0	0	112	D698 V699 Q704 Q705 L706 V725	D698-C702 WeakPolarHBondContact O-CB 3.48Å; D698-C702 PolarHBondContact O-N 2.98Å; V699-C702 WeakPolarHBondContact O-CB 3.25Å; V699-C702 PolarHBondContact O-N 3.42Å; C702-Q704 VanDerWaalsContact C-N 3.34Å; C702-Q704 PolarHBondContact O-N 3.07Å; C702-Q705 PolarHBondContact O-N 2.91Å; C702-L706 VanDerWaalsContact O-CG 3.32Å; C702-L706 WeakPolarHBondContact O-CG 3.43Å; C702-L706 PolarHBondContact O-N 2.99Å; C702-L706 VanDerWaalsContact O-N 3.07Å; C702-V725 HydrophobicContact CB-CG2 4.39Å
703	I	94.2	Very high	80.6	Confident	4 Å²	4	65.6 Å²	65.6	2%	0.021	42%	0.415	C	S	.	.	H	α-helix	trans	-61.7	-44.3	176.4	-66.1	170.5	0	0	0	110.3	Q618 Q619 L622 V699 Q700 Q705 L706 I707 V725	Q618-I703 HydrophobicContact CB-CD1 4.36Å; Q619-I703 HydrophobicContact CB-CG2 3.75Å; Q619-I703 HydrophobicContact CG-CG2 4.22Å; L622-I703 HydrophobicContact CD1-CD1 3.65Å; V699-I703 HydrophobicContact CG1-CD1 4.07Å; V699-I703 WeakPolarHBondContact O-CG1 3.16Å; V699-I703 PolarHBondContact O-N 3.3Å; Q700-I703 PolarHBondContact O-N 3.11Å; I703-Q705 VanDerWaalsContact C-N 3.34Å; I703-Q705 PolarHBondContact O-N 3.04Å; I703-L706 PolarHBondContact O-N 2.79Å; I703-I707 HydrophobicContact CG2-CD1 3.68Å; I703-I707 HydrophobicContact CG2-CG1 4.29Å; I703-I707 VanDerWaalsContact O-CG1 3.32Å; I703-I707 WeakPolarHBondContact O-CG1 3.38Å; I703-I707 PolarHBondContact O-N 2.81Å; I703-V725 HydrophobicContact CD1-CB 4.39Å; I703-V725 HydrophobicContact CD1-CG2 4.45Å; I703-V725 HydrophobicContact CG1-CB 3.9Å; I703-V725 HydrophobicContact CG1-CG2 3.53Å
704	Q	91.6	Very high	78	Confident	101 Å²	101	67 Å²	67	47%	0.472	44%	0.44	S	S	.	.	H	α-helix	trans	-59.9	-42.7	178.5	-174.9	171.5	-6.1	0	0	112.5	Q700 S701 C702 I707 G708	Q700-Q704 WeakPolarHBondContact O-CB 3.49Å; Q700-Q704 PolarHBondContact O-N 3.23Å; S701-Q704 PolarHBondContact O-N 3.41Å; C702-Q704 VanDerWaalsContact C-N 3.34Å; C702-Q704 PolarHBondContact O-N 3.07Å; Q704-I707 PolarHBondContact O-N 2.74Å; Q704-G708 PolarHBondContact O-N 2.79Å
705	Q	90.9	Very high	75.4	Confident	135 Å²	135	71.8 Å²	71.8	63%	0.631	46%	0.462	S	S	*	.	H	α-helix	trans	-63.4	-40.2	176.5	-72.7	173.8	3.4	0	0	112.2	S701 C702 I703 G709	S701-Q705 VanDerWaalsContact O-CG 3.3Å; S701-Q705 WeakPolarHBondContact O-CG 3.47Å; S701-Q705 PolarHBondContact O-N 2.94Å; C702-Q705 PolarHBondContact O-N 2.91Å; I703-Q705 VanDerWaalsContact C-N 3.34Å; I703-Q705 PolarHBondContact O-N 3.04Å; Q705-G709 PolarHBondContact O-N 3.1Å
706	L	89.9	Confident	72.8	Confident	41 Å²	41	77.3 Å²	77.3	22%	0.215	49%	0.49	C	S	.	.	H	α-helix	trans	-69.4	-35.4	178.8	-69	170.8	0	0	0	112.5	T508 C702 I703 R723 V725	T508-L706 HydrophobicContact CG2-CD1 3.91Å; C702-L706 VanDerWaalsContact O-CG 3.32Å; C702-L706 WeakPolarHBondContact O-CG 3.43Å; C702-L706 PolarHBondContact O-N 2.99Å; C702-L706 VanDerWaalsContact O-N 3.07Å; I703-L706 PolarHBondContact O-N 2.79Å; L706-R723 HydrophobicContact CD2-CB 4.16Å; L706-V725 HydrophobicContact CD1-CG2 3.97Å
707	I	87.4	Confident	70.3	Confident	67 Å²	67	89 Å²	89	34%	0.344	53%	0.534	S	S	.	.	H	α-helix	trans	-68.7	-43.4	174.8	-66.4	168.5	0	0	0	111.1	P615 Q619 I703 Q704 G709	P615-I707 HydrophobicContact CB-CD1 4.06Å; P615-I707 HydrophobicContact CB-CG1 3.96Å; Q619-I707 HydrophobicContact CB-CD1 4.26Å; I703-I707 HydrophobicContact CG2-CD1 3.68Å; I703-I707 HydrophobicContact CG2-CG1 4.29Å; I703-I707 VanDerWaalsContact O-CG1 3.32Å; I703-I707 WeakPolarHBondContact O-CG1 3.38Å; I703-I707 PolarHBondContact O-N 2.81Å; Q704-I707 PolarHBondContact O-N 2.74Å; I707-G709 PolarHBondContact O-N 2.78Å
708	G	73.1	Confident	67.9	Low	64 Å²	64	91.1 Å²	91.1	66%	0.66	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	6.7	-170.6	0	0	0	0	0	117.1	Q704 G710	Q704-G708 PolarHBondContact O-N 2.79Å; G708-G710 PolarHBondContact O-N 2.93Å
709	G	55.9	Low	65.8	Low	41 Å²	41	92.8 Å²	92.8	42%	0.423	55%	0.549	S	S	.	.			trans	-33.7	114.9	-158.8	0	0	0	0	0	119	Q705 I707	Q705-G709 PolarHBondContact O-N 3.1Å; I707-G709 PolarHBondContact O-N 2.78Å
710	G	46.1	Very low	63.9	Low	85 Å²	85	95.7 Å²	95.7	88%	0.876	57%	0.573	S	S	*	*			trans	169.6	80.4	167.8	0	0	0	0	0	113.2	G708	G708-G710 PolarHBondContact O-N 2.93Å
711	G	36	Very low	62.4	Low	77 Å²	77	96.5 Å²	96.5	79%	0.794	59%	0.589	S	S	*	*			trans	-164.9	79.3	177.9	0	0	0	0	0	113.3
712	D	43.2	Very low	61.8	Low	163 Å²	163	98.1 Å²	98.1	87%	0.872	59%	0.594	S	S	*	*			trans	46.4	97.9	149.3	-139.6	11.8	0	0	0	119.3
713	M	38.8	Very low	61.5	Low	187 Å²	187	102 Å²	102	92%	0.921	61%	0.605	S	S	*	*			trans	175.4	111.5	138	-94.9	-81.4	-157.4	0	0	111.1
714	G	40	Very low	61.5	Low	71 Å²	71	102.1 Å²	102.1	73%	0.732	61%	0.606	S	S	*	*	S	Bend	trans	74	93.6	146.7	0	0	0	0	0	120.4	N716	G714-N716 PolarHBondContact O-N 2.81Å
715	D	37.8	Very low	61.6	Low	173 Å²	173	97.4 Å²	97.4	93%	0.925	58%	0.584	S	S	*	*	S	Bend	trans	53.4	21.6	139	-90.5	-0.8	0	0	0	122.9
