A0A077ZH80_TRITR Loading...

Pkinase domain containing protein

AlphaFold DB , UniProt , Accession A0A077ZH80, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 361 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	24.9	Very low	23.9	Very low	234 Å²	234	140.2 Å²	140.2	100%	1.153	78%	0.777	S	S	*	*				0	107.5	0	-113.6	-179.9	-79.1	0	0	107.1	V3	M1-V3 PolarHBondContact O-N 3.12Å; M1-V3 VanDerWaalsContact O-N 3.09Å
2	L	18.4	Very low	25.2	Very low	186 Å²	186	135.5 Å²	135.5	97%	0.974	74%	0.743	S	S	*	*			trans	-67.8	107.9	-175.3	-102.8	104.6	0	0	0	110.3	G4	L2-G4 PolarHBondContact O-N 3.32Å
3	V	20.2	Very low	26.1	Very low	137 Å²	137	129.2 Å²	129.2	83%	0.83	71%	0.705	S	S	*	*			trans	-86.8	96.3	166.5	178.9	0	0	0	0	106.7	M1	M1-V3 PolarHBondContact O-N 3.12Å; M1-V3 VanDerWaalsContact O-N 3.09Å
4	G	21.2	Very low	27	Very low	67 Å²	67	124.1 Å²	124.1	69%	0.691	69%	0.689	S	S	*	*			trans	-102.7	98.3	178.2	0	0	0	0	0	111.3	L2 M6	L2-G4 PolarHBondContact O-N 3.32Å; G4-M6 PolarHBondContact O-N 3.29Å
5	K	20.5	Very low	27.8	Very low	209 Å²	209	119.4 Å²	119.4	91%	0.909	66%	0.66	S	S	*	*			trans	-69.1	108	161.9	-81.6	178	173.2	176.3	0	108
6	M	21.8	Very low	28.8	Very low	183 Å²	183	114.7 Å²	114.7	90%	0.901	63%	0.631	S	S	*	*			trans	-106.8	122.8	166	-97	-178.9	63.2	0	0	109	G4	G4-M6 PolarHBondContact O-N 3.29Å
7	G	22.7	Very low	29.8	Very low	79 Å²	79	113.8 Å²	113.8	81%	0.814	62%	0.624	S	S	*	*			trans	-65.5	146.2	-169.1	0	0	0	0	0	114.6
8	V	24.2	Very low	30.7	Very low	118 Å²	118	108.4 Å²	108.4	72%	0.715	60%	0.595	S	S	*	*			trans	-94.8	97.9	174.5	-177.1	0	0	0	0	107.8	Q10	V8-Q10 HydrophobicContact CG1-CB 4.01Å; V8-Q10 HydrophobicContact CG1-CG 3.64Å
9	I	25.5	Very low	31.7	Very low	131 Å²	131	105.4 Å²	105.4	67%	0.672	58%	0.578	S	S	*	*			trans	-89	95.4	160.9	-58.6	176	0	0	0	105.5	F11	I9-F11 HydrophobicContact CB-CE2 4.41Å; I9-F11 HydrophobicContact CG2-CD2 4.05Å; I9-F11 HydrophobicContact CG2-CE2 3.51Å; I9-F11 HydrophobicContact CG2-CZ 3.93Å; I9-F11 PolarHBondContact O-N 3.42Å
10	Q	30.9	Very low	32.9	Very low	74 Å²	74	103 Å²	103	35%	0.346	56%	0.562	S	S	.	*			trans	-83.7	95.2	-173.5	-122.4	169.4	10	0	0	110	V8 F12	V8-Q10 HydrophobicContact CG1-CB 4.01Å; V8-Q10 HydrophobicContact CG1-CG 3.64Å; Q10-F12 HydrophobicContact CB-CD2 4.2Å; Q10-F12 HydrophobicContact CB-CE2 3.64Å; Q10-F12 HydrophobicContact CB-CZ 4.14Å; Q10-F12 HydrophobicContact CG-CE1 4.42Å; Q10-F12 HydrophobicContact CG-CE2 3.75Å; Q10-F12 HydrophobicContact CG-CZ 3.69Å; Q10-F12 PolarHBondContact O-N 2.85Å; Q10-F12 VanDerWaalsContact OE1-CZ 3.26Å
11	F	32.8	Very low	33.9	Very low	124 Å²	124	101.7 Å²	101.7	54%	0.544	55%	0.548	S	S	.	.			trans	-78.9	102.4	166.5	-68.5	-83.4	0	0	0	108.9	I9 Q13 F300	I9-F11 HydrophobicContact CB-CE2 4.41Å; I9-F11 HydrophobicContact CG2-CD2 4.05Å; I9-F11 HydrophobicContact CG2-CE2 3.51Å; I9-F11 HydrophobicContact CG2-CZ 3.93Å; I9-F11 PolarHBondContact O-N 3.42Å; F11-Q13 PolarHBondContact O-N 3.07Å; F11-F300 HydrophobicContact CB-CD2 4.23Å
12	F	39.3	Very low	35.4	Very low	84 Å²	84	99.5 Å²	99.5	37%	0.368	53%	0.528	S	S	.	.			trans	-82.7	89.7	172.1	-69.6	-80.4	0	0	0	109.9	Q10 F75 P77 L122	Q10-F12 HydrophobicContact CB-CD2 4.2Å; Q10-F12 HydrophobicContact CB-CE2 3.64Å; Q10-F12 HydrophobicContact CB-CZ 4.14Å; Q10-F12 HydrophobicContact CG-CE1 4.42Å; Q10-F12 HydrophobicContact CG-CE2 3.75Å; Q10-F12 HydrophobicContact CG-CZ 3.69Å; Q10-F12 PolarHBondContact O-N 2.85Å; Q10-F12 VanDerWaalsContact OE1-CZ 3.26Å; F12-F75 HydrophobicContact CD2-CB 4.32Å; F12-F75 WeakPolarHBondContact CE2-O 3.43Å; F12-P77 HydrophobicContact CZ-CG 3.89Å; F12-L122 HydrophobicContact CB-CD1 4.44Å; F12-L122 HydrophobicContact CE1-CD2 4.35Å; F12-L122 HydrophobicContact CE2-CD2 4.34Å; F12-L122 HydrophobicContact CG-CD1 4.37Å; F12-L122 HydrophobicContact CZ-CD2 4.26Å
13	Q	37.5	Very low	37.1	Very low	54 Å²	54	92 Å²	92	25%	0.252	49%	0.488	S	S	.	.			trans	-111.5	125.5	164.6	-70.5	177.6	-10.7	0	0	108.2	F11 F300	F11-Q13 PolarHBondContact O-N 3.07Å; Q13-F300 HydrophobicContact CB-CE1 4.2Å; Q13-F300 HydrophobicContact CB-CE2 4.06Å; Q13-F300 HydrophobicContact CB-CZ 3.82Å; Q13-F300 WeakPolarHBondContact O-CZ 3.49Å
14	A	37.4	Very low	38.9	Very low	57 Å²	57	89 Å²	89	47%	0.471	47%	0.467	S	S	.	.			trans	-93.7	129.2	-177.8	0	0	0	0	0	111
15	M	39.7	Very low	40.8	Very low	54 Å²	54	92.9 Å²	92.9	27%	0.266	47%	0.465	S	S	.	.			trans	-125	119.1	175.5	179	178	55.2	0	0	109.9	I17 I291	M15-I17 HydrophobicContact CE-CD1 3.73Å; M15-I17 HydrophobicContact CE-CG1 3.97Å; M15-I17 HydrophobicContact CG-CG1 4.11Å; M15-I17 HydrophobicContact SD-CD1 4.46Å; M15-I17 HydrophobicContact SD-CG1 4.22Å; M15-I291 HydrophobicContact CE-CG2 3.54Å; M15-I291 HydrophobicContact SD-CG2 3.24Å; M15-I291 WeakPolarHBondContact SD-CG2 3.35Å
16	K	44.5	Very low	42.4	Very low	44 Å²	44	89.4 Å²	89.4	19%	0.191	45%	0.45	C	S	.	.			trans	-94.5	105.7	173.7	-166.6	174.4	-172	177.1	0	109.8	V18 E50 G135 L336	K16-V18 HydrophobicContact CG-CG2 4.19Å; K16-E50 IonicContact NZ-OE1 3.69Å; K16-E50 PolarHBondContact NZ-OE1 2.81Å; K16-E50 IonicContact NZ-OE2 2.75Å; K16-E50 PolarHBondContact NZ-OE2 3.49Å; K16-G135 WeakPolarHBondContact CE-O 3.38Å; K16-L336 WeakPolarHBondContact O-CA 3.47Å
17	I	44.9	Very low	44.1	Very low	99 Å²	99	84.3 Å²	84.3	51%	0.508	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.6	130.2	177.3	-56.1	-171.9	0	0	0	109.6	M15 L337	M15-I17 HydrophobicContact CE-CD1 3.73Å; M15-I17 HydrophobicContact CE-CG1 3.97Å; M15-I17 HydrophobicContact CG-CG1 4.11Å; M15-I17 HydrophobicContact SD-CD1 4.46Å; M15-I17 HydrophobicContact SD-CG1 4.22Å; I17-L337 HydrophobicContact CB-CD1 4.21Å; I17-L337 HydrophobicContact CD1-CD1 3.82Å; I17-L337 HydrophobicContact CG1-CD1 3.83Å; I17-L337 HydrophobicContact CG2-CB 3.9Å; I17-L337 HydrophobicContact CG2-CD1 3.62Å; I17-L337 HydrophobicContact CG2-CG 4.37Å
18	V	46.1	Very low	45.7	Very low	18 Å²	18	82.2 Å²	82.2	11%	0.109	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	119.8	-178.1	175.4	0	0	0	0	112.5	K16 K20 I23 I47 L336 L337	K16-V18 HydrophobicContact CG-CG2 4.19Å; V18-K20 PolarHBondContact O-N 3.41Å; V18-I23 HydrophobicContact CB-CD1 4.48Å; V18-I23 HydrophobicContact CG1-CD1 2.98Å; V18-I23 HydrophobicContact CG1-CG1 4.22Å; V18-I47 HydrophobicContact CG1-CD1 3.97Å; V18-L336 HydrophobicContact CB-CD2 3.38Å; V18-L336 HydrophobicContact CG1-CD2 4.12Å; V18-L336 HydrophobicContact CG2-CD2 3.32Å; V18-L336 HydrophobicContact CG2-CG 4.34Å; V18-L337 CarbonylContact C-O 3.47Å; V18-L337 CarbonylContact O-C 3.57Å
19	D	50.4	Low	47.1	Very low	51 Å²	51	81.7 Å²	81.7	27%	0.273	39%	0.393	S	S	.	.			trans	-81.5	103.5	174.9	-178.2	-21.3	0	0	0	110.4	R21 R22 I23	D19-R21 PolarHBondContact O-N 3.29Å; D19-R21 WeakPolarHBondContact OD1-CA 3.27Å; D19-R21 WeakPolarHBondContact OD1-CB 3.44Å; D19-R21 PolarHBondContact OD1-N 3.41Å; D19-R22 HydrophobicContact CB-CB 4Å; D19-R22 HydrophobicContact CB-CG 4.06Å; D19-R22 PolarHBondContact O-N 3.21Å; D19-R22 VanDerWaalsContact O-N 3.13Å; D19-R22 PolarHBondContact OD1-N 3.22Å; D19-R22 VanDerWaalsContact OD1-N 3.09Å; D19-R22 WeakPolarHBondContact OD2-CD 3.31Å; D19-R22 VanDerWaalsContact OD2-CG 3.29Å; D19-R22 WeakPolarHBondContact OD2-CG 3.29Å; D19-R22 IonicContact OD2-NE 2.81Å; D19-R22 PolarHBondContact OD2-NE 3.47Å; D19-I23 PolarHBondContact O-N 2.99Å; D19-I23 VanDerWaalsContact O-N 3.12Å
20	K	54.9	Low	48.3	Very low	56 Å²	56	80 Å²	80	24%	0.243	38%	0.384	C	S	.	.	H	α-helix	trans	-55	-35.2	178.2	172.3	169.7	173	172.4	0	112.7	V18 L24 L44 I338	V18-K20 PolarHBondContact O-N 3.41Å; K20-L24 HydrophobicContact CD-CD1 4.5Å; K20-L24 HydrophobicContact CG-CD1 3.78Å; K20-L24 HydrophobicContact CG-CG 4.4Å; K20-L24 WeakPolarHBondContact O-CB 3.28Å; K20-L24 VanDerWaalsContact O-CG 3.27Å; K20-L24 WeakPolarHBondContact O-CG 3.38Å; K20-L24 PolarHBondContact O-N 2.95Å; K20-L44 HydrophobicContact CB-CD2 4.41Å; K20-L44 HydrophobicContact CD-CD1 3.71Å; K20-L44 HydrophobicContact CD-CD2 4.38Å; K20-L44 HydrophobicContact CG-CD1 4.11Å; K20-L44 HydrophobicContact CG-CD2 4.1Å; K20-I338 HydrophobicContact CB-CG2 3.88Å; K20-I338 HydrophobicContact CD-CG2 3.34Å; K20-I338 HydrophobicContact CG-CG2 4.23Å
21	R	54	Low	49.1	Very low	76 Å²	76	85 Å²	85	29%	0.287	40%	0.4	S	S	.	.	H	α-helix	trans	-72.5	-40.2	178.4	-70.4	-156.1	-174.8	100.6	16.2	112.2	D19 I23 L24 K25 F341 S342	D19-R21 PolarHBondContact O-N 3.29Å; D19-R21 WeakPolarHBondContact OD1-CA 3.27Å; D19-R21 WeakPolarHBondContact OD1-CB 3.44Å; D19-R21 PolarHBondContact OD1-N 3.41Å; R21-I23 VanDerWaalsContact C-N 3.29Å; R21-I23 PolarHBondContact O-N 3.12Å; R21-L24 PolarHBondContact O-N 3.41Å; R21-K25 VanDerWaalsContact O-CB 3.31Å; R21-K25 WeakPolarHBondContact O-CB 3.33Å; R21-K25 VanDerWaalsContact O-CG 3.28Å; R21-K25 WeakPolarHBondContact O-CG 3.26Å; R21-K25 PolarHBondContact O-N 2.95Å; R21-F341 PolarHBondContact NH1-O 2.9Å; R21-F341 VanDerWaalsContact NH2-CA 3.26Å; R21-F341 VanDerWaalsContact NH2-N 3.11Å; R21-S342 VanDerWaalsContact CZ-CA 3.47Å; R21-S342 PolarHBondContact NE-OG 3.17Å; R21-S342 PolarHBondContact NH1-OG 3.26Å; R21-S342 PolarHBondContact NH2-OG 3.04Å
22	R	55.6	Low	49.8	Very low	189 Å²	189	86 Å²	86	71%	0.713	41%	0.411	S	S	*	.	H	α-helix	trans	-60.7	-41.7	175.5	-78.1	179.3	-173.2	-153.9	-3	111.2	D19 K25 K26	D19-R22 HydrophobicContact CB-CB 4Å; D19-R22 HydrophobicContact CB-CG 4.06Å; D19-R22 PolarHBondContact O-N 3.21Å; D19-R22 VanDerWaalsContact O-N 3.13Å; D19-R22 PolarHBondContact OD1-N 3.22Å; D19-R22 VanDerWaalsContact OD1-N 3.09Å; D19-R22 WeakPolarHBondContact OD2-CD 3.31Å; D19-R22 VanDerWaalsContact OD2-CG 3.29Å; D19-R22 WeakPolarHBondContact OD2-CG 3.29Å; D19-R22 IonicContact OD2-NE 2.81Å; D19-R22 PolarHBondContact OD2-NE 3.47Å; R22-K25 PolarHBondContact O-N 2.86Å; R22-K26 WeakPolarHBondContact O-CB 3.5Å; R22-K26 PolarHBondContact O-N 3.47Å
23	I	54.9	Low	50.3	Low	27 Å²	27	90 Å²	90	14%	0.138	43%	0.428	C	S	.	.	H	α-helix	trans	-62.9	-53.8	176.2	-67.8	158.9	0	0	0	110.8	V18 D19 R21 K25 K26 F27 P43 I47	V18-I23 HydrophobicContact CB-CD1 4.48Å; V18-I23 HydrophobicContact CG1-CD1 2.98Å; V18-I23 HydrophobicContact CG1-CG1 4.22Å; D19-I23 PolarHBondContact O-N 2.99Å; D19-I23 VanDerWaalsContact O-N 3.12Å; R21-I23 VanDerWaalsContact C-N 3.29Å; R21-I23 PolarHBondContact O-N 3.12Å; I23-K25 VanDerWaalsContact C-N 3.25Å; I23-K25 PolarHBondContact O-N 2.84Å; I23-K26 PolarHBondContact O-N 3.22Å; I23-K26 VanDerWaalsContact O-N 3.11Å; I23-F27 HydrophobicContact CG2-CD2 3.79Å; I23-F27 HydrophobicContact CG2-CE2 3.99Å; I23-F27 WeakPolarHBondContact O-CD2 3.23Å; I23-F27 PolarHBondContact O-N 3.45Å; I23-P43 HydrophobicContact CG2-CB 3.61Å; I23-I47 HydrophobicContact CD1-CD1 3.2Å; I23-I47 HydrophobicContact CG1-CD1 4.22Å
24	L	58.9	Low	50.6	Low	76 Å²	76	92.2 Å²	92.2	40%	0.398	44%	0.441	S	S	.	.	H	α-helix	trans	-61.1	-35.6	-178.6	-70	171	0	0	0	111.9	K20 R21 G28	K20-L24 HydrophobicContact CD-CD1 4.5Å; K20-L24 HydrophobicContact CG-CD1 3.78Å; K20-L24 HydrophobicContact CG-CG 4.4Å; K20-L24 WeakPolarHBondContact O-CB 3.28Å; K20-L24 VanDerWaalsContact O-CG 3.27Å; K20-L24 WeakPolarHBondContact O-CG 3.38Å; K20-L24 PolarHBondContact O-N 2.95Å; R21-L24 PolarHBondContact O-N 3.41Å; L24-G28 PolarHBondContact O-N 3.49Å
25	K	59.7	Low	50.9	Low	147 Å²	147	95.9 Å²	95.9	64%	0.639	46%	0.464	S	S	*	.	H	α-helix	trans	-64.4	-47.4	172.3	-77.7	-178.8	179.2	-173.8	0	112.3	R21 R22 I23 F27 G28 I29	R21-K25 VanDerWaalsContact O-CB 3.31Å; R21-K25 WeakPolarHBondContact O-CB 3.33Å; R21-K25 VanDerWaalsContact O-CG 3.28Å; R21-K25 WeakPolarHBondContact O-CG 3.26Å; R21-K25 PolarHBondContact O-N 2.95Å; R22-K25 PolarHBondContact O-N 2.86Å; I23-K25 VanDerWaalsContact C-N 3.25Å; I23-K25 PolarHBondContact O-N 2.84Å; K25-F27 VanDerWaalsContact C-N 3.3Å; K25-F27 PolarHBondContact O-N 3.05Å; K25-G28 PolarHBondContact O-N 3.47Å; K25-I29 VanDerWaalsContact O-CG1 3.29Å; K25-I29 WeakPolarHBondContact O-CG1 3.44Å; K25-I29 PolarHBondContact O-N 2.8Å
26	K	54.7	Low	51.1	Low	136 Å²	136	97.8 Å²	97.8	59%	0.591	49%	0.488	S	S	*	.	H	α-helix	trans	-60.9	-40.8	179.3	-163.2	178	-178.1	-175.6	0	111.1	R22 I23 L30	R22-K26 WeakPolarHBondContact O-CB 3.5Å; R22-K26 PolarHBondContact O-N 3.47Å; I23-K26 PolarHBondContact O-N 3.22Å; I23-K26 VanDerWaalsContact O-N 3.11Å; K26-L30 PolarHBondContact O-N 3.07Å
27	F	57.4	Low	51.1	Low	77 Å²	77	99.2 Å²	99.2	34%	0.338	51%	0.508	S	S	.	.	H	α-helix	trans	-71.8	-36.4	174.6	-85.8	-89.5	0	0	0	113.4	I23 K25 I29 L30 R31 P43	I23-F27 HydrophobicContact CG2-CD2 3.79Å; I23-F27 HydrophobicContact CG2-CE2 3.99Å; I23-F27 WeakPolarHBondContact O-CD2 3.23Å; I23-F27 PolarHBondContact O-N 3.45Å; K25-F27 VanDerWaalsContact C-N 3.3Å; K25-F27 PolarHBondContact O-N 3.05Å; F27-I29 VanDerWaalsContact C-N 3.33Å; F27-I29 PolarHBondContact O-N 3.01Å; F27-L30 PolarHBondContact O-N 3.17Å; F27-R31 WeakPolarHBondContact O-CB 3.44Å; F27-R31 PolarHBondContact O-N 2.88Å; F27-P43 HydrophobicContact CB-CG 3.91Å; F27-P43 HydrophobicContact CD1-CB 4.3Å; F27-P43 HydrophobicContact CD1-CG 3.66Å; F27-P43 HydrophobicContact CD2-CB 3.57Å; F27-P43 HydrophobicContact CD2-CG 3.66Å; F27-P43 HydrophobicContact CE1-CB 4.31Å; F27-P43 HydrophobicContact CE1-CG 4.03Å; F27-P43 HydrophobicContact CE2-CB 3.6Å; F27-P43 HydrophobicContact CE2-CG 4.04Å; F27-P43 HydrophobicContact CG-CB 3.93Å; F27-P43 HydrophobicContact CG-CG 3.45Å; F27-P43 VanDerWaalsContact CG-CG 3.45Å; F27-P43 HydrophobicContact CZ-CB 3.97Å; F27-P43 HydrophobicContact CZ-CG 4.2Å
