A0A2K5NHJ0_CERAT Loading...

Protein-lysine N-trimethyltransferase SMYD5

AlphaFold DB , UniProt , Accession A0A2K5NHJ0, Species CERAT (Cercocebus atys, Sooty mangabey), Gene SMYD5, Length 497 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	30.1	Very low	26.3	Very low	246 Å²	246	143.8 Å²	143.8	100%	1.212	75%	0.747	S	S	*	*				0	109.3	0	-89.1	176.6	-167	0	0	106.6
2	Y	21	Very low	26.4	Very low	238 Å²	238	143.9 Å²	143.9	93%	0.933	74%	0.741	S	S	*	*	P	Polyproline II helix	trans	-78.2	136.4	-178	-80.4	-95.3	0	0	0	109.9
3	A	21.6	Very low	26.6	Very low	99 Å²	99	140 Å²	140	82%	0.818	73%	0.728	S	S	*	*	P	Polyproline II helix	trans	-90.4	122.9	169.8	0	0	0	0	0	108.8
4	Y	23	Very low	26.9	Very low	225 Å²	225	139.9 Å²	139.9	88%	0.882	72%	0.722	S	S	*	*	P	Polyproline II helix	trans	-91.5	124.5	171.3	-127.2	-98.1	0	0	0	107.2
5	T	25.5	Very low	27.2	Very low	116 Å²	116	140.1 Å²	140.1	71%	0.712	72%	0.716	S	S	*	*	P	Polyproline II helix	trans	-92.3	127.2	177	45.2	0	0	0	0	110.3	S7	T5-S7 PolarHBondContact O-N 3.38Å; T5-S7 VanDerWaalsContact O-N 3.11Å
6	D	28.9	Very low	27.2	Very low	148 Å²	148	133.8 Å²	133.8	79%	0.791	70%	0.697	S	S	*	*			trans	-51.1	107.4	168.1	-90	-45.9	0	0	0	110.7
7	S	29.4	Very low	27.6	Very low	75 Å²	75	131.2 Å²	131.2	52%	0.524	69%	0.688	S	S	.	*			trans	-126.8	-1.5	170.3	46.2	0	0	0	0	112.3	T5	T5-S7 PolarHBondContact O-N 3.38Å; T5-S7 VanDerWaalsContact O-N 3.11Å
8	D	26.3	Very low	28.1	Very low	119 Å²	119	127.7 Å²	127.7	64%	0.636	67%	0.67	S	S	*	*	H	α-helix	trans	-92.5	-16.9	-176.1	-73.2	-39.4	0	0	0	113.4
9	T	27.6	Very low	28.3	Very low	85 Å²	85	125.1 Å²	125.1	52%	0.521	66%	0.66	S	S	.	*	H	α-helix	trans	-85.2	-27.3	-176.7	22.9	0	0	0	0	114.2	T13	T9-T13 PolarHBondContact O-OG1 3.06Å
10	E	27.5	Very low	28.5	Very low	153 Å²	153	126.6 Å²	126.6	72%	0.715	66%	0.66	S	S	*	*	H	α-helix	trans	-78.8	-30.4	174	-78.8	-176.1	156.9	0	0	112.8	T13 Q14	E10-T13 PolarHBondContact O-OG1 2.95Å; E10-T13 VanDerWaalsContact O-OG1 3.07Å; E10-Q14 PolarHBondContact O-N 3.49Å
11	V	29	Very low	28.8	Very low	78 Å²	78	123 Å²	123	47%	0.473	65%	0.649	S	S	.	*	H	α-helix	trans	-74.5	-29.5	179.1	180	0	0	0	0	111.9	K15	V11-K15 WeakPolarHBondContact O-CG 3.43Å; V11-K15 PolarHBondContact O-N 3.13Å
12	Q	26.8	Very low	29	Very low	145 Å²	145	115 Å²	115	68%	0.678	61%	0.609	S	S	*	*	H	α-helix	trans	-78.9	-33.8	178.1	-73.8	-170.4	-2	0	0	113.2	G16	Q12-G16 PolarHBondContact O-N 2.99Å; Q12-G16 VanDerWaalsContact O-N 3.07Å
13	T	28.6	Very low	29.4	Very low	93 Å²	93	111.8 Å²	111.8	57%	0.571	60%	0.595	S	S	*	*	H	α-helix	trans	-70	-37.8	176.3	44.8	0	0	0	0	111.7	T9 E10 G16 T17	T9-T13 PolarHBondContact O-OG1 3.06Å; E10-T13 PolarHBondContact O-OG1 2.95Å; E10-T13 VanDerWaalsContact O-OG1 3.07Å; T13-G16 PolarHBondContact O-N 3Å; T13-T17 PolarHBondContact O-N 3.15Å; T13-T17 VanDerWaalsContact O-N 3.14Å; T13-T17 PolarHBondContact O-OG1 3.05Å
14	Q	31.5	Very low	29.8	Very low	138 Å²	138	113 Å²	113	65%	0.645	58%	0.584	S	S	*	*	H	α-helix	trans	-67.3	-37.3	174.2	-116	163.8	1.5	0	0	113.6	E10 T17 D18	E10-Q14 PolarHBondContact O-N 3.49Å; Q14-T17 WeakPolarHBondContact CA-OG1 3.38Å; Q14-T17 PolarHBondContact O-OG1 2.63Å; Q14-D18 PolarHBondContact O-N 3.16Å
15	K	31.8	Very low	30.3	Very low	143 Å²	143	102.8 Å²	102.8	62%	0.622	55%	0.546	S	S	*	.	H	α-helix	trans	-67.2	-35.4	172.5	-79.2	-178.4	177.7	-178.6	0	112.6	V11 V19	V11-K15 WeakPolarHBondContact O-CG 3.43Å; V11-K15 PolarHBondContact O-N 3.13Å; K15-V19 WeakPolarHBondContact O-CG2 3.47Å; K15-V19 PolarHBondContact O-N 3.03Å
16	G	26.7	Very low	30.7	Very low	40 Å²	40	101.8 Å²	101.8	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-71.3	-32.1	178.8	0	0	0	0	0	114	Q12 T13 K20	Q12-G16 PolarHBondContact O-N 2.99Å; Q12-G16 VanDerWaalsContact O-N 3.07Å; T13-G16 PolarHBondContact O-N 3Å; G16-K20 PolarHBondContact O-N 3.49Å
17	T	33.3	Very low	30.6	Very low	89 Å²	89	100.9 Å²	100.9	55%	0.546	53%	0.528	S	S	.	.	H	α-helix	trans	-75.5	-36	173.8	48	0	0	0	0	112.7	T13 Q14 K20 A21	T13-T17 PolarHBondContact O-N 3.15Å; T13-T17 VanDerWaalsContact O-N 3.14Å; T13-T17 PolarHBondContact O-OG1 3.05Å; Q14-T17 WeakPolarHBondContact CA-OG1 3.38Å; Q14-T17 PolarHBondContact O-OG1 2.63Å; T17-K20 PolarHBondContact O-N 3.36Å; T17-A21 WeakPolarHBondContact O-CB 3.35Å; T17-A21 PolarHBondContact O-N 3.09Å
18	D	36.8	Very low	30.5	Very low	68 Å²	68	102 Å²	102	36%	0.364	53%	0.525	S	S	.	.	H	α-helix	trans	-63.8	-42.2	175.1	-100.1	-20.5	0	0	0	111.4	Q14 A21 Q22 R145	Q14-D18 PolarHBondContact O-N 3.16Å; D18-A21 PolarHBondContact O-N 3.42Å; D18-Q22 WeakPolarHBondContact O-CB 3.41Å; D18-Q22 VanDerWaalsContact O-CG 3.22Å; D18-Q22 WeakPolarHBondContact O-CG 3.44Å; D18-Q22 PolarHBondContact O-N 3.31Å; D18-R145 IonicContact OD2-NH2 2.82Å; D18-R145 PolarHBondContact OD2-NH2 2.69Å; D18-R145 VanDerWaalsContact OD2-NH2 3.16Å
19	V	33.2	Very low	30.6	Very low	79 Å²	79	98 Å²	98	48%	0.479	51%	0.506	S	S	.	.	H	α-helix	trans	-72.3	-32.7	178.7	176.3	0	0	0	0	112.3	K15 R23	K15-V19 WeakPolarHBondContact O-CG2 3.47Å; K15-V19 PolarHBondContact O-N 3.03Å; V19-R23 WeakPolarHBondContact O-CB 3.28Å; V19-R23 PolarHBondContact O-N 3.39Å
20	K	30.6	Very low	30.6	Very low	154 Å²	154	101.6 Å²	101.6	67%	0.67	51%	0.51	S	S	*	.	H	α-helix	trans	-71.7	-39.8	173.1	-88.4	-173.5	174.7	-175.9	0	112.2	G16 T17 Q22 R23 Q24	G16-K20 PolarHBondContact O-N 3.49Å; T17-K20 PolarHBondContact O-N 3.36Å; K20-Q22 VanDerWaalsContact C-N 3.34Å; K20-R23 PolarHBondContact O-N 3.32Å; K20-Q24 WeakPolarHBondContact O-CB 3.44Å; K20-Q24 PolarHBondContact O-N 2.91Å
21	A	34.8	Very low	30.7	Very low	52 Å²	52	96.1 Å²	96.1	43%	0.43	48%	0.484	S	S	.	.	H	α-helix	trans	-65.3	-37.8	173.4	0	0	0	0	0	111.7	T17 D18 Q24 A25	T17-A21 WeakPolarHBondContact O-CB 3.35Å; T17-A21 PolarHBondContact O-N 3.09Å; D18-A21 PolarHBondContact O-N 3.42Å; A21-Q24 PolarHBondContact O-N 3.23Å; A21-A25 WeakPolarHBondContact O-CB 3.36Å; A21-A25 PolarHBondContact O-N 3.1Å
22	Q	34.5	Very low	30.6	Very low	79 Å²	79	99 Å²	99	37%	0.369	49%	0.492	S	S	.	.	H	α-helix	trans	-65.6	-39.1	171.3	-76.8	172.7	-26.6	0	0	112.6	D18 K20 A25 Q26	D18-Q22 WeakPolarHBondContact O-CB 3.41Å; D18-Q22 VanDerWaalsContact O-CG 3.22Å; D18-Q22 WeakPolarHBondContact O-CG 3.44Å; D18-Q22 PolarHBondContact O-N 3.31Å; K20-Q22 VanDerWaalsContact C-N 3.34Å; Q22-A25 WeakPolarHBondContact O-CB 3.37Å; Q22-A25 PolarHBondContact O-N 2.88Å; Q22-Q26 VanDerWaalsContact O-CG 3.29Å; Q22-Q26 WeakPolarHBondContact O-CG 3.35Å; Q22-Q26 PolarHBondContact O-N 2.9Å
23	R	31	Very low	30.6	Very low	169 Å²	169	94 Å²	94	64%	0.638	47%	0.472	S	S	*	.	H	α-helix	trans	-71.3	-33.9	174.2	-89.2	-177.1	169.8	-151.7	-2.5	113.8	V19 K20 A25 Q26 L27	V19-R23 WeakPolarHBondContact O-CB 3.28Å; V19-R23 PolarHBondContact O-N 3.39Å; K20-R23 PolarHBondContact O-N 3.32Å; R23-A25 VanDerWaalsContact C-N 3.33Å; R23-Q26 WeakPolarHBondContact O-CB 3.17Å; R23-Q26 PolarHBondContact O-N 3.46Å; R23-L27 PolarHBondContact O-N 3.13Å
24	Q	29.5	Very low	30.8	Very low	125 Å²	125	90.8 Å²	90.8	58%	0.584	45%	0.452	S	S	*	.	H	α-helix	trans	-70.1	-33.3	171.9	-113	166.8	-26.8	0	0	111.2	K20 A21 Q26 L27 H28	K20-Q24 WeakPolarHBondContact O-CB 3.44Å; K20-Q24 PolarHBondContact O-N 2.91Å; A21-Q24 PolarHBondContact O-N 3.23Å; Q24-Q26 VanDerWaalsContact C-N 3.34Å; Q24-L27 PolarHBondContact O-N 2.92Å; Q24-H28 PolarHBondContact O-N 3.5Å
25	A	33.4	Very low	30.7	Very low	10 Å²	10	85.1 Å²	85.1	8%	0.083	43%	0.429	C	S	.	.	H	α-helix	trans	-63.7	-38.4	169.2	0	0	0	0	0	112.3	A21 Q22 R23 L27 S29 Y239	A21-A25 WeakPolarHBondContact O-CB 3.36Å; A21-A25 PolarHBondContact O-N 3.1Å; Q22-A25 WeakPolarHBondContact O-CB 3.37Å; Q22-A25 PolarHBondContact O-N 2.88Å; R23-A25 VanDerWaalsContact C-N 3.33Å; A25-L27 PolarHBondContact O-N 3.19Å; A25-S29 WeakPolarHBondContact O-CB 3.43Å; A25-S29 PolarHBondContact O-N 3.05Å; A25-S29 PolarHBondContact O-OG 3.07Å; A25-Y239 WeakPolarHBondContact CA-OH 3.35Å; A25-Y239 HydrophobicContact CB-CE1 4.34Å; A25-Y239 WeakPolarHBondContact CB-OH 3.41Å; A25-Y239 PolarHBondContact N-OH 2.99Å
26	Q	34.2	Very low	30.9	Very low	95 Å²	95	79.2 Å²	79.2	44%	0.444	40%	0.404	S	S	.	.	H	α-helix	trans	-66.9	-30.9	177.1	-75.9	169.7	-18.6	0	0	114.2	Q22 R23 Q24	Q22-Q26 VanDerWaalsContact O-CG 3.29Å; Q22-Q26 WeakPolarHBondContact O-CG 3.35Å; Q22-Q26 PolarHBondContact O-N 2.9Å; R23-Q26 WeakPolarHBondContact O-CB 3.17Å; R23-Q26 PolarHBondContact O-N 3.46Å; Q24-Q26 VanDerWaalsContact C-N 3.34Å
27	L	25.5	Very low	31.2	Very low	130 Å²	130	78.6 Å²	78.6	68%	0.681	39%	0.39	S	S	*	.	H	α-helix	trans	-80.1	-33.6	179.1	-88.4	150.3	0	0	0	112.5	R23 Q24 A25	R23-L27 PolarHBondContact O-N 3.13Å; Q24-L27 PolarHBondContact O-N 2.92Å; A25-L27 PolarHBondContact O-N 3.19Å
28	H	27	Very low	31.2	Very low	99 Å²	99	78.3 Å²	78.3	46%	0.458	38%	0.381	S	S	.	.	H	α-helix	trans	-92.5	-21.9	178.2	-78.7	-72.4	0	0	0	114.3	Q24 R30 Q31 Y239	Q24-H28 PolarHBondContact O-N 3.5Å; H28-R30 VanDerWaalsContact C-N 3.25Å; H28-R30 PolarHBondContact O-N 3.34Å; H28-Q31 PolarHBondContact O-N 3.01Å; H28-Y239 HydrophobicContact CB-CD1 4.11Å; H28-Y239 HydrophobicContact CB-CE1 4Å
29	S	29.2	Very low	31.1	Very low	34 Å²	34	78 Å²	78	24%	0.238	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-8.1	-179.5	89.8	0	0	0	0	114.6	A25 Q31	A25-S29 WeakPolarHBondContact O-CB 3.43Å; A25-S29 PolarHBondContact O-N 3.05Å; A25-S29 PolarHBondContact O-OG 3.07Å; S29-Q31 PolarHBondContact O-N 3.01Å
30	R	27.1	Very low	31	Very low	160 Å²	160	77.4 Å²	77.4	60%	0.604	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70	-16.4	169.7	-82	-176.1	166.4	-139	0.5	112.8	H28 E480	H28-R30 VanDerWaalsContact C-N 3.25Å; H28-R30 PolarHBondContact O-N 3.34Å; R30-E480 IonicContact CZ-OE2 3.54Å; R30-E480 IonicContact NH1-OE1 2.93Å; R30-E480 PolarHBondContact NH1-OE1 3.47Å; R30-E480 VanDerWaalsContact NH1-OE1 3.15Å; R30-E480 IonicContact NH1-OE2 3.83Å; R30-E480 PolarHBondContact NH1-OE2 3.45Å
31	Q	29.2	Very low	30.7	Very low	38 Å²	38	72.7 Å²	72.7	18%	0.178	36%	0.364	C	S	.	.	S	Bend	trans	-108.5	-7	-158.3	-52	-161.4	-70.3	0	0	116.1	H28 S29 E480 E481 G483	H28-Q31 PolarHBondContact O-N 3.01Å; S29-Q31 PolarHBondContact O-N 3.01Å; Q31-E480 WeakPolarHBondContact CG-O 3.36Å; Q31-E480 PolarHBondContact NE2-O 3.28Å; Q31-E481 WeakPolarHBondContact O-CA 3.37Å; Q31-E481 VanDerWaalsContact O-CB 3.23Å; Q31-E481 WeakPolarHBondContact O-CB 3.35Å; Q31-E481 VanDerWaalsContact O-CG 3.28Å; Q31-E481 WeakPolarHBondContact O-CG 3.48Å; Q31-G483 PolarHBondContact NE2-O 3.29Å
32	Q	27.8	Very low	30.3	Very low	139 Å²	139	74 Å²	74	65%	0.65	38%	0.382	S	S	*	.			trans	-152.4	80.2	-176.4	-67.2	-174.5	-12.3	0	0	112.1	P241	Q32-P241 WeakPolarHBondContact O-CD 3.41Å; Q32-P241 WeakPolarHBondContact O-CG 3.2Å
33	T	27.4	Very low	29.7	Very low	40 Å²	40	74.7 Å²	74.7	25%	0.245	40%	0.401	C	S	.	.			trans	-127	92.6	178.8	34.2	0	0	0	0	111.4	F38 P241 E481	T33-F38 HydrophobicContact CG2-CE2 3.67Å; T33-F38 HydrophobicContact CG2-CZ 4.2Å; T33-P241 HydrophobicContact CG2-CB 4.48Å; T33-P241 HydrophobicContact CG2-CG 3.81Å; T33-E481 PolarHBondContact N-OE1 2.85Å; T33-E481 PolarHBondContact OG1-OE1 3.08Å
34	T	32.9	Very low	29.4	Very low	26 Å²	26	75.9 Å²	75.9	16%	0.16	41%	0.414	C	S	.	.			trans	-143	135.7	165.3	-1.1	0	0	0	0	113.6	I446	T34-I446 HydrophobicContact CG2-CG1 4.23Å; T34-I446 HydrophobicContact CG2-CG2 3.92Å
35	A	29.5	Very low	29.1	Very low	18 Å²	18	77.7 Å²	77.7	15%	0.149	43%	0.428	C	S	.	.	S	Bend	trans	91.6	-27.8	163.9	0	0	0	0	0	121.2	N450	A35-N450 HydrophobicContact CB-CB 4.08Å
36	L	34.2	Very low	28.6	Very low	19 Å²	19	85.7 Å²	85.7	10%	0.099	47%	0.469	C	S	.	.	S	Bend	trans	-119.9	-22.5	-178	-99.5	97.5	0	0	0	118	F138 T243	L36-F138 HydrophobicContact CD2-CZ 4.24Å; L36-T243 WeakPolarHBondContact CD1-O 3.49Å
37	K	33.6	Very low	28	Very low	28 Å²	28	85.3 Å²	85.3	12%	0.122	48%	0.481	C	S	.	.	S	Bend	trans	-81.2	-28.5	-171.8	-82.4	-155.3	167.2	-174.8	0	116.6	P241 E382	K37-P241 HydrophobicContact CD-CB 3.25Å; K37-P241 HydrophobicContact CD-CG 4.41Å; K37-P241 VanDerWaalsContact CE-CA 3.46Å; K37-P241 HydrophobicContact CG-CB 4.02Å; K37-P241 VanDerWaalsContact NZ-CA 3.35Å; K37-E382 WeakPolarHBondContact CE-OE1 3.47Å; K37-E382 WeakPolarHBondContact CE-OE2 3.4Å; K37-E382 IonicContact NZ-OE2 2.85Å
38	F	33.7	Very low	27.9	Very low	83 Å²	83	86.2 Å²	86.2	36%	0.364	49%	0.493	S	S	.	.	S	Bend	trans	-102.9	15.1	-164.1	-66.4	-78.5	0	0	0	115.5	T33 L40 E377 D432	T33-F38 HydrophobicContact CG2-CE2 3.67Å; T33-F38 HydrophobicContact CG2-CZ 4.2Å; F38-L40 PolarHBondContact O-N 3.05Å; F38-L40 VanDerWaalsContact O-N 3.16Å; F38-E377 WeakPolarHBondContact CZ-OE2 3.24Å; F38-D432 HydrophobicContact CB-CB 4.09Å
39	R	35.3	Very low	27.7	Very low	60 Å²	60	86.3 Å²	86.3	23%	0.226	51%	0.505	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	14.1	173.7	-68.1	-168.7	-174.4	172.8	9	114.5	Y430 Y451	R39-Y430 PolarHBondContact NH2-O 2.79Å; R39-Y451 PolarHBondContact NH2-OH 2.87Å; R39-Y451 VanDerWaalsContact NH2-OH 3.09Å
40	L	30.5	Very low	27.4	Very low	67 Å²	67	93.9 Å²	93.9	35%	0.351	54%	0.536	S	S	.	.	T	Hydrogen-bonded Turn	trans	-113.9	12	-169	-72.2	160.7	0	0	0	115.9	F38 G336 N380	F38-L40 PolarHBondContact O-N 3.05Å; F38-L40 VanDerWaalsContact O-N 3.16Å; L40-G336 VanDerWaalsContact CD1-CA 3.43Å; L40-G336 VanDerWaalsContact CD2-CA 3.42Å; L40-N380 HydrophobicContact CD1-CB 4.19Å; L40-N380 WeakPolarHBondContact CD1-ND2 3.3Å
41	G	25.2	Very low	27.2	Very low	56 Å²	56	90.4 Å²	90.4	58%	0.577	54%	0.542	S	S	*	.			trans	-142.8	125.2	-179.8	0	0	0	0	0	114.1
42	G	24.7	Very low	26.9	Very low	78 Å²	78	97 Å²	97	80%	0.804	58%	0.577	S	S	*	*			trans	124.4	83.3	152.4	0	0	0	0	0	116.5
43	A	23.2	Very low	26.8	Very low	94 Å²	94	95.4 Å²	95.4	78%	0.777	58%	0.581	S	S	*	*			trans	-103.2	103.5	150.5	0	0	0	0	0	107.7
44	Q	24.5	Very low	27.2	Very low	194 Å²	194	99.7 Å²	99.7	91%	0.907	61%	0.61	S	S	*	*			trans	-120	113	164.3	-76	-173.2	-6.6	0	0	108.5
45	N	23.6	Very low	26.9	Very low	164 Å²	164	102.3 Å²	102.3	88%	0.877	64%	0.642	S	S	*	*			trans	-71	138	179	-80.4	-47.8	0	0	0	111.2
46	L	23.2	Very low	26.7	Very low	178 Å²	178	106.8 Å²	106.8	93%	0.932	68%	0.679	S	S	*	*			trans	-130.4	114.2	154.6	-97.2	153.4	0	0	0	108.7
47	A	21.3	Very low	26.4	Very low	86 Å²	86	109.2 Å²	109.2	71%	0.711	71%	0.709	S	S	*	*			trans	-85.6	142.4	171.3	0	0	0	0	0	109.9
48	T	22.7	Very low	26.5	Very low	150 Å²	150	113.4 Å²	113.4	92%	0.92	74%	0.739	S	S	*	*			trans	-162.8	145.7	139.9	24.2	0	0	0	0	110.7
49	S	22.6	Very low	26.1	Very low	101 Å²	101	118.6 Å²	118.6	71%	0.706	76%	0.764	S	S	*	*			trans	-80.5	152.7	-176	52.4	0	0	0	0	113.7
50	E	23.3	Very low	25.6	Very low	193 Å²	193	119.3 Å²	119.3	90%	0.902	79%	0.79	S	S	*	*				179.2	157.6	112.5	-97.8	-177	164.5	0	0	113.1
51	A	23.1	Very low	25.3	Very low	87 Å²	87	120.4 Å²	120.4	72%	0.719	82%	0.817	S	S	*	*			trans	-81	161.1	-163.6	0	0	0	0	0	115.1
52	L	23.2	Very low	25.3	Very low	175 Å²	175	121.9 Å²	121.9	92%	0.916	83%	0.833	S	S	*	*				177.7	141.5	123.8	-91.2	153	0	0	0	111.2
53	S	25.2	Very low	25.3	Very low	106 Å²	106	122.6 Å²	122.6	74%	0.741	83%	0.831	S	S	*	*			trans	-120.8	-173.9	171.6	-37.7	0	0	0	0	107.9
54	P	36.4	Very low	25.5	Very low	130 Å²	130	123.1 Å²	123.1	84%	0.844	83%	0.829	S	S	*	*			cis	-129	177.3	-37.7	26.3	-5.4	0	0	0	111.8
55	G	25.4	Very low	25.5	Very low	82 Å²	82	122.2 Å²	122.2	85%	0.845	83%	0.825	S	S	*	*			trans	-162.1	111.3	165.2	0	0	0	0	0	112.6
56	A	26.1	Very low	25.9	Very low	111 Å²	111	120.6 Å²	120.6	92%	0.917	82%	0.821	S	S	*	*			trans	-99.7	152.8	-179.4	0	0	0	0	0	112
57	G	27	Very low	26.3	Very low	70 Å²	70	118.9 Å²	118.9	72%	0.722	81%	0.808	S	S	*	*			trans	154.4	146.5	157.4	0	0	0	0	0	115.1
58	P	36	Very low	26.8	Very low	116 Å²	116	121.3 Å²	121.3	75%	0.753	81%	0.814	S	S	*	*			trans	-128.3	-167	-133	30	-7.4	0	0	0	115.5
59	E	26.5	Very low	27.1	Very low	193 Å²	193	117 Å²	117	90%	0.902	80%	0.799	S	S	*	*			trans	86.7	141.6	159.9	-49.3	-171.2	169.5	0	0	116.4
60	G	24.9	Very low	27.5	Very low	75 Å²	75	116.1 Å²	116.1	77%	0.773	79%	0.786	S	S	*	*			cis	-176.5	145	3.3	0	0	0	0	0	106.4
61	G	24.1	Very low	27.9	Very low	89 Å²	89	115.3 Å²	115.3	92%	0.918	78%	0.775	S	S	*	*				93.7	131.5	101.4	0	0	0	0	0	113.8
62	G	25.3	Very low	28.2	Very low	87 Å²	87	117 Å²	117	90%	0.897	78%	0.776	S	S	*	*			trans	136	105.2	158	0	0	0	0	0	116.7
63	A	24.6	Very low	28.7	Very low	93 Å²	93	114.2 Å²	114.2	77%	0.769	76%	0.76	S	S	*	*			trans	-91.9	163.4	-175.1	0	0	0	0	0	114.8
64	S	25.8	Very low	29	Very low	106 Å²	106	116.2 Å²	116.2	74%	0.741	75%	0.752	S	S	*	*			trans	101.7	144.4	131.3	82.9	0	0	0	0	120.6
65	Q	26.4	Very low	28.6	Very low	175 Å²	175	120.2 Å²	120.2	82%	0.818	75%	0.75	S	S	*	*			trans	90.4	68.8	157.6	-58.1	-170.5	7.3	0	0	119.5
66	V	30	Very low	28.8	Very low	130 Å²	130	126.5 Å²	126.5	79%	0.788	75%	0.748	S	S	*	*			trans	-138.2	57.3	146.3	-166.9	0	0	0	0	109.2
67	E	31.7	Very low	29	Very low	142 Å²	142	130.7 Å²	130.7	66%	0.664	74%	0.74	S	S	*	*			trans	-125.9	41.3	-166.5	-133.6	-160.8	169.6	0	0	115.1
68	V	33.3	Very low	29.2	Very low	137 Å²	137	130.9 Å²	130.9	83%	0.83	74%	0.735	S	S	*	*	S	Bend	trans	-137.3	-15.6	169.7	-162.9	0	0	0	0	114.3
69	G	28.3	Very low	28.8	Very low	60 Å²	60	134.8 Å²	134.8	62%	0.619	74%	0.74	S	S	*	*	S	Bend	trans	-86	-17.1	175.4	0	0	0	0	0	116.1	R71	G69-R71 PolarHBondContact O-N 3.11Å
70	L	30.7	Very low	28.9	Very low	81 Å²	81	133.9 Å²	133.9	42%	0.424	74%	0.738	S	S	.	*	H	α-helix	trans	-79.3	-14.3	-172.3	-100.8	91.5	0	0	0	115.4	V72 R74	L70-V72 PolarHBondContact O-N 3.08Å; L70-R74 WeakPolarHBondContact O-CB 3.47Å; L70-R74 VanDerWaalsContact O-CG 3.23Å; L70-R74 WeakPolarHBondContact O-CG 3.46Å; L70-R74 PolarHBondContact O-N 3.37Å; L70-R74 VanDerWaalsContact O-N 3.16Å
71	R	31.2	Very low	29.2	Very low	177 Å²	177	133.9 Å²	133.9	67%	0.668	73%	0.731	S	S	*	*	H	α-helix	trans	-76.7	-23.7	-171.3	-73.5	-177	-176.6	-179.9	1.9	114	G69	G69-R71 PolarHBondContact O-N 3.11Å
72	V	29.8	Very low	29.7	Very low	123 Å²	123	133.6 Å²	133.6	75%	0.745	72%	0.72	S	S	*	*	H	α-helix	trans	-87.8	-30.6	-179.8	-177.4	0	0	0	0	111.9	L70	L70-V72 PolarHBondContact O-N 3.08Å
73	I	33.7	Very low	30.4	Very low	115 Å²	115	134.3 Å²	134.3	59%	0.59	71%	0.711	S	S	*	*	H	α-helix	trans	-76.1	-32.6	173.2	-62.8	168.1	0	0	0	111.3	R75 R76 R77	I73-R75 VanDerWaalsContact C-N 3.32Å; I73-R75 PolarHBondContact O-N 3.02Å; I73-R76 PolarHBondContact O-N 2.9Å; I73-R77 PolarHBondContact O-N 3.33Å
74	R	31.6	Very low	31.7	Very low	148 Å²	148	135.9 Å²	135.9	56%	0.558	71%	0.711	S	S	*	*	H	α-helix	trans	-62	-32.4	175.2	-82.7	176.6	175.7	174.4	1.5	113.6	L70 A78	L70-R74 WeakPolarHBondContact O-CB 3.47Å; L70-R74 VanDerWaalsContact O-CG 3.23Å; L70-R74 WeakPolarHBondContact O-CG 3.46Å; L70-R74 PolarHBondContact O-N 3.37Å; L70-R74 VanDerWaalsContact O-N 3.16Å; R74-A78 WeakPolarHBondContact O-CB 3.4Å; R74-A78 PolarHBondContact O-N 3.35Å
75	R	28.4	Very low	33.6	Very low	214 Å²	214	131.9 Å²	131.9	81%	0.808	68%	0.683	S	S	*	*	H	α-helix	trans	-75.2	-22.9	176.9	-78.5	-175.4	174.4	-178.4	-1.2	114	I73	I73-R75 VanDerWaalsContact C-N 3.32Å; I73-R75 PolarHBondContact O-N 3.02Å
76	R	28.6	Very low	36.2	Very low	214 Å²	214	126 Å²	126	81%	0.808	66%	0.658	S	S	*	*	H	α-helix	trans	-85.9	-34	171.5	-83.4	-176.2	170	-176.9	-3	112.6	I73 A78 K79	I73-R76 PolarHBondContact O-N 2.9Å; R76-A78 VanDerWaalsContact C-N 3.3Å; R76-A78 PolarHBondContact O-N 3.27Å; R76-K79 PolarHBondContact O-N 3.17Å
77	R	32.2	Very low	38.8	Very low	199 Å²	199	120.8 Å²	120.8	75%	0.751	63%	0.626	S	S	*	*	H	α-helix	trans	-65.1	-30.6	168.8	-89	-174.3	169.7	-176.2	-2.6	113.1	I73 K79 M80 A81	I73-R77 PolarHBondContact O-N 3.33Å; R77-K79 PolarHBondContact O-N 3.32Å; R77-M80 PolarHBondContact O-N 2.71Å; R77-A81 PolarHBondContact O-N 3.44Å
78	A	30	Very low	41.5	Very low	74 Å²	74	115.3 Å²	115.3	61%	0.612	60%	0.6	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.4	-12.2	175.5	0	0	0	0	0	114.9	R74 R76	R74-A78 WeakPolarHBondContact O-CB 3.4Å; R74-A78 PolarHBondContact O-N 3.35Å; R76-A78 VanDerWaalsContact C-N 3.3Å; R76-A78 PolarHBondContact O-N 3.27Å
79	K	27	Very low	44.1	Very low	198 Å²	198	111.2 Å²	111.2	86%	0.861	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.9	1.9	173	-87.2	-173.6	173.1	-174.8	0	114	R76 R77	R76-K79 PolarHBondContact O-N 3.17Å; R77-K79 PolarHBondContact O-N 3.32Å
80	M	29.4	Very low	47.1	Very low	174 Å²	174	109.7 Å²	109.7	86%	0.857	55%	0.554	S	S	*	*	S	Bend	trans	-112.6	12.7	171.4	-82.3	-97.2	-142.6	0	0	111.8	R77 A82	R77-M80 PolarHBondContact O-N 2.71Å; M80-A82 VanDerWaalsContact C-N 3.26Å; M80-A82 PolarHBondContact O-N 3.3Å
81	A	32.2	Very low	50	Low	75 Å²	75	106.6 Å²	106.6	62%	0.62	54%	0.538	S	S	*	.			trans	-83.8	78.8	160.8	0	0	0	0	0	107.1	R77 S83	R77-A81 PolarHBondContact O-N 3.44Å; A81-S83 PolarHBondContact O-N 3.28Å; A81-S83 VanDerWaalsContact O-N 3.1Å
82	A	34.3	Very low	52.6	Low	84 Å²	84	100.4 Å²	100.4	69%	0.694	52%	0.52	S	S	*	.			trans	-50.5	119.7	154.1	0	0	0	0	0	105.6	M80 T84	M80-A82 VanDerWaalsContact C-N 3.26Å; M80-A82 PolarHBondContact O-N 3.3Å; A82-T84 VanDerWaalsContact C-N 3.34Å; A82-T84 PolarHBondContact O-N 3.04Å
83	S	39.9	Very low	54.7	Low	101 Å²	101	97.7 Å²	97.7	71%	0.706	52%	0.517	S	S	*	.			trans	-40.6	95.8	-179.1	169.5	0	0	0	0	110.4	A81 C85	A81-S83 PolarHBondContact O-N 3.28Å; A81-S83 VanDerWaalsContact O-N 3.1Å; S83-C85 PolarHBondContact O-N 3.45Å; S83-C85 VanDerWaalsContact O-N 3.1Å
84	T	52.5	Low	55.6	Low	127 Å²	127	98 Å²	98	78%	0.779	52%	0.524	S	S	*	.			trans	-64.6	116.3	-178.8	44.3	0	0	0	0	106.2	A82 D86	A82-T84 VanDerWaalsContact C-N 3.34Å; A82-T84 PolarHBondContact O-N 3.04Å; T84-D86 PolarHBondContact O-N 3.16Å
85	C	64.7	Low	56.6	Low	22 Å²	22	92.7 Å²	92.7	15%	0.149	51%	0.512	C	S	.	.			trans	-60.7	128.2	176.7	-145.8	0	0	0	0	107.3	S83 V87 L268 Q271	S83-C85 PolarHBondContact O-N 3.45Å; S83-C85 VanDerWaalsContact O-N 3.1Å; C85-V87 PolarHBondContact O-N 2.91Å; C85-L268 HydrophobicContact CB-CD2 3.88Å; C85-L268 HydrophobicContact CB-CG 4.31Å; C85-L268 WeakPolarHBondContact SG-CD2 3.32Å; C85-L268 VanDerWaalsContact SG-CG 3.57Å; C85-Q271 PolarHBondContact O-NE2 3.31Å
86	D	81.8	Confident	58	Low	52 Å²	52	84.1 Å²	84.1	28%	0.278	49%	0.49	S	S	.	.			trans	-64.4	105.8	-171.1	167.7	39.8	0	0	0	110.3	T84 F88 S89 R99	T84-D86 PolarHBondContact O-N 3.16Å; D86-F88 PolarHBondContact O-N 3.26Å; D86-F88 WeakPolarHBondContact OD1-CB 3.38Å; D86-F88 WeakPolarHBondContact OD1-CD2 3.35Å; D86-F88 PolarHBondContact OD1-N 3.44Å; D86-S89 WeakPolarHBondContact CB-OG 3.42Å; D86-S89 VanDerWaalsContact O-CB 3.24Å; D86-S89 WeakPolarHBondContact O-CB 3.47Å; D86-S89 PolarHBondContact O-N 2.9Å; D86-S89 PolarHBondContact O-OG 3.49Å; D86-S89 PolarHBondContact OD2-N 3.03Å; D86-S89 PolarHBondContact OD2-OG 3.02Å; D86-R99 IonicContact OD1-CZ 3.17Å; D86-R99 IonicContact OD1-NE 2.69Å; D86-R99 IonicContact OD1-NH2 3.95Å; D86-R99 PolarHBondContact OD1-NH2 3.49Å; D86-R99 IonicContact OD2-CZ 3.96Å; D86-R99 IonicContact OD2-NH2 3.33Å; D86-R99 PolarHBondContact OD2-NH2 2.86Å
87	V	84	Confident	59.9	Low	20 Å²	20	81.1 Å²	81.1	12%	0.121	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.4	-19.3	-180	-63.8	0	0	0	0	112.9	C85 V104 Q271 V388 L389	C85-V87 PolarHBondContact O-N 2.91Å; V87-V104 HydrophobicContact CG2-CG2 3.97Å; V87-Q271 VanDerWaalsContact CG1-OE1 3.29Å; V87-V388 HydrophobicContact CB-CG1 3.99Å; V87-V388 HydrophobicContact CG1-CG1 3.92Å; V87-L389 HydrophobicContact CB-CD1 4.36Å; V87-L389 HydrophobicContact CG2-CD1 4.02Å
88	F	89	Confident	61.9	Low	26 Å²	26	72 Å²	72	11%	0.114	45%	0.446	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-1.9	177.6	-59.2	-84.6	0	0	0	113.6	D86 F90 C91 A98 R99 V102 L389	D86-F88 PolarHBondContact O-N 3.26Å; D86-F88 WeakPolarHBondContact OD1-CB 3.38Å; D86-F88 WeakPolarHBondContact OD1-CD2 3.35Å; D86-F88 PolarHBondContact OD1-N 3.44Å; F88-F90 PolarHBondContact O-N 3.37Å; F88-C91 WeakPolarHBondContact O-CB 3.44Å; F88-C91 PolarHBondContact O-N 3.43Å; F88-C91 VanDerWaalsContact O-N 3.08Å; F88-A98 HydrophobicContact CD1-CB 4.23Å; F88-A98 HydrophobicContact CE1-CB 4.47Å; F88-R99 HydrophobicContact CB-CG 3.96Å; F88-R99 HydrophobicContact CD1-CG 3.75Å; F88-R99 HydrophobicContact CD2-CG 3.77Å; F88-R99 HydrophobicContact CE1-CG 4.14Å; F88-R99 HydrophobicContact CE2-CG 4.17Å; F88-R99 HydrophobicContact CG-CG 3.54Å; F88-R99 HydrophobicContact CZ-CG 4.33Å; F88-V102 HydrophobicContact CE1-CG2 3.88Å; F88-V102 HydrophobicContact CZ-CG2 4.38Å; F88-L389 HydrophobicContact CD1-CD1 4.32Å; F88-L389 HydrophobicContact CD1-CD2 3.73Å; F88-L389 HydrophobicContact CE1-CD1 3.95Å; F88-L389 HydrophobicContact CE1-CD2 3.77Å; F88-L389 HydrophobicContact CZ-CD1 4.26Å
89	S	87.6	Confident	64.2	Low	52 Å²	52	74.6 Å²	74.6	36%	0.364	44%	0.44	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-22.5	-174.6	-64.2	0	0	0	0	113.8	D86	D86-S89 WeakPolarHBondContact CB-OG 3.42Å; D86-S89 VanDerWaalsContact O-CB 3.24Å; D86-S89 WeakPolarHBondContact O-CB 3.47Å; D86-S89 PolarHBondContact O-N 2.9Å; D86-S89 PolarHBondContact O-OG 3.49Å; D86-S89 PolarHBondContact OD2-N 3.03Å; D86-S89 PolarHBondContact OD2-OG 3.02Å
90	F	91.1	Very high	66.8	Low	28 Å²	28	69.5 Å²	69.5	12%	0.123	43%	0.425	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.9	0.5	-176.3	-66.9	-91.5	0	0	0	113.2	F88 E130 R131 L133 W265 L268 V388	F88-F90 PolarHBondContact O-N 3.37Å; F90-E130 HydrophobicContact CB-CG 4.06Å; F90-R131 WeakPolarHBondContact CB-O 3.34Å; F90-R131 PolarHBondContact O-N 2.98Å; F90-L133 HydrophobicContact CD2-CD1 4.45Å; F90-L133 HydrophobicContact CE1-CD1 3.68Å; F90-L133 HydrophobicContact CE2-CD1 3.6Å; F90-L133 HydrophobicContact CZ-CD1 3.15Å; F90-W265 HydrophobicContact CZ-CH2 4.48Å; F90-W265 HydrophobicContact CZ-CZ3 4.38Å; F90-L268 HydrophobicContact CE2-CD1 3.87Å; F90-L268 HydrophobicContact CE2-CD2 4.02Å; F90-L268 HydrophobicContact CZ-CD1 4Å; F90-V388 HydrophobicContact CD2-CG2 4.27Å
91	C	91.3	Very high	69.6	Low	15 Å²	15	61.3 Å²	61.3	10%	0.101	39%	0.385	C	S	.	.	B	Isolated β-bridge	trans	-66.7	135.6	172.7	-69.5	0	0	0	0	111.2	F88 V129 L389	F88-C91 WeakPolarHBondContact O-CB 3.44Å; F88-C91 PolarHBondContact O-N 3.43Å; F88-C91 VanDerWaalsContact O-N 3.08Å; C91-V129 CarbonylContact C-O 3.57Å; C91-V129 WeakPolarHBondContact CA-O 3.48Å; C91-L389 VanDerWaalsContact SG-CD2 3.52Å
92	V	85.1	Confident	72.6	Confident	47 Å²	47	57.9 Å²	57.9	29%	0.285	36%	0.356	S	S	.	.			trans	-89.1	144.8	177.5	-174.6	0	0	0	0	110.6	V129 R131 L411	V92-V129 HydrophobicContact CB-CB 4.19Å; V92-V129 HydrophobicContact CB-CG1 4.02Å; V92-V129 HydrophobicContact CG2-CG1 4.17Å; V92-V129 PolarHBondContact N-O 2.86Å; V92-R131 HydrophobicContact CG2-CG 3.65Å; V92-L411 HydrophobicContact CG2-CD2 3.96Å
93	G	73.9	Confident	75.5	Confident	66 Å²	66	57.6 Å²	57.6	68%	0.68	34%	0.341	S	S	*	.	S	Bend	trans	90.5	-158.3	-178.7	0	0	0	0	0	112.2	A95	G93-A95 VanDerWaalsContact C-N 3.35Å; G93-A95 PolarHBondContact O-N 3.04Å
94	V	52.5	Low	78.1	Confident	123 Å²	123	55 Å²	55	75%	0.745	32%	0.32	S	S	*	.			trans	-70.7	95.8	176.3	-171.8	0	0	0	0	107.1	G96 R97	V94-G96 PolarHBondContact O-N 2.9Å; V94-R97 PolarHBondContact O-N 2.62Å
95	A	53.6	Low	80.1	Confident	35 Å²	35	53 Å²	53	29%	0.289	30%	0.298	S	S	.	.	H	α-helix	trans	-48.1	-22.6	177	0	0	0	0	0	113.1	G93 R97 R99	G93-A95 VanDerWaalsContact C-N 3.35Å; G93-A95 PolarHBondContact O-N 3.04Å; A95-R97 VanDerWaalsContact C-N 3.34Å; A95-R97 PolarHBondContact O-N 2.89Å; A95-R99 WeakPolarHBondContact O-CB 3.26Å; A95-R99 VanDerWaalsContact O-CG 3.25Å; A95-R99 WeakPolarHBondContact O-CG 3.45Å; A95-R99 PolarHBondContact O-N 3.19Å; A95-R99 VanDerWaalsContact O-N 3.11Å
96	G	57.9	Low	81.4	Confident	34 Å²	34	59.1 Å²	59.1	35%	0.351	32%	0.323	S	S	.	.	H	α-helix	trans	-56.4	-35.4	168.8	0	0	0	0	0	115	V94 V100	V94-G96 PolarHBondContact O-N 2.9Å; G96-V100 VanDerWaalsContact O-CB 3.31Å; G96-V100 WeakPolarHBondContact O-CB 3.44Å; G96-V100 WeakPolarHBondContact O-CG2 3.49Å; G96-V100 PolarHBondContact O-N 2.82Å
97	R	68.8	Low	81.8	Confident	151 Å²	151	59.1 Å²	59.1	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-68.4	-49.2	-179.7	-169.8	179.1	-179.7	-178.9	-1	111.5	V94 A95 R99 V100 S101 E125	V94-R97 PolarHBondContact O-N 2.62Å; A95-R97 VanDerWaalsContact C-N 3.34Å; A95-R97 PolarHBondContact O-N 2.89Å; R97-R99 VanDerWaalsContact C-N 3.35Å; R97-R99 PolarHBondContact O-N 3.23Å; R97-V100 PolarHBondContact O-N 3.38Å; R97-S101 WeakPolarHBondContact O-CB 3.42Å; R97-S101 PolarHBondContact O-N 3.4Å; R97-S101 PolarHBondContact O-OG 2.99Å; R97-E125 IonicContact CZ-OE1 3.09Å; R97-E125 IonicContact NE-OE1 2.73Å; R97-E125 IonicContact NH2-OE1 2.64Å; R97-E125 PolarHBondContact NH2-OE1 3.25Å
98	A	73.6	Confident	82	Confident	7 Å²	7	60 Å²	60	6%	0.058	33%	0.332	C	S	.	.	H	α-helix	trans	-59.8	-46.1	175.1	0	0	0	0	0	111	F88 V100 S101 V102 F128	F88-A98 HydrophobicContact CD1-CB 4.23Å; F88-A98 HydrophobicContact CE1-CB 4.47Å; A98-V100 PolarHBondContact O-N 3.43Å; A98-S101 PolarHBondContact O-N 3.38Å; A98-S101 VanDerWaalsContact O-N 3.08Å; A98-V102 WeakPolarHBondContact O-CG2 3.48Å; A98-V102 PolarHBondContact O-N 3.08Å; A98-F128 HydrophobicContact CB-CB 3.88Å
99	R	78.2	Confident	81.6	Confident	130 Å²	130	64.6 Å²	64.6	49%	0.491	37%	0.367	S	S	.	.	H	α-helix	trans	-63.8	-21.8	177.8	-73.6	176.4	172.9	-155	8.4	114.8	D86 F88 A95 R97	D86-R99 IonicContact OD1-CZ 3.17Å; D86-R99 IonicContact OD1-NE 2.69Å; D86-R99 IonicContact OD1-NH2 3.95Å; D86-R99 PolarHBondContact OD1-NH2 3.49Å; D86-R99 IonicContact OD2-CZ 3.96Å; D86-R99 IonicContact OD2-NH2 3.33Å; D86-R99 PolarHBondContact OD2-NH2 2.86Å; F88-R99 HydrophobicContact CB-CG 3.96Å; F88-R99 HydrophobicContact CD1-CG 3.75Å; F88-R99 HydrophobicContact CD2-CG 3.77Å; F88-R99 HydrophobicContact CE1-CG 4.14Å; F88-R99 HydrophobicContact CE2-CG 4.17Å; F88-R99 HydrophobicContact CG-CG 3.54Å; F88-R99 HydrophobicContact CZ-CG 4.33Å; A95-R99 WeakPolarHBondContact O-CB 3.26Å; A95-R99 VanDerWaalsContact O-CG 3.25Å; A95-R99 WeakPolarHBondContact O-CG 3.45Å; A95-R99 PolarHBondContact O-N 3.19Å; A95-R99 VanDerWaalsContact O-N 3.11Å; R97-R99 VanDerWaalsContact C-N 3.35Å; R97-R99 PolarHBondContact O-N 3.23Å
100	V	81.6	Confident	81.2	Confident	90 Å²	90	66.5 Å²	66.5	55%	0.545	39%	0.386	S	S	.	.	H	α-helix	trans	-88.4	-29.3	175.3	170.5	0	0	0	0	111	G96 R97 A98 T118	G96-V100 VanDerWaalsContact O-CB 3.31Å; G96-V100 WeakPolarHBondContact O-CB 3.44Å; G96-V100 WeakPolarHBondContact O-CG2 3.49Å; G96-V100 PolarHBondContact O-N 2.82Å; R97-V100 PolarHBondContact O-N 3.38Å; A98-V100 PolarHBondContact O-N 3.43Å; V100-T118 PolarHBondContact O-OG1 3.34Å
101	S	88.2	Confident	80.8	Confident	3 Å²	3	69.8 Å²	69.8	2%	0.021	40%	0.4	C	S	.	.	H	α-helix	trans	-88.3	-29.4	-176.8	-64.6	0	0	0	0	114.9	R97 A98 A117 T118 Q119	R97-S101 WeakPolarHBondContact O-CB 3.42Å; R97-S101 PolarHBondContact O-N 3.4Å; R97-S101 PolarHBondContact O-OG 2.99Å; A98-S101 PolarHBondContact O-N 3.38Å; A98-S101 VanDerWaalsContact O-N 3.08Å; S101-A117 WeakPolarHBondContact O-CA 3.35Å; S101-T118 WeakPolarHBondContact CA-OG1 3.46Å; S101-T118 PolarHBondContact O-N 3.45Å; S101-T118 PolarHBondContact O-OG1 3.15Å; S101-Q119 PolarHBondContact OG-NE2 2.64Å
102	V	94.8	Very high	80.7	Confident	2 Å²	2	70.3 Å²	70.3	1%	0.012	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	155.1	-174.7	-55.2	0	0	0	0	113.1	F88 A98 L115 F116 T118 I121 I127 I426	F88-V102 HydrophobicContact CE1-CG2 3.88Å; F88-V102 HydrophobicContact CZ-CG2 4.38Å; A98-V102 WeakPolarHBondContact O-CG2 3.48Å; A98-V102 PolarHBondContact O-N 3.08Å; V102-L115 HydrophobicContact CB-CD1 3.98Å; V102-L115 HydrophobicContact CB-CD2 4.37Å; V102-L115 HydrophobicContact CB-CG 4.1Å; V102-L115 HydrophobicContact CG1-CD2 4.42Å; V102-L115 HydrophobicContact CG2-CD1 3.82Å; V102-L115 HydrophobicContact CG2-CD2 4.3Å; V102-L115 HydrophobicContact CG2-CG 4.31Å; V102-F116 CarbonylContact C-O 3.59Å; V102-F116 WeakPolarHBondContact CA-O 3.38Å; V102-T118 PolarHBondContact N-OG1 3.01Å; V102-I121 HydrophobicContact CG1-CD1 4.18Å; V102-I127 HydrophobicContact CG1-CG2 3.47Å; V102-I127 VanDerWaalsContact CG1-CG2 3.47Å; V102-I426 HydrophobicContact CB-CD1 4.31Å; V102-I426 HydrophobicContact CG1-CD1 3.35Å
103	E	95.1	Very high	81	Confident	79 Å²	79	71.6 Å²	71.6	37%	0.369	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.9	149.8	170.8	69	-179.7	170.7	0	0	111.9	R105 F116 T118	E103-R105 HydrophobicContact CG-CG 4.13Å; E103-R105 IonicContact OE1-CZ 2.93Å; E103-R105 IonicContact OE1-NE 2.67Å; E103-R105 PolarHBondContact OE1-NE 3.49Å; E103-R105 IonicContact OE1-NH2 3.16Å; E103-R105 PolarHBondContact OE1-NH2 2.96Å; E103-F116 HydrophobicContact CG-CB 4.43Å; E103-F116 PolarHBondContact N-O 2.89Å; E103-F116 PolarHBondContact O-N 3.42Å; E103-T118 HydrophobicContact CB-CG2 3.83Å; E103-T118 HydrophobicContact CG-CG2 3.6Å
104	V	94.6	Very high	82	Confident	46 Å²	46	68.5 Å²	68.5	28%	0.279	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	126.3	174.3	179.3	0	0	0	0	109.2	V87 K113 G114 L115 L389 C392	V87-V104 HydrophobicContact CG2-CG2 3.97Å; V104-K113 HydrophobicContact CG1-CB 4.06Å; V104-K113 HydrophobicContact CG1-CD 4.27Å; V104-K113 HydrophobicContact CG1-CG 4.31Å; V104-G114 WeakPolarHBondContact CA-O 3.47Å; V104-L115 HydrophobicContact CG2-CD1 3.74Å; V104-L389 HydrophobicContact CG2-CD1 3.78Å; V104-C392 HydrophobicContact CG1-CB 4.31Å; V104-C392 HydrophobicContact CG2-CB 4.16Å
105	R	94.2	Very high	84.2	Confident	84 Å²	84	62.6 Å²	62.6	32%	0.317	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	151.6	175.8	-53.8	-179.4	-173.5	149.1	1.5	110.1	E103 K113 G114 F116	E103-R105 HydrophobicContact CG-CG 4.13Å; E103-R105 IonicContact OE1-CZ 2.93Å; E103-R105 IonicContact OE1-NE 2.67Å; E103-R105 PolarHBondContact OE1-NE 3.49Å; E103-R105 IonicContact OE1-NH2 3.16Å; E103-R105 PolarHBondContact OE1-NH2 2.96Å; R105-K113 CarbonylContact O-C 3.49Å; R105-K113 WeakPolarHBondContact O-CA 3.39Å; R105-G114 PolarHBondContact N-O 2.88Å; R105-G114 PolarHBondContact O-N 3.24Å; R105-F116 HydrophobicContact CB-CD2 3.72Å; R105-F116 HydrophobicContact CB-CE2 3.74Å; R105-F116 HydrophobicContact CG-CD2 3.64Å; R105-F116 HydrophobicContact CG-CE2 4.15Å; R105-F116 HydrophobicContact CG-CG 4.25Å
106	F	92.8	Very high	86.3	Confident	151 Å²	151	62.1 Å²	62.1	66%	0.662	33%	0.333	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.4	123.5	165.3	-179.6	-100	0	0	0	108.7	S108	F106-S108 WeakPolarHBondContact CE2-O 3.43Å; F106-S108 VanDerWaalsContact CZ-O 3.24Å; F106-S108 WeakPolarHBondContact CZ-O 3.45Å
107	V	90	Very high	88.1	Confident	52 Å²	52	60.5 Å²	60.5	32%	0.315	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	-57	-175.9	-177.5	0	0	0	0	110.4	K111 G112 F116	V107-K111 HydrophobicContact CB-CB 4.09Å; V107-K111 HydrophobicContact CG1-CB 4.06Å; V107-K111 HydrophobicContact CG1-CD 3.83Å; V107-G112 PolarHBondContact N-O 3.16Å; V107-F116 HydrophobicContact CG2-CE2 3.79Å; V107-F116 HydrophobicContact CG2-CZ 3.85Å
108	S	87.6	Confident	89.5	Confident	40 Å²	40	55.8 Å²	55.8	28%	0.28	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-165.2	172.1	176.9	70.6	0	0	0	0	110.6	F106 A110 K111 G112	F106-S108 WeakPolarHBondContact CE2-O 3.43Å; F106-S108 VanDerWaalsContact CZ-O 3.24Å; F106-S108 WeakPolarHBondContact CZ-O 3.45Å; S108-A110 PolarHBondContact O-N 3.2Å; S108-A110 PolarHBondContact OG-N 2.96Å; S108-K111 PolarHBondContact OG-N 3.27Å; S108-G112 VanDerWaalsContact O-CA 3.27Å; S108-G112 WeakPolarHBondContact O-CA 3.44Å; S108-G112 PolarHBondContact O-N 2.9Å
109	S	80.8	Confident	90.5	Very high	122 Å²	122	59.1 Å²	59.1	85%	0.853	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-27.7	171.3	52.5	0	0	0	0	112.9
110	A	79.2	Confident	91.4	Very high	91 Å²	91	56.8 Å²	56.8	75%	0.752	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.4	-37.4	-179.9	0	0	0	0	0	113.1	S108	S108-A110 PolarHBondContact O-N 3.2Å; S108-A110 PolarHBondContact OG-N 2.96Å
111	K	82.5	Confident	92.1	Very high	98 Å²	98	52.5 Å²	52.5	43%	0.426	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.8	-19.3	179.5	-73.5	-169.4	170.4	-168	0	113.6	V107 S108	V107-K111 HydrophobicContact CB-CB 4.09Å; V107-K111 HydrophobicContact CG1-CB 4.06Å; V107-K111 HydrophobicContact CG1-CD 3.83Å; S108-K111 PolarHBondContact OG-N 3.27Å
112	G	88.9	Confident	92.5	Very high	25 Å²	25	60.2 Å²	60.2	26%	0.258	32%	0.318	S	S	.	.	E	Extended strand (participates in β ladder)	trans	69.1	-129.2	-174.9	0	0	0	0	0	112.6	V107 S108	V107-G112 PolarHBondContact N-O 3.16Å; S108-G112 VanDerWaalsContact O-CA 3.27Å; S108-G112 WeakPolarHBondContact O-CA 3.44Å; S108-G112 PolarHBondContact O-N 2.9Å