716	N	40.9	Very low	61.7	Low	146 Å²	146	91.1 Å²	91.1	78%	0.781	55%	0.554	S	S	*	*			trans	-135.2	111.6	157.6	-91.9	-34.6	0	0	0	111	G714 T718	G714-N716 PolarHBondContact O-N 2.81Å; N716-T718 VanDerWaalsContact C-N 3.34Å; N716-T718 PolarHBondContact O-N 2.85Å
717	R	41.2	Very low	61.9	Low	246 Å²	246	89.4 Å²	89.4	93%	0.928	55%	0.545	S	S	*	.			trans	-66.2	86.9	176.5	-67.2	179.4	178.6	-176.5	-0.7	110.4
718	T	45.3	Very low	62.3	Low	99 Å²	99	86.3 Å²	86.3	61%	0.607	53%	0.529	S	S	*	.	P	Polyproline II helix	trans	-94.5	124.8	160	44.9	0	0	0	0	108.4	N716	N716-T718 VanDerWaalsContact C-N 3.34Å; N716-T718 PolarHBondContact O-N 2.85Å
719	H	51.8	Low	63.3	Low	142 Å²	142	83.2 Å²	83.2	66%	0.657	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-72.8	149	178.8	-67.9	-80.1	0	0	0	109.9	G721 D722	H719-G721 PolarHBondContact O-N 2.85Å; H719-D722 WeakPolarHBondContact CB-OD2 3.48Å; H719-D722 PolarHBondContact N-OD2 3.06Å; H719-D722 VanDerWaalsContact N-OD2 3.08Å; H719-D722 PolarHBondContact O-N 2.85Å
720	A	55.5	Low	65	Low	62 Å²	62	81.6 Å²	81.6	51%	0.512	48%	0.48	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	130.2	169.6	0	0	0	0	0	109.2
721	G	63	Low	67.1	Low	47 Å²	47	77.8 Å²	77.8	49%	0.485	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	97.2	-6.5	-177.5	0	0	0	0	0	116.6	A511 H719 R723	A511-G721 WeakPolarHBondContact CB-O 3.4Å; H719-G721 PolarHBondContact O-N 2.85Å; G721-R723 VanDerWaalsContact C-N 3.32Å; G721-R723 PolarHBondContact O-N 2.8Å
722	D	81.1	Confident	69.5	Low	82 Å²	82	76.8 Å²	76.8	44%	0.439	41%	0.414	S	S	.	.	S	Bend	trans	-80.1	-12.6	179.3	-70.5	-21.6	0	0	0	113.8	A510 A511 H719	A510-D722 CarbonylContact C-O 3.48Å; A510-D722 WeakPolarHBondContact CA-O 3.23Å; A511-D722 PolarHBondContact N-O 2.99Å; H719-D722 WeakPolarHBondContact CB-OD2 3.48Å; H719-D722 PolarHBondContact N-OD2 3.06Å; H719-D722 VanDerWaalsContact N-OD2 3.08Å; H719-D722 PolarHBondContact O-N 2.85Å
723	R	88.5	Confident	71.6	Confident	110 Å²	110	69.9 Å²	69.9	42%	0.415	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.6	150.8	-174.9	-63.9	-174	71.3	-167.9	1.6	111.7	T508 G509 L706 G721	T508-R723 PolarHBondContact O-NH2 3Å; T508-R723 VanDerWaalsContact O-NH2 3.09Å; T508-R723 PolarHBondContact OG1-NH2 2.87Å; G509-R723 CarbonylContact O-C 3.36Å; G509-R723 WeakPolarHBondContact O-CA 3.37Å; G509-R723 VanDerWaalsContact O-CB 3.29Å; G509-R723 WeakPolarHBondContact O-CB 3.35Å; L706-R723 HydrophobicContact CD2-CB 4.16Å; G721-R723 VanDerWaalsContact C-N 3.32Å; G721-R723 PolarHBondContact O-N 2.8Å
724	Q	92.7	Very high	74	Confident	6 Å²	6	61 Å²	61	3%	0.028	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.3	164.2	174.6	70.6	-172.4	38.5	0	0	112.3	T508 G509 L512 P615 L726	T508-Q724 WeakPolarHBondContact CA-O 3.4Å; G509-Q724 PolarHBondContact N-O 2.93Å; G509-Q724 PolarHBondContact O-N 3.03Å; L512-Q724 VanDerWaalsContact CD1-NE2 3.25Å; P615-Q724 HydrophobicContact CG-CB 3.96Å; Q724-L726 HydrophobicContact CG-CD2 3.85Å
725	V	94.6	Very high	76.2	Confident	2 Å²	2	58.9 Å²	58.9	1%	0.012	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	128.9	169	176.7	0	0	0	0	108.6	V506 T508 V649 V699 C702 I703 L706	V506-V725 HydrophobicContact CG1-CG1 3.89Å; V506-V725 HydrophobicContact CG1-CG2 3.93Å; T508-V725 HydrophobicContact CG2-CG2 4.16Å; V649-V725 HydrophobicContact CG2-CG1 4.1Å; V649-V725 WeakPolarHBondContact CG2-O 3.49Å; V699-V725 HydrophobicContact CG1-CG1 4.47Å; C702-V725 HydrophobicContact CB-CG2 4.39Å; I703-V725 HydrophobicContact CD1-CB 4.39Å; I703-V725 HydrophobicContact CD1-CG2 4.45Å; I703-V725 HydrophobicContact CG1-CB 3.9Å; I703-V725 HydrophobicContact CG1-CG2 3.53Å; L706-V725 HydrophobicContact CD1-CG2 3.97Å
726	L	93.8	Very high	78.2	Confident	2 Å²	2	55.2 Å²	55.2	1%	0.01	28%	0.28	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	-25.2	178.4	-61.4	-179.2	0	0	0	112.2	V507 L512 R648 Q724	V507-L726 PolarHBondContact O-N 3.34Å; L512-L726 HydrophobicContact CD1-CD2 4.41Å; L512-L726 HydrophobicContact CD2-CD2 4.22Å; L512-L726 HydrophobicContact CG-CD2 4.05Å; R648-L726 WeakPolarHBondContact CB-O 3.32Å; R648-L726 PolarHBondContact NE-O 2.95Å; Q724-L726 HydrophobicContact CG-CD2 3.85Å
727	Q	94.1	Very high	80	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.028	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.2	144.7	-176.8	-173.5	-179	-63.8	0	0	109.9	V506 V507 R648 V729	V506-Q727 CarbonylContact C-O 3.52Å; V506-Q727 WeakPolarHBondContact CA-O 3.38Å; V507-Q727 HydrophobicContact CB-CB 4.03Å; V507-Q727 HydrophobicContact CG2-CB 4.1Å; V507-Q727 PolarHBondContact N-O 3.12Å; R648-Q727 VanDerWaalsContact NH1-OE1 3.16Å; Q727-V729 WeakPolarHBondContact CG-O 3.3Å