28	G	55.7	Low	51.2	Low	34 Å²	34	99.9 Å²	99.9	35%	0.351	52%	0.519	S	S	.	.	H	α-helix	trans	-62.3	-38.9	174.2	0	0	0	0	0	112.7	L24 K25 R31 N32	L24-G28 PolarHBondContact O-N 3.49Å; K25-G28 PolarHBondContact O-N 3.47Å; G28-R31 PolarHBondContact O-N 3Å; G28-N32 PolarHBondContact O-N 3.11Å
29	I	54.8	Low	51.2	Low	108 Å²	108	104.7 Å²	104.7	55%	0.554	55%	0.55	S	S	*	*	H	α-helix	trans	-66.6	-38.6	174.3	-64.4	162.4	0	0	0	111.1	K25 F27	K25-I29 VanDerWaalsContact O-CG1 3.29Å; K25-I29 WeakPolarHBondContact O-CG1 3.44Å; K25-I29 PolarHBondContact O-N 2.8Å; F27-I29 VanDerWaalsContact C-N 3.33Å; F27-I29 PolarHBondContact O-N 3.01Å
30	L	49.5	Very low	51.1	Low	94 Å²	94	109.9 Å²	109.9	49%	0.492	57%	0.571	S	S	.	*	H	α-helix	trans	-67.3	-38.6	176.1	-123.3	84.3	0	0	0	112.3	K26 F27 N32 K33 L34	K26-L30 PolarHBondContact O-N 3.07Å; F27-L30 PolarHBondContact O-N 3.17Å; L30-N32 VanDerWaalsContact C-N 3.3Å; L30-N32 PolarHBondContact O-N 3.11Å; L30-K33 PolarHBondContact O-N 3.28Å; L30-K33 VanDerWaalsContact O-N 3.07Å; L30-L34 HydrophobicContact CD2-CD1 4.38Å; L30-L34 PolarHBondContact O-N 3.02Å
31	R	48.6	Very low	51.1	Low	180 Å²	180	110.4 Å²	110.4	68%	0.679	58%	0.579	S	S	*	*	H	α-helix	trans	-62.6	-36	178.3	-178.2	179.3	156.6	126.4	-0.6	112.3	F27 G28 K33	F27-R31 WeakPolarHBondContact O-CB 3.44Å; F27-R31 PolarHBondContact O-N 2.88Å; G28-R31 PolarHBondContact O-N 3Å; R31-K33 PolarHBondContact O-N 2.94Å
32	N	46.4	Very low	51.5	Low	144 Å²	144	109 Å²	109	77%	0.77	58%	0.577	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71.9	-10.4	176.4	-78	2.6	0	0	0	113.8	G28 L30	G28-N32 PolarHBondContact O-N 3.11Å; L30-N32 VanDerWaalsContact C-N 3.3Å; L30-N32 PolarHBondContact O-N 3.11Å
33	K	49.7	Very low	51.8	Low	168 Å²	168	100.4 Å²	100.4	73%	0.73	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-104.9	-11	178.8	-71.5	-171.5	174.3	-169.9	0	114.3	L30 R31	L30-K33 PolarHBondContact O-N 3.28Å; L30-K33 VanDerWaalsContact O-N 3.07Å; R31-K33 PolarHBondContact O-N 2.94Å
34	L	45.4	Very low	52.3	Low	101 Å²	101	99.7 Å²	99.7	53%	0.529	54%	0.542	S	S	.	.			trans	-121.2	92.4	-176.2	-69.8	164.4	0	0	0	109.3	L30 A36	L30-L34 HydrophobicContact CD2-CD1 4.38Å; L30-L34 PolarHBondContact O-N 3.02Å; L34-A36 PolarHBondContact O-N 3.42Å; L34-A36 VanDerWaalsContact O-N 3.12Å
35	S	42.2	Very low	52.6	Low	135 Å²	135	100.6 Å²	100.6	94%	0.944	54%	0.544	S	S	*	.	S	Bend	trans	-68.5	-2.4	-178.9	-30.6	0	0	0	0	114.2
36	A	45.6	Very low	52.8	Low	94 Å²	94	100 Å²	100	78%	0.777	54%	0.538	S	S	*	.	S	Bend	trans	-143.8	90	176.5	0	0	0	0	0	108.7	L34	L34-A36 PolarHBondContact O-N 3.42Å; L34-A36 VanDerWaalsContact O-N 3.12Å
37	A	44.4	Very low	53.4	Low	74 Å²	74	94.7 Å²	94.7	61%	0.612	52%	0.516	S	S	*	.			trans	-107.8	140.6	-180	0	0	0	0	0	111.2
38	P	45.5	Very low	53.9	Low	113 Å²	113	93.6 Å²	93.6	73%	0.734	51%	0.51	S	S	*	.			trans	-56.9	168.3	171.5	-15.6	27.5	0	0	0	112	F40	P38-F40 PolarHBondContact O-N 3.46Å
39	P	46.5	Very low	54.4	Low	118 Å²	118	94.6 Å²	94.6	77%	0.766	51%	0.507	S	S	*	.	S	Bend	trans	-49.4	139.2	-176.6	18.3	-30.7	0	0	0	111.9	V41	P39-V41 PolarHBondContact O-N 3.3Å
40	F	47.8	Very low	54.9	Low	160 Å²	160	90.9 Å²	90.9	70%	0.702	49%	0.487	S	S	*	.			trans	-54.4	97.7	-175.4	179.7	-97.7	0	0	0	111.2	P38 N42	P38-F40 PolarHBondContact O-N 3.46Å; F40-N42 HydrophobicContact CE1-CB 4.34Å
41	V	56	Low	55.8	Low	68 Å²	68	86.5 Å²	86.5	41%	0.412	47%	0.465	S	S	.	.			trans	-85	118.9	166.2	-177.7	0	0	0	0	107	P39 P43 R46	P39-V41 PolarHBondContact O-N 3.3Å; V41-P43 WeakPolarHBondContact O-CD 3.29Å; V41-R46 HydrophobicContact CG1-CG 3.99Å
42	N	62.7	Low	56.8	Low	47 Å²	47	78 Å²	78	25%	0.251	43%	0.433	S	S	.	.			trans	-60.7	122.2	-179.9	-178.7	-10.7	0	0	0	108.9	F40 L44 E45 R46	F40-N42 HydrophobicContact CE1-CB 4.34Å; N42-L44 PolarHBondContact O-N 3.12Å; N42-L44 WeakPolarHBondContact OD1-CB 3.38Å; N42-L44 PolarHBondContact OD1-N 3.09Å; N42-L44 VanDerWaalsContact OD1-N 3.12Å; N42-E45 HydrophobicContact CB-CB 4.22Å; N42-E45 HydrophobicContact CB-CG 3.83Å; N42-E45 WeakPolarHBondContact O-CB 3.43Å; N42-E45 PolarHBondContact O-N 3.13Å; N42-R46 PolarHBondContact O-N 2.73Å
43	P	61.2	Low	58.1	Low	8 Å²	8	71.5 Å²	71.5	5%	0.052	40%	0.398	C	S	.	.	H	α-helix	trans	-54.1	-27.5	-180	-30.7	37.9	0	0	0	114.3	I23 F27 V41	I23-P43 HydrophobicContact CG2-CB 3.61Å; F27-P43 HydrophobicContact CB-CG 3.91Å; F27-P43 HydrophobicContact CD1-CB 4.3Å; F27-P43 HydrophobicContact CD1-CG 3.66Å; F27-P43 HydrophobicContact CD2-CB 3.57Å; F27-P43 HydrophobicContact CD2-CG 3.66Å; F27-P43 HydrophobicContact CE1-CB 4.31Å; F27-P43 HydrophobicContact CE1-CG 4.03Å; F27-P43 HydrophobicContact CE2-CB 3.6Å; F27-P43 HydrophobicContact CE2-CG 4.04Å; F27-P43 HydrophobicContact CG-CB 3.93Å; F27-P43 HydrophobicContact CG-CG 3.45Å; F27-P43 VanDerWaalsContact CG-CG 3.45Å; F27-P43 HydrophobicContact CZ-CB 3.97Å; F27-P43 HydrophobicContact CZ-CG 4.2Å; V41-P43 WeakPolarHBondContact O-CD 3.29Å
44	L	65.5	Low	59	Low	12 Å²	12	64.4 Å²	64.4	6%	0.063	37%	0.368	C	S	.	.	H	α-helix	trans	-74.3	-32.9	176.3	-63.5	173	0	0	0	112.8	K20 N42 R46 I47 Y48	K20-L44 HydrophobicContact CB-CD2 4.41Å; K20-L44 HydrophobicContact CD-CD1 3.71Å; K20-L44 HydrophobicContact CD-CD2 4.38Å; K20-L44 HydrophobicContact CG-CD1 4.11Å; K20-L44 HydrophobicContact CG-CD2 4.1Å; N42-L44 PolarHBondContact O-N 3.12Å; N42-L44 WeakPolarHBondContact OD1-CB 3.38Å; N42-L44 PolarHBondContact OD1-N 3.09Å; N42-L44 VanDerWaalsContact OD1-N 3.12Å; L44-R46 VanDerWaalsContact C-N 3.3Å; L44-R46 PolarHBondContact O-N 3.44Å; L44-I47 WeakPolarHBondContact O-CB 3.45Å; L44-I47 PolarHBondContact O-N 3.42Å; L44-I47 VanDerWaalsContact O-N 3.12Å; L44-Y48 HydrophobicContact CB-CE2 4.15Å; L44-Y48 VanDerWaalsContact O-CD2 3.26Å; L44-Y48 WeakPolarHBondContact O-CD2 3.41Å; L44-Y48 PolarHBondContact O-N 3.39Å
45	E	66	Low	60.3	Low	94 Å²	94	61.6 Å²	61.6	44%	0.439	35%	0.351	S	S	.	.	H	α-helix	trans	-61.5	-42.1	175.9	-75	170	178	0	0	110.4	N42 I47 Y48 D49	N42-E45 HydrophobicContact CB-CB 4.22Å; N42-E45 HydrophobicContact CB-CG 3.83Å; N42-E45 WeakPolarHBondContact O-CB 3.43Å; N42-E45 PolarHBondContact O-N 3.13Å; E45-I47 PolarHBondContact O-N 2.87Å; E45-Y48 PolarHBondContact O-N 3.22Å; E45-D49 VanDerWaalsContact O-CG 3.22Å; E45-D49 PolarHBondContact O-N 3.29Å
46	R	64.2	Low	62.1	Low	136 Å²	136	58.4 Å²	58.4	51%	0.513	32%	0.32	S	S	.	.	H	α-helix	trans	-57.2	-34.2	174.7	-65.1	-173.3	180	-177.5	-0.9	113.3	V41 N42 L44 E50	V41-R46 HydrophobicContact CG1-CG 3.99Å; N42-R46 PolarHBondContact O-N 2.73Å; L44-R46 VanDerWaalsContact C-N 3.3Å; L44-R46 PolarHBondContact O-N 3.44Å; R46-E50 WeakPolarHBondContact O-CB 3.22Å; R46-E50 PolarHBondContact O-N 3.46Å
47	I	65.4	Low	63.9	Low	24 Å²	24	54 Å²	54	12%	0.123	28%	0.283	C	S	.	.	H	α-helix	trans	-77.1	-38.5	179	-62.2	174.8	0	0	0	110.5	V18 I23 L44 E45 D49 E50 V51 L336	V18-I47 HydrophobicContact CG1-CD1 3.97Å; I23-I47 HydrophobicContact CD1-CD1 3.2Å; I23-I47 HydrophobicContact CG1-CD1 4.22Å; L44-I47 WeakPolarHBondContact O-CB 3.45Å; L44-I47 PolarHBondContact O-N 3.42Å; L44-I47 VanDerWaalsContact O-N 3.12Å; E45-I47 PolarHBondContact O-N 2.87Å; I47-D49 VanDerWaalsContact C-N 3.34Å; I47-E50 PolarHBondContact O-N 2.78Å; I47-V51 WeakPolarHBondContact O-CG2 3.42Å; I47-V51 PolarHBondContact O-N 2.76Å; I47-L336 HydrophobicContact CG2-CD1 3.63Å; I47-L336 HydrophobicContact CG2-CD2 3.81Å; I47-L336 HydrophobicContact CG2-CG 4.39Å
48	Y	68.5	Low	65.8	Low	54 Å²	54	55 Å²	55	21%	0.212	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-41.4	173	-62.2	-40.2	0	0	0	111.7	L44 E45 V51 A52 V275 S278 V279 I338	L44-Y48 HydrophobicContact CB-CE2 4.15Å; L44-Y48 VanDerWaalsContact O-CD2 3.26Å; L44-Y48 WeakPolarHBondContact O-CD2 3.41Å; L44-Y48 PolarHBondContact O-N 3.39Å; E45-Y48 PolarHBondContact O-N 3.22Å; Y48-V51 PolarHBondContact O-N 3.12Å; Y48-A52 VanDerWaalsContact O-CB 3.27Å; Y48-A52 WeakPolarHBondContact O-CB 3.49Å; Y48-A52 PolarHBondContact O-N 2.59Å; Y48-V275 VanDerWaalsContact CB-CG1 3.48Å; Y48-S278 PolarHBondContact O-OG 3.25Å; Y48-V279 HydrophobicContact CD1-CB 3.83Å; Y48-V279 HydrophobicContact CD1-CG2 3.4Å; Y48-V279 VanDerWaalsContact CD1-CG2 3.4Å; Y48-V279 HydrophobicContact CE1-CB 3.62Å; Y48-V279 HydrophobicContact CE1-CG1 3.9Å; Y48-V279 HydrophobicContact CE1-CG2 3.6Å; Y48-I338 HydrophobicContact CE1-CD1 4.27Å; Y48-I338 WeakPolarHBondContact OH-CD1 3.23Å
49	D	66.1	Low	67.8	Low	55 Å²	55	49.9 Å²	49.9	29%	0.294	25%	0.245	S	C	.	.	H	α-helix	trans	-59.4	-49.3	173.3	-66	-24.6	0	0	0	110.1	E45 I47 V51 A52 I53 I270 V275	E45-D49 VanDerWaalsContact O-CG 3.22Å; E45-D49 PolarHBondContact O-N 3.29Å; I47-D49 VanDerWaalsContact C-N 3.34Å; D49-V51 VanDerWaalsContact C-N 3.33Å; D49-V51 PolarHBondContact O-N 3.25Å; D49-A52 PolarHBondContact O-N 3.03Å; D49-A52 VanDerWaalsContact O-N 3.13Å; D49-I53 VanDerWaalsContact O-CG1 3.3Å; D49-I53 WeakPolarHBondContact O-CG1 3.4Å; D49-I53 PolarHBondContact O-N 2.75Å; D49-I270 HydrophobicContact CB-CD1 4.38Å; D49-V275 WeakPolarHBondContact OD1-CG2 3.29Å
50	E	65.5	Low	69.8	Low	29 Å²	29	47.6 Å²	47.6	14%	0.136	23%	0.23	C	C	.	.	H	α-helix	trans	-54.9	-47.2	177.6	-168.2	-165.9	167.1	0	0	112	K16 R46 I47 I53 Q54 S137	K16-E50 IonicContact NZ-OE1 3.69Å; K16-E50 PolarHBondContact NZ-OE1 2.81Å; K16-E50 IonicContact NZ-OE2 2.75Å; K16-E50 PolarHBondContact NZ-OE2 3.49Å; R46-E50 WeakPolarHBondContact O-CB 3.22Å; R46-E50 PolarHBondContact O-N 3.46Å; I47-E50 PolarHBondContact O-N 2.78Å; E50-I53 PolarHBondContact O-N 3.2Å; E50-Q54 WeakPolarHBondContact O-CG 3.29Å; E50-Q54 PolarHBondContact O-N 2.95Å; E50-Q54 PolarHBondContact OE1-NE2 3.25Å; E50-S137 PolarHBondContact OE1-OG 3.11Å
51	V	67.8	Low	71.8	Confident	3 Å²	3	40.3 Å²	40.3	2%	0.018	20%	0.198	C	C	.	.	H	α-helix	trans	-69.7	-36.3	178.8	174.3	0	0	0	0	112.2	I47 Y48 D49 I53 Q54 K55 A334 L336	I47-V51 WeakPolarHBondContact O-CG2 3.42Å; I47-V51 PolarHBondContact O-N 2.76Å; Y48-V51 PolarHBondContact O-N 3.12Å; D49-V51 VanDerWaalsContact C-N 3.33Å; D49-V51 PolarHBondContact O-N 3.25Å; V51-I53 VanDerWaalsContact C-N 3.34Å; V51-Q54 PolarHBondContact O-N 2.81Å; V51-K55 WeakPolarHBondContact O-CG 3.19Å; V51-K55 PolarHBondContact O-N 3.38Å; V51-A334 HydrophobicContact CG1-CB 4.36Å; V51-L336 HydrophobicContact CB-CD1 4.19Å; V51-L336 HydrophobicContact CG2-CD1 3.33Å
52	A	71.3	Confident	73.4	Confident	2 Å²	2	37.2 Å²	37.2	2%	0.017	18%	0.179	C	C	.	.	H	α-helix	trans	-63.5	-40.3	175.2	0	0	0	0	0	111.6	Y48 D49 K55 K56 I270 D274 V275	Y48-A52 VanDerWaalsContact O-CB 3.27Å; Y48-A52 WeakPolarHBondContact O-CB 3.49Å; Y48-A52 PolarHBondContact O-N 2.59Å; D49-A52 PolarHBondContact O-N 3.03Å; D49-A52 VanDerWaalsContact O-N 3.13Å; A52-K55 PolarHBondContact O-N 3.08Å; A52-K56 PolarHBondContact O-N 3.34Å; A52-I270 HydrophobicContact CB-CD1 4.48Å; A52-I270 HydrophobicContact CB-CG2 3.56Å; A52-D274 HydrophobicContact CB-CB 4.39Å; A52-V275 HydrophobicContact CB-CG2 4.34Å
53	I	73.2	Confident	74.2	Confident	7 Å²	7	36.8 Å²	36.8	4%	0.036	18%	0.178	C	C	.	.	H	α-helix	trans	-61.4	-51.8	173.1	-62.8	167.3	0	0	0	109.8	D49 E50 V51 K55 K56 L57 I111 Q139 I270	D49-I53 VanDerWaalsContact O-CG1 3.3Å; D49-I53 WeakPolarHBondContact O-CG1 3.4Å; D49-I53 PolarHBondContact O-N 2.75Å; E50-I53 PolarHBondContact O-N 3.2Å; V51-I53 VanDerWaalsContact C-N 3.34Å; I53-K55 VanDerWaalsContact C-N 3.27Å; I53-K55 PolarHBondContact O-N 2.84Å; I53-K56 CarbonylContact O-C 3.46Å; I53-K56 WeakPolarHBondContact O-CA 3.46Å; I53-K56 PolarHBondContact O-N 3.37Å; I53-L57 HydrophobicContact CG2-CD2 4.03Å; I53-L57 WeakPolarHBondContact O-CG 3.26Å; I53-L57 PolarHBondContact O-N 2.63Å; I53-I111 HydrophobicContact CG2-CD1 3.62Å; I53-I111 HydrophobicContact CG2-CG1 4.49Å; I53-Q139 HydrophobicContact CD1-CG 4.3Å; I53-I270 HydrophobicContact CB-CD1 4.45Å; I53-I270 HydrophobicContact CD1-CD1 3.79Å; I53-I270 HydrophobicContact CG1-CD1 3.16Å; I53-I270 HydrophobicContact CG1-CG1 3.73Å
54	Q	69.5	Low	74.7	Confident	19 Å²	19	40.6 Å²	40.6	9%	0.089	19%	0.194	C	C	.	.	H	α-helix	trans	-57.4	-39.3	-178.8	-73.1	177.3	4.5	0	0	112.5	E50 V51 K56 L57 F134 S137	E50-Q54 WeakPolarHBondContact O-CG 3.29Å; E50-Q54 PolarHBondContact O-N 2.95Å; E50-Q54 PolarHBondContact OE1-NE2 3.25Å; V51-Q54 PolarHBondContact O-N 2.81Å; Q54-K56 VanDerWaalsContact C-N 3.27Å; Q54-K56 PolarHBondContact O-N 3.37Å; Q54-L57 PolarHBondContact O-N 3.22Å; Q54-F134 HydrophobicContact CG-CB 4.47Å; Q54-S137 PolarHBondContact NE2-OG 3.03Å