113	K	92.6	Very high	92.7	Very high	75 Å²	75	67.3 Å²	67.3	33%	0.326	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.7	156	178.9	-62.5	171.4	-172.5	164.6	0	109.9	V104 R105 Q271 C392 N394	V104-K113 HydrophobicContact CG1-CB 4.06Å; V104-K113 HydrophobicContact CG1-CD 4.27Å; V104-K113 HydrophobicContact CG1-CG 4.31Å; R105-K113 CarbonylContact O-C 3.49Å; R105-K113 WeakPolarHBondContact O-CA 3.39Å; K113-Q271 PolarHBondContact NZ-O 2.69Å; K113-Q271 VanDerWaalsContact NZ-O 3.11Å; K113-C392 HydrophobicContact CB-CB 4.48Å; K113-N394 PolarHBondContact O-ND2 3.4Å; K113-N394 PolarHBondContact O-OD1 3.13Å
114	G	95.1	Very high	92.7	Very high	0 Å²	0	66.1 Å²	66.1	0%	0	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.5	149.3	170.9	0	0	0	0	0	109.9	V104 R105 F116 C392	V104-G114 WeakPolarHBondContact CA-O 3.47Å; R105-G114 PolarHBondContact N-O 2.88Å; R105-G114 PolarHBondContact O-N 3.24Å; G114-F116 WeakPolarHBondContact O-CD2 3.47Å; G114-C392 CarbonylContact C-O 3.58Å; G114-C392 VanDerWaalsContact CA-O 3.25Å; G114-C392 WeakPolarHBondContact CA-O 3.24Å
115	L	97.1	Very high	92.7	Very high	0 Å²	0	66 Å²	66	0%	0	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.1	132.5	174.3	-167.6	71.7	0	0	0	109.4	V102 V104 F128 L389 C392 C393 E425 I426	V102-L115 HydrophobicContact CB-CD1 3.98Å; V102-L115 HydrophobicContact CB-CD2 4.37Å; V102-L115 HydrophobicContact CB-CG 4.1Å; V102-L115 HydrophobicContact CG1-CD2 4.42Å; V102-L115 HydrophobicContact CG2-CD1 3.82Å; V102-L115 HydrophobicContact CG2-CD2 4.3Å; V102-L115 HydrophobicContact CG2-CG 4.31Å; V104-L115 HydrophobicContact CG2-CD1 3.74Å; L115-F128 HydrophobicContact CD2-CD1 4.41Å; L115-F128 HydrophobicContact CD2-CE1 3.56Å; L115-F128 HydrophobicContact CD2-CZ 4.31Å; L115-L389 HydrophobicContact CD1-CD1 3.71Å; L115-L389 HydrophobicContact CD1-CG 4.39Å; L115-C392 PolarHBondContact N-O 3.46Å; L115-C393 VanDerWaalsContact CD2-SG 3.56Å; L115-E425 CarbonylContact O-C 3.32Å; L115-E425 WeakPolarHBondContact O-CA 3.27Å; L115-I426 HydrophobicContact CB-CB 4.4Å; L115-I426 HydrophobicContact CD2-CB 4.34Å; L115-I426 HydrophobicContact CD2-CD1 4.07Å; L115-I426 HydrophobicContact CD2-CG2 4.43Å; L115-I426 HydrophobicContact CG-CD1 4.23Å; L115-I426 PolarHBondContact O-N 3.39Å
116	F	97.8	Very high	92.7	Very high	24 Å²	24	64.7 Å²	64.7	11%	0.105	36%	0.356	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	141.4	-175.8	-68.6	-96.8	0	0	0	111	V102 E103 R105 V107 G114 G423 E424 E425	V102-F116 CarbonylContact C-O 3.59Å; V102-F116 WeakPolarHBondContact CA-O 3.38Å; E103-F116 HydrophobicContact CG-CB 4.43Å; E103-F116 PolarHBondContact N-O 2.89Å; E103-F116 PolarHBondContact O-N 3.42Å; R105-F116 HydrophobicContact CB-CD2 3.72Å; R105-F116 HydrophobicContact CB-CE2 3.74Å; R105-F116 HydrophobicContact CG-CD2 3.64Å; R105-F116 HydrophobicContact CG-CE2 4.15Å; R105-F116 HydrophobicContact CG-CG 4.25Å; V107-F116 HydrophobicContact CG2-CE2 3.79Å; V107-F116 HydrophobicContact CG2-CZ 3.85Å; G114-F116 WeakPolarHBondContact O-CD2 3.47Å; F116-G423 WeakPolarHBondContact CD1-O 3.46Å; F116-E424 VanDerWaalsContact CA-O 3.32Å; F116-E424 WeakPolarHBondContact CA-O 3.2Å; F116-E425 HydrophobicContact CD1-CB 3.95Å; F116-E425 HydrophobicContact CD1-CG 4.41Å; F116-E425 HydrophobicContact CE1-CB 3.57Å; F116-E425 HydrophobicContact CE1-CG 3.94Å; F116-E425 HydrophobicContact CE2-CG 4.27Å; F116-E425 HydrophobicContact CZ-CB 4Å; F116-E425 HydrophobicContact CZ-CG 3.84Å
117	A	97.6	Very high	92.8	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	136.5	172.8	0	0	0	0	0	110.6	S101 I121 I420 G423 E424 I426	S101-A117 WeakPolarHBondContact O-CA 3.35Å; A117-I121 HydrophobicContact CB-CD1 4.07Å; A117-I420 HydrophobicContact CB-CG2 3.79Å; A117-G423 PolarHBondContact O-N 3.43Å; A117-E424 PolarHBondContact N-O 3.38Å; A117-I426 HydrophobicContact CB-CD1 4.38Å
118	T	96.5	Very high	93	Very high	53 Å²	53	55.6 Å²	55.6	33%	0.325	31%	0.312	S	S	.	.	S	Bend	trans	-102.7	-12.8	174.6	47	0	0	0	0	112.5	V100 S101 V102 E103	V100-T118 PolarHBondContact O-OG1 3.34Å; S101-T118 WeakPolarHBondContact CA-OG1 3.46Å; S101-T118 PolarHBondContact O-N 3.45Å; S101-T118 PolarHBondContact O-OG1 3.15Å; V102-T118 PolarHBondContact N-OG1 3.01Å; E103-T118 HydrophobicContact CB-CG2 3.83Å; E103-T118 HydrophobicContact CG-CG2 3.6Å
119	Q	95.4	Very high	93.4	Very high	76 Å²	76	54.9 Å²	54.9	36%	0.355	31%	0.306	S	S	.	.	S	Bend	trans	-142.3	173.7	174	66.4	-171.5	-13.6	0	0	110	S101 I121	S101-Q119 PolarHBondContact OG-NE2 2.64Å; Q119-I121 PolarHBondContact O-N 2.89Å
120	L	96.8	Very high	94.1	Very high	81 Å²	81	49 Å²	49	42%	0.424	27%	0.265	S	S	.	.			trans	-66	127.7	172.6	176.5	71	0	0	0	109.5	D419 I420	L120-D419 HydrophobicContact CD1-CB 4.4Å; L120-I420 WeakPolarHBondContact CA-O 3.34Å
121	I	96.7	Very high	94.9	Very high	1 Å²	1	50.5 Å²	50.5	1%	0.005	25%	0.251	C	S	.	.	B	Isolated β-bridge	trans	-112.7	127.9	171.5	-56	176.7	0	0	0	106.9	V102 A117 Q119 E125 I127 A416 D419 I420 I426	V102-I121 HydrophobicContact CG1-CD1 4.18Å; A117-I121 HydrophobicContact CB-CD1 4.07Å; Q119-I121 PolarHBondContact O-N 2.89Å; I121-E125 HydrophobicContact CG2-CB 4.04Å; I121-E125 HydrophobicContact CG2-CG 4.39Å; I121-I127 HydrophobicContact CD1-CG1 4.18Å; I121-I127 HydrophobicContact CD1-CG2 4.05Å; I121-I127 HydrophobicContact CG2-CG1 4.02Å; I121-A416 HydrophobicContact CG2-CB 3.86Å; I121-D419 CarbonylContact O-C 3.53Å; I121-D419 WeakPolarHBondContact O-CA 3.46Å; I121-I420 HydrophobicContact CB-CB 4.28Å; I121-I420 PolarHBondContact N-O 3.3Å; I121-I420 PolarHBondContact O-N 3.26Å; I121-I426 HydrophobicContact CD1-CD1 4.2Å
122	R	97.4	Very high	95.5	Very high	164 Å²	164	46.3 Å²	46.3	62%	0.619	23%	0.234	S	C	*	.			trans	-84.8	151.8	-177.8	-66	-169.2	-179.7	98.1	-1.3	111.7	G124 E125 D419	R122-G124 PolarHBondContact O-N 2.93Å; R122-E125 PolarHBondContact N-OE2 3.31Å; R122-E125 WeakPolarHBondContact O-CB 3.35Å; R122-E125 PolarHBondContact O-N 3.45Å; R122-D419 WeakPolarHBondContact CA-OD1 3.36Å
123	K	97.8	Very high	95.9	Very high	151 Å²	151	45.1 Å²	45.1	66%	0.657	22%	0.222	S	C	*	.	T	Hydrogen-bonded Turn	trans	-48.1	132.6	168	178.6	168.9	-178.7	170	0	111.2	E125 L417 D419	K123-E125 PolarHBondContact O-N 3.4Å; K123-L417 VanDerWaalsContact CD-O 3.25Å; K123-L417 WeakPolarHBondContact CD-O 3.4Å; K123-L417 WeakPolarHBondContact CE-O 3.38Å; K123-L417 WeakPolarHBondContact CG-O 3.45Å; K123-D419 PolarHBondContact N-OD1 3.48Å
124	G	95.1	Very high	96.1	Very high	54 Å²	54	41.8 Å²	41.8	56%	0.557	21%	0.207	S	C	*	.	T	Hydrogen-bonded Turn	trans	79.9	-4.2	-178.6	0	0	0	0	0	114.7	R122 A416	R122-G124 PolarHBondContact O-N 2.93Å; G124-A416 PolarHBondContact N-O 3.4Å
125	E	94.6	Very high	96.1	Very high	45 Å²	45	42 Å²	42	21%	0.21	21%	0.209	C	C	.	.			trans	-76	129.9	175	-172.1	173.4	176.3	0	0	110.8	R97 I121 R122 K123 I127 A416	R97-E125 IonicContact CZ-OE1 3.09Å; R97-E125 IonicContact NE-OE1 2.73Å; R97-E125 IonicContact NH2-OE1 2.64Å; R97-E125 PolarHBondContact NH2-OE1 3.25Å; I121-E125 HydrophobicContact CG2-CB 4.04Å; I121-E125 HydrophobicContact CG2-CG 4.39Å; R122-E125 PolarHBondContact N-OE2 3.31Å; R122-E125 WeakPolarHBondContact O-CB 3.35Å; R122-E125 PolarHBondContact O-N 3.45Å; K123-E125 PolarHBondContact O-N 3.4Å; E125-I127 PolarHBondContact O-N 3.3Å; E125-A416 PolarHBondContact O-N 2.92Å
126	T	94.4	Very high	96.1	Very high	55 Å²	55	42 Å²	42	34%	0.337	21%	0.209	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	113	167.8	-51.4	0	0	0	0	109.6	V129 H413 V414	T126-V129 HydrophobicContact CG2-CG2 3.78Å; T126-H413 HydrophobicContact CG2-CB 4.42Å; T126-V414 CarbonylContact C-O 3.52Å
127	I	94.9	Very high	95.8	Very high	5 Å²	5	42.7 Å²	42.7	3%	0.026	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	-52.1	179.8	-57.8	171.3	0	0	0	109.4	V102 I121 E125 A401 V414 A416 I420 I426	V102-I127 HydrophobicContact CG1-CG2 3.47Å; V102-I127 VanDerWaalsContact CG1-CG2 3.47Å; I121-I127 HydrophobicContact CD1-CG1 4.18Å; I121-I127 HydrophobicContact CD1-CG2 4.05Å; I121-I127 HydrophobicContact CG2-CG1 4.02Å; E125-I127 PolarHBondContact O-N 3.3Å; I127-A401 HydrophobicContact CD1-CB 3.82Å; I127-V414 HydrophobicContact CB-CB 4.47Å; I127-V414 HydrophobicContact CB-CG1 4.44Å; I127-V414 WeakPolarHBondContact CB-O 3.24Å; I127-V414 HydrophobicContact CD1-CG1 3.93Å; I127-V414 PolarHBondContact N-O 2.63Å; I127-A416 HydrophobicContact CD1-CB 4.24Å; I127-A416 HydrophobicContact CG1-CB 4.35Å; I127-I420 HydrophobicContact CD1-CD1 4.04Å; I127-I426 HydrophobicContact CD1-CD1 4.27Å; I127-I426 HydrophobicContact CD1-CG2 3.95Å; I127-I426 HydrophobicContact CG2-CD1 4.07Å
128	F	95.1	Very high	95.5	Very high	8 Å²	8	43 Å²	43	4%	0.035	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-157.7	161.3	172.8	62.3	-91.6	0	0	0	111.4	A98 L115 E130 L389 Q390 L412 V414	A98-F128 HydrophobicContact CB-CB 3.88Å; L115-F128 HydrophobicContact CD2-CD1 4.41Å; L115-F128 HydrophobicContact CD2-CE1 3.56Å; L115-F128 HydrophobicContact CD2-CZ 4.31Å; F128-E130 HydrophobicContact CD2-CB 4.06Å; F128-E130 HydrophobicContact CE2-CB 4.1Å; F128-L389 HydrophobicContact CD1-CD2 3.89Å; F128-L389 HydrophobicContact CD2-CD2 3.87Å; F128-L389 HydrophobicContact CE1-CD2 3.99Å; F128-L389 HydrophobicContact CE1-CG 4.15Å; F128-L389 HydrophobicContact CE2-CB 4.14Å; F128-L389 HydrophobicContact CE2-CD2 3.93Å; F128-L389 HydrophobicContact CE2-CG 4.07Å; F128-L389 HydrophobicContact CG-CD2 3.84Å; F128-L389 HydrophobicContact CZ-CB 4.3Å; F128-L389 HydrophobicContact CZ-CD2 3.98Å; F128-L389 HydrophobicContact CZ-CG 3.87Å; F128-Q390 HydrophobicContact CE2-CB 4.33Å; F128-Q390 HydrophobicContact CZ-CB 4.3Å; F128-L412 HydrophobicContact CE2-CD2 4.37Å; F128-V414 HydrophobicContact CD1-CB 4.2Å; F128-V414 HydrophobicContact CD1-CG2 4.4Å; F128-V414 HydrophobicContact CD2-CG2 4.2Å; F128-V414 HydrophobicContact CE1-CB 3.84Å; F128-V414 HydrophobicContact CE1-CG1 4.2Å; F128-V414 HydrophobicContact CE1-CG2 3.74Å; F128-V414 HydrophobicContact CE2-CB 4.31Å; F128-V414 HydrophobicContact CE2-CG2 3.54Å; F128-V414 HydrophobicContact CZ-CB 3.93Å; F128-V414 HydrophobicContact CZ-CG1 4.49Å; F128-V414 HydrophobicContact CZ-CG2 3.28Å; F128-V414 PolarHBondContact O-N 3.25Å
129	V	95.1	Very high	95.1	Very high	24 Å²	24	41.2 Å²	41.2	15%	0.145	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.4	134	170.1	-177.8	0	0	0	0	107.7	C91 V92 T126 L411 L412	C91-V129 CarbonylContact C-O 3.57Å; C91-V129 WeakPolarHBondContact CA-O 3.48Å; V92-V129 HydrophobicContact CB-CB 4.19Å; V92-V129 HydrophobicContact CB-CG1 4.02Å; V92-V129 HydrophobicContact CG2-CG1 4.17Å; V92-V129 PolarHBondContact N-O 2.86Å; T126-V129 HydrophobicContact CG2-CG2 3.78Å; V129-L411 HydrophobicContact CG1-CB 4.28Å; V129-L412 CarbonylContact C-O 3.56Å; V129-L412 VanDerWaalsContact CA-O 3.26Å; V129-L412 WeakPolarHBondContact CA-O 3.46Å
130	E	95.1	Very high	94.7	Very high	0 Å²	0	38.7 Å²	38.7	0%	0	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	137.1	-174.6	-170.1	175.7	-167.7	0	0	112	F90 F128 F387 V388 L389 Q390 L412	F90-E130 HydrophobicContact CB-CG 4.06Å; F128-E130 HydrophobicContact CD2-CB 4.06Å; F128-E130 HydrophobicContact CE2-CB 4.1Å; E130-F387 HydrophobicContact CB-CD1 4.25Å; E130-F387 HydrophobicContact CG-CD1 4.09Å; E130-V388 PolarHBondContact OE1-N 3.39Å; E130-L389 PolarHBondContact OE1-N 2.94Å; E130-L389 WeakPolarHBondContact OE2-CB 3.45Å; E130-L389 PolarHBondContact OE2-N 3.01Å; E130-Q390 PolarHBondContact OE2-N 3.24Å; E130-L412 PolarHBondContact N-O 3.14Å; E130-L412 PolarHBondContact O-N 3.06Å
131	R	96	Very high	94.3	Very high	122 Å²	122	35 Å²	35	46%	0.46	17%	0.171	S	C	.	.			trans	-84.1	143.1	165.6	-71.4	173.6	-144.2	-92.5	-0.5	109.5	F90 V92 L411	F90-R131 WeakPolarHBondContact CB-O 3.34Å; F90-R131 PolarHBondContact O-N 2.98Å; V92-R131 HydrophobicContact CG2-CG 3.65Å; R131-L411 HydrophobicContact CB-CD2 4.33Å; R131-L411 HydrophobicContact CG-CD2 3.39Å
132	P	96.3	Very high	93.6	Very high	10 Å²	10	38.8 Å²	38.8	7%	0.065	20%	0.201	C	C	.	.			trans	-65.9	146.5	173.3	29.1	-33.7	0	0	0	110.3	V134 A135 L386 F387 F410	P132-V134 VanDerWaalsContact C-N 3.28Å; P132-V134 WeakPolarHBondContact CB-O 3.37Å; P132-A135 HydrophobicContact CB-CB 3.96Å; P132-A135 HydrophobicContact CG-CB 3.67Å; P132-L386 CarbonylContact C-O 3.5Å; P132-L386 WeakPolarHBondContact CA-O 3.42Å; P132-F387 HydrophobicContact CB-CD1 4.17Å; P132-F387 HydrophobicContact CB-CE1 3.73Å; P132-F387 HydrophobicContact CB-CE2 4.12Å; P132-F387 HydrophobicContact CB-CZ 3.7Å; P132-F387 HydrophobicContact CG-CE1 4.17Å; P132-F387 HydrophobicContact CG-CZ 4.17Å; P132-F410 WeakPolarHBondContact CD-O 3.28Å; P132-F410 HydrophobicContact CG-CB 4Å; P132-F410 HydrophobicContact CG-CD2 3.33Å; P132-F410 HydrophobicContact CG-CE2 3.88Å; P132-F410 HydrophobicContact CG-CG 3.72Å
133	L	95.7	Very high	92.8	Very high	0 Å²	0	36 Å²	36	0%	0	20%	0.198	C	C	.	.	S	Bend	trans	-59.9	-44.8	167.6	-175.6	66.1	0	0	0	110.1	F90 Q209 W265 L268 F269 F272 L386 V388	F90-L133 HydrophobicContact CD2-CD1 4.45Å; F90-L133 HydrophobicContact CE1-CD1 3.68Å; F90-L133 HydrophobicContact CE2-CD1 3.6Å; F90-L133 HydrophobicContact CZ-CD1 3.15Å; L133-Q209 PolarHBondContact O-NE2 3.43Å; L133-W265 HydrophobicContact CD1-CE3 3.68Å; L133-W265 HydrophobicContact CD1-CH2 4.34Å; L133-W265 HydrophobicContact CD1-CZ3 3.31Å; L133-W265 HydrophobicContact CG-CE3 4.31Å; L133-W265 HydrophobicContact CG-CZ3 3.99Å; L133-L268 HydrophobicContact CD1-CB 4.09Å; L133-L268 HydrophobicContact CD1-CD1 3.83Å; L133-L268 HydrophobicContact CD1-CG 4.42Å; L133-L268 HydrophobicContact CD2-CB 3.89Å; L133-F269 HydrophobicContact CD2-CD1 3.4Å; L133-F269 HydrophobicContact CD2-CE1 3.27Å; L133-F269 HydrophobicContact CD2-CG 4.23Å; L133-F269 HydrophobicContact CD2-CZ 4.02Å; L133-F269 HydrophobicContact CG-CD1 4.38Å; L133-F269 HydrophobicContact CG-CE1 3.76Å; L133-F269 HydrophobicContact CG-CZ 4.21Å; L133-F272 HydrophobicContact CD2-CE2 3.74Å; L133-F272 HydrophobicContact CD2-CZ 4.38Å; L133-L386 WeakPolarHBondContact CB-O 3.41Å; L133-L386 PolarHBondContact N-O 3.45Å; L133-V388 HydrophobicContact CB-CG2 4.34Å; L133-V388 HydrophobicContact CD2-CG2 4.35Å
134	V	96.7	Very high	91.9	Very high	5 Å²	5	31.2 Å²	31.2	3%	0.03	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-147.6	147.2	168.4	-69.7	0	0	0	0	108.3	P132 L248 R251 M252 F269 G385 L386	P132-V134 VanDerWaalsContact C-N 3.28Å; P132-V134 WeakPolarHBondContact CB-O 3.37Å; V134-L248 HydrophobicContact CB-CD1 4.3Å; V134-L248 HydrophobicContact CG2-CD1 3.81Å; V134-L248 HydrophobicContact CG2-CG 4.26Å; V134-R251 HydrophobicContact CB-CB 4.22Å; V134-R251 HydrophobicContact CG1-CB 4.28Å; V134-M252 HydrophobicContact CG2-CG 3.82Å; V134-F269 HydrophobicContact CG1-CE1 4.26Å; V134-F269 HydrophobicContact CG1-CZ 3.97Å; V134-F269 HydrophobicContact CG2-CE1 4.02Å; V134-G385 CarbonylContact O-C 3.6Å; V134-G385 VanDerWaalsContact O-CA 3.23Å; V134-G385 WeakPolarHBondContact O-CA 3.36Å; V134-L386 HydrophobicContact CG2-CB 4.33Å; V134-L386 HydrophobicContact CG2-CD1 4.02Å; V134-L386 HydrophobicContact CG2-CG 4.29Å; V134-L386 PolarHBondContact O-N 3.37Å
135	A	96.9	Very high	91.3	Very high	4 Å²	4	36.6 Å²	36.6	3%	0.033	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.1	150.3	171.7	0	0	0	0	0	110.1	P132 L153 R251 I335 S384 F410	P132-A135 HydrophobicContact CB-CB 3.96Å; P132-A135 HydrophobicContact CG-CB 3.67Å; A135-L153 HydrophobicContact CB-CD1 4.24Å; A135-R251 WeakPolarHBondContact O-CD 3.35Å; A135-R251 VanDerWaalsContact O-CZ 3.24Å; A135-R251 PolarHBondContact O-NE 3Å; A135-R251 PolarHBondContact O-NH1 3Å; A135-I335 HydrophobicContact CB-CD1 3.94Å; A135-S384 CarbonylContact C-O 3.58Å; A135-S384 WeakPolarHBondContact CA-O 3.37Å; A135-S384 WeakPolarHBondContact CB-O 3.44Å; A135-F410 HydrophobicContact CB-CD2 4.13Å
136	A	95.4	Very high	90.9	Very high	1 Å²	1	35.3 Å²	35.3	1%	0.008	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.8	178.3	0	0	0	0	0	110.5	M247 L248 G383 S384	A136-M247 HydrophobicContact CB-CB 3.97Å; A136-L248 HydrophobicContact CB-CB 4.31Å; A136-L248 HydrophobicContact CB-CD1 4.21Å; A136-G383 CarbonylContact O-C 3.56Å; A136-G383 WeakPolarHBondContact O-CA 3.36Å; A136-S384 PolarHBondContact N-O 3.05Å; A136-S384 PolarHBondContact O-N 3.04Å
137	Q	92.5	Very high	90.7	Very high	37 Å²	37	40.6 Å²	40.6	17%	0.173	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	150.2	165.8	-69.4	179.3	49	0	0	109.9	A148 C149 L153	Q137-A148 PolarHBondContact NE2-O 3.32Å; Q137-C149 PolarHBondContact NE2-O 3.49Å; Q137-L153 HydrophobicContact CG-CD1 4.23Å; Q137-L153 HydrophobicContact CG-CG 3.78Å
138	F	90.6	Very high	90.7	Very high	8 Å²	8	40.9 Å²	40.9	4%	0.035	19%	0.19	C	C	.	.			trans	-66.6	142.9	165.5	-71.4	-13.5	0	0	0	110.5	L36 W140 N141 E242 E382	L36-F138 HydrophobicContact CD2-CZ 4.24Å; F138-W140 PolarHBondContact O-N 3.07Å; F138-N141 VanDerWaalsContact O-CB 3.32Å; F138-N141 WeakPolarHBondContact O-CB 3.29Å; F138-N141 PolarHBondContact O-N 3.15Å; F138-N141 VanDerWaalsContact O-N 3.17Å; F138-E242 VanDerWaalsContact CA-OE2 3.3Å; F138-E242 WeakPolarHBondContact CA-OE2 3.44Å; F138-E242 HydrophobicContact CB-CB 4.24Å; F138-E242 HydrophobicContact CB-CG 4.24Å; F138-E242 WeakPolarHBondContact CB-OE2 3.44Å; F138-E242 HydrophobicContact CD1-CB 4.4Å; F138-E242 HydrophobicContact CD1-CG 3.83Å; F138-E242 HydrophobicContact CD2-CB 3.91Å; F138-E242 HydrophobicContact CD2-CG 4.24Å; F138-E242 HydrophobicContact CE1-CG 4.25Å; F138-E242 HydrophobicContact CE2-CB 4.38Å; F138-E242 WeakPolarHBondContact CE2-O 3.24Å; F138-E242 HydrophobicContact CG-CB 3.94Å; F138-E242 HydrophobicContact CG-CG 3.85Å; F138-E242 WeakPolarHBondContact CZ-O 3.47Å; F138-E382 HydrophobicContact CD2-CB 3.43Å; F138-E382 VanDerWaalsContact CD2-CB 3.43Å; F138-E382 HydrophobicContact CE2-CB 3.9Å; F138-E382 HydrophobicContact CG-CB 4.28Å; F138-E382 PolarHBondContact N-O 3.42Å
139	L	89.5	Confident	90.7	Very high	15 Å²	15	40.5 Å²	40.5	8%	0.079	19%	0.188	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-29	-173.6	-73.2	-174.2	0	0	0	111.8	N141 A142 Q231 W234 R235 E242 I246 M247	L139-N141 PolarHBondContact O-N 3.04Å; L139-A142 PolarHBondContact O-N 2.78Å; L139-Q231 HydrophobicContact CD1-CB 3.71Å; L139-Q231 HydrophobicContact CD1-CG 3.8Å; L139-Q231 WeakPolarHBondContact CD1-O 3.5Å; L139-Q231 HydrophobicContact CD2-CB 4.37Å; L139-Q231 HydrophobicContact CD2-CG 3.84Å; L139-W234 HydrophobicContact CD1-CB 4.13Å; L139-W234 HydrophobicContact CD1-CG 4.16Å; L139-R235 HydrophobicContact CB-CG 4.12Å; L139-R235 HydrophobicContact CD1-CG 4.33Å; L139-E242 PolarHBondContact N-OE2 3.34Å; L139-I246 HydrophobicContact CD1-CG2 4.19Å; L139-M247 HydrophobicContact CD1-CG 4.43Å; L139-M247 HydrophobicContact CD2-CG 3.55Å; L139-M247 HydrophobicContact CD2-SD 4.42Å; L139-M247 HydrophobicContact CG-CG 4.08Å
140	W	86.6	Confident	90.8	Very high	23 Å²	23	40.7 Å²	40.7	9%	0.087	19%	0.189	C	C	.	.	H	α-helix	trans	-67.7	-21.6	178.5	-65.6	100.2	0	0	0	113.4	F138 A142 L143 Y144 R235 H238 Y239 P240	F138-W140 PolarHBondContact O-N 3.07Å; W140-A142 VanDerWaalsContact C-N 3.27Å; W140-A142 PolarHBondContact O-N 3.2Å; W140-L143 HydrophobicContact CE3-CB 4.39Å; W140-L143 HydrophobicContact CE3-CD2 3.42Å; W140-L143 VanDerWaalsContact CE3-CD2 3.42Å; W140-L143 HydrophobicContact CH2-CD2 4.46Å; W140-L143 HydrophobicContact CZ3-CD2 3.28Å; W140-L143 PolarHBondContact O-N 3.05Å; W140-L143 VanDerWaalsContact O-N 3.12Å; W140-Y144 HydrophobicContact CB-CD2 4.02Å; W140-Y144 HydrophobicContact CB-CE2 3.83Å; W140-Y144 HydrophobicContact CE3-CE2 4.35Å; W140-Y144 WeakPolarHBondContact O-CD2 3.34Å; W140-Y144 PolarHBondContact O-N 3.17Å; W140-R235 HydrophobicContact CH2-CB 4.32Å; W140-R235 HydrophobicContact CZ2-CB 3.81Å; W140-R235 HydrophobicContact CZ2-CG 4.02Å; W140-R235 WeakPolarHBondContact CZ2-O 3.2Å; W140-H238 PolarHBondContact NE1-O 3.23Å; W140-Y239 HydrophobicContact CH2-CD2 4.03Å; W140-Y239 HydrophobicContact CH2-CE2 4.11Å; W140-Y239 HydrophobicContact CZ2-CD2 4.26Å; W140-P240 HydrophobicContact CB-CG 4.31Å; W140-P240 HydrophobicContact CD2-CG 3.26Å; W140-P240 VanDerWaalsContact CE2-CD 3.4Å; W140-P240 VanDerWaalsContact CE2-CG 3.47Å; W140-P240 HydrophobicContact CE3-CG 3.55Å; W140-P240 HydrophobicContact CG-CG 3.58Å; W140-P240 HydrophobicContact CH2-CG 4.23Å; W140-P240 VanDerWaalsContact CZ2-CD 3.46Å; W140-P240 HydrophobicContact CZ2-CG 3.99Å; W140-P240 HydrophobicContact CZ3-CG 4.02Å
141	N	87.2	Confident	90.9	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.021	19%	0.193	C	C	.	.	H	α-helix	trans	-55.2	-44.6	174.3	-74.4	-7	0	0	0	112	F138 L139 L143 Y144 R145 Y146 C381 E382	F138-N141 VanDerWaalsContact O-CB 3.32Å; F138-N141 WeakPolarHBondContact O-CB 3.29Å; F138-N141 PolarHBondContact O-N 3.15Å; F138-N141 VanDerWaalsContact O-N 3.17Å; L139-N141 PolarHBondContact O-N 3.04Å; N141-L143 VanDerWaalsContact C-N 3.34Å; N141-L143 PolarHBondContact O-N 3.25Å; N141-Y144 CarbonylContact O-C 3.54Å; N141-Y144 PolarHBondContact O-N 3.29Å; N141-R145 PolarHBondContact O-N 2.74Å; N141-Y146 PolarHBondContact O-N 2.94Å; N141-C381 PolarHBondContact ND2-SG 2.81Å; N141-E382 PolarHBondContact ND2-N 3.11Å; N141-E382 PolarHBondContact ND2-O 3.36Å; N141-E382 PolarHBondContact OD1-N 3.17Å
142	A	82.6	Confident	90.9	Very high	79 Å²	79	36 Å²	36	65%	0.653	17%	0.173	S	C	*	.	H	α-helix	trans	-64.5	-40.4	179.8	0	0	0	0	0	111.3	L139 W140 R145	L139-A142 PolarHBondContact O-N 2.78Å; W140-A142 VanDerWaalsContact C-N 3.27Å; W140-A142 PolarHBondContact O-N 3.2Å; A142-R145 PolarHBondContact O-N 3.36Å; A142-R145 VanDerWaalsContact O-N 3.11Å
143	L	81.1	Confident	90.9	Very high	106 Å²	106	35.6 Å²	35.6	56%	0.555	17%	0.169	S	C	*	.	H	α-helix	trans	-65.7	-42.4	177.8	-168.1	71.4	0	0	0	111.6	W140 N141 R145	W140-L143 HydrophobicContact CE3-CB 4.39Å; W140-L143 HydrophobicContact CE3-CD2 3.42Å; W140-L143 VanDerWaalsContact CE3-CD2 3.42Å; W140-L143 HydrophobicContact CH2-CD2 4.46Å; W140-L143 HydrophobicContact CZ3-CD2 3.28Å; W140-L143 PolarHBondContact O-N 3.05Å; W140-L143 VanDerWaalsContact O-N 3.12Å; N141-L143 VanDerWaalsContact C-N 3.34Å; N141-L143 PolarHBondContact O-N 3.25Å; L143-R145 PolarHBondContact O-N 2.99Å
144	Y	78.6	Confident	90.9	Very high	51 Å²	51	39.1 Å²	39.1	20%	0.2	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.2	8	174.2	-63.2	-56.2	0	0	0	113.8	W140 N141 Y146 P240 F378	W140-Y144 HydrophobicContact CB-CD2 4.02Å; W140-Y144 HydrophobicContact CB-CE2 3.83Å; W140-Y144 HydrophobicContact CE3-CE2 4.35Å; W140-Y144 WeakPolarHBondContact O-CD2 3.34Å; W140-Y144 PolarHBondContact O-N 3.17Å; N141-Y144 CarbonylContact O-C 3.54Å; N141-Y144 PolarHBondContact O-N 3.29Å; Y144-Y146 PolarHBondContact O-N 3.38Å; Y144-P240 HydrophobicContact CE2-CG 4.35Å; Y144-F378 HydrophobicContact CE2-CE1 4.07Å; Y144-F378 HydrophobicContact CE2-CZ 4.29Å
145	R	82.3	Confident	90.7	Very high	167 Å²	167	39 Å²	39	63%	0.63	18%	0.183	S	C	*	.	T	Hydrogen-bonded Turn	trans	59.9	26.2	175.3	-50	-176.5	-175.1	169.1	10.3	114.1	D18 N141 A142 L143 R147	D18-R145 IonicContact OD2-NH2 2.82Å; D18-R145 PolarHBondContact OD2-NH2 2.69Å; D18-R145 VanDerWaalsContact OD2-NH2 3.16Å; N141-R145 PolarHBondContact O-N 2.74Å; A142-R145 PolarHBondContact O-N 3.36Å; A142-R145 VanDerWaalsContact O-N 3.11Å; L143-R145 PolarHBondContact O-N 2.99Å; R145-R147 PolarHBondContact O-N 2.99Å
146	Y	86.6	Confident	90.6	Very high	18 Å²	18	39.1 Å²	39.1	7%	0.071	18%	0.183	C	C	.	.			trans	-62.6	129.4	167.9	-77.8	-87.5	0	0	0	109.2	N141 Y144 F378 N380 C381	N141-Y146 PolarHBondContact O-N 2.94Å; Y144-Y146 PolarHBondContact O-N 3.38Å; Y146-F378 PolarHBondContact OH-O 2.94Å; Y146-N380 VanDerWaalsContact CE1-C 3.42Å; Y146-N380 WeakPolarHBondContact CE1-O 3.28Å; Y146-C381 HydrophobicContact CD1-CB 4Å; Y146-C381 HydrophobicContact CG-CB 4.43Å
147	R	90.1	Very high	90.5	Very high	166 Å²	166	39.6 Å²	39.6	63%	0.626	19%	0.185	S	C	*	.			trans	-101.3	107.2	175.3	-64.2	-173.2	178.8	-165.1	0.6	108.6	R145 L156	R145-R147 PolarHBondContact O-N 2.99Å; R147-L156 HydrophobicContact CB-CB 4.08Å; R147-L156 WeakPolarHBondContact O-CB 3.48Å; R147-L156 PolarHBondContact O-N 3.14Å
148	A	93.9	Very high	90.6	Very high	10 Å²	10	42.5 Å²	42.5	8%	0.083	20%	0.197	C	C	.	.	B	Isolated β-bridge	trans	-136.2	152.4	179.9	0	0	0	0	0	111.7	Q137 D150 L153 R154 L156 C381	Q137-A148 PolarHBondContact NE2-O 3.32Å; A148-D150 PolarHBondContact O-N 2.85Å; A148-L153 WeakPolarHBondContact CB-O 3.31Å; A148-R154 CarbonylContact C-O 3.55Å; A148-R154 WeakPolarHBondContact CA-O 3.23Å; A148-L156 VanDerWaalsContact C-CD1 3.43Å; A148-L156 WeakPolarHBondContact O-CD1 3.4Å; A148-C381 HydrophobicContact CB-CB 4.18Å; A148-C381 WeakPolarHBondContact CB-SG 3.41Å
149	C	96.9	Very high	90.8	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	20%	0.195	C	C	.	.			trans	-62	126.6	175.6	179.3	0	0	0	0	109.7	Q137 H151 C152 L153 R154 L156 C198	Q137-C149 PolarHBondContact NE2-O 3.49Å; C149-H151 PolarHBondContact O-N 3.23Å; C149-H151 PolarHBondContact SG-N 2.99Å; C149-H151 VanDerWaalsContact SG-N 3.44Å; C149-C152 VanDerWaalsContact SG-SG 3.63Å; C149-L153 VanDerWaalsContact O-CA 3.26Å; C149-L153 WeakPolarHBondContact O-CA 3.37Å; C149-L153 PolarHBondContact O-N 3.34Å; C149-R154 HydrophobicContact CB-CB 4.33Å; C149-R154 PolarHBondContact N-O 3.32Å; C149-L156 HydrophobicContact CB-CD2 4.17Å; C149-C198 HydrophobicContact CB-CB 4.04Å; C149-C198 PolarHBondContact SG-N 3.13Å; C149-C198 VanDerWaalsContact SG-N 3.4Å
150	D	96.1	Very high	91.1	Very high	29 Å²	29	44.3 Å²	44.3	16%	0.155	21%	0.205	C	C	.	.	T	Hydrogen-bonded Turn	trans	-60.7	-28.4	177.5	175.5	76.3	0	0	0	112.6	A148 V195 M196 Y197 Y210 R251	A148-D150 PolarHBondContact O-N 2.85Å; D150-V195 HydrophobicContact CB-CG1 4.48Å; D150-V195 HydrophobicContact CB-CG2 3.68Å; D150-M196 PolarHBondContact N-O 3.14Å; D150-Y197 HydrophobicContact CB-CD1 4.29Å; D150-Y197 HydrophobicContact CB-CE1 3.74Å; D150-Y197 PolarHBondContact OD2-OH 2.8Å; D150-Y210 PolarHBondContact O-OH 3.06Å; D150-Y210 PolarHBondContact OD2-OH 3.34Å; D150-R251 VanDerWaalsContact O-CZ 3.25Å; D150-R251 PolarHBondContact O-NH1 3.47Å; D150-R251 PolarHBondContact O-NH2 2.96Å; D150-R251 IonicContact OD1-NH2 2.64Å; D150-R251 PolarHBondContact OD1-NH2 2.79Å; D150-R251 IonicContact OD2-NH2 2.62Å; D150-R251 PolarHBondContact OD2-NH2 3Å
151	H	97.6	Very high	91.4	Very high	20 Å²	20	46.2 Å²	46.2	9%	0.093	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-60.7	179.6	-170.6	58.2	0	0	0	113.3	C149 Y197 C202 A206 Y210 F410	C149-H151 PolarHBondContact O-N 3.23Å; C149-H151 PolarHBondContact SG-N 2.99Å; C149-H151 VanDerWaalsContact SG-N 3.44Å; H151-Y197 HydrophobicContact CB-CD1 4.05Å; H151-Y197 HydrophobicContact CB-CE1 4.2Å; H151-C202 HydrophobicContact CB-CB 4Å; H151-A206 HydrophobicContact CB-CB 4.13Å; H151-Y210 WeakPolarHBondContact CA-OH 3.34Å; H151-Y210 AromaticContact ND1-CE1 3.67Å; H151-F410 AromaticContact CD2-CZ 3.9Å; H151-F410 AromaticContact NE2-CE2 3.87Å; H151-F410 AromaticContact NE2-CZ 3.74Å; H151-F410 WeakPolarHBondContact O-CD2 3.41Å; H151-F410 VanDerWaalsContact O-CE2 3.29Å; H151-F410 WeakPolarHBondContact O-CE2 3.36Å
152	C	96.7	Very high	91.6	Very high	4 Å²	4	46.1 Å²	46.1	3%	0.027	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-103.7	6.7	-168.3	72	0	0	0	0	114.7	C149 R154 C198 N409 F410	C149-C152 VanDerWaalsContact SG-SG 3.63Å; C152-R154 PolarHBondContact O-N 2.79Å; C152-R154 WeakPolarHBondContact SG-CB 3.41Å; C152-C198 PolarHBondContact SG-SG 3.2Å; C152-N409 HydrophobicContact CB-CB 4.32Å; C152-N409 CarbonylContact O-C 3.51Å; C152-N409 VanDerWaalsContact O-CA 3.31Å; C152-N409 WeakPolarHBondContact O-CA 3.29Å; C152-F410 HydrophobicContact CB-CD1 3.78Å; C152-F410 HydrophobicContact CB-CD2 4.12Å; C152-F410 HydrophobicContact CB-CE1 3.65Å; C152-F410 HydrophobicContact CB-CE2 3.97Å; C152-F410 HydrophobicContact CB-CG 4.04Å; C152-F410 HydrophobicContact CB-CZ 3.74Å; C152-F410 PolarHBondContact O-N 3.49Å
153	L	95.4	Very high	92.1	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	18%	0.184	C	C	.	.			trans	63	-6.8	-178.8	-75.8	59.5	0	0	0	115	A135 Q137 A148 C149 A155 I335 T337	A135-L153 HydrophobicContact CB-CD1 4.24Å; Q137-L153 HydrophobicContact CG-CD1 4.23Å; Q137-L153 HydrophobicContact CG-CG 3.78Å; A148-L153 WeakPolarHBondContact CB-O 3.31Å; C149-L153 VanDerWaalsContact O-CA 3.26Å; C149-L153 WeakPolarHBondContact O-CA 3.37Å; C149-L153 PolarHBondContact O-N 3.34Å; L153-A155 PolarHBondContact O-N 3.07Å; L153-I335 HydrophobicContact CB-CG2 4.44Å; L153-I335 HydrophobicContact CD2-CB 3.81Å; L153-I335 HydrophobicContact CD2-CD1 3.97Å; L153-I335 HydrophobicContact CD2-CG1 4.49Å; L153-I335 HydrophobicContact CD2-CG2 3.77Å; L153-T337 HydrophobicContact CB-CG2 4.35Å; L153-T337 PolarHBondContact O-OG1 3.04Å
154	R	95.3	Very high	92.7	Very high	74 Å²	74	39.6 Å²	39.6	28%	0.279	17%	0.168	S	C	.	.			trans	-48.6	132.6	178.1	176.2	168.1	-69.2	-175.9	-1.6	112.8	A148 C149 C152 L156 C198 E407 N408 N409	A148-R154 CarbonylContact C-O 3.55Å; A148-R154 WeakPolarHBondContact CA-O 3.23Å; C149-R154 HydrophobicContact CB-CB 4.33Å; C149-R154 PolarHBondContact N-O 3.32Å; C152-R154 PolarHBondContact O-N 2.79Å; C152-R154 WeakPolarHBondContact SG-CB 3.41Å; R154-L156 PolarHBondContact O-N 3.07Å; R154-C198 HydrophobicContact CG-CB 4.48Å; R154-E407 PolarHBondContact NH2-O 2.66Å; R154-N408 VanDerWaalsContact CA-O 3.28Å; R154-N408 WeakPolarHBondContact CA-O 3.33Å; R154-N408 WeakPolarHBondContact CB-O 3.48Å; R154-N408 WeakPolarHBondContact CG-O 3.38Å; R154-N408 PolarHBondContact NE-O 3.35Å; R154-N409 HydrophobicContact CB-CB 4.18Å; R154-N409 PolarHBondContact NH2-ND2 3.33Å
155	A	93.3	Very high	93.2	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.033	17%	0.17	C	C	.	.	B	Isolated β-bridge	trans	-56.9	132.9	172.8	0	0	0	0	0	111.7	L153	L153-A155 PolarHBondContact O-N 3.07Å
156	L	94.7	Very high	93.5	Very high	5 Å²	5	32.6 Å²	32.6	3%	0.026	14%	0.141	C	C	.	.			trans	-105.5	-3	-179.6	-58.7	178.1	0	0	0	112.7	R147 A148 C149 R154 H187 M196 C198	R147-L156 HydrophobicContact CB-CB 4.08Å; R147-L156 WeakPolarHBondContact O-CB 3.48Å; R147-L156 PolarHBondContact O-N 3.14Å; A148-L156 VanDerWaalsContact C-CD1 3.43Å; A148-L156 WeakPolarHBondContact O-CD1 3.4Å; C149-L156 HydrophobicContact CB-CD2 4.17Å; R154-L156 PolarHBondContact O-N 3.07Å; L156-H187 PolarHBondContact O-CE1 2.9Å; L156-M196 HydrophobicContact CD1-CB 3.35Å; L156-M196 HydrophobicContact CD1-CE 4.3Å; L156-M196 HydrophobicContact CD1-CG 4.2Å; L156-C198 HydrophobicContact CD2-CB 3.6Å
157	E	92.7	Very high	93.7	Very high	12 Å²	12	32.2 Å²	32.2	6%	0.056	14%	0.141	C	C	.	.	S	Bend	trans	-99.3	142.9	171	57.4	-176.7	160.6	0	0	109.5	E161 N162 R165 S339	E157-E161 WeakPolarHBondContact CA-OE2 3.32Å; E157-E161 HydrophobicContact CB-CB 4.05Å; E157-N162 HydrophobicContact CG-CB 3.93Å; E157-N162 PolarHBondContact OE1-ND2 3.49Å; E157-R165 IonicContact OE1-CZ 3.98Å; E157-R165 IonicContact OE1-NE 3.59Å; E157-R165 PolarHBondContact OE1-NE 3.46Å; E157-R165 IonicContact OE1-NH2 3.34Å; E157-R165 PolarHBondContact OE1-NH2 2.93Å; E157-R165 IonicContact OE2-CZ 2.59Å; E157-R165 IonicContact OE2-NE 2.71Å; E157-R165 PolarHBondContact OE2-NE 2.81Å; E157-R165 IonicContact OE2-NH2 3.91Å; E157-S339 VanDerWaalsContact O-CB 3.24Å; E157-S339 WeakPolarHBondContact O-CB 3.3Å; E157-S339 PolarHBondContact O-OG 2.87Å
158	K	94.7	Very high	93.7	Very high	97 Å²	97	27.1 Å²	27.1	42%	0.422	14%	0.14	S	C	.	.			trans	-63.1	157.3	173.3	-71.5	-176.4	174.3	-171.6	0	110.3	E160 E161 N162 V182 K184	K158-E160 PolarHBondContact O-N 3.41Å; K158-E161 HydrophobicContact CB-CB 4.47Å; K158-E161 HydrophobicContact CB-CG 4.11Å; K158-E161 PolarHBondContact N-OE2 3.22Å; K158-E161 WeakPolarHBondContact O-CB 3.08Å; K158-E161 PolarHBondContact O-N 2.63Å; K158-N162 WeakPolarHBondContact O-CB 3.31Å; K158-N162 PolarHBondContact O-N 3.28Å; K158-V182 HydrophobicContact CG-CB 4.4Å; K158-K184 HydrophobicContact CG-CD 4.14Å
159	A	94.7	Very high	93.5	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.008	15%	0.154	C	C	.	.	H	α-helix	trans	-51.1	-42.1	177.1	0	0	0	0	0	112.5	N162 A163 L174 C180 S339 W343	A159-N162 WeakPolarHBondContact O-CB 3.5Å; A159-N162 PolarHBondContact O-N 3.31Å; A159-A163 WeakPolarHBondContact O-CB 3.33Å; A159-A163 PolarHBondContact O-N 3.45Å; A159-L174 VanDerWaalsContact C-CD1 3.41Å; A159-L174 HydrophobicContact CB-CD1 3.72Å; A159-C180 HydrophobicContact CB-CB 4.29Å; A159-C180 PolarHBondContact N-SG 3.22Å; A159-C180 VanDerWaalsContact N-SG 3.37Å; A159-S339 WeakPolarHBondContact CB-O 3.47Å; A159-S339 PolarHBondContact N-OG 2.92Å; A159-W343 HydrophobicContact CB-CB 3.55Å; A159-W343 HydrophobicContact CB-CG 3.95Å
160	E	95.3	Very high	93	Very high	61 Å²	61	36.2 Å²	36.2	29%	0.285	19%	0.189	S	C	.	.	H	α-helix	trans	-67.2	-43.5	177.4	-176	175.4	93.5	0	0	112.6	K158 N162 A163 Q164 Q172 V173 L174	K158-E160 PolarHBondContact O-N 3.41Å; E160-N162 VanDerWaalsContact C-N 3.27Å; E160-N162 PolarHBondContact O-N 3.26Å; E160-A163 PolarHBondContact O-N 3.36Å; E160-Q164 HydrophobicContact CG-CG 4.5Å; E160-Q164 WeakPolarHBondContact O-CB 3.28Å; E160-Q164 VanDerWaalsContact O-CG 3.24Å; E160-Q164 WeakPolarHBondContact O-CG 3.16Å; E160-Q164 PolarHBondContact O-N 3.05Å; E160-Q172 WeakPolarHBondContact CG-O 3.23Å; E160-V173 WeakPolarHBondContact OE2-CA 3.34Å; E160-L174 HydrophobicContact CB-CB 4.47Å; E160-L174 HydrophobicContact CB-CD1 4.18Å; E160-L174 HydrophobicContact CB-CG 4.05Å; E160-L174 HydrophobicContact CG-CG 4.35Å; E160-L174 PolarHBondContact OE2-N 2.86Å
161	E	93.9	Very high	92.6	Very high	63 Å²	63	38 Å²	38	29%	0.294	21%	0.214	S	C	.	.	H	α-helix	trans	-61.5	-39.9	175.5	-62.9	173	158.3	0	0	110.6	E157 K158 Q164 R165 K184	E157-E161 WeakPolarHBondContact CA-OE2 3.32Å; E157-E161 HydrophobicContact CB-CB 4.05Å; K158-E161 HydrophobicContact CB-CB 4.47Å; K158-E161 HydrophobicContact CB-CG 4.11Å; K158-E161 PolarHBondContact N-OE2 3.22Å; K158-E161 WeakPolarHBondContact O-CB 3.08Å; K158-E161 PolarHBondContact O-N 2.63Å; E161-Q164 PolarHBondContact O-N 3.08Å; E161-R165 WeakPolarHBondContact O-CB 3.38Å; E161-R165 PolarHBondContact O-N 2.92Å; E161-K184 IonicContact OE1-NZ 2.9Å; E161-K184 PolarHBondContact OE1-NZ 3.21Å; E161-K184 IonicContact OE2-NZ 3.56Å; E161-K184 PolarHBondContact OE2-NZ 2.93Å
162	N	92.1	Very high	92.2	Very high	2 Å²	2	38.5 Å²	38.5	1%	0.011	22%	0.217	C	C	.	.	H	α-helix	trans	-62.8	-47.6	174.9	-175.6	-158.6	0	0	0	111.2	E157 K158 A159 E160 R165 L166 S338 L340	E157-N162 HydrophobicContact CG-CB 3.93Å; E157-N162 PolarHBondContact OE1-ND2 3.49Å; K158-N162 WeakPolarHBondContact O-CB 3.31Å; K158-N162 PolarHBondContact O-N 3.28Å; A159-N162 WeakPolarHBondContact O-CB 3.5Å; A159-N162 PolarHBondContact O-N 3.31Å; E160-N162 VanDerWaalsContact C-N 3.27Å; E160-N162 PolarHBondContact O-N 3.26Å; N162-R165 PolarHBondContact ND2-NH2 3.48Å; N162-R165 PolarHBondContact O-N 3.4Å; N162-L166 VanDerWaalsContact ND2-CD1 3.29Å; N162-L166 WeakPolarHBondContact ND2-CD1 3.28Å; N162-L166 WeakPolarHBondContact O-CB 3.25Å; N162-L166 VanDerWaalsContact O-CG 3.28Å; N162-L166 WeakPolarHBondContact O-CG 3.45Å; N162-L166 PolarHBondContact O-N 2.9Å; N162-S338 PolarHBondContact OD1-OG 3.09Å; N162-L340 HydrophobicContact CB-CB 4.4Å; N162-L340 WeakPolarHBondContact OD1-CB 3.37Å; N162-L340 PolarHBondContact OD1-N 3.1Å
163	A	92.8	Very high	92.1	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-61.5	-44.6	176.6	0	0	0	0	0	112.4	A159 E160 R165 L166 T167 Q172 L174 L340 L367	A159-A163 WeakPolarHBondContact O-CB 3.33Å; A159-A163 PolarHBondContact O-N 3.45Å; E160-A163 PolarHBondContact O-N 3.36Å; A163-R165 VanDerWaalsContact C-N 3.33Å; A163-R165 PolarHBondContact O-N 3.16Å; A163-L166 PolarHBondContact O-N 3.36Å; A163-T167 WeakPolarHBondContact O-CB 3.48Å; A163-T167 WeakPolarHBondContact O-CG2 3.4Å; A163-T167 PolarHBondContact O-N 3.42Å; A163-T167 PolarHBondContact O-OG1 2.76Å; A163-Q172 HydrophobicContact CB-CG 4.43Å; A163-L174 HydrophobicContact CB-CD1 4.28Å; A163-L174 HydrophobicContact CB-CD2 3.97Å; A163-L174 HydrophobicContact CB-CG 4.35Å; A163-L340 HydrophobicContact CB-CD1 4.26Å; A163-L340 HydrophobicContact CB-CD2 4.39Å; A163-L367 HydrophobicContact CB-CD1 4.2Å; A163-L367 HydrophobicContact CB-CD2 4.37Å
164	Q	93.1	Very high	92.1	Very high	48 Å²	48	43.1 Å²	43.1	22%	0.224	24%	0.244	C	C	.	.	H	α-helix	trans	-61	-42.1	177	-71.9	171.1	2.2	0	0	111.8	E160 E161 T167 G168 K169 P170 Q172	E160-Q164 HydrophobicContact CG-CG 4.5Å; E160-Q164 WeakPolarHBondContact O-CB 3.28Å; E160-Q164 VanDerWaalsContact O-CG 3.24Å; E160-Q164 WeakPolarHBondContact O-CG 3.16Å; E160-Q164 PolarHBondContact O-N 3.05Å; E161-Q164 PolarHBondContact O-N 3.08Å; Q164-T167 PolarHBondContact O-OG1 3.01Å; Q164-G168 CarbonylContact O-C 3.53Å; Q164-G168 WeakPolarHBondContact O-CA 3.33Å; Q164-G168 PolarHBondContact O-N 3.17Å; Q164-K169 WeakPolarHBondContact CG-O 3.38Å; Q164-K169 PolarHBondContact O-N 2.84Å; Q164-K169 VanDerWaalsContact O-N 3.15Å; Q164-P170 PolarHBondContact NE2-O 3.01Å; Q164-Q172 HydrophobicContact CG-CB 3.89Å; Q164-Q172 WeakPolarHBondContact CG-O 3.22Å; Q164-Q172 PolarHBondContact NE2-O 2.97Å