728	F	95.3	Very high	82.1	Confident	1 Å²	1	41.3 Å²	41.3	0%	0.004	25%	0.248	C	C	.	.	S	Bend	trans	-135.8	-11.6	165.9	68.4	-87.9	0	0	0	113.8	W504 Y505 V506 L622 V649 A652 L696 V699	W504-F728 WeakPolarHBondContact CB-O 3.06Å; Y505-F728 WeakPolarHBondContact O-CA 3.48Å; V506-F728 HydrophobicContact CG2-CB 4.32Å; L622-F728 HydrophobicContact CD2-CE1 4.4Å; L622-F728 HydrophobicContact CD2-CZ 4.12Å; V649-F728 HydrophobicContact CB-CE1 4.49Å; V649-F728 HydrophobicContact CG1-CD1 4.23Å; V649-F728 HydrophobicContact CG1-CE1 3.91Å; V649-F728 WeakPolarHBondContact O-CE1 3.25Å; A652-F728 HydrophobicContact CB-CD1 4.06Å; A652-F728 HydrophobicContact CB-CD2 4.44Å; A652-F728 HydrophobicContact CB-CE1 3.46Å; A652-F728 VanDerWaalsContact CB-CE1 3.46Å; A652-F728 HydrophobicContact CB-CE2 3.89Å; A652-F728 HydrophobicContact CB-CZ 3.36Å; L696-F728 HydrophobicContact CD2-CE2 4.1Å; L696-F728 HydrophobicContact CD2-CZ 4.32Å; V699-F728 HydrophobicContact CB-CG 4.44Å; V699-F728 HydrophobicContact CG1-CB 4.21Å; V699-F728 HydrophobicContact CG1-CD1 3.88Å; V699-F728 HydrophobicContact CG1-CE1 4.39Å; V699-F728 HydrophobicContact CG1-CG 4.02Å; V699-F728 HydrophobicContact CG2-CB 3.44Å; V699-F728 VanDerWaalsContact CG2-CB 3.44Å; V699-F728 HydrophobicContact CG2-CD1 4.37Å; V699-F728 HydrophobicContact CG2-CD2 3.89Å; V699-F728 HydrophobicContact CG2-CG 3.67Å
729	V	93.9	Very high	84.2	Confident	0 Å²	0	36.6 Å²	36.6	0%	0	22%	0.219	C	C	.	.	S	Bend	trans	-112.3	131.1	169.5	177.9	0	0	0	0	108.1	W504 A652 F655 Q727 E733 L734	W504-V729 HydrophobicContact CD2-CG2 3.9Å; W504-V729 HydrophobicContact CE3-CG2 3.71Å; W504-V729 HydrophobicContact CH2-CG2 3.72Å; W504-V729 HydrophobicContact CZ2-CG1 4.06Å; W504-V729 HydrophobicContact CZ2-CG2 3.9Å; W504-V729 HydrophobicContact CZ3-CG2 3.63Å; A652-V729 HydrophobicContact CB-CB 3.77Å; A652-V729 HydrophobicContact CB-CG2 3.56Å; F655-V729 HydrophobicContact CD1-CG1 4.27Å; Q727-V729 WeakPolarHBondContact CG-O 3.3Å; V729-E733 HydrophobicContact CG1-CB 3.82Å; V729-L734 HydrophobicContact CB-CD2 4.06Å; V729-L734 HydrophobicContact CB-CG 4.28Å; V729-L734 HydrophobicContact CG1-CD2 3.71Å; V729-L734 HydrophobicContact CG1-CG 3.94Å
730	P	91.3	Very high	86	Confident	7 Å²	7	30.5 Å²	30.5	5%	0.045	19%	0.192	C	C	.	.			trans	-56.6	142.2	177.4	-24.3	33.9	0	0	0	112.2	W504 Y505 E732 E733 L734	W504-P730 VanDerWaalsContact CD1-CD 3.43Å; Y505-P730 HydrophobicContact CD1-CG 4.45Å; Y505-P730 HydrophobicContact CE1-CG 4.08Å; P730-E732 VanDerWaalsContact CB-OE2 3.29Å; P730-E732 WeakPolarHBondContact CB-OE2 3.48Å; P730-E732 PolarHBondContact O-N 3.24Å; P730-E733 PolarHBondContact O-N 2.93Å; P730-L734 PolarHBondContact O-N 3.45Å
731	M	89.8	Confident	87.5	Confident	4 Å²	4	32.3 Å²	32.3	2%	0.02	19%	0.19	C	C	.	.	H	α-helix	trans	-59.8	-31.2	178.2	-77.4	-57.4	-53.7	0	0	111.8	Y184 L204 P519 F520 R648 E733 L734 L735	Y184-M731 HydrophobicContact CD1-CE 3.59Å; Y184-M731 HydrophobicContact CD2-CB 4.44Å; Y184-M731 HydrophobicContact CD2-CE 4.44Å; Y184-M731 HydrophobicContact CD2-CG 3.95Å; Y184-M731 HydrophobicContact CE1-CE 4.05Å; Y184-M731 HydrophobicContact CG-CE 3.8Å; Y184-M731 HydrophobicContact CG-CG 4.01Å; Y184-M731 HydrophobicContact CG-SD 4.23Å; L204-M731 HydrophobicContact CD1-CB 3.85Å; P519-M731 HydrophobicContact CG-CE 4.06Å; F520-M731 HydrophobicContact CZ-CE 4.2Å; R648-M731 WeakPolarHBondContact CD-SD 3.37Å; R648-M731 HydrophobicContact CG-SD 3.6Å; M731-E733 PolarHBondContact O-N 3.06Å; M731-E733 VanDerWaalsContact O-N 3.17Å; M731-L734 HydrophobicContact CE-CB 4.48Å; M731-L734 PolarHBondContact O-N 3.37Å; M731-L734 VanDerWaalsContact O-N 3.14Å; M731-L734 HydrophobicContact SD-CD1 3.99Å; M731-L735 HydrophobicContact CE-CD1 4.14Å; M731-L735 HydrophobicContact CE-CD2 3.66Å; M731-L735 HydrophobicContact CE-CG 3.76Å; M731-L735 WeakPolarHBondContact O-CB 3.5Å; M731-L735 VanDerWaalsContact O-CG 3.23Å; M731-L735 WeakPolarHBondContact O-CG 3.49Å; M731-L735 PolarHBondContact O-N 3.05Å
732	E	86.3	Confident	88.9	Confident	56 Å²	56	30.2 Å²	30.2	26%	0.262	17%	0.167	S	C	.	.	H	α-helix	trans	-54.6	-33	173.5	-64.4	85.9	161.6	0	0	112.2	L204 P730 K736	L204-E732 WeakPolarHBondContact CB-OE1 3.47Å; L204-E732 HydrophobicContact CD1-CG 3.79Å; L204-E732 WeakPolarHBondContact CD1-OE1 3.28Å; P730-E732 VanDerWaalsContact CB-OE2 3.29Å; P730-E732 WeakPolarHBondContact CB-OE2 3.48Å; P730-E732 PolarHBondContact O-N 3.24Å; E732-K736 WeakPolarHBondContact O-CD 3.42Å; E732-K736 WeakPolarHBondContact O-CE 3.46Å; E732-K736 WeakPolarHBondContact O-CG 3.48Å; E732-K736 PolarHBondContact O-NZ 2.72Å
733	E	87.7	Confident	89.5	Confident	18 Å²	18	26.3 Å²	26.3	8%	0.084	15%	0.146	C	C	.	.	H	α-helix	trans	-83.2	-40.4	176.7	-68.6	-54.3	130.3	0	0	111.9	R496 V729 P730 M731 L735 K736	R496-E733 IonicContact NH1-OE2 3.53Å; V729-E733 HydrophobicContact CG1-CB 3.82Å; P730-E733 PolarHBondContact O-N 2.93Å; M731-E733 PolarHBondContact O-N 3.06Å; M731-E733 VanDerWaalsContact O-N 3.17Å; E733-L735 VanDerWaalsContact C-N 3.31Å; E733-L735 PolarHBondContact O-N 3.07Å; E733-K736 PolarHBondContact O-N 2.9Å; E733-K736 IonicContact OE1-NZ 3.66Å; E733-K736 PolarHBondContact OE1-NZ 3.29Å