55	K	72.2	Confident	74.5	Confident	42 Å²	42	42.3 Å²	42.3	18%	0.183	20%	0.203	C	C	.	.	H	α-helix	trans	-62.5	-32.5	173.1	-78	-172.6	177.9	-169.4	0	113.3	V51 A52 I53 L65 N277 S278	V51-K55 WeakPolarHBondContact O-CG 3.19Å; V51-K55 PolarHBondContact O-N 3.38Å; A52-K55 PolarHBondContact O-N 3.08Å; I53-K55 VanDerWaalsContact C-N 3.27Å; I53-K55 PolarHBondContact O-N 2.84Å; K55-L65 HydrophobicContact CG-CD2 3.53Å; K55-L65 HydrophobicContact CG-CG 4.18Å; K55-N277 PolarHBondContact NZ-O 3.11Å; K55-S278 WeakPolarHBondContact CE-O 3.49Å; K55-S278 PolarHBondContact NZ-O 3.18Å
56	K	78.8	Confident	74	Confident	68 Å²	68	43.4 Å²	43.4	30%	0.296	21%	0.211	S	C	.	.	H	α-helix	trans	-91.6	-6.4	-179	-76.1	-162.3	174.9	-169.1	0	114.7	A52 I53 Q54 D58 V268 T269 D274	A52-K56 PolarHBondContact O-N 3.34Å; I53-K56 CarbonylContact O-C 3.46Å; I53-K56 WeakPolarHBondContact O-CA 3.46Å; I53-K56 PolarHBondContact O-N 3.37Å; Q54-K56 VanDerWaalsContact C-N 3.27Å; Q54-K56 PolarHBondContact O-N 3.37Å; K56-D58 PolarHBondContact O-N 2.97Å; K56-V268 HydrophobicContact CB-CG1 3.37Å; K56-V268 HydrophobicContact CD-CG1 3.77Å; K56-V268 HydrophobicContact CG-CG1 4.25Å; K56-T269 PolarHBondContact NZ-O 3.47Å; K56-D274 WeakPolarHBondContact CE-OD1 3.47Å; K56-D274 WeakPolarHBondContact CE-OD2 3.32Å; K56-D274 VanDerWaalsContact NZ-CG 3.26Å; K56-D274 IonicContact NZ-OD1 3.75Å; K56-D274 PolarHBondContact NZ-OD1 3.03Å; K56-D274 IonicContact NZ-OD2 3.73Å; K56-D274 PolarHBondContact NZ-OD2 3.12Å
57	L	83.2	Confident	72.8	Confident	1 Å²	1	41.5 Å²	41.5	1%	0.005	21%	0.208	C	C	.	.			trans	-60	125.5	175.4	-65	178.7	0	0	0	110	I53 Q54 I62 Y105 L106 Q109 I111 F134	I53-L57 HydrophobicContact CG2-CD2 4.03Å; I53-L57 WeakPolarHBondContact O-CG 3.26Å; I53-L57 PolarHBondContact O-N 2.63Å; Q54-L57 PolarHBondContact O-N 3.22Å; L57-I62 HydrophobicContact CB-CG2 4.28Å; L57-I62 HydrophobicContact CD1-CG2 4.46Å; L57-Y105 WeakPolarHBondContact CA-OH 3.43Å; L57-Y105 HydrophobicContact CB-CE1 4.08Å; L57-Y105 HydrophobicContact CD2-CE1 3.7Å; L57-Y105 HydrophobicContact CG-CE1 4.38Å; L57-L106 HydrophobicContact CD1-CD2 3.71Å; L57-Q109 HydrophobicContact CD2-CB 4.17Å; L57-Q109 HydrophobicContact CD2-CG 3.97Å; L57-I111 HydrophobicContact CD1-CD1 3.92Å; L57-I111 HydrophobicContact CD2-CD1 3.79Å; L57-I111 HydrophobicContact CG-CD1 4.36Å; L57-F134 HydrophobicContact CD1-CE1 4.46Å; L57-F134 HydrophobicContact CD1-CZ 4.33Å
58	D	84.2	Confident	71.4	Confident	95 Å²	95	42 Å²	42	51%	0.508	21%	0.212	S	C	.	.			trans	-136	100.6	-178.9	-156	-4.5	0	0	0	110.5	K56 K64 Y105	K56-D58 PolarHBondContact O-N 2.97Å; D58-K64 VanDerWaalsContact CG-NZ 3.35Å; D58-K64 IonicContact OD1-NZ 3.42Å; D58-K64 IonicContact OD2-NZ 3.74Å; D58-K64 PolarHBondContact OD2-NZ 3.45Å; D58-Y105 PolarHBondContact N-OH 3.23Å; D58-Y105 VanDerWaalsContact N-OH 3.09Å
59	H	87.3	Confident	69.6	Low	6 Å²	6	50.6 Å²	50.6	3%	0.028	24%	0.244	C	C	.	.			trans	-152.3	141	-178.9	-176.9	-87.6	0	0	0	109.8	N61 I62 Y105 Y264	H59-N61 PolarHBondContact CE1-OD1 2.93Å; H59-N61 VanDerWaalsContact CE1-OD1 3.27Å; H59-N61 PolarHBondContact ND1-N 3.1Å; H59-N61 PolarHBondContact O-N 2.92Å; H59-N61 VanDerWaalsContact O-N 3.14Å; H59-I62 HydrophobicContact CB-CB 4.01Å; H59-I62 HydrophobicContact CB-CG1 3.77Å; H59-I62 PolarHBondContact O-N 2.74Å; H59-Y105 HydrophobicContact CB-CD1 3.63Å; H59-Y105 HydrophobicContact CB-CD2 4.12Å; H59-Y105 HydrophobicContact CB-CE1 3.83Å; H59-Y105 HydrophobicContact CB-CE2 4.32Å; H59-Y105 HydrophobicContact CB-CG 3.78Å; H59-Y105 AromaticContact CD2-CD2 3.83Å; H59-Y105 AromaticContact CD2-CG 3.66Å; H59-Y105 AromaticContact CG-CG 3.78Å; H59-Y264 AromaticContact CD2-CD1 3.96Å; H59-Y264 AromaticContact CD2-CD2 3.91Å; H59-Y264 AromaticContact CD2-CE1 3.66Å; H59-Y264 AromaticContact CD2-CE2 3.57Å; H59-Y264 AromaticContact CD2-CZ 3.46Å; H59-Y264 VanDerWaalsContact CD2-CZ 3.46Å; H59-Y264 AromaticContact NE2-CD2 3.94Å; H59-Y264 AromaticContact NE2-CE2 3.5Å; H59-Y264 WeakPolarHBondContact NE2-CE2 3.48Å; H59-Y264 AromaticContact NE2-CZ 3.8Å
60	P	88.6	Confident	68	Low	69 Å²	69	52.2 Å²	52.2	45%	0.448	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-34.4	-178.4	20.1	-33.7	0	0	0	113.4	K130 Y264	P60-K130 WeakPolarHBondContact O-CG 3.46Å; P60-K130 PolarHBondContact O-NZ 3.1Å; P60-Y264 WeakPolarHBondContact CD-OH 3.46Å
61	N	91.5	Very high	66.7	Low	8 Å²	8	60 Å²	60	4%	0.043	29%	0.292	C	S	.	.	T	Hydrogen-bonded Turn	trans	-99.6	17.9	178.5	-49.4	104.5	0	0	0	114.6	H59 D98 L129 K130 I131	H59-N61 PolarHBondContact CE1-OD1 2.93Å; H59-N61 VanDerWaalsContact CE1-OD1 3.27Å; H59-N61 PolarHBondContact ND1-N 3.1Å; H59-N61 PolarHBondContact O-N 2.92Å; H59-N61 VanDerWaalsContact O-N 3.14Å; N61-D98 WeakPolarHBondContact CB-O 3.38Å; N61-D98 VanDerWaalsContact CG-O 3.3Å; N61-D98 WeakPolarHBondContact ND2-CB 3.36Å; N61-D98 PolarHBondContact ND2-OD1 2.9Å; N61-D98 VanDerWaalsContact ND2-OD1 3.09Å; N61-L129 WeakPolarHBondContact CA-O 3.14Å; N61-L129 WeakPolarHBondContact CB-O 3.1Å; N61-L129 PolarHBondContact ND2-O 3.45Å; N61-K130 CarbonylContact O-C 3.53Å; N61-K130 WeakPolarHBondContact O-CA 3.4Å; N61-I131 PolarHBondContact O-N 3.42Å
62	I	87.9	Confident	65.6	Low	2 Å²	2	68.4 Å²	68.4	1%	0.01	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-117.5	138.8	169.9	-62.2	-58.9	0	0	0	108.9	L57 H59 K64 G102 Y105 L106 I131 F134	L57-I62 HydrophobicContact CB-CG2 4.28Å; L57-I62 HydrophobicContact CD1-CG2 4.46Å; H59-I62 HydrophobicContact CB-CB 4.01Å; H59-I62 HydrophobicContact CB-CG1 3.77Å; H59-I62 PolarHBondContact O-N 2.74Å; I62-K64 PolarHBondContact O-N 2.71Å; I62-G102 WeakPolarHBondContact CD1-O 3.5Å; I62-Y105 HydrophobicContact CG1-CD1 3.82Å; I62-Y105 HydrophobicContact CG1-CE1 4.3Å; I62-L106 HydrophobicContact CD1-CD1 3.85Å; I62-L106 HydrophobicContact CD1-CD2 4.06Å; I62-L106 HydrophobicContact CD1-CG 3.81Å; I62-I131 HydrophobicContact CD1-CB 3.76Å; I62-I131 HydrophobicContact CD1-CD1 3.96Å; I62-I131 HydrophobicContact CD1-CG1 4.12Å; I62-F134 HydrophobicContact CD1-CZ 4.44Å; I62-F134 HydrophobicContact CG2-CE2 4.23Å; I62-F134 HydrophobicContact CG2-CZ 3.8Å
63	V	80.7	Confident	64.9	Low	39 Å²	39	71.7 Å²	71.7	24%	0.236	35%	0.354	C	S	.	.			trans	-71.2	109.8	168.5	177.2	0	0	0	0	108.1	L65 L122 K130 I131	V63-L65 PolarHBondContact O-N 2.87Å; V63-L122 HydrophobicContact CG2-CD1 4.2Å; V63-K130 HydrophobicContact CG2-CB 3.61Å; V63-K130 HydrophobicContact CG2-CD 4.3Å; V63-I131 WeakPolarHBondContact CG2-O 3.46Å; V63-I131 PolarHBondContact N-O 2.78Å
64	K	71.8	Confident	64.4	Low	88 Å²	88	77 Å²	77	38%	0.383	38%	0.381	S	S	.	.			trans	-66.6	127.2	172.8	-170.3	166.1	-168.6	167.5	0	108.7	D58 I62 I66	D58-K64 VanDerWaalsContact CG-NZ 3.35Å; D58-K64 IonicContact OD1-NZ 3.42Å; D58-K64 IonicContact OD2-NZ 3.74Å; D58-K64 PolarHBondContact OD2-NZ 3.45Å; I62-K64 PolarHBondContact O-N 2.71Å; K64-I66 HydrophobicContact CB-CG1 4.22Å; K64-I66 HydrophobicContact CD-CG1 4.45Å; K64-I66 HydrophobicContact CG-CG1 4.09Å; K64-I66 PolarHBondContact O-N 3.2Å
65	L	61.7	Low	64.5	Low	48 Å²	48	78 Å²	78	25%	0.251	39%	0.386	S	S	.	.			trans	-74.1	83.4	173.3	-176.6	67.4	0	0	0	108.4	K55 V63 A334	K55-L65 HydrophobicContact CG-CD2 3.53Å; K55-L65 HydrophobicContact CG-CG 4.18Å; V63-L65 PolarHBondContact O-N 2.87Å; L65-A334 HydrophobicContact CD1-CB 4.26Å; L65-A334 HydrophobicContact CD2-CB 3.67Å; L65-A334 HydrophobicContact CG-CB 4.42Å
66	I	53.8	Low	64.9	Low	116 Å²	116	83.9 Å²	83.9	60%	0.595	41%	0.407	S	S	*	.			trans	-76.9	133	177.7	-60.3	176.3	0	0	0	108.6	K64 V68	K64-I66 HydrophobicContact CB-CG1 4.22Å; K64-I66 HydrophobicContact CD-CG1 4.45Å; K64-I66 HydrophobicContact CG-CG1 4.09Å; K64-I66 PolarHBondContact O-N 3.2Å; I66-V68 PolarHBondContact O-N 3.38Å
67	E	40.7	Very low	65.1	Low	97 Å²	97	81.3 Å²	81.3	45%	0.453	40%	0.397	S	S	.	.			trans	-68.6	80.5	164.9	-158.9	174.5	171.3	0	0	109	R69 R280	E67-R69 PolarHBondContact O-N 3.46Å; E67-R280 IonicContact OE1-CZ 2.69Å; E67-R280 IonicContact OE1-NE 3.47Å; E67-R280 IonicContact OE1-NH1 3.77Å; E67-R280 IonicContact OE1-NH2 2.75Å; E67-R280 PolarHBondContact OE1-NH2 3.17Å
68	V	36.1	Very low	65.3	Low	34 Å²	34	81.8 Å²	81.8	21%	0.206	40%	0.4	C	S	.	.	S	Bend	trans	28.1	91.6	159.3	-152.3	0	0	0	0	117.2	I66 P331 I332	I66-V68 PolarHBondContact O-N 3.38Å; V68-P331 HydrophobicContact CB-CB 3.13Å; V68-P331 HydrophobicContact CG1-CB 3.19Å; V68-P331 VanDerWaalsContact CG2-C 3.46Å; V68-P331 HydrophobicContact CG2-CB 3.62Å; V68-I332 VanDerWaalsContact CG2-O 3.27Å; V68-I332 WeakPolarHBondContact CG2-O 3.38Å
69	R	30.2	Very low	65.5	Low	234 Å²	234	78 Å²	78	88%	0.883	38%	0.38	S	S	*	.			trans	-130.2	108.3	140.6	-72.6	-171.8	168.8	112.1	-3.9	106.7	E67 K71	E67-R69 PolarHBondContact O-N 3.46Å; R69-K71 PolarHBondContact O-N 3.08Å; R69-K71 VanDerWaalsContact O-N 3.16Å
70	C	32.3	Very low	65.5	Low	90 Å²	90	83.9 Å²	83.9	61%	0.608	41%	0.407	S	S	*	.			trans	-79.6	95.7	-177.6	-158.2	0	0	0	0	109.4
71	K	37.8	Very low	65.5	Low	191 Å²	191	83.2 Å²	83.2	83%	0.83	40%	0.399	S	S	*	.			trans	-87.2	134	143.2	-75.3	-173.8	176.8	-177.2	0	105.7	R69 S73	R69-K71 PolarHBondContact O-N 3.08Å; R69-K71 VanDerWaalsContact O-N 3.16Å; K71-S73 PolarHBondContact O-N 2.64Å
72	Q	45.7	Very low	65.5	Low	180 Å²	180	88.6 Å²	88.6	84%	0.841	44%	0.435	S	S	*	.			trans	-60.3	70.2	-172.1	-63.2	163.2	-27.8	0	0	112.7	L74	Q72-L74 PolarHBondContact O-N 2.84Å; Q72-L74 VanDerWaalsContact O-N 3.09Å
73	S	54.9	Low	65.7	Low	71 Å²	71	90.4 Å²	90.4	50%	0.497	45%	0.446	S	S	.	.			trans	-76.1	99.7	168.3	55.8	0	0	0	0	107.4	K71 F75	K71-S73 PolarHBondContact O-N 2.64Å; S73-F75 WeakPolarHBondContact O-CD2 3.05Å; S73-F75 PolarHBondContact O-N 3.47Å; S73-F75 WeakPolarHBondContact OG-CE2 3.08Å
74	L	64.1	Low	66.3	Low	118 Å²	118	96.5 Å²	96.5	62%	0.618	48%	0.477	S	S	*	.			trans	-74.3	95.1	179.9	-169.5	74	0	0	0	108.8	Q72 E125	Q72-L74 PolarHBondContact O-N 2.84Å; Q72-L74 VanDerWaalsContact O-N 3.09Å; L74-E125 PolarHBondContact N-OE1 3.12Å
75	F	71.3	Confident	67.4	Low	40 Å²	40	96.9 Å²	96.9	18%	0.175	49%	0.491	C	S	.	.			trans	-83.2	139.7	169.8	-65.5	-66	0	0	0	110	F12 S73 L122 L123 T124 K130	F12-F75 HydrophobicContact CD2-CB 4.32Å; F12-F75 WeakPolarHBondContact CE2-O 3.43Å; S73-F75 WeakPolarHBondContact O-CD2 3.05Å; S73-F75 PolarHBondContact O-N 3.47Å; S73-F75 WeakPolarHBondContact OG-CE2 3.08Å; F75-L122 HydrophobicContact CB-CB 4.11Å; F75-L122 HydrophobicContact CB-CD1 3.93Å; F75-L122 HydrophobicContact CB-CG 4.47Å; F75-L122 HydrophobicContact CD1-CB 4.28Å; F75-L122 HydrophobicContact CG-CB 4.41Å; F75-L122 HydrophobicContact CG-CD1 4.25Å; F75-L123 WeakPolarHBondContact CA-O 3.45Å; F75-T124 HydrophobicContact CD1-CG2 4.35Å; F75-T124 HydrophobicContact CE1-CG2 3.71Å; F75-K130 HydrophobicContact CE1-CD 4.02Å; F75-K130 HydrophobicContact CZ-CD 4.41Å
76	R	80.6	Confident	69	Low	167 Å²	167	95.8 Å²	95.8	63%	0.63	49%	0.487	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-128	148.9	169.8	63.5	-179.9	179.4	176.5	-0.3	110.1	L122 L123	R76-L122 CarbonylContact O-C 3.54Å; R76-L122 WeakPolarHBondContact O-CA 3.46Å; R76-L123 HydrophobicContact CG-CB 4.11Å; R76-L123 PolarHBondContact N-O 3.31Å; R76-L123 PolarHBondContact O-N 3.45Å
77	P	83.6	Confident	71	Confident	14 Å²	14	91.8 Å²	91.8	9%	0.091	47%	0.466	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-51.8	143.8	167.4	-28.2	38.2	0	0	0	111.5	F12 L79 E80	F12-P77 HydrophobicContact CZ-CG 3.89Å; P77-L79 PolarHBondContact O-N 2.97Å; P77-E80 HydrophobicContact CB-CG 4.45Å
78	V	86.2	Confident	73.7	Confident	11 Å²	11	91.3 Å²	91.3	7%	0.067	47%	0.47	C	S	.	.	S	Bend	trans	-60.7	-40	176.1	174	0	0	0	0	111.1	L87 H95 L121 L123 L129 F187	V78-L87 HydrophobicContact CG1-CD1 3.99Å; V78-H95 HydrophobicContact CG1-CB 4.24Å; V78-L121 HydrophobicContact CG2-CB 3.85Å; V78-L121 WeakPolarHBondContact CG2-O 3.4Å; V78-L121 PolarHBondContact N-O 3.27Å; V78-L123 HydrophobicContact CB-CD1 4.4Å; V78-L123 HydrophobicContact CB-CD2 4.48Å; V78-L123 HydrophobicContact CB-CG 4.17Å; V78-L123 HydrophobicContact CG2-CD1 4.32Å; V78-L123 HydrophobicContact CG2-CD2 3.63Å; V78-L123 HydrophobicContact CG2-CG 3.58Å; V78-L129 HydrophobicContact CG2-CB 4.45Å; V78-L129 HydrophobicContact CG2-CD1 3.4Å; V78-L129 VanDerWaalsContact CG2-CD1 3.4Å; V78-L129 HydrophobicContact CG2-CG 3.83Å; V78-F187 HydrophobicContact CB-CE1 3.94Å; V78-F187 HydrophobicContact CB-CZ 4.04Å; V78-F187 HydrophobicContact CG1-CD1 4.23Å; V78-F187 HydrophobicContact CG1-CE1 3.49Å; V78-F187 VanDerWaalsContact CG1-CE1 3.49Å; V78-F187 HydrophobicContact CG1-CE2 4.35Å; V78-F187 HydrophobicContact CG1-CZ 3.55Å; V78-F187 HydrophobicContact CG2-CZ 4.49Å