165	R	90.3	Very high	92.1	Very high	68 Å²	68	41.6 Å²	41.6	26%	0.257	24%	0.244	S	C	.	.	H	α-helix	trans	-65.2	-48	177	-178	178	61	73.2	3.1	111.5	E157 E161 N162 A163 G168	E157-R165 IonicContact OE1-CZ 3.98Å; E157-R165 IonicContact OE1-NE 3.59Å; E157-R165 PolarHBondContact OE1-NE 3.46Å; E157-R165 IonicContact OE1-NH2 3.34Å; E157-R165 PolarHBondContact OE1-NH2 2.93Å; E157-R165 IonicContact OE2-CZ 2.59Å; E157-R165 IonicContact OE2-NE 2.71Å; E157-R165 PolarHBondContact OE2-NE 2.81Å; E157-R165 IonicContact OE2-NH2 3.91Å; E161-R165 WeakPolarHBondContact O-CB 3.38Å; E161-R165 PolarHBondContact O-N 2.92Å; N162-R165 PolarHBondContact ND2-NH2 3.48Å; N162-R165 PolarHBondContact O-N 3.4Å; A163-R165 VanDerWaalsContact C-N 3.33Å; A163-R165 PolarHBondContact O-N 3.16Å; R165-G168 PolarHBondContact O-N 3.38Å
166	L	88.6	Confident	92.2	Very high	2 Å²	2	44.1 Å²	44.1	1%	0.01	26%	0.255	C	S	.	.	H	α-helix	trans	-68.7	-38.5	-177.1	-71.6	175.6	0	0	0	112.5	N162 A163 L340 I371 A374 T375 F378 L379	N162-L166 VanDerWaalsContact ND2-CD1 3.29Å; N162-L166 WeakPolarHBondContact ND2-CD1 3.28Å; N162-L166 WeakPolarHBondContact O-CB 3.25Å; N162-L166 VanDerWaalsContact O-CG 3.28Å; N162-L166 WeakPolarHBondContact O-CG 3.45Å; N162-L166 PolarHBondContact O-N 2.9Å; A163-L166 PolarHBondContact O-N 3.36Å; L166-L340 HydrophobicContact CD1-CD2 4.28Å; L166-I371 HydrophobicContact CB-CB 4.45Å; L166-I371 HydrophobicContact CB-CD1 4.19Å; L166-I371 HydrophobicContact CB-CG1 3.86Å; L166-I371 HydrophobicContact CB-CG2 3.81Å; L166-I371 HydrophobicContact CD1-CD1 4.22Å; L166-I371 HydrophobicContact CD1-CG2 4.3Å; L166-I371 HydrophobicContact CG-CG2 4.46Å; L166-A374 VanDerWaalsContact O-CB 3.31Å; L166-A374 WeakPolarHBondContact O-CB 3.47Å; L166-T375 HydrophobicContact CD2-CG2 4.43Å; L166-T375 VanDerWaalsContact O-CG2 3.23Å; L166-T375 WeakPolarHBondContact O-CG2 3.05Å; L166-F378 WeakPolarHBondContact CD2-O 3.48Å; L166-L379 HydrophobicContact CD1-CD2 4.25Å
167	T	90.4	Very high	92.2	Very high	11 Å²	11	47.9 Å²	47.9	7%	0.067	28%	0.28	C	S	.	.	H	α-helix	trans	-81.3	-15.3	176.6	56.7	0	0	0	0	113.6	A163 Q164 K169 L367 D370 I371	A163-T167 WeakPolarHBondContact O-CB 3.48Å; A163-T167 WeakPolarHBondContact O-CG2 3.4Å; A163-T167 PolarHBondContact O-N 3.42Å; A163-T167 PolarHBondContact O-OG1 2.76Å; Q164-T167 PolarHBondContact O-OG1 3.01Å; T167-K169 PolarHBondContact O-N 3.4Å; T167-K169 WeakPolarHBondContact OG1-CB 3.23Å; T167-K169 PolarHBondContact OG1-N 2.87Å; T167-L367 HydrophobicContact CG2-CD1 3.63Å; T167-D370 HydrophobicContact CG2-CB 3.99Å; T167-I371 HydrophobicContact CG2-CD1 4.48Å; T167-I371 HydrophobicContact CG2-CG1 3.56Å
168	G	89.2	Confident	92.3	Very high	59 Å²	59	53.5 Å²	53.5	61%	0.608	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	66.2	14.7	-167.6	0	0	0	0	0	114	Q164 R165 P170	Q164-G168 CarbonylContact O-C 3.53Å; Q164-G168 WeakPolarHBondContact O-CA 3.33Å; Q164-G168 PolarHBondContact O-N 3.17Å; R165-G168 PolarHBondContact O-N 3.38Å; G168-P170 WeakPolarHBondContact O-CD 3.41Å
169	K	91	Very high	92.3	Very high	88 Å²	88	50.7 Å²	50.7	38%	0.383	30%	0.295	S	S	.	.			trans	-108.4	95.9	-176.7	-62.3	177.1	-172.2	178.3	0	110.6	Q164 T167 G171 Q172 D370	Q164-K169 WeakPolarHBondContact CG-O 3.38Å; Q164-K169 PolarHBondContact O-N 2.84Å; Q164-K169 VanDerWaalsContact O-N 3.15Å; T167-K169 PolarHBondContact O-N 3.4Å; T167-K169 WeakPolarHBondContact OG1-CB 3.23Å; T167-K169 PolarHBondContact OG1-N 2.87Å; K169-G171 PolarHBondContact O-N 3.16Å; K169-G171 VanDerWaalsContact O-N 3.08Å; K169-Q172 HydrophobicContact CB-CB 4.29Å; K169-Q172 WeakPolarHBondContact O-CB 3.21Å; K169-Q172 PolarHBondContact O-N 2.86Å; K169-D370 IonicContact NZ-OD1 3.72Å; K169-D370 IonicContact NZ-OD2 3.79Å; K169-D370 PolarHBondContact NZ-OD2 3.24Å
170	P	86.4	Confident	92.3	Very high	112 Å²	112	51.8 Å²	51.8	73%	0.727	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.7	-13.1	-176.9	26.6	-35.1	0	0	0	114.6	Q164 G168	Q164-P170 PolarHBondContact NE2-O 3.01Å; G168-P170 WeakPolarHBondContact O-CD 3.41Å
171	G	86.9	Confident	92.1	Very high	67 Å²	67	52.4 Å²	52.4	69%	0.691	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.6	3.7	174.7	0	0	0	0	0	114.4	K169 V173	K169-G171 PolarHBondContact O-N 3.16Å; K169-G171 VanDerWaalsContact O-N 3.08Å; G171-V173 PolarHBondContact O-N 3.42Å
172	Q	89.5	Confident	92.2	Very high	31 Å²	31	50 Å²	50	15%	0.145	30%	0.3	C	S	.	.			trans	-65.2	122.2	177.9	-171.7	66.8	42.8	0	0	109.5	E160 A163 Q164 K169 L367	E160-Q172 WeakPolarHBondContact CG-O 3.23Å; A163-Q172 HydrophobicContact CB-CG 4.43Å; Q164-Q172 HydrophobicContact CG-CB 3.89Å; Q164-Q172 WeakPolarHBondContact CG-O 3.22Å; Q164-Q172 PolarHBondContact NE2-O 2.97Å; K169-Q172 HydrophobicContact CB-CB 4.29Å; K169-Q172 WeakPolarHBondContact O-CB 3.21Å; K169-Q172 PolarHBondContact O-N 2.86Å; Q172-L367 HydrophobicContact CG-CD1 4.27Å
173	V	94.1	Very high	92.3	Very high	95 Å²	95	56.4 Å²	56.4	58%	0.576	33%	0.325	S	S	*	.			trans	-112.1	132.8	176.5	178.1	0	0	0	0	108.3	E160 G171 F363	E160-V173 WeakPolarHBondContact OE2-CA 3.34Å; G171-V173 PolarHBondContact O-N 3.42Å; V173-F363 WeakPolarHBondContact O-CZ 3.38Å
174	L	95.7	Very high	92.4	Very high	5 Å²	5	60.2 Å²	60.2	3%	0.026	34%	0.341	C	S	.	.			trans	-91.8	136.9	175.1	-62.1	-172.8	0	0	0	110.5	A159 E160 A163 L340 W343 F363 L367	A159-L174 VanDerWaalsContact C-CD1 3.41Å; A159-L174 HydrophobicContact CB-CD1 3.72Å; E160-L174 HydrophobicContact CB-CB 4.47Å; E160-L174 HydrophobicContact CB-CD1 4.18Å; E160-L174 HydrophobicContact CB-CG 4.05Å; E160-L174 HydrophobicContact CG-CG 4.35Å; E160-L174 PolarHBondContact OE2-N 2.86Å; A163-L174 HydrophobicContact CB-CD1 4.28Å; A163-L174 HydrophobicContact CB-CD2 3.97Å; A163-L174 HydrophobicContact CB-CG 4.35Å; L174-L340 HydrophobicContact CD1-CD1 3.89Å; L174-W343 HydrophobicContact CB-CZ2 3.99Å; L174-W343 HydrophobicContact CD1-CD2 3.96Å; L174-W343 HydrophobicContact CD1-CE3 4.12Å; L174-W343 HydrophobicContact CD1-CG 4.38Å; L174-W343 HydrophobicContact CD1-CZ3 4.47Å; L174-W343 HydrophobicContact CD2-CH2 4.32Å; L174-W343 HydrophobicContact CD2-CZ3 4.43Å; L174-F363 HydrophobicContact CD2-CE1 3.86Å; L174-F363 HydrophobicContact CD2-CZ 3.9Å; L174-L367 HydrophobicContact CD2-CD2 3.69Å
175	P	95.3	Very high	92.6	Very high	43 Å²	43	63 Å²	63	28%	0.279	36%	0.357	S	S	.	.	S	Bend	trans	-63.4	157.9	166.5	24.8	-26.9	0	0	0	110	W343 L360 F363	P175-W343 HydrophobicContact CG-CH2 4.18Å; P175-W343 HydrophobicContact CG-CZ2 3.81Å; P175-W343 VanDerWaalsContact O-CE2 3.3Å; P175-W343 WeakPolarHBondContact O-CZ2 3.39Å; P175-W343 PolarHBondContact O-NE1 3.19Å; P175-L360 HydrophobicContact CB-CD1 4.33Å; P175-L360 HydrophobicContact CG-CD1 3.55Å; P175-F363 HydrophobicContact CG-CD1 3.96Å; P175-F363 HydrophobicContact CG-CE1 3.97Å; P175-F363 HydrophobicContact CG-CG 4.48Å; P175-F363 HydrophobicContact CG-CZ 4.46Å
176	H	95.4	Very high	93	Very high	57 Å²	57	63.7 Å²	63.7	26%	0.264	37%	0.366	S	S	.	.			trans	51.2	53.1	178.4	-57.7	-69	0	0	0	114.9	E178 L179 W343	H176-E178 WeakPolarHBondContact CA-OE1 3.4Å; H176-E178 VanDerWaalsContact CA-OE2 3.28Å; H176-E178 WeakPolarHBondContact CA-OE2 3.14Å; H176-E178 WeakPolarHBondContact CB-OE1 3.33Å; H176-E178 IonicContact CG-OE1 2.96Å; H176-E178 IonicContact ND1-OE1 3.64Å; H176-E178 PolarHBondContact ND1-OE1 2.88Å; H176-E178 PolarHBondContact O-N 3.23Å; H176-E178 VanDerWaalsContact O-N 3.09Å; H176-L179 HydrophobicContact CB-CD1 3.61Å; H176-L179 HydrophobicContact CB-CG 3.91Å; H176-L179 WeakPolarHBondContact O-CB 3.29Å; H176-L179 PolarHBondContact O-N 3.21Å; H176-W343 PolarHBondContact O-NE1 3.35Å
177	P	93.8	Very high	93.4	Very high	83 Å²	83	65 Å²	65	54%	0.539	37%	0.372	S	S	.	.	G	3₁₀ helix	trans	-60.9	-20.8	-178.6	27.3	-36.4	0	0	0	113.4	L179 C180	P177-L179 PolarHBondContact O-N 3.06Å; P177-C180 WeakPolarHBondContact O-CB 3.48Å; P177-C180 PolarHBondContact O-N 3.46Å
178	E	94.7	Very high	93.8	Very high	130 Å²	130	67.6 Å²	67.6	61%	0.607	38%	0.383	S	S	*	.	G	3₁₀ helix	trans	-62.5	-20.6	173.5	69.2	-77.8	179.8	0	0	114.2	H176 C180	H176-E178 WeakPolarHBondContact CA-OE1 3.4Å; H176-E178 VanDerWaalsContact CA-OE2 3.28Å; H176-E178 WeakPolarHBondContact CA-OE2 3.14Å; H176-E178 WeakPolarHBondContact CB-OE1 3.33Å; H176-E178 IonicContact CG-OE1 2.96Å; H176-E178 IonicContact ND1-OE1 3.64Å; H176-E178 PolarHBondContact ND1-OE1 2.88Å; H176-E178 PolarHBondContact O-N 3.23Å; H176-E178 VanDerWaalsContact O-N 3.09Å; E178-C180 VanDerWaalsContact C-N 3.27Å; E178-C180 PolarHBondContact O-N 3.38Å
179	L	95	Very high	94.2	Very high	38 Å²	38	67.6 Å²	67.6	20%	0.199	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-77.6	-13.1	177.2	-62.8	179.2	0	0	0	113.1	H176 P177 T181 A346 L350	H176-L179 HydrophobicContact CB-CD1 3.61Å; H176-L179 HydrophobicContact CB-CG 3.91Å; H176-L179 WeakPolarHBondContact O-CB 3.29Å; H176-L179 PolarHBondContact O-N 3.21Å; P177-L179 PolarHBondContact O-N 3.06Å; L179-T181 PolarHBondContact O-N 3.11Å; L179-A346 HydrophobicContact CB-CB 3.89Å; L179-A346 HydrophobicContact CD1-CB 4.07Å; L179-A346 HydrophobicContact CD2-CB 4.24Å; L179-A346 HydrophobicContact CG-CB 4.3Å; L179-L350 HydrophobicContact CD1-CD1 3.96Å; L179-L350 HydrophobicContact CD1-CD2 4.16Å; L179-L350 HydrophobicContact CD1-CG 4.15Å; L179-L350 HydrophobicContact CD2-CD2 4.31Å
180	C	94.3	Very high	94.5	Very high	25 Å²	25	63.6 Å²	63.6	17%	0.169	35%	0.352	C	S	.	.			trans	-70.5	118.3	174.7	-179.5	0	0	0	0	110.7	A159 P177 E178 V182	A159-C180 HydrophobicContact CB-CB 4.29Å; A159-C180 PolarHBondContact N-SG 3.22Å; A159-C180 VanDerWaalsContact N-SG 3.37Å; P177-C180 WeakPolarHBondContact O-CB 3.48Å; P177-C180 PolarHBondContact O-N 3.46Å; E178-C180 VanDerWaalsContact C-N 3.27Å; E178-C180 PolarHBondContact O-N 3.38Å; C180-V182 VanDerWaalsContact C-N 3.32Å; C180-V182 PolarHBondContact O-N 2.91Å
181	T	92.2	Very high	94.9	Very high	74 Å²	74	62.7 Å²	62.7	45%	0.454	35%	0.346	S	S	.	.			trans	-85.3	-2	-177.1	77.3	0	0	0	0	114.2	L179 R183 Q342	L179-T181 PolarHBondContact O-N 3.11Å; T181-R183 PolarHBondContact O-N 2.89Å; T181-Q342 VanDerWaalsContact OG1-CD 3.27Å; T181-Q342 PolarHBondContact OG1-NE2 2.89Å; T181-Q342 PolarHBondContact OG1-OE1 3.21Å
182	V	94.6	Very high	95.3	Very high	12 Å²	12	65.5 Å²	65.5	7%	0.073	34%	0.341	C	S	.	.			trans	-72.6	121.1	-174.1	178.3	0	0	0	0	111.4	K158 C180 K184	K158-V182 HydrophobicContact CG-CB 4.4Å; C180-V182 VanDerWaalsContact C-N 3.32Å; C180-V182 PolarHBondContact O-N 2.91Å; V182-K184 HydrophobicContact CG1-CG 4.16Å
183	R	94.6	Very high	95.6	Very high	137 Å²	137	64.4 Å²	64.4	52%	0.517	34%	0.337	S	S	.	.			trans	-106.1	80.2	-176.7	-67.8	-63.3	-59.6	-86.2	-5.4	112	T181 D185 L186 H187	T181-R183 PolarHBondContact O-N 2.89Å; R183-D185 IonicContact CZ-OD1 3.95Å; R183-D185 IonicContact CZ-OD2 3.65Å; R183-D185 IonicContact NE-OD1 3.68Å; R183-D185 PolarHBondContact NE-OD1 2.91Å; R183-D185 IonicContact NE-OD2 3.54Å; R183-D185 IonicContact NH2-OD1 3.15Å; R183-D185 IonicContact NH2-OD2 3.81Å; R183-D185 PolarHBondContact NH2-OD2 3.19Å; R183-D185 PolarHBondContact O-N 3.16Å; R183-L186 HydrophobicContact CB-CB 4.46Å; R183-L186 HydrophobicContact CB-CD1 3.85Å; R183-L186 HydrophobicContact CB-CG 4.04Å; R183-L186 HydrophobicContact CG-CD1 4.42Å; R183-L186 PolarHBondContact O-N 3.27Å; R183-H187 PolarHBondContact O-CD2 3.25Å; R183-H187 VanDerWaalsContact O-CD2 3.27Å; R183-H187 PolarHBondContact O-NE2 3.47Å
184	K	95.9	Very high	95.6	Very high	80 Å²	80	65.2 Å²	65.2	35%	0.348	33%	0.334	S	S	.	.	G	3₁₀ helix	trans	-60.1	-26.3	-178.3	-60.3	-174.9	74.7	159	0	113.7	K158 E161 V182 L186 H187	K158-K184 HydrophobicContact CG-CD 4.14Å; E161-K184 IonicContact OE1-NZ 2.9Å; E161-K184 PolarHBondContact OE1-NZ 3.21Å; E161-K184 IonicContact OE2-NZ 3.56Å; E161-K184 PolarHBondContact OE2-NZ 2.93Å; V182-K184 HydrophobicContact CG1-CG 4.16Å; K184-L186 PolarHBondContact O-N 3.14Å; K184-H187 WeakPolarHBondContact O-CB 3.41Å; K184-H187 PolarHBondContact O-N 3.32Å
185	D	96.7	Very high	95.6	Very high	105 Å²	105	66.8 Å²	66.8	56%	0.561	34%	0.344	S	S	*	.	G	3₁₀ helix	trans	-64.3	-22.8	175.7	59	-61.7	0	0	0	113.5	R183	R183-D185 IonicContact CZ-OD1 3.95Å; R183-D185 IonicContact CZ-OD2 3.65Å; R183-D185 IonicContact NE-OD1 3.68Å; R183-D185 PolarHBondContact NE-OD1 2.91Å; R183-D185 IonicContact NE-OD2 3.54Å; R183-D185 IonicContact NH2-OD1 3.15Å; R183-D185 IonicContact NH2-OD2 3.81Å; R183-D185 PolarHBondContact NH2-OD2 3.19Å; R183-D185 PolarHBondContact O-N 3.16Å
186	L	97.6	Very high	95.7	Very high	84 Å²	84	67.8 Å²	67.8	44%	0.44	35%	0.346	S	S	.	.	G	3₁₀ helix	trans	-92.5	-10	178.4	-59.1	-179.1	0	0	0	113.4	R183 K184 C198 S199	R183-L186 HydrophobicContact CB-CB 4.46Å; R183-L186 HydrophobicContact CB-CD1 3.85Å; R183-L186 HydrophobicContact CB-CG 4.04Å; R183-L186 HydrophobicContact CG-CD1 4.42Å; R183-L186 PolarHBondContact O-N 3.27Å; K184-L186 PolarHBondContact O-N 3.14Å; L186-C198 CarbonylContact C-O 3.55Å; L186-S199 WeakPolarHBondContact O-CA 3.47Å
187	H	98.1	Very high	95.8	Very high	29 Å²	29	65 Å²	65	13%	0.134	33%	0.333	C	S	.	.			trans	-61.2	144.4	-175.3	-66.8	177.1	0	0	0	111.2	L156 R183 K184 M196 Y197	L156-H187 PolarHBondContact O-CE1 2.9Å; R183-H187 PolarHBondContact O-CD2 3.25Å; R183-H187 VanDerWaalsContact O-CD2 3.27Å; R183-H187 PolarHBondContact O-NE2 3.47Å; K184-H187 WeakPolarHBondContact O-CB 3.41Å; K184-H187 PolarHBondContact O-N 3.32Å; H187-M196 HydrophobicContact CB-CE 3.9Å; H187-Y197 WeakPolarHBondContact CA-O 3.19Å
188	Q	98.1	Very high	96	Very high	66 Å²	66	61.8 Å²	61.8	31%	0.308	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.9	154.2	-179.5	-66.4	-67.2	-59.4	0	0	109.4	M196 Y197 A200	Q188-M196 CarbonylContact O-C 3.54Å; Q188-Y197 PolarHBondContact N-O 3.42Å; Q188-Y197 PolarHBondContact O-N 3.4Å; Q188-A200 HydrophobicContact CG-CB 4.3Å
189	N	97.6	Very high	96.1	Very high	58 Å²	58	56.4 Å²	56.4	31%	0.31	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	152.6	170.8	-65.3	68.4	0	0	0	109.7	Q194 V195 M196 R203	N189-Q194 PolarHBondContact ND2-O 2.72Å; N189-V195 CarbonylContact C-O 3.57Å; N189-V195 WeakPolarHBondContact CA-O 3.43Å; N189-M196 PolarHBondContact ND2-SD 2.83Å; N189-M196 PolarHBondContact OD1-SD 3.42Å; N189-M196 VanDerWaalsContact OD1-SD 3.39Å; N189-R203 VanDerWaalsContact O-CD 3.28Å; N189-R203 WeakPolarHBondContact O-CD 3.31Å; N189-R203 PolarHBondContact O-NH1 3.44Å
190	C	97.3	Very high	96.3	Very high	5 Å²	5	56.2 Å²	56.2	3%	0.034	29%	0.293	C	S	.	.			trans	-63.2	128.2	157.3	176.7	0	0	0	0	108.6	H192 Q194 V195 Y197 H211	C190-H192 PolarHBondContact O-N 3.36Å; C190-H192 VanDerWaalsContact O-N 3.16Å; C190-H192 PolarHBondContact SG-N 3.22Å; C190-H192 VanDerWaalsContact SG-N 3.44Å; C190-Q194 VanDerWaalsContact O-CA 3.25Å; C190-Q194 WeakPolarHBondContact O-CA 3.25Å; C190-Q194 PolarHBondContact O-N 2.97Å; C190-V195 HydrophobicContact CB-CG1 3.85Å; C190-V195 PolarHBondContact N-O 2.87Å; C190-Y197 HydrophobicContact CB-CE2 4.19Å; C190-H211 PolarHBondContact SG-NE2 2.99Å
191	P	95.9	Very high	96.5	Very high	92 Å²	92	61.3 Å²	61.3	60%	0.597	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.3	-15.2	-179.4	27.2	-34.4	0	0	0	113.5	Q194	P191-Q194 PolarHBondContact O-NE2 2.86Å
192	H	95.1	Very high	96.7	Very high	127 Å²	127	58.6 Å²	58.6	59%	0.588	30%	0.298	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-51.1	-175.7	-58	-68.7	0	0	0	113	C190 G217	C190-H192 PolarHBondContact O-N 3.36Å; C190-H192 VanDerWaalsContact O-N 3.16Å; C190-H192 PolarHBondContact SG-N 3.22Å; C190-H192 VanDerWaalsContact SG-N 3.44Å; H192-G217 CarbonylContact O-C 3.54Å
193	C	95.3	Very high	96.9	Very high	7 Å²	7	61.3 Å²	61.3	5%	0.047	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-110	2.4	-176	75.2	0	0	0	0	114.2	V195 H211 P216 G217 Q220	C193-V195 PolarHBondContact O-N 3.38Å; C193-H211 VanDerWaalsContact SG-CE1 3.56Å; C193-P216 HydrophobicContact CB-CG 4.02Å; C193-G217 WeakPolarHBondContact CA-O 3.33Å; C193-Q220 HydrophobicContact CB-CB 4.37Å; C193-Q220 VanDerWaalsContact CB-OE1 3.32Å
194	Q	95.3	Very high	97.1	Very high	113 Å²	113	59.1 Å²	59.1	53%	0.528	31%	0.305	S	S	.	.			trans	63.5	4.2	177.7	-56.2	-58.2	-45.3	0	0	116.6	N189 C190 P191	N189-Q194 PolarHBondContact ND2-O 2.72Å; C190-Q194 VanDerWaalsContact O-CA 3.25Å; C190-Q194 WeakPolarHBondContact O-CA 3.25Å; C190-Q194 PolarHBondContact O-N 2.97Å; P191-Q194 PolarHBondContact O-NE2 2.86Å
195	V	95.1	Very high	97.2	Very high	37 Å²	37	57 Å²	57	22%	0.224	30%	0.302	C	S	.	.			trans	-57.1	142	174.8	78.4	0	0	0	0	111.4	D150 N189 C190 C193 Y197 H211	D150-V195 HydrophobicContact CB-CG1 4.48Å; D150-V195 HydrophobicContact CB-CG2 3.68Å; N189-V195 CarbonylContact C-O 3.57Å; N189-V195 WeakPolarHBondContact CA-O 3.43Å; C190-V195 HydrophobicContact CB-CG1 3.85Å; C190-V195 PolarHBondContact N-O 2.87Å; C193-V195 PolarHBondContact O-N 3.38Å; V195-Y197 HydrophobicContact CG1-CE2 3.65Å; V195-Y197 VanDerWaalsContact CG1-OH 3.31Å; V195-Y197 WeakPolarHBondContact CG1-OH 3.33Å; V195-H211 VanDerWaalsContact CG1-CE1 3.49Å; V195-H211 WeakPolarHBondContact CG1-CE1 3.45Å
196	M	96.8	Very high	97.3	Very high	64 Å²	64	52 Å²	52	32%	0.315	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.6	145.3	-170.1	-63.8	-77.8	-54.8	0	0	113.4	D150 L156 H187 Q188 N189	D150-M196 PolarHBondContact N-O 3.14Å; L156-M196 HydrophobicContact CD1-CB 3.35Å; L156-M196 HydrophobicContact CD1-CE 4.3Å; L156-M196 HydrophobicContact CD1-CG 4.2Å; H187-M196 HydrophobicContact CB-CE 3.9Å; Q188-M196 CarbonylContact O-C 3.54Å; N189-M196 PolarHBondContact ND2-SD 2.83Å; N189-M196 PolarHBondContact OD1-SD 3.42Å; N189-M196 VanDerWaalsContact OD1-SD 3.39Å
197	Y	98.3	Very high	97.3	Very high	0 Å²	0	50 Å²	50	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	146.2	172.7	-58	-84.1	0	0	0	110.4	D150 H151 H187 Q188 C190 V195 S199 C202 R203 A206 H211	D150-Y197 HydrophobicContact CB-CD1 4.29Å; D150-Y197 HydrophobicContact CB-CE1 3.74Å; D150-Y197 PolarHBondContact OD2-OH 2.8Å; H151-Y197 HydrophobicContact CB-CD1 4.05Å; H151-Y197 HydrophobicContact CB-CE1 4.2Å; H187-Y197 WeakPolarHBondContact CA-O 3.19Å; Q188-Y197 PolarHBondContact N-O 3.42Å; Q188-Y197 PolarHBondContact O-N 3.4Å; C190-Y197 HydrophobicContact CB-CE2 4.19Å; V195-Y197 HydrophobicContact CG1-CE2 3.65Å; V195-Y197 VanDerWaalsContact CG1-OH 3.31Å; V195-Y197 WeakPolarHBondContact CG1-OH 3.33Å; Y197-S199 PolarHBondContact O-N 2.93Å; Y197-C202 HydrophobicContact CD1-CB 4.33Å; Y197-R203 HydrophobicContact CD1-CB 4.34Å; Y197-R203 HydrophobicContact CD2-CB 3.61Å; Y197-R203 HydrophobicContact CD2-CG 3.61Å; Y197-R203 HydrophobicContact CE2-CB 4.15Å; Y197-R203 HydrophobicContact CE2-CG 3.74Å; Y197-R203 HydrophobicContact CG-CB 3.71Å; Y197-R203 HydrophobicContact CG-CG 4.24Å; Y197-A206 HydrophobicContact CD1-CB 4.32Å; Y197-A206 HydrophobicContact CE1-CB 3.44Å; Y197-A206 VanDerWaalsContact CE1-CB 3.44Å; Y197-H211 PolarHBondContact OH-CE1 2.86Å; Y197-H211 VanDerWaalsContact OH-CG 3.3Å; Y197-H211 PolarHBondContact OH-ND1 2.86Å
198	C	97.4	Very high	97.3	Very high	14 Å²	14	55.5 Å²	55.5	10%	0.095	29%	0.293	C	S	.	.	S	Bend	trans	-71.8	-18.1	179	65.4	0	0	0	0	113.2	C149 C152 R154 L156 L186 C202	C149-C198 HydrophobicContact CB-CB 4.04Å; C149-C198 PolarHBondContact SG-N 3.13Å; C149-C198 VanDerWaalsContact SG-N 3.4Å; C152-C198 PolarHBondContact SG-SG 3.2Å; R154-C198 HydrophobicContact CG-CB 4.48Å; L156-C198 HydrophobicContact CD2-CB 3.6Å; L186-C198 CarbonylContact C-O 3.55Å; C198-C202 PolarHBondContact SG-SG 3.35Å
199	S	97.9	Very high	97.3	Very high	17 Å²	17	54.3 Å²	54.3	12%	0.119	29%	0.287	C	S	.	.	S	Bend	trans	-158.1	169.6	179.6	83.9	0	0	0	0	112.5	L186 Y197 E201 C202 R203	L186-S199 WeakPolarHBondContact O-CA 3.47Å; Y197-S199 PolarHBondContact O-N 2.93Å; S199-E201 VanDerWaalsContact C-N 3.31Å; S199-E201 WeakPolarHBondContact CB-OE2 3.32Å; S199-E201 PolarHBondContact OG-N 3Å; S199-E201 PolarHBondContact OG-OE2 3.19Å; S199-C202 PolarHBondContact O-N 3.33Å; S199-C202 PolarHBondContact OG-N 3.01Å; S199-R203 PolarHBondContact O-N 2.73Å; S199-R203 VanDerWaalsContact O-N 3.16Å
200	A	98.3	Very high	97.3	Very high	34 Å²	34	51.7 Å²	51.7	28%	0.281	27%	0.273	S	S	.	.	H	α-helix	trans	-63.2	-37.2	173	0	0	0	0	0	112.2	Q188 R203 L204	Q188-A200 HydrophobicContact CG-CB 4.3Å; A200-R203 PolarHBondContact O-N 2.86Å; A200-L204 WeakPolarHBondContact O-CB 3.15Å; A200-L204 VanDerWaalsContact O-CG 3.31Å; A200-L204 WeakPolarHBondContact O-CG 3.41Å; A200-L204 PolarHBondContact O-N 2.8Å
201	E	97.8	Very high	97.3	Very high	133 Å²	133	52 Å²	52	62%	0.621	27%	0.274	S	S	*	.	H	α-helix	trans	-62.6	-44.5	177.2	-58.4	72.5	-156.4	0	0	110.9	S199 L204 A205	S199-E201 VanDerWaalsContact C-N 3.31Å; S199-E201 WeakPolarHBondContact CB-OE2 3.32Å; S199-E201 PolarHBondContact OG-N 3Å; S199-E201 PolarHBondContact OG-OE2 3.19Å; E201-L204 PolarHBondContact O-N 2.99Å; E201-A205 VanDerWaalsContact O-CB 3.29Å; E201-A205 WeakPolarHBondContact O-CB 3.31Å; E201-A205 PolarHBondContact O-N 3.44Å
202	C	98.3	Very high	97.4	Very high	17 Å²	17	53.9 Å²	53.9	12%	0.115	27%	0.274	C	S	.	.	H	α-helix	trans	-64.2	-40.4	176.3	-80.8	0	0	0	0	112.3	H151 Y197 C198 S199 A206	H151-C202 HydrophobicContact CB-CB 4Å; Y197-C202 HydrophobicContact CD1-CB 4.33Å; C198-C202 PolarHBondContact SG-SG 3.35Å; S199-C202 PolarHBondContact O-N 3.33Å; S199-C202 PolarHBondContact OG-N 3.01Å; C202-A206 WeakPolarHBondContact O-CB 3.42Å; C202-A206 PolarHBondContact O-N 3.44Å
203	R	98.5	Very high	97.5	Very high	68 Å²	68	49.9 Å²	49.9	26%	0.257	26%	0.259	S	S	.	.	H	α-helix	trans	-62.6	-46.5	175.6	-174.9	-177.6	71	-159.7	-6	111.4	N189 Y197 S199 A200 T207	N189-R203 VanDerWaalsContact O-CD 3.28Å; N189-R203 WeakPolarHBondContact O-CD 3.31Å; N189-R203 PolarHBondContact O-NH1 3.44Å; Y197-R203 HydrophobicContact CD1-CB 4.34Å; Y197-R203 HydrophobicContact CD2-CB 3.61Å; Y197-R203 HydrophobicContact CD2-CG 3.61Å; Y197-R203 HydrophobicContact CE2-CB 4.15Å; Y197-R203 HydrophobicContact CE2-CG 3.74Å; Y197-R203 HydrophobicContact CG-CB 3.71Å; Y197-R203 HydrophobicContact CG-CG 4.24Å; S199-R203 PolarHBondContact O-N 2.73Å; S199-R203 VanDerWaalsContact O-N 3.16Å; A200-R203 PolarHBondContact O-N 2.86Å; R203-T207 WeakPolarHBondContact O-CB 3.48Å; R203-T207 PolarHBondContact O-N 3.19Å; R203-T207 PolarHBondContact O-OG1 3.22Å
204	L	98.3	Very high	97.6	Very high	92 Å²	92	50.3 Å²	50.3	48%	0.482	26%	0.26	S	S	.	.	H	α-helix	trans	-64.6	-47.1	179.4	-71	172.3	0	0	0	111.3	A200 E201 A206 T207 E208	A200-L204 WeakPolarHBondContact O-CB 3.15Å; A200-L204 VanDerWaalsContact O-CG 3.31Å; A200-L204 WeakPolarHBondContact O-CG 3.41Å; A200-L204 PolarHBondContact O-N 2.8Å; E201-L204 PolarHBondContact O-N 2.99Å; L204-A206 VanDerWaalsContact C-N 3.34Å; L204-A206 PolarHBondContact O-N 3.16Å; L204-T207 WeakPolarHBondContact O-CB 3.36Å; L204-T207 PolarHBondContact O-N 2.95Å; L204-T207 VanDerWaalsContact O-N 3.14Å; L204-E208 WeakPolarHBondContact O-CG 3.26Å; L204-E208 PolarHBondContact O-N 3.26Å
205	A	97.9	Very high	97.7	Very high	34 Å²	34	46.3 Å²	46.3	28%	0.281	25%	0.245	S	C	.	.	H	α-helix	trans	-58.5	-44.9	177.1	0	0	0	0	0	111.9	E201 E208 Q209	E201-A205 VanDerWaalsContact O-CB 3.29Å; E201-A205 WeakPolarHBondContact O-CB 3.31Å; E201-A205 PolarHBondContact O-N 3.44Å; A205-E208 PolarHBondContact O-N 3.42Å; A205-Q209 VanDerWaalsContact O-CB 3.25Å; A205-Q209 WeakPolarHBondContact O-CB 3.49Å; A205-Q209 PolarHBondContact O-N 3.32Å
206	A	98.4	Very high	97.7	Very high	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-60.9	-46.8	174.1	0	0	0	0	0	112.2	H151 Y197 C202 L204 E208 Q209 Y210 H211	H151-A206 HydrophobicContact CB-CB 4.13Å; Y197-A206 HydrophobicContact CD1-CB 4.32Å; Y197-A206 HydrophobicContact CE1-CB 3.44Å; Y197-A206 VanDerWaalsContact CE1-CB 3.44Å; C202-A206 WeakPolarHBondContact O-CB 3.42Å; C202-A206 PolarHBondContact O-N 3.44Å; L204-A206 VanDerWaalsContact C-N 3.34Å; L204-A206 PolarHBondContact O-N 3.16Å; A206-E208 PolarHBondContact O-N 3.26Å; A206-Q209 PolarHBondContact O-N 3.38Å; A206-Y210 HydrophobicContact CB-CE1 4.04Å; A206-Y210 HydrophobicContact CB-CE2 4.23Å; A206-Y210 VanDerWaalsContact CB-OH 3.25Å; A206-Y210 WeakPolarHBondContact CB-OH 3.36Å; A206-Y210 PolarHBondContact O-N 3.02Å; A206-H211 HydrophobicContact CB-CB 4.11Å; A206-H211 VanDerWaalsContact O-CB 3.23Å; A206-H211 WeakPolarHBondContact O-CB 3.32Å; A206-H211 PolarHBondContact O-N 3.17Å
207	T	98.1	Very high	97.5	Very high	43 Å²	43	42.7 Å²	42.7	26%	0.264	23%	0.228	S	C	.	.	I	π-helix	trans	-58.4	-46.5	179	-59.1	0	0	0	0	111.3	R203 L204 Q212 Q258	R203-T207 WeakPolarHBondContact O-CB 3.48Å; R203-T207 PolarHBondContact O-N 3.19Å; R203-T207 PolarHBondContact O-OG1 3.22Å; L204-T207 WeakPolarHBondContact O-CB 3.36Å; L204-T207 PolarHBondContact O-N 2.95Å; L204-T207 VanDerWaalsContact O-N 3.14Å; T207-Q212 HydrophobicContact CG2-CG 3.89Å; T207-Q212 WeakPolarHBondContact O-CG 3.5Å; T207-Q212 PolarHBondContact O-NE2 3.12Å; T207-Q258 PolarHBondContact O-NE2 3.38Å
208	E	97.3	Very high	97.2	Very high	145 Å²	145	48.9 Å²	48.9	68%	0.678	27%	0.268	S	S	*	.	I	π-helix	trans	-67.9	-36.1	179.8	-71.7	177.5	-178.6	0	0	112.3	L204 A205 A206 Q258	L204-E208 WeakPolarHBondContact O-CG 3.26Å; L204-E208 PolarHBondContact O-N 3.26Å; A205-E208 PolarHBondContact O-N 3.42Å; A206-E208 PolarHBondContact O-N 3.26Å; E208-Q258 PolarHBondContact O-NE2 2.87Å
209	Q	97.8	Very high	97	Very high	40 Å²	40	50.2 Å²	50.2	19%	0.187	28%	0.278	C	S	.	.	I	π-helix	trans	-87.2	-54.8	-172.1	-170.3	175.9	-5.8	0	0	114	L133 A205 A206 T255 Q258 W265	L133-Q209 PolarHBondContact O-NE2 3.43Å; A205-Q209 VanDerWaalsContact O-CB 3.25Å; A205-Q209 WeakPolarHBondContact O-CB 3.49Å; A205-Q209 PolarHBondContact O-N 3.32Å; A206-Q209 PolarHBondContact O-N 3.38Å; Q209-T255 HydrophobicContact CG-CG2 3.83Å; Q209-T255 WeakPolarHBondContact O-CA 3.47Å; Q209-Q258 PolarHBondContact O-NE2 3.3Å; Q209-W265 HydrophobicContact CG-CH2 4.38Å
210	Y	98.3	Very high	96.6	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.016	29%	0.288	C	S	.	.	I	π-helix	trans	-144.6	-19.5	-169.2	63.4	-99.6	0	0	0	114.9	D150 H151 A206 Q212 V213 L214 R251 Q258	D150-Y210 PolarHBondContact O-OH 3.06Å; D150-Y210 PolarHBondContact OD2-OH 3.34Å; H151-Y210 WeakPolarHBondContact CA-OH 3.34Å; H151-Y210 AromaticContact ND1-CE1 3.67Å; A206-Y210 HydrophobicContact CB-CE1 4.04Å; A206-Y210 HydrophobicContact CB-CE2 4.23Å; A206-Y210 VanDerWaalsContact CB-OH 3.25Å; A206-Y210 WeakPolarHBondContact CB-OH 3.36Å; A206-Y210 PolarHBondContact O-N 3.02Å; Y210-Q212 PolarHBondContact O-N 2.91Å; Y210-V213 PolarHBondContact O-N 3.3Å; Y210-L214 HydrophobicContact CD2-CD1 3.95Å; Y210-L214 PolarHBondContact O-N 3.4Å; Y210-R251 HydrophobicContact CD2-CG 4.21Å; Y210-R251 VanDerWaalsContact CE2-CZ 3.44Å; Y210-R251 HydrophobicContact CG-CG 4.25Å; Y210-R251 PolarHBondContact OH-NH1 3.42Å; Y210-R251 PolarHBondContact OH-NH2 3.17Å; Y210-Q258 PolarHBondContact O-OE1 3.5Å
211	H	98.3	Very high	96.1	Very high	12 Å²	12	58.4 Å²	58.4	6%	0.056	31%	0.314	C	S	.	.	I	π-helix	trans	-76.6	-26.1	-164.9	-178	70.9	0	0	0	113.1	C190 C193 V195 Y197 A206 V213 L214 C215	C190-H211 PolarHBondContact SG-NE2 2.99Å; C193-H211 VanDerWaalsContact SG-CE1 3.56Å; V195-H211 VanDerWaalsContact CG1-CE1 3.49Å; V195-H211 WeakPolarHBondContact CG1-CE1 3.45Å; Y197-H211 PolarHBondContact OH-CE1 2.86Å; Y197-H211 VanDerWaalsContact OH-CG 3.3Å; Y197-H211 PolarHBondContact OH-ND1 2.86Å; A206-H211 HydrophobicContact CB-CB 4.11Å; A206-H211 VanDerWaalsContact O-CB 3.23Å; A206-H211 WeakPolarHBondContact O-CB 3.32Å; A206-H211 PolarHBondContact O-N 3.17Å; H211-V213 PolarHBondContact O-N 3.32Å; H211-L214 CarbonylContact O-C 3.49Å; H211-L214 PolarHBondContact O-N 3.37Å; H211-C215 WeakPolarHBondContact O-CA 3.46Å; H211-C215 WeakPolarHBondContact O-CB 3.44Å; H211-C215 PolarHBondContact O-N 3Å
212	Q	97.3	Very high	95.9	Very high	130 Å²	130	54.9 Å²	54.9	61%	0.607	30%	0.299	S	S	*	.	H	α-helix	trans	-61.5	-36.4	175	-65.1	170.4	55.9	0	0	112	T207 Y210 Q258	T207-Q212 HydrophobicContact CG2-CG 3.89Å; T207-Q212 WeakPolarHBondContact O-CG 3.5Å; T207-Q212 PolarHBondContact O-NE2 3.12Å; Y210-Q212 PolarHBondContact O-N 2.91Å; Q212-Q258 VanDerWaalsContact CA-OE1 3.3Å; Q212-Q258 VanDerWaalsContact CB-OE1 3.28Å
213	V	97.6	Very high	95.7	Very high	43 Å²	43	58.8 Å²	58.8	26%	0.261	32%	0.324	S	S	.	.	H	α-helix	trans	-77.6	-37.2	176.3	168.3	0	0	0	0	111.6	Y210 H211 A254 K257 Q258 L307	Y210-V213 PolarHBondContact O-N 3.3Å; H211-V213 PolarHBondContact O-N 3.32Å; V213-A254 HydrophobicContact CB-CB 3.93Å; V213-A254 HydrophobicContact CG1-CB 3.78Å; V213-K257 HydrophobicContact CG1-CD 4.01Å; V213-K257 HydrophobicContact CG2-CB 4.17Å; V213-K257 HydrophobicContact CG2-CD 4.11Å; V213-K257 HydrophobicContact CG2-CG 3.86Å; V213-Q258 HydrophobicContact CB-CG 4.3Å; V213-Q258 HydrophobicContact CG2-CG 3.49Å; V213-Q258 VanDerWaalsContact CG2-CG 3.49Å; V213-L307 HydrophobicContact CG1-CD2 4.18Å
214	L	97.8	Very high	95.5	Very high	16 Å²	16	61.2 Å²	61.2	8%	0.084	34%	0.342	C	S	.	.	H	α-helix	trans	-90.8	-6.1	-176.7	-62.6	-174.2	0	0	0	114.7	Y210 H211 P216 L227 A250 R251 A254 L307	Y210-L214 HydrophobicContact CD2-CD1 3.95Å; Y210-L214 PolarHBondContact O-N 3.4Å; H211-L214 CarbonylContact O-C 3.49Å; H211-L214 PolarHBondContact O-N 3.37Å; L214-P216 WeakPolarHBondContact O-CD 3.11Å; L214-L227 HydrophobicContact CB-CD1 4.45Å; L214-L227 HydrophobicContact CD2-CD1 4.11Å; L214-L227 HydrophobicContact CD2-CD2 4.11Å; L214-L227 WeakPolarHBondContact O-CD1 3.29Å; L214-A250 HydrophobicContact CD1-CB 4.48Å; L214-A250 HydrophobicContact CD2-CB 4.24Å; L214-R251 HydrophobicContact CD1-CG 3.68Å; L214-A254 HydrophobicContact CD1-CB 3.93Å; L214-A254 HydrophobicContact CD2-CB 3.89Å; L214-A254 HydrophobicContact CG-CB 3.58Å; L214-L307 HydrophobicContact CD2-CD2 3.53Å
215	C	96.9	Very high	95.4	Very high	29 Å²	29	58.7 Å²	58.7	20%	0.196	33%	0.327	C	S	.	.			trans	-73.9	114.3	179.8	-179.2	0	0	0	0	109.2	H211 G217	H211-C215 WeakPolarHBondContact O-CA 3.46Å; H211-C215 WeakPolarHBondContact O-CB 3.44Å; H211-C215 PolarHBondContact O-N 3Å; C215-G217 PolarHBondContact O-N 3.28Å; C215-G217 PolarHBondContact SG-N 2.91Å; C215-G217 VanDerWaalsContact SG-N 3.39Å
216	P	93.8	Very high	95.3	Very high	16 Å²	16	59 Å²	59	10%	0.104	33%	0.326	C	S	.	.			trans	-75.7	-4.9	175.3	34.1	-36.3	0	0	0	111.9	C193 L214 S219 Q220	C193-P216 HydrophobicContact CB-CG 4.02Å; L214-P216 WeakPolarHBondContact O-CD 3.11Å; P216-S219 WeakPolarHBondContact O-CB 3.37Å; P216-S219 PolarHBondContact O-N 2.91Å; P216-Q220 HydrophobicContact CG-CB 3.89Å; P216-Q220 HydrophobicContact CG-CG 4.33Å
217	G	94.2	Very high	95.2	Very high	9 Å²	9	59.4 Å²	59.4	9%	0.093	33%	0.328	C	S	.	.	G	3₁₀ helix	trans	55	-133.4	-177	0	0	0	0	0	111.8	H192 C193 C215 S219 Q220	H192-G217 CarbonylContact O-C 3.54Å; C193-G217 WeakPolarHBondContact CA-O 3.33Å; C215-G217 PolarHBondContact O-N 3.28Å; C215-G217 PolarHBondContact SG-N 2.91Å; C215-G217 VanDerWaalsContact SG-N 3.39Å; G217-S219 PolarHBondContact O-N 3.49Å; G217-Q220 PolarHBondContact O-N 2.92Å
218	P	91.8	Very high	95.1	Very high	130 Å²	130	58.3 Å²	58.3	84%	0.844	32%	0.321	S	S	*	.	G	3₁₀ helix	trans	-62.6	-16.9	176.2	-21.8	33.8	0	0	0	114.6	Q220	P218-Q220 PolarHBondContact O-N 3.39Å
219	S	93.3	Very high	95.1	Very high	43 Å²	43	54.7 Å²	54.7	30%	0.301	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-86.2	15.5	178.9	-61.7	0	0	0	0	113	P216 G217 D221 D222 N228	P216-S219 WeakPolarHBondContact O-CB 3.37Å; P216-S219 PolarHBondContact O-N 2.91Å; G217-S219 PolarHBondContact O-N 3.49Å; S219-D221 PolarHBondContact O-N 3.43Å; S219-D222 WeakPolarHBondContact O-CB 3.2Å; S219-D222 PolarHBondContact O-N 2.83Å; S219-N228 PolarHBondContact O-ND2 2.84Å
220	Q	88.8	Confident	95	Very high	70 Å²	70	52.8 Å²	52.8	33%	0.327	29%	0.294	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.3	-41.3	178.7	-179.7	71.6	43.2	0	0	112.3	C193 P216 G217 P218 N228	C193-Q220 HydrophobicContact CB-CB 4.37Å; C193-Q220 VanDerWaalsContact CB-OE1 3.32Å; P216-Q220 HydrophobicContact CG-CB 3.89Å; P216-Q220 HydrophobicContact CG-CG 4.33Å; G217-Q220 PolarHBondContact O-N 2.92Å; P218-Q220 PolarHBondContact O-N 3.39Å; Q220-N228 PolarHBondContact O-ND2 3.11Å
221	D	88.2	Confident	94.8	Very high	152 Å²	152	54.4 Å²	54.4	81%	0.813	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.3	7.7	-178.9	-56.2	-46.8	0	0	0	113.3	S219 P223	S219-D221 PolarHBondContact O-N 3.43Å; D221-P223 VanDerWaalsContact O-CD 3.28Å; D221-P223 WeakPolarHBondContact O-CD 3.04Å
222	D	93.9	Very high	94.5	Very high	59 Å²	59	59 Å²	59	32%	0.316	32%	0.324	S	S	.	.			trans	-81.7	111.7	179.1	179.2	3.1	0	0	0	110.4	S219 L224 H225 N228	S219-D222 WeakPolarHBondContact O-CB 3.2Å; S219-D222 PolarHBondContact O-N 2.83Å; D222-L224 PolarHBondContact O-N 2.82Å; D222-L224 VanDerWaalsContact O-N 3.16Å; D222-L224 WeakPolarHBondContact OD1-CB 3.35Å; D222-L224 PolarHBondContact OD1-N 3.18Å; D222-H225 HydrophobicContact CB-CB 4.26Å; D222-H225 VanDerWaalsContact O-CB 3.3Å; D222-H225 WeakPolarHBondContact O-CB 3.48Å; D222-H225 PolarHBondContact O-N 3.46Å; D222-H225 VanDerWaalsContact O-N 3.09Å; D222-N228 WeakPolarHBondContact O-CB 3.39Å; D222-N228 PolarHBondContact O-ND2 2.94Å
223	P	92.8	Very high	94.2	Very high	99 Å²	99	53.3 Å²	53.3	64%	0.643	30%	0.299	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-17.4	-180	29	-36	0	0	0	112.9	D221 K229	D221-P223 VanDerWaalsContact O-CD 3.28Å; D221-P223 WeakPolarHBondContact O-CD 3.04Å; P223-K229 WeakPolarHBondContact O-CG 3.46Å
224	L	94.8	Very high	93.9	Very high	120 Å²	120	51.3 Å²	51.3	63%	0.628	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.2	-10.9	177.6	-59.6	-179.1	0	0	0	113.1	D222 K229	D222-L224 PolarHBondContact O-N 2.82Å; D222-L224 VanDerWaalsContact O-N 3.16Å; D222-L224 WeakPolarHBondContact OD1-CB 3.35Å; D222-L224 PolarHBondContact OD1-N 3.18Å; L224-K229 WeakPolarHBondContact O-CE 3.31Å
225	H	96.3	Very high	93.4	Very high	39 Å²	39	53.1 Å²	53.1	18%	0.181	29%	0.292	C	S	.	.	S	Bend	trans	-60.1	132.4	176.6	-173.8	-89.1	0	0	0	110.1	D222 L227 N228 K229	D222-H225 HydrophobicContact CB-CB 4.26Å; D222-H225 VanDerWaalsContact O-CB 3.3Å; D222-H225 WeakPolarHBondContact O-CB 3.48Å; D222-H225 PolarHBondContact O-N 3.46Å; D222-H225 VanDerWaalsContact O-N 3.09Å; H225-L227 VanDerWaalsContact C-N 3.3Å; H225-L227 PolarHBondContact ND1-N 2.97Å; H225-L227 PolarHBondContact O-N 3.15Å; H225-N228 HydrophobicContact CB-CB 4.14Å; H225-N228 WeakPolarHBondContact O-CA 3.25Å; H225-N228 WeakPolarHBondContact O-CB 3.45Å; H225-N228 PolarHBondContact O-N 2.78Å; H225-K229 PolarHBondContact O-N 3.39Å
226	P	97	Very high	92.8	Very high	40 Å²	40	55.8 Å²	55.8	26%	0.26	31%	0.311	S	S	.	.	H	α-helix	trans	-54.5	-40.6	-173.8	-30.2	36.3	0	0	0	114.6	N228 K229 L230 E305 A306	P226-N228 VanDerWaalsContact C-N 3.33Å; P226-N228 PolarHBondContact O-N 2.97Å; P226-K229 PolarHBondContact O-N 2.79Å; P226-L230 PolarHBondContact O-N 3.08Å; P226-L230 VanDerWaalsContact O-N 3.1Å; P226-E305 HydrophobicContact CB-CG 4.38Å; P226-A306 HydrophobicContact CB-CB 3.73Å
227	L	96.2	Very high	92.2	Very high	8 Å²	8	56.3 Å²	56.3	4%	0.042	31%	0.314	C	S	.	.	H	α-helix	trans	-66.7	-33.7	175.3	-69.9	174.2	0	0	0	112.8	L214 H225 L230 Q231 A306 L307	L214-L227 HydrophobicContact CB-CD1 4.45Å; L214-L227 HydrophobicContact CD2-CD1 4.11Å; L214-L227 HydrophobicContact CD2-CD2 4.11Å; L214-L227 WeakPolarHBondContact O-CD1 3.29Å; H225-L227 VanDerWaalsContact C-N 3.3Å; H225-L227 PolarHBondContact ND1-N 2.97Å; H225-L227 PolarHBondContact O-N 3.15Å; L227-L230 PolarHBondContact O-N 3.44Å; L227-Q231 WeakPolarHBondContact O-CB 3.2Å; L227-Q231 WeakPolarHBondContact O-CG 3.38Å; L227-Q231 PolarHBondContact O-N 2.97Å; L227-Q231 PolarHBondContact O-NE2 3Å; L227-A306 HydrophobicContact CD2-CB 3.89Å; L227-A306 HydrophobicContact CG-CB 4.34Å; L227-L307 HydrophobicContact CD2-CD1 4.22Å; L227-L307 HydrophobicContact CD2-CD2 3.99Å; L227-L307 HydrophobicContact CD2-CG 4.06Å
228	N	95.3	Very high	91.2	Very high	20 Å²	20	56.5 Å²	56.5	11%	0.107	31%	0.312	C	S	.	.	H	α-helix	trans	-73.8	-38.8	-179.4	-69.2	-10.6	0	0	0	110.4	S219 Q220 D222 H225 P226 L230 Q231 E232	S219-N228 PolarHBondContact O-ND2 2.84Å; Q220-N228 PolarHBondContact O-ND2 3.11Å; D222-N228 WeakPolarHBondContact O-CB 3.39Å; D222-N228 PolarHBondContact O-ND2 2.94Å; H225-N228 HydrophobicContact CB-CB 4.14Å; H225-N228 WeakPolarHBondContact O-CA 3.25Å; H225-N228 WeakPolarHBondContact O-CB 3.45Å; H225-N228 PolarHBondContact O-N 2.78Å; P226-N228 VanDerWaalsContact C-N 3.33Å; P226-N228 PolarHBondContact O-N 2.97Å; N228-L230 PolarHBondContact O-N 3.38Å; N228-Q231 PolarHBondContact O-N 2.84Å; N228-E232 WeakPolarHBondContact O-CB 3.38Å; N228-E232 PolarHBondContact O-N 3.27Å