734	L	89.7	Confident	89.6	Confident	0 Å²	0	23.7 Å²	23.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-67.9	-28.3	180	-60.3	-177.3	0	0	0	113.2	F520 R648 A652 F655 V729 P730 M731 K736 L739 T740	F520-L734 HydrophobicContact CE1-CB 4.41Å; F520-L734 HydrophobicContact CZ-CB 4.2Å; F520-L734 HydrophobicContact CZ-CD1 4.14Å; R648-L734 HydrophobicContact CB-CD1 4.47Å; A652-L734 HydrophobicContact CB-CD1 4.47Å; A652-L734 HydrophobicContact CB-CD2 4.24Å; F655-L734 HydrophobicContact CB-CD2 3.82Å; F655-L734 HydrophobicContact CD2-CD2 4.44Å; F655-L734 HydrophobicContact CG-CD2 4.04Å; V729-L734 HydrophobicContact CB-CD2 4.06Å; V729-L734 HydrophobicContact CB-CG 4.28Å; V729-L734 HydrophobicContact CG1-CD2 3.71Å; V729-L734 HydrophobicContact CG1-CG 3.94Å; P730-L734 PolarHBondContact O-N 3.45Å; M731-L734 HydrophobicContact CE-CB 4.48Å; M731-L734 PolarHBondContact O-N 3.37Å; M731-L734 VanDerWaalsContact O-N 3.14Å; M731-L734 HydrophobicContact SD-CD1 3.99Å; L734-K736 VanDerWaalsContact C-N 3.35Å; L734-L739 HydrophobicContact CB-CD2 4.42Å; L734-L739 HydrophobicContact CD2-CD2 3.99Å; L734-T740 PolarHBondContact O-OG1 3.35Å
735	L	85.8	Confident	89.5	Confident	28 Å²	28	25.1 Å²	25.1	15%	0.147	15%	0.146	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.3	-2.8	179.4	-63.4	-179.4	0	0	0	114.1	Y184 A201 A435 M731 E733	Y184-L735 HydrophobicContact CE1-CD1 3.95Å; A201-L735 HydrophobicContact CB-CD1 3.82Å; A435-L735 HydrophobicContact CB-CD1 4.35Å; A435-L735 HydrophobicContact CB-CD2 3.36Å; A435-L735 HydrophobicContact CB-CG 4.46Å; M731-L735 HydrophobicContact CE-CD1 4.14Å; M731-L735 HydrophobicContact CE-CD2 3.66Å; M731-L735 HydrophobicContact CE-CG 3.76Å; M731-L735 WeakPolarHBondContact O-CB 3.5Å; M731-L735 VanDerWaalsContact O-CG 3.23Å; M731-L735 WeakPolarHBondContact O-CG 3.49Å; M731-L735 PolarHBondContact O-N 3.05Å; E733-L735 VanDerWaalsContact C-N 3.31Å; E733-L735 PolarHBondContact O-N 3.07Å
736	K	79.8	Confident	89.4	Confident	95 Å²	95	25 Å²	25	41%	0.413	15%	0.145	S	C	.	.	S	Bend	trans	-98.4	147.6	-176.9	-73.6	168.7	-168.6	162	0	112.2	E732 E733 L734	E732-K736 WeakPolarHBondContact O-CD 3.42Å; E732-K736 WeakPolarHBondContact O-CE 3.46Å; E732-K736 WeakPolarHBondContact O-CG 3.48Å; E732-K736 PolarHBondContact O-NZ 2.72Å; E733-K736 PolarHBondContact O-N 2.9Å; E733-K736 IonicContact OE1-NZ 3.66Å; E733-K736 PolarHBondContact OE1-NZ 3.29Å; L734-K736 VanDerWaalsContact C-N 3.35Å
737	G	79.6	Confident	89.3	Confident	64 Å²	64	25 Å²	25	66%	0.66	15%	0.145	S	C	*	.	T	Hydrogen-bonded Turn	trans	76.7	-157.2	173.5	0	0	0	0	0	112.7	L739	G737-L739 VanDerWaalsContact C-N 3.32Å
738	G	85.3	Confident	89.1	Confident	36 Å²	36	25.2 Å²	25.2	37%	0.371	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-5.9	-179.4	0	0	0	0	0	115	L492 T740 E741 F742	L492-G738 WeakPolarHBondContact CD2-O 3.49Å; G738-T740 PolarHBondContact O-N 3.25Å; G738-E741 PolarHBondContact O-N 3.07Å; G738-F742 PolarHBondContact O-N 3.2Å
739	L	89.8	Confident	88.7	Confident	1 Å²	1	27 Å²	27	1%	0.005	16%	0.155	C	C	.	.	H	α-helix	trans	-57.8	-50.5	-172.6	-176.7	77.8	0	0	0	112.1	L492 V654 F655 L734 G737 E741 F742 L743	L492-L739 HydrophobicContact CD1-CD1 3.89Å; V654-L739 HydrophobicContact CG1-CD1 4.33Å; F655-L739 HydrophobicContact CB-CD1 4.45Å; F655-L739 HydrophobicContact CB-CD2 3.99Å; F655-L739 HydrophobicContact CD2-CD2 3.77Å; F655-L739 HydrophobicContact CG-CD2 4.32Å; L734-L739 HydrophobicContact CB-CD2 4.42Å; L734-L739 HydrophobicContact CD2-CD2 3.99Å; G737-L739 VanDerWaalsContact C-N 3.32Å; L739-E741 VanDerWaalsContact C-N 3.31Å; L739-E741 PolarHBondContact O-N 3.25Å; L739-F742 WeakPolarHBondContact O-CB 3.46Å; L739-F742 PolarHBondContact O-N 2.98Å; L739-L743 HydrophobicContact CD1-CD1 4.13Å; L739-L743 HydrophobicContact CD1-CG 4.19Å; L739-L743 HydrophobicContact CD2-CD1 4.06Å; L739-L743 HydrophobicContact CG-CD1 3.77Å; L739-L743 HydrophobicContact CG-CG 4.12Å; L739-L743 WeakPolarHBondContact O-CG 3.49Å; L739-L743 PolarHBondContact O-N 3.35Å
740	T	88	Confident	88.5	Confident	14 Å²	14	27 Å²	27	9%	0.086	16%	0.155	C	C	.	.	H	α-helix	trans	-58.7	-43.8	-177.7	-47.9	0	0	0	0	111.7	F520 L734 G738 L743 W744	F520-T740 HydrophobicContact CD1-CG2 4.46Å; L734-T740 PolarHBondContact O-OG1 3.35Å; G738-T740 PolarHBondContact O-N 3.25Å; T740-L743 PolarHBondContact O-N 3.03Å; T740-W744 WeakPolarHBondContact O-CB 3.41Å; T740-W744 PolarHBondContact O-N 3.03Å
741	E	87.7	Confident	88.4	Confident	100 Å²	100	26.9 Å²	26.9	47%	0.467	15%	0.154	S	C	.	.	H	α-helix	trans	-65	-44.4	178.2	-176.1	171.7	-165.3	0	0	111.2	G738 L739 W744 T745	G738-E741 PolarHBondContact O-N 3.07Å; L739-E741 VanDerWaalsContact C-N 3.31Å; L739-E741 PolarHBondContact O-N 3.25Å; E741-W744 PolarHBondContact O-N 3.01Å; E741-T745 PolarHBondContact O-N 3.16Å; E741-T745 PolarHBondContact O-OG1 3.32Å; E741-T745 VanDerWaalsContact O-OG1 3.05Å