79	L	88.3	Confident	76.6	Confident	16 Å²	16	91.6 Å²	91.6	8%	0.084	47%	0.469	C	S	.	.			trans	-152.4	135.1	177.9	-166.2	68.5	0	0	0	109.6	P77 I81 T83 L87 P118 A186 F187	P77-L79 PolarHBondContact O-N 2.97Å; L79-I81 HydrophobicContact CD2-CG2 3.81Å; L79-I81 HydrophobicContact CG-CG2 4.06Å; L79-T83 HydrophobicContact CD1-CG2 3.81Å; L79-T83 HydrophobicContact CD2-CG2 4Å; L79-T83 HydrophobicContact CG-CG2 3.92Å; L79-L87 HydrophobicContact CD1-CD2 4.34Å; L79-L87 HydrophobicContact CD1-CG 4.37Å; L79-P118 HydrophobicContact CB-CB 4.22Å; L79-P118 WeakPolarHBondContact O-CB 3.45Å; L79-A186 VanDerWaalsContact CD2-O 3.23Å; L79-A186 WeakPolarHBondContact CD2-O 3.49Å; L79-F187 HydrophobicContact CB-CD1 4.16Å; L79-F187 HydrophobicContact CB-CE1 4.32Å; L79-F187 HydrophobicContact CD2-CD1 4.28Å
80	E	88.7	Confident	79.7	Confident	128 Å²	128	85.4 Å²	85.4	60%	0.598	45%	0.453	S	S	*	.			trans	-92.8	133	164.6	-64.9	-172.9	166	0	0	108.4	P77 T83	P77-E80 HydrophobicContact CB-CG 4.45Å; E80-T83 VanDerWaalsContact O-CB 3.27Å; E80-T83 WeakPolarHBondContact O-CB 3.48Å; E80-T83 VanDerWaalsContact O-CG2 3.24Å; E80-T83 WeakPolarHBondContact O-CG2 3.2Å
81	I	88.8	Confident	82.7	Confident	55 Å²	55	81.7 Å²	81.7	28%	0.282	43%	0.429	S	S	.	.	S	Bend	trans	-123.1	148.7	-179.6	62.3	168.9	0	0	0	110.5	L79 T83 P118 F156 A186 V192	L79-I81 HydrophobicContact CD2-CG2 3.81Å; L79-I81 HydrophobicContact CG-CG2 4.06Å; I81-T83 HydrophobicContact CG2-CG2 4.46Å; I81-P118 HydrophobicContact CD1-CG 4.4Å; I81-F156 HydrophobicContact CD1-CE2 4.46Å; I81-F156 HydrophobicContact CD1-CZ 3.83Å; I81-A186 HydrophobicContact CD1-CB 4.12Å; I81-A186 HydrophobicContact CG2-CB 4.28Å; I81-V192 HydrophobicContact CD1-CG1 3.92Å
82	P	90.5	Very high	85.6	Confident	121 Å²	121	72.6 Å²	72.6	79%	0.786	39%	0.39	S	S	*	.	S	Bend	cis	-69.9	151.9	-3.9	31.4	-35.4	0	0	0	112.7	G190	P82-G190 CarbonylContact C-O 3.56Å; P82-G190 VanDerWaalsContact CA-O 3.22Å; P82-G190 WeakPolarHBondContact CA-O 3.37Å
83	T	93.1	Very high	88.1	Confident	40 Å²	40	65 Å²	65	25%	0.245	35%	0.354	C	S	.	.			trans	-148.7	143.3	178	-178.8	0	0	0	0	112.1	L79 E80 I81 S85 G190	L79-T83 HydrophobicContact CD1-CG2 3.81Å; L79-T83 HydrophobicContact CD2-CG2 4Å; L79-T83 HydrophobicContact CG-CG2 3.92Å; E80-T83 VanDerWaalsContact O-CB 3.27Å; E80-T83 WeakPolarHBondContact O-CB 3.48Å; E80-T83 VanDerWaalsContact O-CG2 3.24Å; E80-T83 WeakPolarHBondContact O-CG2 3.2Å; I81-T83 HydrophobicContact CG2-CG2 4.46Å; T83-S85 VanDerWaalsContact C-N 3.27Å; T83-S85 PolarHBondContact OG1-N 3.33Å; T83-S85 VanDerWaalsContact OG1-N 3.09Å; T83-G190 PolarHBondContact N-O 3.32Å
84	D	92.6	Very high	90	Very high	168 Å²	168	69.2 Å²	69.2	90%	0.898	36%	0.358	S	S	*	.	S	Bend	trans	-86	-0.3	173	-58.3	-40	0	0	0	112.3	P86	D84-P86 VanDerWaalsContact O-CD 3.23Å; D84-P86 WeakPolarHBondContact O-CD 3.36Å
85	S	94.4	Very high	91.5	Very high	95 Å²	95	64.3 Å²	64.3	66%	0.664	33%	0.332	S	S	*	.	S	Bend	trans	-116.3	61	177	-62.8	0	0	0	0	112.3	T83	T83-S85 VanDerWaalsContact C-N 3.27Å; T83-S85 PolarHBondContact OG1-N 3.33Å; T83-S85 VanDerWaalsContact OG1-N 3.09Å
86	P	95.3	Very high	92.8	Very high	26 Å²	26	62.5 Å²	62.5	17%	0.169	32%	0.324	C	S	.	.	P	Polyproline II helix	trans	-67.3	154.5	176.8	28.2	-33.9	0	0	0	112.4	D84 V188 R217	D84-P86 VanDerWaalsContact O-CD 3.23Å; D84-P86 WeakPolarHBondContact O-CD 3.36Å; P86-V188 WeakPolarHBondContact CB-O 3.39Å; P86-R217 PolarHBondContact O-NH2 2.88Å
87	L	96.3	Very high	93.6	Very high	31 Å²	31	56.4 Å²	56.4	16%	0.162	30%	0.301	C	S	.	.	P	Polyproline II helix	trans	-64.2	148.2	-177.2	-57.9	-178	0	0	0	111.6	V78 L79 A91 A92 F187 R217	V78-L87 HydrophobicContact CG1-CD1 3.99Å; L79-L87 HydrophobicContact CD1-CD2 4.34Å; L79-L87 HydrophobicContact CD1-CG 4.37Å; L87-A91 HydrophobicContact CB-CB 4.18Å; L87-A92 HydrophobicContact CB-CB 4.36Å; L87-F187 WeakPolarHBondContact CB-O 3.37Å; L87-F187 HydrophobicContact CD1-CB 4.06Å; L87-F187 HydrophobicContact CD1-CD1 4.14Å; L87-F187 HydrophobicContact CD1-CD2 4.49Å; L87-F187 HydrophobicContact CD1-CG 4Å; L87-F187 PolarHBondContact N-O 2.92Å; L87-R217 PolarHBondContact O-NH1 2.88Å
88	T	96.5	Very high	94.1	Very high	87 Å²	87	57.6 Å²	57.6	53%	0.534	31%	0.307	S	S	.	.	P	Polyproline II helix	trans	-62.4	153.8	167.4	63.7	0	0	0	0	110.1	N90 A91 A92	T88-N90 PolarHBondContact O-N 3.43Å; T88-N90 VanDerWaalsContact O-N 3.17Å; T88-A91 PolarHBondContact O-N 2.85Å; T88-A91 WeakPolarHBondContact OG1-CB 3.24Å; T88-A91 PolarHBondContact OG1-N 2.88Å; T88-A92 PolarHBondContact O-N 2.89Å
89	E	96.8	Very high	94.6	Very high	41 Å²	41	57.1 Å²	57.1	19%	0.192	30%	0.304	C	S	.	.	H	α-helix	trans	-54.7	-39	179.7	-168.6	178.5	134.6	0	0	112	A92 R93 I219 S220 L223 W249	E89-A92 PolarHBondContact O-N 3.4Å; E89-R93 WeakPolarHBondContact O-CB 3.3Å; E89-R93 PolarHBondContact O-N 3.47Å; E89-R93 IonicContact OE1-NH2 2.97Å; E89-R93 PolarHBondContact OE1-NH2 3.4Å; E89-R93 VanDerWaalsContact OE1-NH2 3.1Å; E89-I219 WeakPolarHBondContact OE2-CA 3.05Å; E89-S220 VanDerWaalsContact OE1-CB 3.28Å; E89-S220 WeakPolarHBondContact OE1-CB 3.34Å; E89-S220 PolarHBondContact OE1-OG 2.83Å; E89-S220 PolarHBondContact OE2-N 3.06Å; E89-L223 HydrophobicContact CG-CD2 3.86Å; E89-W249 HydrophobicContact CG-CZ2 3.92Å; E89-W249 PolarHBondContact OE1-NE1 3.24Å
90	N	95.9	Very high	95	Very high	103 Å²	103	56.3 Å²	56.3	55%	0.551	30%	0.3	S	S	*	.	H	α-helix	trans	-66.6	-38.7	175.9	-69.3	-16.7	0	0	0	113.1	T88 R93 R94	T88-N90 PolarHBondContact O-N 3.43Å; T88-N90 VanDerWaalsContact O-N 3.17Å; N90-R93 PolarHBondContact OD1-NH1 3.4Å; N90-R94 WeakPolarHBondContact O-CG 3.27Å; N90-R94 PolarHBondContact O-N 3.41Å
91	A	96.1	Very high	95.3	Very high	12 Å²	12	51.8 Å²	51.8	10%	0.099	28%	0.28	C	S	.	.	H	α-helix	trans	-69.3	-43.5	174.9	0	0	0	0	0	111.4	L87 T88 R93 R94 H95	L87-A91 HydrophobicContact CB-CB 4.18Å; T88-A91 PolarHBondContact O-N 2.85Å; T88-A91 WeakPolarHBondContact OG1-CB 3.24Å; T88-A91 PolarHBondContact OG1-N 2.88Å; A91-R93 VanDerWaalsContact C-N 3.32Å; A91-R93 PolarHBondContact O-N 3.13Å; A91-R94 PolarHBondContact O-N 3.02Å; A91-H95 PolarHBondContact O-CD2 3.13Å; A91-H95 VanDerWaalsContact O-CD2 3.24Å; A91-H95 PolarHBondContact O-N 2.93Å
92	A	97.6	Very high	95.5	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-57.2	-44.4	174.1	0	0	0	0	0	111.3	L87 T88 E89 R94 H95 F96 L184 F187 V188	L87-A92 HydrophobicContact CB-CB 4.36Å; T88-A92 PolarHBondContact O-N 2.89Å; E89-A92 PolarHBondContact O-N 3.4Å; A92-R94 PolarHBondContact O-N 3.26Å; A92-H95 PolarHBondContact O-N 3.21Å; A92-F96 WeakPolarHBondContact O-CB 3.49Å; A92-F96 PolarHBondContact O-N 3.38Å; A92-L184 HydrophobicContact CB-CD1 4.33Å; A92-F187 HydrophobicContact CB-CB 3.92Å; A92-V188 HydrophobicContact CB-CG2 3.68Å
93	R	97.7	Very high	95.7	Very high	22 Å²	22	43.4 Å²	43.4	8%	0.083	23%	0.229	C	C	.	.	H	α-helix	trans	-58.8	-46.8	176.2	-171.2	-175.3	-62.4	101.3	6.1	112.9	E89 N90 A91 H95 F96 R97 W249	E89-R93 WeakPolarHBondContact O-CB 3.3Å; E89-R93 PolarHBondContact O-N 3.47Å; E89-R93 IonicContact OE1-NH2 2.97Å; E89-R93 PolarHBondContact OE1-NH2 3.4Å; E89-R93 VanDerWaalsContact OE1-NH2 3.1Å; N90-R93 PolarHBondContact OD1-NH1 3.4Å; A91-R93 VanDerWaalsContact C-N 3.32Å; A91-R93 PolarHBondContact O-N 3.13Å; R93-H95 PolarHBondContact O-N 3.32Å; R93-F96 PolarHBondContact O-N 2.88Å; R93-R97 VanDerWaalsContact O-CG 3.26Å; R93-R97 WeakPolarHBondContact O-CG 3.18Å; R93-R97 PolarHBondContact O-N 3.04Å; R93-W249 HydrophobicContact CB-CH2 3.59Å; R93-W249 HydrophobicContact CB-CZ2 3.69Å; R93-W249 HydrophobicContact CB-CZ3 4.12Å; R93-W249 VanDerWaalsContact CD-O 3.22Å; R93-W249 WeakPolarHBondContact CD-O 3.39Å; R93-W249 HydrophobicContact CG-CE3 4.3Å; R93-W249 HydrophobicContact CG-CH2 4.05Å; R93-W249 HydrophobicContact CG-CZ2 4.25Å; R93-W249 HydrophobicContact CG-CZ3 4.06Å; R93-W249 PolarHBondContact NE-O 3.15Å
94	R	95.8	Very high	95.7	Very high	158 Å²	158	42.2 Å²	42.2	60%	0.596	22%	0.22	S	C	*	.	H	α-helix	trans	-59	-49.9	179.5	-73.6	-174.1	-62.6	143.3	1.2	111.5	N90 A91 A92 R97 D98	N90-R94 WeakPolarHBondContact O-CG 3.27Å; N90-R94 PolarHBondContact O-N 3.41Å; A91-R94 PolarHBondContact O-N 3.02Å; A92-R94 PolarHBondContact O-N 3.26Å; R94-R97 PolarHBondContact O-N 3.49Å; R94-D98 PolarHBondContact O-N 2.51Å
95	H	96.6	Very high	95.7	Very high	16 Å²	16	34.7 Å²	34.7	7%	0.074	18%	0.18	C	C	.	.	H	α-helix	trans	-66.9	-40	178.4	-65.9	-35.8	0	0	0	112.3	V78 A91 A92 R93 R97 D98 A99 L123 L129 F187	V78-H95 HydrophobicContact CG1-CB 4.24Å; A91-H95 PolarHBondContact O-CD2 3.13Å; A91-H95 VanDerWaalsContact O-CD2 3.24Å; A91-H95 PolarHBondContact O-N 2.93Å; A92-H95 PolarHBondContact O-N 3.21Å; R93-H95 PolarHBondContact O-N 3.32Å; H95-R97 VanDerWaalsContact C-N 3.33Å; H95-R97 PolarHBondContact O-N 3.41Å; H95-D98 WeakPolarHBondContact O-CB 3.15Å; H95-D98 PolarHBondContact O-N 3.23Å; H95-A99 PolarHBondContact O-N 2.91Å; H95-L123 WeakPolarHBondContact CE1-CD2 3.36Å; H95-L129 HydrophobicContact CB-CD1 3.68Å; H95-L129 WeakPolarHBondContact O-CD1 3.39Å; H95-F187 HydrophobicContact CB-CE2 4.01Å
96	F	97.7	Very high	95.5	Very high	1 Å²	1	30.2 Å²	30.2	0%	0.004	15%	0.148	C	C	.	.	H	α-helix	trans	-60.4	-42.3	176.6	-176.3	-95.5	0	0	0	112.3	A92 R93 D98 A99 V100 L180 L184 L226 M230 I244 W249 V250	A92-F96 WeakPolarHBondContact O-CB 3.49Å; A92-F96 PolarHBondContact O-N 3.38Å; R93-F96 PolarHBondContact O-N 2.88Å; F96-D98 PolarHBondContact O-N 3.38Å; F96-A99 PolarHBondContact O-N 3.3Å; F96-A99 VanDerWaalsContact O-N 3.16Å; F96-V100 HydrophobicContact CD1-CG2 3.82Å; F96-V100 HydrophobicContact CE1-CG2 3.45Å; F96-V100 VanDerWaalsContact CE1-CG2 3.45Å; F96-V100 HydrophobicContact CE2-CG2 4.5Å; F96-V100 HydrophobicContact CG-CG2 4.49Å; F96-V100 HydrophobicContact CZ-CG2 3.83Å; F96-V100 WeakPolarHBondContact O-CG2 3.3Å; F96-V100 PolarHBondContact O-N 3.46Å; F96-L180 HydrophobicContact CD2-CD1 4.35Å; F96-L180 HydrophobicContact CD2-CG 4.34Å; F96-L180 HydrophobicContact CE2-CD1 4.16Å; F96-L180 HydrophobicContact CE2-CD2 3.92Å; F96-L180 HydrophobicContact CE2-CG 3.66Å; F96-L180 HydrophobicContact CZ-CD2 4.03Å; F96-L180 HydrophobicContact CZ-CG 4.27Å; F96-L184 HydrophobicContact CB-CD1 4.23Å; F96-L184 HydrophobicContact CD2-CB 3.75Å; F96-L184 HydrophobicContact CD2-CD1 3.9Å; F96-L184 HydrophobicContact CD2-CD2 3.85Å; F96-L184 HydrophobicContact CD2-CG 4.03Å; F96-L184 HydrophobicContact CE2-CB 3.8Å; F96-L184 HydrophobicContact CE2-CD2 3.67Å; F96-L184 HydrophobicContact CE2-CG 4.2Å; F96-L184 HydrophobicContact CG-CD1 4.19Å; F96-L184 HydrophobicContact CG-CD2 4.36Å; F96-L184 HydrophobicContact CZ-CD2 4.08Å; F96-L226 HydrophobicContact CE1-CD2 4.12Å; F96-L226 HydrophobicContact CZ-CD2 4.33Å; F96-M230 HydrophobicContact CE2-CE 3.89Å; F96-M230 HydrophobicContact CE2-SD 3.95Å; F96-M230 HydrophobicContact CZ-CE 3.84Å; F96-M230 HydrophobicContact CZ-SD 3.6Å; F96-I244 HydrophobicContact CE1-CG2 3.66Å; F96-I244 HydrophobicContact CZ-CG2 3.92Å; F96-W249 HydrophobicContact CB-CH2 4.41Å; F96-W249 HydrophobicContact CB-CZ3 4.19Å; F96-W249 AromaticContact CD1-CZ3 3.8Å; F96-W249 HydrophobicContact CD1-CZ3 3.8Å; F96-W249 HydrophobicContact CE1-CZ3 4.41Å; F96-W249 HydrophobicContact CG-CZ3 4.06Å; F96-V250 HydrophobicContact CD1-CG2 4.16Å; F96-V250 HydrophobicContact CE1-CG2 3.82Å
97	R	96.8	Very high	95.3	Very high	40 Å²	40	29.6 Å²	29.6	15%	0.151	14%	0.143	C	C	.	.	H	α-helix	trans	-58.2	-45.8	176	-74.4	170.3	64.3	91.7	0.3	112.2	R93 R94 H95 A99 V100 L101 V250 Q256 P257 L258	R93-R97 VanDerWaalsContact O-CG 3.26Å; R93-R97 WeakPolarHBondContact O-CG 3.18Å; R93-R97 PolarHBondContact O-N 3.04Å; R94-R97 PolarHBondContact O-N 3.49Å; H95-R97 VanDerWaalsContact C-N 3.33Å; H95-R97 PolarHBondContact O-N 3.41Å; R97-A99 VanDerWaalsContact C-N 3.35Å; R97-A99 PolarHBondContact O-N 3.34Å; R97-V100 PolarHBondContact O-N 3.39Å; R97-L101 WeakPolarHBondContact O-CG 3.34Å; R97-L101 PolarHBondContact O-N 2.93Å; R97-L101 VanDerWaalsContact O-N 3.11Å; R97-V250 HydrophobicContact CG-CG1 3.98Å; R97-V250 PolarHBondContact NH1-O 2.88Å; R97-Q256 PolarHBondContact NH1-O 3.47Å; R97-Q256 PolarHBondContact NH2-O 3.22Å; R97-P257 PolarHBondContact NH2-O 3.43Å; R97-L258 HydrophobicContact CB-CD1 4.03Å; R97-L258 HydrophobicContact CB-CD2 4.44Å; R97-L258 HydrophobicContact CG-CD1 4.29Å; R97-L258 HydrophobicContact CG-CD2 4.37Å
98	D	95.1	Very high	95	Very high	38 Å²	38	30.2 Å²	30.2	20%	0.203	15%	0.149	C	C	.	.	H	α-helix	trans	-60	-43.8	174.5	-81.5	-12.6	0	0	0	112	N61 R94 H95 F96 L101 G102 L129	N61-D98 WeakPolarHBondContact CB-O 3.38Å; N61-D98 VanDerWaalsContact CG-O 3.3Å; N61-D98 WeakPolarHBondContact ND2-CB 3.36Å; N61-D98 PolarHBondContact ND2-OD1 2.9Å; N61-D98 VanDerWaalsContact ND2-OD1 3.09Å; R94-D98 PolarHBondContact O-N 2.51Å; H95-D98 WeakPolarHBondContact O-CB 3.15Å; H95-D98 PolarHBondContact O-N 3.23Å; F96-D98 PolarHBondContact O-N 3.38Å; D98-L101 PolarHBondContact O-N 3.03Å; D98-G102 PolarHBondContact O-N 2.89Å; D98-L129 HydrophobicContact CB-CB 3.7Å; D98-L129 HydrophobicContact CB-CD2 4.22Å; D98-L129 HydrophobicContact CB-CG 4.46Å; D98-L129 PolarHBondContact OD2-N 2.99Å