229	K	96.4	Very high	90	Very high	69 Å²	69	54.7 Å²	54.7	30%	0.3	29%	0.289	S	S	.	.	H	α-helix	trans	-58.8	-44.9	170.5	-67.8	-179.4	-178.7	165	0	112.4	P223 L224 H225 P226 E232 A233 L302 E305	P223-K229 WeakPolarHBondContact O-CG 3.46Å; L224-K229 WeakPolarHBondContact O-CE 3.31Å; H225-K229 PolarHBondContact O-N 3.39Å; P226-K229 PolarHBondContact O-N 2.79Å; K229-E232 PolarHBondContact O-N 3.47Å; K229-A233 VanDerWaalsContact O-CB 3.29Å; K229-A233 WeakPolarHBondContact O-CB 3.26Å; K229-A233 PolarHBondContact O-N 2.92Å; K229-L302 HydrophobicContact CB-CD2 4.1Å; K229-L302 HydrophobicContact CD-CD2 4.41Å; K229-E305 IonicContact NZ-OE1 2.8Å
230	L	96	Very high	88.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-60.8	-46.8	177.2	174.9	65.4	0	0	0	111.5	P226 L227 N228 A233 W234 I246 L299 L302 F303 L307	P226-L230 PolarHBondContact O-N 3.08Å; P226-L230 VanDerWaalsContact O-N 3.1Å; L227-L230 PolarHBondContact O-N 3.44Å; N228-L230 PolarHBondContact O-N 3.38Å; L230-A233 PolarHBondContact O-N 2.85Å; L230-W234 WeakPolarHBondContact O-CB 3.41Å; L230-W234 PolarHBondContact O-N 2.73Å; L230-I246 HydrophobicContact CD1-CD1 4.38Å; L230-I246 HydrophobicContact CD1-CG1 3.86Å; L230-I246 HydrophobicContact CD2-CG1 4.12Å; L230-I246 HydrophobicContact CG-CG1 4.05Å; L230-L299 HydrophobicContact CD1-CD2 4.34Å; L230-L302 HydrophobicContact CB-CB 4.33Å; L230-L302 HydrophobicContact CD1-CB 4.05Å; L230-F303 HydrophobicContact CD1-CB 4.12Å; L230-F303 HydrophobicContact CD1-CD2 4.44Å; L230-F303 HydrophobicContact CD2-CB 4.48Å; L230-F303 HydrophobicContact CD2-CD2 3.76Å; L230-L307 HydrophobicContact CD2-CD1 4.47Å
231	Q	94.1	Very high	87.3	Confident	38 Å²	38	49.9 Å²	49.9	18%	0.178	26%	0.263	C	S	.	.	H	α-helix	trans	-63.8	-41	179.3	-74.9	176.4	57.1	0	0	112.5	L139 L227 N228 W234 R235 M247	L139-Q231 HydrophobicContact CD1-CB 3.71Å; L139-Q231 HydrophobicContact CD1-CG 3.8Å; L139-Q231 WeakPolarHBondContact CD1-O 3.5Å; L139-Q231 HydrophobicContact CD2-CB 4.37Å; L139-Q231 HydrophobicContact CD2-CG 3.84Å; L227-Q231 WeakPolarHBondContact O-CB 3.2Å; L227-Q231 WeakPolarHBondContact O-CG 3.38Å; L227-Q231 PolarHBondContact O-N 2.97Å; L227-Q231 PolarHBondContact O-NE2 3Å; N228-Q231 PolarHBondContact O-N 2.84Å; Q231-W234 PolarHBondContact O-N 2.89Å; Q231-R235 PolarHBondContact O-N 3.27Å; Q231-M247 HydrophobicContact CG-SD 3.7Å
232	E	92.1	Very high	86.5	Confident	110 Å²	110	42.8 Å²	42.8	51%	0.514	23%	0.225	S	C	.	.	H	α-helix	trans	-67.5	-45.5	177	-172.9	59.6	-159.2	0	0	111.5	N228 K229 W234 R235 S236	N228-E232 WeakPolarHBondContact O-CB 3.38Å; N228-E232 PolarHBondContact O-N 3.27Å; K229-E232 PolarHBondContact O-N 3.47Å; E232-W234 VanDerWaalsContact C-N 3.27Å; E232-W234 PolarHBondContact O-N 3.45Å; E232-R235 PolarHBondContact O-N 3.01Å; E232-R235 IonicContact OE2-CZ 3.58Å; E232-R235 IonicContact OE2-NE 3.05Å; E232-R235 PolarHBondContact OE2-NE 2.95Å; E232-R235 IonicContact OE2-NH2 3.71Å; E232-R235 PolarHBondContact OE2-NH2 3.49Å; E232-S236 PolarHBondContact O-N 2.86Å
233	A	92.1	Very high	85.1	Confident	10 Å²	10	41 Å²	41	8%	0.083	22%	0.217	C	C	.	.	H	α-helix	trans	-57.7	-42.4	174.8	0	0	0	0	0	111.4	K229 L230 S236 V237 L299 L302	K229-A233 VanDerWaalsContact O-CB 3.29Å; K229-A233 WeakPolarHBondContact O-CB 3.26Å; K229-A233 PolarHBondContact O-N 2.92Å; L230-A233 PolarHBondContact O-N 2.85Å; A233-S236 PolarHBondContact O-N 2.84Å; A233-S236 PolarHBondContact O-OG 3.17Å; A233-V237 WeakPolarHBondContact O-CG2 3.4Å; A233-V237 PolarHBondContact O-N 2.9Å; A233-L299 HydrophobicContact CB-CD2 4Å; A233-L302 HydrophobicContact CB-CD1 3.4Å
234	W	90.5	Very high	84.1	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.188	C	C	.	.	H	α-helix	trans	-59	-50.9	174.7	-178	-98.8	0	0	0	112.3	L139 L230 Q231 E232 S236 V237 H238 E242 A244 I246 L288 L299 F325	L139-W234 HydrophobicContact CD1-CB 4.13Å; L139-W234 HydrophobicContact CD1-CG 4.16Å; L230-W234 WeakPolarHBondContact O-CB 3.41Å; L230-W234 PolarHBondContact O-N 2.73Å; Q231-W234 PolarHBondContact O-N 2.89Å; E232-W234 VanDerWaalsContact C-N 3.27Å; E232-W234 PolarHBondContact O-N 3.45Å; W234-S236 PolarHBondContact O-N 2.98Å; W234-V237 WeakPolarHBondContact O-CG2 3.25Å; W234-V237 PolarHBondContact O-N 2.95Å; W234-V237 VanDerWaalsContact O-N 3.15Å; W234-H238 HydrophobicContact CD2-CB 4.28Å; W234-H238 HydrophobicContact CZ2-CB 4.09Å; W234-H238 AromaticContact CZ2-CG 3.87Å; W234-H238 AromaticContact CZ2-ND1 3.88Å; W234-H238 WeakPolarHBondContact O-CB 3.4Å; W234-H238 PolarHBondContact O-N 2.88Å; W234-E242 PolarHBondContact NE1-OE1 2.96Å; W234-A244 HydrophobicContact CH2-CB 4.3Å; W234-A244 HydrophobicContact CZ2-CB 4.27Å; W234-A244 VanDerWaalsContact CZ2-O 3.25Å; W234-A244 WeakPolarHBondContact CZ2-O 3.19Å; W234-I246 HydrophobicContact CB-CB 4.42Å; W234-I246 HydrophobicContact CB-CG2 3.71Å; W234-I246 HydrophobicContact CD2-CB 3.61Å; W234-I246 HydrophobicContact CD2-CG2 3.65Å; W234-I246 HydrophobicContact CE3-CB 3.66Å; W234-I246 HydrophobicContact CE3-CD1 4.49Å; W234-I246 HydrophobicContact CE3-CG1 4.27Å; W234-I246 HydrophobicContact CE3-CG2 4.17Å; W234-I246 HydrophobicContact CG-CB 3.98Å; W234-I246 HydrophobicContact CG-CG2 3.44Å; W234-I246 VanDerWaalsContact CG-CG2 3.44Å; W234-I246 HydrophobicContact CZ3-CB 4.23Å; W234-L288 HydrophobicContact CH2-CD2 4.31Å; W234-L288 HydrophobicContact CZ3-CD2 4.04Å; W234-L299 HydrophobicContact CB-CD2 4.44Å; W234-L299 HydrophobicContact CE3-CD1 3.79Å; W234-L299 HydrophobicContact CE3-CD2 4.27Å; W234-L299 HydrophobicContact CZ3-CD1 3.93Å; W234-F325 HydrophobicContact CE3-CZ 4.46Å; W234-F325 AromaticContact CH2-CE1 3.64Å; W234-F325 HydrophobicContact CH2-CE1 3.64Å; W234-F325 HydrophobicContact CH2-CZ 4.17Å; W234-F325 AromaticContact CZ3-CE1 3.45Å; W234-F325 HydrophobicContact CZ3-CE1 3.45Å; W234-F325 VanDerWaalsContact CZ3-CE1 3.45Å; W234-F325 AromaticContact CZ3-CZ 3.54Å; W234-F325 HydrophobicContact CZ3-CZ 3.54Å
235	R	88	Confident	83.6	Confident	54 Å²	54	30.8 Å²	30.8	20%	0.204	16%	0.158	C	C	.	.	H	α-helix	trans	-59.9	-34.2	177.5	-73.9	-173.6	-67.6	-92.3	1.8	112.8	L139 W140 Q231 E232 V237	L139-R235 HydrophobicContact CB-CG 4.12Å; L139-R235 HydrophobicContact CD1-CG 4.33Å; W140-R235 HydrophobicContact CH2-CB 4.32Å; W140-R235 HydrophobicContact CZ2-CB 3.81Å; W140-R235 HydrophobicContact CZ2-CG 4.02Å; W140-R235 WeakPolarHBondContact CZ2-O 3.2Å; Q231-R235 PolarHBondContact O-N 3.27Å; E232-R235 PolarHBondContact O-N 3.01Å; E232-R235 IonicContact OE2-CZ 3.58Å; E232-R235 IonicContact OE2-NE 3.05Å; E232-R235 PolarHBondContact OE2-NE 2.95Å; E232-R235 IonicContact OE2-NH2 3.71Å; E232-R235 PolarHBondContact OE2-NH2 3.49Å; R235-V237 VanDerWaalsContact C-N 3.3Å; R235-V237 PolarHBondContact O-N 2.82Å
236	S	84	Confident	83.4	Confident	86 Å²	86	29 Å²	29	60%	0.601	15%	0.149	S	C	*	.	H	α-helix	trans	-71.4	-22.9	179.8	74.5	0	0	0	0	114.2	E232 A233 W234	E232-S236 PolarHBondContact O-N 2.86Å; A233-S236 PolarHBondContact O-N 2.84Å; A233-S236 PolarHBondContact O-OG 3.17Å; W234-S236 PolarHBondContact O-N 2.98Å
237	V	80.2	Confident	83.4	Confident	26 Å²	26	28.1 Å²	28.1	16%	0.158	14%	0.142	C	C	.	.	H	α-helix	trans	-108.7	-19.5	-178.6	-56.1	0	0	0	0	112.8	A233 W234 R235 Q295 L299	A233-V237 WeakPolarHBondContact O-CG2 3.4Å; A233-V237 PolarHBondContact O-N 2.9Å; W234-V237 WeakPolarHBondContact O-CG2 3.25Å; W234-V237 PolarHBondContact O-N 2.95Å; W234-V237 VanDerWaalsContact O-N 3.15Å; R235-V237 VanDerWaalsContact C-N 3.3Å; R235-V237 PolarHBondContact O-N 2.82Å; V237-Q295 HydrophobicContact CB-CB 4.39Å; V237-Q295 HydrophobicContact CB-CG 4.27Å; V237-Q295 HydrophobicContact CG1-CB 3.95Å; V237-Q295 HydrophobicContact CG1-CG 3.64Å; V237-L299 HydrophobicContact CG2-CD1 4.04Å
238	H	73.7	Confident	83.3	Confident	14 Å²	14	27.8 Å²	27.8	7%	0.065	14%	0.14	C	C	.	.	S	Bend	trans	-123.7	84.1	-178.9	-155.1	100.9	0	0	0	109.7	W140 W234 P241 T243 L287	W140-H238 PolarHBondContact NE1-O 3.23Å; W234-H238 HydrophobicContact CD2-CB 4.28Å; W234-H238 HydrophobicContact CZ2-CB 4.09Å; W234-H238 AromaticContact CZ2-CG 3.87Å; W234-H238 AromaticContact CZ2-ND1 3.88Å; W234-H238 WeakPolarHBondContact O-CB 3.4Å; W234-H238 PolarHBondContact O-N 2.88Å; H238-P241 PolarHBondContact NE2-O 2.81Å; H238-T243 PolarHBondContact CE1-OG1 3.25Å; H238-T243 PolarHBondContact NE2-N 2.93Å; H238-T243 PolarHBondContact NE2-OG1 2.72Å; H238-L287 PolarHBondContact CE1-O 3.03Å; H238-L287 PolarHBondContact ND1-O 2.66Å; H238-L287 VanDerWaalsContact ND1-O 3.14Å
239	Y	67.6	Low	83.3	Confident	91 Å²	91	26.9 Å²	26.9	36%	0.357	14%	0.136	S	C	.	.	P	Polyproline II helix	trans	-69.6	154.2	175.9	-162.7	-102.9	0	0	0	110.7	A25 H28 W140 P241	A25-Y239 WeakPolarHBondContact CA-OH 3.35Å; A25-Y239 HydrophobicContact CB-CE1 4.34Å; A25-Y239 WeakPolarHBondContact CB-OH 3.41Å; A25-Y239 PolarHBondContact N-OH 2.99Å; H28-Y239 HydrophobicContact CB-CD1 4.11Å; H28-Y239 HydrophobicContact CB-CE1 4Å; W140-Y239 HydrophobicContact CH2-CD2 4.03Å; W140-Y239 HydrophobicContact CH2-CE2 4.11Å; W140-Y239 HydrophobicContact CZ2-CD2 4.26Å; Y239-P241 CarbonylContact O-C 3.53Å
240	P	64.6	Low	83.4	Confident	4 Å²	4	23.6 Å²	23.6	3%	0.026	12%	0.121	C	C	.	.	S	Bend	trans	-61	141.4	175.4	-24	37	0	0	0	111.2	W140 Y144 F378	W140-P240 HydrophobicContact CB-CG 4.31Å; W140-P240 HydrophobicContact CD2-CG 3.26Å; W140-P240 VanDerWaalsContact CE2-CD 3.4Å; W140-P240 VanDerWaalsContact CE2-CG 3.47Å; W140-P240 HydrophobicContact CE3-CG 3.55Å; W140-P240 HydrophobicContact CG-CG 3.58Å; W140-P240 HydrophobicContact CH2-CG 4.23Å; W140-P240 VanDerWaalsContact CZ2-CD 3.46Å; W140-P240 HydrophobicContact CZ2-CG 3.99Å; W140-P240 HydrophobicContact CZ3-CG 4.02Å; Y144-P240 HydrophobicContact CE2-CG 4.35Å; P240-F378 HydrophobicContact CB-CZ 3.92Å
241	P	60.4	Low	83.5	Confident	9 Å²	9	24.1 Å²	24.1	6%	0.058	12%	0.123	C	C	.	.	S	Bend	cis	-75.2	131.3	5.7	32.4	-39	0	0	0	115.3	Q32 T33 K37 H238 Y239 T243	Q32-P241 WeakPolarHBondContact O-CD 3.41Å; Q32-P241 WeakPolarHBondContact O-CG 3.2Å; T33-P241 HydrophobicContact CG2-CB 4.48Å; T33-P241 HydrophobicContact CG2-CG 3.81Å; K37-P241 HydrophobicContact CD-CB 3.25Å; K37-P241 HydrophobicContact CD-CG 4.41Å; K37-P241 VanDerWaalsContact CE-CA 3.46Å; K37-P241 HydrophobicContact CG-CB 4.02Å; K37-P241 VanDerWaalsContact NZ-CA 3.35Å; H238-P241 PolarHBondContact NE2-O 2.81Å; Y239-P241 CarbonylContact O-C 3.53Å; P241-T243 PolarHBondContact O-N 2.71Å
242	E	70.7	Confident	83.7	Confident	2 Å²	2	22.3 Å²	22.3	1%	0.009	12%	0.115	C	C	.	.	P	Polyproline II helix	trans	-71.3	119.5	171.8	-174.5	169.1	-179	0	0	109.3	F138 L139 W234 A244	F138-E242 VanDerWaalsContact CA-OE2 3.3Å; F138-E242 WeakPolarHBondContact CA-OE2 3.44Å; F138-E242 HydrophobicContact CB-CB 4.24Å; F138-E242 HydrophobicContact CB-CG 4.24Å; F138-E242 WeakPolarHBondContact CB-OE2 3.44Å; F138-E242 HydrophobicContact CD1-CB 4.4Å; F138-E242 HydrophobicContact CD1-CG 3.83Å; F138-E242 HydrophobicContact CD2-CB 3.91Å; F138-E242 HydrophobicContact CD2-CG 4.24Å; F138-E242 HydrophobicContact CE1-CG 4.25Å; F138-E242 HydrophobicContact CE2-CB 4.38Å; F138-E242 WeakPolarHBondContact CE2-O 3.24Å; F138-E242 HydrophobicContact CG-CB 3.94Å; F138-E242 HydrophobicContact CG-CG 3.85Å; F138-E242 WeakPolarHBondContact CZ-O 3.47Å; L139-E242 PolarHBondContact N-OE2 3.34Å; W234-E242 PolarHBondContact NE1-OE1 2.96Å; E242-A244 WeakPolarHBondContact CG-O 3.3Å
243	T	63.9	Low	84	Confident	22 Å²	22	17.1 Å²	17.1	14%	0.135	9%	0.091	C	C	.	.			trans	-106.6	-15.4	-177.8	53.2	0	0	0	0	112.4	L36 H238 P241	L36-T243 WeakPolarHBondContact CD1-O 3.49Å; H238-T243 PolarHBondContact CE1-OG1 3.25Å; H238-T243 PolarHBondContact NE2-N 2.93Å; H238-T243 PolarHBondContact NE2-OG1 2.72Å; P241-T243 PolarHBondContact O-N 2.71Å
244	A	72.9	Confident	84.3	Confident	4 Å²	4	16.6 Å²	16.6	3%	0.033	9%	0.087	C	C	.	.	S	Bend	trans	-138.5	163.3	173.7	0	0	0	0	0	109.5	W234 E242 L287	W234-A244 HydrophobicContact CH2-CB 4.3Å; W234-A244 HydrophobicContact CZ2-CB 4.27Å; W234-A244 VanDerWaalsContact CZ2-O 3.25Å; W234-A244 WeakPolarHBondContact CZ2-O 3.19Å; E242-A244 WeakPolarHBondContact CG-O 3.3Å; A244-L287 HydrophobicContact CB-CD1 4.11Å; A244-L287 HydrophobicContact CB-CD2 3.93Å
245	S	84.4	Confident	84.7	Confident	1 Å²	1	16.7 Å²	16.7	1%	0.007	9%	0.087	C	C	.	.			trans	-128.1	114.5	179.1	-177.4	0	0	0	0	111.5	M247 L248	S245-M247 PolarHBondContact O-N 2.75Å; S245-M247 PolarHBondContact OG-N 3.29Å; S245-L248 VanDerWaalsContact O-CB 3.3Å; S245-L248 WeakPolarHBondContact O-CB 3.31Å; S245-L248 PolarHBondContact O-N 3.39Å; S245-L248 PolarHBondContact OG-N 2.8Å
246	I	92.1	Very high	85.2	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	8%	0.077	C	C	.	.	H	α-helix	trans	-58	-28.9	169.9	-167.3	60.2	0	0	0	111.5	L139 L230 W234 L248 M249 A250 F303 F321 F325	L139-I246 HydrophobicContact CD1-CG2 4.19Å; L230-I246 HydrophobicContact CD1-CD1 4.38Å; L230-I246 HydrophobicContact CD1-CG1 3.86Å; L230-I246 HydrophobicContact CD2-CG1 4.12Å; L230-I246 HydrophobicContact CG-CG1 4.05Å; W234-I246 HydrophobicContact CB-CB 4.42Å; W234-I246 HydrophobicContact CB-CG2 3.71Å; W234-I246 HydrophobicContact CD2-CB 3.61Å; W234-I246 HydrophobicContact CD2-CG2 3.65Å; W234-I246 HydrophobicContact CE3-CB 3.66Å; W234-I246 HydrophobicContact CE3-CD1 4.49Å; W234-I246 HydrophobicContact CE3-CG1 4.27Å; W234-I246 HydrophobicContact CE3-CG2 4.17Å; W234-I246 HydrophobicContact CG-CB 3.98Å; W234-I246 HydrophobicContact CG-CG2 3.44Å; W234-I246 VanDerWaalsContact CG-CG2 3.44Å; W234-I246 HydrophobicContact CZ3-CB 4.23Å; I246-L248 VanDerWaalsContact C-N 3.29Å; I246-L248 PolarHBondContact O-N 3.26Å; I246-M249 HydrophobicContact CD1-CE 4.22Å; I246-M249 HydrophobicContact CD1-SD 3.98Å; I246-M249 WeakPolarHBondContact O-CB 3.43Å; I246-M249 PolarHBondContact O-N 2.86Å; I246-A250 PolarHBondContact O-N 2.94Å; I246-F303 HydrophobicContact CD1-CD2 3.94Å; I246-F303 HydrophobicContact CD1-CE2 4.32Å; I246-F303 HydrophobicContact CG1-CD2 4.35Å; I246-F321 HydrophobicContact CD1-CZ 4.25Å; I246-F325 HydrophobicContact CD1-CE2 4.28Å; I246-F325 HydrophobicContact CD1-CZ 4.05Å
247	M	95.3	Very high	85.8	Confident	23 Å²	23	13.5 Å²	13.5	11%	0.113	6%	0.064	C	C	.	.	H	α-helix	trans	-72.8	-23	178.3	-65.6	-50.2	-60.1	0	0	112.6	A136 L139 Q231 S245 A250 R251	A136-M247 HydrophobicContact CB-CB 3.97Å; L139-M247 HydrophobicContact CD1-CG 4.43Å; L139-M247 HydrophobicContact CD2-CG 3.55Å; L139-M247 HydrophobicContact CD2-SD 4.42Å; L139-M247 HydrophobicContact CG-CG 4.08Å; Q231-M247 HydrophobicContact CG-SD 3.7Å; S245-M247 PolarHBondContact O-N 2.75Å; S245-M247 PolarHBondContact OG-N 3.29Å; M247-A250 HydrophobicContact CE-CB 3.99Å; M247-A250 PolarHBondContact O-N 3.27Å; M247-A250 HydrophobicContact SD-CB 4.25Å; M247-R251 WeakPolarHBondContact O-CB 3.45Å; M247-R251 WeakPolarHBondContact O-CG 3.49Å; M247-R251 PolarHBondContact O-N 2.96Å
248	L	95.3	Very high	86.7	Confident	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-66	-45.7	170.1	-163.7	65.8	0	0	0	110.5	V134 A136 S245 I246 A250 R251 M252 V328 L386	V134-L248 HydrophobicContact CB-CD1 4.3Å; V134-L248 HydrophobicContact CG2-CD1 3.81Å; V134-L248 HydrophobicContact CG2-CG 4.26Å; A136-L248 HydrophobicContact CB-CB 4.31Å; A136-L248 HydrophobicContact CB-CD1 4.21Å; S245-L248 VanDerWaalsContact O-CB 3.3Å; S245-L248 WeakPolarHBondContact O-CB 3.31Å; S245-L248 PolarHBondContact O-N 3.39Å; S245-L248 PolarHBondContact OG-N 2.8Å; I246-L248 VanDerWaalsContact C-N 3.29Å; I246-L248 PolarHBondContact O-N 3.26Å; L248-A250 VanDerWaalsContact C-N 3.31Å; L248-A250 PolarHBondContact O-N 2.78Å; L248-R251 PolarHBondContact O-N 2.68Å; L248-M252 WeakPolarHBondContact O-CG 3.33Å; L248-M252 PolarHBondContact O-N 3.17Å; L248-V328 HydrophobicContact CB-CG1 4.44Å; L248-V328 HydrophobicContact CD2-CG1 3.76Å; L248-V328 HydrophobicContact CD2-CG2 4.19Å; L248-L386 HydrophobicContact CD2-CD2 4.3Å; L248-L386 HydrophobicContact CD2-CG 3.99Å
249	M	96	Very high	87.8	Confident	2 Å²	2	14.3 Å²	14.3	1%	0.01	7%	0.069	C	C	.	.	H	α-helix	trans	-60.7	-41.7	173	-63.1	170	54	0	0	111.3	I246 R251 M252 V253 F303 F321 L324 F325 V328	I246-M249 HydrophobicContact CD1-CE 4.22Å; I246-M249 HydrophobicContact CD1-SD 3.98Å; I246-M249 WeakPolarHBondContact O-CB 3.43Å; I246-M249 PolarHBondContact O-N 2.86Å; M249-R251 VanDerWaalsContact C-N 3.29Å; M249-R251 PolarHBondContact O-N 3.28Å; M249-M252 WeakPolarHBondContact O-CB 3.48Å; M249-M252 PolarHBondContact O-N 2.81Å; M249-M252 VanDerWaalsContact O-N 3.16Å; M249-V253 PolarHBondContact O-N 2.8Å; M249-V253 VanDerWaalsContact O-N 3.1Å; M249-F303 HydrophobicContact CB-CE2 3.82Å; M249-F303 HydrophobicContact CB-CZ 3.89Å; M249-F303 HydrophobicContact CE-CZ 4.47Å; M249-F321 HydrophobicContact CE-CD2 3.67Å; M249-F321 HydrophobicContact CE-CE2 3.33Å; M249-F321 HydrophobicContact CE-CZ 3.99Å; M249-L324 HydrophobicContact CE-CB 3.71Å; M249-L324 HydrophobicContact CE-CD1 3.92Å; M249-L324 HydrophobicContact SD-CB 4.46Å; M249-F325 HydrophobicContact CE-CD2 3.77Å; M249-F325 HydrophobicContact CE-CE2 3.67Å; M249-F325 HydrophobicContact SD-CD2 3.76Å; M249-F325 HydrophobicContact SD-CE2 3.65Å; M249-F325 HydrophobicContact SD-CG 4.24Å; M249-F325 HydrophobicContact SD-CZ 4.07Å; M249-V328 HydrophobicContact CG-CG2 3.78Å
250	A	97.9	Very high	89.1	Confident	0 Å²	0	20.5 Å²	20.5	0%	0	10%	0.097	C	C	.	.	H	α-helix	trans	-60	-41.1	176.2	0	0	0	0	0	112	L214 I246 M247 L248 V253 A254 F303 L307	L214-A250 HydrophobicContact CD1-CB 4.48Å; L214-A250 HydrophobicContact CD2-CB 4.24Å; I246-A250 PolarHBondContact O-N 2.94Å; M247-A250 HydrophobicContact CE-CB 3.99Å; M247-A250 PolarHBondContact O-N 3.27Å; M247-A250 HydrophobicContact SD-CB 4.25Å; L248-A250 VanDerWaalsContact C-N 3.31Å; L248-A250 PolarHBondContact O-N 2.78Å; A250-V253 PolarHBondContact O-N 3.27Å; A250-A254 VanDerWaalsContact O-CB 3.26Å; A250-A254 WeakPolarHBondContact O-CB 3.47Å; A250-A254 PolarHBondContact O-N 3.02Å; A250-F303 HydrophobicContact CB-CE2 4.27Å; A250-L307 HydrophobicContact CB-CD1 3.5Å
251	R	97.9	Very high	90.5	Very high	11 Å²	11	23.9 Å²	23.9	4%	0.042	12%	0.116	C	C	.	.	H	α-helix	trans	-67.8	-34.6	174.9	-76.2	-175.9	-178.5	-139.9	-9.2	113.2	V134 A135 D150 Y210 L214 M247 L248 M249 T255	V134-R251 HydrophobicContact CB-CB 4.22Å; V134-R251 HydrophobicContact CG1-CB 4.28Å; A135-R251 WeakPolarHBondContact O-CD 3.35Å; A135-R251 VanDerWaalsContact O-CZ 3.24Å; A135-R251 PolarHBondContact O-NE 3Å; A135-R251 PolarHBondContact O-NH1 3Å; D150-R251 VanDerWaalsContact O-CZ 3.25Å; D150-R251 PolarHBondContact O-NH1 3.47Å; D150-R251 PolarHBondContact O-NH2 2.96Å; D150-R251 IonicContact OD1-NH2 2.64Å; D150-R251 PolarHBondContact OD1-NH2 2.79Å; D150-R251 IonicContact OD2-NH2 2.62Å; D150-R251 PolarHBondContact OD2-NH2 3Å; Y210-R251 HydrophobicContact CD2-CG 4.21Å; Y210-R251 VanDerWaalsContact CE2-CZ 3.44Å; Y210-R251 HydrophobicContact CG-CG 4.25Å; Y210-R251 PolarHBondContact OH-NH1 3.42Å; Y210-R251 PolarHBondContact OH-NH2 3.17Å; L214-R251 HydrophobicContact CD1-CG 3.68Å; M247-R251 WeakPolarHBondContact O-CB 3.45Å; M247-R251 WeakPolarHBondContact O-CG 3.49Å; M247-R251 PolarHBondContact O-N 2.96Å; L248-R251 PolarHBondContact O-N 2.68Å; M249-R251 VanDerWaalsContact C-N 3.29Å; M249-R251 PolarHBondContact O-N 3.28Å; R251-T255 WeakPolarHBondContact O-CB 3.43Å; R251-T255 PolarHBondContact O-N 3.18Å; R251-T255 PolarHBondContact O-OG1 3.31Å
252	M	97.9	Very high	92.3	Very high	0 Å²	0	26.7 Å²	26.7	0%	0	13%	0.127	C	C	.	.	H	α-helix	trans	-58.7	-52.3	172.7	-64.6	169.1	62.9	0	0	110.5	V134 L248 M249 T255 V256 F269 W315 L324 L327 V328 L386	V134-M252 HydrophobicContact CG2-CG 3.82Å; L248-M252 WeakPolarHBondContact O-CG 3.33Å; L248-M252 PolarHBondContact O-N 3.17Å; M249-M252 WeakPolarHBondContact O-CB 3.48Å; M249-M252 PolarHBondContact O-N 2.81Å; M249-M252 VanDerWaalsContact O-N 3.16Å; M252-T255 PolarHBondContact O-N 3.28Å; M252-V256 WeakPolarHBondContact O-CG2 3.29Å; M252-V256 PolarHBondContact O-N 2.89Å; M252-V256 VanDerWaalsContact O-N 3.1Å; M252-F269 HydrophobicContact CB-CE1 4.08Å; M252-F269 HydrophobicContact CB-CE2 4.17Å; M252-F269 HydrophobicContact CB-CZ 3.87Å; M252-F269 HydrophobicContact CE-CB 4.17Å; M252-F269 HydrophobicContact CE-CD1 3.67Å; M252-F269 HydrophobicContact CE-CE1 4.2Å; M252-F269 HydrophobicContact CE-CG 3.9Å; M252-F269 HydrophobicContact CG-CD1 4.08Å; M252-F269 HydrophobicContact CG-CE1 3.59Å; M252-F269 HydrophobicContact CG-CZ 3.88Å; M252-W315 HydrophobicContact CB-CH2 4.46Å; M252-W315 HydrophobicContact CB-CZ3 4.21Å; M252-W315 HydrophobicContact CE-CH2 4.13Å; M252-W315 HydrophobicContact CE-CZ2 4.38Å; M252-L324 HydrophobicContact CE-CD2 3.69Å; M252-L327 HydrophobicContact CE-CD1 4.46Å; M252-L327 HydrophobicContact CE-CD2 4.15Å; M252-V328 HydrophobicContact SD-CG2 4.02Å; M252-L386 HydrophobicContact CE-CD1 4.44Å; M252-L386 HydrophobicContact CG-CD1 4.37Å; M252-L386 HydrophobicContact SD-CD1 3.91Å
253	V	98.4	Very high	93.4	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	15%	0.152	C	C	.	.	H	α-helix	trans	-62.9	-48.9	179.7	175.8	0	0	0	0	111.5	M249 A250 T255 V256 K257 F303 L307 E309 W315 F316	M249-V253 PolarHBondContact O-N 2.8Å; M249-V253 VanDerWaalsContact O-N 3.1Å; A250-V253 PolarHBondContact O-N 3.27Å; V253-T255 PolarHBondContact O-N 3.2Å; V253-V256 PolarHBondContact O-N 2.67Å; V253-V256 VanDerWaalsContact O-N 3.14Å; V253-K257 VanDerWaalsContact O-CB 3.3Å; V253-K257 WeakPolarHBondContact O-CB 3.23Å; V253-K257 PolarHBondContact O-N 3.23Å; V253-F303 HydrophobicContact CG2-CE1 3.8Å; V253-F303 HydrophobicContact CG2-CZ 3.66Å; V253-L307 HydrophobicContact CG1-CB 4.01Å; V253-L307 WeakPolarHBondContact CG1-O 3.25Å; V253-E309 HydrophobicContact CG1-CB 4.12Å; V253-W315 HydrophobicContact CG2-CE3 3.85Å; V253-W315 HydrophobicContact CG2-CZ3 4.09Å; V253-F316 HydrophobicContact CG1-CZ 3.99Å; V253-F316 HydrophobicContact CG2-CZ 4.08Å
254	A	98.5	Very high	94.9	Very high	0 Å²	0	35.3 Å²	35.3	0%	0	16%	0.164	C	C	.	.	H	α-helix	trans	-59.6	-37.9	179.7	0	0	0	0	0	112.3	V213 L214 A250 K257 Q258	V213-A254 HydrophobicContact CB-CB 3.93Å; V213-A254 HydrophobicContact CG1-CB 3.78Å; L214-A254 HydrophobicContact CD1-CB 3.93Å; L214-A254 HydrophobicContact CD2-CB 3.89Å; L214-A254 HydrophobicContact CG-CB 3.58Å; A250-A254 VanDerWaalsContact O-CB 3.26Å; A250-A254 WeakPolarHBondContact O-CB 3.47Å; A250-A254 PolarHBondContact O-N 3.02Å; A254-K257 PolarHBondContact O-N 3.45Å; A254-Q258 WeakPolarHBondContact O-CB 3.17Å; A254-Q258 WeakPolarHBondContact O-CG 2.92Å; A254-Q258 PolarHBondContact O-N 2.96Å
255	T	98.3	Very high	95.9	Very high	2 Å²	2	37 Å²	37	1%	0.012	17%	0.17	C	C	.	.	H	α-helix	trans	-62.4	-47	174.6	-59.6	0	0	0	0	111.8	Q209 R251 M252 V253 K257 A259 W265	Q209-T255 HydrophobicContact CG-CG2 3.83Å; Q209-T255 WeakPolarHBondContact O-CA 3.47Å; R251-T255 WeakPolarHBondContact O-CB 3.43Å; R251-T255 PolarHBondContact O-N 3.18Å; R251-T255 PolarHBondContact O-OG1 3.31Å; M252-T255 PolarHBondContact O-N 3.28Å; V253-T255 PolarHBondContact O-N 3.2Å; T255-K257 VanDerWaalsContact C-N 3.34Å; T255-A259 VanDerWaalsContact O-CB 3.27Å; T255-A259 WeakPolarHBondContact O-CB 3.02Å; T255-A259 PolarHBondContact O-N 3.49Å; T255-A259 VanDerWaalsContact O-N 3.08Å; T255-W265 HydrophobicContact CG2-CD2 3.42Å; T255-W265 VanDerWaalsContact CG2-CD2 3.42Å; T255-W265 HydrophobicContact CG2-CE3 3.34Å; T255-W265 HydrophobicContact CG2-CG 4.09Å; T255-W265 HydrophobicContact CG2-CH2 3.67Å; T255-W265 HydrophobicContact CG2-CZ2 3.75Å; T255-W265 HydrophobicContact CG2-CZ3 3.45Å; T255-W265 VanDerWaalsContact CG2-CZ3 3.45Å
256	V	98.3	Very high	96.5	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	18%	0.178	C	C	.	.	H	α-helix	trans	-62.8	-43.3	175.1	176.4	0	0	0	0	110.8	M252 V253 Q258 A259 K262 W265 I266 F269 A311 V312 W315	M252-V256 WeakPolarHBondContact O-CG2 3.29Å; M252-V256 PolarHBondContact O-N 2.89Å; M252-V256 VanDerWaalsContact O-N 3.1Å; V253-V256 PolarHBondContact O-N 2.67Å; V253-V256 VanDerWaalsContact O-N 3.14Å; V256-Q258 PolarHBondContact O-N 3.34Å; V256-A259 PolarHBondContact O-N 3.22Å; V256-K262 HydrophobicContact CG1-CB 4.07Å; V256-K262 HydrophobicContact CG1-CD 4.36Å; V256-K262 HydrophobicContact CG1-CG 4.38Å; V256-K262 WeakPolarHBondContact O-CG 3.19Å; V256-W265 HydrophobicContact CG2-CB 4Å; V256-I266 HydrophobicContact CG1-CD1 4.13Å; V256-I266 HydrophobicContact CG1-CG1 4.02Å; V256-I266 HydrophobicContact CG2-CG1 4.16Å; V256-F269 HydrophobicContact CG2-CD2 4.14Å; V256-F269 HydrophobicContact CG2-CE2 3.88Å; V256-A311 HydrophobicContact CG1-CB 4.47Å; V256-V312 HydrophobicContact CG1-CG1 4.03Å; V256-V312 HydrophobicContact CG1-CG2 4.46Å; V256-V312 HydrophobicContact CG2-CG1 4.4Å; V256-W315 HydrophobicContact CG2-CH2 4.24Å; V256-W315 HydrophobicContact CG2-CZ3 4.34Å
257	K	97.7	Very high	96.5	Very high	73 Å²	73	43.6 Å²	43.6	32%	0.317	20%	0.197	S	C	.	.	H	α-helix	trans	-63.3	-39.5	-176.8	-173.2	158.3	-173.1	167.5	0	112.6	V213 V253 A254 T255 Y308 E309	V213-K257 HydrophobicContact CG1-CD 4.01Å; V213-K257 HydrophobicContact CG2-CB 4.17Å; V213-K257 HydrophobicContact CG2-CD 4.11Å; V213-K257 HydrophobicContact CG2-CG 3.86Å; V253-K257 VanDerWaalsContact O-CB 3.3Å; V253-K257 WeakPolarHBondContact O-CB 3.23Å; V253-K257 PolarHBondContact O-N 3.23Å; A254-K257 PolarHBondContact O-N 3.45Å; T255-K257 VanDerWaalsContact C-N 3.34Å; K257-Y308 PolarHBondContact NZ-O 3.44Å; K257-E309 HydrophobicContact CB-CG 4.33Å; K257-E309 HydrophobicContact CD-CB 4.39Å; K257-E309 WeakPolarHBondContact CG-OE2 3.48Å
258	Q	97.8	Very high	96.5	Very high	39 Å²	39	42.5 Å²	42.5	18%	0.182	19%	0.191	C	C	.	.	H	α-helix	trans	-81.4	-21.7	177	-71.3	-171.8	-161.2	0	0	114.4	T207 E208 Q209 Y210 Q212 V213 A254 V256	T207-Q258 PolarHBondContact O-NE2 3.38Å; E208-Q258 PolarHBondContact O-NE2 2.87Å; Q209-Q258 PolarHBondContact O-NE2 3.3Å; Y210-Q258 PolarHBondContact O-OE1 3.5Å; Q212-Q258 VanDerWaalsContact CA-OE1 3.3Å; Q212-Q258 VanDerWaalsContact CB-OE1 3.28Å; V213-Q258 HydrophobicContact CB-CG 4.3Å; V213-Q258 HydrophobicContact CG2-CG 3.49Å; V213-Q258 VanDerWaalsContact CG2-CG 3.49Å; A254-Q258 WeakPolarHBondContact O-CB 3.17Å; A254-Q258 WeakPolarHBondContact O-CG 2.92Å; A254-Q258 PolarHBondContact O-N 2.96Å; V256-Q258 PolarHBondContact O-N 3.34Å
259	A	97.1	Very high	96.4	Very high	17 Å²	17	42.5 Å²	42.5	14%	0.14	19%	0.191	C	C	.	.			trans	-65.1	138.4	-172.9	0	0	0	0	0	112.6	T255 V256 W265	T255-A259 VanDerWaalsContact O-CB 3.27Å; T255-A259 WeakPolarHBondContact O-CB 3.02Å; T255-A259 PolarHBondContact O-N 3.49Å; T255-A259 VanDerWaalsContact O-N 3.08Å; V256-A259 PolarHBondContact O-N 3.22Å; A259-W265 HydrophobicContact CB-CG 4.28Å
260	K	95.3	Very high	96.2	Very high	221 Å²	221	46.2 Å²	46.2	96%	0.961	22%	0.217	S	C	*	.	S	Bend	trans	-66.7	-39.3	168	-65.3	-179.2	-179.6	175.8	0	111.9
261	D	95.3	Very high	95.7	Very high	76 Å²	76	47.9 Å²	47.9	41%	0.406	23%	0.225	S	C	.	.	S	Bend	trans	-111.1	85.4	175.3	-178.9	-8.3	0	0	0	108.6	D263 R264	D261-D263 VanDerWaalsContact C-N 3.31Å; D261-D263 PolarHBondContact O-N 3.43Å; D261-D263 PolarHBondContact OD1-N 2.62Å; D261-R264 HydrophobicContact CB-CB 4.21Å; D261-R264 VanDerWaalsContact CG-CB 3.46Å; D261-R264 PolarHBondContact O-N 3.21Å; D261-R264 PolarHBondContact OD1-N 3.01Å; D261-R264 WeakPolarHBondContact OD2-CB 3.42Å
262	K	96.5	Very high	95.4	Very high	68 Å²	68	47.6 Å²	47.6	30%	0.296	22%	0.224	S	C	.	.	H	α-helix	trans	-61.5	-41.5	-179.5	-59.9	-165.3	171.8	177.8	0	111.4	V256 R264 W265 I266 E309 A311	V256-K262 HydrophobicContact CG1-CB 4.07Å; V256-K262 HydrophobicContact CG1-CD 4.36Å; V256-K262 HydrophobicContact CG1-CG 4.38Å; V256-K262 WeakPolarHBondContact O-CG 3.19Å; K262-R264 VanDerWaalsContact C-N 3.28Å; K262-R264 PolarHBondContact O-N 3.08Å; K262-W265 PolarHBondContact O-N 3.2Å; K262-W265 VanDerWaalsContact O-N 3.09Å; K262-I266 HydrophobicContact CB-CD1 4.48Å; K262-I266 WeakPolarHBondContact O-CG1 3.47Å; K262-I266 PolarHBondContact O-N 3.19Å; K262-E309 IonicContact NZ-OE1 3.86Å; K262-E309 PolarHBondContact NZ-OE1 3.15Å; K262-E309 IonicContact NZ-OE2 2.72Å; K262-A311 HydrophobicContact CD-CB 3.76Å
263	D	95.4	Very high	94.6	Very high	99 Å²	99	50.6 Å²	50.6	53%	0.529	24%	0.244	S	C	.	.	H	α-helix	trans	-62.7	-34.3	-176.8	-63.3	-34.2	0	0	0	112.3	D261 R267	D261-D263 VanDerWaalsContact C-N 3.31Å; D261-D263 PolarHBondContact O-N 3.43Å; D261-D263 PolarHBondContact OD1-N 2.62Å; D263-R267 VanDerWaalsContact CB-NH1 3.3Å; D263-R267 WeakPolarHBondContact O-CB 3.47Å; D263-R267 VanDerWaalsContact O-CG 3.3Å; D263-R267 WeakPolarHBondContact O-CG 3.43Å; D263-R267 PolarHBondContact O-N 3.29Å
264	R	94.1	Very high	93.4	Very high	105 Å²	105	54.9 Å²	54.9	40%	0.396	27%	0.267	S	S	.	.	H	α-helix	trans	-58.9	-46.6	173.7	175.4	-178.6	173.2	-156.5	-3.8	111.8	D261 K262 R267 L268	D261-R264 HydrophobicContact CB-CB 4.21Å; D261-R264 VanDerWaalsContact CG-CB 3.46Å; D261-R264 PolarHBondContact O-N 3.21Å; D261-R264 PolarHBondContact OD1-N 3.01Å; D261-R264 WeakPolarHBondContact OD2-CB 3.42Å; K262-R264 VanDerWaalsContact C-N 3.28Å; K262-R264 PolarHBondContact O-N 3.08Å; R264-R267 PolarHBondContact O-N 3.43Å; R264-L268 HydrophobicContact CG-CD1 4.24Å; R264-L268 WeakPolarHBondContact O-CG 3.44Å; R264-L268 PolarHBondContact O-N 2.89Å; R264-L268 VanDerWaalsContact O-N 3.07Å
265	W	95.1	Very high	92.1	Very high	41 Å²	41	56.1 Å²	56.1	16%	0.155	27%	0.273	C	S	.	.	H	α-helix	trans	-69.6	-41.9	-179.7	-71.2	97.9	0	0	0	111.8	F90 L133 Q209 T255 V256 A259 K262 R267 L268 F269	F90-W265 HydrophobicContact CZ-CH2 4.48Å; F90-W265 HydrophobicContact CZ-CZ3 4.38Å; L133-W265 HydrophobicContact CD1-CE3 3.68Å; L133-W265 HydrophobicContact CD1-CH2 4.34Å; L133-W265 HydrophobicContact CD1-CZ3 3.31Å; L133-W265 HydrophobicContact CG-CE3 4.31Å; L133-W265 HydrophobicContact CG-CZ3 3.99Å; Q209-W265 HydrophobicContact CG-CH2 4.38Å; T255-W265 HydrophobicContact CG2-CD2 3.42Å; T255-W265 VanDerWaalsContact CG2-CD2 3.42Å; T255-W265 HydrophobicContact CG2-CE3 3.34Å; T255-W265 HydrophobicContact CG2-CG 4.09Å; T255-W265 HydrophobicContact CG2-CH2 3.67Å; T255-W265 HydrophobicContact CG2-CZ2 3.75Å; T255-W265 HydrophobicContact CG2-CZ3 3.45Å; T255-W265 VanDerWaalsContact CG2-CZ3 3.45Å; V256-W265 HydrophobicContact CG2-CB 4Å; A259-W265 HydrophobicContact CB-CG 4.28Å; K262-W265 PolarHBondContact O-N 3.2Å; K262-W265 VanDerWaalsContact O-N 3.09Å; W265-R267 VanDerWaalsContact C-N 3.29Å; W265-R267 PolarHBondContact O-N 3.24Å; W265-L268 HydrophobicContact CE3-CD1 4.38Å; W265-L268 WeakPolarHBondContact O-CB 3.4Å; W265-L268 PolarHBondContact O-N 2.97Å; W265-F269 HydrophobicContact CB-CD2 4.48Å; W265-F269 HydrophobicContact CB-CE2 4.17Å; W265-F269 HydrophobicContact CE3-CE2 4.32Å; W265-F269 HydrophobicContact CE3-CZ 4.28Å; W265-F269 WeakPolarHBondContact O-CD2 3.22Å; W265-F269 PolarHBondContact O-N 2.71Å
266	I	95.4	Very high	90.4	Very high	34 Å²	34	60.3 Å²	60.3	17%	0.174	30%	0.298	C	S	.	.	H	α-helix	trans	-57.7	-44.4	174.9	-64.3	167.3	0	0	0	110.4	V256 K262 L268 F269 S270 A311 V312	V256-I266 HydrophobicContact CG1-CD1 4.13Å; V256-I266 HydrophobicContact CG1-CG1 4.02Å; V256-I266 HydrophobicContact CG2-CG1 4.16Å; K262-I266 HydrophobicContact CB-CD1 4.48Å; K262-I266 WeakPolarHBondContact O-CG1 3.47Å; K262-I266 PolarHBondContact O-N 3.19Å; I266-L268 VanDerWaalsContact C-N 3.32Å; I266-L268 PolarHBondContact O-N 2.92Å; I266-F269 PolarHBondContact O-N 2.94Å; I266-S270 WeakPolarHBondContact O-CB 3.42Å; I266-S270 PolarHBondContact O-N 2.59Å; I266-S270 PolarHBondContact O-OG 3.26Å; I266-A311 HydrophobicContact CD1-CB 4.32Å; I266-A311 WeakPolarHBondContact CD1-O 3.16Å; I266-V312 HydrophobicContact CD1-CG1 3.77Å; I266-V312 HydrophobicContact CG1-CG1 3.66Å
267	R	93.9	Very high	89.1	Confident	104 Å²	104	63.7 Å²	63.7	39%	0.392	33%	0.326	S	S	.	.	H	α-helix	trans	-65	-29.3	174.9	-76.5	-172.5	-62.3	-92.4	-2.4	114.2	D263 R264 W265 S270 Q271	D263-R267 VanDerWaalsContact CB-NH1 3.3Å; D263-R267 WeakPolarHBondContact O-CB 3.47Å; D263-R267 VanDerWaalsContact O-CG 3.3Å; D263-R267 WeakPolarHBondContact O-CG 3.43Å; D263-R267 PolarHBondContact O-N 3.29Å; R264-R267 PolarHBondContact O-N 3.43Å; W265-R267 VanDerWaalsContact C-N 3.29Å; W265-R267 PolarHBondContact O-N 3.24Å; R267-S270 WeakPolarHBondContact CA-OG 3.35Å; R267-S270 PolarHBondContact O-OG 3.07Å; R267-S270 VanDerWaalsContact O-OG 3.05Å; R267-Q271 VanDerWaalsContact O-CG 3.29Å; R267-Q271 WeakPolarHBondContact O-CG 3.41Å
268	L	94.1	Very high	87.9	Confident	0 Å²	0	65.1 Å²	65.1	0%	0	34%	0.337	C	S	.	.	H	α-helix	trans	-72.8	-46.1	174.8	-77.1	164.4	0	0	0	110.6	C85 F90 L133 R264 W265 I266 S270 Q271	C85-L268 HydrophobicContact CB-CD2 3.88Å; C85-L268 HydrophobicContact CB-CG 4.31Å; C85-L268 WeakPolarHBondContact SG-CD2 3.32Å; C85-L268 VanDerWaalsContact SG-CG 3.57Å; F90-L268 HydrophobicContact CE2-CD1 3.87Å; F90-L268 HydrophobicContact CE2-CD2 4.02Å; F90-L268 HydrophobicContact CZ-CD1 4Å; L133-L268 HydrophobicContact CD1-CB 4.09Å; L133-L268 HydrophobicContact CD1-CD1 3.83Å; L133-L268 HydrophobicContact CD1-CG 4.42Å; L133-L268 HydrophobicContact CD2-CB 3.89Å; R264-L268 HydrophobicContact CG-CD1 4.24Å; R264-L268 WeakPolarHBondContact O-CG 3.44Å; R264-L268 PolarHBondContact O-N 2.89Å; R264-L268 VanDerWaalsContact O-N 3.07Å; W265-L268 HydrophobicContact CE3-CD1 4.38Å; W265-L268 WeakPolarHBondContact O-CB 3.4Å; W265-L268 PolarHBondContact O-N 2.97Å; I266-L268 VanDerWaalsContact C-N 3.32Å; I266-L268 PolarHBondContact O-N 2.92Å; L268-S270 VanDerWaalsContact C-N 3.31Å; L268-S270 PolarHBondContact O-N 3.06Å; L268-Q271 WeakPolarHBondContact O-CB 3.48Å; L268-Q271 WeakPolarHBondContact O-CG 3.28Å; L268-Q271 PolarHBondContact O-N 3.04Å; L268-Q271 VanDerWaalsContact O-N 3.17Å
269	F	94.4	Very high	86.9	Confident	1 Å²	1	66 Å²	66	0%	0.004	34%	0.342	C	S	.	.	H	α-helix	trans	-65.1	-34.1	177.1	-66.6	-55.3	0	0	0	112.6	L133 V134 M252 V256 W265 I266 Q271 F272 W315 L386	L133-F269 HydrophobicContact CD2-CD1 3.4Å; L133-F269 HydrophobicContact CD2-CE1 3.27Å; L133-F269 HydrophobicContact CD2-CG 4.23Å; L133-F269 HydrophobicContact CD2-CZ 4.02Å; L133-F269 HydrophobicContact CG-CD1 4.38Å; L133-F269 HydrophobicContact CG-CE1 3.76Å; L133-F269 HydrophobicContact CG-CZ 4.21Å; V134-F269 HydrophobicContact CG1-CE1 4.26Å; V134-F269 HydrophobicContact CG1-CZ 3.97Å; V134-F269 HydrophobicContact CG2-CE1 4.02Å; M252-F269 HydrophobicContact CB-CE1 4.08Å; M252-F269 HydrophobicContact CB-CE2 4.17Å; M252-F269 HydrophobicContact CB-CZ 3.87Å; M252-F269 HydrophobicContact CE-CB 4.17Å; M252-F269 HydrophobicContact CE-CD1 3.67Å; M252-F269 HydrophobicContact CE-CE1 4.2Å; M252-F269 HydrophobicContact CE-CG 3.9Å; M252-F269 HydrophobicContact CG-CD1 4.08Å; M252-F269 HydrophobicContact CG-CE1 3.59Å; M252-F269 HydrophobicContact CG-CZ 3.88Å; V256-F269 HydrophobicContact CG2-CD2 4.14Å; V256-F269 HydrophobicContact CG2-CE2 3.88Å; W265-F269 HydrophobicContact CB-CD2 4.48Å; W265-F269 HydrophobicContact CB-CE2 4.17Å; W265-F269 HydrophobicContact CE3-CE2 4.32Å; W265-F269 HydrophobicContact CE3-CZ 4.28Å; W265-F269 WeakPolarHBondContact O-CD2 3.22Å; W265-F269 PolarHBondContact O-N 2.71Å; I266-F269 PolarHBondContact O-N 2.94Å; F269-Q271 PolarHBondContact O-N 2.8Å; F269-F272 WeakPolarHBondContact O-CD2 3.13Å; F269-F272 PolarHBondContact O-N 3.28Å; F269-W315 HydrophobicContact CB-CH2 4.25Å; F269-W315 HydrophobicContact CB-CZ2 4.13Å; F269-W315 AromaticContact CD2-CH2 3.73Å; F269-W315 HydrophobicContact CD2-CH2 3.73Å; F269-W315 HydrophobicContact CD2-CZ2 4.42Å; F269-W315 HydrophobicContact CE2-CH2 4.41Å; F269-W315 HydrophobicContact CG-CH2 4.17Å; F269-L386 HydrophobicContact CD1-CD1 4.38Å; F269-L386 HydrophobicContact CE1-CD1 4.43Å
270	S	90.7	Very high	85.9	Confident	79 Å²	79	66.2 Å²	66.2	55%	0.552	34%	0.34	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-0.7	176.5	74.5	0	0	0	0	114.3	I266 R267 L268	I266-S270 WeakPolarHBondContact O-CB 3.42Å; I266-S270 PolarHBondContact O-N 2.59Å; I266-S270 PolarHBondContact O-OG 3.26Å; R267-S270 WeakPolarHBondContact CA-OG 3.35Å; R267-S270 PolarHBondContact O-OG 3.07Å; R267-S270 VanDerWaalsContact O-OG 3.05Å; L268-S270 VanDerWaalsContact C-N 3.31Å; L268-S270 PolarHBondContact O-N 3.06Å
271	Q	88.3	Confident	84.8	Confident	36 Å²	36	60 Å²	60	17%	0.168	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	-21	176.9	-61.7	-153.5	20.4	0	0	114.2	C85 V87 K113 R267 L268 F269	C85-Q271 PolarHBondContact O-NE2 3.31Å; V87-Q271 VanDerWaalsContact CG1-OE1 3.29Å; K113-Q271 PolarHBondContact NZ-O 2.69Å; K113-Q271 VanDerWaalsContact NZ-O 3.11Å; R267-Q271 VanDerWaalsContact O-CG 3.29Å; R267-Q271 WeakPolarHBondContact O-CG 3.41Å; L268-Q271 WeakPolarHBondContact O-CB 3.48Å; L268-Q271 WeakPolarHBondContact O-CG 3.28Å; L268-Q271 PolarHBondContact O-N 3.04Å; L268-Q271 VanDerWaalsContact O-N 3.17Å; F269-Q271 PolarHBondContact O-N 2.8Å