742	F	92.3	Very high	88.3	Confident	3 Å²	3	26.9 Å²	26.9	1%	0.013	16%	0.155	C	C	.	.	H	α-helix	trans	-59.4	-49.6	175.7	175.8	-89.7	0	0	0	112.6	C490 L492 V654 I664 F666 L679 G738 L739 W744 T745 M746	C490-F742 VanDerWaalsContact SG-CD2 3.57Å; L492-F742 HydrophobicContact CB-CD2 4.44Å; L492-F742 HydrophobicContact CD1-CB 3.65Å; L492-F742 HydrophobicContact CD1-CD1 3.37Å; L492-F742 HydrophobicContact CD1-CD2 3.82Å; L492-F742 HydrophobicContact CD1-CE1 3.89Å; L492-F742 HydrophobicContact CD1-CE2 4.25Å; L492-F742 HydrophobicContact CD1-CG 3.33Å; L492-F742 HydrophobicContact CD1-CZ 4.29Å; L492-F742 HydrophobicContact CD2-CB 3.58Å; L492-F742 HydrophobicContact CD2-CD2 4.37Å; L492-F742 HydrophobicContact CD2-CG 4.07Å; L492-F742 HydrophobicContact CG-CB 3.53Å; L492-F742 HydrophobicContact CG-CD1 4.01Å; L492-F742 HydrophobicContact CG-CD2 3.49Å; L492-F742 VanDerWaalsContact CG-CD2 3.49Å; L492-F742 HydrophobicContact CG-CE2 4.11Å; L492-F742 HydrophobicContact CG-CG 3.41Å; L492-F742 VanDerWaalsContact CG-CG 3.41Å; V654-F742 HydrophobicContact CG1-CE1 4.19Å; I664-F742 HydrophobicContact CG2-CE1 4.43Å; I664-F742 HydrophobicContact CG2-CE2 4.49Å; I664-F742 HydrophobicContact CG2-CZ 3.82Å; I664-F742 WeakPolarHBondContact O-CE2 3.32Å; F666-F742 HydrophobicContact CB-CZ 4.19Å; F666-F742 HydrophobicContact CD1-CD2 4.21Å; F666-F742 HydrophobicContact CD1-CE1 4.35Å; F666-F742 AromaticContact CD1-CE2 3.6Å; F666-F742 HydrophobicContact CD1-CE2 3.6Å; F666-F742 AromaticContact CD1-CZ 3.67Å; F666-F742 HydrophobicContact CD1-CZ 3.67Å; F666-F742 HydrophobicContact CE1-CD2 4.48Å; F666-F742 HydrophobicContact CE1-CE2 4.28Å; F666-F742 HydrophobicContact CG-CZ 4.39Å; L679-F742 HydrophobicContact CD2-CE1 4.36Å; L679-F742 HydrophobicContact CD2-CZ 4.28Å; G738-F742 PolarHBondContact O-N 3.2Å; L739-F742 WeakPolarHBondContact O-CB 3.46Å; L739-F742 PolarHBondContact O-N 2.98Å; F742-W744 VanDerWaalsContact C-N 3.32Å; F742-W744 PolarHBondContact O-N 3.13Å; F742-T745 PolarHBondContact O-N 3.18Å; F742-M746 HydrophobicContact CE1-SD 4.34Å; F742-M746 WeakPolarHBondContact O-CB 3.29Å; F742-M746 PolarHBondContact O-N 3.21Å
743	L	93.5	Very high	88.3	Confident	0 Å²	0	24.7 Å²	24.7	0%	0	14%	0.144	C	C	.	.	H	α-helix	trans	-65	-39.2	178.9	-64.9	177.4	0	0	0	111.1	F520 A645 A651 V654 L739 T740 M746 N747	F520-L743 HydrophobicContact CB-CB 3.93Å; F520-L743 HydrophobicContact CB-CD1 4.42Å; F520-L743 HydrophobicContact CD1-CB 4.3Å; F520-L743 HydrophobicContact CD1-CD1 3.68Å; F520-L743 HydrophobicContact CE1-CD1 4.06Å; F520-L743 HydrophobicContact CG-CB 4.37Å; F520-L743 HydrophobicContact CG-CD1 4Å; F520-L743 CarbonylContact O-C 3.55Å; A645-L743 HydrophobicContact CB-CD2 3.82Å; A651-L743 HydrophobicContact CB-CD1 3.61Å; V654-L743 HydrophobicContact CB-CD2 4.03Å; V654-L743 HydrophobicContact CG1-CD2 3.86Å; V654-L743 HydrophobicContact CG2-CD2 4.17Å; L739-L743 HydrophobicContact CD1-CD1 4.13Å; L739-L743 HydrophobicContact CD1-CG 4.19Å; L739-L743 HydrophobicContact CD2-CD1 4.06Å; L739-L743 HydrophobicContact CG-CD1 3.77Å; L739-L743 HydrophobicContact CG-CG 4.12Å; L739-L743 WeakPolarHBondContact O-CG 3.49Å; L739-L743 PolarHBondContact O-N 3.35Å; T740-L743 PolarHBondContact O-N 3.03Å; L743-M746 HydrophobicContact CD2-CE 3.94Å; L743-M746 PolarHBondContact O-N 3.23Å; L743-N747 VanDerWaalsContact O-CB 3.3Å; L743-N747 WeakPolarHBondContact O-CB 3.45Å; L743-N747 PolarHBondContact O-N 2.87Å; L743-N747 PolarHBondContact O-ND2 3.26Å; L743-N747 VanDerWaalsContact O-ND2 3.16Å
744	W	90.6	Very high	88.2	Confident	55 Å²	55	24.1 Å²	24.1	21%	0.208	14%	0.141	C	C	.	.	H	α-helix	trans	-60.3	-47	176	-172.3	94.1	0	0	0	112	F520 C521 D522 T740 E741 F742 S748	F520-W744 VanDerWaalsContact O-CA 3.24Å; F520-W744 WeakPolarHBondContact O-CA 3.12Å; F520-W744 PolarHBondContact O-N 2.72Å; C521-W744 PolarHBondContact O-NE1 2.89Å; D522-W744 HydrophobicContact CB-CZ2 3.96Å; T740-W744 WeakPolarHBondContact O-CB 3.41Å; T740-W744 PolarHBondContact O-N 3.03Å; E741-W744 PolarHBondContact O-N 3.01Å; F742-W744 VanDerWaalsContact C-N 3.32Å; F742-W744 PolarHBondContact O-N 3.13Å; W744-S748 VanDerWaalsContact O-CB 3.26Å; W744-S748 WeakPolarHBondContact O-CB 3.28Å; W744-S748 PolarHBondContact O-N 3.05Å; W744-S748 PolarHBondContact O-OG 3.09Å
745	T	90.5	Very high	88.1	Confident	36 Å²	36	24.1 Å²	24.1	22%	0.221	14%	0.141	C	C	.	.	H	α-helix	trans	-63.9	-49	175.8	-55.5	0	0	0	0	110.8	F666 E741 F742 N747 S748 E749	F666-T745 HydrophobicContact CE1-CG2 4.42Å; F666-T745 HydrophobicContact CZ-CG2 4.01Å; E741-T745 PolarHBondContact O-N 3.16Å; E741-T745 PolarHBondContact O-OG1 3.32Å; E741-T745 VanDerWaalsContact O-OG1 3.05Å; F742-T745 PolarHBondContact O-N 3.18Å; T745-N747 PolarHBondContact O-N 2.87Å; T745-S748 PolarHBondContact O-N 2.95Å; T745-E749 WeakPolarHBondContact O-CG 3.35Å; T745-E749 PolarHBondContact O-N 2.98Å