99	A	96.7	Very high	94.5	Very high	1 Å²	1	26.4 Å²	26.4	1%	0.008	13%	0.126	C	C	.	.	H	α-helix	trans	-64.9	-39.8	178.5	0	0	0	0	0	112.1	H95 F96 R97 G102 L103 L121 L129 L180	H95-A99 PolarHBondContact O-N 2.91Å; F96-A99 PolarHBondContact O-N 3.3Å; F96-A99 VanDerWaalsContact O-N 3.16Å; R97-A99 VanDerWaalsContact C-N 3.35Å; R97-A99 PolarHBondContact O-N 3.34Å; A99-G102 PolarHBondContact O-N 3.28Å; A99-L103 VanDerWaalsContact O-CB 3.26Å; A99-L103 WeakPolarHBondContact O-CB 3.48Å; A99-L103 PolarHBondContact O-N 2.66Å; A99-L121 HydrophobicContact CB-CD1 4.17Å; A99-L129 HydrophobicContact CB-CD1 4.47Å; A99-L129 HydrophobicContact CB-CD2 3.97Å; A99-L180 HydrophobicContact CB-CD1 3.82Å
100	V	96.7	Very high	94	Very high	0 Å²	0	26.5 Å²	26.5	0%	0	13%	0.125	C	C	.	.	H	α-helix	trans	-60.5	-46.2	175	169.1	0	0	0	0	110.8	F96 R97 L103 E104 L180 L241 I244 K245 L258	F96-V100 HydrophobicContact CD1-CG2 3.82Å; F96-V100 HydrophobicContact CE1-CG2 3.45Å; F96-V100 VanDerWaalsContact CE1-CG2 3.45Å; F96-V100 HydrophobicContact CE2-CG2 4.5Å; F96-V100 HydrophobicContact CG-CG2 4.49Å; F96-V100 HydrophobicContact CZ-CG2 3.83Å; F96-V100 WeakPolarHBondContact O-CG2 3.3Å; F96-V100 PolarHBondContact O-N 3.46Å; R97-V100 PolarHBondContact O-N 3.39Å; V100-L103 PolarHBondContact O-N 2.99Å; V100-E104 VanDerWaalsContact O-CB 3.24Å; V100-E104 WeakPolarHBondContact O-CB 3.28Å; V100-E104 PolarHBondContact O-N 3.14Å; V100-L180 HydrophobicContact CG2-CD2 3.87Å; V100-L241 HydrophobicContact CG1-CD2 4.33Å; V100-I244 HydrophobicContact CG1-CG2 4.45Å; V100-I244 HydrophobicContact CG2-CG2 3.85Å; V100-K245 HydrophobicContact CG1-CD 4.32Å; V100-K245 HydrophobicContact CG1-CG 3.63Å; V100-L258 HydrophobicContact CB-CD2 4.2Å; V100-L258 HydrophobicContact CG1-CD2 3.84Å
101	L	94.3	Very high	93.5	Very high	32 Å²	32	21.9 Å²	21.9	17%	0.168	10%	0.1	C	C	.	.	H	α-helix	trans	-63.1	-46.2	178.3	-68.5	173.1	0	0	0	111.9	R97 D98 L103 E104 Y105 L258	R97-L101 WeakPolarHBondContact O-CG 3.34Å; R97-L101 PolarHBondContact O-N 2.93Å; R97-L101 VanDerWaalsContact O-N 3.11Å; D98-L101 PolarHBondContact O-N 3.03Å; L101-L103 PolarHBondContact O-N 3.47Å; L101-E104 PolarHBondContact O-N 3.06Å; L101-Y105 PolarHBondContact O-N 3.42Å; L101-L258 HydrophobicContact CD1-CD1 3.84Å; L101-L258 HydrophobicContact CD2-CD1 3.98Å; L101-L258 HydrophobicContact CD2-CG 4.04Å; L101-L258 HydrophobicContact CG-CD1 3.87Å; L101-L258 HydrophobicContact CG-CG 4.33Å
102	G	93.2	Very high	93.2	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-61	-45.2	176.9	0	0	0	0	0	112.5	I62 D98 A99 Y105 L106	I62-G102 WeakPolarHBondContact CD1-O 3.5Å; D98-G102 PolarHBondContact O-N 2.89Å; A99-G102 PolarHBondContact O-N 3.28Å; G102-Y105 WeakPolarHBondContact O-CB 3.32Å; G102-Y105 PolarHBondContact O-N 3.24Å; G102-L106 WeakPolarHBondContact O-CG 3.2Å; G102-L106 PolarHBondContact O-N 3.5Å; G102-L106 VanDerWaalsContact O-N 3.1Å
103	L	94.7	Very high	92.8	Very high	0 Å²	0	21.3 Å²	21.3	0%	0	10%	0.096	C	C	.	.	H	α-helix	trans	-68.8	-39.1	-178.5	-173.9	61.6	0	0	0	112.1	A99 V100 L101 Y105 L106 H107 H113 I116 I131 D176 L180 L241	A99-L103 VanDerWaalsContact O-CB 3.26Å; A99-L103 WeakPolarHBondContact O-CB 3.48Å; A99-L103 PolarHBondContact O-N 2.66Å; V100-L103 PolarHBondContact O-N 2.99Å; L101-L103 PolarHBondContact O-N 3.47Å; L103-Y105 VanDerWaalsContact C-N 3.34Å; L103-Y105 PolarHBondContact O-N 2.97Å; L103-L106 HydrophobicContact CD1-CD1 4.32Å; L103-L106 WeakPolarHBondContact O-CB 3.34Å; L103-L106 PolarHBondContact O-N 3.1Å; L103-H107 PolarHBondContact O-CD2 3.24Å; L103-H107 PolarHBondContact O-N 3.01Å; L103-H113 HydrophobicContact CD1-CB 4.32Å; L103-I116 HydrophobicContact CD1-CD1 4.23Å; L103-I116 HydrophobicContact CD1-CG1 4.29Å; L103-I131 HydrophobicContact CB-CD1 4.09Å; L103-D176 HydrophobicContact CD1-CB 4Å; L103-D176 HydrophobicContact CD2-CB 3.96Å; L103-D176 HydrophobicContact CG-CB 4.46Å; L103-L180 HydrophobicContact CD2-CB 4.45Å; L103-L180 HydrophobicContact CD2-CD2 4.09Å; L103-L241 HydrophobicContact CD2-CD2 4.18Å; L103-L241 HydrophobicContact CG-CD1 4.23Å
104	E	93.5	Very high	92.4	Very high	15 Å²	15	20.8 Å²	20.8	7%	0.07	9%	0.094	C	C	.	.	H	α-helix	trans	-59.7	-45.4	173.8	-178.8	172	-117.4	0	0	111.9	V100 L101 L106 H107 C108 L241 K245 Q260	V100-E104 VanDerWaalsContact O-CB 3.24Å; V100-E104 WeakPolarHBondContact O-CB 3.28Å; V100-E104 PolarHBondContact O-N 3.14Å; L101-E104 PolarHBondContact O-N 3.06Å; E104-L106 VanDerWaalsContact C-N 3.33Å; E104-L106 PolarHBondContact O-N 2.82Å; E104-H107 PolarHBondContact O-N 2.68Å; E104-C108 PolarHBondContact O-N 3.29Å; E104-C108 PolarHBondContact O-SG 3.12Å; E104-C108 VanDerWaalsContact O-SG 3.41Å; E104-L241 HydrophobicContact CB-CD1 3.93Å; E104-K245 WeakPolarHBondContact OE1-CD 3.3Å; E104-K245 IonicContact OE1-NZ 3.79Å; E104-K245 PolarHBondContact OE1-NZ 3.18Å; E104-K245 WeakPolarHBondContact OE2-CD 3.21Å; E104-K245 IonicContact OE2-NZ 2.89Å; E104-K245 PolarHBondContact OE2-NZ 2.94Å; E104-Q260 PolarHBondContact OE1-NE2 3.2Å; E104-Q260 WeakPolarHBondContact OE2-CG 3.34Å; E104-Q260 PolarHBondContact OE2-NE2 3.13Å
105	Y	91.8	Very high	92.1	Very high	11 Å²	11	13.9 Å²	13.9	4%	0.043	7%	0.069	C	C	.	.	H	α-helix	trans	-55.9	-47.6	173.7	170.1	-97.2	0	0	0	111.3	L57 D58 H59 I62 L101 G102 L103 H107 C108 Q109 Y264	L57-Y105 WeakPolarHBondContact CA-OH 3.43Å; L57-Y105 HydrophobicContact CB-CE1 4.08Å; L57-Y105 HydrophobicContact CD2-CE1 3.7Å; L57-Y105 HydrophobicContact CG-CE1 4.38Å; D58-Y105 PolarHBondContact N-OH 3.23Å; D58-Y105 VanDerWaalsContact N-OH 3.09Å; H59-Y105 HydrophobicContact CB-CD1 3.63Å; H59-Y105 HydrophobicContact CB-CD2 4.12Å; H59-Y105 HydrophobicContact CB-CE1 3.83Å; H59-Y105 HydrophobicContact CB-CE2 4.32Å; H59-Y105 HydrophobicContact CB-CG 3.78Å; H59-Y105 AromaticContact CD2-CD2 3.83Å; H59-Y105 AromaticContact CD2-CG 3.66Å; H59-Y105 AromaticContact CG-CG 3.78Å; I62-Y105 HydrophobicContact CG1-CD1 3.82Å; I62-Y105 HydrophobicContact CG1-CE1 4.3Å; L101-Y105 PolarHBondContact O-N 3.42Å; G102-Y105 WeakPolarHBondContact O-CB 3.32Å; G102-Y105 PolarHBondContact O-N 3.24Å; L103-Y105 VanDerWaalsContact C-N 3.34Å; L103-Y105 PolarHBondContact O-N 2.97Å; Y105-H107 VanDerWaalsContact C-N 3.35Å; Y105-H107 PolarHBondContact O-N 3.38Å; Y105-C108 WeakPolarHBondContact O-CB 3.34Å; Y105-C108 PolarHBondContact O-N 3.48Å; Y105-Q109 HydrophobicContact CD1-CG 4.37Å; Y105-Q109 HydrophobicContact CD2-CG 4.33Å; Y105-Q109 HydrophobicContact CE1-CG 3.95Å; Y105-Q109 HydrophobicContact CE2-CG 3.88Å; Y105-Q109 VanDerWaalsContact O-CG 3.32Å; Y105-Q109 WeakPolarHBondContact O-CG 3.37Å; Y105-Q109 PolarHBondContact O-N 3.3Å; Y105-Y264 AromaticContact CD2-CD1 3.81Å; Y105-Y264 HydrophobicContact CD2-CD1 3.81Å; Y105-Y264 HydrophobicContact CD2-CG 4Å; Y105-Y264 HydrophobicContact CE2-CD1 4.12Å
106	L	91.1	Very high	92	Very high	0 Å²	0	13.2 Å²	13.2	0%	0	7%	0.065	C	C	.	.	H	α-helix	trans	-58	-45.9	176.2	-65.9	170.7	0	0	0	112	L57 I62 G102 L103 E104 C108 Q109 K110 I111 H113 I131 F134	L57-L106 HydrophobicContact CD1-CD2 3.71Å; I62-L106 HydrophobicContact CD1-CD1 3.85Å; I62-L106 HydrophobicContact CD1-CD2 4.06Å; I62-L106 HydrophobicContact CD1-CG 3.81Å; G102-L106 WeakPolarHBondContact O-CG 3.2Å; G102-L106 PolarHBondContact O-N 3.5Å; G102-L106 VanDerWaalsContact O-N 3.1Å; L103-L106 HydrophobicContact CD1-CD1 4.32Å; L103-L106 WeakPolarHBondContact O-CB 3.34Å; L103-L106 PolarHBondContact O-N 3.1Å; E104-L106 VanDerWaalsContact C-N 3.33Å; E104-L106 PolarHBondContact O-N 2.82Å; L106-C108 VanDerWaalsContact C-N 3.3Å; L106-C108 PolarHBondContact O-N 3.11Å; L106-Q109 CarbonylContact O-C 3.55Å; L106-Q109 WeakPolarHBondContact O-CA 3.46Å; L106-Q109 PolarHBondContact O-N 2.88Å; L106-Q109 VanDerWaalsContact O-N 3.09Å; L106-K110 PolarHBondContact O-N 3.41Å; L106-K110 VanDerWaalsContact O-N 3.13Å; L106-I111 CarbonylContact C-O 3.55Å; L106-I111 HydrophobicContact CB-CB 4.31Å; L106-I111 HydrophobicContact CD2-CB 4.44Å; L106-I111 HydrophobicContact CD2-CD1 4.36Å; L106-I111 HydrophobicContact CD2-CG2 4.37Å; L106-I111 PolarHBondContact O-N 3.38Å; L106-I111 VanDerWaalsContact O-O 3.09Å; L106-H113 HydrophobicContact CD1-CB 4.38Å; L106-I131 HydrophobicContact CD1-CD1 4.34Å; L106-F134 HydrophobicContact CD1-CE1 3.72Å; L106-F134 HydrophobicContact CD1-CZ 4.43Å; L106-F134 HydrophobicContact CD2-CE1 3.57Å; L106-F134 HydrophobicContact CD2-CZ 4.1Å; L106-F134 HydrophobicContact CG-CE1 4.3Å
107	H	91.4	Very high	91.8	Very high	13 Å²	13	14.6 Å²	14.6	6%	0.06	7%	0.071	C	C	.	.	H	α-helix	trans	-64.2	-34.2	179.8	-74	-165.8	0	0	0	112.3	L103 E104 Y105 K110 I111 R173 D176 L241	L103-H107 PolarHBondContact O-CD2 3.24Å; L103-H107 PolarHBondContact O-N 3.01Å; E104-H107 PolarHBondContact O-N 2.68Å; Y105-H107 VanDerWaalsContact C-N 3.35Å; Y105-H107 PolarHBondContact O-N 3.38Å; H107-K110 PolarHBondContact O-N 3.13Å; H107-I111 PolarHBondContact CD2-O 3.14Å; H107-I111 PolarHBondContact N-O 3.21Å; H107-R173 PolarHBondContact O-NH2 3.28Å; H107-D176 IonicContact CD2-OD2 3.38Å; H107-D176 IonicContact CE1-OD2 2.64Å; H107-D176 IonicContact NE2-OD2 3.44Å; H107-D176 PolarHBondContact NE2-OD2 2.7Å; H107-L241 HydrophobicContact CB-CD1 4.46Å; H107-L241 WeakPolarHBondContact ND1-CD1 3.3Å
108	C	88.6	Confident	91.6	Very high	44 Å²	44	12.8 Å²	12.8	30%	0.297	7%	0.065	S	C	.	.	H	α-helix	trans	-65.7	-41.6	170.9	-73.6	0	0	0	0	111.9	E104 Y105 L106 K110	E104-C108 PolarHBondContact O-N 3.29Å; E104-C108 PolarHBondContact O-SG 3.12Å; E104-C108 VanDerWaalsContact O-SG 3.41Å; Y105-C108 WeakPolarHBondContact O-CB 3.34Å; Y105-C108 PolarHBondContact O-N 3.48Å; L106-C108 VanDerWaalsContact C-N 3.3Å; L106-C108 PolarHBondContact O-N 3.11Å; C108-K110 PolarHBondContact O-N 2.84Å; C108-K110 VanDerWaalsContact O-N 3.08Å
109	Q	86.5	Confident	91.2	Very high	8 Å²	8	13.7 Å²	13.7	4%	0.037	7%	0.074	C	C	.	.	T	Hydrogen-bonded Turn	trans	-72	6.5	172.6	-60	-48.5	-44	0	0	114	L57 Y105 L106 I111 Q266 V268	L57-Q109 HydrophobicContact CD2-CB 4.17Å; L57-Q109 HydrophobicContact CD2-CG 3.97Å; Y105-Q109 HydrophobicContact CD1-CG 4.37Å; Y105-Q109 HydrophobicContact CD2-CG 4.33Å; Y105-Q109 HydrophobicContact CE1-CG 3.95Å; Y105-Q109 HydrophobicContact CE2-CG 3.88Å; Y105-Q109 VanDerWaalsContact O-CG 3.32Å; Y105-Q109 WeakPolarHBondContact O-CG 3.37Å; Y105-Q109 PolarHBondContact O-N 3.3Å; L106-Q109 CarbonylContact O-C 3.55Å; L106-Q109 WeakPolarHBondContact O-CA 3.46Å; L106-Q109 PolarHBondContact O-N 2.88Å; L106-Q109 VanDerWaalsContact O-N 3.09Å; Q109-I111 VanDerWaalsContact C-N 3.29Å; Q109-I111 HydrophobicContact CB-CD1 4.18Å; Q109-I111 HydrophobicContact CB-CG1 4.36Å; Q109-I111 PolarHBondContact O-N 3.21Å; Q109-Q266 PolarHBondContact NE2-O 2.74Å; Q109-V268 HydrophobicContact CG-CG2 4.47Å
110	K	86.2	Confident	90.9	Very high	43 Å²	43	14.1 Å²	14.1	19%	0.187	8%	0.076	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.3	38.2	-178.1	-52.5	-68.1	179.7	175.4	0	113.3	L106 H107 C108 Q139 F140 G142 Q267	L106-K110 PolarHBondContact O-N 3.41Å; L106-K110 VanDerWaalsContact O-N 3.13Å; H107-K110 PolarHBondContact O-N 3.13Å; C108-K110 PolarHBondContact O-N 2.84Å; C108-K110 VanDerWaalsContact O-N 3.08Å; K110-Q139 CarbonylContact O-C 3.55Å; K110-Q139 VanDerWaalsContact O-CA 3.24Å; K110-Q139 WeakPolarHBondContact O-CA 3.46Å; K110-Q139 VanDerWaalsContact O-CG 3.29Å; K110-Q139 WeakPolarHBondContact O-CG 3.49Å; K110-F140 VanDerWaalsContact CA-CZ 3.47Å; K110-F140 HydrophobicContact CB-CD1 4.29Å; K110-F140 HydrophobicContact CB-CD2 4.32Å; K110-F140 HydrophobicContact CB-CE1 4.16Å; K110-F140 HydrophobicContact CB-CE2 4.18Å; K110-F140 HydrophobicContact CB-CG 4.37Å; K110-F140 HydrophobicContact CB-CZ 4.07Å; K110-F140 VanDerWaalsContact CB-O 3.29Å; K110-F140 WeakPolarHBondContact CB-O 3.48Å; K110-F140 HydrophobicContact CD-CD2 4Å; K110-F140 HydrophobicContact CD-CE2 3.39Å; K110-F140 HydrophobicContact CD-CZ 3.75Å; K110-F140 HydrophobicContact CG-CE2 4.41Å; K110-F140 WeakPolarHBondContact O-CD1 3.3Å; K110-F140 WeakPolarHBondContact O-CE1 3.44Å; K110-F140 PolarHBondContact O-N 2.91Å; K110-G142 PolarHBondContact NZ-O 3.08Å; K110-Q267 VanDerWaalsContact CG-NE2 3.29Å
111	I	86.4	Confident	90.6	Very high	5 Å²	5	14.1 Å²	14.1	3%	0.026	8%	0.076	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	130.3	175.3	-57.6	171	0	0	0	108.5	I53 L57 L106 H107 Q109 S138	I53-I111 HydrophobicContact CG2-CD1 3.62Å; I53-I111 HydrophobicContact CG2-CG1 4.49Å; L57-I111 HydrophobicContact CD1-CD1 3.92Å; L57-I111 HydrophobicContact CD2-CD1 3.79Å; L57-I111 HydrophobicContact CG-CD1 4.36Å; L106-I111 CarbonylContact C-O 3.55Å; L106-I111 HydrophobicContact CB-CB 4.31Å; L106-I111 HydrophobicContact CD2-CB 4.44Å; L106-I111 HydrophobicContact CD2-CD1 4.36Å; L106-I111 HydrophobicContact CD2-CG2 4.37Å; L106-I111 PolarHBondContact O-N 3.38Å; L106-I111 VanDerWaalsContact O-O 3.09Å; H107-I111 PolarHBondContact CD2-O 3.14Å; H107-I111 PolarHBondContact N-O 3.21Å; Q109-I111 VanDerWaalsContact C-N 3.29Å; Q109-I111 HydrophobicContact CB-CD1 4.18Å; Q109-I111 HydrophobicContact CB-CG1 4.36Å; Q109-I111 PolarHBondContact O-N 3.21Å; I111-S138 WeakPolarHBondContact CA-O 3.18Å