272	F	90.4	Very high	84	Confident	5 Å²	5	60.9 Å²	60.9	2%	0.022	32%	0.316	C	S	.	.	S	Bend	trans	-76.2	154.4	-179.9	-67.7	-75	0	0	0	110.5	L133 F269 N274 L327 N331 L386 F387 V388	L133-F272 HydrophobicContact CD2-CE2 3.74Å; L133-F272 HydrophobicContact CD2-CZ 4.38Å; F269-F272 WeakPolarHBondContact O-CD2 3.13Å; F269-F272 PolarHBondContact O-N 3.28Å; F272-N274 PolarHBondContact O-N 2.86Å; F272-L327 HydrophobicContact CB-CD1 4.02Å; F272-L327 HydrophobicContact CB-CD2 4.01Å; F272-L327 HydrophobicContact CB-CG 3.77Å; F272-L327 HydrophobicContact CG-CD2 4.36Å; F272-N331 HydrophobicContact CB-CB 4.35Å; F272-N331 HydrophobicContact CD1-CB 3.66Å; F272-N331 HydrophobicContact CE1-CB 4.41Å; F272-N331 HydrophobicContact CG-CB 4.32Å; F272-L386 HydrophobicContact CD2-CD1 4.49Å; F272-L386 HydrophobicContact CE1-CB 4.12Å; F272-L386 HydrophobicContact CE2-CB 4.13Å; F272-L386 HydrophobicContact CE2-CD1 4.35Å; F272-L386 HydrophobicContact CZ-CB 3.7Å; F272-F387 WeakPolarHBondContact CE1-O 3.46Å; F272-V388 HydrophobicContact CE2-CG2 4.31Å; F272-V388 HydrophobicContact CZ-CG2 3.88Å
273	C	80.9	Confident	83	Confident	62 Å²	62	58 Å²	58	42%	0.419	30%	0.303	S	S	.	.			trans	-66.6	128	177.9	-172.6	0	0	0	0	110.1	K275 L327 T330 N331	C273-K275 VanDerWaalsContact SG-CG 3.58Å; C273-L327 WeakPolarHBondContact O-CA 3.46Å; C273-T330 PolarHBondContact O-OG1 2.81Å; C273-N331 PolarHBondContact N-ND2 2.89Å; C273-N331 PolarHBondContact N-OD1 2.82Å; C273-N331 VanDerWaalsContact N-OD1 3.13Å; C273-N331 PolarHBondContact O-ND2 2.91Å
274	N	73.5	Confident	82	Confident	90 Å²	90	53.3 Å²	53.3	48%	0.481	28%	0.278	S	S	.	.			trans	-133.1	76.1	176	60.3	-15.4	0	0	0	108.7	F272	F272-N274 PolarHBondContact O-N 2.86Å
275	K	71.1	Confident	81	Confident	26 Å²	26	51.7 Å²	51.7	11%	0.113	28%	0.275	C	S	.	.			trans	-48	173.6	-165.1	-69.5	-174.8	-171.3	161.3	0	116.5	C273 E279 E280 I283 T330 Y451 L452	C273-K275 VanDerWaalsContact SG-CG 3.58Å; K275-E279 HydrophobicContact CB-CB 3.72Å; K275-E279 WeakPolarHBondContact CB-OE2 3.06Å; K275-E279 HydrophobicContact CD-CB 4.02Å; K275-E279 HydrophobicContact CG-CB 4.5Å; K275-E280 HydrophobicContact CB-CG 4.48Å; K275-E280 WeakPolarHBondContact O-CG 3.28Å; K275-E280 VanDerWaalsContact O-OE1 3.04Å; K275-I283 HydrophobicContact CD-CD1 3.71Å; K275-T330 HydrophobicContact CD-CG2 4.25Å; K275-Y451 WeakPolarHBondContact CE-O 3.36Å; K275-Y451 PolarHBondContact NZ-O 3.27Å; K275-L452 HydrophobicContact CD-CB 4.16Å; K275-L452 HydrophobicContact CD-CD1 3.54Å; K275-L452 HydrophobicContact CD-CG 4.3Å; K275-L452 VanDerWaalsContact NZ-CG 3.3Å
276	T	64.1	Low	80.1	Confident	90 Å²	90	53.8 Å²	53.8	55%	0.552	29%	0.285	S	S	*	.			trans	-70.9	161.1	-178	62.8	0	0	0	0	112.4	N278 E279 E280	T276-N278 VanDerWaalsContact C-N 3.29Å; T276-N278 PolarHBondContact O-N 3.03Å; T276-N278 VanDerWaalsContact O-N 3.07Å; T276-E279 PolarHBondContact N-OE2 2.93Å; T276-E279 VanDerWaalsContact N-OE2 3.08Å; T276-E279 WeakPolarHBondContact O-CA 3.16Å; T276-E279 WeakPolarHBondContact O-CB 3.3Å; T276-E279 PolarHBondContact O-N 3.29Å; T276-E279 PolarHBondContact OG1-OE2 3.01Å; T276-E280 WeakPolarHBondContact O-CG 3.15Å; T276-E280 PolarHBondContact O-N 2.84Å
277	A	70.9	Confident	79	Confident	71 Å²	71	53.2 Å²	53.2	59%	0.587	28%	0.282	S	S	*	.	H	α-helix	trans	-51.1	-39.8	-171	0	0	0	0	0	115.4	E281	A277-E281 WeakPolarHBondContact O-CG 3.04Å; A277-E281 PolarHBondContact O-N 2.86Å
278	N	72	Confident	78.1	Confident	103 Å²	103	48.9 Å²	48.9	55%	0.551	27%	0.267	S	S	*	.	H	α-helix	trans	-68.8	-43.4	178.5	-171.3	82.1	0	0	0	111.9	T276 E280 E281 E282	T276-N278 VanDerWaalsContact C-N 3.29Å; T276-N278 PolarHBondContact O-N 3.03Å; T276-N278 VanDerWaalsContact O-N 3.07Å; N278-E280 VanDerWaalsContact C-N 3.35Å; N278-E281 PolarHBondContact O-N 2.66Å; N278-E282 PolarHBondContact ND2-OE1 3.16Å; N278-E282 PolarHBondContact O-N 3.18Å
279	E	76.3	Confident	77	Confident	59 Å²	59	49.9 Å²	49.9	28%	0.276	28%	0.278	S	S	.	.	H	α-helix	trans	-67	-35.7	178.4	-70.9	175.4	150.6	0	0	112	K275 T276 E281 E282 I283 L452	K275-E279 HydrophobicContact CB-CB 3.72Å; K275-E279 WeakPolarHBondContact CB-OE2 3.06Å; K275-E279 HydrophobicContact CD-CB 4.02Å; K275-E279 HydrophobicContact CG-CB 4.5Å; T276-E279 PolarHBondContact N-OE2 2.93Å; T276-E279 VanDerWaalsContact N-OE2 3.08Å; T276-E279 WeakPolarHBondContact O-CA 3.16Å; T276-E279 WeakPolarHBondContact O-CB 3.3Å; T276-E279 PolarHBondContact O-N 3.29Å; T276-E279 PolarHBondContact OG1-OE2 3.01Å; E279-E281 VanDerWaalsContact C-N 3.35Å; E279-E282 PolarHBondContact O-N 2.83Å; E279-I283 WeakPolarHBondContact O-CD1 3.39Å; E279-I283 WeakPolarHBondContact O-CG1 3.48Å; E279-I283 PolarHBondContact O-N 3.14Å; E279-I283 VanDerWaalsContact O-N 3.1Å; E279-L452 HydrophobicContact CB-CD1 3.39Å; E279-L452 HydrophobicContact CG-CD1 3.83Å; E279-L452 VanDerWaalsContact O-CD1 3.29Å; E279-L452 WeakPolarHBondContact O-CD1 3.28Å
280	E	76.1	Confident	75.5	Confident	21 Å²	21	56.1 Å²	56.1	10%	0.098	31%	0.311	C	S	.	.	H	α-helix	trans	-62	-43	173.9	-68.9	175	145.9	0	0	111.4	K275 T276 N278 I283 V284 S323 A326	K275-E280 HydrophobicContact CB-CG 4.48Å; K275-E280 WeakPolarHBondContact O-CG 3.28Å; K275-E280 VanDerWaalsContact O-OE1 3.04Å; T276-E280 WeakPolarHBondContact O-CG 3.15Å; T276-E280 PolarHBondContact O-N 2.84Å; N278-E280 VanDerWaalsContact C-N 3.35Å; E280-I283 PolarHBondContact O-N 3.41Å; E280-V284 WeakPolarHBondContact O-CB 3.41Å; E280-V284 WeakPolarHBondContact O-CG2 3.35Å; E280-V284 PolarHBondContact O-N 2.95Å; E280-S323 VanDerWaalsContact OE1-CA 3.29Å; E280-S323 WeakPolarHBondContact OE1-CA 3.42Å; E280-S323 WeakPolarHBondContact OE1-CB 3.41Å; E280-S323 PolarHBondContact OE1-OG 2.75Å; E280-A326 HydrophobicContact CB-CB 4.2Å; E280-A326 HydrophobicContact CG-CB 3.84Å
281	E	73.4	Confident	74.1	Confident	89 Å²	89	59.4 Å²	59.4	42%	0.416	32%	0.316	S	S	.	.	H	α-helix	trans	-64.9	-41.7	178.3	-71	-171.4	158.6	0	0	111.9	A277 N278 E279 I283 V284 H285 R322	A277-E281 WeakPolarHBondContact O-CG 3.04Å; A277-E281 PolarHBondContact O-N 2.86Å; N278-E281 PolarHBondContact O-N 2.66Å; E279-E281 VanDerWaalsContact C-N 3.35Å; E281-I283 PolarHBondContact O-N 3.33Å; E281-V284 PolarHBondContact O-N 2.92Å; E281-H285 WeakPolarHBondContact O-CB 3.48Å; E281-H285 PolarHBondContact O-N 2.94Å; E281-R322 IonicContact OE1-CZ 2.67Å; E281-R322 IonicContact OE1-NH1 3.23Å; E281-R322 PolarHBondContact OE1-NH1 2.73Å
282	E	77.3	Confident	73.3	Confident	96 Å²	96	59.4 Å²	59.4	45%	0.449	32%	0.315	S	S	.	.	H	α-helix	trans	-61	-43.2	175.8	-72.1	171.8	-178.6	0	0	112.1	N278 E279 H285 K286 L452	N278-E282 PolarHBondContact ND2-OE1 3.16Å; N278-E282 PolarHBondContact O-N 3.18Å; E279-E282 PolarHBondContact O-N 2.83Å; E282-H285 PolarHBondContact O-N 2.97Å; E282-K286 PolarHBondContact O-N 3.39Å; E282-L452 HydrophobicContact CB-CD2 4.34Å; E282-L452 VanDerWaalsContact OE2-CD2 3.29Å; E282-L452 WeakPolarHBondContact OE2-CD2 3.41Å
283	I	74.8	Confident	72.2	Confident	6 Å²	6	66.7 Å²	66.7	3%	0.031	35%	0.347	C	S	.	.	H	α-helix	trans	-65.5	-45.6	176.5	-68.8	157.7	0	0	0	111.3	K275 E279 E280 E281 H285 K286 L287 A326 T330 L452	K275-I283 HydrophobicContact CD-CD1 3.71Å; E279-I283 WeakPolarHBondContact O-CD1 3.39Å; E279-I283 WeakPolarHBondContact O-CG1 3.48Å; E279-I283 PolarHBondContact O-N 3.14Å; E279-I283 VanDerWaalsContact O-N 3.1Å; E280-I283 PolarHBondContact O-N 3.41Å; E281-I283 PolarHBondContact O-N 3.33Å; I283-H285 VanDerWaalsContact C-N 3.28Å; I283-H285 PolarHBondContact O-N 2.75Å; I283-K286 PolarHBondContact O-N 3.01Å; I283-L287 HydrophobicContact CG2-CD1 3.96Å; I283-L287 HydrophobicContact CG2-CG 4.29Å; I283-L287 WeakPolarHBondContact O-CG 3.35Å; I283-L287 PolarHBondContact O-N 2.99Å; I283-A326 HydrophobicContact CD1-CB 4.09Å; I283-T330 HydrophobicContact CD1-CG2 3.3Å; I283-T330 HydrophobicContact CG1-CG2 4.22Å; I283-L452 HydrophobicContact CD1-CD1 3.66Å; I283-L452 HydrophobicContact CG1-CD1 3.71Å; I283-L452 HydrophobicContact CG1-CG 4.4Å
284	V	74.7	Confident	71.8	Confident	1 Å²	1	66.5 Å²	66.5	1%	0.006	36%	0.355	C	S	.	.	H	α-helix	trans	-61.7	-41.8	-179.5	171.2	0	0	0	0	110.4	E280 E281 L287 L288 F292 L296 R322 F325	E280-V284 WeakPolarHBondContact O-CB 3.41Å; E280-V284 WeakPolarHBondContact O-CG2 3.35Å; E280-V284 PolarHBondContact O-N 2.95Å; E281-V284 PolarHBondContact O-N 2.92Å; V284-L287 PolarHBondContact O-N 2.92Å; V284-L288 HydrophobicContact CG1-CD1 4.09Å; V284-L288 PolarHBondContact O-N 3.45Å; V284-F292 HydrophobicContact CG1-CD2 3.53Å; V284-F292 HydrophobicContact CG1-CE2 3.8Å; V284-F292 HydrophobicContact CG1-CG 4.45Å; V284-L296 HydrophobicContact CG1-CD1 4.36Å; V284-L296 HydrophobicContact CG1-CD2 3.96Å; V284-R322 HydrophobicContact CG2-CB 4.43Å; V284-F325 HydrophobicContact CG2-CB 3.97Å
285	H	74.4	Confident	72.3	Confident	72 Å²	72	64.7 Å²	64.7	33%	0.333	34%	0.343	S	S	.	.	H	α-helix	trans	-58.7	-45.9	174.6	-176.2	-76.1	0	0	0	111.5	E281 E282 I283 L287 L288 G289 D290 F292	E281-H285 WeakPolarHBondContact O-CB 3.48Å; E281-H285 PolarHBondContact O-N 2.94Å; E282-H285 PolarHBondContact O-N 2.97Å; I283-H285 VanDerWaalsContact C-N 3.28Å; I283-H285 PolarHBondContact O-N 2.75Å; H285-L287 VanDerWaalsContact C-N 3.3Å; H285-L287 PolarHBondContact O-N 3.36Å; H285-L288 PolarHBondContact O-N 2.91Å; H285-G289 CarbonylContact O-C 3.56Å; H285-G289 WeakPolarHBondContact O-CA 3.2Å; H285-G289 PolarHBondContact O-N 3.27Å; H285-D290 VanDerWaalsContact CE1-CG 3.48Å; H285-D290 IonicContact CE1-OD1 3.26Å; H285-D290 PolarHBondContact CE1-OD1 3.09Å; H285-D290 IonicContact ND1-OD1 2.66Å; H285-D290 IonicContact NE2-OD1 3.66Å; H285-D290 PolarHBondContact NE2-OD1 3.43Å; H285-F292 HydrophobicContact CB-CD1 4.44Å; H285-F292 HydrophobicContact CB-CE1 4.05Å; H285-F292 HydrophobicContact CB-CZ 4.3Å; H285-F292 AromaticContact CD2-CE1 3.5Å; H285-F292 VanDerWaalsContact CD2-CE1 3.5Å; H285-F292 WeakPolarHBondContact CD2-CE1 3.5Å
286	K	74.9	Confident	73.1	Confident	84 Å²	84	63.9 Å²	63.9	37%	0.365	34%	0.341	S	S	.	.	H	α-helix	trans	-63.8	-36.1	177	-172	68.2	-179.4	-166	0	112.5	E282 I283 E449	E282-K286 PolarHBondContact O-N 3.39Å; I283-K286 PolarHBondContact O-N 3.01Å; K286-E449 IonicContact NZ-OE2 3.66Å; K286-E449 PolarHBondContact NZ-OE2 3.18Å
287	L	73.9	Confident	74.4	Confident	22 Å²	22	62.8 Å²	62.8	12%	0.115	33%	0.329	C	S	.	.	H	α-helix	trans	-75.3	-34	-179.7	-70.8	178.7	0	0	0	113.5	H238 A244 I283 V284 H285 F325	H238-L287 PolarHBondContact CE1-O 3.03Å; H238-L287 PolarHBondContact ND1-O 2.66Å; H238-L287 VanDerWaalsContact ND1-O 3.14Å; A244-L287 HydrophobicContact CB-CD1 4.11Å; A244-L287 HydrophobicContact CB-CD2 3.93Å; I283-L287 HydrophobicContact CG2-CD1 3.96Å; I283-L287 HydrophobicContact CG2-CG 4.29Å; I283-L287 WeakPolarHBondContact O-CG 3.35Å; I283-L287 PolarHBondContact O-N 2.99Å; V284-L287 PolarHBondContact O-N 2.92Å; H285-L287 VanDerWaalsContact C-N 3.3Å; H285-L287 PolarHBondContact O-N 3.36Å; L287-F325 HydrophobicContact CD1-CD1 4.26Å
288	L	73.2	Confident	75.4	Confident	13 Å²	13	62.7 Å²	62.7	7%	0.068	32%	0.318	C	S	.	.	H	α-helix	trans	-115.7	-1.6	-172.4	-63.6	178.9	0	0	0	113.9	W234 V284 H285 F292 L296	W234-L288 HydrophobicContact CH2-CD2 4.31Å; W234-L288 HydrophobicContact CZ3-CD2 4.04Å; V284-L288 HydrophobicContact CG1-CD1 4.09Å; V284-L288 PolarHBondContact O-N 3.45Å; H285-L288 PolarHBondContact O-N 2.91Å; L288-F292 HydrophobicContact CB-CB 3.45Å; L288-F292 VanDerWaalsContact CB-CB 3.45Å; L288-F292 HydrophobicContact CD1-CB 4.21Å; L288-F292 HydrophobicContact CG-CB 4.49Å; L288-L296 HydrophobicContact CD1-CB 4.19Å; L288-L296 HydrophobicContact CD1-CD1 3.78Å
289	G	71.3	Confident	76.5	Confident	22 Å²	22	57.8 Å²	57.8	23%	0.227	29%	0.292	C	S	.	.			trans	69.8	176.5	-175.9	0	0	0	0	0	114.3	H285 K291 F292	H285-G289 CarbonylContact O-C 3.56Å; H285-G289 WeakPolarHBondContact O-CA 3.2Å; H285-G289 PolarHBondContact O-N 3.27Å; G289-K291 PolarHBondContact O-N 3.31Å; G289-F292 VanDerWaalsContact O-CB 3.23Å; G289-F292 WeakPolarHBondContact O-CB 3.47Å; G289-F292 WeakPolarHBondContact O-CD1 3.24Å; G289-F292 PolarHBondContact O-N 2.87Å; G289-F292 VanDerWaalsContact O-N 3.17Å
290	D	63.2	Low	77.4	Confident	132 Å²	132	57 Å²	57	71%	0.706	29%	0.286	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.5	-19.2	-170.6	-59.9	22.9	0	0	0	114	H285 F292	H285-D290 VanDerWaalsContact CE1-CG 3.48Å; H285-D290 IonicContact CE1-OD1 3.26Å; H285-D290 PolarHBondContact CE1-OD1 3.09Å; H285-D290 IonicContact ND1-OD1 2.66Å; H285-D290 IonicContact NE2-OD1 3.66Å; H285-D290 PolarHBondContact NE2-OD1 3.43Å; D290-F292 VanDerWaalsContact C-N 3.34Å; D290-F292 PolarHBondContact O-N 2.99Å
291	K	62.4	Low	78.4	Confident	148 Å²	148	62.5 Å²	62.5	64%	0.643	31%	0.306	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91	15.8	-179.5	-63.3	172.1	-173.5	155.5	0	113.3	G289 K293 E484	G289-K291 PolarHBondContact O-N 3.31Å; K291-K293 PolarHBondContact O-N 3.29Å; K291-E484 IonicContact NZ-OE2 2.99Å; K291-E484 PolarHBondContact NZ-OE2 3.45Å
292	F	71.1	Confident	79.6	Confident	36 Å²	36	59.4 Å²	59.4	16%	0.158	29%	0.293	C	S	.	.	H	α-helix	trans	-72.4	-26	-165	70.4	-74.1	0	0	0	118.2	V284 H285 L288 G289 D290 G294 Q295 L296	V284-F292 HydrophobicContact CG1-CD2 3.53Å; V284-F292 HydrophobicContact CG1-CE2 3.8Å; V284-F292 HydrophobicContact CG1-CG 4.45Å; H285-F292 HydrophobicContact CB-CD1 4.44Å; H285-F292 HydrophobicContact CB-CE1 4.05Å; H285-F292 HydrophobicContact CB-CZ 4.3Å; H285-F292 AromaticContact CD2-CE1 3.5Å; H285-F292 VanDerWaalsContact CD2-CE1 3.5Å; H285-F292 WeakPolarHBondContact CD2-CE1 3.5Å; L288-F292 HydrophobicContact CB-CB 3.45Å; L288-F292 VanDerWaalsContact CB-CB 3.45Å; L288-F292 HydrophobicContact CD1-CB 4.21Å; L288-F292 HydrophobicContact CG-CB 4.49Å; G289-F292 VanDerWaalsContact O-CB 3.23Å; G289-F292 WeakPolarHBondContact O-CB 3.47Å; G289-F292 WeakPolarHBondContact O-CD1 3.24Å; G289-F292 PolarHBondContact O-N 2.87Å; G289-F292 VanDerWaalsContact O-N 3.17Å; D290-F292 VanDerWaalsContact C-N 3.34Å; D290-F292 PolarHBondContact O-N 2.99Å; F292-G294 VanDerWaalsContact C-N 3.34Å; F292-G294 PolarHBondContact O-N 3.4Å; F292-Q295 PolarHBondContact O-N 3.19Å; F292-Q295 VanDerWaalsContact O-N 3.1Å; F292-L296 WeakPolarHBondContact O-CB 3.48Å; F292-L296 PolarHBondContact O-N 3.3Å
293	K	66.9	Low	80.5	Confident	158 Å²	158	54.9 Å²	54.9	69%	0.687	27%	0.271	S	S	*	.	H	α-helix	trans	-61.6	-38.8	-166.2	-167	176.1	-177.1	174.9	0	113.7	K291	K291-K293 PolarHBondContact O-N 3.29Å
294	G	73.3	Confident	81.6	Confident	57 Å²	57	56.2 Å²	56.2	59%	0.588	28%	0.28	S	S	*	.	H	α-helix	trans	-75.2	-34	176.5	0	0	0	0	0	113.2	F292 L298	F292-G294 VanDerWaalsContact C-N 3.34Å; F292-G294 PolarHBondContact O-N 3.4Å; G294-L298 PolarHBondContact O-N 3.29Å
295	Q	84.2	Confident	82.7	Confident	52 Å²	52	61.6 Å²	61.6	24%	0.243	31%	0.305	C	S	.	.	H	α-helix	trans	-71.1	-43.9	179.7	-64.8	175.8	-18.1	0	0	111.5	V237 F292 E297 L298 L299	V237-Q295 HydrophobicContact CB-CB 4.39Å; V237-Q295 HydrophobicContact CB-CG 4.27Å; V237-Q295 HydrophobicContact CG1-CB 3.95Å; V237-Q295 HydrophobicContact CG1-CG 3.64Å; F292-Q295 PolarHBondContact O-N 3.19Å; F292-Q295 VanDerWaalsContact O-N 3.1Å; Q295-E297 VanDerWaalsContact C-N 3.33Å; Q295-E297 PolarHBondContact O-N 2.77Å; Q295-L298 WeakPolarHBondContact O-CB 3.32Å; Q295-L298 PolarHBondContact O-N 3.35Å; Q295-L299 WeakPolarHBondContact O-CG 3.38Å; Q295-L299 PolarHBondContact O-N 3.05Å
296	L	87.4	Confident	83.9	Confident	10 Å²	10	59.3 Å²	59.3	5%	0.052	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-40.8	179.8	-173.3	69.6	0	0	0	111.9	V284 L288 F292 L299 R300 F321 R322 F325	V284-L296 HydrophobicContact CG1-CD1 4.36Å; V284-L296 HydrophobicContact CG1-CD2 3.96Å; L288-L296 HydrophobicContact CD1-CB 4.19Å; L288-L296 HydrophobicContact CD1-CD1 3.78Å; F292-L296 WeakPolarHBondContact O-CB 3.48Å; F292-L296 PolarHBondContact O-N 3.3Å; L296-L299 PolarHBondContact O-N 3.29Å; L296-R300 WeakPolarHBondContact O-CB 3.2Å; L296-R300 PolarHBondContact O-N 3.5Å; L296-F321 HydrophobicContact CD1-CD1 3.8Å; L296-F321 HydrophobicContact CD1-CE1 3.74Å; L296-F321 HydrophobicContact CG-CD1 4.18Å; L296-F321 HydrophobicContact CG-CE1 4.36Å; L296-R322 HydrophobicContact CD2-CG 3.55Å; L296-F325 HydrophobicContact CD1-CD2 3.92Å; L296-F325 HydrophobicContact CD1-CE2 3.86Å; L296-F325 HydrophobicContact CD1-CG 4.43Å; L296-F325 HydrophobicContact CD1-CZ 4.3Å
297	E	90.7	Very high	84.9	Confident	67 Å²	67	55.3 Å²	55.3	31%	0.313	28%	0.281	S	S	.	.	H	α-helix	trans	-70.7	-34.3	177.1	178.2	54.5	-155.2	0	0	112.4	Q295 R300 R301	Q295-E297 VanDerWaalsContact C-N 3.33Å; Q295-E297 PolarHBondContact O-N 2.77Å; E297-R300 IonicContact OE1-CZ 3Å; E297-R300 IonicContact OE1-NE 3.36Å; E297-R300 IonicContact OE1-NH2 3.85Å; E297-R300 PolarHBondContact OE1-NH2 3.37Å; E297-R300 IonicContact OE2-CZ 2.81Å; E297-R300 IonicContact OE2-NE 3.55Å; E297-R300 PolarHBondContact OE2-NE 3.48Å; E297-R300 IonicContact OE2-NH2 3.95Å; E297-R300 PolarHBondContact OE2-NH2 2.86Å; E297-R301 VanDerWaalsContact O-CG 3.32Å; E297-R301 WeakPolarHBondContact O-CG 3.44Å; E297-R301 PolarHBondContact O-N 2.87Å; E297-R301 VanDerWaalsContact O-N 3.12Å; E297-R301 PolarHBondContact O-NE 3.29Å; E297-R301 WeakPolarHBondContact OE1-CG 3.36Å; E297-R301 IonicContact OE1-NE 2.82Å
298	L	92.9	Very high	86.1	Confident	68 Å²	68	59.7 Å²	59.7	36%	0.356	30%	0.297	S	S	.	.	H	α-helix	trans	-61.8	-51.4	169.6	175.3	62.8	0	0	0	110.9	G294 Q295 R300 R301 L302	G294-L298 PolarHBondContact O-N 3.29Å; Q295-L298 WeakPolarHBondContact O-CB 3.32Å; Q295-L298 PolarHBondContact O-N 3.35Å; L298-R300 VanDerWaalsContact C-N 3.32Å; L298-R300 PolarHBondContact O-N 2.99Å; L298-R301 PolarHBondContact O-N 3.48Å; L298-L302 HydrophobicContact CD1-CD1 4.02Å; L298-L302 HydrophobicContact CD1-CG 4.23Å; L298-L302 HydrophobicContact CG-CD1 4.07Å; L298-L302 WeakPolarHBondContact O-CG 3.34Å; L298-L302 PolarHBondContact O-N 3.18Å
299	L	94.1	Very high	87.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-57.9	-44.5	178.2	-71.2	175.3	0	0	0	111.4	L230 A233 W234 V237 Q295 L296 R301 L302 F303 F321 F325	L230-L299 HydrophobicContact CD1-CD2 4.34Å; A233-L299 HydrophobicContact CB-CD2 4Å; W234-L299 HydrophobicContact CB-CD2 4.44Å; W234-L299 HydrophobicContact CE3-CD1 3.79Å; W234-L299 HydrophobicContact CE3-CD2 4.27Å; W234-L299 HydrophobicContact CZ3-CD1 3.93Å; V237-L299 HydrophobicContact CG2-CD1 4.04Å; Q295-L299 WeakPolarHBondContact O-CG 3.38Å; Q295-L299 PolarHBondContact O-N 3.05Å; L296-L299 PolarHBondContact O-N 3.29Å; L299-R301 PolarHBondContact O-N 3.33Å; L299-L302 PolarHBondContact O-N 3.03Å; L299-F303 WeakPolarHBondContact O-CB 3.45Å; L299-F303 PolarHBondContact O-N 3.09Å; L299-F321 HydrophobicContact CB-CE1 4.09Å; L299-F321 HydrophobicContact CB-CZ 4.16Å; L299-F325 HydrophobicContact CD1-CZ 4.3Å
300	R	95.5	Very high	88.5	Confident	42 Å²	42	66.4 Å²	66.4	16%	0.158	32%	0.322	C	S	.	.	H	α-helix	trans	-59.3	-44.9	177.9	-170.2	-172	69.2	73.1	4.3	112	L296 E297 L298 F303 T304 F316 F321	L296-R300 WeakPolarHBondContact O-CB 3.2Å; L296-R300 PolarHBondContact O-N 3.5Å; E297-R300 IonicContact OE1-CZ 3Å; E297-R300 IonicContact OE1-NE 3.36Å; E297-R300 IonicContact OE1-NH2 3.85Å; E297-R300 PolarHBondContact OE1-NH2 3.37Å; E297-R300 IonicContact OE2-CZ 2.81Å; E297-R300 IonicContact OE2-NE 3.55Å; E297-R300 PolarHBondContact OE2-NE 3.48Å; E297-R300 IonicContact OE2-NH2 3.95Å; E297-R300 PolarHBondContact OE2-NH2 2.86Å; L298-R300 VanDerWaalsContact C-N 3.32Å; L298-R300 PolarHBondContact O-N 2.99Å; R300-F303 PolarHBondContact O-N 3.16Å; R300-T304 WeakPolarHBondContact O-CB 3.41Å; R300-T304 PolarHBondContact O-N 3.37Å; R300-T304 PolarHBondContact O-OG1 3.2Å; R300-F316 PolarHBondContact NH1-O 3.09Å; R300-F321 HydrophobicContact CB-CD1 3.55Å; R300-F321 HydrophobicContact CB-CD2 4.43Å; R300-F321 HydrophobicContact CB-CE1 3.63Å; R300-F321 HydrophobicContact CB-CG 3.95Å; R300-F321 HydrophobicContact CB-CZ 4.13Å; R300-F321 HydrophobicContact CG-CB 3.84Å; R300-F321 HydrophobicContact CG-CD1 3.82Å; R300-F321 HydrophobicContact CG-CD2 4.1Å; R300-F321 HydrophobicContact CG-CE1 4.29Å; R300-F321 HydrophobicContact CG-CG 3.67Å
301	R	96.9	Very high	90.1	Very high	138 Å²	138	62 Å²	62	52%	0.521	30%	0.304	S	S	.	.	H	α-helix	trans	-63.6	-47.3	178.7	-73.9	-177.8	-62.7	160.5	0.5	111.7	E297 L298 L299 F303 T304 E305	E297-R301 VanDerWaalsContact O-CG 3.32Å; E297-R301 WeakPolarHBondContact O-CG 3.44Å; E297-R301 PolarHBondContact O-N 2.87Å; E297-R301 VanDerWaalsContact O-N 3.12Å; E297-R301 PolarHBondContact O-NE 3.29Å; E297-R301 WeakPolarHBondContact OE1-CG 3.36Å; E297-R301 IonicContact OE1-NE 2.82Å; L298-R301 PolarHBondContact O-N 3.48Å; L299-R301 PolarHBondContact O-N 3.33Å; R301-F303 VanDerWaalsContact C-N 3.34Å; R301-F303 PolarHBondContact O-N 2.87Å; R301-T304 WeakPolarHBondContact O-CB 3.47Å; R301-T304 PolarHBondContact O-N 3.39Å; R301-E305 PolarHBondContact O-N 3.05Å
302	L	97.7	Very high	91.7	Very high	24 Å²	24	54.9 Å²	54.9	13%	0.126	27%	0.273	C	S	.	.	H	α-helix	trans	-63.3	-40.4	176.2	-67.1	174.1	0	0	0	111.9	K229 L230 A233 L298 L299 T304 E305 A306	K229-L302 HydrophobicContact CB-CD2 4.1Å; K229-L302 HydrophobicContact CD-CD2 4.41Å; L230-L302 HydrophobicContact CB-CB 4.33Å; L230-L302 HydrophobicContact CD1-CB 4.05Å; A233-L302 HydrophobicContact CB-CD1 3.4Å; L298-L302 HydrophobicContact CD1-CD1 4.02Å; L298-L302 HydrophobicContact CD1-CG 4.23Å; L298-L302 HydrophobicContact CG-CD1 4.07Å; L298-L302 WeakPolarHBondContact O-CG 3.34Å; L298-L302 PolarHBondContact O-N 3.18Å; L299-L302 PolarHBondContact O-N 3.03Å; L302-T304 VanDerWaalsContact C-N 3.33Å; L302-T304 PolarHBondContact O-N 3.06Å; L302-E305 PolarHBondContact O-N 3.34Å; L302-A306 WeakPolarHBondContact O-CB 3.27Å; L302-A306 PolarHBondContact O-N 2.94Å
303	F	97.8	Very high	93	Very high	0 Å²	0	55.5 Å²	55.5	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-40.9	175.7	-170.6	-95.1	0	0	0	111.4	L230 I246 M249 A250 V253 L299 R300 R301 A306 L307 F316 F321	L230-F303 HydrophobicContact CD1-CB 4.12Å; L230-F303 HydrophobicContact CD1-CD2 4.44Å; L230-F303 HydrophobicContact CD2-CB 4.48Å; L230-F303 HydrophobicContact CD2-CD2 3.76Å; I246-F303 HydrophobicContact CD1-CD2 3.94Å; I246-F303 HydrophobicContact CD1-CE2 4.32Å; I246-F303 HydrophobicContact CG1-CD2 4.35Å; M249-F303 HydrophobicContact CB-CE2 3.82Å; M249-F303 HydrophobicContact CB-CZ 3.89Å; M249-F303 HydrophobicContact CE-CZ 4.47Å; A250-F303 HydrophobicContact CB-CE2 4.27Å; V253-F303 HydrophobicContact CG2-CE1 3.8Å; V253-F303 HydrophobicContact CG2-CZ 3.66Å; L299-F303 WeakPolarHBondContact O-CB 3.45Å; L299-F303 PolarHBondContact O-N 3.09Å; R300-F303 PolarHBondContact O-N 3.16Å; R301-F303 VanDerWaalsContact C-N 3.34Å; R301-F303 PolarHBondContact O-N 2.87Å; F303-A306 PolarHBondContact O-N 3.45Å; F303-L307 HydrophobicContact CD2-CD1 3.91Å; F303-L307 HydrophobicContact CE2-CD1 3.58Å; F303-L307 HydrophobicContact CZ-CD1 3.94Å; F303-L307 WeakPolarHBondContact O-CB 3.23Å; F303-L307 PolarHBondContact O-N 3.45Å; F303-F316 AromaticContact CD1-CD1 3.83Å; F303-F316 HydrophobicContact CD1-CD1 3.83Å; F303-F316 AromaticContact CD1-CE1 3.49Å; F303-F316 HydrophobicContact CD1-CE1 3.49Å; F303-F316 VanDerWaalsContact CD1-CE1 3.49Å; F303-F316 HydrophobicContact CD1-CZ 4.46Å; F303-F316 HydrophobicContact CE1-CD1 4.19Å; F303-F316 AromaticContact CE1-CE1 3.57Å; F303-F316 HydrophobicContact CE1-CE1 3.57Å; F303-F316 HydrophobicContact CE1-CZ 4.12Å; F303-F321 HydrophobicContact CB-CE2 3.79Å; F303-F321 HydrophobicContact CB-CZ 4.07Å; F303-F321 HydrophobicContact CD1-CD2 4.2Å; F303-F321 AromaticContact CD1-CE2 3.66Å; F303-F321 HydrophobicContact CD1-CE2 3.66Å; F303-F321 HydrophobicContact CD2-CE2 4.2Å; F303-F321 HydrophobicContact CE1-CE2 4.28Å; F303-F321 AromaticContact CG-CE2 3.63Å; F303-F321 HydrophobicContact CG-CE2 3.63Å; F303-F321 HydrophobicContact CG-CZ 4.31Å
304	T	98.1	Very high	94.4	Very high	35 Å²	35	52 Å²	52	22%	0.215	27%	0.268	C	S	.	.	H	α-helix	trans	-65.1	-49.1	175.9	-57.1	0	0	0	0	110.9	R300 R301 L302 A306 L307 Y308 F316	R300-T304 WeakPolarHBondContact O-CB 3.41Å; R300-T304 PolarHBondContact O-N 3.37Å; R300-T304 PolarHBondContact O-OG1 3.2Å; R301-T304 WeakPolarHBondContact O-CB 3.47Å; R301-T304 PolarHBondContact O-N 3.39Å; L302-T304 VanDerWaalsContact C-N 3.33Å; L302-T304 PolarHBondContact O-N 3.06Å; T304-A306 VanDerWaalsContact C-N 3.27Å; T304-A306 PolarHBondContact O-N 2.91Å; T304-L307 PolarHBondContact O-N 3.48Å; T304-Y308 HydrophobicContact CG2-CD2 4.03Å; T304-Y308 VanDerWaalsContact O-CB 3.27Å; T304-Y308 WeakPolarHBondContact O-CB 3.23Å; T304-Y308 PolarHBondContact O-N 2.62Å; T304-F316 HydrophobicContact CG2-CB 4.48Å; T304-F316 HydrophobicContact CG2-CD1 4.23Å; T304-F316 WeakPolarHBondContact OG1-CD1 3.14Å
305	E	97.9	Very high	95.4	Very high	114 Å²	114	50.8 Å²	50.8	53%	0.533	25%	0.245	S	C	.	.	H	α-helix	trans	-55.9	-43.9	177	-176.1	-176.5	162.1	0	0	111.5	P226 K229 R301 L302	P226-E305 HydrophobicContact CB-CG 4.38Å; K229-E305 IonicContact NZ-OE1 2.8Å; R301-E305 PolarHBondContact O-N 3.05Å; L302-E305 PolarHBondContact O-N 3.34Å
306	A	97.6	Very high	96	Very high	23 Å²	23	48.7 Å²	48.7	19%	0.19	24%	0.236	C	C	.	.	H	α-helix	trans	-76.1	-35	-176.5	0	0	0	0	0	113.8	P226 L227 L302 F303 T304	P226-A306 HydrophobicContact CB-CB 3.73Å; L227-A306 HydrophobicContact CD2-CB 3.89Å; L227-A306 HydrophobicContact CG-CB 4.34Å; L302-A306 WeakPolarHBondContact O-CB 3.27Å; L302-A306 PolarHBondContact O-N 2.94Å; F303-A306 PolarHBondContact O-N 3.45Å; T304-A306 VanDerWaalsContact C-N 3.27Å; T304-A306 PolarHBondContact O-N 2.91Å
307	L	97.9	Very high	96.5	Very high	1 Å²	1	51.1 Å²	51.1	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-133.9	0.7	-158.9	-66.9	169	0	0	0	115.9	V213 L214 L227 L230 A250 V253 F303 T304 E309 F316	V213-L307 HydrophobicContact CG1-CD2 4.18Å; L214-L307 HydrophobicContact CD2-CD2 3.53Å; L227-L307 HydrophobicContact CD2-CD1 4.22Å; L227-L307 HydrophobicContact CD2-CD2 3.99Å; L227-L307 HydrophobicContact CD2-CG 4.06Å; L230-L307 HydrophobicContact CD2-CD1 4.47Å; A250-L307 HydrophobicContact CB-CD1 3.5Å; V253-L307 HydrophobicContact CG1-CB 4.01Å; V253-L307 WeakPolarHBondContact CG1-O 3.25Å; F303-L307 HydrophobicContact CD2-CD1 3.91Å; F303-L307 HydrophobicContact CE2-CD1 3.58Å; F303-L307 HydrophobicContact CZ-CD1 3.94Å; F303-L307 WeakPolarHBondContact O-CB 3.23Å; F303-L307 PolarHBondContact O-N 3.45Å; T304-L307 PolarHBondContact O-N 3.48Å; L307-E309 PolarHBondContact O-N 3.38Å; L307-F316 HydrophobicContact CB-CE1 4.42Å
308	Y	97.9	Very high	96.5	Very high	114 Å²	114	51 Å²	51	45%	0.447	26%	0.256	S	S	.	.			trans	-43.8	133.9	-173.9	-174.5	-98.5	0	0	0	113.4	K257 T304 F316	K257-Y308 PolarHBondContact NZ-O 3.44Å; T304-Y308 HydrophobicContact CG2-CD2 4.03Å; T304-Y308 VanDerWaalsContact O-CB 3.27Å; T304-Y308 WeakPolarHBondContact O-CB 3.23Å; T304-Y308 PolarHBondContact O-N 2.62Å; Y308-F316 HydrophobicContact CD2-CB 4.23Å; Y308-F316 HydrophobicContact CD2-CD1 4.31Å; Y308-F316 AromaticContact CD2-CD2 3.83Å; Y308-F316 HydrophobicContact CD2-CD2 3.83Å; Y308-F316 HydrophobicContact CD2-CE2 4.23Å; Y308-F316 AromaticContact CD2-CG 3.86Å; Y308-F316 HydrophobicContact CD2-CG 3.86Å; Y308-F316 HydrophobicContact CE2-CB 4.42Å; Y308-F316 HydrophobicContact CE2-CD2 4.16Å; Y308-F316 HydrophobicContact CE2-CG 4.37Å
309	E	97.3	Very high	96.4	Very high	22 Å²	22	53 Å²	53	10%	0.103	27%	0.267	C	S	.	.			trans	-144.4	121.4	-179.2	174.3	52.1	-139.5	0	0	109.1	V253 K257 K262 L307 A311 V312 S313 F316	V253-E309 HydrophobicContact CG1-CB 4.12Å; K257-E309 HydrophobicContact CB-CG 4.33Å; K257-E309 HydrophobicContact CD-CB 4.39Å; K257-E309 WeakPolarHBondContact CG-OE2 3.48Å; K262-E309 IonicContact NZ-OE1 3.86Å; K262-E309 PolarHBondContact NZ-OE1 3.15Å; K262-E309 IonicContact NZ-OE2 2.72Å; L307-E309 PolarHBondContact O-N 3.38Å; E309-A311 VanDerWaalsContact C-N 3.32Å; E309-A311 HydrophobicContact CG-CB 4.28Å; E309-A311 PolarHBondContact O-N 3.45Å; E309-A311 PolarHBondContact OE1-N 3.45Å; E309-V312 HydrophobicContact CB-CG2 3.86Å; E309-V312 HydrophobicContact CG-CG2 3.85Å; E309-V312 CarbonylContact O-C 3.36Å; E309-V312 PolarHBondContact O-N 3.38Å; E309-V312 VanDerWaalsContact O-N 3.16Å; E309-S313 PolarHBondContact O-N 3.19Å; E309-S313 VanDerWaalsContact O-N 3.11Å; E309-F316 HydrophobicContact CB-CE2 4.45Å
310	E	97.4	Very high	96.3	Very high	153 Å²	153	53.5 Å²	53.5	72%	0.715	27%	0.273	S	S	*	.	G	3₁₀ helix	trans	-61.2	-39.4	-173.8	-173.7	-179.9	179.6	0	0	112.5	V312 S313	E310-V312 PolarHBondContact O-N 2.81Å; E310-V312 VanDerWaalsContact O-N 3.1Å; E310-S313 WeakPolarHBondContact O-CB 3.36Å; E310-S313 PolarHBondContact O-N 3.05Å; E310-S313 PolarHBondContact O-OG 2.78Å; E310-S313 VanDerWaalsContact O-OG 3.11Å
311	A	97.2	Very high	96.2	Very high	39 Å²	39	51.6 Å²	51.6	32%	0.322	27%	0.265	S	S	.	.	G	3₁₀ helix	trans	-61.7	-20	-179.7	0	0	0	0	0	113.8	V256 K262 I266 E309	V256-A311 HydrophobicContact CG1-CB 4.47Å; K262-A311 HydrophobicContact CD-CB 3.76Å; I266-A311 HydrophobicContact CD1-CB 4.32Å; I266-A311 WeakPolarHBondContact CD1-O 3.16Å; E309-A311 VanDerWaalsContact C-N 3.32Å; E309-A311 HydrophobicContact CG-CB 4.28Å; E309-A311 PolarHBondContact O-N 3.45Å; E309-A311 PolarHBondContact OE1-N 3.45Å
312	V	96.8	Very high	95.9	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.249	C	C	.	.	G	3₁₀ helix	trans	-127.6	31.9	175.3	-71.8	0	0	0	0	111.5	V256 I266 E309 E310 Q314 W315 F316	V256-V312 HydrophobicContact CG1-CG1 4.03Å; V256-V312 HydrophobicContact CG1-CG2 4.46Å; V256-V312 HydrophobicContact CG2-CG1 4.4Å; I266-V312 HydrophobicContact CD1-CG1 3.77Å; I266-V312 HydrophobicContact CG1-CG1 3.66Å; E309-V312 HydrophobicContact CB-CG2 3.86Å; E309-V312 HydrophobicContact CG-CG2 3.85Å; E309-V312 CarbonylContact O-C 3.36Å; E309-V312 PolarHBondContact O-N 3.38Å; E309-V312 VanDerWaalsContact O-N 3.16Å; E310-V312 PolarHBondContact O-N 2.81Å; E310-V312 VanDerWaalsContact O-N 3.1Å; V312-Q314 VanDerWaalsContact C-OE1 3.3Å; V312-Q314 PolarHBondContact O-N 3.25Å; V312-W315 HydrophobicContact CB-CD2 3.7Å; V312-W315 HydrophobicContact CB-CE3 3.56Å; V312-W315 HydrophobicContact CB-CG 4.17Å; V312-W315 HydrophobicContact CB-CZ3 4.01Å; V312-W315 HydrophobicContact CG1-CD2 4.03Å; V312-W315 HydrophobicContact CG1-CE3 3.87Å; V312-W315 HydrophobicContact CG1-CH2 3.93Å; V312-W315 HydrophobicContact CG1-CZ2 4.09Å; V312-W315 HydrophobicContact CG1-CZ3 3.83Å; V312-W315 HydrophobicContact CG2-CD2 4.31Å; V312-W315 HydrophobicContact CG2-CE3 3.68Å; V312-W315 HydrophobicContact CG2-CZ3 4.01Å; V312-W315 VanDerWaalsContact O-CB 3.29Å; V312-W315 WeakPolarHBondContact O-CB 3.26Å; V312-W315 PolarHBondContact O-N 3.15Å; V312-F316 HydrophobicContact CG2-CE2 4.17Å; V312-F316 WeakPolarHBondContact O-CD2 3.31Å
313	S	97.3	Very high	95.5	Very high	48 Å²	48	47.6 Å²	47.6	34%	0.336	25%	0.253	S	S	.	.	G	3₁₀ helix	trans	-51.9	-31.3	-179.6	52.5	0	0	0	0	113.3	E309 E310 W315 F316	E309-S313 PolarHBondContact O-N 3.19Å; E309-S313 VanDerWaalsContact O-N 3.11Å; E310-S313 WeakPolarHBondContact O-CB 3.36Å; E310-S313 PolarHBondContact O-N 3.05Å; E310-S313 PolarHBondContact O-OG 2.78Å; E310-S313 VanDerWaalsContact O-OG 3.11Å; S313-W315 PolarHBondContact O-N 3.21Å; S313-F316 PolarHBondContact O-N 3.49Å; S313-F316 VanDerWaalsContact O-N 3.08Å
314	Q	95.6	Very high	95.2	Very high	86 Å²	86	47.7 Å²	47.7	40%	0.402	25%	0.254	S	S	.	.	G	3₁₀ helix	trans	-56.6	-33.8	175.5	69.5	-77.5	-1.9	0	0	113.2	V312 F316 T317 G320	V312-Q314 VanDerWaalsContact C-OE1 3.3Å; V312-Q314 PolarHBondContact O-N 3.25Å; Q314-F316 PolarHBondContact O-N 2.93Å; Q314-T317 PolarHBondContact O-N 3.47Å; Q314-T317 PolarHBondContact O-OG1 3.07Å; Q314-G320 WeakPolarHBondContact O-CA 3.49Å
315	W	95.9	Very high	94.7	Very high	30 Å²	30	46.2 Å²	46.2	11%	0.114	24%	0.244	C	C	.	.	G	3₁₀ helix	trans	-69.4	-16	179.9	-70.5	-9.9	0	0	0	113.9	M252 V253 V256 F269 V312 S313 F321 L324	M252-W315 HydrophobicContact CB-CH2 4.46Å; M252-W315 HydrophobicContact CB-CZ3 4.21Å; M252-W315 HydrophobicContact CE-CH2 4.13Å; M252-W315 HydrophobicContact CE-CZ2 4.38Å; V253-W315 HydrophobicContact CG2-CE3 3.85Å; V253-W315 HydrophobicContact CG2-CZ3 4.09Å; V256-W315 HydrophobicContact CG2-CH2 4.24Å; V256-W315 HydrophobicContact CG2-CZ3 4.34Å; F269-W315 HydrophobicContact CB-CH2 4.25Å; F269-W315 HydrophobicContact CB-CZ2 4.13Å; F269-W315 AromaticContact CD2-CH2 3.73Å; F269-W315 HydrophobicContact CD2-CH2 3.73Å; F269-W315 HydrophobicContact CD2-CZ2 4.42Å; F269-W315 HydrophobicContact CE2-CH2 4.41Å; F269-W315 HydrophobicContact CG-CH2 4.17Å; V312-W315 HydrophobicContact CB-CD2 3.7Å; V312-W315 HydrophobicContact CB-CE3 3.56Å; V312-W315 HydrophobicContact CB-CG 4.17Å; V312-W315 HydrophobicContact CB-CZ3 4.01Å; V312-W315 HydrophobicContact CG1-CD2 4.03Å; V312-W315 HydrophobicContact CG1-CE3 3.87Å; V312-W315 HydrophobicContact CG1-CH2 3.93Å; V312-W315 HydrophobicContact CG1-CZ2 4.09Å; V312-W315 HydrophobicContact CG1-CZ3 3.83Å; V312-W315 HydrophobicContact CG2-CD2 4.31Å; V312-W315 HydrophobicContact CG2-CE3 3.68Å; V312-W315 HydrophobicContact CG2-CZ3 4.01Å; V312-W315 VanDerWaalsContact O-CB 3.29Å; V312-W315 WeakPolarHBondContact O-CB 3.26Å; V312-W315 PolarHBondContact O-N 3.15Å; S313-W315 PolarHBondContact O-N 3.21Å; W315-F321 WeakPolarHBondContact O-CA 3.4Å; W315-F321 PolarHBondContact O-N 2.77Å; W315-L324 HydrophobicContact CB-CD1 3.54Å; W315-L324 HydrophobicContact CB-CG 4.11Å; W315-L324 HydrophobicContact CD2-CD1 3.88Å; W315-L324 HydrophobicContact CD2-CD2 3.8Å; W315-L324 HydrophobicContact CD2-CG 4.15Å; W315-L324 HydrophobicContact CE3-CD1 4.08Å; W315-L324 HydrophobicContact CE3-CD2 4.31Å; W315-L324 HydrophobicContact CG-CD1 3.65Å; W315-L324 HydrophobicContact CG-CD2 3.97Å; W315-L324 HydrophobicContact CG-CG 3.84Å; W315-L324 HydrophobicContact CZ2-CD2 4.3Å
316	F	97.1	Very high	94.1	Very high	9 Å²	9	40.8 Å²	40.8	4%	0.039	22%	0.219	C	C	.	.	G	3₁₀ helix	trans	-97.6	-2.4	179.7	-59.6	-86.6	0	0	0	112.5	V253 R300 F303 T304 L307 Y308 E309 V312 S313 Q314	V253-F316 HydrophobicContact CG1-CZ 3.99Å; V253-F316 HydrophobicContact CG2-CZ 4.08Å; R300-F316 PolarHBondContact NH1-O 3.09Å; F303-F316 AromaticContact CD1-CD1 3.83Å; F303-F316 HydrophobicContact CD1-CD1 3.83Å; F303-F316 AromaticContact CD1-CE1 3.49Å; F303-F316 HydrophobicContact CD1-CE1 3.49Å; F303-F316 VanDerWaalsContact CD1-CE1 3.49Å; F303-F316 HydrophobicContact CD1-CZ 4.46Å; F303-F316 HydrophobicContact CE1-CD1 4.19Å; F303-F316 AromaticContact CE1-CE1 3.57Å; F303-F316 HydrophobicContact CE1-CE1 3.57Å; F303-F316 HydrophobicContact CE1-CZ 4.12Å; T304-F316 HydrophobicContact CG2-CB 4.48Å; T304-F316 HydrophobicContact CG2-CD1 4.23Å; T304-F316 WeakPolarHBondContact OG1-CD1 3.14Å; L307-F316 HydrophobicContact CB-CE1 4.42Å; Y308-F316 HydrophobicContact CD2-CB 4.23Å; Y308-F316 HydrophobicContact CD2-CD1 4.31Å; Y308-F316 AromaticContact CD2-CD2 3.83Å; Y308-F316 HydrophobicContact CD2-CD2 3.83Å; Y308-F316 HydrophobicContact CD2-CE2 4.23Å; Y308-F316 AromaticContact CD2-CG 3.86Å; Y308-F316 HydrophobicContact CD2-CG 3.86Å; Y308-F316 HydrophobicContact CE2-CB 4.42Å; Y308-F316 HydrophobicContact CE2-CD2 4.16Å; Y308-F316 HydrophobicContact CE2-CG 4.37Å; E309-F316 HydrophobicContact CB-CE2 4.45Å; V312-F316 HydrophobicContact CG2-CE2 4.17Å; V312-F316 WeakPolarHBondContact O-CD2 3.31Å; S313-F316 PolarHBondContact O-N 3.49Å; S313-F316 VanDerWaalsContact O-N 3.08Å; Q314-F316 PolarHBondContact O-N 2.93Å
317	T	95.9	Very high	93.8	Very high	61 Å²	61	40 Å²	40	37%	0.374	21%	0.212	S	C	.	.	S	Bend	trans	-74.3	158	170.2	69.2	0	0	0	0	110.3	Q314 D319 G320 F321	Q314-T317 PolarHBondContact O-N 3.47Å; Q314-T317 PolarHBondContact O-OG1 3.07Å; T317-D319 VanDerWaalsContact C-N 3.29Å; T317-D319 PolarHBondContact O-N 3.2Å; T317-G320 PolarHBondContact O-N 2.88Å; T317-G320 PolarHBondContact OG1-N 3.27Å; T317-F321 VanDerWaalsContact O-CB 3.28Å; T317-F321 WeakPolarHBondContact O-CB 3.3Å; T317-F321 PolarHBondContact O-N 3.2Å
318	P	92.2	Very high	93.4	Very high	65 Å²	65	40.3 Å²	40.3	42%	0.422	21%	0.213	S	C	.	.	H	α-helix	trans	-52.2	-46.8	176.1	-28.5	36.5	0	0	0	113.1	R322	P318-R322 WeakPolarHBondContact O-CG 3.25Å; P318-R322 PolarHBondContact O-N 2.64Å
319	D	90.4	Very high	92.7	Very high	108 Å²	108	35.5 Å²	35.5	58%	0.578	20%	0.199	S	C	*	.	H	α-helix	trans	-70.4	-47	-179.4	-59.3	-27.4	0	0	0	111.2	T317 F321 R322 S323	T317-D319 VanDerWaalsContact C-N 3.29Å; T317-D319 PolarHBondContact O-N 3.2Å; D319-F321 VanDerWaalsContact C-N 3.27Å; D319-F321 PolarHBondContact O-N 2.77Å; D319-R322 WeakPolarHBondContact O-CB 3.45Å; D319-R322 PolarHBondContact O-N 2.87Å; D319-R322 VanDerWaalsContact O-N 3.12Å; D319-S323 PolarHBondContact O-N 2.86Å; D319-S323 PolarHBondContact O-OG 3Å