746	M	92.1	Very high	88.2	Confident	0 Å²	0	22.9 Å²	22.9	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-58	-51.4	-179.7	-176.6	-174.3	71.7	0	0	112.1	V642 A645 F666 A677 L679 F742 L743 S748 E749 I750	V642-M746 HydrophobicContact CG2-SD 4.3Å; A645-M746 HydrophobicContact CB-CE 3.47Å; A645-M746 VanDerWaalsContact CB-CE 3.47Å; F666-M746 HydrophobicContact CB-CG 4.36Å; F666-M746 HydrophobicContact CB-SD 4.31Å; F666-M746 HydrophobicContact CD1-CB 3.86Å; F666-M746 HydrophobicContact CD1-CG 4.1Å; F666-M746 HydrophobicContact CD2-CB 4.17Å; F666-M746 HydrophobicContact CD2-CG 3.8Å; F666-M746 HydrophobicContact CE1-CB 3.73Å; F666-M746 HydrophobicContact CE1-CG 4.37Å; F666-M746 HydrophobicContact CE2-CB 4.07Å; F666-M746 HydrophobicContact CE2-CG 4.1Å; F666-M746 HydrophobicContact CG-CB 4.09Å; F666-M746 HydrophobicContact CG-CG 3.82Å; F666-M746 HydrophobicContact CG-SD 4.34Å; F666-M746 VanDerWaalsContact CZ-CA 3.42Å; F666-M746 HydrophobicContact CZ-CB 3.85Å; F666-M746 HydrophobicContact CZ-CG 4.38Å; A677-M746 HydrophobicContact CB-CG 3.82Å; A677-M746 HydrophobicContact CB-SD 3.82Å; L679-M746 HydrophobicContact CD2-SD 3.71Å; F742-M746 HydrophobicContact CE1-SD 4.34Å; F742-M746 WeakPolarHBondContact O-CB 3.29Å; F742-M746 PolarHBondContact O-N 3.21Å; L743-M746 HydrophobicContact CD2-CE 3.94Å; L743-M746 PolarHBondContact O-N 3.23Å; M746-S748 VanDerWaalsContact C-N 3.33Å; M746-S748 PolarHBondContact O-N 2.76Å; M746-E749 PolarHBondContact O-N 2.96Å; M746-I750 HydrophobicContact CG-CD1 3.94Å; M746-I750 VanDerWaalsContact O-CG1 3.29Å; M746-I750 WeakPolarHBondContact O-CG1 3.47Å; M746-I750 PolarHBondContact O-N 2.92Å
747	N	92.9	Very high	88.4	Confident	0 Å²	0	18.6 Å²	18.6	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-65.2	-37.1	-179.9	-73.9	-39.6	0	0	0	111.8	F520 C521 A645 L646 L743 T745 E749 I750 T751	F520-N747 WeakPolarHBondContact O-CB 3.45Å; F520-N747 PolarHBondContact O-ND2 3.2Å; C521-N747 HydrophobicContact CB-CB 3.87Å; A645-N747 VanDerWaalsContact C-ND2 3.33Å; A645-N747 PolarHBondContact N-OD1 3.41Å; A645-N747 PolarHBondContact O-ND2 3.15Å; L646-N747 HydrophobicContact CD2-CB 3.92Å; L743-N747 VanDerWaalsContact O-CB 3.3Å; L743-N747 WeakPolarHBondContact O-CB 3.45Å; L743-N747 PolarHBondContact O-N 2.87Å; L743-N747 PolarHBondContact O-ND2 3.26Å; L743-N747 VanDerWaalsContact O-ND2 3.16Å; T745-N747 PolarHBondContact O-N 2.87Å; N747-E749 PolarHBondContact O-N 3.38Å; N747-I750 PolarHBondContact O-N 2.58Å; N747-T751 VanDerWaalsContact O-CB 3.32Å; N747-T751 WeakPolarHBondContact O-CB 3.23Å; N747-T751 PolarHBondContact O-N 2.67Å; N747-T751 PolarHBondContact O-OG1 3.45Å
748	S	89.1	Confident	88.7	Confident	12 Å²	12	15.6 Å²	15.6	8%	0.084	9%	0.085	C	C	.	.	H	α-helix	trans	-62.7	-42.2	176.7	-61.1	0	0	0	0	111.9	W744 T745 M746 Q752	W744-S748 VanDerWaalsContact O-CB 3.26Å; W744-S748 WeakPolarHBondContact O-CB 3.28Å; W744-S748 PolarHBondContact O-N 3.05Å; W744-S748 PolarHBondContact O-OG 3.09Å; T745-S748 PolarHBondContact O-N 2.95Å; M746-S748 VanDerWaalsContact C-N 3.33Å; M746-S748 PolarHBondContact O-N 2.76Å; S748-Q752 WeakPolarHBondContact O-CB 3.42Å; S748-Q752 PolarHBondContact O-N 3.34Å
749	E	88.2	Confident	88.7	Confident	37 Å²	37	15.5 Å²	15.5	17%	0.173	8%	0.076	C	C	.	.	H	α-helix	trans	-64.7	-45.6	175.5	-68.5	-65.6	155.8	0	0	111.8	R486 F666 T745 M746 N747 Q752 Q753	R486-E749 VanDerWaalsContact CD-OE2 3.25Å; R486-E749 WeakPolarHBondContact CD-OE2 3.08Å; R486-E749 WeakPolarHBondContact CG-OE2 3.3Å; R486-E749 IonicContact CZ-OE2 3.68Å; R486-E749 IonicContact NE-OE2 3.85Å; R486-E749 IonicContact NH1-OE1 3.76Å; R486-E749 IonicContact NH1-OE2 2.72Å; R486-E749 PolarHBondContact NH1-OE2 3.43Å; F666-E749 HydrophobicContact CE2-CB 4.4Å; F666-E749 HydrophobicContact CE2-CG 4.35Å; F666-E749 HydrophobicContact CZ-CG 4.47Å; T745-E749 WeakPolarHBondContact O-CG 3.35Å; T745-E749 PolarHBondContact O-N 2.98Å; M746-E749 PolarHBondContact O-N 2.96Å; N747-E749 PolarHBondContact O-N 3.38Å; E749-Q752 PolarHBondContact O-N 3.18Å; E749-Q753 WeakPolarHBondContact O-CB 3.06Å; E749-Q753 PolarHBondContact O-N 2.98Å
750	I	88.7	Confident	88	Confident	1 Å²	1	18.2 Å²	18.2	1%	0.005	9%	0.089	C	C	.	.	H	α-helix	trans	-59	-50.6	176	-67.1	167.8	0	0	0	110.5	F643 V675 A677 M746 N747 Q752 Q753 K754	F643-I750 WeakPolarHBondContact O-CG2 3.4Å; V675-I750 HydrophobicContact CG1-CG2 4.46Å; A677-I750 HydrophobicContact CB-CD1 3.83Å; A677-I750 HydrophobicContact CB-CG1 4.28Å; M746-I750 HydrophobicContact CG-CD1 3.94Å; M746-I750 VanDerWaalsContact O-CG1 3.29Å; M746-I750 WeakPolarHBondContact O-CG1 3.47Å; M746-I750 PolarHBondContact O-N 2.92Å; N747-I750 PolarHBondContact O-N 2.58Å; I750-Q752 PolarHBondContact O-N 3.19Å; I750-Q753 PolarHBondContact O-N 2.98Å; I750-K754 HydrophobicContact CG2-CD 4.31Å; I750-K754 WeakPolarHBondContact O-CG 3.49Å; I750-K754 PolarHBondContact O-N 2.89Å