112	V	89.6	Confident	90.3	Very high	0 Å²	0	12.8 Å²	12.8	0%	0	7%	0.069	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	138.5	164.2	-67.8	0	0	0	0	109.1	R114 S137 S138 F140 A145 L147 G172 R173 D176	V112-R114 HydrophobicContact CB-CG 4.35Å; V112-R114 HydrophobicContact CG2-CG 3.93Å; V112-S137 VanDerWaalsContact O-CA 3.28Å; V112-S137 WeakPolarHBondContact O-CA 3.49Å; V112-S137 WeakPolarHBondContact O-CB 3.39Å; V112-S138 VanDerWaalsContact CG2-O 3.3Å; V112-S138 WeakPolarHBondContact CG2-O 3.48Å; V112-S138 PolarHBondContact N-O 3.19Å; V112-S138 PolarHBondContact O-N 3.42Å; V112-F140 HydrophobicContact CG1-CD1 3.98Å; V112-F140 HydrophobicContact CG1-CE1 3.75Å; V112-A145 HydrophobicContact CB-CB 4.41Å; V112-A145 HydrophobicContact CG1-CB 3.74Å; V112-A145 HydrophobicContact CG2-CB 3.73Å; V112-L147 HydrophobicContact CG2-CD1 4.31Å; V112-G172 VanDerWaalsContact CG1-C 3.48Å; V112-R173 HydrophobicContact CG1-CG 4.07Å; V112-D176 WeakPolarHBondContact CA-OD2 3.43Å
113	H	89.3	Confident	90	Very high	0 Å²	0	13.3 Å²	13.3	0%	0	7%	0.072	C	C	.	.			trans	-81.2	-43	-173.1	-171.7	-78.2	0	0	0	112.2	L103 L106 D115 I116 I131 S132 D133 F134 D176	L103-H113 HydrophobicContact CD1-CB 4.32Å; L106-H113 HydrophobicContact CD1-CB 4.38Å; H113-D115 PolarHBondContact CE1-O 2.71Å; H113-D115 VanDerWaalsContact ND1-C 3.26Å; H113-D115 PolarHBondContact ND1-N 2.87Å; H113-D115 PolarHBondContact O-N 3.23Å; H113-I116 HydrophobicContact CB-CD1 3.73Å; H113-I116 HydrophobicContact CB-CG1 3.87Å; H113-I116 VanDerWaalsContact CG-CD1 3.4Å; H113-I116 PolarHBondContact ND1-N 3.4Å; H113-I131 VanDerWaalsContact CD2-CG2 3.49Å; H113-I131 WeakPolarHBondContact CD2-CG2 3.44Å; H113-S132 PolarHBondContact NE2-O 3.03Å; H113-D133 PolarHBondContact CE1-O 3.15Å; H113-D133 VanDerWaalsContact CE1-O 3.22Å; H113-D133 PolarHBondContact NE2-O 2.98Å; H113-F134 AromaticContact CD2-CD1 3.79Å; H113-F134 AromaticContact CD2-CE1 3.72Å; H113-D176 PolarHBondContact N-OD1 3.09Å; H113-D176 PolarHBondContact N-OD2 2.83Å
114	R	89.3	Confident	89.5	Confident	12 Å²	12	14.3 Å²	14.3	5%	0.045	8%	0.078	C	C	.	.	S	Bend	trans	67.5	-11.1	178.1	-54.9	177.6	60.1	175.5	12.9	116.9	V112 V136 L147 D149 Y170 D176	V112-R114 HydrophobicContact CB-CG 4.35Å; V112-R114 HydrophobicContact CG2-CG 3.93Å; R114-V136 HydrophobicContact CB-CG2 4.3Å; R114-V136 WeakPolarHBondContact CD-O 3.23Å; R114-L147 HydrophobicContact CG-CD1 4.04Å; R114-D149 IonicContact CZ-OD1 3.85Å; R114-D149 VanDerWaalsContact CZ-OD1 3.29Å; R114-D149 IonicContact NH1-OD1 2.74Å; R114-D149 PolarHBondContact NH1-OD1 2.94Å; R114-D149 IonicContact NH1-OD2 3.29Å; R114-D149 PolarHBondContact NH1-OD2 3.09Å; R114-D149 PolarHBondContact NH2-O 3.32Å; R114-D149 IonicContact NH2-OD1 2.83Å; R114-D149 PolarHBondContact NH2-OD1 3.24Å; R114-D149 IonicContact NH2-OD2 3.71Å; R114-Y170 PolarHBondContact NH2-OH 2.89Å; R114-Y170 VanDerWaalsContact NH2-OH 3.13Å; R114-D176 WeakPolarHBondContact CA-OD1 3.27Å; R114-D176 PolarHBondContact N-OD1 2.92Å
115	D	89.6	Confident	88.9	Confident	13 Å²	13	20.6 Å²	20.6	7%	0.07	11%	0.108	C	C	.	.			trans	-134.8	45.9	176.6	-161.3	38.5	0	0	0	113.3	H113 K117 N120 V136 T153	H113-D115 PolarHBondContact CE1-O 2.71Å; H113-D115 VanDerWaalsContact ND1-C 3.26Å; H113-D115 PolarHBondContact ND1-N 2.87Å; H113-D115 PolarHBondContact O-N 3.23Å; D115-K117 PolarHBondContact O-N 3.2Å; D115-K117 IonicContact OD1-NZ 3.1Å; D115-K117 PolarHBondContact OD1-NZ 3.35Å; D115-K117 WeakPolarHBondContact OD2-CE 3.43Å; D115-K117 IonicContact OD2-NZ 3.28Å; D115-K117 PolarHBondContact OD2-NZ 3.41Å; D115-N120 PolarHBondContact O-ND2 3.44Å; D115-N120 PolarHBondContact OD2-ND2 3.34Å; D115-N120 VanDerWaalsContact OD2-ND2 3.09Å; D115-V136 HydrophobicContact CB-CG2 3.6Å; D115-T153 WeakPolarHBondContact OD1-CB 3.45Å; D115-T153 PolarHBondContact OD1-N 2.94Å; D115-T153 PolarHBondContact OD1-OG1 3.47Å
116	I	94.5	Very high	88.4	Confident	1 Å²	1	25.8 Å²	25.8	1%	0.005	14%	0.141	C	C	.	.			trans	-69.9	119.4	174.5	-63.4	-66.2	0	0	0	109.5	L103 H113 I131 F156 S179 L180 T183	L103-I116 HydrophobicContact CD1-CD1 4.23Å; L103-I116 HydrophobicContact CD1-CG1 4.29Å; H113-I116 HydrophobicContact CB-CD1 3.73Å; H113-I116 HydrophobicContact CB-CG1 3.87Å; H113-I116 VanDerWaalsContact CG-CD1 3.4Å; H113-I116 PolarHBondContact ND1-N 3.4Å; I116-I131 HydrophobicContact CD1-CD1 4.27Å; I116-I131 HydrophobicContact CD1-CG2 3.84Å; I116-F156 WeakPolarHBondContact O-CD1 3.25Å; I116-S179 WeakPolarHBondContact O-CB 3.1Å; I116-L180 HydrophobicContact CG2-CB 4.32Å; I116-L180 HydrophobicContact CG2-CD1 4.12Å; I116-T183 PolarHBondContact O-OG1 3.49Å
117	K	93.4	Very high	88.2	Confident	30 Å²	30	27.4 Å²	27.4	13%	0.13	16%	0.158	C	C	.	.			trans	-161.3	159.6	-179.9	65.8	-166.8	-174	-154.5	0	110.8	D115 S119 N120 L121 T153 F156 T183	D115-K117 PolarHBondContact O-N 3.2Å; D115-K117 IonicContact OD1-NZ 3.1Å; D115-K117 PolarHBondContact OD1-NZ 3.35Å; D115-K117 WeakPolarHBondContact OD2-CE 3.43Å; D115-K117 IonicContact OD2-NZ 3.28Å; D115-K117 PolarHBondContact OD2-NZ 3.41Å; K117-S119 WeakPolarHBondContact CE-OG 3.32Å; K117-S119 PolarHBondContact O-N 3.1Å; K117-S119 VanDerWaalsContact O-N 3.08Å; K117-N120 WeakPolarHBondContact CE-ND2 3.4Å; K117-N120 WeakPolarHBondContact CE-OD1 3.48Å; K117-N120 HydrophobicContact CG-CB 4.1Å; K117-N120 PolarHBondContact O-N 3.41Å; K117-L121 PolarHBondContact O-N 2.99Å; K117-T153 HydrophobicContact CD-CG2 4.46Å; K117-T153 VanDerWaalsContact CD-OG1 3.31Å; K117-T153 WeakPolarHBondContact CD-OG1 3.47Å; K117-T153 PolarHBondContact NZ-OG1 2.9Å; K117-F156 HydrophobicContact CB-CD1 3.75Å; K117-F156 HydrophobicContact CB-CD2 4.05Å; K117-F156 HydrophobicContact CB-CE1 3.61Å; K117-F156 HydrophobicContact CB-CE2 3.92Å; K117-F156 HydrophobicContact CB-CG 3.98Å; K117-F156 HydrophobicContact CB-CZ 3.71Å; K117-T183 WeakPolarHBondContact CA-OG1 3.48Å
118	P	92.6	Very high	88	Confident	2 Å²	2	29.1 Å²	29.1	1%	0.013	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-51.5	-36.1	-177.7	-30	35.1	0	0	0	115.6	L79 I81 N120 L121 T183 A186 F187	L79-P118 HydrophobicContact CB-CB 4.22Å; L79-P118 WeakPolarHBondContact O-CB 3.45Å; I81-P118 HydrophobicContact CD1-CG 4.4Å; P118-N120 VanDerWaalsContact C-N 3.3Å; P118-N120 PolarHBondContact O-N 3.28Å; P118-L121 PolarHBondContact O-N 3.03Å; P118-L121 VanDerWaalsContact O-O 3.1Å; P118-T183 HydrophobicContact CG-CG2 4.07Å; P118-A186 HydrophobicContact CG-CB 4.03Å; P118-F187 HydrophobicContact CB-CE1 4.1Å; P118-F187 HydrophobicContact CG-CD1 4.42Å; P118-F187 HydrophobicContact CG-CE1 4.18Å
119	S	86.9	Confident	88.2	Confident	57 Å²	57	27 Å²	27	40%	0.399	16%	0.157	S	C	.	.	G	3₁₀ helix	trans	-73	-18.9	179.1	52.1	0	0	0	0	114.9	K117	K117-S119 WeakPolarHBondContact CE-OG 3.32Å; K117-S119 PolarHBondContact O-N 3.1Å; K117-S119 VanDerWaalsContact O-N 3.08Å
120	N	89	Confident	88.3	Confident	10 Å²	10	28.8 Å²	28.8	5%	0.053	16%	0.164	C	C	.	.	G	3₁₀ helix	trans	-96.3	-3.6	175.2	-71.2	0.5	0	0	0	112.2	D115 K117 P118 S132	D115-N120 PolarHBondContact O-ND2 3.44Å; D115-N120 PolarHBondContact OD2-ND2 3.34Å; D115-N120 VanDerWaalsContact OD2-ND2 3.09Å; K117-N120 WeakPolarHBondContact CE-ND2 3.4Å; K117-N120 WeakPolarHBondContact CE-OD1 3.48Å; K117-N120 HydrophobicContact CG-CB 4.1Å; K117-N120 PolarHBondContact O-N 3.41Å; P118-N120 VanDerWaalsContact C-N 3.3Å; P118-N120 PolarHBondContact O-N 3.28Å; N120-S132 PolarHBondContact O-N 3.42Å; N120-S132 PolarHBondContact O-OG 2.93Å
121	L	90.5	Very high	88.5	Confident	0 Å²	0	26.8 Å²	26.8	0%	0	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	111.6	173.5	-57.1	-173.4	0	0	0	108.7	V78 A99 K117 P118 L129 I131 T183 F187	V78-L121 HydrophobicContact CG2-CB 3.85Å; V78-L121 WeakPolarHBondContact CG2-O 3.4Å; V78-L121 PolarHBondContact N-O 3.27Å; A99-L121 HydrophobicContact CB-CD1 4.17Å; K117-L121 PolarHBondContact O-N 2.99Å; P118-L121 PolarHBondContact O-N 3.03Å; P118-L121 VanDerWaalsContact O-O 3.1Å; L121-L129 HydrophobicContact CB-CD1 3.93Å; L121-L129 HydrophobicContact CB-CD2 4.19Å; L121-L129 HydrophobicContact CB-CG 4.06Å; L121-L129 HydrophobicContact CD1-CD1 4.07Å; L121-L129 HydrophobicContact CD2-CD2 4.15Å; L121-I131 HydrophobicContact CD2-CB 4.22Å; L121-I131 HydrophobicContact CD2-CG1 3.76Å; L121-I131 HydrophobicContact CD2-CG2 4.25Å; L121-T183 HydrophobicContact CD1-CG2 3.64Å; L121-F187 HydrophobicContact CD1-CZ 3.84Å
122	L	88.4	Confident	88.3	Confident	4 Å²	4	27.2 Å²	27.2	2%	0.021	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	135.5	-172.4	-58.8	-175.1	0	0	0	111.2	F12 V63 F75 R76 L129 K130 S132	F12-L122 HydrophobicContact CB-CD1 4.44Å; F12-L122 HydrophobicContact CE1-CD2 4.35Å; F12-L122 HydrophobicContact CE2-CD2 4.34Å; F12-L122 HydrophobicContact CG-CD1 4.37Å; F12-L122 HydrophobicContact CZ-CD2 4.26Å; V63-L122 HydrophobicContact CG2-CD1 4.2Å; F75-L122 HydrophobicContact CB-CB 4.11Å; F75-L122 HydrophobicContact CB-CD1 3.93Å; F75-L122 HydrophobicContact CB-CG 4.47Å; F75-L122 HydrophobicContact CD1-CB 4.28Å; F75-L122 HydrophobicContact CG-CB 4.41Å; F75-L122 HydrophobicContact CG-CD1 4.25Å; R76-L122 CarbonylContact O-C 3.54Å; R76-L122 WeakPolarHBondContact O-CA 3.46Å; L122-L129 CarbonylContact O-C 3.53Å; L122-L129 WeakPolarHBondContact O-CA 3.37Å; L122-K130 PolarHBondContact N-O 3.08Å; L122-K130 PolarHBondContact O-N 3.48Å; L122-S132 WeakPolarHBondContact CG-OG 3.12Å
123	L	86.8	Confident	87.5	Confident	12 Å²	12	30.5 Å²	30.5	6%	0.063	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.9	132.2	170.6	-67	176.9	0	0	0	110.7	F75 R76 V78 H95 S128 L129	F75-L123 WeakPolarHBondContact CA-O 3.45Å; R76-L123 HydrophobicContact CG-CB 4.11Å; R76-L123 PolarHBondContact N-O 3.31Å; R76-L123 PolarHBondContact O-N 3.45Å; V78-L123 HydrophobicContact CB-CD1 4.4Å; V78-L123 HydrophobicContact CB-CD2 4.48Å; V78-L123 HydrophobicContact CB-CG 4.17Å; V78-L123 HydrophobicContact CG2-CD1 4.32Å; V78-L123 HydrophobicContact CG2-CD2 3.63Å; V78-L123 HydrophobicContact CG2-CG 3.58Å; H95-L123 WeakPolarHBondContact CE1-CD2 3.36Å; L123-S128 WeakPolarHBondContact CA-O 3.43Å; L123-L129 HydrophobicContact CD2-CB 4.18Å
124	T	83.8	Confident	86.6	Confident	20 Å²	20	31.6 Å²	31.6	12%	0.123	18%	0.182	C	C	.	.	P	Polyproline II helix	trans	-74.7	166	165.6	67.5	0	0	0	0	110.2	F75 T126 G127 S128 K130	F75-T124 HydrophobicContact CD1-CG2 4.35Å; F75-T124 HydrophobicContact CE1-CG2 3.71Å; T124-T126 PolarHBondContact O-N 3.42Å; T124-T126 PolarHBondContact OG1-N 3.26Å; T124-T126 PolarHBondContact OG1-OG1 3.26Å; T124-G127 PolarHBondContact O-N 3.5Å; T124-G127 PolarHBondContact OG1-N 2.86Å; T124-S128 WeakPolarHBondContact CG2-O 3.42Å; T124-S128 PolarHBondContact N-O 2.61Å; T124-S128 PolarHBondContact OG1-N 3.36Å; T124-S128 PolarHBondContact OG1-O 3.13Å; T124-K130 HydrophobicContact CG2-CD 3.78Å; T124-K130 HydrophobicContact CG2-CG 4.12Å
125	E	80.6	Confident	85.2	Confident	147 Å²	147	32.7 Å²	32.7	69%	0.687	20%	0.196	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.9	-29.2	171.5	-66.8	174	-170.7	0	0	112.5	L74 G127	L74-E125 PolarHBondContact N-OE1 3.12Å; E125-G127 PolarHBondContact O-N 2.83Å
126	T	83	Confident	83.9	Confident	120 Å²	120	34.7 Å²	34.7	74%	0.736	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-1.9	175.3	62.1	0	0	0	0	113.5	T124 S128	T124-T126 PolarHBondContact O-N 3.42Å; T124-T126 PolarHBondContact OG1-N 3.26Å; T124-T126 PolarHBondContact OG1-OG1 3.26Å; T126-S128 PolarHBondContact OG1-OG 3.18Å
127	G	85.2	Confident	82.5	Confident	35 Å²	35	35.1 Å²	35.1	36%	0.361	21%	0.212	S	C	.	.	S	Bend	trans	81.2	8.5	179.7	0	0	0	0	0	115.3	T124 E125	T124-G127 PolarHBondContact O-N 3.5Å; T124-G127 PolarHBondContact OG1-N 2.86Å; E125-G127 PolarHBondContact O-N 2.83Å
128	S	87.7	Confident	81.3	Confident	48 Å²	48	35.3 Å²	35.3	34%	0.336	22%	0.217	S	C	.	.			trans	-81.1	141.9	174.3	-53.5	0	0	0	0	110.4	L123 T124 T126	L123-S128 WeakPolarHBondContact CA-O 3.43Å; T124-S128 WeakPolarHBondContact CG2-O 3.42Å; T124-S128 PolarHBondContact N-O 2.61Å; T124-S128 PolarHBondContact OG1-N 3.36Å; T124-S128 PolarHBondContact OG1-O 3.13Å; T126-S128 PolarHBondContact OG1-OG 3.18Å