320	G	92.7	Very high	92.1	Very high	12 Å²	12	35.3 Å²	35.3	12%	0.124	20%	0.199	C	C	.	.	H	α-helix	trans	-66.2	-28.8	-179.3	0	0	0	0	0	113.9	Q314 T317 L324	Q314-G320 WeakPolarHBondContact O-CA 3.49Å; T317-G320 PolarHBondContact O-N 2.88Å; T317-G320 PolarHBondContact OG1-N 3.27Å; G320-L324 PolarHBondContact O-N 3.46Å
321	F	93	Very high	91.7	Very high	1 Å²	1	29 Å²	29	0%	0.004	17%	0.17	C	C	.	.	H	α-helix	trans	-69.6	-41.2	173	-167.6	-113.8	0	0	0	111.2	I246 M249 L296 L299 R300 F303 W315 T317 D319 L324 F325	I246-F321 HydrophobicContact CD1-CZ 4.25Å; M249-F321 HydrophobicContact CE-CD2 3.67Å; M249-F321 HydrophobicContact CE-CE2 3.33Å; M249-F321 HydrophobicContact CE-CZ 3.99Å; L296-F321 HydrophobicContact CD1-CD1 3.8Å; L296-F321 HydrophobicContact CD1-CE1 3.74Å; L296-F321 HydrophobicContact CG-CD1 4.18Å; L296-F321 HydrophobicContact CG-CE1 4.36Å; L299-F321 HydrophobicContact CB-CE1 4.09Å; L299-F321 HydrophobicContact CB-CZ 4.16Å; R300-F321 HydrophobicContact CB-CD1 3.55Å; R300-F321 HydrophobicContact CB-CD2 4.43Å; R300-F321 HydrophobicContact CB-CE1 3.63Å; R300-F321 HydrophobicContact CB-CG 3.95Å; R300-F321 HydrophobicContact CB-CZ 4.13Å; R300-F321 HydrophobicContact CG-CB 3.84Å; R300-F321 HydrophobicContact CG-CD1 3.82Å; R300-F321 HydrophobicContact CG-CD2 4.1Å; R300-F321 HydrophobicContact CG-CE1 4.29Å; R300-F321 HydrophobicContact CG-CG 3.67Å; F303-F321 HydrophobicContact CB-CE2 3.79Å; F303-F321 HydrophobicContact CB-CZ 4.07Å; F303-F321 HydrophobicContact CD1-CD2 4.2Å; F303-F321 AromaticContact CD1-CE2 3.66Å; F303-F321 HydrophobicContact CD1-CE2 3.66Å; F303-F321 HydrophobicContact CD2-CE2 4.2Å; F303-F321 HydrophobicContact CE1-CE2 4.28Å; F303-F321 AromaticContact CG-CE2 3.63Å; F303-F321 HydrophobicContact CG-CE2 3.63Å; F303-F321 HydrophobicContact CG-CZ 4.31Å; W315-F321 WeakPolarHBondContact O-CA 3.4Å; W315-F321 PolarHBondContact O-N 2.77Å; T317-F321 VanDerWaalsContact O-CB 3.28Å; T317-F321 WeakPolarHBondContact O-CB 3.3Å; T317-F321 PolarHBondContact O-N 3.2Å; D319-F321 VanDerWaalsContact C-N 3.27Å; D319-F321 PolarHBondContact O-N 2.77Å; F321-L324 WeakPolarHBondContact O-CB 3.18Å; F321-L324 PolarHBondContact O-N 3.5Å; F321-F325 HydrophobicContact CD1-CD2 4.06Å; F321-F325 AromaticContact CD1-CE2 3.93Å; F321-F325 HydrophobicContact CD1-CE2 3.93Å; F321-F325 AromaticContact CE1-CD2 3.96Å; F321-F325 HydrophobicContact CE1-CD2 3.96Å; F321-F325 AromaticContact CE1-CE2 3.34Å; F321-F325 HydrophobicContact CE1-CE2 3.34Å; F321-F325 HydrophobicContact CE1-CZ 4.33Å; F321-F325 HydrophobicContact CE2-CE2 4.12Å; F321-F325 HydrophobicContact CZ-CD2 4.29Å; F321-F325 AromaticContact CZ-CE2 3.47Å; F321-F325 HydrophobicContact CZ-CE2 3.47Å; F321-F325 VanDerWaalsContact CZ-CE2 3.47Å; F321-F325 HydrophobicContact CZ-CZ 4.38Å; F321-F325 WeakPolarHBondContact O-CD2 3.03Å; F321-F325 PolarHBondContact O-N 3.03Å
322	R	89.7	Confident	91.4	Very high	49 Å²	49	27.6 Å²	27.6	19%	0.185	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-44.6	171.7	-68.4	168.6	-174.9	-166.9	-4.2	111.6	E281 V284 L296 P318 D319 L324 F325 A326	E281-R322 IonicContact OE1-CZ 2.67Å; E281-R322 IonicContact OE1-NH1 3.23Å; E281-R322 PolarHBondContact OE1-NH1 2.73Å; V284-R322 HydrophobicContact CG2-CB 4.43Å; L296-R322 HydrophobicContact CD2-CG 3.55Å; P318-R322 WeakPolarHBondContact O-CG 3.25Å; P318-R322 PolarHBondContact O-N 2.64Å; D319-R322 WeakPolarHBondContact O-CB 3.45Å; D319-R322 PolarHBondContact O-N 2.87Å; D319-R322 VanDerWaalsContact O-N 3.12Å; R322-L324 VanDerWaalsContact C-N 3.28Å; R322-L324 PolarHBondContact O-N 2.78Å; R322-F325 WeakPolarHBondContact O-CB 3.3Å; R322-F325 PolarHBondContact O-N 3.01Å; R322-F325 VanDerWaalsContact O-N 3.12Å; R322-A326 PolarHBondContact O-N 3.35Å
323	S	89.7	Confident	91.2	Very high	29 Å²	29	27.7 Å²	27.7	20%	0.203	16%	0.16	C	C	.	.	H	α-helix	trans	-60.4	-36.8	175.6	-57.5	0	0	0	0	112.5	E280 D319 A326 L327	E280-S323 VanDerWaalsContact OE1-CA 3.29Å; E280-S323 WeakPolarHBondContact OE1-CA 3.42Å; E280-S323 WeakPolarHBondContact OE1-CB 3.41Å; E280-S323 PolarHBondContact OE1-OG 2.75Å; D319-S323 PolarHBondContact O-N 2.86Å; D319-S323 PolarHBondContact O-OG 3Å; S323-A326 PolarHBondContact O-N 3.45Å; S323-L327 VanDerWaalsContact O-CB 3.31Å; S323-L327 WeakPolarHBondContact O-CB 3.45Å; S323-L327 PolarHBondContact O-N 3.1Å
324	L	90.9	Very high	90.8	Very high	3 Å²	3	25.9 Å²	25.9	2%	0.016	15%	0.149	C	C	.	.	H	α-helix	trans	-65.3	-41.7	173.8	-82.1	-172.2	0	0	0	112.5	M249 M252 W315 G320 F321 R322 L327 V328	M249-L324 HydrophobicContact CE-CB 3.71Å; M249-L324 HydrophobicContact CE-CD1 3.92Å; M249-L324 HydrophobicContact SD-CB 4.46Å; M252-L324 HydrophobicContact CE-CD2 3.69Å; W315-L324 HydrophobicContact CB-CD1 3.54Å; W315-L324 HydrophobicContact CB-CG 4.11Å; W315-L324 HydrophobicContact CD2-CD1 3.88Å; W315-L324 HydrophobicContact CD2-CD2 3.8Å; W315-L324 HydrophobicContact CD2-CG 4.15Å; W315-L324 HydrophobicContact CE3-CD1 4.08Å; W315-L324 HydrophobicContact CE3-CD2 4.31Å; W315-L324 HydrophobicContact CG-CD1 3.65Å; W315-L324 HydrophobicContact CG-CD2 3.97Å; W315-L324 HydrophobicContact CG-CG 3.84Å; W315-L324 HydrophobicContact CZ2-CD2 4.3Å; G320-L324 PolarHBondContact O-N 3.46Å; F321-L324 WeakPolarHBondContact O-CB 3.18Å; F321-L324 PolarHBondContact O-N 3.5Å; R322-L324 VanDerWaalsContact C-N 3.28Å; R322-L324 PolarHBondContact O-N 2.78Å; L324-L327 PolarHBondContact O-N 3.28Å; L324-V328 PolarHBondContact O-N 3.44Å
325	F	88.3	Confident	90.6	Very high	3 Å²	3	21.9 Å²	21.9	1%	0.013	13%	0.13	C	C	.	.	H	α-helix	trans	-60	-49.1	174.1	-96.5	-90.2	0	0	0	111.4	W234 I246 M249 V284 L287 L296 L299 F321 R322 L327 V328 G329	W234-F325 HydrophobicContact CE3-CZ 4.46Å; W234-F325 AromaticContact CH2-CE1 3.64Å; W234-F325 HydrophobicContact CH2-CE1 3.64Å; W234-F325 HydrophobicContact CH2-CZ 4.17Å; W234-F325 AromaticContact CZ3-CE1 3.45Å; W234-F325 HydrophobicContact CZ3-CE1 3.45Å; W234-F325 VanDerWaalsContact CZ3-CE1 3.45Å; W234-F325 AromaticContact CZ3-CZ 3.54Å; W234-F325 HydrophobicContact CZ3-CZ 3.54Å; I246-F325 HydrophobicContact CD1-CE2 4.28Å; I246-F325 HydrophobicContact CD1-CZ 4.05Å; M249-F325 HydrophobicContact CE-CD2 3.77Å; M249-F325 HydrophobicContact CE-CE2 3.67Å; M249-F325 HydrophobicContact SD-CD2 3.76Å; M249-F325 HydrophobicContact SD-CE2 3.65Å; M249-F325 HydrophobicContact SD-CG 4.24Å; M249-F325 HydrophobicContact SD-CZ 4.07Å; V284-F325 HydrophobicContact CG2-CB 3.97Å; L287-F325 HydrophobicContact CD1-CD1 4.26Å; L296-F325 HydrophobicContact CD1-CD2 3.92Å; L296-F325 HydrophobicContact CD1-CE2 3.86Å; L296-F325 HydrophobicContact CD1-CG 4.43Å; L296-F325 HydrophobicContact CD1-CZ 4.3Å; L299-F325 HydrophobicContact CD1-CZ 4.3Å; F321-F325 HydrophobicContact CD1-CD2 4.06Å; F321-F325 AromaticContact CD1-CE2 3.93Å; F321-F325 HydrophobicContact CD1-CE2 3.93Å; F321-F325 AromaticContact CE1-CD2 3.96Å; F321-F325 HydrophobicContact CE1-CD2 3.96Å; F321-F325 AromaticContact CE1-CE2 3.34Å; F321-F325 HydrophobicContact CE1-CE2 3.34Å; F321-F325 HydrophobicContact CE1-CZ 4.33Å; F321-F325 HydrophobicContact CE2-CE2 4.12Å; F321-F325 HydrophobicContact CZ-CD2 4.29Å; F321-F325 AromaticContact CZ-CE2 3.47Å; F321-F325 HydrophobicContact CZ-CE2 3.47Å; F321-F325 VanDerWaalsContact CZ-CE2 3.47Å; F321-F325 HydrophobicContact CZ-CZ 4.38Å; F321-F325 WeakPolarHBondContact O-CD2 3.03Å; F321-F325 PolarHBondContact O-N 3.03Å; R322-F325 WeakPolarHBondContact O-CB 3.3Å; R322-F325 PolarHBondContact O-N 3.01Å; R322-F325 VanDerWaalsContact O-N 3.12Å; F325-L327 VanDerWaalsContact C-N 3.28Å; F325-L327 PolarHBondContact O-N 3.08Å; F325-V328 PolarHBondContact O-N 2.96Å; F325-G329 PolarHBondContact O-N 2.92Å
326	A	85.9	Confident	90.3	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	13%	0.128	C	C	.	.	H	α-helix	trans	-59.9	-40.1	177	0	0	0	0	0	111.7	E280 I283 R322 S323 G329 T330	E280-A326 HydrophobicContact CB-CB 4.2Å; E280-A326 HydrophobicContact CG-CB 3.84Å; I283-A326 HydrophobicContact CD1-CB 4.09Å; R322-A326 PolarHBondContact O-N 3.35Å; S323-A326 PolarHBondContact O-N 3.45Å; A326-G329 PolarHBondContact O-N 3.23Å; A326-T330 WeakPolarHBondContact O-CB 3.46Å; A326-T330 VanDerWaalsContact O-CG2 3.28Å; A326-T330 WeakPolarHBondContact O-CG2 2.92Å; A326-T330 PolarHBondContact O-N 3.03Å; A326-T330 PolarHBondContact O-OG1 3.1Å
327	L	90.5	Very high	89.9	Confident	8 Å²	8	20.4 Å²	20.4	4%	0.042	13%	0.126	C	C	.	.	H	α-helix	trans	-60.8	-51.6	175.5	-175.4	161.8	0	0	0	111.3	M252 F272 C273 S323 L324 F325 N331 L386	M252-L327 HydrophobicContact CE-CD1 4.46Å; M252-L327 HydrophobicContact CE-CD2 4.15Å; F272-L327 HydrophobicContact CB-CD1 4.02Å; F272-L327 HydrophobicContact CB-CD2 4.01Å; F272-L327 HydrophobicContact CB-CG 3.77Å; F272-L327 HydrophobicContact CG-CD2 4.36Å; C273-L327 WeakPolarHBondContact O-CA 3.46Å; S323-L327 VanDerWaalsContact O-CB 3.31Å; S323-L327 WeakPolarHBondContact O-CB 3.45Å; S323-L327 PolarHBondContact O-N 3.1Å; L324-L327 PolarHBondContact O-N 3.28Å; F325-L327 VanDerWaalsContact C-N 3.28Å; F325-L327 PolarHBondContact O-N 3.08Å; L327-N331 WeakPolarHBondContact O-CB 3.25Å; L327-N331 PolarHBondContact O-N 3.35Å; L327-N331 VanDerWaalsContact O-N 3.09Å; L327-N331 PolarHBondContact O-ND2 3.33Å; L327-L386 HydrophobicContact CD2-CD1 3.83Å; L327-L386 HydrophobicContact CD2-CD2 4.25Å
328	V	89.1	Confident	89.7	Confident	6 Å²	6	18 Å²	18	4%	0.036	11%	0.112	C	C	.	.	H	α-helix	trans	-65.9	-40.6	179.9	168.3	0	0	0	0	111.5	L248 M249 M252 L324 F325 G332	L248-V328 HydrophobicContact CB-CG1 4.44Å; L248-V328 HydrophobicContact CD2-CG1 3.76Å; L248-V328 HydrophobicContact CD2-CG2 4.19Å; M249-V328 HydrophobicContact CG-CG2 3.78Å; M252-V328 HydrophobicContact SD-CG2 4.02Å; L324-V328 PolarHBondContact O-N 3.44Å; F325-V328 PolarHBondContact O-N 2.96Å; V328-G332 VanDerWaalsContact O-CA 3.25Å; V328-G332 WeakPolarHBondContact O-CA 3.47Å; V328-G332 PolarHBondContact O-N 3.14Å
329	G	83.9	Confident	89.7	Confident	14 Å²	14	14.9 Å²	14.9	14%	0.144	9%	0.092	C	C	.	.	H	α-helix	trans	-66.6	-36.5	179.6	0	0	0	0	0	113.8	F325 A326	F325-G329 PolarHBondContact O-N 2.92Å; A326-G329 PolarHBondContact O-N 3.23Å
330	T	84.2	Confident	89.8	Confident	18 Å²	18	9.9 Å²	9.9	11%	0.11	7%	0.065	C	C	.	.	H	α-helix	trans	-89.7	-22.9	-175.9	54.7	0	0	0	0	114.4	C273 K275 I283 A326	C273-T330 PolarHBondContact O-OG1 2.81Å; K275-T330 HydrophobicContact CD-CG2 4.25Å; I283-T330 HydrophobicContact CD1-CG2 3.3Å; I283-T330 HydrophobicContact CG1-CG2 4.22Å; A326-T330 WeakPolarHBondContact O-CB 3.46Å; A326-T330 VanDerWaalsContact O-CG2 3.28Å; A326-T330 WeakPolarHBondContact O-CG2 2.92Å; A326-T330 PolarHBondContact O-N 3.03Å; A326-T330 PolarHBondContact O-OG1 3.1Å
331	N	89.2	Confident	89.7	Confident	20 Å²	20	10.8 Å²	10.8	11%	0.107	7%	0.07	C	C	.	.	H	α-helix	trans	-116.1	-10.1	-176	-53.3	-96.1	0	0	0	113.1	F272 C273 L327 Q333 L386	F272-N331 HydrophobicContact CB-CB 4.35Å; F272-N331 HydrophobicContact CD1-CB 3.66Å; F272-N331 HydrophobicContact CE1-CB 4.41Å; F272-N331 HydrophobicContact CG-CB 4.32Å; C273-N331 PolarHBondContact N-ND2 2.89Å; C273-N331 PolarHBondContact N-OD1 2.82Å; C273-N331 VanDerWaalsContact N-OD1 3.13Å; C273-N331 PolarHBondContact O-ND2 2.91Å; L327-N331 WeakPolarHBondContact O-CB 3.25Å; L327-N331 PolarHBondContact O-N 3.35Å; L327-N331 VanDerWaalsContact O-N 3.09Å; L327-N331 PolarHBondContact O-ND2 3.33Å; N331-Q333 PolarHBondContact O-N 3.31Å; N331-L386 HydrophobicContact CB-CD2 3.99Å
332	G	91.2	Very high	89.6	Confident	10 Å²	10	12.4 Å²	12.4	10%	0.103	8%	0.077	C	C	.	.	P	Polyproline II helix	trans	-63.2	120.7	179	0	0	0	0	0	111.2	V328	V328-G332 VanDerWaalsContact O-CA 3.25Å; V328-G332 WeakPolarHBondContact O-CA 3.47Å; V328-G332 PolarHBondContact O-N 3.14Å
333	Q	91.7	Very high	89.9	Confident	2 Å²	2	10.1 Å²	10.1	1%	0.009	7%	0.068	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.9	122	171.7	170.1	61.3	58.1	0	0	108.6	N331 S384 G385 F387 F405 L412	N331-Q333 PolarHBondContact O-N 3.31Å; Q333-S384 CarbonylContact O-C 3.36Å; Q333-S384 VanDerWaalsContact O-CA 3.23Å; Q333-S384 WeakPolarHBondContact O-CA 3.22Å; Q333-G385 PolarHBondContact N-O 3.05Å; Q333-G385 PolarHBondContact O-N 3.07Å; Q333-F387 HydrophobicContact CB-CD2 3.74Å; Q333-F387 HydrophobicContact CB-CE2 3.86Å; Q333-F387 HydrophobicContact CG-CD2 4.14Å; Q333-F387 HydrophobicContact CG-CE2 3.97Å; Q333-F405 HydrophobicContact CG-CZ 3.93Å; Q333-L412 HydrophobicContact CG-CD1 3.7Å
334	G	90.3	Very high	90.1	Very high	9 Å²	9	9.4 Å²	9.4	9%	0.093	6%	0.063	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-60.8	138.6	172.8	0	0	0	0	0	111.5	G383 F405	G334-G383 CarbonylContact C-O 3.46Å; G334-G383 WeakPolarHBondContact CA-O 3.4Å; G334-F405 WeakPolarHBondContact O-CE2 3.49Å; G334-F405 WeakPolarHBondContact O-CZ 3.41Å
335	I	90.6	Very high	90.1	Very high	3 Å²	3	14.7 Å²	14.7	2%	0.015	9%	0.087	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	123.1	178.9	-56.6	168.9	0	0	0	106.6	A135 L153 T337 E382 G383 F387 F405 F410	A135-I335 HydrophobicContact CB-CD1 3.94Å; L153-I335 HydrophobicContact CB-CG2 4.44Å; L153-I335 HydrophobicContact CD2-CB 3.81Å; L153-I335 HydrophobicContact CD2-CD1 3.97Å; L153-I335 HydrophobicContact CD2-CG1 4.49Å; L153-I335 HydrophobicContact CD2-CG2 3.77Å; I335-T337 HydrophobicContact CG2-CG2 4.32Å; I335-E382 CarbonylContact O-C 3.55Å; I335-E382 WeakPolarHBondContact O-CA 3.46Å; I335-G383 PolarHBondContact N-O 3.41Å; I335-G383 PolarHBondContact O-N 2.92Å; I335-F387 HydrophobicContact CD1-CE2 4.23Å; I335-F387 HydrophobicContact CD1-CZ 4.11Å; I335-F387 HydrophobicContact CG1-CE2 4.47Å; I335-F387 HydrophobicContact CG1-CZ 4.5Å; I335-F405 HydrophobicContact CB-CE1 4.44Å; I335-F405 HydrophobicContact CB-CZ 4.32Å; I335-F405 HydrophobicContact CG1-CE1 3.85Å; I335-F405 HydrophobicContact CG1-CE2 4.49Å; I335-F405 HydrophobicContact CG1-CZ 3.74Å; I335-F405 HydrophobicContact CG2-CD1 4.19Å; I335-F405 HydrophobicContact CG2-CE1 4.18Å; I335-F405 HydrophobicContact CG2-CG 4.5Å; I335-F405 HydrophobicContact CG2-CZ 4.48Å; I335-F410 HydrophobicContact CD1-CB 3.94Å
336	G	88.8	Confident	90.3	Very high	6 Å²	6	16 Å²	16	6%	0.062	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.4	171.8	0	0	0	0	0	111.2	L40 C381	L40-G336 VanDerWaalsContact CD1-CA 3.43Å; L40-G336 VanDerWaalsContact CD2-CA 3.42Å; G336-C381 WeakPolarHBondContact CA-O 3.32Å
337	T	89.8	Confident	90.8	Very high	2 Å²	2	16 Å²	16	1%	0.012	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-134.7	135.1	178.4	55.3	0	0	0	0	109.8	L153 I335 C381 N408	L153-T337 HydrophobicContact CB-CG2 4.35Å; L153-T337 PolarHBondContact O-OG1 3.04Å; I335-T337 HydrophobicContact CG2-CG2 4.32Å; T337-C381 PolarHBondContact N-O 3.41Å; T337-C381 WeakPolarHBondContact O-CB 3.47Å; T337-C381 PolarHBondContact O-N 2.9Å; T337-C381 WeakPolarHBondContact OG1-CB 3.45Å; T337-C381 PolarHBondContact OG1-O 3.14Å; T337-N408 VanDerWaalsContact CA-OD1 3.23Å; T337-N408 WeakPolarHBondContact CA-OD1 3.43Å; T337-N408 WeakPolarHBondContact CB-OD1 3.41Å
338	S	90.9	Very high	90.9	Very high	9 Å²	9	19.9 Å²	19.9	6%	0.063	12%	0.119	C	C	.	.			trans	-151.2	124.3	177.3	167.7	0	0	0	0	109.3	N162 L340 S341 Q342 N380 N408	N162-S338 PolarHBondContact OD1-OG 3.09Å; S338-L340 PolarHBondContact OG-N 3.43Å; S338-S341 PolarHBondContact OG-N 3.16Å; S338-Q342 PolarHBondContact O-N 2.96Å; S338-Q342 VanDerWaalsContact O-N 3.15Å; S338-N380 WeakPolarHBondContact CB-OD1 3.46Å; S338-N408 PolarHBondContact N-OD1 3.37Å; S338-N408 PolarHBondContact O-ND2 2.96Å; S338-N408 PolarHBondContact O-OD1 2.91Å
339	S	93.2	Very high	91	Very high	1 Å²	1	23.6 Å²	23.6	1%	0.007	15%	0.151	C	C	.	.	H	α-helix	trans	-68.4	-28.4	173	52.5	0	0	0	0	111.5	E157 A159 W343	E157-S339 VanDerWaalsContact O-CB 3.24Å; E157-S339 WeakPolarHBondContact O-CB 3.3Å; E157-S339 PolarHBondContact O-OG 2.87Å; A159-S339 WeakPolarHBondContact CB-O 3.47Å; A159-S339 PolarHBondContact N-OG 2.92Å; S339-W343 WeakPolarHBondContact O-CB 3.3Å; S339-W343 PolarHBondContact O-N 2.95Å
340	L	92.8	Very high	91.6	Very high	2 Å²	2	25 Å²	25	1%	0.01	15%	0.154	C	C	.	.	H	α-helix	trans	-67.5	-50.1	173.2	179.1	61.3	0	0	0	111.9	N162 A163 L166 L174 S338 Q342 W343 V344 L367 I371	N162-L340 HydrophobicContact CB-CB 4.4Å; N162-L340 WeakPolarHBondContact OD1-CB 3.37Å; N162-L340 PolarHBondContact OD1-N 3.1Å; A163-L340 HydrophobicContact CB-CD1 4.26Å; A163-L340 HydrophobicContact CB-CD2 4.39Å; L166-L340 HydrophobicContact CD1-CD2 4.28Å; L174-L340 HydrophobicContact CD1-CD1 3.89Å; S338-L340 PolarHBondContact OG-N 3.43Å; L340-Q342 VanDerWaalsContact C-N 3.28Å; L340-Q342 PolarHBondContact O-N 3.44Å; L340-W343 HydrophobicContact CD1-CE3 3.72Å; L340-W343 HydrophobicContact CD1-CZ3 4.15Å; L340-W343 WeakPolarHBondContact O-CA 3.31Å; L340-W343 WeakPolarHBondContact O-CB 2.83Å; L340-W343 PolarHBondContact O-N 3.1Å; L340-V344 WeakPolarHBondContact O-CG2 3.18Å; L340-V344 PolarHBondContact O-N 2.97Å; L340-L367 HydrophobicContact CD1-CD2 3.85Å; L340-L367 HydrophobicContact CD2-CD2 4.33Å; L340-I371 HydrophobicContact CD2-CD1 3.47Å; L340-I371 VanDerWaalsContact CD2-CD1 3.47Å
341	S	90.1	Very high	92.1	Very high	32 Å²	32	33.6 Å²	33.6	22%	0.224	19%	0.193	C	C	.	.	H	α-helix	trans	-58.2	-41.6	176.9	166.4	0	0	0	0	111.7	S338 W343 V344 H345	S338-S341 PolarHBondContact OG-N 3.16Å; S341-W343 VanDerWaalsContact C-N 3.32Å; S341-W343 PolarHBondContact O-N 3.26Å; S341-V344 PolarHBondContact O-N 3.33Å; S341-H345 PolarHBondContact O-CD2 3.43Å; S341-H345 VanDerWaalsContact O-CD2 3.24Å; S341-H345 PolarHBondContact O-N 3.31Å
342	Q	91.4	Very high	92.4	Very high	34 Å²	34	35.2 Å²	35.2	16%	0.159	20%	0.202	C	C	.	.	H	α-helix	trans	-62.9	-38.9	175.5	-168.5	-173.4	42.4	0	0	112.6	T181 S338 L340 A346 N408	T181-Q342 VanDerWaalsContact OG1-CD 3.27Å; T181-Q342 PolarHBondContact OG1-NE2 2.89Å; T181-Q342 PolarHBondContact OG1-OE1 3.21Å; S338-Q342 PolarHBondContact O-N 2.96Å; S338-Q342 VanDerWaalsContact O-N 3.15Å; L340-Q342 VanDerWaalsContact C-N 3.28Å; L340-Q342 PolarHBondContact O-N 3.44Å; Q342-A346 WeakPolarHBondContact O-CB 3.4Å; Q342-A346 PolarHBondContact O-N 3.34Å; Q342-N408 HydrophobicContact CB-CB 4.43Å; Q342-N408 HydrophobicContact CG-CB 4.44Å
343	W	95.1	Very high	92.6	Very high	1 Å²	1	41.9 Å²	41.9	0%	0.004	23%	0.228	C	C	.	.	H	α-helix	trans	-65.6	-42.1	174.9	168.2	88.5	0	0	0	111.7	A159 L174 P175 H176 S339 L340 S341 H345 A346 C347 L360 F363 I364 L367	A159-W343 HydrophobicContact CB-CB 3.55Å; A159-W343 HydrophobicContact CB-CG 3.95Å; L174-W343 HydrophobicContact CB-CZ2 3.99Å; L174-W343 HydrophobicContact CD1-CD2 3.96Å; L174-W343 HydrophobicContact CD1-CE3 4.12Å; L174-W343 HydrophobicContact CD1-CG 4.38Å; L174-W343 HydrophobicContact CD1-CZ3 4.47Å; L174-W343 HydrophobicContact CD2-CH2 4.32Å; L174-W343 HydrophobicContact CD2-CZ3 4.43Å; P175-W343 HydrophobicContact CG-CH2 4.18Å; P175-W343 HydrophobicContact CG-CZ2 3.81Å; P175-W343 VanDerWaalsContact O-CE2 3.3Å; P175-W343 WeakPolarHBondContact O-CZ2 3.39Å; P175-W343 PolarHBondContact O-NE1 3.19Å; H176-W343 PolarHBondContact O-NE1 3.35Å; S339-W343 WeakPolarHBondContact O-CB 3.3Å; S339-W343 PolarHBondContact O-N 2.95Å; L340-W343 HydrophobicContact CD1-CE3 3.72Å; L340-W343 HydrophobicContact CD1-CZ3 4.15Å; L340-W343 WeakPolarHBondContact O-CA 3.31Å; L340-W343 WeakPolarHBondContact O-CB 2.83Å; L340-W343 PolarHBondContact O-N 3.1Å; S341-W343 VanDerWaalsContact C-N 3.32Å; S341-W343 PolarHBondContact O-N 3.26Å; W343-H345 PolarHBondContact O-N 3.08Å; W343-A346 WeakPolarHBondContact O-CB 3.17Å; W343-A346 PolarHBondContact O-N 3.35Å; W343-A346 VanDerWaalsContact O-N 3.16Å; W343-C347 VanDerWaalsContact CZ2-SG 3.51Å; W343-C347 PolarHBondContact O-N 2.82Å; W343-C347 PolarHBondContact O-SG 3.28Å; W343-C347 VanDerWaalsContact O-SG 3.39Å; W343-L360 HydrophobicContact CH2-CD1 4.5Å; W343-F363 HydrophobicContact CH2-CD1 4.24Å; W343-F363 AromaticContact CH2-CE1 3.93Å; W343-F363 HydrophobicContact CH2-CE1 3.93Å; W343-I364 HydrophobicContact CH2-CD1 4.25Å; W343-I364 HydrophobicContact CH2-CG1 3.9Å; W343-I364 HydrophobicContact CZ3-CD1 4.29Å; W343-I364 HydrophobicContact CZ3-CG1 3.93Å; W343-L367 HydrophobicContact CZ3-CD2 4.49Å
344	V	93.4	Very high	92.8	Very high	14 Å²	14	47.2 Å²	47.2	9%	0.085	26%	0.262	C	S	.	.	H	α-helix	trans	-58.4	-49.1	174.7	173.2	0	0	0	0	110.7	L340 S341 A346 C347 D348 I364 Y368	L340-V344 WeakPolarHBondContact O-CG2 3.18Å; L340-V344 PolarHBondContact O-N 2.97Å; S341-V344 PolarHBondContact O-N 3.33Å; V344-A346 VanDerWaalsContact C-N 3.26Å; V344-A346 PolarHBondContact O-N 3.5Å; V344-C347 WeakPolarHBondContact O-CA 3.48Å; V344-C347 VanDerWaalsContact O-CB 3.26Å; V344-C347 WeakPolarHBondContact O-CB 3.39Å; V344-C347 PolarHBondContact O-N 2.95Å; V344-D348 PolarHBondContact O-N 3.39Å; V344-I364 HydrophobicContact CG1-CD1 4.48Å; V344-I364 HydrophobicContact CG1-CG2 4.15Å; V344-I364 HydrophobicContact CG2-CG2 4.2Å; V344-Y368 HydrophobicContact CG1-CE2 4.49Å; V344-Y368 HydrophobicContact CG2-CE2 3.94Å
345	H	91.1	Very high	93.1	Very high	115 Å²	115	53.5 Å²	53.5	53%	0.532	29%	0.29	S	S	.	.	H	α-helix	trans	-61.2	-34.4	176.5	-72.6	-45.5	0	0	0	113.5	S341 W343 D348	S341-H345 PolarHBondContact O-CD2 3.43Å; S341-H345 VanDerWaalsContact O-CD2 3.24Å; S341-H345 PolarHBondContact O-N 3.31Å; W343-H345 PolarHBondContact O-N 3.08Å; H345-D348 IonicContact ND1-OD2 3.19Å; H345-D348 PolarHBondContact O-N 3.42Å
346	A	93.4	Very high	93.3	Very high	29 Å²	29	56.9 Å²	56.9	24%	0.24	31%	0.307	C	S	.	.	H	α-helix	trans	-69.7	-34.5	174.3	0	0	0	0	0	112	L179 Q342 W343 V344 A349	L179-A346 HydrophobicContact CB-CB 3.89Å; L179-A346 HydrophobicContact CD1-CB 4.07Å; L179-A346 HydrophobicContact CD2-CB 4.24Å; L179-A346 HydrophobicContact CG-CB 4.3Å; Q342-A346 WeakPolarHBondContact O-CB 3.4Å; Q342-A346 PolarHBondContact O-N 3.34Å; W343-A346 WeakPolarHBondContact O-CB 3.17Å; W343-A346 PolarHBondContact O-N 3.35Å; W343-A346 VanDerWaalsContact O-N 3.16Å; V344-A346 VanDerWaalsContact C-N 3.26Å; V344-A346 PolarHBondContact O-N 3.5Å; A346-A349 PolarHBondContact O-N 2.65Å
347	C	95.3	Very high	93.7	Very high	0 Å²	0	58.9 Å²	58.9	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-63.7	-38.1	173	-75.2	0	0	0	0	112.2	W343 V344 A349 L350 R357 L360 I364	W343-C347 VanDerWaalsContact CZ2-SG 3.51Å; W343-C347 PolarHBondContact O-N 2.82Å; W343-C347 PolarHBondContact O-SG 3.28Å; W343-C347 VanDerWaalsContact O-SG 3.39Å; V344-C347 WeakPolarHBondContact O-CA 3.48Å; V344-C347 VanDerWaalsContact O-CB 3.26Å; V344-C347 WeakPolarHBondContact O-CB 3.39Å; V344-C347 PolarHBondContact O-N 2.95Å; C347-A349 PolarHBondContact O-N 2.85Å; C347-L350 WeakPolarHBondContact O-CB 3.28Å; C347-L350 PolarHBondContact O-N 2.72Å; C347-L350 VanDerWaalsContact O-N 3.16Å; C347-R357 PolarHBondContact O-NH1 3.1Å; C347-R357 PolarHBondContact O-NH2 3.48Å; C347-R357 VanDerWaalsContact O-NH2 3.1Å; C347-L360 HydrophobicContact CB-CD2 3.96Å; C347-I364 HydrophobicContact CB-CD1 4.13Å
348	D	92.8	Very high	94	Very high	91 Å²	91	64.6 Å²	64.6	49%	0.487	34%	0.34	S	S	.	.	H	α-helix	trans	-59.4	-34.7	176.2	-63.4	-25.3	0	0	0	111.8	V344 H345 L350	V344-D348 PolarHBondContact O-N 3.39Å; H345-D348 IonicContact ND1-OD2 3.19Å; H345-D348 PolarHBondContact O-N 3.42Å; D348-L350 VanDerWaalsContact C-N 3.31Å; D348-L350 PolarHBondContact O-N 3.12Å
349	A	93	Very high	94.3	Very high	84 Å²	84	70.4 Å²	70.4	69%	0.694	37%	0.366	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.6	-5.2	-179.1	0	0	0	0	0	114.5	A346 C347	A346-A349 PolarHBondContact O-N 2.65Å; C347-A349 PolarHBondContact O-N 2.85Å
350	L	94.6	Very high	94.5	Very high	43 Å²	43	70.8 Å²	70.8	23%	0.225	37%	0.368	C	S	.	.			trans	-68.7	142	180	-67.1	173	0	0	0	112.4	L179 C347 D348 L352 R357 L360	L179-L350 HydrophobicContact CD1-CD1 3.96Å; L179-L350 HydrophobicContact CD1-CD2 4.16Å; L179-L350 HydrophobicContact CD1-CG 4.15Å; L179-L350 HydrophobicContact CD2-CD2 4.31Å; C347-L350 WeakPolarHBondContact O-CB 3.28Å; C347-L350 PolarHBondContact O-N 2.72Å; C347-L350 VanDerWaalsContact O-N 3.16Å; D348-L350 VanDerWaalsContact C-N 3.31Å; D348-L350 PolarHBondContact O-N 3.12Å; L350-L352 HydrophobicContact CB-CD1 4.13Å; L350-L352 HydrophobicContact CB-CD2 4.16Å; L350-L352 HydrophobicContact CB-CG 3.77Å; L350-L352 HydrophobicContact CD1-CD1 4.07Å; L350-L352 HydrophobicContact CD1-CD2 4.37Å; L350-L352 HydrophobicContact CD1-CG 4.38Å; L350-L352 PolarHBondContact O-N 3.39Å; L350-R357 PolarHBondContact O-NH2 2.99Å; L350-L360 HydrophobicContact CD1-CD2 4.18Å
351	E	95.5	Very high	94.6	Very high	199 Å²	199	73.6 Å²	73.6	93%	0.93	38%	0.383	S	S	*	.			trans	-90.8	94.4	167.6	-67.2	-175.9	179.8	0	0	109.2
352	L	95.1	Very high	94.9	Very high	54 Å²	54	77 Å²	77	28%	0.283	40%	0.397	S	S	.	.			trans	-111.6	156.8	-177.6	-61.1	179.9	0	0	0	111.8	L350 D356 R357 L360	L350-L352 HydrophobicContact CB-CD1 4.13Å; L350-L352 HydrophobicContact CB-CD2 4.16Å; L350-L352 HydrophobicContact CB-CG 3.77Å; L350-L352 HydrophobicContact CD1-CD1 4.07Å; L350-L352 HydrophobicContact CD1-CD2 4.37Å; L350-L352 HydrophobicContact CD1-CG 4.38Å; L350-L352 PolarHBondContact O-N 3.39Å; L352-D356 HydrophobicContact CB-CB 4.3Å; L352-R357 HydrophobicContact CB-CB 4.28Å; L352-L360 HydrophobicContact CD1-CD2 3.68Å
353	K	96.8	Very high	95.1	Very high	150 Å²	150	78.1 Å²	78.1	65%	0.652	40%	0.402	S	S	*	.			trans	-66.6	151.3	167.7	-63.6	175.7	-175.6	169.2	0	109.2	Q355 D356 R357	K353-Q355 VanDerWaalsContact C-N 3.26Å; K353-Q355 PolarHBondContact O-N 3.01Å; K353-Q355 VanDerWaalsContact O-N 3.13Å; K353-D356 PolarHBondContact O-N 3.49Å; K353-R357 PolarHBondContact O-N 3.04Å
354	P	96.1	Very high	95.1	Very high	113 Å²	113	78.5 Å²	78.5	73%	0.734	40%	0.404	S	S	*	.	H	α-helix	trans	-52.7	-39.9	-176.8	-29.2	35.3	0	0	0	114.6	R357 E358	P354-R357 PolarHBondContact O-N 2.94Å; P354-E358 WeakPolarHBondContact O-CB 3.38Å; P354-E358 PolarHBondContact O-N 3.34Å
355	Q	95.8	Very high	95.2	Very high	142 Å²	142	82.4 Å²	82.4	66%	0.664	42%	0.424	S	S	*	.	H	α-helix	trans	-67.2	-39.6	178.1	-69.3	176	-11.5	0	0	113	K353 Q359	K353-Q355 VanDerWaalsContact C-N 3.26Å; K353-Q355 PolarHBondContact O-N 3.01Å; K353-Q355 VanDerWaalsContact O-N 3.13Å; Q355-Q359 WeakPolarHBondContact O-CG 3.45Å; Q355-Q359 PolarHBondContact O-N 3Å; Q355-Q359 VanDerWaalsContact O-N 3.15Å
356	D	95.4	Very high	95.4	Very high	73 Å²	73	81.4 Å²	81.4	39%	0.39	42%	0.42	S	S	.	.	H	α-helix	trans	-72.4	-36.2	179.4	-58.8	-35.4	0	0	0	110.4	L352 K353 L360	L352-D356 HydrophobicContact CB-CB 4.3Å; K353-D356 PolarHBondContact O-N 3.49Å; D356-L360 WeakPolarHBondContact O-CB 3.23Å; D356-L360 PolarHBondContact O-N 2.92Å
357	R	96.5	Very high	95.4	Very high	48 Å²	48	80.1 Å²	80.1	18%	0.181	41%	0.409	C	S	.	.	H	α-helix	trans	-60.4	-51.8	172.5	174.8	59.5	63.8	-162.4	4.7	111.2	C347 L350 L352 K353 P354 Q359 L360 D361	C347-R357 PolarHBondContact O-NH1 3.1Å; C347-R357 PolarHBondContact O-NH2 3.48Å; C347-R357 VanDerWaalsContact O-NH2 3.1Å; L350-R357 PolarHBondContact O-NH2 2.99Å; L352-R357 HydrophobicContact CB-CB 4.28Å; K353-R357 PolarHBondContact O-N 3.04Å; P354-R357 PolarHBondContact O-N 2.94Å; R357-Q359 VanDerWaalsContact C-N 3.32Å; R357-Q359 PolarHBondContact O-N 3.45Å; R357-L360 PolarHBondContact O-N 3.45Å; R357-L360 VanDerWaalsContact O-N 3.13Å; R357-D361 WeakPolarHBondContact CD-OD1 3.2Å; R357-D361 WeakPolarHBondContact CD-OD2 3.48Å; R357-D361 IonicContact NH1-OD1 3.06Å; R357-D361 PolarHBondContact O-N 3.2Å
358	E	96.7	Very high	95.3	Very high	123 Å²	123	83.6 Å²	83.6	58%	0.575	42%	0.423	S	S	*	.	H	α-helix	trans	-59	-41.7	179.1	-176	178.5	-167.9	0	0	112.1	P354 L360 D361 I362	P354-E358 WeakPolarHBondContact O-CB 3.38Å; P354-E358 PolarHBondContact O-N 3.34Å; E358-L360 PolarHBondContact O-N 3.11Å; E358-D361 PolarHBondContact O-N 2.86Å; E358-I362 HydrophobicContact CG-CD1 4.03Å; E358-I362 WeakPolarHBondContact O-CB 3.42Å; E358-I362 WeakPolarHBondContact O-CD1 3.47Å; E358-I362 VanDerWaalsContact O-CG1 3.24Å; E358-I362 WeakPolarHBondContact O-CG1 3.42Å; E358-I362 PolarHBondContact O-N 3.03Å
359	Q	96.8	Very high	95.2	Very high	131 Å²	131	85.1 Å²	85.1	61%	0.612	43%	0.425	S	S	*	.	H	α-helix	trans	-64	-40.1	175.8	-73.5	176.1	26.6	0	0	112.8	Q355 R357 F363	Q355-Q359 WeakPolarHBondContact O-CG 3.45Å; Q355-Q359 PolarHBondContact O-N 3Å; Q355-Q359 VanDerWaalsContact O-N 3.15Å; R357-Q359 VanDerWaalsContact C-N 3.32Å; R357-Q359 PolarHBondContact O-N 3.45Å; Q359-F363 WeakPolarHBondContact O-CB 3.48Å; Q359-F363 PolarHBondContact O-N 2.93Å
360	L	96.1	Very high	95.1	Very high	9 Å²	9	82.9 Å²	82.9	5%	0.047	40%	0.401	C	S	.	.	H	α-helix	trans	-66.9	-43.9	177.7	-179	57.3	0	0	0	111.4	P175 W343 C347 L350 L352 D356 R357 E358 F363 I364	P175-L360 HydrophobicContact CB-CD1 4.33Å; P175-L360 HydrophobicContact CG-CD1 3.55Å; W343-L360 HydrophobicContact CH2-CD1 4.5Å; C347-L360 HydrophobicContact CB-CD2 3.96Å; L350-L360 HydrophobicContact CD1-CD2 4.18Å; L352-L360 HydrophobicContact CD1-CD2 3.68Å; D356-L360 WeakPolarHBondContact O-CB 3.23Å; D356-L360 PolarHBondContact O-N 2.92Å; R357-L360 PolarHBondContact O-N 3.45Å; R357-L360 VanDerWaalsContact O-N 3.13Å; E358-L360 PolarHBondContact O-N 3.11Å; L360-F363 WeakPolarHBondContact O-CB 3.19Å; L360-F363 PolarHBondContact O-N 3.27Å; L360-I364 HydrophobicContact CD1-CD1 4.05Å; L360-I364 HydrophobicContact CD1-CG1 4.29Å; L360-I364 HydrophobicContact CG-CD1 3.98Å; L360-I364 WeakPolarHBondContact O-CG1 3.46Å; L360-I364 PolarHBondContact O-N 3.31Å
361	D	95.1	Very high	94.9	Very high	60 Å²	60	80.8 Å²	80.8	32%	0.321	39%	0.39	S	S	.	.	H	α-helix	trans	-63.6	-44.7	179.3	-61.5	-14.9	0	0	0	110.4	R357 E358 F363 I364 D365	R357-D361 WeakPolarHBondContact CD-OD1 3.2Å; R357-D361 WeakPolarHBondContact CD-OD2 3.48Å; R357-D361 IonicContact NH1-OD1 3.06Å; R357-D361 PolarHBondContact O-N 3.2Å; E358-D361 PolarHBondContact O-N 2.86Å; D361-F363 VanDerWaalsContact C-N 3.3Å; D361-F363 PolarHBondContact O-N 3.33Å; D361-I364 PolarHBondContact O-N 3.14Å; D361-D365 WeakPolarHBondContact O-CB 3.28Å; D361-D365 PolarHBondContact O-N 3.27Å
362	I	97.2	Very high	94.5	Very high	104 Å²	104	77.7 Å²	77.7	53%	0.533	38%	0.376	S	S	.	.	H	α-helix	trans	-58.5	-41.4	173.8	-70.5	167.1	0	0	0	111.5	E358 Q366	E358-I362 HydrophobicContact CG-CD1 4.03Å; E358-I362 WeakPolarHBondContact O-CB 3.42Å; E358-I362 WeakPolarHBondContact O-CD1 3.47Å; E358-I362 VanDerWaalsContact O-CG1 3.24Å; E358-I362 WeakPolarHBondContact O-CG1 3.42Å; E358-I362 PolarHBondContact O-N 3.03Å; I362-Q366 WeakPolarHBondContact O-CB 3.44Å; I362-Q366 PolarHBondContact O-N 3.23Å
363	F	96.5	Very high	94.2	Very high	57 Å²	57	79.2 Å²	79.2	25%	0.25	40%	0.396	C	S	.	.	H	α-helix	trans	-63.8	-46.1	177.4	172.1	-86.6	0	0	0	111.6	V173 L174 P175 W343 Q359 L360 D361 Q366 L367	V173-F363 WeakPolarHBondContact O-CZ 3.38Å; L174-F363 HydrophobicContact CD2-CE1 3.86Å; L174-F363 HydrophobicContact CD2-CZ 3.9Å; P175-F363 HydrophobicContact CG-CD1 3.96Å; P175-F363 HydrophobicContact CG-CE1 3.97Å; P175-F363 HydrophobicContact CG-CG 4.48Å; P175-F363 HydrophobicContact CG-CZ 4.46Å; W343-F363 HydrophobicContact CH2-CD1 4.24Å; W343-F363 AromaticContact CH2-CE1 3.93Å; W343-F363 HydrophobicContact CH2-CE1 3.93Å; Q359-F363 WeakPolarHBondContact O-CB 3.48Å; Q359-F363 PolarHBondContact O-N 2.93Å; L360-F363 WeakPolarHBondContact O-CB 3.19Å; L360-F363 PolarHBondContact O-N 3.27Å; D361-F363 VanDerWaalsContact C-N 3.3Å; D361-F363 PolarHBondContact O-N 3.33Å; F363-Q366 PolarHBondContact O-N 2.91Å; F363-L367 HydrophobicContact CE1-CD2 4.25Å; F363-L367 WeakPolarHBondContact O-CB 3.32Å; F363-L367 PolarHBondContact O-N 3Å
364	I	95.2	Very high	93.7	Very high	10 Å²	10	74 Å²	74	5%	0.051	38%	0.381	C	S	.	.	H	α-helix	trans	-63.7	-45.1	180	-69.5	170.9	0	0	0	110	W343 V344 C347 L360 D361 Q366 L367 Y368	W343-I364 HydrophobicContact CH2-CD1 4.25Å; W343-I364 HydrophobicContact CH2-CG1 3.9Å; W343-I364 HydrophobicContact CZ3-CD1 4.29Å; W343-I364 HydrophobicContact CZ3-CG1 3.93Å; V344-I364 HydrophobicContact CG1-CD1 4.48Å; V344-I364 HydrophobicContact CG1-CG2 4.15Å; V344-I364 HydrophobicContact CG2-CG2 4.2Å; C347-I364 HydrophobicContact CB-CD1 4.13Å; L360-I364 HydrophobicContact CD1-CD1 4.05Å; L360-I364 HydrophobicContact CD1-CG1 4.29Å; L360-I364 HydrophobicContact CG-CD1 3.98Å; L360-I364 WeakPolarHBondContact O-CG1 3.46Å; L360-I364 PolarHBondContact O-N 3.31Å; D361-I364 PolarHBondContact O-N 3.14Å; I364-Q366 VanDerWaalsContact C-N 3.35Å; I364-Q366 PolarHBondContact O-N 2.59Å; I364-L367 WeakPolarHBondContact O-CB 3.41Å; I364-L367 PolarHBondContact O-N 2.82Å; I364-L367 VanDerWaalsContact O-N 3.16Å; I364-Y368 HydrophobicContact CG2-CD2 3.77Å; I364-Y368 HydrophobicContact CG2-CE2 3.71Å; I364-Y368 WeakPolarHBondContact O-CD2 3.44Å; I364-Y368 PolarHBondContact O-N 3.15Å
365	D	94.8	Very high	92.8	Very high	95 Å²	95	70.4 Å²	70.4	51%	0.508	36%	0.357	S	S	.	.	H	α-helix	trans	-59.8	-44.7	176.9	-76.3	-11.4	0	0	0	111.9	D361 L367 Y368 K369	D361-D365 WeakPolarHBondContact O-CB 3.28Å; D361-D365 PolarHBondContact O-N 3.27Å; D365-L367 VanDerWaalsContact C-N 3.32Å; D365-L367 PolarHBondContact O-N 2.7Å; D365-Y368 PolarHBondContact O-N 3.27Å; D365-K369 WeakPolarHBondContact O-CG 3.42Å; D365-K369 PolarHBondContact O-N 3.27Å; D365-K369 VanDerWaalsContact O-N 3.08Å
366	Q	95.4	Very high	91.9	Very high	94 Å²	94	64.7 Å²	64.7	44%	0.439	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-37.4	176.8	-173.3	58.4	53.3	0	0	111.7	I362 F363 I364 K369 D370	I362-Q366 WeakPolarHBondContact O-CB 3.44Å; I362-Q366 PolarHBondContact O-N 3.23Å; F363-Q366 PolarHBondContact O-N 2.91Å; I364-Q366 VanDerWaalsContact C-N 3.35Å; I364-Q366 PolarHBondContact O-N 2.59Å; Q366-K369 PolarHBondContact O-N 2.78Å; Q366-D370 PolarHBondContact NE2-OD1 3.25Å; Q366-D370 WeakPolarHBondContact O-CB 3.5Å; Q366-D370 VanDerWaalsContact O-CG 3.22Å; Q366-D370 PolarHBondContact O-N 2.89Å
367	L	93.8	Very high	90.5	Very high	2 Å²	2	67.6 Å²	67.6	1%	0.01	35%	0.348	C	S	.	.	H	α-helix	trans	-62	-45.8	176.2	177.4	62	0	0	0	111.4	A163 T167 Q172 L174 L340 W343 F363 I364 D365 D370 I371	A163-L367 HydrophobicContact CB-CD1 4.2Å; A163-L367 HydrophobicContact CB-CD2 4.37Å; T167-L367 HydrophobicContact CG2-CD1 3.63Å; Q172-L367 HydrophobicContact CG-CD1 4.27Å; L174-L367 HydrophobicContact CD2-CD2 3.69Å; L340-L367 HydrophobicContact CD1-CD2 3.85Å; L340-L367 HydrophobicContact CD2-CD2 4.33Å; W343-L367 HydrophobicContact CZ3-CD2 4.49Å; F363-L367 HydrophobicContact CE1-CD2 4.25Å; F363-L367 WeakPolarHBondContact O-CB 3.32Å; F363-L367 PolarHBondContact O-N 3Å; I364-L367 WeakPolarHBondContact O-CB 3.41Å; I364-L367 PolarHBondContact O-N 2.82Å; I364-L367 VanDerWaalsContact O-N 3.16Å; D365-L367 VanDerWaalsContact C-N 3.32Å; D365-L367 PolarHBondContact O-N 2.7Å; L367-D370 PolarHBondContact O-N 2.79Å; L367-I371 HydrophobicContact CD1-CD1 4.11Å; L367-I371 HydrophobicContact CD1-CG1 4.35Å; L367-I371 HydrophobicContact CG-CD1 3.98Å; L367-I371 VanDerWaalsContact O-CG1 3.24Å; L367-I371 WeakPolarHBondContact O-CG1 3.44Å; L367-I371 PolarHBondContact O-N 2.9Å
368	Y	91.6	Very high	88.9	Confident	74 Å²	74	67 Å²	67	29%	0.29	35%	0.347	S	S	.	.	H	α-helix	trans	-64.1	-40.6	177.1	-84.9	-74.3	0	0	0	112.5	V344 I364 D365 D370 I371 E372 L379	V344-Y368 HydrophobicContact CG1-CE2 4.49Å; V344-Y368 HydrophobicContact CG2-CE2 3.94Å; I364-Y368 HydrophobicContact CG2-CD2 3.77Å; I364-Y368 HydrophobicContact CG2-CE2 3.71Å; I364-Y368 WeakPolarHBondContact O-CD2 3.44Å; I364-Y368 PolarHBondContact O-N 3.15Å; D365-Y368 PolarHBondContact O-N 3.27Å; Y368-D370 VanDerWaalsContact C-N 3.33Å; Y368-D370 PolarHBondContact O-N 3.04Å; Y368-I371 PolarHBondContact O-N 2.99Å; Y368-E372 WeakPolarHBondContact O-CB 3.27Å; Y368-E372 PolarHBondContact O-N 3.01Å; Y368-L379 HydrophobicContact CD1-CD1 4.3Å; Y368-L379 HydrophobicContact CD1-CD2 4.37Å; Y368-L379 HydrophobicContact CE1-CD1 4.03Å; Y368-L379 HydrophobicContact CE1-CD2 4.27Å
369	K	91.6	Very high	87.6	Confident	123 Å²	123	63.4 Å²	63.4	54%	0.535	33%	0.331	S	S	.	.	H	α-helix	trans	-60.3	-42.2	173.4	-71.7	170.7	-174.8	169.3	0	112.3	D365 Q366 I371 E372 A373	D365-K369 WeakPolarHBondContact O-CG 3.42Å; D365-K369 PolarHBondContact O-N 3.27Å; D365-K369 VanDerWaalsContact O-N 3.08Å; Q366-K369 PolarHBondContact O-N 2.78Å; K369-I371 VanDerWaalsContact C-N 3.32Å; K369-E372 PolarHBondContact O-N 3.01Å; K369-A373 WeakPolarHBondContact O-CB 3.35Å; K369-A373 PolarHBondContact O-N 3.41Å