751	T	89	Confident	86.9	Confident	4 Å²	4	20.6 Å²	20.6	3%	0.025	10%	0.099	C	C	.	.	H	α-helix	trans	-63.7	-41.9	-178.2	-63.9	0	0	0	0	111.5	L525 L529 N747 K754 L755	L525-T751 HydrophobicContact CB-CG2 3.74Å; L525-T751 WeakPolarHBondContact O-CG2 3.07Å; L529-T751 HydrophobicContact CB-CG2 3.87Å; L529-T751 HydrophobicContact CD2-CG2 3.86Å; L529-T751 HydrophobicContact CG-CG2 4.46Å; N747-T751 VanDerWaalsContact O-CB 3.32Å; N747-T751 WeakPolarHBondContact O-CB 3.23Å; N747-T751 PolarHBondContact O-N 2.67Å; N747-T751 PolarHBondContact O-OG1 3.45Å; T751-K754 PolarHBondContact O-N 3.39Å; T751-L755 HydrophobicContact CG2-CD1 4.13Å; T751-L755 WeakPolarHBondContact O-CG 3.32Å; T751-L755 PolarHBondContact O-N 2.99Å
752	Q	88.1	Confident	85.3	Confident	5 Å²	5	18.9 Å²	18.9	2%	0.023	10%	0.102	C	C	.	.	H	α-helix	trans	-62	-46.3	175.9	-179.7	-179.8	-4	0	0	111.7	L477 S480 R486 S748 E749 I750 K754 L755 H756	L477-Q752 VanDerWaalsContact CD1-NE2 3.27Å; L477-Q752 HydrophobicContact CG-CG 4.41Å; L477-Q752 PolarHBondContact O-NE2 3.11Å; S480-Q752 PolarHBondContact OG-NE2 2.97Å; R486-Q752 VanDerWaalsContact NH1-NE2 3.12Å; S748-Q752 WeakPolarHBondContact O-CB 3.42Å; S748-Q752 PolarHBondContact O-N 3.34Å; E749-Q752 PolarHBondContact O-N 3.18Å; I750-Q752 PolarHBondContact O-N 3.19Å; Q752-K754 VanDerWaalsContact C-N 3.34Å; Q752-K754 PolarHBondContact O-N 3.04Å; Q752-L755 PolarHBondContact O-N 3.11Å; Q752-H756 WeakPolarHBondContact O-CB 3.44Å; Q752-H756 PolarHBondContact O-N 3.37Å
753	Q	85.6	Confident	83.1	Confident	9 Å²	9	23 Å²	23	4%	0.042	14%	0.136	C	C	.	.	H	α-helix	trans	-60.6	-43.5	177.8	-174.6	178.3	27.5	0	0	111.3	V675 E749 I750 H756 L757	V675-Q753 HydrophobicContact CG1-CB 4.21Å; V675-Q753 HydrophobicContact CG1-CG 4.04Å; E749-Q753 WeakPolarHBondContact O-CB 3.06Å; E749-Q753 PolarHBondContact O-N 2.98Å; I750-Q753 PolarHBondContact O-N 2.98Å; Q753-H756 PolarHBondContact O-N 3.15Å; Q753-L757 HydrophobicContact CG-CD1 4.17Å; Q753-L757 VanDerWaalsContact O-CG 3.32Å; Q753-L757 WeakPolarHBondContact O-CG 3.32Å; Q753-L757 PolarHBondContact O-N 3.29Å; Q753-L757 VanDerWaalsContact O-N 3.15Å
754	K	86.6	Confident	80.3	Confident	6 Å²	6	31.8 Å²	31.8	3%	0.026	20%	0.196	C	C	.	.	H	α-helix	trans	-59.5	-50.3	175.3	-71	-178	175.7	172.1	0	111.8	L529 W540 V675 I750 T751 Q752 H756 L757 L758	L529-K754 HydrophobicContact CD1-CB 3.85Å; L529-K754 HydrophobicContact CD1-CD 4.49Å; L529-K754 HydrophobicContact CD2-CB 4.45Å; L529-K754 HydrophobicContact CD2-CD 4.04Å; W540-K754 HydrophobicContact CH2-CB 3.89Å; W540-K754 HydrophobicContact CH2-CG 3.71Å; W540-K754 HydrophobicContact CZ2-CG 3.86Å; W540-K754 HydrophobicContact CZ3-CB 3.89Å; W540-K754 HydrophobicContact CZ3-CG 4.14Å; W540-K754 VanDerWaalsContact CZ3-O 3.28Å; W540-K754 WeakPolarHBondContact CZ3-O 3.46Å; V675-K754 HydrophobicContact CB-CG 3.96Å; V675-K754 HydrophobicContact CG1-CD 4.32Å; V675-K754 HydrophobicContact CG1-CG 3.46Å; V675-K754 VanDerWaalsContact CG1-CG 3.46Å; V675-K754 WeakPolarHBondContact O-CE 3.3Å; I750-K754 HydrophobicContact CG2-CD 4.31Å; I750-K754 WeakPolarHBondContact O-CG 3.49Å; I750-K754 PolarHBondContact O-N 2.89Å; T751-K754 PolarHBondContact O-N 3.39Å; Q752-K754 VanDerWaalsContact C-N 3.34Å; Q752-K754 PolarHBondContact O-N 3.04Å; K754-H756 VanDerWaalsContact C-N 3.35Å; K754-H756 PolarHBondContact O-N 3.37Å; K754-L757 PolarHBondContact O-N 2.95Å; K754-L758 WeakPolarHBondContact O-CG 3.37Å; K754-L758 PolarHBondContact O-N 3.45Å
755	L	87.9	Confident	79.8	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-62.1	-40.1	178.8	-77.7	171.1	0	0	0	112.8	I469 I478 L525 H528 L529 A532 T751 Q752 L757 L758 L759	I469-L755 HydrophobicContact CD1-CD2 3.89Å; I478-L755 HydrophobicContact CD1-CD1 3.97Å; I478-L755 HydrophobicContact CG1-CB 4.49Å; I478-L755 HydrophobicContact CG1-CD1 4.26Å; I478-L755 HydrophobicContact CG2-CB 3.61Å; L525-L755 HydrophobicContact CD2-CD1 4.36Å; H528-L755 HydrophobicContact CB-CD1 3.97Å; H528-L755 HydrophobicContact CB-CD2 4.36Å; L529-L755 HydrophobicContact CB-CD1 4.36Å; L529-L755 HydrophobicContact CB-CD2 4.21Å; L529-L755 HydrophobicContact CB-CG 4.16Å; L529-L755 HydrophobicContact CD1-CD2 4.25Å; L529-L755 HydrophobicContact CD1-CG 4.24Å; A532-L755 HydrophobicContact CB-CD2 4.23Å; T751-L755 HydrophobicContact CG2-CD1 4.13Å; T751-L755 WeakPolarHBondContact O-CG 3.32Å; T751-L755 PolarHBondContact O-N 2.99Å; Q752-L755 PolarHBondContact O-N 3.11Å; L755-L757 VanDerWaalsContact C-N 3.34Å; L755-L757 PolarHBondContact O-N 3.01Å; L755-L758 PolarHBondContact O-N 3.48Å; L755-L759 WeakPolarHBondContact O-CG 3.26Å; L755-L759 PolarHBondContact O-N 3.4Å