129	L	92.5	Very high	80.2	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-92.3	137.2	178.7	178.3	162.9	0	0	0	111.4	N61 V78 H95 D98 A99 L121 L122 L123 F187	N61-L129 WeakPolarHBondContact CA-O 3.14Å; N61-L129 WeakPolarHBondContact CB-O 3.1Å; N61-L129 PolarHBondContact ND2-O 3.45Å; V78-L129 HydrophobicContact CG2-CB 4.45Å; V78-L129 HydrophobicContact CG2-CD1 3.4Å; V78-L129 VanDerWaalsContact CG2-CD1 3.4Å; V78-L129 HydrophobicContact CG2-CG 3.83Å; H95-L129 HydrophobicContact CB-CD1 3.68Å; H95-L129 WeakPolarHBondContact O-CD1 3.39Å; D98-L129 HydrophobicContact CB-CB 3.7Å; D98-L129 HydrophobicContact CB-CD2 4.22Å; D98-L129 HydrophobicContact CB-CG 4.46Å; D98-L129 PolarHBondContact OD2-N 2.99Å; A99-L129 HydrophobicContact CB-CD1 4.47Å; A99-L129 HydrophobicContact CB-CD2 3.97Å; L121-L129 HydrophobicContact CB-CD1 3.93Å; L121-L129 HydrophobicContact CB-CD2 4.19Å; L121-L129 HydrophobicContact CB-CG 4.06Å; L121-L129 HydrophobicContact CD1-CD1 4.07Å; L121-L129 HydrophobicContact CD2-CD2 4.15Å; L122-L129 CarbonylContact O-C 3.53Å; L122-L129 WeakPolarHBondContact O-CA 3.37Å; L123-L129 HydrophobicContact CD2-CB 4.18Å; L129-F187 HydrophobicContact CD1-CZ 4.41Å
130	K	89.8	Confident	79.6	Confident	46 Å²	46	37.5 Å²	37.5	20%	0.2	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	131.1	174.2	-66.7	179.4	175.2	-75.4	0	111.1	P60 N61 V63 F75 L122 T124	P60-K130 WeakPolarHBondContact O-CG 3.46Å; P60-K130 PolarHBondContact O-NZ 3.1Å; N61-K130 CarbonylContact O-C 3.53Å; N61-K130 WeakPolarHBondContact O-CA 3.4Å; V63-K130 HydrophobicContact CG2-CB 3.61Å; V63-K130 HydrophobicContact CG2-CD 4.3Å; F75-K130 HydrophobicContact CE1-CD 4.02Å; F75-K130 HydrophobicContact CZ-CD 4.41Å; L122-K130 PolarHBondContact N-O 3.08Å; L122-K130 PolarHBondContact O-N 3.48Å; T124-K130 HydrophobicContact CG2-CD 3.78Å; T124-K130 HydrophobicContact CG2-CG 4.12Å
131	I	89.3	Confident	78.4	Confident	1 Å²	1	43.3 Å²	43.3	1%	0.005	26%	0.256	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	134.2	172	-52.1	177.9	0	0	0	109.1	N61 I62 V63 L103 L106 H113 I116 L121	N61-I131 PolarHBondContact O-N 3.42Å; I62-I131 HydrophobicContact CD1-CB 3.76Å; I62-I131 HydrophobicContact CD1-CD1 3.96Å; I62-I131 HydrophobicContact CD1-CG1 4.12Å; V63-I131 WeakPolarHBondContact CG2-O 3.46Å; V63-I131 PolarHBondContact N-O 2.78Å; L103-I131 HydrophobicContact CB-CD1 4.09Å; L106-I131 HydrophobicContact CD1-CD1 4.34Å; H113-I131 VanDerWaalsContact CD2-CG2 3.49Å; H113-I131 WeakPolarHBondContact CD2-CG2 3.44Å; I116-I131 HydrophobicContact CD1-CD1 4.27Å; I116-I131 HydrophobicContact CD1-CG2 3.84Å; L121-I131 HydrophobicContact CD2-CB 4.22Å; L121-I131 HydrophobicContact CD2-CG1 3.76Å; L121-I131 HydrophobicContact CD2-CG2 4.25Å
132	S	82.7	Confident	77.7	Confident	13 Å²	13	45.8 Å²	45.8	9%	0.091	28%	0.282	C	S	.	.			trans	-133.3	173.4	-179	73.4	0	0	0	0	111.2	H113 N120 L122	H113-S132 PolarHBondContact NE2-O 3.03Å; N120-S132 PolarHBondContact O-N 3.42Å; N120-S132 PolarHBondContact O-OG 2.93Å; L122-S132 WeakPolarHBondContact CG-OG 3.12Å
133	D	73	Confident	76.7	Confident	70 Å²	70	52.7 Å²	52.7	37%	0.374	32%	0.319	S	S	.	.			trans	61.5	77.4	175.9	-164.2	3.7	0	0	0	115.6	H113 G135	H113-D133 PolarHBondContact CE1-O 3.15Å; H113-D133 VanDerWaalsContact CE1-O 3.22Å; H113-D133 PolarHBondContact NE2-O 2.98Å; D133-G135 PolarHBondContact O-N 2.74Å; D133-G135 PolarHBondContact OD1-N 3.24Å; D133-G135 VanDerWaalsContact OD1-N 3.11Å
134	F	70.5	Confident	76.1	Confident	23 Å²	23	54.5 Å²	54.5	10%	0.101	33%	0.328	C	S	.	.			trans	-83.6	22	173.1	-56.5	-81.8	0	0	0	113.3	Q54 L57 I62 L106 H113 V136 S137	Q54-F134 HydrophobicContact CG-CB 4.47Å; L57-F134 HydrophobicContact CD1-CE1 4.46Å; L57-F134 HydrophobicContact CD1-CZ 4.33Å; I62-F134 HydrophobicContact CD1-CZ 4.44Å; I62-F134 HydrophobicContact CG2-CE2 4.23Å; I62-F134 HydrophobicContact CG2-CZ 3.8Å; L106-F134 HydrophobicContact CD1-CE1 3.72Å; L106-F134 HydrophobicContact CD1-CZ 4.43Å; L106-F134 HydrophobicContact CD2-CE1 3.57Å; L106-F134 HydrophobicContact CD2-CZ 4.1Å; L106-F134 HydrophobicContact CG-CE1 4.3Å; H113-F134 AromaticContact CD2-CD1 3.79Å; H113-F134 AromaticContact CD2-CE1 3.72Å; F134-V136 PolarHBondContact O-N 3.2Å; F134-V136 VanDerWaalsContact O-N 3.08Å; F134-S137 PolarHBondContact O-N 3.06Å; F134-S137 VanDerWaalsContact O-N 3.1Å; F134-S137 PolarHBondContact O-OG 3.26Å; F134-S137 VanDerWaalsContact O-OG 3.06Å
135	G	59	Low	75.8	Confident	34 Å²	34	53.6 Å²	53.6	35%	0.351	32%	0.323	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.1	-29.3	-172.3	0	0	0	0	0	114.4	K16 D133	K16-G135 WeakPolarHBondContact CE-O 3.38Å; D133-G135 PolarHBondContact O-N 2.74Å; D133-G135 PolarHBondContact OD1-N 3.24Å; D133-G135 VanDerWaalsContact OD1-N 3.11Å
136	V	62.1	Low	75.8	Confident	56 Å²	56	52.6 Å²	52.6	34%	0.339	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.6	13.5	178.4	-62.7	0	0	0	0	113.4	R114 D115 F134 A151	R114-V136 HydrophobicContact CB-CG2 4.3Å; R114-V136 WeakPolarHBondContact CD-O 3.23Å; D115-V136 HydrophobicContact CB-CG2 3.6Å; F134-V136 PolarHBondContact O-N 3.2Å; F134-V136 VanDerWaalsContact O-N 3.08Å; V136-A151 HydrophobicContact CB-CB 4.31Å
137	S	66.3	Low	75.6	Confident	9 Å²	9	47.3 Å²	47.3	6%	0.063	29%	0.289	C	S	.	.			trans	-61.8	158.1	178.7	68.8	0	0	0	0	111.8	E50 Q54 V112 F134	E50-S137 PolarHBondContact OE1-OG 3.11Å; Q54-S137 PolarHBondContact NE2-OG 3.03Å; V112-S137 VanDerWaalsContact O-CA 3.28Å; V112-S137 WeakPolarHBondContact O-CA 3.49Å; V112-S137 WeakPolarHBondContact O-CB 3.39Å; F134-S137 PolarHBondContact O-N 3.06Å; F134-S137 VanDerWaalsContact O-N 3.1Å; F134-S137 PolarHBondContact O-OG 3.26Å; F134-S137 VanDerWaalsContact O-OG 3.06Å
138	S	67.3	Low	75.2	Confident	35 Å²	35	50.2 Å²	50.2	25%	0.245	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	134.8	174.8	-167.4	0	0	0	0	110.8	I111 V112	I111-S138 WeakPolarHBondContact CA-O 3.18Å; V112-S138 VanDerWaalsContact CG2-O 3.3Å; V112-S138 WeakPolarHBondContact CG2-O 3.48Å; V112-S138 PolarHBondContact N-O 3.19Å; V112-S138 PolarHBondContact O-N 3.42Å
139	Q	68.9	Low	74.8	Confident	91 Å²	91	50.8 Å²	50.8	43%	0.425	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	143.7	169.3	-165.1	-173.4	10	0	0	109.7	I53 K110	I53-Q139 HydrophobicContact CD1-CG 4.3Å; K110-Q139 CarbonylContact O-C 3.55Å; K110-Q139 VanDerWaalsContact O-CA 3.24Å; K110-Q139 WeakPolarHBondContact O-CA 3.46Å; K110-Q139 VanDerWaalsContact O-CG 3.29Å; K110-Q139 WeakPolarHBondContact O-CG 3.49Å
140	F	74.5	Confident	74.1	Confident	14 Å²	14	54.9 Å²	54.9	6%	0.061	32%	0.316	C	S	.	.			trans	-126.7	162.9	177.2	61.9	-84.4	0	0	0	112.7	K110 V112 D144 A145 R173	K110-F140 VanDerWaalsContact CA-CZ 3.47Å; K110-F140 HydrophobicContact CB-CD1 4.29Å; K110-F140 HydrophobicContact CB-CD2 4.32Å; K110-F140 HydrophobicContact CB-CE1 4.16Å; K110-F140 HydrophobicContact CB-CE2 4.18Å; K110-F140 HydrophobicContact CB-CG 4.37Å; K110-F140 HydrophobicContact CB-CZ 4.07Å; K110-F140 VanDerWaalsContact CB-O 3.29Å; K110-F140 WeakPolarHBondContact CB-O 3.48Å; K110-F140 HydrophobicContact CD-CD2 4Å; K110-F140 HydrophobicContact CD-CE2 3.39Å; K110-F140 HydrophobicContact CD-CZ 3.75Å; K110-F140 HydrophobicContact CG-CE2 4.41Å; K110-F140 WeakPolarHBondContact O-CD1 3.3Å; K110-F140 WeakPolarHBondContact O-CE1 3.44Å; K110-F140 PolarHBondContact O-N 2.91Å; V112-F140 HydrophobicContact CG1-CD1 3.98Å; V112-F140 HydrophobicContact CG1-CE1 3.75Å; F140-D144 WeakPolarHBondContact CD2-O 3.45Å; F140-A145 VanDerWaalsContact CB-CA 3.42Å; F140-A145 HydrophobicContact CB-CB 3.52Å; F140-A145 HydrophobicContact CD1-CB 3.61Å; F140-A145 HydrophobicContact CD2-CB 4.45Å; F140-A145 HydrophobicContact CE1-CB 4.42Å; F140-A145 HydrophobicContact CG-CB 3.63Å; F140-R173 HydrophobicContact CZ-CG 4.39Å
141	T	65	Low	73.4	Confident	131 Å²	131	53.6 Å²	53.6	80%	0.804	31%	0.314	S	S	*	.			trans	-115.7	152	171.5	58.2	0	0	0	0	108.6
142	G	74.6	Confident	72.9	Confident	53 Å²	53	54.8 Å²	54.8	55%	0.546	33%	0.327	S	S	.	.	S	Bend	trans	82	-151.6	-176.9	0	0	0	0	0	113.9	K110	K110-G142 PolarHBondContact NZ-O 3.08Å
143	L	68.1	Low	73.1	Confident	149 Å²	149	56 Å²	56	78%	0.78	33%	0.334	S	S	*	.	S	Bend	trans	-79.9	-29.5	-172.7	-67.8	175	0	0	0	113.1	R173	L143-R173 PolarHBondContact O-NE 3.48Å; L143-R173 PolarHBondContact O-NH1 3.28Å
144	D	73.5	Confident	74	Confident	49 Å²	49	54.9 Å²	54.9	26%	0.262	33%	0.33	S	S	.	.	S	Bend	trans	-149.2	161.4	-174.8	-152.1	-17.5	0	0	0	112.2	F140 L146 S171 R173	F140-D144 WeakPolarHBondContact CD2-O 3.45Å; D144-L146 PolarHBondContact O-N 2.73Å; D144-S171 PolarHBondContact OD1-OG 2.9Å; D144-S171 WeakPolarHBondContact OD2-CB 3.47Å; D144-S171 PolarHBondContact OD2-OG 3.49Å; D144-R173 WeakPolarHBondContact OD1-CB 3.46Å; D144-R173 WeakPolarHBondContact OD1-CD 3.44Å; D144-R173 WeakPolarHBondContact OD1-CG 3.3Å; D144-R173 PolarHBondContact OD1-N 3.4Å
145	A	78	Confident	75.2	Confident	2 Å²	2	54.6 Å²	54.6	2%	0.017	33%	0.332	C	S	.	.			trans	-85	103.4	170.6	0	0	0	0	0	109.8	V112 F140 L147 G172	V112-A145 HydrophobicContact CB-CB 4.41Å; V112-A145 HydrophobicContact CG1-CB 3.74Å; V112-A145 HydrophobicContact CG2-CB 3.73Å; F140-A145 VanDerWaalsContact CB-CA 3.42Å; F140-A145 HydrophobicContact CB-CB 3.52Å; F140-A145 HydrophobicContact CD1-CB 3.61Å; F140-A145 HydrophobicContact CD2-CB 4.45Å; F140-A145 HydrophobicContact CE1-CB 4.42Å; F140-A145 HydrophobicContact CG-CB 3.63Å; A145-L147 HydrophobicContact CB-CD2 4.33Å; A145-L147 HydrophobicContact CB-CG 4.25Å; A145-L147 PolarHBondContact O-N 2.92Å; A145-G172 PolarHBondContact O-N 3.24Å
146	L	80.5	Confident	77	Confident	126 Å²	126	53.5 Å²	53.5	66%	0.66	32%	0.318	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	102.4	168.8	-66.9	176	0	0	0	109.2	D144 F169	D144-L146 PolarHBondContact O-N 2.73Å; L146-F169 HydrophobicContact CB-CB 4.3Å; L146-F169 HydrophobicContact CB-CD1 4.12Å; L146-F169 HydrophobicContact CD2-CB 4.32Å
147	L	78.5	Confident	78.5	Confident	8 Å²	8	51 Å²	51	4%	0.042	30%	0.302	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	146.9	-178.7	-59.9	175	0	0	0	110.4	V112 R114 A145 F169 Y170	V112-L147 HydrophobicContact CG2-CD1 4.31Å; R114-L147 HydrophobicContact CG-CD1 4.04Å; A145-L147 HydrophobicContact CB-CD2 4.33Å; A145-L147 HydrophobicContact CB-CG 4.25Å; A145-L147 PolarHBondContact O-N 2.92Å; L147-F169 CarbonylContact O-C 3.21Å; L147-F169 VanDerWaalsContact O-CA 3.26Å; L147-F169 WeakPolarHBondContact O-CA 3.41Å; L147-Y170 HydrophobicContact CB-CD1 4.14Å; L147-Y170 HydrophobicContact CB-CD2 4.2Å; L147-Y170 HydrophobicContact CB-CE1 3.65Å; L147-Y170 HydrophobicContact CB-CE2 3.71Å; L147-Y170 HydrophobicContact CB-CG 4.39Å; L147-Y170 VanDerWaalsContact CB-CZ 3.41Å; L147-Y170 HydrophobicContact CD1-CD2 4.42Å; L147-Y170 HydrophobicContact CD1-CE2 3.58Å; L147-Y170 HydrophobicContact CG-CE2 4.25Å; L147-Y170 PolarHBondContact N-O 3.43Å; L147-Y170 WeakPolarHBondContact O-CD1 3.43Å; L147-Y170 WeakPolarHBondContact O-CE1 3.47Å; L147-Y170 PolarHBondContact O-N 3.41Å
148	N	78.5	Confident	80	Confident	97 Å²	97	50.5 Å²	50.5	52%	0.519	30%	0.299	S	S	.	.			trans	-134.8	9.9	178.2	66.6	1.3	0	0	0	113.4	H168 F169	N148-H168 WeakPolarHBondContact CB-O 3.37Å; N148-F169 HydrophobicContact CB-CD1 3.89Å; N148-F169 HydrophobicContact CB-CE1 3.84Å; N148-F169 HydrophobicContact CB-CZ 4.45Å
149	D	78	Confident	81.3	Confident	59 Å²	59	49.4 Å²	49.4	32%	0.316	29%	0.291	S	S	.	.	S	Bend	trans	-117.7	149.5	178.7	66.7	-28.8	0	0	0	111.6	R114 Y170	R114-D149 IonicContact CZ-OD1 3.85Å; R114-D149 VanDerWaalsContact CZ-OD1 3.29Å; R114-D149 IonicContact NH1-OD1 2.74Å; R114-D149 PolarHBondContact NH1-OD1 2.94Å; R114-D149 IonicContact NH1-OD2 3.29Å; R114-D149 PolarHBondContact NH1-OD2 3.09Å; R114-D149 PolarHBondContact NH2-O 3.32Å; R114-D149 IonicContact NH2-OD1 2.83Å; R114-D149 PolarHBondContact NH2-OD1 3.24Å; R114-D149 IonicContact NH2-OD2 3.71Å; D149-Y170 PolarHBondContact O-OH 3.45Å
150	I	77.8	Confident	82.5	Confident	86 Å²	86	45.7 Å²	45.7	44%	0.441	27%	0.274	S	S	.	.			trans	-85.9	114.6	176.2	-56.8	-178.6	0	0	0	107.8	M157	I150-M157 HydrophobicContact CB-CE 4.35Å; I150-M157 HydrophobicContact CG2-CE 3.47Å; I150-M157 VanDerWaalsContact CG2-CE 3.47Å; I150-M157 HydrophobicContact CG2-SD 3.98Å
151	A	74.9	Confident	83.3	Confident	19 Å²	19	45.1 Å²	45.1	16%	0.157	27%	0.272	C	S	.	.			trans	-146.7	150.5	172.9	0	0	0	0	0	110.8	V136 M157	V136-A151 HydrophobicContact CB-CB 4.31Å; A151-M157 WeakPolarHBondContact O-CE 3.44Å
152	G	79.7	Confident	84.5	Confident	26 Å²	26	39 Å²	39	27%	0.268	23%	0.234	S	C	.	.	S	Bend	trans	112.7	179.8	-178.1	0	0	0	0	0	113
153	T	87.1	Confident	84.9	Confident	39 Å²	39	41.2 Å²	41.2	24%	0.239	23%	0.23	C	C	.	.			trans	-80.1	123.3	179.4	-55.9	0	0	0	0	110.7	D115 K117 A155 F156 M157	D115-T153 WeakPolarHBondContact OD1-CB 3.45Å; D115-T153 PolarHBondContact OD1-N 2.94Å; D115-T153 PolarHBondContact OD1-OG1 3.47Å; K117-T153 HydrophobicContact CD-CG2 4.46Å; K117-T153 VanDerWaalsContact CD-OG1 3.31Å; K117-T153 WeakPolarHBondContact CD-OG1 3.47Å; K117-T153 PolarHBondContact NZ-OG1 2.9Å; T153-A155 VanDerWaalsContact C-N 3.34Å; T153-A155 PolarHBondContact O-N 2.92Å; T153-F156 HydrophobicContact CG2-CD2 3.84Å; T153-F156 HydrophobicContact CG2-CE2 4.28Å; T153-F156 PolarHBondContact O-N 3.23Å; T153-M157 WeakPolarHBondContact O-CG 3.24Å; T153-M157 PolarHBondContact O-N 3.2Å