370	D	91.6	Very high	86.7	Confident	36 Å²	36	58.4 Å²	58.4	19%	0.193	31%	0.309	C	S	.	.	H	α-helix	trans	-65.2	-37.5	177.6	-74.9	-10.3	0	0	0	111.9	T167 K169 Q366 L367 Y368 A374	T167-D370 HydrophobicContact CG2-CB 3.99Å; K169-D370 IonicContact NZ-OD1 3.72Å; K169-D370 IonicContact NZ-OD2 3.79Å; K169-D370 PolarHBondContact NZ-OD2 3.24Å; Q366-D370 PolarHBondContact NE2-OD1 3.25Å; Q366-D370 WeakPolarHBondContact O-CB 3.5Å; Q366-D370 VanDerWaalsContact O-CG 3.22Å; Q366-D370 PolarHBondContact O-N 2.89Å; L367-D370 PolarHBondContact O-N 2.79Å; Y368-D370 VanDerWaalsContact C-N 3.33Å; Y368-D370 PolarHBondContact O-N 3.04Å; D370-A374 WeakPolarHBondContact O-CB 3.45Å; D370-A374 PolarHBondContact O-N 2.72Å
371	I	89.3	Confident	86	Confident	0 Å²	0	58.1 Å²	58.1	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-69.1	-48.5	176.4	-67.1	166.4	0	0	0	110.6	L166 T167 L340 L367 Y368 K369 A373 A374 T375 L379	L166-I371 HydrophobicContact CB-CB 4.45Å; L166-I371 HydrophobicContact CB-CD1 4.19Å; L166-I371 HydrophobicContact CB-CG1 3.86Å; L166-I371 HydrophobicContact CB-CG2 3.81Å; L166-I371 HydrophobicContact CD1-CD1 4.22Å; L166-I371 HydrophobicContact CD1-CG2 4.3Å; L166-I371 HydrophobicContact CG-CG2 4.46Å; T167-I371 HydrophobicContact CG2-CD1 4.48Å; T167-I371 HydrophobicContact CG2-CG1 3.56Å; L340-I371 HydrophobicContact CD2-CD1 3.47Å; L340-I371 VanDerWaalsContact CD2-CD1 3.47Å; L367-I371 HydrophobicContact CD1-CD1 4.11Å; L367-I371 HydrophobicContact CD1-CG1 4.35Å; L367-I371 HydrophobicContact CG-CD1 3.98Å; L367-I371 VanDerWaalsContact O-CG1 3.24Å; L367-I371 WeakPolarHBondContact O-CG1 3.44Å; L367-I371 PolarHBondContact O-N 2.9Å; Y368-I371 PolarHBondContact O-N 2.99Å; K369-I371 VanDerWaalsContact C-N 3.32Å; I371-A373 VanDerWaalsContact C-N 3.26Å; I371-A373 PolarHBondContact O-N 3.2Å; I371-A374 PolarHBondContact O-N 2.88Å; I371-T375 WeakPolarHBondContact CG2-OG1 3.18Å; I371-T375 PolarHBondContact O-N 3.49Å; I371-T375 PolarHBondContact O-OG1 2.85Å; I371-T375 VanDerWaalsContact O-OG1 3.04Å; I371-L379 HydrophobicContact CB-CD2 4.25Å; I371-L379 HydrophobicContact CD1-CD2 4.31Å; I371-L379 HydrophobicContact CG2-CD2 3.32Å
372	E	87.9	Confident	85.6	Confident	133 Å²	133	56.3 Å²	56.3	62%	0.621	30%	0.297	S	S	*	.	H	α-helix	trans	-56.7	-42.8	177.7	-173.9	-179.8	-176.2	0	0	111.1	Y368 K369 A374 G376	Y368-E372 WeakPolarHBondContact O-CB 3.27Å; Y368-E372 PolarHBondContact O-N 3.01Å; K369-E372 PolarHBondContact O-N 3.01Å; E372-A374 VanDerWaalsContact C-N 3.29Å; E372-A374 PolarHBondContact O-N 3.05Å; E372-G376 WeakPolarHBondContact O-CA 3.2Å; E372-G376 PolarHBondContact O-N 3.09Å
373	A	88.5	Confident	85.4	Confident	87 Å²	87	51.4 Å²	51.4	72%	0.719	27%	0.272	S	S	*	.	H	α-helix	trans	-64.2	-30.4	175.8	0	0	0	0	0	113.7	K369 I371	K369-A373 WeakPolarHBondContact O-CB 3.35Å; K369-A373 PolarHBondContact O-N 3.41Å; I371-A373 VanDerWaalsContact C-N 3.26Å; I371-A373 PolarHBondContact O-N 3.2Å
374	A	85.6	Confident	85.2	Confident	40 Å²	40	48.7 Å²	48.7	33%	0.331	26%	0.26	S	S	.	.	H	α-helix	trans	-90.8	-40.9	-176.3	0	0	0	0	0	113.4	L166 D370 I371 E372	L166-A374 VanDerWaalsContact O-CB 3.31Å; L166-A374 WeakPolarHBondContact O-CB 3.47Å; D370-A374 WeakPolarHBondContact O-CB 3.45Å; D370-A374 PolarHBondContact O-N 2.72Å; I371-A374 PolarHBondContact O-N 2.88Å; E372-A374 VanDerWaalsContact C-N 3.29Å; E372-A374 PolarHBondContact O-N 3.05Å
375	T	76.4	Confident	85.2	Confident	37 Å²	37	48.2 Å²	48.2	23%	0.227	26%	0.258	C	S	.	.	H	α-helix	trans	-126.6	-1.1	-170.2	55.5	0	0	0	0	114.3	L166 I371	L166-T375 HydrophobicContact CD2-CG2 4.43Å; L166-T375 VanDerWaalsContact O-CG2 3.23Å; L166-T375 WeakPolarHBondContact O-CG2 3.05Å; I371-T375 WeakPolarHBondContact CG2-OG1 3.18Å; I371-T375 PolarHBondContact O-N 3.49Å; I371-T375 PolarHBondContact O-OG1 2.85Å; I371-T375 VanDerWaalsContact O-OG1 3.04Å
376	G	77.7	Confident	85.3	Confident	23 Å²	23	43.7 Å²	43.7	24%	0.237	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	63.1	-136.8	-171.8	0	0	0	0	0	111.2	E372 F378	E372-G376 WeakPolarHBondContact O-CA 3.2Å; E372-G376 PolarHBondContact O-N 3.09Å; G376-F378 VanDerWaalsContact C-N 3.32Å; G376-F378 PolarHBondContact O-N 3.1Å
377	E	65.4	Low	85.3	Confident	133 Å²	133	39.2 Å²	39.2	62%	0.621	21%	0.213	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-3.7	-172.3	-58.8	-177.6	163	0	0	114.9	F38 L379	F38-E377 WeakPolarHBondContact CZ-OE2 3.24Å; E377-L379 PolarHBondContact O-N 3.29Å
378	F	64.4	Low	85.3	Confident	36 Å²	36	39.2 Å²	39.2	16%	0.158	21%	0.213	C	C	.	.			trans	-81.6	90.8	-176.4	-82.3	-91.3	0	0	0	112.4	Y144 Y146 L166 P240 G376	Y144-F378 HydrophobicContact CE2-CE1 4.07Å; Y144-F378 HydrophobicContact CE2-CZ 4.29Å; Y146-F378 PolarHBondContact OH-O 2.94Å; L166-F378 WeakPolarHBondContact CD2-O 3.48Å; P240-F378 HydrophobicContact CB-CZ 3.92Å; G376-F378 VanDerWaalsContact C-N 3.32Å; G376-F378 PolarHBondContact O-N 3.1Å
379	L	68.1	Low	85.4	Confident	48 Å²	48	35.7 Å²	35.7	25%	0.251	20%	0.199	S	C	.	.			trans	-103	-32.4	179.7	-69.2	167.7	0	0	0	114.4	L166 Y368 I371 E377	L166-L379 HydrophobicContact CD1-CD2 4.25Å; Y368-L379 HydrophobicContact CD1-CD1 4.3Å; Y368-L379 HydrophobicContact CD1-CD2 4.37Å; Y368-L379 HydrophobicContact CE1-CD1 4.03Å; Y368-L379 HydrophobicContact CE1-CD2 4.27Å; I371-L379 HydrophobicContact CB-CD2 4.25Å; I371-L379 HydrophobicContact CD1-CD2 4.31Å; I371-L379 HydrophobicContact CG2-CD2 3.32Å; E377-L379 PolarHBondContact O-N 3.29Å
380	N	78.3	Confident	85.6	Confident	26 Å²	26	30.3 Å²	30.3	14%	0.139	18%	0.176	C	C	.	.	S	Bend	trans	-108.5	152.3	-165.2	-64.9	-45.6	0	0	0	112.1	L40 Y146 S338 E382	L40-N380 HydrophobicContact CD1-CB 4.19Å; L40-N380 WeakPolarHBondContact CD1-ND2 3.3Å; Y146-N380 VanDerWaalsContact CE1-C 3.42Å; Y146-N380 WeakPolarHBondContact CE1-O 3.28Å; S338-N380 WeakPolarHBondContact CB-OD1 3.46Å; N380-E382 PolarHBondContact O-N 2.93Å
381	C	81.3	Confident	85.7	Confident	3 Å²	3	30 Å²	30	2%	0.02	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.4	118.4	155.9	164.7	0	0	0	0	107.6	N141 Y146 A148 G336 T337	N141-C381 PolarHBondContact ND2-SG 2.81Å; Y146-C381 HydrophobicContact CD1-CB 4Å; Y146-C381 HydrophobicContact CG-CB 4.43Å; A148-C381 HydrophobicContact CB-CB 4.18Å; A148-C381 WeakPolarHBondContact CB-SG 3.41Å; G336-C381 WeakPolarHBondContact CA-O 3.32Å; T337-C381 PolarHBondContact N-O 3.41Å; T337-C381 WeakPolarHBondContact O-CB 3.47Å; T337-C381 PolarHBondContact O-N 2.9Å; T337-C381 WeakPolarHBondContact OG1-CB 3.45Å; T337-C381 PolarHBondContact OG1-O 3.14Å
382	E	87.8	Confident	86	Confident	21 Å²	21	30.1 Å²	30.1	10%	0.098	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.8	148.8	-173.6	-61.7	-177.9	140.6	0	0	112.2	K37 F138 N141 I335 N380	K37-E382 WeakPolarHBondContact CE-OE1 3.47Å; K37-E382 WeakPolarHBondContact CE-OE2 3.4Å; K37-E382 IonicContact NZ-OE2 2.85Å; F138-E382 HydrophobicContact CD2-CB 3.43Å; F138-E382 VanDerWaalsContact CD2-CB 3.43Å; F138-E382 HydrophobicContact CE2-CB 3.9Å; F138-E382 HydrophobicContact CG-CB 4.28Å; F138-E382 PolarHBondContact N-O 3.42Å; N141-E382 PolarHBondContact ND2-N 3.11Å; N141-E382 PolarHBondContact ND2-O 3.36Å; N141-E382 PolarHBondContact OD1-N 3.17Å; I335-E382 CarbonylContact O-C 3.55Å; I335-E382 WeakPolarHBondContact O-CA 3.46Å; N380-E382 PolarHBondContact O-N 2.93Å
383	G	91.6	Very high	86.3	Confident	1 Å²	1	23.8 Å²	23.8	1%	0.01	15%	0.147	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-168.9	-171.1	173.1	0	0	0	0	0	110.9	A136 G334 I335	A136-G383 CarbonylContact O-C 3.56Å; A136-G383 WeakPolarHBondContact O-CA 3.36Å; G334-G383 CarbonylContact C-O 3.46Å; G334-G383 WeakPolarHBondContact CA-O 3.4Å; I335-G383 PolarHBondContact N-O 3.41Å; I335-G383 PolarHBondContact O-N 2.92Å
384	S	93.6	Very high	86.7	Confident	1 Å²	1	20.8 Å²	20.8	1%	0.007	12%	0.119	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.8	157.5	176.1	61.4	0	0	0	0	112	A135 A136 Q333	A135-S384 CarbonylContact C-O 3.58Å; A135-S384 WeakPolarHBondContact CA-O 3.37Å; A135-S384 WeakPolarHBondContact CB-O 3.44Å; A136-S384 PolarHBondContact N-O 3.05Å; A136-S384 PolarHBondContact O-N 3.04Å; Q333-S384 CarbonylContact O-C 3.36Å; Q333-S384 VanDerWaalsContact O-CA 3.23Å; Q333-S384 WeakPolarHBondContact O-CA 3.22Å
385	G	95.3	Very high	87.1	Confident	0 Å²	0	19.6 Å²	19.6	0%	0	11%	0.107	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.3	158.7	176.4	0	0	0	0	0	112.9	V134 Q333	V134-G385 CarbonylContact O-C 3.6Å; V134-G385 VanDerWaalsContact O-CA 3.23Å; V134-G385 WeakPolarHBondContact O-CA 3.36Å; Q333-G385 PolarHBondContact N-O 3.05Å; Q333-G385 PolarHBondContact O-N 3.07Å
386	L	95.5	Very high	88	Confident	0 Å²	0	18.3 Å²	18.3	0%	0	10%	0.1	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	121.3	173.2	-66.1	179.9	0	0	0	109.6	P132 L133 V134 L248 M252 F269 F272 L327 N331	P132-L386 CarbonylContact C-O 3.5Å; P132-L386 WeakPolarHBondContact CA-O 3.42Å; L133-L386 WeakPolarHBondContact CB-O 3.41Å; L133-L386 PolarHBondContact N-O 3.45Å; V134-L386 HydrophobicContact CG2-CB 4.33Å; V134-L386 HydrophobicContact CG2-CD1 4.02Å; V134-L386 HydrophobicContact CG2-CG 4.29Å; V134-L386 PolarHBondContact O-N 3.37Å; L248-L386 HydrophobicContact CD2-CD2 4.3Å; L248-L386 HydrophobicContact CD2-CG 3.99Å; M252-L386 HydrophobicContact CE-CD1 4.44Å; M252-L386 HydrophobicContact CG-CD1 4.37Å; M252-L386 HydrophobicContact SD-CD1 3.91Å; F269-L386 HydrophobicContact CD1-CD1 4.38Å; F269-L386 HydrophobicContact CE1-CD1 4.43Å; F272-L386 HydrophobicContact CD2-CD1 4.49Å; F272-L386 HydrophobicContact CE1-CB 4.12Å; F272-L386 HydrophobicContact CE2-CB 4.13Å; F272-L386 HydrophobicContact CE2-CD1 4.35Å; F272-L386 HydrophobicContact CZ-CB 3.7Å; L327-L386 HydrophobicContact CD2-CD1 3.83Å; L327-L386 HydrophobicContact CD2-CD2 4.25Å; N331-L386 HydrophobicContact CB-CD2 3.99Å
387	F	95.5	Very high	88.9	Confident	0 Å²	0	17.3 Å²	17.3	0%	0	9%	0.089	C	C	.	.			trans	-120.3	120.2	-176.2	-64.1	-95.2	0	0	0	109.4	E130 P132 F272 Q333 I335 Q390 S391 F405 F410 L412	E130-F387 HydrophobicContact CB-CD1 4.25Å; E130-F387 HydrophobicContact CG-CD1 4.09Å; P132-F387 HydrophobicContact CB-CD1 4.17Å; P132-F387 HydrophobicContact CB-CE1 3.73Å; P132-F387 HydrophobicContact CB-CE2 4.12Å; P132-F387 HydrophobicContact CB-CZ 3.7Å; P132-F387 HydrophobicContact CG-CE1 4.17Å; P132-F387 HydrophobicContact CG-CZ 4.17Å; F272-F387 WeakPolarHBondContact CE1-O 3.46Å; Q333-F387 HydrophobicContact CB-CD2 3.74Å; Q333-F387 HydrophobicContact CB-CE2 3.86Å; Q333-F387 HydrophobicContact CG-CD2 4.14Å; Q333-F387 HydrophobicContact CG-CE2 3.97Å; I335-F387 HydrophobicContact CD1-CE2 4.23Å; I335-F387 HydrophobicContact CD1-CZ 4.11Å; I335-F387 HydrophobicContact CG1-CE2 4.47Å; I335-F387 HydrophobicContact CG1-CZ 4.5Å; F387-Q390 HydrophobicContact CB-CB 3.8Å; F387-S391 WeakPolarHBondContact O-CB 3.25Å; F387-S391 PolarHBondContact O-N 2.91Å; F387-S391 PolarHBondContact O-OG 3.39Å; F387-F405 HydrophobicContact CZ-CE1 4.08Å; F387-F410 WeakPolarHBondContact CE1-O 3.25Å; F387-F410 WeakPolarHBondContact CZ-O 3.46Å; F387-L412 HydrophobicContact CD1-CB 3.79Å; F387-L412 HydrophobicContact CD1-CD1 4.3Å; F387-L412 HydrophobicContact CD2-CD1 4.21Å; F387-L412 HydrophobicContact CE1-CB 3.43Å; F387-L412 VanDerWaalsContact CE1-CB 3.43Å; F387-L412 HydrophobicContact CE1-CD1 4.34Å; F387-L412 HydrophobicContact CE1-CG 4.48Å; F387-L412 HydrophobicContact CE2-CD1 4.26Å; F387-L412 HydrophobicContact CG-CD1 4.23Å; F387-L412 HydrophobicContact CZ-CB 3.92Å; F387-L412 HydrophobicContact CZ-CD1 4.32Å
388	V	93.9	Very high	90.3	Very high	1 Å²	1	14.3 Å²	14.3	1%	0.006	8%	0.079	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74	-43.3	-166.4	-179.9	0	0	0	0	111.5	V87 F90 E130 L133 F272 S391 C392	V87-V388 HydrophobicContact CB-CG1 3.99Å; V87-V388 HydrophobicContact CG1-CG1 3.92Å; F90-V388 HydrophobicContact CD2-CG2 4.27Å; E130-V388 PolarHBondContact OE1-N 3.39Å; L133-V388 HydrophobicContact CB-CG2 4.34Å; L133-V388 HydrophobicContact CD2-CG2 4.35Å; F272-V388 HydrophobicContact CE2-CG2 4.31Å; F272-V388 HydrophobicContact CZ-CG2 3.88Å; V388-S391 PolarHBondContact O-OG 3.49Å; V388-S391 VanDerWaalsContact O-OG 3.1Å; V388-C392 PolarHBondContact O-SG 3.38Å
389	L	94.6	Very high	91.9	Very high	0 Å²	0	13.4 Å²	13.4	0%	0	8%	0.077	C	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	-43.7	-179.9	-171.9	62.2	0	0	0	110.8	V87 F88 C91 V104 L115 F128 E130 S391 C392	V87-L389 HydrophobicContact CB-CD1 4.36Å; V87-L389 HydrophobicContact CG2-CD1 4.02Å; F88-L389 HydrophobicContact CD1-CD1 4.32Å; F88-L389 HydrophobicContact CD1-CD2 3.73Å; F88-L389 HydrophobicContact CE1-CD1 3.95Å; F88-L389 HydrophobicContact CE1-CD2 3.77Å; F88-L389 HydrophobicContact CZ-CD1 4.26Å; C91-L389 VanDerWaalsContact SG-CD2 3.52Å; V104-L389 HydrophobicContact CG2-CD1 3.78Å; L115-L389 HydrophobicContact CD1-CD1 3.71Å; L115-L389 HydrophobicContact CD1-CG 4.39Å; F128-L389 HydrophobicContact CD1-CD2 3.89Å; F128-L389 HydrophobicContact CD2-CD2 3.87Å; F128-L389 HydrophobicContact CE1-CD2 3.99Å; F128-L389 HydrophobicContact CE1-CG 4.15Å; F128-L389 HydrophobicContact CE2-CB 4.14Å; F128-L389 HydrophobicContact CE2-CD2 3.93Å; F128-L389 HydrophobicContact CE2-CG 4.07Å; F128-L389 HydrophobicContact CG-CD2 3.84Å; F128-L389 HydrophobicContact CZ-CB 4.3Å; F128-L389 HydrophobicContact CZ-CD2 3.98Å; F128-L389 HydrophobicContact CZ-CG 3.87Å; E130-L389 PolarHBondContact OE1-N 2.94Å; E130-L389 WeakPolarHBondContact OE2-CB 3.45Å; E130-L389 PolarHBondContact OE2-N 3.01Å; L389-S391 VanDerWaalsContact C-N 3.28Å; L389-S391 PolarHBondContact O-N 3.09Å; L389-C392 VanDerWaalsContact O-CB 3.28Å; L389-C392 WeakPolarHBondContact O-CB 3.46Å; L389-C392 PolarHBondContact O-N 2.67Å
390	Q	95.4	Very high	93.3	Very high	10 Å²	10	11.9 Å²	11.9	5%	0.047	7%	0.069	C	C	.	.	G	3₁₀ helix	trans	-60.6	-35.6	176.8	179.4	-83.3	-42.9	0	0	112.5	F128 E130 F387 C392 C393 T403 L412 I428	F128-Q390 HydrophobicContact CE2-CB 4.33Å; F128-Q390 HydrophobicContact CZ-CB 4.3Å; E130-Q390 PolarHBondContact OE2-N 3.24Å; F387-Q390 HydrophobicContact CB-CB 3.8Å; Q390-C392 PolarHBondContact O-N 2.76Å; Q390-C393 WeakPolarHBondContact O-CB 3.35Å; Q390-C393 PolarHBondContact O-N 3.48Å; Q390-T403 HydrophobicContact CG-CG2 3.96Å; Q390-L412 HydrophobicContact CB-CD1 4.4Å; Q390-L412 HydrophobicContact CB-CD2 3.85Å; Q390-L412 HydrophobicContact CG-CD1 3.89Å; Q390-L412 HydrophobicContact CG-CD2 3.83Å; Q390-I428 HydrophobicContact CG-CD1 4.49Å
391	S	93.8	Very high	94.2	Very high	30 Å²	30	10.7 Å²	10.7	21%	0.21	6%	0.063	C	C	.	.	G	3₁₀ helix	trans	-65.3	-6.6	175.5	75.3	0	0	0	0	114	F387 V388 L389	F387-S391 WeakPolarHBondContact O-CB 3.25Å; F387-S391 PolarHBondContact O-N 2.91Å; F387-S391 PolarHBondContact O-OG 3.39Å; V388-S391 PolarHBondContact O-OG 3.49Å; V388-S391 VanDerWaalsContact O-OG 3.1Å; L389-S391 VanDerWaalsContact C-N 3.28Å; L389-S391 PolarHBondContact O-N 3.09Å
392	C	94.5	Very high	94.9	Very high	2 Å²	2	14.8 Å²	14.8	1%	0.014	8%	0.082	C	C	.	.	G	3₁₀ helix	trans	-89.8	-7.3	171.8	-59	0	0	0	0	113.1	V104 K113 G114 L115 V388 L389 Q390	V104-C392 HydrophobicContact CG1-CB 4.31Å; V104-C392 HydrophobicContact CG2-CB 4.16Å; K113-C392 HydrophobicContact CB-CB 4.48Å; G114-C392 CarbonylContact C-O 3.58Å; G114-C392 VanDerWaalsContact CA-O 3.25Å; G114-C392 WeakPolarHBondContact CA-O 3.24Å; L115-C392 PolarHBondContact N-O 3.46Å; V388-C392 PolarHBondContact O-SG 3.38Å; L389-C392 VanDerWaalsContact O-CB 3.28Å; L389-C392 WeakPolarHBondContact O-CB 3.46Å; L389-C392 PolarHBondContact O-N 2.67Å; Q390-C392 PolarHBondContact O-N 2.76Å
393	C	95.7	Very high	95.2	Very high	0 Å²	0	15.1 Å²	15.1	0%	0	9%	0.085	C	C	.	.	P	Polyproline II helix	trans	-82	116.3	176.5	-58.6	0	0	0	0	109.4	L115 Q390 I428 Y430	L115-C393 VanDerWaalsContact CD2-SG 3.56Å; Q390-C393 WeakPolarHBondContact O-CB 3.35Å; Q390-C393 PolarHBondContact O-N 3.48Å; C393-I428 HydrophobicContact CB-CD1 4.07Å; C393-I428 HydrophobicContact CB-CG1 3.93Å; C393-I428 HydrophobicContact CB-CG2 4.09Å; C393-Y430 PolarHBondContact O-OH 3.07Å
394	N	95.4	Very high	95.2	Very high	24 Å²	24	16.8 Å²	16.8	13%	0.128	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.2	165.7	179.9	-77.8	-44.6	0	0	0	112.6	K113 E425 C427 I428	K113-N394 PolarHBondContact O-ND2 3.4Å; K113-N394 PolarHBondContact O-OD1 3.13Å; N394-E425 PolarHBondContact ND2-OE1 2.93Å; N394-C427 CarbonylContact O-C 3.57Å; N394-C427 WeakPolarHBondContact O-CA 3.26Å; N394-C427 WeakPolarHBondContact O-CB 3.42Å; N394-I428 PolarHBondContact O-N 3.42Å
395	H	95	Very high	95.1	Very high	16 Å²	16	18.1 Å²	18.1	7%	0.074	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	139.8	176.8	-179.5	70.1	0	0	0	113.5	C397 I428 Y430 L447 F453	H395-C397 PolarHBondContact NE2-N 2.78Å; H395-C397 PolarHBondContact NE2-SG 2.88Å; H395-I428 CarbonylContact C-O 3.52Å; H395-I428 VanDerWaalsContact CA-O 3.27Å; H395-I428 WeakPolarHBondContact CA-O 3.28Å; H395-Y430 HydrophobicContact CB-CD1 4.11Å; H395-Y430 HydrophobicContact CB-CD2 3.74Å; H395-Y430 HydrophobicContact CB-CE1 4.21Å; H395-Y430 HydrophobicContact CB-CE2 3.87Å; H395-Y430 HydrophobicContact CB-CG 3.86Å; H395-Y430 PolarHBondContact CE1-N 3.42Å; H395-Y430 AromaticContact ND1-CG 3.73Å; H395-Y430 PolarHBondContact ND1-N 3.2Å; H395-L447 WeakPolarHBondContact NE2-CD1 3.29Å; H395-F453 HydrophobicContact CB-CE1 4.32Å; H395-F453 HydrophobicContact CB-CE2 4.16Å; H395-F453 HydrophobicContact CB-CZ 3.48Å; H395-F453 VanDerWaalsContact CB-CZ 3.48Å; H395-F453 AromaticContact CD2-CZ 3.79Å; H395-F453 AromaticContact CG-CZ 3.75Å
396	S	96.3	Very high	94.7	Very high	10 Å²	10	21.8 Å²	21.8	7%	0.07	13%	0.126	C	C	.	.			trans	-138.5	139.9	157.1	179.1	0	0	0	0	109.9	V398 I428 C457	S396-V398 WeakPolarHBondContact CB-O 3.44Å; S396-V398 PolarHBondContact O-N 3.33Å; S396-V398 PolarHBondContact OG-N 3.42Å; S396-V398 VanDerWaalsContact OG-N 3.14Å; S396-V398 PolarHBondContact OG-O 3.01Å; S396-I428 PolarHBondContact N-O 2.95Å; S396-C457 WeakPolarHBondContact OG-CB 3.48Å
397	C	95.1	Very high	94.4	Very high	1 Å²	1	25.2 Å²	25.2	1%	0.007	14%	0.142	C	C	.	.	S	Bend	trans	-68.9	-19.2	170.8	-51.8	0	0	0	0	112	H395 P399 R443 K459	H395-C397 PolarHBondContact NE2-N 2.78Å; H395-C397 PolarHBondContact NE2-SG 2.88Å; C397-P399 WeakPolarHBondContact O-CD 3.33Å; C397-R443 PolarHBondContact SG-NE 3.42Å; C397-R443 VanDerWaalsContact SG-NE 3.43Å; C397-K459 HydrophobicContact CB-CB 4.36Å; C397-K459 HydrophobicContact CB-CD 4.17Å
398	V	95.6	Very high	94.1	Very high	70 Å²	70	25.7 Å²	25.7	42%	0.424	15%	0.145	S	C	.	.	S	Bend	trans	-115.9	77.5	168.6	-76.2	0	0	0	0	108.1	S396 P458 K459	S396-V398 WeakPolarHBondContact CB-O 3.44Å; S396-V398 PolarHBondContact O-N 3.33Å; S396-V398 PolarHBondContact OG-N 3.42Å; S396-V398 VanDerWaalsContact OG-N 3.14Å; S396-V398 PolarHBondContact OG-O 3.01Å; V398-P458 HydrophobicContact CG2-CB 4.39Å; V398-P458 HydrophobicContact CG2-CG 4.45Å; V398-K459 HydrophobicContact CG1-CB 3.91Å; V398-K459 HydrophobicContact CG1-CD 4.16Å; V398-K459 HydrophobicContact CG2-CB 4.25Å
399	P	97.1	Very high	94.1	Very high	18 Å²	18	26.1 Å²	26.1	12%	0.117	15%	0.147	C	C	.	.			trans	-72.6	149.5	-175.8	33.2	-37.4	0	0	0	111	C397 L417 C427	C397-P399 WeakPolarHBondContact O-CD 3.33Å; P399-L417 HydrophobicContact CG-CD1 4.04Å; P399-C427 WeakPolarHBondContact CA-O 3.32Å; P399-C427 WeakPolarHBondContact CB-O 3.27Å
400	N	98.1	Very high	94.1	Very high	16 Å²	16	26.9 Å²	26.9	9%	0.086	15%	0.15	C	C	.	.	S	Bend	trans	-101.1	-3.2	172.8	61.7	4.2	0	0	0	112.4	L417 E418 I420 E425 C427	N400-L417 PolarHBondContact O-N 2.9Å; N400-E418 HydrophobicContact CB-CG 3.79Å; N400-E418 WeakPolarHBondContact CB-OE1 3.09Å; N400-I420 HydrophobicContact CB-CD1 4.31Å; N400-I420 HydrophobicContact CB-CG1 4.26Å; N400-E425 PolarHBondContact ND2-O 3.23Å; N400-C427 PolarHBondContact N-O 2.91Å; N400-C427 VanDerWaalsContact N-O 3.14Å; N400-C427 PolarHBondContact OD1-N 3.38Å; N400-C427 PolarHBondContact OD1-O 3.08Å
401	A	97.4	Very high	94.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	158.6	172.9	0	0	0	0	0	111.7	I127 V414 T415 I426 C427 I428	I127-A401 HydrophobicContact CD1-CB 3.82Å; A401-V414 HydrophobicContact CB-CG1 4Å; A401-T415 CarbonylContact C-O 3.47Å; A401-T415 WeakPolarHBondContact CA-O 3.34Å; A401-T415 WeakPolarHBondContact CB-O 3.47Å; A401-I426 HydrophobicContact CB-CG2 3.71Å; A401-C427 PolarHBondContact N-O 2.84Å; A401-C427 VanDerWaalsContact N-O 3.17Å; A401-I428 HydrophobicContact CB-CG2 4.23Å; A401-I428 WeakPolarHBondContact O-CA 3.22Å
402	E	95.6	Very high	94.2	Very high	90 Å²	90	25.5 Å²	25.5	42%	0.421	14%	0.141	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.5	156.5	176.5	64.7	179	178.1	0	0	111.9	V414 T415 L417	E402-V414 VanDerWaalsContact O-CA 3.3Å; E402-V414 WeakPolarHBondContact O-CA 3.29Å; E402-T415 PolarHBondContact N-O 2.96Å; E402-T415 PolarHBondContact O-N 3.48Å; E402-L417 HydrophobicContact CB-CD1 4.19Å; E402-L417 HydrophobicContact CB-CD2 4.12Å; E402-L417 HydrophobicContact CB-CG 4.2Å; E402-L417 VanDerWaalsContact CD-CD2 3.49Å; E402-L417 HydrophobicContact CG-CD2 3.79Å; E402-L417 HydrophobicContact CG-CG 4.21Å
403	T	94	Very high	94.2	Very high	27 Å²	27	26.5 Å²	26.5	17%	0.166	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	137.3	171.9	57.8	0	0	0	0	110.2	Q390 L412 H413 V414 I428	Q390-T403 HydrophobicContact CG-CG2 3.96Å; T403-L412 HydrophobicContact CG2-CD1 4.19Å; T403-L412 HydrophobicContact CG2-CD2 4.39Å; T403-H413 CarbonylContact C-O 3.36Å; T403-H413 VanDerWaalsContact CA-O 3.31Å; T403-H413 WeakPolarHBondContact CA-O 3.44Å; T403-V414 HydrophobicContact CG2-CG2 4.26Å; T403-I428 HydrophobicContact CG2-CD1 3.93Å; T403-I428 HydrophobicContact CG2-CG2 4.21Å
404	S	91.3	Very high	94.3	Very high	37 Å²	37	26.5 Å²	26.5	26%	0.259	15%	0.145	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.3	165.5	177	63.3	0	0	0	0	112.7	P406 H413	S404-P406 WeakPolarHBondContact O-CD 3.47Å; S404-H413 PolarHBondContact N-O 3.34Å; S404-H413 PolarHBondContact O-N 2.96Å
405	F	91.6	Very high	94.3	Very high	28 Å²	28	26.3 Å²	26.3	12%	0.123	15%	0.145	C	C	.	.			trans	-124.2	58.9	-179.2	-60.8	-83.3	0	0	0	111.7	Q333 G334 I335 F387 E407 N408 N409 L411 L412	Q333-F405 HydrophobicContact CG-CZ 3.93Å; G334-F405 WeakPolarHBondContact O-CE2 3.49Å; G334-F405 WeakPolarHBondContact O-CZ 3.41Å; I335-F405 HydrophobicContact CB-CE1 4.44Å; I335-F405 HydrophobicContact CB-CZ 4.32Å; I335-F405 HydrophobicContact CG1-CE1 3.85Å; I335-F405 HydrophobicContact CG1-CE2 4.49Å; I335-F405 HydrophobicContact CG1-CZ 3.74Å; I335-F405 HydrophobicContact CG2-CD1 4.19Å; I335-F405 HydrophobicContact CG2-CE1 4.18Å; I335-F405 HydrophobicContact CG2-CG 4.5Å; I335-F405 HydrophobicContact CG2-CZ 4.48Å; F387-F405 HydrophobicContact CZ-CE1 4.08Å; F405-E407 PolarHBondContact O-N 2.75Å; F405-N408 PolarHBondContact O-N 3.03Å; F405-N408 VanDerWaalsContact O-N 3.17Å; F405-N409 WeakPolarHBondContact CD1-O 3.4Å; F405-L411 WeakPolarHBondContact CD1-O 3.25Å; F405-L412 HydrophobicContact CE1-CB 3.85Å; F405-L412 HydrophobicContact CE1-CD1 4.31Å; F405-L412 HydrophobicContact CE1-CG 4.42Å; F405-L412 HydrophobicContact CZ-CB 4.36Å; F405-L412 HydrophobicContact CZ-CD1 3.98Å; F405-L412 HydrophobicContact CZ-CG 4.47Å
406	P	88	Confident	94.4	Very high	77 Å²	77	25.7 Å²	25.7	50%	0.5	14%	0.142	S	C	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-20	-169.8	26.9	-36.1	0	0	0	113.8	S404 N408 H413	S404-P406 WeakPolarHBondContact O-CD 3.47Å; P406-N408 VanDerWaalsContact C-N 3.28Å; P406-N408 PolarHBondContact O-N 3.31Å; P406-H413 HydrophobicContact CG-CB 4.23Å
407	E	89.2	Confident	94.4	Very high	73 Å²	73	28.1 Å²	28.1	34%	0.341	15%	0.154	S	C	.	.	T	Hydrogen-bonded Turn	trans	-88.3	9.3	-177.9	-65.2	-176.2	-126.3	0	0	114.3	R154 F405 N409 L411 H413	R154-E407 PolarHBondContact NH2-O 2.66Å; F405-E407 PolarHBondContact O-N 2.75Å; E407-N409 PolarHBondContact O-N 2.95Å; E407-L411 WeakPolarHBondContact OE2-CD1 3.19Å; E407-H413 IonicContact OE1-CE1 2.62Å; E407-H413 IonicContact OE1-NE2 3.38Å; E407-H413 PolarHBondContact OE1-NE2 3.27Å
408	N	89.2	Confident	94.6	Very high	9 Å²	9	32.9 Å²	32.9	5%	0.048	18%	0.177	C	C	.	.	S	Bend	trans	50.7	46.7	-179.4	-166.6	24	0	0	0	111.5	R154 T337 S338 Q342 F405 P406	R154-N408 VanDerWaalsContact CA-O 3.28Å; R154-N408 WeakPolarHBondContact CA-O 3.33Å; R154-N408 WeakPolarHBondContact CB-O 3.48Å; R154-N408 WeakPolarHBondContact CG-O 3.38Å; R154-N408 PolarHBondContact NE-O 3.35Å; T337-N408 VanDerWaalsContact CA-OD1 3.23Å; T337-N408 WeakPolarHBondContact CA-OD1 3.43Å; T337-N408 WeakPolarHBondContact CB-OD1 3.41Å; S338-N408 PolarHBondContact N-OD1 3.37Å; S338-N408 PolarHBondContact O-ND2 2.96Å; S338-N408 PolarHBondContact O-OD1 2.91Å; Q342-N408 HydrophobicContact CB-CB 4.43Å; Q342-N408 HydrophobicContact CG-CB 4.44Å; F405-N408 PolarHBondContact O-N 3.03Å; F405-N408 VanDerWaalsContact O-N 3.17Å; P406-N408 VanDerWaalsContact C-N 3.28Å; P406-N408 PolarHBondContact O-N 3.31Å
409	N	93.7	Very high	94.7	Very high	10 Å²	10	33.7 Å²	33.7	5%	0.053	18%	0.179	C	C	.	.	S	Bend	trans	-156.5	-176.7	178.5	66.1	22.9	0	0	0	108.7	C152 R154 F405 E407 L411	C152-N409 HydrophobicContact CB-CB 4.32Å; C152-N409 CarbonylContact O-C 3.51Å; C152-N409 VanDerWaalsContact O-CA 3.31Å; C152-N409 WeakPolarHBondContact O-CA 3.29Å; R154-N409 HydrophobicContact CB-CB 4.18Å; R154-N409 PolarHBondContact NH2-ND2 3.33Å; F405-N409 WeakPolarHBondContact CD1-O 3.4Å; E407-N409 PolarHBondContact O-N 2.95Å; N409-L411 PolarHBondContact O-N 2.9Å; N409-L411 VanDerWaalsContact O-N 3.13Å; N409-L411 WeakPolarHBondContact OD1-CB 3.3Å; N409-L411 WeakPolarHBondContact OD1-CG 3.39Å; N409-L411 PolarHBondContact OD1-N 3.12Å
410	F	95.1	Very high	94.7	Very high	16 Å²	16	32.9 Å²	32.9	7%	0.07	17%	0.173	C	C	.	.	S	Bend	trans	-70.8	4.9	179	67.5	1	0	0	0	116.6	P132 A135 H151 C152 I335 F387 L412	P132-F410 WeakPolarHBondContact CD-O 3.28Å; P132-F410 HydrophobicContact CG-CB 4Å; P132-F410 HydrophobicContact CG-CD2 3.33Å; P132-F410 HydrophobicContact CG-CE2 3.88Å; P132-F410 HydrophobicContact CG-CG 3.72Å; A135-F410 HydrophobicContact CB-CD2 4.13Å; H151-F410 AromaticContact CD2-CZ 3.9Å; H151-F410 AromaticContact NE2-CE2 3.87Å; H151-F410 AromaticContact NE2-CZ 3.74Å; H151-F410 WeakPolarHBondContact O-CD2 3.41Å; H151-F410 VanDerWaalsContact O-CE2 3.29Å; H151-F410 WeakPolarHBondContact O-CE2 3.36Å; C152-F410 HydrophobicContact CB-CD1 3.78Å; C152-F410 HydrophobicContact CB-CD2 4.12Å; C152-F410 HydrophobicContact CB-CE1 3.65Å; C152-F410 HydrophobicContact CB-CE2 3.97Å; C152-F410 HydrophobicContact CB-CG 4.04Å; C152-F410 HydrophobicContact CB-CZ 3.74Å; C152-F410 PolarHBondContact O-N 3.49Å; I335-F410 HydrophobicContact CD1-CB 3.94Å; F387-F410 WeakPolarHBondContact CE1-O 3.25Å; F387-F410 WeakPolarHBondContact CZ-O 3.46Å; F410-L412 PolarHBondContact O-N 3.39Å
411	L	95.6	Very high	94.7	Very high	11 Å²	11	38.2 Å²	38.2	6%	0.058	20%	0.196	C	C	.	.			trans	-77.7	112.4	-179	-66.7	-178.3	0	0	0	108.7	V92 V129 R131 F405 E407 N409	V92-L411 HydrophobicContact CG2-CD2 3.96Å; V129-L411 HydrophobicContact CG1-CB 4.28Å; R131-L411 HydrophobicContact CB-CD2 4.33Å; R131-L411 HydrophobicContact CG-CD2 3.39Å; F405-L411 WeakPolarHBondContact CD1-O 3.25Å; E407-L411 WeakPolarHBondContact OE2-CD1 3.19Å; N409-L411 PolarHBondContact O-N 2.9Å; N409-L411 VanDerWaalsContact O-N 3.13Å; N409-L411 WeakPolarHBondContact OD1-CB 3.3Å; N409-L411 WeakPolarHBondContact OD1-CG 3.39Å; N409-L411 PolarHBondContact OD1-N 3.12Å
412	L	95.1	Very high	94.8	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	126.9	-179.7	-179.4	141	0	0	0	109.4	F128 V129 E130 Q333 F387 Q390 T403 F405 F410 V414	F128-L412 HydrophobicContact CE2-CD2 4.37Å; V129-L412 CarbonylContact C-O 3.56Å; V129-L412 VanDerWaalsContact CA-O 3.26Å; V129-L412 WeakPolarHBondContact CA-O 3.46Å; E130-L412 PolarHBondContact N-O 3.14Å; E130-L412 PolarHBondContact O-N 3.06Å; Q333-L412 HydrophobicContact CG-CD1 3.7Å; F387-L412 HydrophobicContact CD1-CB 3.79Å; F387-L412 HydrophobicContact CD1-CD1 4.3Å; F387-L412 HydrophobicContact CD2-CD1 4.21Å; F387-L412 HydrophobicContact CE1-CB 3.43Å; F387-L412 VanDerWaalsContact CE1-CB 3.43Å; F387-L412 HydrophobicContact CE1-CD1 4.34Å; F387-L412 HydrophobicContact CE1-CG 4.48Å; F387-L412 HydrophobicContact CE2-CD1 4.26Å; F387-L412 HydrophobicContact CG-CD1 4.23Å; F387-L412 HydrophobicContact CZ-CB 3.92Å; F387-L412 HydrophobicContact CZ-CD1 4.32Å; Q390-L412 HydrophobicContact CB-CD1 4.4Å; Q390-L412 HydrophobicContact CB-CD2 3.85Å; Q390-L412 HydrophobicContact CG-CD1 3.89Å; Q390-L412 HydrophobicContact CG-CD2 3.83Å; T403-L412 HydrophobicContact CG2-CD1 4.19Å; T403-L412 HydrophobicContact CG2-CD2 4.39Å; F405-L412 HydrophobicContact CE1-CB 3.85Å; F405-L412 HydrophobicContact CE1-CD1 4.31Å; F405-L412 HydrophobicContact CE1-CG 4.42Å; F405-L412 HydrophobicContact CZ-CB 4.36Å; F405-L412 HydrophobicContact CZ-CD1 3.98Å; F405-L412 HydrophobicContact CZ-CG 4.47Å; F410-L412 PolarHBondContact O-N 3.39Å; L412-V414 HydrophobicContact CD2-CG2 3.43Å; L412-V414 VanDerWaalsContact CD2-CG2 3.43Å
413	H	95	Very high	94.9	Very high	24 Å²	24	39.3 Å²	39.3	11%	0.111	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	132.5	170.6	-74.2	-125.7	0	0	0	108.5	T126 T403 S404 P406 E407	T126-H413 HydrophobicContact CG2-CB 4.42Å; T403-H413 CarbonylContact C-O 3.36Å; T403-H413 VanDerWaalsContact CA-O 3.31Å; T403-H413 WeakPolarHBondContact CA-O 3.44Å; S404-H413 PolarHBondContact N-O 3.34Å; S404-H413 PolarHBondContact O-N 2.96Å; P406-H413 HydrophobicContact CG-CB 4.23Å; E407-H413 IonicContact OE1-CE1 2.62Å; E407-H413 IonicContact OE1-NE2 3.38Å; E407-H413 PolarHBondContact OE1-NE2 3.27Å
414	V	96.3	Very high	95	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	23%	0.225	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	118.1	166.6	-174.1	0	0	0	0	108.3	T126 I127 F128 A401 E402 T403 L412	T126-V414 CarbonylContact C-O 3.52Å; I127-V414 HydrophobicContact CB-CB 4.47Å; I127-V414 HydrophobicContact CB-CG1 4.44Å; I127-V414 WeakPolarHBondContact CB-O 3.24Å; I127-V414 HydrophobicContact CD1-CG1 3.93Å; I127-V414 PolarHBondContact N-O 2.63Å; F128-V414 HydrophobicContact CD1-CB 4.2Å; F128-V414 HydrophobicContact CD1-CG2 4.4Å; F128-V414 HydrophobicContact CD2-CG2 4.2Å; F128-V414 HydrophobicContact CE1-CB 3.84Å; F128-V414 HydrophobicContact CE1-CG1 4.2Å; F128-V414 HydrophobicContact CE1-CG2 3.74Å; F128-V414 HydrophobicContact CE2-CB 4.31Å; F128-V414 HydrophobicContact CE2-CG2 3.54Å; F128-V414 HydrophobicContact CZ-CB 3.93Å; F128-V414 HydrophobicContact CZ-CG1 4.49Å; F128-V414 HydrophobicContact CZ-CG2 3.28Å; F128-V414 PolarHBondContact O-N 3.25Å; A401-V414 HydrophobicContact CB-CG1 4Å; E402-V414 VanDerWaalsContact O-CA 3.3Å; E402-V414 WeakPolarHBondContact O-CA 3.29Å; T403-V414 HydrophobicContact CG2-CG2 4.26Å; L412-V414 HydrophobicContact CD2-CG2 3.43Å; L412-V414 VanDerWaalsContact CD2-CG2 3.43Å
415	T	96	Very high	95.4	Very high	20 Å²	20	41.4 Å²	41.4	12%	0.123	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.1	139.2	-174.4	-59.5	0	0	0	0	110.4	A401 E402	A401-T415 CarbonylContact C-O 3.47Å; A401-T415 WeakPolarHBondContact CA-O 3.34Å; A401-T415 WeakPolarHBondContact CB-O 3.47Å; E402-T415 PolarHBondContact N-O 2.96Å; E402-T415 PolarHBondContact O-N 3.48Å
416	A	97.5	Very high	95.7	Very high	2 Å²	2	40.1 Å²	40.1	2%	0.017	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	129.4	178.6	0	0	0	0	0	111.5	I121 G124 E125 I127 I420	I121-A416 HydrophobicContact CG2-CB 3.86Å; G124-A416 PolarHBondContact N-O 3.4Å; E125-A416 PolarHBondContact O-N 2.92Å; I127-A416 HydrophobicContact CD1-CB 4.24Å; I127-A416 HydrophobicContact CG1-CB 4.35Å; A416-I420 HydrophobicContact CB-CD1 3.95Å; A416-I420 HydrophobicContact CB-CG1 4.33Å
417	L	97.1	Very high	96.1	Very high	61 Å²	61	37.2 Å²	37.2	32%	0.319	20%	0.197	S	C	.	.	S	Bend	trans	-84.9	-20.5	176.8	-68.4	175.5	0	0	0	112.5	K123 P399 N400 E402	K123-L417 VanDerWaalsContact CD-O 3.25Å; K123-L417 WeakPolarHBondContact CD-O 3.4Å; K123-L417 WeakPolarHBondContact CE-O 3.38Å; K123-L417 WeakPolarHBondContact CG-O 3.45Å; P399-L417 HydrophobicContact CG-CD1 4.04Å; N400-L417 PolarHBondContact O-N 2.9Å; E402-L417 HydrophobicContact CB-CD1 4.19Å; E402-L417 HydrophobicContact CB-CD2 4.12Å; E402-L417 HydrophobicContact CB-CG 4.2Å; E402-L417 VanDerWaalsContact CD-CD2 3.49Å; E402-L417 HydrophobicContact CG-CD2 3.79Å; E402-L417 HydrophobicContact CG-CG 4.21Å
418	E	97.5	Very high	96.5	Very high	101 Å²	101	33.8 Å²	33.8	47%	0.472	18%	0.181	S	C	.	.	S	Bend	trans	-146.9	175.7	178.7	59.8	-177.6	178.1	0	0	110.4	N400 I420	N400-E418 HydrophobicContact CB-CG 3.79Å; N400-E418 WeakPolarHBondContact CB-OE1 3.09Å; E418-I420 PolarHBondContact O-N 2.86Å
419	D	98.2	Very high	96.7	Very high	88 Å²	88	34.2 Å²	34.2	47%	0.471	18%	0.184	S	C	.	.			trans	-71	120.6	173.8	-78.5	2.9	0	0	0	109.8	L120 I121 R122 K123	L120-D419 HydrophobicContact CD1-CB 4.4Å; I121-D419 CarbonylContact O-C 3.53Å; I121-D419 WeakPolarHBondContact O-CA 3.46Å; R122-D419 WeakPolarHBondContact CA-OD1 3.36Å; K123-D419 PolarHBondContact N-OD1 3.48Å
420	I	98.3	Very high	96.6	Very high	0 Å²	0	35.4 Å²	35.4	0%	0	19%	0.189	C	C	.	.	B	Isolated β-bridge	trans	-104.6	119	-179.4	-50.1	176.4	0	0	0	109.1	A117 L120 I121 I127 N400 A416 E418 E424 I426	A117-I420 HydrophobicContact CB-CG2 3.79Å; L120-I420 WeakPolarHBondContact CA-O 3.34Å; I121-I420 HydrophobicContact CB-CB 4.28Å; I121-I420 PolarHBondContact N-O 3.3Å; I121-I420 PolarHBondContact O-N 3.26Å; I127-I420 HydrophobicContact CD1-CD1 4.04Å; N400-I420 HydrophobicContact CB-CD1 4.31Å; N400-I420 HydrophobicContact CB-CG1 4.26Å; A416-I420 HydrophobicContact CB-CD1 3.95Å; A416-I420 HydrophobicContact CB-CG1 4.33Å; E418-I420 PolarHBondContact O-N 2.86Å; I420-E424 HydrophobicContact CG2-CB 3.87Å; I420-I426 HydrophobicContact CD1-CG1 4.23Å; I420-I426 HydrophobicContact CG2-CG1 4.34Å
421	K	98.2	Very high	96.2	Very high	128 Å²	128	35 Å²	35	56%	0.557	19%	0.187	S	C	*	.			trans	-81.2	155.2	-176.4	-62.5	173.7	-169.9	153	0	111.7	G423 E424	K421-G423 PolarHBondContact O-N 3.27Å; K421-E424 HydrophobicContact CB-CG 4.08Å; K421-E424 PolarHBondContact N-OE2 2.86Å; K421-E424 WeakPolarHBondContact O-CB 3.31Å; K421-E424 PolarHBondContact O-N 2.85Å; K421-E424 VanDerWaalsContact O-N 3.07Å
422	P	98	Very high	95.5	Very high	78 Å²	78	35.5 Å²	35.5	51%	0.506	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	-54	129.4	171.8	-16.3	24.2	0	0	0	111.2
423	G	97.4	Very high	94.7	Very high	36 Å²	36	38 Å²	38	37%	0.371	21%	0.207	S	C	.	.	T	Hydrogen-bonded Turn	trans	93.4	-13.8	-179.5	0	0	0	0	0	115	F116 A117 K421	F116-G423 WeakPolarHBondContact CD1-O 3.46Å; A117-G423 PolarHBondContact O-N 3.43Å; K421-G423 PolarHBondContact O-N 3.27Å
424	E	97.8	Very high	94	Very high	69 Å²	69	40.9 Å²	40.9	32%	0.322	23%	0.229	S	C	.	.			trans	-72.4	145.1	175.6	-69.4	178.4	172.3	0	0	111.5	F116 A117 I420 K421	F116-E424 VanDerWaalsContact CA-O 3.32Å; F116-E424 WeakPolarHBondContact CA-O 3.2Å; A117-E424 PolarHBondContact N-O 3.38Å; I420-E424 HydrophobicContact CG2-CB 3.87Å; K421-E424 HydrophobicContact CB-CG 4.08Å; K421-E424 PolarHBondContact N-OE2 2.86Å; K421-E424 WeakPolarHBondContact O-CB 3.31Å; K421-E424 PolarHBondContact O-N 2.85Å; K421-E424 VanDerWaalsContact O-N 3.07Å
425	E	97.8	Very high	93.5	Very high	39 Å²	39	41.6 Å²	41.6	18%	0.182	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	133.5	174.1	-166.2	171.9	-170.1	0	0	109.2	L115 F116 N394 N400	L115-E425 CarbonylContact O-C 3.32Å; L115-E425 WeakPolarHBondContact O-CA 3.27Å; F116-E425 HydrophobicContact CD1-CB 3.95Å; F116-E425 HydrophobicContact CD1-CG 4.41Å; F116-E425 HydrophobicContact CE1-CB 3.57Å; F116-E425 HydrophobicContact CE1-CG 3.94Å; F116-E425 HydrophobicContact CE2-CG 4.27Å; F116-E425 HydrophobicContact CZ-CB 4Å; F116-E425 HydrophobicContact CZ-CG 3.84Å; N394-E425 PolarHBondContact ND2-OE1 2.93Å; N400-E425 PolarHBondContact ND2-O 3.23Å
426	I	98.3	Very high	93.1	Very high	0 Å²	0	43.8 Å²	43.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	110.3	174	-61	172.1	0	0	0	106.8	V102 L115 A117 I121 I127 A401 I420	V102-I426 HydrophobicContact CB-CD1 4.31Å; V102-I426 HydrophobicContact CG1-CD1 3.35Å; L115-I426 HydrophobicContact CB-CB 4.4Å; L115-I426 HydrophobicContact CD2-CB 4.34Å; L115-I426 HydrophobicContact CD2-CD1 4.07Å; L115-I426 HydrophobicContact CD2-CG2 4.43Å; L115-I426 HydrophobicContact CG-CD1 4.23Å; L115-I426 PolarHBondContact O-N 3.39Å; A117-I426 HydrophobicContact CB-CD1 4.38Å; I121-I426 HydrophobicContact CD1-CD1 4.2Å; I127-I426 HydrophobicContact CD1-CD1 4.27Å; I127-I426 HydrophobicContact CD1-CG2 3.95Å; I127-I426 HydrophobicContact CG2-CD1 4.07Å; A401-I426 HydrophobicContact CB-CG2 3.71Å; I420-I426 HydrophobicContact CD1-CG1 4.23Å; I420-I426 HydrophobicContact CG2-CG1 4.34Å