756	H	87.6	Confident	79.2	Confident	3 Å²	3	30.3 Å²	30.3	1%	0.014	19%	0.194	C	C	.	.	H	α-helix	trans	-57.1	-47.8	176.7	-179.5	75.4	0	0	0	111.7	I478 Q479 S480 H481 Q752 Q753 K754 L759 Q760	I478-H756 WeakPolarHBondContact O-CB 3.37Å; I478-H756 PolarHBondContact O-ND1 3.26Å; Q479-H756 PolarHBondContact O-CE1 3.25Å; Q479-H756 VanDerWaalsContact O-CE1 3.28Å; Q479-H756 PolarHBondContact O-ND1 3.15Å; S480-H756 PolarHBondContact O-CE1 3.01Å; S480-H756 PolarHBondContact O-ND1 3.45Å; H481-H756 AromaticContact CE1-CE1 3.96Å; H481-H756 AromaticContact CE1-NE2 3.97Å; H481-H756 AromaticContact ND1-CE1 3.44Å; H481-H756 PolarHBondContact ND1-CE1 3.45Å; H481-H756 AromaticContact ND1-NE2 3.25Å; H481-H756 PolarHBondContact ND1-NE2 3.16Å; Q752-H756 WeakPolarHBondContact O-CB 3.44Å; Q752-H756 PolarHBondContact O-N 3.37Å; Q753-H756 PolarHBondContact O-N 3.15Å; K754-H756 VanDerWaalsContact C-N 3.35Å; K754-H756 PolarHBondContact O-N 3.37Å; H756-L759 PolarHBondContact O-N 3.24Å; H756-Q760 PolarHBondContact CE1-NE2 3.02Å; H756-Q760 PolarHBondContact NE2-NE2 3.45Å; H756-Q760 PolarHBondContact O-N 3.05Å
757	L	83.6	Confident	78.5	Confident	5 Å²	5	32 Å²	32	3%	0.026	20%	0.204	C	C	.	.	H	α-helix	trans	-69.1	-42.2	-178.3	-67.6	169.3	0	0	0	111.6	W540 V543 C546 P671 V675 Q753 K754 L755 L759 Q760 E761	W540-L757 HydrophobicContact CH2-CB 4.15Å; W540-L757 HydrophobicContact CH2-CD1 3.88Å; W540-L757 HydrophobicContact CZ3-CB 4.13Å; V543-L757 HydrophobicContact CG1-CB 3.58Å; C546-L757 HydrophobicContact CB-CD2 3.9Å; P671-L757 HydrophobicContact CG-CD1 4.12Å; V675-L757 HydrophobicContact CG2-CD1 3.67Å; Q753-L757 HydrophobicContact CG-CD1 4.17Å; Q753-L757 VanDerWaalsContact O-CG 3.32Å; Q753-L757 WeakPolarHBondContact O-CG 3.32Å; Q753-L757 PolarHBondContact O-N 3.29Å; Q753-L757 VanDerWaalsContact O-N 3.15Å; K754-L757 PolarHBondContact O-N 2.95Å; L755-L757 VanDerWaalsContact C-N 3.34Å; L755-L757 PolarHBondContact O-N 3.01Å; L757-L759 PolarHBondContact O-N 3.07Å; L757-Q760 PolarHBondContact O-N 3.38Å; L757-Q760 VanDerWaalsContact O-N 3.1Å; L757-E761 PolarHBondContact O-N 3.37Å
758	L	84.9	Confident	77.7	Confident	0 Å²	0	33.9 Å²	33.9	0%	0	22%	0.216	C	C	.	.	H	α-helix	trans	-59.3	-34.1	174.1	-75.2	177	0	0	0	113.2	W465 R466 L529 A532 L533 V538 W540 V543 K754 L755	W465-L758 HydrophobicContact CH2-CB 4.03Å; R466-L758 PolarHBondContact NH1-O 2.89Å; R466-L758 PolarHBondContact NH2-O 3.42Å; L529-L758 HydrophobicContact CD1-CD1 4.08Å; A532-L758 HydrophobicContact CB-CD1 3.88Å; L533-L758 HydrophobicContact CD2-CD1 4.23Å; V538-L758 HydrophobicContact CG1-CD1 4.45Å; V538-L758 HydrophobicContact CG1-CD2 3.31Å; V538-L758 HydrophobicContact CG1-CG 4.48Å; W540-L758 HydrophobicContact CE3-CD1 4.08Å; W540-L758 HydrophobicContact CE3-CD2 3.63Å; W540-L758 HydrophobicContact CE3-CG 3.64Å; W540-L758 HydrophobicContact CZ3-CD1 4.42Å; W540-L758 HydrophobicContact CZ3-CD2 4.16Å; W540-L758 HydrophobicContact CZ3-CG 3.78Å; V543-L758 HydrophobicContact CG2-CD2 3.93Å; K754-L758 WeakPolarHBondContact O-CG 3.37Å; K754-L758 PolarHBondContact O-N 3.45Å; L755-L758 PolarHBondContact O-N 3.48Å
759	L	84.9	Confident	76.9	Confident	35 Å²	35	35.3 Å²	35.3	18%	0.183	23%	0.225	C	C	.	.	H	α-helix	trans	-71.3	-32.9	176.5	-75.6	179.1	0	0	0	112.9	W465 R466 I469 I478 Q479 L755 H756 L757	W465-L759 HydrophobicContact CH2-CD2 3.92Å; W465-L759 HydrophobicContact CZ3-CD2 3.6Å; W465-L759 HydrophobicContact CZ3-CG 4.26Å; R466-L759 HydrophobicContact CB-CD2 4.31Å; R466-L759 HydrophobicContact CG-CD2 4.14Å; I469-L759 HydrophobicContact CG2-CD1 4.08Å; I478-L759 HydrophobicContact CG2-CD1 3.55Å; Q479-L759 HydrophobicContact CG-CD1 4.45Å; L755-L759 WeakPolarHBondContact O-CG 3.26Å; L755-L759 PolarHBondContact O-N 3.4Å; H756-L759 PolarHBondContact O-N 3.24Å; L757-L759 PolarHBondContact O-N 3.07Å
760	Q	76.5	Confident	76.2	Confident	57 Å²	57	35.1 Å²	35.1	27%	0.266	23%	0.228	S	C	.	.	H	α-helix	trans	-76.7	-31.8	-176.9	-75.2	-174	-5	0	0	114.1	H481 C546 H756 L757 A762 A763	H481-Q760 PolarHBondContact CE1-NE2 3.4Å; C546-Q760 PolarHBondContact SG-NE2 2.94Å; C546-Q760 PolarHBondContact SG-OE1 3.05Å; H756-Q760 PolarHBondContact CE1-NE2 3.02Å; H756-Q760 PolarHBondContact NE2-NE2 3.45Å; H756-Q760 PolarHBondContact O-N 3.05Å; L757-Q760 PolarHBondContact O-N 3.38Å; L757-Q760 VanDerWaalsContact O-N 3.1Å; Q760-A762 PolarHBondContact O-N 2.71Å; Q760-A763 PolarHBondContact O-N 3.02Å
761	E	64.9	Low	75.3	Confident	65 Å²	65	37.6 Å²	37.6	30%	0.304	24%	0.244	S	C	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-24.5	-179.2	-164.3	-178.4	-170.7	0	0	113.6	V543 L757	V543-E761 WeakPolarHBondContact CG2-OE2 3.36Å; L757-E761 PolarHBondContact O-N 3.37Å
762	A	52.9	Low	74.3	Confident	64 Å²	64	40.2 Å²	40.2	53%	0.529	26%	0.261	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-3.5	178.4	0	0	0	0	0	114.7	R466 Q760	R466-A762 VanDerWaalsContact CZ-CB 3.45Å; Q760-A762 PolarHBondContact O-N 2.71Å
763	A	46.5	Very low	73.1	Confident	88 Å²	88	43.1 Å²	43.1	73%	0.727	28%	0.281	S	S	*	.			trans	-98.8	0.4	-179.3	0	0	0	0	0	113.4	Q760	Q760-A763 PolarHBondContact O-N 3.02Å
764	C	35.2	Very low	72	Confident	185 Å²	185	46.2 Å²	46.2	100%	1.25	30%	0.302	S	S	*	.			trans	-109.1	0	177.1	-82.1	0	0	0	0	112.5

Retrieved 764 of 764 residues in 1133.3 ms (Link to these results)

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