427	C	97.9	Very high	92.6	Very high	17 Å²	17	50 Å²	50	12%	0.115	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	132.7	-178	-66.3	0	0	0	0	110	N394 P399 N400 A401	N394-C427 CarbonylContact O-C 3.57Å; N394-C427 WeakPolarHBondContact O-CA 3.26Å; N394-C427 WeakPolarHBondContact O-CB 3.42Å; P399-C427 WeakPolarHBondContact CA-O 3.32Å; P399-C427 WeakPolarHBondContact CB-O 3.27Å; N400-C427 PolarHBondContact N-O 2.91Å; N400-C427 VanDerWaalsContact N-O 3.14Å; N400-C427 PolarHBondContact OD1-N 3.38Å; N400-C427 PolarHBondContact OD1-O 3.08Å; A401-C427 PolarHBondContact N-O 2.84Å; A401-C427 VanDerWaalsContact N-O 3.17Å
428	I	96.7	Very high	92.1	Very high	1 Å²	1	50 Å²	50	1%	0.005	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	166.8	171.6	63	172.2	0	0	0	109.5	Q390 C393 N394 H395 S396 A401 T403 Y430	Q390-I428 HydrophobicContact CG-CD1 4.49Å; C393-I428 HydrophobicContact CB-CD1 4.07Å; C393-I428 HydrophobicContact CB-CG1 3.93Å; C393-I428 HydrophobicContact CB-CG2 4.09Å; N394-I428 PolarHBondContact O-N 3.42Å; H395-I428 CarbonylContact C-O 3.52Å; H395-I428 VanDerWaalsContact CA-O 3.27Å; H395-I428 WeakPolarHBondContact CA-O 3.28Å; S396-I428 PolarHBondContact N-O 2.95Å; A401-I428 HydrophobicContact CB-CG2 4.23Å; A401-I428 WeakPolarHBondContact O-CA 3.22Å; T403-I428 HydrophobicContact CG2-CD1 3.93Å; T403-I428 HydrophobicContact CG2-CG2 4.21Å; I428-Y430 HydrophobicContact CD1-CD1 4.29Å; I428-Y430 HydrophobicContact CD1-CE1 3.98Å; I428-Y430 HydrophobicContact CG1-CD1 4.07Å; I428-Y430 HydrophobicContact CG1-CE1 3.81Å
429	S	94.1	Very high	91.8	Very high	17 Å²	17	46.8 Å²	46.8	12%	0.119	25%	0.251	C	S	.	.			trans	-87.6	142	168.1	-174.5	0	0	0	0	110.6	L431 R436	S429-L431 WeakPolarHBondContact CB-O 3.35Å; S429-L431 PolarHBondContact OG-N 3.49Å; S429-L431 PolarHBondContact OG-O 3.4Å; S429-R436 VanDerWaalsContact OG-CD 3.31Å; S429-R436 WeakPolarHBondContact OG-CD 3.39Å; S429-R436 WeakPolarHBondContact OG-CG 3.19Å
430	Y	91.1	Very high	91.6	Very high	36 Å²	36	45.3 Å²	45.3	14%	0.141	24%	0.239	C	C	.	.	S	Bend	trans	-96.2	-14.4	169.7	-67	-0.3	0	0	0	111.3	R39 C393 H395 I428 Y451 F453	R39-Y430 PolarHBondContact NH2-O 2.79Å; C393-Y430 PolarHBondContact O-OH 3.07Å; H395-Y430 HydrophobicContact CB-CD1 4.11Å; H395-Y430 HydrophobicContact CB-CD2 3.74Å; H395-Y430 HydrophobicContact CB-CE1 4.21Å; H395-Y430 HydrophobicContact CB-CE2 3.87Å; H395-Y430 HydrophobicContact CB-CG 3.86Å; H395-Y430 PolarHBondContact CE1-N 3.42Å; H395-Y430 AromaticContact ND1-CG 3.73Å; H395-Y430 PolarHBondContact ND1-N 3.2Å; I428-Y430 HydrophobicContact CD1-CD1 4.29Å; I428-Y430 HydrophobicContact CD1-CE1 3.98Å; I428-Y430 HydrophobicContact CG1-CD1 4.07Å; I428-Y430 HydrophobicContact CG1-CE1 3.81Å; Y430-Y451 AromaticContact CD2-CD1 3.63Å; Y430-Y451 HydrophobicContact CD2-CD1 3.63Å; Y430-Y451 HydrophobicContact CD2-CD2 4Å; Y430-Y451 AromaticContact CD2-CE1 3.76Å; Y430-Y451 HydrophobicContact CD2-CE1 3.76Å; Y430-Y451 HydrophobicContact CD2-CE2 4.1Å; Y430-Y451 AromaticContact CD2-CG 3.76Å; Y430-Y451 HydrophobicContact CD2-CG 3.76Å; Y430-Y451 AromaticContact CD2-CZ 3.99Å; Y430-Y451 AromaticContact CE2-CD1 4Å; Y430-Y451 HydrophobicContact CE2-CD1 4Å; Y430-Y451 HydrophobicContact CE2-CE1 4.32Å; Y430-Y451 HydrophobicContact CE2-CG 4.37Å; Y430-Y451 HydrophobicContact CG-CE1 4.26Å; Y430-Y451 HydrophobicContact CG-CE2 4.34Å; Y430-F453 HydrophobicContact CD2-CE1 4.05Å; Y430-F453 HydrophobicContact CD2-CZ 4.41Å; Y430-F453 HydrophobicContact CE2-CE1 4.17Å
431	L	87	Confident	91.2	Very high	6 Å²	6	47.7 Å²	47.7	3%	0.031	25%	0.25	C	C	.	.	S	Bend	trans	-96.6	149.8	176.7	-56.3	177.2	0	0	0	109.3	S429 Q435 R436 R443 I446 L447	S429-L431 WeakPolarHBondContact CB-O 3.35Å; S429-L431 PolarHBondContact OG-N 3.49Å; S429-L431 PolarHBondContact OG-O 3.4Å; L431-Q435 HydrophobicContact CB-CB 3.87Å; L431-Q435 HydrophobicContact CD2-CB 4.46Å; L431-R436 HydrophobicContact CB-CG 3.94Å; L431-R443 HydrophobicContact CD1-CB 3.87Å; L431-R443 HydrophobicContact CD1-CG 3.83Å; L431-I446 HydrophobicContact CD2-CB 4.02Å; L431-I446 HydrophobicContact CD2-CG2 3.45Å; L431-I446 VanDerWaalsContact CD2-CG2 3.45Å; L431-L447 HydrophobicContact CD1-CD1 4.31Å; L431-L447 HydrophobicContact CD1-CG 4.3Å; L431-L447 HydrophobicContact CD2-CD2 3.88Å; L431-L447 HydrophobicContact CD2-CG 4.08Å; L431-L447 HydrophobicContact CG-CD2 4.05Å; L431-L447 HydrophobicContact CG-CG 4.32Å
432	D	81.4	Confident	90.8	Very high	22 Å²	22	41.7 Å²	41.7	12%	0.118	22%	0.224	C	C	.	.			trans	-71.2	178.5	170	63	60.4	0	0	0	112.4	F38 C434 Q435 R436	F38-D432 HydrophobicContact CB-CB 4.09Å; D432-C434 WeakPolarHBondContact OD1-CA 3.46Å; D432-C434 WeakPolarHBondContact OD1-CB 3.5Å; D432-C434 PolarHBondContact OD1-N 2.94Å; D432-Q435 WeakPolarHBondContact OD1-CB 3.14Å; D432-Q435 WeakPolarHBondContact OD1-CG 3.16Å; D432-Q435 PolarHBondContact OD1-N 3.43Å; D432-Q435 VanDerWaalsContact OD2-CG 3.28Å; D432-Q435 WeakPolarHBondContact OD2-CG 3.35Å; D432-Q435 PolarHBondContact OD2-NE2 3.36Å; D432-Q435 PolarHBondContact OD2-OE1 3.02Å; D432-R436 WeakPolarHBondContact O-CB 3.44Å; D432-R436 VanDerWaalsContact O-CG 3.25Å; D432-R436 WeakPolarHBondContact O-CG 3.15Å; D432-R436 PolarHBondContact O-N 2.85Å
433	C	77.2	Confident	90.5	Very high	54 Å²	54	38 Å²	38	37%	0.365	20%	0.2	S	C	.	.	H	α-helix	trans	-62.7	-42.4	-178.2	56.1	0	0	0	0	112.8	R436 E437	C433-R436 PolarHBondContact O-N 2.82Å; C433-E437 PolarHBondContact O-N 3.46Å
434	C	81.4	Confident	90.2	Very high	84 Å²	84	36.4 Å²	36.4	57%	0.568	18%	0.183	S	C	*	.	H	α-helix	trans	-66.6	-49.4	179.8	-59.6	0	0	0	0	110.5	D432 R436 E437 R438	D432-C434 WeakPolarHBondContact OD1-CA 3.46Å; D432-C434 WeakPolarHBondContact OD1-CB 3.5Å; D432-C434 PolarHBondContact OD1-N 2.94Å; C434-R436 VanDerWaalsContact C-N 3.27Å; C434-R436 PolarHBondContact O-N 3.05Å; C434-E437 PolarHBondContact O-N 2.77Å; C434-R438 PolarHBondContact O-N 3.39Å
435	Q	84.3	Confident	89.8	Confident	15 Å²	15	35.4 Å²	35.4	7%	0.07	18%	0.177	C	C	.	.	H	α-helix	trans	-59.5	-35.5	177.1	-71.3	174.2	-6	0	0	112.6	L431 D432 E437 R438 R443 I446	L431-Q435 HydrophobicContact CB-CB 3.87Å; L431-Q435 HydrophobicContact CD2-CB 4.46Å; D432-Q435 WeakPolarHBondContact OD1-CB 3.14Å; D432-Q435 WeakPolarHBondContact OD1-CG 3.16Å; D432-Q435 PolarHBondContact OD1-N 3.43Å; D432-Q435 VanDerWaalsContact OD2-CG 3.28Å; D432-Q435 WeakPolarHBondContact OD2-CG 3.35Å; D432-Q435 PolarHBondContact OD2-NE2 3.36Å; D432-Q435 PolarHBondContact OD2-OE1 3.02Å; Q435-E437 PolarHBondContact O-N 2.86Å; Q435-R438 WeakPolarHBondContact O-CB 3.31Å; Q435-R438 PolarHBondContact O-N 3.23Å; Q435-R443 WeakPolarHBondContact O-CD 3.37Å; Q435-R443 WeakPolarHBondContact O-CG 3.27Å; Q435-I446 HydrophobicContact CB-CD1 4.37Å; Q435-I446 HydrophobicContact CG-CD1 3.96Å
436	R	87.3	Confident	89.2	Confident	65 Å²	65	34.3 Å²	34.3	25%	0.245	17%	0.173	C	C	.	.	H	α-helix	trans	-64.2	-28.5	176.7	-83	-169.3	-62.2	119.9	-1.9	113.2	S429 L431 D432 C433 C434 R443 K459	S429-R436 VanDerWaalsContact OG-CD 3.31Å; S429-R436 WeakPolarHBondContact OG-CD 3.39Å; S429-R436 WeakPolarHBondContact OG-CG 3.19Å; L431-R436 HydrophobicContact CB-CG 3.94Å; D432-R436 WeakPolarHBondContact O-CB 3.44Å; D432-R436 VanDerWaalsContact O-CG 3.25Å; D432-R436 WeakPolarHBondContact O-CG 3.15Å; D432-R436 PolarHBondContact O-N 2.85Å; C433-R436 PolarHBondContact O-N 2.82Å; C434-R436 VanDerWaalsContact C-N 3.27Å; C434-R436 PolarHBondContact O-N 3.05Å; R436-R443 VanDerWaalsContact O-CD 3.3Å; R436-R443 WeakPolarHBondContact O-CD 3.44Å; R436-K459 PolarHBondContact O-NZ 2.9Å
437	E	87.3	Confident	88.7	Confident	132 Å²	132	34.3 Å²	34.3	62%	0.617	17%	0.173	S	C	*	.	H	α-helix	trans	-88.5	-12.6	179.2	-58.3	-47.4	148.7	0	0	113.6	C433 C434 Q435 K459	C433-E437 PolarHBondContact O-N 3.46Å; C434-E437 PolarHBondContact O-N 2.77Å; Q435-E437 PolarHBondContact O-N 2.86Å; E437-K459 IonicContact OE2-NZ 2.65Å; E437-K459 PolarHBondContact OE2-NZ 3.38Å
438	R	88.1	Confident	88.1	Confident	63 Å²	63	38.2 Å²	38.2	24%	0.238	19%	0.185	C	C	.	.	S	Bend	trans	-62.2	167.3	171.6	-64.7	-165.6	178.4	179.1	0.8	112.9	C434 Q435 R443 E474 E477	C434-R438 PolarHBondContact O-N 3.39Å; Q435-R438 WeakPolarHBondContact O-CB 3.31Å; Q435-R438 PolarHBondContact O-N 3.23Å; R438-R443 PolarHBondContact O-NH1 2.83Å; R438-E474 VanDerWaalsContact CB-OE1 3.31Å; R438-E474 WeakPolarHBondContact CB-OE1 3.4Å; R438-E474 VanDerWaalsContact CD-OE1 3.3Å; R438-E474 WeakPolarHBondContact CD-OE1 3.14Å; R438-E474 WeakPolarHBondContact CG-OE1 3.45Å; R438-E474 IonicContact NE-OE1 3.63Å; R438-E477 IonicContact CZ-OE2 2.78Å; R438-E477 IonicContact NH1-OE2 3.69Å; R438-E477 PolarHBondContact NH1-OE2 3.2Å; R438-E477 IonicContact NH2-OE1 3.21Å; R438-E477 IonicContact NH2-OE2 2.79Å; R438-E477 PolarHBondContact NH2-OE2 3.34Å
439	S	90.7	Very high	87.3	Confident	32 Å²	32	41.4 Å²	41.4	22%	0.224	20%	0.2	C	C	.	.			trans	-55.9	156.9	179.8	84	0	0	0	0	113.1	H441 S442 R443	S439-H441 PolarHBondContact O-N 2.9Å; S439-H441 PolarHBondContact OG-N 3.22Å; S439-S442 PolarHBondContact O-N 3.03Å; S439-S442 PolarHBondContact OG-N 3.17Å; S439-S442 VanDerWaalsContact OG-N 3.11Å; S439-S442 PolarHBondContact OG-OG 3.19Å; S439-R443 WeakPolarHBondContact O-CG 3.17Å; S439-R443 PolarHBondContact O-N 3.1Å
440	R	92.9	Very high	86.6	Confident	57 Å²	57	41.5 Å²	41.5	22%	0.215	20%	0.199	C	C	.	.	H	α-helix	trans	-52.8	-38.8	171.9	-177.9	179.2	176.8	-98.1	3.7	112.1	H444 C460 E463	R440-H444 PolarHBondContact NE-CE1 2.87Å; R440-H444 VanDerWaalsContact O-CB 3.31Å; R440-H444 WeakPolarHBondContact O-CB 3.14Å; R440-H444 PolarHBondContact O-N 3.27Å; R440-C460 WeakPolarHBondContact CD-O 3.5Å; R440-C460 PolarHBondContact NE-O 3.28Å; R440-E463 HydrophobicContact CB-CB 4.03Å; R440-E463 WeakPolarHBondContact CB-OE2 3.5Å; R440-E463 WeakPolarHBondContact CD-O 3.36Å; R440-E463 HydrophobicContact CG-CB 4.49Å
441	H	90.1	Very high	86.1	Confident	50 Å²	50	40.9 Å²	40.9	23%	0.231	20%	0.197	C	C	.	.	H	α-helix	trans	-62.3	-54.4	-179.7	-179.6	82.2	0	0	0	110.8	S439 R443 H444 K445 N468	S439-H441 PolarHBondContact O-N 2.9Å; S439-H441 PolarHBondContact OG-N 3.22Å; H441-R443 PolarHBondContact O-N 3.21Å; H441-H444 CarbonylContact O-C 3.59Å; H441-H444 PolarHBondContact O-N 3.01Å; H441-H444 VanDerWaalsContact O-N 3.12Å; H441-K445 PolarHBondContact O-N 2.79Å; H441-N468 HydrophobicContact CB-CB 4.38Å
442	S	89.3	Confident	85.9	Confident	3 Å²	3	42.3 Å²	42.3	2%	0.021	20%	0.204	C	C	.	.	H	α-helix	trans	-62.8	-43.4	-177.5	-42.3	0	0	0	0	110.9	S439 H444 K445 I446 E474	S439-S442 PolarHBondContact O-N 3.03Å; S439-S442 PolarHBondContact OG-N 3.17Å; S439-S442 VanDerWaalsContact OG-N 3.11Å; S439-S442 PolarHBondContact OG-OG 3.19Å; S442-H444 VanDerWaalsContact C-N 3.35Å; S442-H444 PolarHBondContact O-N 3.34Å; S442-K445 WeakPolarHBondContact O-CB 3.35Å; S442-K445 PolarHBondContact O-N 3.33Å; S442-I446 WeakPolarHBondContact O-CG1 3.33Å; S442-I446 PolarHBondContact O-N 2.78Å; S442-E474 PolarHBondContact OG-OE2 3.46Å
443	R	92.9	Very high	86.2	Confident	1 Å²	1	44.1 Å²	44.1	0%	0.004	21%	0.211	C	C	.	.	H	α-helix	trans	-59.4	-44	173.3	-65.2	-168.4	-37.7	-97.6	-1	112.2	C397 L431 Q435 R436 R438 S439 H441 L447 C460 E463	C397-R443 PolarHBondContact SG-NE 3.42Å; C397-R443 VanDerWaalsContact SG-NE 3.43Å; L431-R443 HydrophobicContact CD1-CB 3.87Å; L431-R443 HydrophobicContact CD1-CG 3.83Å; Q435-R443 WeakPolarHBondContact O-CD 3.37Å; Q435-R443 WeakPolarHBondContact O-CG 3.27Å; R436-R443 VanDerWaalsContact O-CD 3.3Å; R436-R443 WeakPolarHBondContact O-CD 3.44Å; R438-R443 PolarHBondContact O-NH1 2.83Å; S439-R443 WeakPolarHBondContact O-CG 3.17Å; S439-R443 PolarHBondContact O-N 3.1Å; H441-R443 PolarHBondContact O-N 3.21Å; R443-L447 WeakPolarHBondContact O-CB 3.38Å; R443-L447 WeakPolarHBondContact O-CG 3.16Å; R443-L447 PolarHBondContact O-N 3.11Å; R443-C460 PolarHBondContact NH2-SG 3.37Å; R443-E463 IonicContact CZ-OE2 2.79Å; R443-E463 IonicContact NH1-OE1 3.33Å; R443-E463 IonicContact NH1-OE2 3.22Å; R443-E463 PolarHBondContact NH1-OE2 3.35Å; R443-E463 IonicContact NH2-OE1 3.73Å; R443-E463 IonicContact NH2-OE2 3.86Å; R443-E463 PolarHBondContact NH2-OE2 3.42Å
444	H	91.4	Very high	86.8	Confident	1 Å²	1	45.3 Å²	45.3	1%	0.005	22%	0.216	C	C	.	.	H	α-helix	trans	-68.7	-36.4	177.5	-75.1	178.4	0	0	0	113	R440 H441 S442 L447 R448 C455 C460	R440-H444 PolarHBondContact NE-CE1 2.87Å; R440-H444 VanDerWaalsContact O-CB 3.31Å; R440-H444 WeakPolarHBondContact O-CB 3.14Å; R440-H444 PolarHBondContact O-N 3.27Å; H441-H444 CarbonylContact O-C 3.59Å; H441-H444 PolarHBondContact O-N 3.01Å; H441-H444 VanDerWaalsContact O-N 3.12Å; S442-H444 VanDerWaalsContact C-N 3.35Å; S442-H444 PolarHBondContact O-N 3.34Å; H444-L447 PolarHBondContact O-N 3.1Å; H444-R448 VanDerWaalsContact O-CB 3.27Å; H444-R448 WeakPolarHBondContact O-CB 3.39Å; H444-R448 WeakPolarHBondContact O-CG 3.41Å; H444-R448 PolarHBondContact O-N 3.34Å; H444-C455 PolarHBondContact NE2-O 3.35Å; H444-C455 VanDerWaalsContact NE2-O 3.08Å; H444-C460 PolarHBondContact NE2-SG 3.34Å
445	K	87.8	Confident	87.4	Confident	49 Å²	49	41.6 Å²	41.6	21%	0.213	19%	0.192	C	C	.	.	H	α-helix	trans	-57.2	-55.4	174	-176.9	178.9	175.6	-170.1	0	109.5	H441 S442 L447 R448 E449 E478	H441-K445 PolarHBondContact O-N 2.79Å; S442-K445 WeakPolarHBondContact O-CB 3.35Å; S442-K445 PolarHBondContact O-N 3.33Å; K445-L447 PolarHBondContact O-N 3.16Å; K445-R448 PolarHBondContact O-N 3.11Å; K445-E449 WeakPolarHBondContact CE-OE1 3.37Å; K445-E449 WeakPolarHBondContact CG-OE1 3.27Å; K445-E449 WeakPolarHBondContact O-CG 3.08Å; K445-E449 PolarHBondContact O-N 3.22Å; K445-E478 IonicContact NZ-OE1 3.54Å; K445-E478 PolarHBondContact NZ-OE1 3.5Å; K445-E478 IonicContact NZ-OE2 3.46Å; K445-E478 PolarHBondContact NZ-OE2 3.16Å
446	I	85.8	Confident	87.8	Confident	16 Å²	16	44.1 Å²	44.1	8%	0.082	21%	0.211	C	C	.	.	H	α-helix	trans	-58.3	-45.3	178.9	-61.6	164.8	0	0	0	112.1	T34 L431 Q435 S442 N450	T34-I446 HydrophobicContact CG2-CG1 4.23Å; T34-I446 HydrophobicContact CG2-CG2 3.92Å; L431-I446 HydrophobicContact CD2-CB 4.02Å; L431-I446 HydrophobicContact CD2-CG2 3.45Å; L431-I446 VanDerWaalsContact CD2-CG2 3.45Å; Q435-I446 HydrophobicContact CB-CD1 4.37Å; Q435-I446 HydrophobicContact CG-CD1 3.96Å; S442-I446 WeakPolarHBondContact O-CG1 3.33Å; S442-I446 PolarHBondContact O-N 2.78Å; I446-N450 WeakPolarHBondContact CG2-ND2 3.29Å; I446-N450 WeakPolarHBondContact O-CB 3.42Å; I446-N450 PolarHBondContact O-N 3.06Å; I446-N450 PolarHBondContact O-ND2 2.81Å
447	L	88.4	Confident	88.2	Confident	0 Å²	0	41.6 Å²	41.6	0%	0	20%	0.203	C	C	.	.	H	α-helix	trans	-70.2	-36.3	-179.1	-70.1	172.8	0	0	0	113	H395 L431 R443 H444 K445 Y451 L452 F453 C455	H395-L447 WeakPolarHBondContact NE2-CD1 3.29Å; L431-L447 HydrophobicContact CD1-CD1 4.31Å; L431-L447 HydrophobicContact CD1-CG 4.3Å; L431-L447 HydrophobicContact CD2-CD2 3.88Å; L431-L447 HydrophobicContact CD2-CG 4.08Å; L431-L447 HydrophobicContact CG-CD2 4.05Å; L431-L447 HydrophobicContact CG-CG 4.32Å; R443-L447 WeakPolarHBondContact O-CB 3.38Å; R443-L447 WeakPolarHBondContact O-CG 3.16Å; R443-L447 PolarHBondContact O-N 3.11Å; H444-L447 PolarHBondContact O-N 3.1Å; K445-L447 PolarHBondContact O-N 3.16Å; L447-Y451 HydrophobicContact CD2-CD2 3.87Å; L447-Y451 HydrophobicContact CD2-CE2 4.39Å; L447-Y451 CarbonylContact O-C 3.58Å; L447-Y451 VanDerWaalsContact O-C 3.32Å; L447-Y451 VanDerWaalsContact O-CA 3.27Å; L447-Y451 WeakPolarHBondContact O-CA 3.4Å; L447-Y451 WeakPolarHBondContact O-CB 3.16Å; L447-Y451 PolarHBondContact O-N 3.26Å; L447-L452 PolarHBondContact O-N 3.04Å; L447-F453 CarbonylContact C-O 3.59Å; L447-F453 HydrophobicContact CB-CE1 4.33Å; L447-F453 HydrophobicContact CB-CZ 4.19Å; L447-F453 HydrophobicContact CD1-CE2 4.24Å; L447-F453 HydrophobicContact CD1-CZ 3.97Å; L447-F453 HydrophobicContact CD2-CE1 3.99Å; L447-F453 HydrophobicContact CD2-CZ 3.73Å; L447-F453 HydrophobicContact CG-CZ 4.18Å; L447-C455 HydrophobicContact CD1-CB 3.72Å
448	R	85.4	Confident	88.6	Confident	98 Å²	98	39.9 Å²	39.9	37%	0.37	20%	0.203	S	C	.	.	H	α-helix	trans	-65.5	-52.4	173.5	-74.8	-176.3	-142.9	110.7	-6.1	109.5	H444 K445 N450 L452 V454	H444-R448 VanDerWaalsContact O-CB 3.27Å; H444-R448 WeakPolarHBondContact O-CB 3.39Å; H444-R448 WeakPolarHBondContact O-CG 3.41Å; H444-R448 PolarHBondContact O-N 3.34Å; K445-R448 PolarHBondContact O-N 3.11Å; R448-N450 PolarHBondContact O-N 2.91Å; R448-L452 WeakPolarHBondContact O-CA 3.42Å; R448-L452 WeakPolarHBondContact O-CD2 3.42Å; R448-L452 PolarHBondContact O-N 2.6Å; R448-V454 HydrophobicContact CG-CG2 3.92Å
449	E	80.4	Confident	88.9	Confident	68 Å²	68	38.6 Å²	38.6	32%	0.318	20%	0.199	S	C	.	.	H	α-helix	trans	-60.5	-45.4	-176.4	-71.7	176	-159.1	0	0	113.2	K286 K445	K286-E449 IonicContact NZ-OE2 3.66Å; K286-E449 PolarHBondContact NZ-OE2 3.18Å; K445-E449 WeakPolarHBondContact CE-OE1 3.37Å; K445-E449 WeakPolarHBondContact CG-OE1 3.27Å; K445-E449 WeakPolarHBondContact O-CG 3.08Å; K445-E449 PolarHBondContact O-N 3.22Å
450	N	77.9	Confident	89.1	Confident	20 Å²	20	37.1 Å²	37.1	11%	0.107	19%	0.189	C	C	.	.	H	α-helix	trans	-92.4	-31.6	-172.2	-61.7	-58.8	0	0	0	113.2	A35 I446 R448	A35-N450 HydrophobicContact CB-CB 4.08Å; I446-N450 WeakPolarHBondContact CG2-ND2 3.29Å; I446-N450 WeakPolarHBondContact O-CB 3.42Å; I446-N450 PolarHBondContact O-N 3.06Å; I446-N450 PolarHBondContact O-ND2 2.81Å; R448-N450 PolarHBondContact O-N 2.91Å
451	Y	80.6	Confident	89.1	Confident	22 Å²	22	39.6 Å²	39.6	9%	0.086	21%	0.206	C	C	.	.	H	α-helix	trans	-122.5	-3.1	-171.6	-58	-80.3	0	0	0	113.7	R39 K275 Y430 L447 F453	R39-Y451 PolarHBondContact NH2-OH 2.87Å; R39-Y451 VanDerWaalsContact NH2-OH 3.09Å; K275-Y451 WeakPolarHBondContact CE-O 3.36Å; K275-Y451 PolarHBondContact NZ-O 3.27Å; Y430-Y451 AromaticContact CD2-CD1 3.63Å; Y430-Y451 HydrophobicContact CD2-CD1 3.63Å; Y430-Y451 HydrophobicContact CD2-CD2 4Å; Y430-Y451 AromaticContact CD2-CE1 3.76Å; Y430-Y451 HydrophobicContact CD2-CE1 3.76Å; Y430-Y451 HydrophobicContact CD2-CE2 4.1Å; Y430-Y451 AromaticContact CD2-CG 3.76Å; Y430-Y451 HydrophobicContact CD2-CG 3.76Å; Y430-Y451 AromaticContact CD2-CZ 3.99Å; Y430-Y451 AromaticContact CE2-CD1 4Å; Y430-Y451 HydrophobicContact CE2-CD1 4Å; Y430-Y451 HydrophobicContact CE2-CE1 4.32Å; Y430-Y451 HydrophobicContact CE2-CG 4.37Å; Y430-Y451 HydrophobicContact CG-CE1 4.26Å; Y430-Y451 HydrophobicContact CG-CE2 4.34Å; L447-Y451 HydrophobicContact CD2-CD2 3.87Å; L447-Y451 HydrophobicContact CD2-CE2 4.39Å; L447-Y451 CarbonylContact O-C 3.58Å; L447-Y451 VanDerWaalsContact O-C 3.32Å; L447-Y451 VanDerWaalsContact O-CA 3.27Å; L447-Y451 WeakPolarHBondContact O-CA 3.4Å; L447-Y451 WeakPolarHBondContact O-CB 3.16Å; L447-Y451 PolarHBondContact O-N 3.26Å; Y451-F453 VanDerWaalsContact C-N 3.26Å; Y451-F453 VanDerWaalsContact CB-CD1 3.49Å; Y451-F453 HydrophobicContact CG-CE1 4.16Å; Y451-F453 PolarHBondContact O-N 3.08Å
452	L	84	Confident	89.3	Confident	36 Å²	36	41.2 Å²	41.2	19%	0.188	23%	0.228	C	C	.	.			trans	52.1	41.4	173.9	-52.1	171	0	0	0	113.4	K275 E279 E282 I283 L447 R448	K275-L452 HydrophobicContact CD-CB 4.16Å; K275-L452 HydrophobicContact CD-CD1 3.54Å; K275-L452 HydrophobicContact CD-CG 4.3Å; K275-L452 VanDerWaalsContact NZ-CG 3.3Å; E279-L452 HydrophobicContact CB-CD1 3.39Å; E279-L452 HydrophobicContact CG-CD1 3.83Å; E279-L452 VanDerWaalsContact O-CD1 3.29Å; E279-L452 WeakPolarHBondContact O-CD1 3.28Å; E282-L452 HydrophobicContact CB-CD2 4.34Å; E282-L452 VanDerWaalsContact OE2-CD2 3.29Å; E282-L452 WeakPolarHBondContact OE2-CD2 3.41Å; I283-L452 HydrophobicContact CD1-CD1 3.66Å; I283-L452 HydrophobicContact CG1-CD1 3.71Å; I283-L452 HydrophobicContact CG1-CG 4.4Å; L447-L452 PolarHBondContact O-N 3.04Å; R448-L452 WeakPolarHBondContact O-CA 3.42Å; R448-L452 WeakPolarHBondContact O-CD2 3.42Å; R448-L452 PolarHBondContact O-N 2.6Å
453	F	87.1	Confident	89.4	Confident	60 Å²	60	42.4 Å²	42.4	26%	0.263	23%	0.233	S	C	.	.			trans	-141.5	162.6	170.3	78.7	-85.2	0	0	0	111.1	H395 Y430 L447 Y451 C455	H395-F453 HydrophobicContact CB-CE1 4.32Å; H395-F453 HydrophobicContact CB-CE2 4.16Å; H395-F453 HydrophobicContact CB-CZ 3.48Å; H395-F453 VanDerWaalsContact CB-CZ 3.48Å; H395-F453 AromaticContact CD2-CZ 3.79Å; H395-F453 AromaticContact CG-CZ 3.75Å; Y430-F453 HydrophobicContact CD2-CE1 4.05Å; Y430-F453 HydrophobicContact CD2-CZ 4.41Å; Y430-F453 HydrophobicContact CE2-CE1 4.17Å; L447-F453 CarbonylContact C-O 3.59Å; L447-F453 HydrophobicContact CB-CE1 4.33Å; L447-F453 HydrophobicContact CB-CZ 4.19Å; L447-F453 HydrophobicContact CD1-CE2 4.24Å; L447-F453 HydrophobicContact CD1-CZ 3.97Å; L447-F453 HydrophobicContact CD2-CE1 3.99Å; L447-F453 HydrophobicContact CD2-CZ 3.73Å; L447-F453 HydrophobicContact CG-CZ 4.18Å; Y451-F453 VanDerWaalsContact C-N 3.26Å; Y451-F453 VanDerWaalsContact CB-CD1 3.49Å; Y451-F453 HydrophobicContact CG-CE1 4.16Å; Y451-F453 PolarHBondContact O-N 3.08Å; F453-C455 HydrophobicContact CE2-CB 4.06Å
454	V	89.6	Confident	89.2	Confident	79 Å²	79	44.5 Å²	44.5	48%	0.479	25%	0.25	S	S	.	.			trans	-106.4	125.5	172.4	-176.1	0	0	0	0	108.9	R448	R448-V454 HydrophobicContact CG-CG2 3.92Å
455	C	93.7	Very high	89.1	Confident	7 Å²	7	52.4 Å²	52.4	5%	0.047	29%	0.293	C	S	.	.			trans	-70.2	138.3	179.4	-169.3	0	0	0	0	111.4	H444 L447 F453 C457	H444-C455 PolarHBondContact NE2-O 3.35Å; H444-C455 VanDerWaalsContact NE2-O 3.08Å; L447-C455 HydrophobicContact CD1-CB 3.72Å; F453-C455 HydrophobicContact CE2-CB 4.06Å; C455-C457 VanDerWaalsContact SG-CB 3.55Å; C455-C457 PolarHBondContact SG-N 3.22Å; C455-C457 VanDerWaalsContact SG-N 3.42Å
456	S	93.8	Very high	88.9	Confident	68 Å²	68	55 Å²	55	48%	0.476	31%	0.306	S	S	.	.			trans	-127.3	30.6	174.7	53	0	0	0	0	111.5	L461	S456-L461 WeakPolarHBondContact O-CD1 3.47Å
457	C	94.9	Very high	88.5	Confident	12 Å²	12	58.9 Å²	58.9	8%	0.081	33%	0.332	C	S	.	.	S	Bend	trans	-67.9	165.2	175.6	77.5	0	0	0	0	111.4	S396 C455 K459 C460 L461	S396-C457 WeakPolarHBondContact OG-CB 3.48Å; C455-C457 VanDerWaalsContact SG-CB 3.55Å; C455-C457 PolarHBondContact SG-N 3.22Å; C455-C457 VanDerWaalsContact SG-N 3.42Å; C457-K459 VanDerWaalsContact C-N 3.27Å; C457-K459 PolarHBondContact O-N 2.92Å; C457-C460 PolarHBondContact O-N 3.32Å; C457-C460 VanDerWaalsContact O-N 3.1Å; C457-L461 WeakPolarHBondContact O-CG 3.35Å; C457-L461 PolarHBondContact O-N 3.01Å
458	P	95.1	Very high	87.9	Confident	95 Å²	95	64 Å²	64	62%	0.617	36%	0.36	S	S	*	.	H	α-helix	trans	-52.1	-40.6	-179.5	-28.8	36.5	0	0	0	114.2	V398 L461 A462	V398-P458 HydrophobicContact CG2-CB 4.39Å; V398-P458 HydrophobicContact CG2-CG 4.45Å; P458-L461 PolarHBondContact O-N 3.2Å; P458-A462 WeakPolarHBondContact O-CB 3.32Å; P458-A462 PolarHBondContact O-N 2.72Å
459	K	94.9	Very high	87.2	Confident	37 Å²	37	63.6 Å²	63.6	16%	0.161	37%	0.368	C	S	.	.	H	α-helix	trans	-61	-51.7	176	-173.3	174.5	-175.9	177.9	0	111.6	C397 V398 R436 E437 C457 L461 A462 E463	C397-K459 HydrophobicContact CB-CB 4.36Å; C397-K459 HydrophobicContact CB-CD 4.17Å; V398-K459 HydrophobicContact CG1-CB 3.91Å; V398-K459 HydrophobicContact CG1-CD 4.16Å; V398-K459 HydrophobicContact CG2-CB 4.25Å; R436-K459 PolarHBondContact O-NZ 2.9Å; E437-K459 IonicContact OE2-NZ 2.65Å; E437-K459 PolarHBondContact OE2-NZ 3.38Å; C457-K459 VanDerWaalsContact C-N 3.27Å; C457-K459 PolarHBondContact O-N 2.92Å; K459-L461 VanDerWaalsContact C-N 3.25Å; K459-L461 PolarHBondContact O-N 3.12Å; K459-A462 PolarHBondContact O-N 3.1Å; K459-E463 WeakPolarHBondContact CE-OE1 3.22Å; K459-E463 WeakPolarHBondContact CG-OE1 3.29Å; K459-E463 WeakPolarHBondContact O-CG 3.29Å; K459-E463 PolarHBondContact O-N 3.25Å; K459-E463 VanDerWaalsContact O-N 3.08Å
460	C	94.4	Very high	86.4	Confident	1 Å²	1	61.4 Å²	61.4	1%	0.007	36%	0.359	C	S	.	.	H	α-helix	trans	-65.2	-25.1	178.4	-69.7	0	0	0	0	114.3	R440 R443 H444 C457	R440-C460 WeakPolarHBondContact CD-O 3.5Å; R440-C460 PolarHBondContact NE-O 3.28Å; R443-C460 PolarHBondContact NH2-SG 3.37Å; H444-C460 PolarHBondContact NE2-SG 3.34Å; C457-C460 PolarHBondContact O-N 3.32Å; C457-C460 VanDerWaalsContact O-N 3.1Å
461	L	94.3	Very high	85.7	Confident	109 Å²	109	63 Å²	63	57%	0.571	37%	0.372	S	S	*	.	H	α-helix	trans	-80.3	-36.8	175.1	-70.2	174.7	0	0	0	111.8	S456 C457 P458 K459 E463 A464	S456-L461 WeakPolarHBondContact O-CD1 3.47Å; C457-L461 WeakPolarHBondContact O-CG 3.35Å; C457-L461 PolarHBondContact O-N 3.01Å; P458-L461 PolarHBondContact O-N 3.2Å; K459-L461 VanDerWaalsContact C-N 3.25Å; K459-L461 PolarHBondContact O-N 3.12Å; L461-E463 VanDerWaalsContact C-N 3.32Å; L461-A464 VanDerWaalsContact O-CB 3.26Å; L461-A464 WeakPolarHBondContact O-CB 3.36Å; L461-A464 PolarHBondContact O-N 2.72Å
462	A	93.8	Very high	84.5	Confident	84 Å²	84	69.5 Å²	69.5	69%	0.694	40%	0.403	S	S	*	.	H	α-helix	trans	-65.7	-37	175.4	0	0	0	0	0	112	P458 K459 A464	P458-A462 WeakPolarHBondContact O-CB 3.32Å; P458-A462 PolarHBondContact O-N 2.72Å; K459-A462 PolarHBondContact O-N 3.1Å; A462-A464 VanDerWaalsContact C-N 3.27Å; A462-A464 PolarHBondContact O-N 3.47Å
463	E	92.3	Very high	83.1	Confident	28 Å²	28	75.1 Å²	75.1	13%	0.131	43%	0.428	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	14.3	179.4	-62.6	167.9	-168.1	0	0	112.8	R440 R443 K459 L461 D465 E466	R440-E463 HydrophobicContact CB-CB 4.03Å; R440-E463 WeakPolarHBondContact CB-OE2 3.5Å; R440-E463 WeakPolarHBondContact CD-O 3.36Å; R440-E463 HydrophobicContact CG-CB 4.49Å; R443-E463 IonicContact CZ-OE2 2.79Å; R443-E463 IonicContact NH1-OE1 3.33Å; R443-E463 IonicContact NH1-OE2 3.22Å; R443-E463 PolarHBondContact NH1-OE2 3.35Å; R443-E463 IonicContact NH2-OE1 3.73Å; R443-E463 IonicContact NH2-OE2 3.86Å; R443-E463 PolarHBondContact NH2-OE2 3.42Å; K459-E463 WeakPolarHBondContact CE-OE1 3.22Å; K459-E463 WeakPolarHBondContact CG-OE1 3.29Å; K459-E463 WeakPolarHBondContact O-CG 3.29Å; K459-E463 PolarHBondContact O-N 3.25Å; K459-E463 VanDerWaalsContact O-N 3.08Å; L461-E463 VanDerWaalsContact C-N 3.32Å; E463-D465 VanDerWaalsContact C-N 3.28Å; E463-D465 PolarHBondContact O-N 3.49Å; E463-E466 HydrophobicContact CB-CG 4.34Å; E463-E466 PolarHBondContact O-N 3Å
464	A	88.6	Confident	81.7	Confident	44 Å²	44	73.2 Å²	73.2	36%	0.364	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-28.5	-171.4	0	0	0	0	0	114.2	L461 A462	L461-A464 VanDerWaalsContact O-CB 3.26Å; L461-A464 WeakPolarHBondContact O-CB 3.36Å; L461-A464 PolarHBondContact O-N 2.72Å; A462-A464 VanDerWaalsContact C-N 3.27Å; A462-A464 PolarHBondContact O-N 3.47Å
465	D	87.8	Confident	80.2	Confident	167 Å²	167	73.6 Å²	73.6	89%	0.893	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-1.1	-179.3	-63.4	-38	0	0	0	112.9	E463	E463-D465 VanDerWaalsContact C-N 3.28Å; E463-D465 PolarHBondContact O-N 3.49Å
466	E	85.1	Confident	78.1	Confident	104 Å²	104	79.6 Å²	79.6	49%	0.486	44%	0.444	S	S	.	.	S	Bend	trans	-72.1	145.3	176.7	-66.7	-176.7	179.3	0	0	111.1	E463	E463-E466 HydrophobicContact CB-CG 4.34Å; E463-E466 PolarHBondContact O-N 3Å
467	P	76.6	Confident	76.2	Confident	98 Å²	98	81 Å²	81	64%	0.636	44%	0.443	S	S	*	.			trans	-61.1	140.9	177.9	25.6	-32.7	0	0	0	110.7	V469	P467-V469 HydrophobicContact CB-CG1 4.31Å; P467-V469 HydrophobicContact CB-CG2 4.3Å; P467-V469 HydrophobicContact CG-CG2 4.12Å; P467-V469 PolarHBondContact O-N 3.19Å
468	N	75.1	Confident	74.1	Confident	108 Å²	108	82.8 Å²	82.8	58%	0.578	45%	0.45	S	S	*	.			trans	-77.5	72.8	174.4	-68.1	-54.4	0	0	0	109.6	H441	H441-N468 HydrophobicContact CB-CB 4.38Å
469	V	70.8	Confident	71.7	Confident	89 Å²	89	85.5 Å²	85.5	54%	0.539	45%	0.454	S	S	.	.			trans	-120.2	134.6	176.1	-65.5	0	0	0	0	109.4	P467	P467-V469 HydrophobicContact CB-CG1 4.31Å; P467-V469 HydrophobicContact CB-CG2 4.3Å; P467-V469 HydrophobicContact CG-CG2 4.12Å; P467-V469 PolarHBondContact O-N 3.19Å
470	T	65.2	Low	69.3	Low	22 Å²	22	88 Å²	88	14%	0.135	47%	0.467	C	S	.	.			trans	-75.2	143.7	159.7	33.6	0	0	0	0	107.7	E475	T470-E475 VanDerWaalsContact OG1-CG 3.25Å; T470-E475 WeakPolarHBondContact OG1-CG 3.5Å; T470-E475 PolarHBondContact OG1-OE1 3.1Å
471	S	62.1	Low	66.9	Low	53 Å²	53	90.7 Å²	90.7	37%	0.371	48%	0.479	S	S	.	.			trans	-68.6	155.6	170.5	47	0	0	0	0	110	E473 E474 E475	S471-E473 PolarHBondContact O-N 3.22Å; S471-E474 CarbonylContact O-C 3.58Å; S471-E474 WeakPolarHBondContact O-CA 3.23Å; S471-E474 WeakPolarHBondContact O-CB 3.23Å; S471-E474 PolarHBondContact O-N 2.8Å; S471-E474 WeakPolarHBondContact OG-CB 3.36Å; S471-E474 WeakPolarHBondContact OG-CG 3.37Å; S471-E474 PolarHBondContact OG-N 3.33Å; S471-E475 PolarHBondContact O-N 3.27Å
472	E	55.7	Low	64.3	Low	159 Å²	159	93.2 Å²	93.2	74%	0.743	49%	0.488	S	S	*	.	H	α-helix	trans	-53.5	-39.1	175.7	-65	175.2	178.6	0	0	111.4	E474 E475 E476	E472-E474 VanDerWaalsContact C-N 3.3Å; E472-E474 PolarHBondContact O-N 3.26Å; E472-E475 PolarHBondContact O-N 3.41Å; E472-E476 WeakPolarHBondContact O-CG 3.47Å; E472-E476 PolarHBondContact O-N 3.12Å
473	E	55.6	Low	61.4	Low	154 Å²	154	90.9 Å²	90.9	72%	0.72	47%	0.472	S	S	*	.	H	α-helix	trans	-64.1	-30.3	173.5	-62.6	178.2	179.1	0	0	113.5	S471 E477	S471-E473 PolarHBondContact O-N 3.22Å; E473-E477 PolarHBondContact O-N 3.23Å
474	E	56.8	Low	58.7	Low	19 Å²	19	95.8 Å²	95.8	9%	0.089	50%	0.495	C	S	.	.	H	α-helix	trans	-80.3	-31.8	176	-76.5	174.8	-173.1	0	0	111.1	R438 S442 S471 E472 E478	R438-E474 VanDerWaalsContact CB-OE1 3.31Å; R438-E474 WeakPolarHBondContact CB-OE1 3.4Å; R438-E474 VanDerWaalsContact CD-OE1 3.3Å; R438-E474 WeakPolarHBondContact CD-OE1 3.14Å; R438-E474 WeakPolarHBondContact CG-OE1 3.45Å; R438-E474 IonicContact NE-OE1 3.63Å; S442-E474 PolarHBondContact OG-OE2 3.46Å; S471-E474 CarbonylContact O-C 3.58Å; S471-E474 WeakPolarHBondContact O-CA 3.23Å; S471-E474 WeakPolarHBondContact O-CB 3.23Å; S471-E474 PolarHBondContact O-N 2.8Å; S471-E474 WeakPolarHBondContact OG-CB 3.36Å; S471-E474 WeakPolarHBondContact OG-CG 3.37Å; S471-E474 PolarHBondContact OG-N 3.33Å; E472-E474 VanDerWaalsContact C-N 3.3Å; E472-E474 PolarHBondContact O-N 3.26Å; E474-E478 VanDerWaalsContact O-CG 3.28Å; E474-E478 WeakPolarHBondContact O-CG 3.41Å; E474-E478 PolarHBondContact O-N 2.66Å
475	E	57.1	Low	56.5	Low	87 Å²	87	99 Å²	99	41%	0.407	51%	0.512	S	S	.	.	H	α-helix	trans	-68.2	-40	175.2	-68.7	178.4	-179.7	0	0	111.4	T470 S471 E472 E478 E479	T470-E475 VanDerWaalsContact OG1-CG 3.25Å; T470-E475 WeakPolarHBondContact OG1-CG 3.5Å; T470-E475 PolarHBondContact OG1-OE1 3.1Å; S471-E475 PolarHBondContact O-N 3.27Å; E472-E475 PolarHBondContact O-N 3.41Å; E475-E478 PolarHBondContact O-N 3.46Å; E475-E479 WeakPolarHBondContact O-CG 3.24Å; E475-E479 PolarHBondContact O-N 2.92Å
476	E	50.4	Low	54.3	Low	133 Å²	133	99.4 Å²	99.4	62%	0.621	51%	0.509	S	S	*	.	H	α-helix	trans	-63.2	-40	174.8	-71.6	-180	-178.1	0	0	112.3	E472 E480	E472-E476 WeakPolarHBondContact O-CG 3.47Å; E472-E476 PolarHBondContact O-N 3.12Å; E476-E480 PolarHBondContact O-N 3.04Å; E476-E480 VanDerWaalsContact O-N 3.09Å
477	E	54.3	Low	52.1	Low	98 Å²	98	101.5 Å²	101.5	46%	0.458	52%	0.523	S	S	.	.	H	α-helix	trans	-65.3	-37	172.9	-73.5	-178.5	-175.3	0	0	112.3	R438 E473 E480 E481	R438-E477 IonicContact CZ-OE2 2.78Å; R438-E477 IonicContact NH1-OE2 3.69Å; R438-E477 PolarHBondContact NH1-OE2 3.2Å; R438-E477 IonicContact NH2-OE1 3.21Å; R438-E477 IonicContact NH2-OE2 2.79Å; R438-E477 PolarHBondContact NH2-OE2 3.34Å; E473-E477 PolarHBondContact O-N 3.23Å; E477-E480 PolarHBondContact O-N 3.27Å; E477-E481 PolarHBondContact O-N 3.21Å; E477-E481 VanDerWaalsContact O-N 3.15Å
478	E	51	Low	50.1	Low	50 Å²	50	101.1 Å²	101.1	23%	0.234	53%	0.529	C	S	.	.	H	α-helix	trans	-70.2	-38.7	177.7	-74.2	-174.9	172.2	0	0	112.3	K445 E474 E475 E481 E482	K445-E478 IonicContact NZ-OE1 3.54Å; K445-E478 PolarHBondContact NZ-OE1 3.5Å; K445-E478 IonicContact NZ-OE2 3.46Å; K445-E478 PolarHBondContact NZ-OE2 3.16Å; E474-E478 VanDerWaalsContact O-CG 3.28Å; E474-E478 WeakPolarHBondContact O-CG 3.41Å; E474-E478 PolarHBondContact O-N 2.66Å; E475-E478 PolarHBondContact O-N 3.46Å; E478-E481 PolarHBondContact O-N 3.03Å; E478-E482 PolarHBondContact O-N 3.47Å
479	E	44.1	Very low	48.1	Very low	151 Å²	151	104.6 Å²	104.6	71%	0.706	54%	0.541	S	S	*	.	H	α-helix	trans	-67.7	-33.6	174.1	-72.4	-173.8	177.9	0	0	112.2	E475 E481 G483	E475-E479 WeakPolarHBondContact O-CG 3.24Å; E475-E479 PolarHBondContact O-N 2.92Å; E479-E481 VanDerWaalsContact C-N 3.34Å; E479-G483 PolarHBondContact O-N 3.37Å
480	E	45.1	Very low	46.4	Very low	90 Å²	90	108.6 Å²	108.6	42%	0.421	56%	0.559	S	S	.	*	H	α-helix	trans	-66.3	-33.4	170.7	-75	-163.1	-172.6	0	0	112	R30 Q31 E476 E477	R30-E480 IonicContact CZ-OE2 3.54Å; R30-E480 IonicContact NH1-OE1 2.93Å; R30-E480 PolarHBondContact NH1-OE1 3.47Å; R30-E480 VanDerWaalsContact NH1-OE1 3.15Å; R30-E480 IonicContact NH1-OE2 3.83Å; R30-E480 PolarHBondContact NH1-OE2 3.45Å; Q31-E480 WeakPolarHBondContact CG-O 3.36Å; Q31-E480 PolarHBondContact NE2-O 3.28Å; E476-E480 PolarHBondContact O-N 3.04Å; E476-E480 VanDerWaalsContact O-N 3.09Å; E477-E480 PolarHBondContact O-N 3.27Å
481	E	42.6	Very low	44.8	Very low	57 Å²	57	111 Å²	111	27%	0.266	59%	0.588	S	S	.	*	H	α-helix	trans	-74	-33	174.9	-73.4	-156.8	146.5	0	0	114.2	Q31 T33 E477 E478 E479	Q31-E481 WeakPolarHBondContact O-CA 3.37Å; Q31-E481 VanDerWaalsContact O-CB 3.23Å; Q31-E481 WeakPolarHBondContact O-CB 3.35Å; Q31-E481 VanDerWaalsContact O-CG 3.28Å; Q31-E481 WeakPolarHBondContact O-CG 3.48Å; T33-E481 PolarHBondContact N-OE1 2.85Å; T33-E481 PolarHBondContact OG1-OE1 3.08Å; E477-E481 PolarHBondContact O-N 3.21Å; E477-E481 VanDerWaalsContact O-N 3.15Å; E478-E481 PolarHBondContact O-N 3.03Å; E479-E481 VanDerWaalsContact C-N 3.34Å
482	E	39.8	Very low	43.6	Very low	163 Å²	163	116.1 Å²	116.1	76%	0.762	61%	0.611	S	S	*	*	H	α-helix	trans	-90.6	-11.8	-176.4	-68	-167	174.4	0	0	115	E478 E484	E478-E482 PolarHBondContact O-N 3.47Å; E482-E484 PolarHBondContact O-N 3.07Å
483	G	34.7	Very low	42.6	Very low	35 Å²	35	117.3 Å²	117.3	36%	0.361	62%	0.617	S	S	.	*			trans	-84.7	83.1	-176.5	0	0	0	0	0	116.2	Q31 E479	Q31-G483 PolarHBondContact NE2-O 3.29Å; E479-G483 PolarHBondContact O-N 3.37Å
484	E	35.5	Very low	41.7	Very low	130 Å²	130	118.2 Å²	118.2	61%	0.607	62%	0.623	S	S	*	*			trans	-70.8	145.2	148.9	-84.6	-164.8	170.6	0	0	108.7	K291 E482 E486	K291-E484 IonicContact NZ-OE2 2.99Å; K291-E484 PolarHBondContact NZ-OE2 3.45Å; E482-E484 PolarHBondContact O-N 3.07Å; E484-E486 PolarHBondContact O-N 2.88Å
485	P	41.1	Very low	40.6	Very low	111 Å²	111	123.2 Å²	123.2	72%	0.721	66%	0.655	S	S	*	*			trans	-70.1	102	169	29.2	-30.1	0	0	0	108.6	D487	P485-D487 PolarHBondContact O-N 2.98Å
486	E	41	Very low	39.5	Very low	176 Å²	176	126.6 Å²	126.6	82%	0.822	68%	0.676	S	S	*	*	S	Bend	trans	-54.7	132.3	145.1	-64.9	-169.7	153.6	0	0	106.6	E484	E484-E486 PolarHBondContact O-N 2.88Å
487	D	39.2	Very low	38.7	Very low	148 Å²	148	130.7 Å²	130.7	79%	0.791	71%	0.709	S	S	*	*			trans	88	64.1	176.9	-44.8	-27.6	0	0	0	117.5	P485	P485-D487 PolarHBondContact O-N 2.98Å
488	A	34.9	Very low	37.9	Very low	91 Å²	91	132.3 Å²	132.3	75%	0.752	72%	0.722	S	S	*	*			trans	-103.5	74.2	137.5	0	0	0	0	0	108.6	L490	A488-L490 PolarHBondContact O-N 3.04Å
489	E	33	Very low	37.3	Very low	180 Å²	180	136.6 Å²	136.6	84%	0.841	75%	0.748	S	S	*	*			trans	-53.1	111.6	159.2	-79.5	-170.2	152.8	0	0	107.6	G491	E489-G491 VanDerWaalsContact C-N 3.26Å; E489-G491 PolarHBondContact O-N 3.04Å
490	L	34.9	Very low	36.9	Very low	174 Å²	174	135.8 Å²	135.8	91%	0.911	75%	0.75	S	S	*	*			trans	-58.7	95.3	164.3	-82.3	154.8	0	0	0	107.2	A488 D492	A488-L490 PolarHBondContact O-N 3.04Å; L490-D492 PolarHBondContact O-N 3.48Å
491	G	31.4	Very low	36.4	Very low	72 Å²	72	138.5 Å²	138.5	74%	0.742	77%	0.769	S	S	*	*			trans	-59.4	105.6	166.6	0	0	0	0	0	109	E489 E493	E489-G491 VanDerWaalsContact C-N 3.26Å; E489-G491 PolarHBondContact O-N 3.04Å; G491-E493 PolarHBondContact O-N 2.82Å; G491-E493 VanDerWaalsContact O-N 3.09Å
492	D	38.2	Very low	36	Very low	161 Å²	161	143.6 Å²	143.6	86%	0.861	80%	0.801	S	S	*	*			trans	-57.1	104.4	159	-108.5	-19.2	0	0	0	107.8	L490	L490-D492 PolarHBondContact O-N 3.48Å
493	E	33.4	Very low	35.8	Very low	183 Å²	183	142.3 Å²	142.3	86%	0.855	80%	0.803	S	S	*	*			trans	-118.8	87.9	160.3	-127.7	-179.6	-174.9	0	0	108.9	G491 T495	G491-E493 PolarHBondContact O-N 2.82Å; G491-E493 VanDerWaalsContact O-N 3.09Å; E493-T495 PolarHBondContact O-N 3.23Å
494	M	36.8	Very low	35.8	Very low	173 Å²	173	150 Å²	150	85%	0.852	84%	0.835	S	S	*	*			trans	-56.6	121.1	152.1	-85.3	-169.5	-77.2	0	0	109
495	T	34.4	Very low	35.9	Very low	124 Å²	124	151.5 Å²	151.5	76%	0.761	85%	0.852	S	S	*	*			trans	-143.1	120.6	142.8	52.7	0	0	0	0	110.5	E493	E493-T495 PolarHBondContact O-N 3.23Å
496	D	33.7	Very low	35.4	Very low	159 Å²	159	154.9 Å²	154.9	85%	0.85	86%	0.863	S	S	*	*			trans	-49.3	138.7	162.9	-63.1	-58.9	0	0	0	112.2
497	V	34.3	Very low	34.9	Very low	218 Å²	218	153 Å²	153	100%	1.321	87%	0.867	S	S	*	*				-177.1	0	112.3	178.3	0	0	0	0	108.9

Retrieved 497 of 497 residues in 1259 ms (Link to these results)

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