154	P	92.3	Very high	85	Confident	46 Å²	46	41.7 Å²	41.7	30%	0.299	23%	0.228	S	C	.	.	G	3₁₀ helix	trans	-46.5	-44.3	-170.7	-35.5	37.8	0	0	0	116.7	F156 M157 V199 L202 Y203 I206	P154-F156 PolarHBondContact O-N 3.26Å; P154-M157 PolarHBondContact O-N 3.18Å; P154-V199 HydrophobicContact CB-CG2 4.18Å; P154-V199 HydrophobicContact CG-CG2 4.27Å; P154-L202 HydrophobicContact CB-CD2 3.92Å; P154-Y203 HydrophobicContact CB-CE1 3.87Å; P154-I206 WeakPolarHBondContact O-CD1 3.34Å
155	A	95	Very high	85	Confident	17 Å²	17	42 Å²	42	14%	0.14	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-70.2	-14.2	-177.7	0	0	0	0	0	114.4	T153 V192 L202	T153-A155 VanDerWaalsContact C-N 3.34Å; T153-A155 PolarHBondContact O-N 2.92Å; A155-V192 HydrophobicContact CB-CG1 4.27Å; A155-V192 HydrophobicContact CB-CG2 4.25Å; A155-L202 HydrophobicContact CB-CD2 4.34Å
156	F	96	Very high	84.5	Confident	12 Å²	12	50.6 Å²	50.6	5%	0.053	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-106.9	-0.4	-179	-64.2	-96.5	0	0	0	112.3	I81 I116 K117 T153 P154 Q175 S179 I182 V192	I81-F156 HydrophobicContact CD1-CE2 4.46Å; I81-F156 HydrophobicContact CD1-CZ 3.83Å; I116-F156 WeakPolarHBondContact O-CD1 3.25Å; K117-F156 HydrophobicContact CB-CD1 3.75Å; K117-F156 HydrophobicContact CB-CD2 4.05Å; K117-F156 HydrophobicContact CB-CE1 3.61Å; K117-F156 HydrophobicContact CB-CE2 3.92Å; K117-F156 HydrophobicContact CB-CG 3.98Å; K117-F156 HydrophobicContact CB-CZ 3.71Å; T153-F156 HydrophobicContact CG2-CD2 3.84Å; T153-F156 HydrophobicContact CG2-CE2 4.28Å; T153-F156 PolarHBondContact O-N 3.23Å; P154-F156 PolarHBondContact O-N 3.26Å; F156-Q175 PolarHBondContact O-NE2 3.42Å; F156-S179 PolarHBondContact O-OG 3.48Å; F156-I182 HydrophobicContact CD1-CB 3.83Å; F156-I182 HydrophobicContact CD1-CG2 3.45Å; F156-I182 VanDerWaalsContact CD1-CG2 3.45Å; F156-I182 HydrophobicContact CE1-CB 4.24Å; F156-I182 HydrophobicContact CE1-CG2 3.55Å; F156-I182 HydrophobicContact CG-CG2 4.08Å; F156-I182 HydrophobicContact CZ-CG2 4.25Å; F156-V192 HydrophobicContact CE1-CG1 4.48Å; F156-V192 HydrophobicContact CE2-CG1 4.16Å; F156-V192 HydrophobicContact CZ-CG1 3.9Å
157	M	94.9	Very high	84.3	Confident	2 Å²	2	51.6 Å²	51.6	1%	0.01	28%	0.28	C	S	.	.			trans	-78.1	139.8	179.2	-62.1	-171.6	68.7	0	0	110.9	I150 A151 T153 P154 A161 L162 W178	I150-M157 HydrophobicContact CB-CE 4.35Å; I150-M157 HydrophobicContact CG2-CE 3.47Å; I150-M157 VanDerWaalsContact CG2-CE 3.47Å; I150-M157 HydrophobicContact CG2-SD 3.98Å; A151-M157 WeakPolarHBondContact O-CE 3.44Å; T153-M157 WeakPolarHBondContact O-CG 3.24Å; T153-M157 PolarHBondContact O-N 3.2Å; P154-M157 PolarHBondContact O-N 3.18Å; M157-A161 HydrophobicContact CE-CB 3.96Å; M157-L162 HydrophobicContact CB-CD2 3.88Å; M157-L162 HydrophobicContact CB-CG 4.37Å; M157-L162 HydrophobicContact CE-CD2 4.03Å; M157-L162 HydrophobicContact SD-CD2 3.99Å; M157-W178 PolarHBondContact O-NE1 2.88Å
158	A	96.2	Very high	84.5	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.29	C	S	.	.			trans	-75.8	152.5	177.4	0	0	0	0	0	110	E160 A161 W178	A158-E160 VanDerWaalsContact CB-CD 3.41Å; A158-E160 HydrophobicContact CB-CG 4.4Å; A158-E160 WeakPolarHBondContact CB-OE1 3.35Å; A158-E160 VanDerWaalsContact CB-OE2 3.3Å; A158-E160 WeakPolarHBondContact CB-OE2 3.46Å; A158-E160 PolarHBondContact O-N 3.25Å; A158-A161 PolarHBondContact O-N 3.26Å; A158-W178 VanDerWaalsContact CA-CD1 3.48Å; A158-W178 HydrophobicContact CB-CB 3.63Å; A158-W178 HydrophobicContact CB-CD2 4Å; A158-W178 HydrophobicContact CB-CG 3.55Å
159	P	95.7	Very high	84.8	Confident	11 Å²	11	54.3 Å²	54.3	7%	0.071	29%	0.288	C	S	.	.	G	3₁₀ helix	trans	-57.3	-35.7	-176.8	22.5	-33.6	0	0	0	113.1	A161 L162 W178 I206 R207 K233	P159-A161 VanDerWaalsContact C-N 3.34Å; P159-A161 PolarHBondContact O-N 3.42Å; P159-L162 PolarHBondContact O-N 3Å; P159-W178 HydrophobicContact CG-CH2 4.3Å; P159-W178 HydrophobicContact CG-CZ3 4.12Å; P159-I206 HydrophobicContact CB-CG2 4.26Å; P159-R207 HydrophobicContact CB-CG 3.97Å; P159-K233 HydrophobicContact CG-CB 4.35Å; P159-K233 HydrophobicContact CG-CD 4.24Å; P159-K233 VanDerWaalsContact CG-O 3.3Å; P159-K233 WeakPolarHBondContact CG-O 3.28Å
160	E	93.5	Very high	85.3	Confident	14 Å²	14	52 Å²	52	7%	0.065	28%	0.275	C	S	.	.	G	3₁₀ helix	trans	-68.1	-29.5	177.1	66.8	-84.4	-162.9	0	0	113.4	A158 L162 E163 H168 Y170 P235 R238	A158-E160 VanDerWaalsContact CB-CD 3.41Å; A158-E160 HydrophobicContact CB-CG 4.4Å; A158-E160 WeakPolarHBondContact CB-OE1 3.35Å; A158-E160 VanDerWaalsContact CB-OE2 3.3Å; A158-E160 WeakPolarHBondContact CB-OE2 3.46Å; A158-E160 PolarHBondContact O-N 3.25Å; E160-L162 PolarHBondContact O-N 2.66Å; E160-E163 PolarHBondContact O-N 2.98Å; E160-H168 PolarHBondContact O-CD2 3.13Å; E160-H168 PolarHBondContact O-NE2 3.08Å; E160-H168 VanDerWaalsContact O-NE2 3.1Å; E160-Y170 HydrophobicContact CG-CD2 4.31Å; E160-Y170 HydrophobicContact CG-CG 4.22Å; E160-P235 HydrophobicContact CG-CG 4.46Å; E160-R238 IonicContact OE1-CZ 3.83Å; E160-R238 IonicContact OE1-NH1 2.7Å; E160-R238 PolarHBondContact OE1-NH1 3.36Å; E160-R238 IonicContact OE1-NH2 3.36Å; E160-R238 PolarHBondContact OE1-NH2 3.49Å; E160-R238 IonicContact OE2-CZ 3.53Å; E160-R238 IonicContact OE2-NH1 2.61Å; E160-R238 IonicContact OE2-NH2 3.11Å; E160-R238 PolarHBondContact OE2-NH2 2.92Å
161	A	91.5	Very high	85.9	Confident	2 Å²	2	49 Å²	49	2%	0.017	26%	0.262	C	S	.	.	G	3₁₀ helix	trans	-75.2	-6.4	176	0	0	0	0	0	113.4	M157 A158 P159 Y170	M157-A161 HydrophobicContact CE-CB 3.96Å; A158-A161 PolarHBondContact O-N 3.26Å; P159-A161 VanDerWaalsContact C-N 3.34Å; P159-A161 PolarHBondContact O-N 3.42Å; A161-Y170 HydrophobicContact CB-CD1 4.42Å; A161-Y170 HydrophobicContact CB-CD2 4.06Å; A161-Y170 HydrophobicContact CB-CE1 4.02Å; A161-Y170 HydrophobicContact CB-CE2 3.62Å; A161-Y170 HydrophobicContact CB-CG 4.45Å
162	L	89.8	Confident	86.7	Confident	3 Å²	3	48.1 Å²	48.1	2%	0.016	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-101.4	3.2	179.1	-56	177.4	0	0	0	112.6	M157 P159 E160 Y203 I206	M157-L162 HydrophobicContact CB-CD2 3.88Å; M157-L162 HydrophobicContact CB-CG 4.37Å; M157-L162 HydrophobicContact CE-CD2 4.03Å; M157-L162 HydrophobicContact SD-CD2 3.99Å; P159-L162 PolarHBondContact O-N 3Å; E160-L162 PolarHBondContact O-N 2.66Å; L162-Y203 HydrophobicContact CD1-CD1 3.62Å; L162-Y203 HydrophobicContact CD1-CE1 4.3Å; L162-Y203 HydrophobicContact CD1-CG 3.97Å; L162-Y203 HydrophobicContact CD2-CD1 3.56Å; L162-Y203 HydrophobicContact CD2-CD2 4.33Å; L162-Y203 HydrophobicContact CD2-CE1 3.41Å; L162-Y203 VanDerWaalsContact CD2-CE1 3.41Å; L162-Y203 HydrophobicContact CD2-CE2 4.24Å; L162-Y203 HydrophobicContact CD2-CG 4.02Å; L162-Y203 HydrophobicContact CG-CD1 4.19Å; L162-Y203 HydrophobicContact CG-CE1 4.48Å; L162-Y203 HydrophobicContact CG-CG 4.45Å; L162-I206 HydrophobicContact CD1-CB 3.91Å; L162-I206 HydrophobicContact CD1-CD1 4.07Å; L162-I206 HydrophobicContact CD1-CG2 3.66Å
163	E	82.9	Confident	87.4	Confident	98 Å²	98	50.1 Å²	50.1	46%	0.458	25%	0.254	S	S	.	.			trans	-71.1	124.7	172.9	-161.9	91.1	-148.6	0	0	109.5	E160 A165 H168	E160-E163 PolarHBondContact O-N 2.98Å; E163-A165 HydrophobicContact CG-CB 4.25Å; E163-H168 HydrophobicContact CB-CB 4.26Å; E163-H168 HydrophobicContact CG-CB 3.96Å
164	E	70.1	Confident	87.8	Confident	159 Å²	159	49 Å²	49	74%	0.743	25%	0.248	S	C	*	.			trans	-87.6	-5.5	-176.5	-65.3	179.8	-172.8	0	0	113.4	K166	E164-K166 PolarHBondContact O-N 3.1Å
165	A	75	Confident	87.9	Confident	55 Å²	55	46.9 Å²	46.9	46%	0.455	23%	0.234	S	C	.	.			trans	-65	124.3	-178.5	0	0	0	0	0	110.6	E163 D167 H168	E163-A165 HydrophobicContact CG-CB 4.25Å; A165-D167 PolarHBondContact O-N 2.94Å; A165-D167 VanDerWaalsContact O-N 3.11Å; A165-H168 HydrophobicContact CB-CB 4.08Å; A165-H168 VanDerWaalsContact O-CB 3.23Å; A165-H168 WeakPolarHBondContact O-CB 3.18Å; A165-H168 PolarHBondContact O-N 3.38Å
166	K	67.4	Low	88	Confident	184 Å²	184	46 Å²	46	80%	0.8	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-61	-25.3	-173.9	-72.2	-178.8	-179.3	169.5	0	114.4	E164	E164-K166 PolarHBondContact O-N 3.1Å
167	D	76.1	Confident	88.1	Confident	146 Å²	146	45.8 Å²	45.8	78%	0.781	23%	0.227	S	C	*	.	T	Hydrogen-bonded Turn	trans	-99.7	7.4	-179.8	-54.7	-43.1	0	0	0	111.9	A165 F169	A165-D167 PolarHBondContact O-N 2.94Å; A165-D167 VanDerWaalsContact O-N 3.11Å; D167-F169 WeakPolarHBondContact O-CD2 3.38Å
168	H	82.1	Confident	88.2	Confident	52 Å²	52	45.7 Å²	45.7	24%	0.241	23%	0.227	C	C	.	.			trans	-78.7	126.1	173.4	-176.6	77.8	0	0	0	110.3	N148 E160 E163 A165	N148-H168 WeakPolarHBondContact CB-O 3.37Å; E160-H168 PolarHBondContact O-CD2 3.13Å; E160-H168 PolarHBondContact O-NE2 3.08Å; E160-H168 VanDerWaalsContact O-NE2 3.1Å; E163-H168 HydrophobicContact CB-CB 4.26Å; E163-H168 HydrophobicContact CG-CB 3.96Å; A165-H168 HydrophobicContact CB-CB 4.08Å; A165-H168 VanDerWaalsContact O-CB 3.23Å; A165-H168 WeakPolarHBondContact O-CB 3.18Å; A165-H168 PolarHBondContact O-N 3.38Å
169	F	84.8	Confident	88.3	Confident	110 Å²	110	45.8 Å²	45.8	48%	0.482	23%	0.227	S	C	.	.			trans	-116.3	136.6	170.7	-65.8	-92.1	0	0	0	109	L146 L147 N148 D167	L146-F169 HydrophobicContact CB-CB 4.3Å; L146-F169 HydrophobicContact CB-CD1 4.12Å; L146-F169 HydrophobicContact CD2-CB 4.32Å; L147-F169 CarbonylContact O-C 3.21Å; L147-F169 VanDerWaalsContact O-CA 3.26Å; L147-F169 WeakPolarHBondContact O-CA 3.41Å; N148-F169 HydrophobicContact CB-CD1 3.89Å; N148-F169 HydrophobicContact CB-CE1 3.84Å; N148-F169 HydrophobicContact CB-CZ 4.45Å; D167-F169 WeakPolarHBondContact O-CD2 3.38Å
170	Y	87.9	Confident	88.5	Confident	11 Å²	11	45.3 Å²	45.3	4%	0.043	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	158.3	176.7	65.8	-86.9	0	0	0	111.5	R114 L147 D149 E160 A161 G172 Q175	R114-Y170 PolarHBondContact NH2-OH 2.89Å; R114-Y170 VanDerWaalsContact NH2-OH 3.13Å; L147-Y170 HydrophobicContact CB-CD1 4.14Å; L147-Y170 HydrophobicContact CB-CD2 4.2Å; L147-Y170 HydrophobicContact CB-CE1 3.65Å; L147-Y170 HydrophobicContact CB-CE2 3.71Å; L147-Y170 HydrophobicContact CB-CG 4.39Å; L147-Y170 VanDerWaalsContact CB-CZ 3.41Å; L147-Y170 HydrophobicContact CD1-CD2 4.42Å; L147-Y170 HydrophobicContact CD1-CE2 3.58Å; L147-Y170 HydrophobicContact CG-CE2 4.25Å; L147-Y170 PolarHBondContact N-O 3.43Å; L147-Y170 WeakPolarHBondContact O-CD1 3.43Å; L147-Y170 WeakPolarHBondContact O-CE1 3.47Å; L147-Y170 PolarHBondContact O-N 3.41Å; D149-Y170 PolarHBondContact O-OH 3.45Å; E160-Y170 HydrophobicContact CG-CD2 4.31Å; E160-Y170 HydrophobicContact CG-CG 4.22Å; A161-Y170 HydrophobicContact CB-CD1 4.42Å; A161-Y170 HydrophobicContact CB-CD2 4.06Å; A161-Y170 HydrophobicContact CB-CE1 4.02Å; A161-Y170 HydrophobicContact CB-CE2 3.62Å; A161-Y170 HydrophobicContact CB-CG 4.45Å; Y170-G172 PolarHBondContact O-N 3.21Å; Y170-Q175 HydrophobicContact CD2-CB 4.26Å; Y170-Q175 HydrophobicContact CE2-CB 4.05Å; Y170-Q175 HydrophobicContact CE2-CG 4.22Å
171	S	91.3	Very high	88.7	Confident	24 Å²	24	44.6 Å²	44.6	17%	0.168	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	116.8	176	167	0	0	0	0	110.8	D144 R173 A174 Q175	D144-S171 PolarHBondContact OD1-OG 2.9Å; D144-S171 WeakPolarHBondContact OD2-CB 3.47Å; D144-S171 PolarHBondContact OD2-OG 3.49Å; S171-R173 VanDerWaalsContact C-N 3.27Å; S171-R173 PolarHBondContact O-N 3.28Å; S171-R173 PolarHBondContact OG-N 2.96Å; S171-A174 PolarHBondContact O-N 3.49Å; S171-A174 WeakPolarHBondContact OG-CB 3.28Å; S171-A174 PolarHBondContact OG-N 3.43Å; S171-Q175 WeakPolarHBondContact O-CB 3.39Å; S171-Q175 PolarHBondContact O-N 3.32Å
172	G	91.1	Very high	89	Confident	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.22	C	C	.	.	H	α-helix	trans	-65.7	-30.7	171.9	0	0	0	0	0	112.7	V112 A145 Y170 Q175 D176	V112-G172 VanDerWaalsContact CG1-C 3.48Å; A145-G172 PolarHBondContact O-N 3.24Å; Y170-G172 PolarHBondContact O-N 3.21Å; G172-Q175 WeakPolarHBondContact O-CB 3.44Å; G172-Q175 PolarHBondContact O-N 2.9Å; G172-D176 PolarHBondContact O-N 3.05Å
173	R	93.9	Very high	89.4	Confident	68 Å²	68	44.4 Å²	44.4	26%	0.257	22%	0.219	S	C	.	.	H	α-helix	trans	-67.2	-44.7	174.4	-70.2	178.3	171.9	-161.6	-9.1	111.3	H107 V112 F140 L143 D144 S171 Q175 D176 I177	H107-R173 PolarHBondContact O-NH2 3.28Å; V112-R173 HydrophobicContact CG1-CG 4.07Å; F140-R173 HydrophobicContact CZ-CG 4.39Å; L143-R173 PolarHBondContact O-NE 3.48Å; L143-R173 PolarHBondContact O-NH1 3.28Å; D144-R173 WeakPolarHBondContact OD1-CB 3.46Å; D144-R173 WeakPolarHBondContact OD1-CD 3.44Å; D144-R173 WeakPolarHBondContact OD1-CG 3.3Å; D144-R173 PolarHBondContact OD1-N 3.4Å; S171-R173 VanDerWaalsContact C-N 3.27Å; S171-R173 PolarHBondContact O-N 3.28Å; S171-R173 PolarHBondContact OG-N 2.96Å; R173-Q175 VanDerWaalsContact C-N 3.32Å; R173-Q175 PolarHBondContact O-N 2.86Å; R173-D176 PolarHBondContact O-N 3.37Å; R173-I177 WeakPolarHBondContact O-CG1 3.45Å; R173-I177 PolarHBondContact O-N 3Å; R173-I177 VanDerWaalsContact O-N 3.12Å
174	A	95.6	Very high	90.2	Very high	14 Å²	14	39.8 Å²	39.8	12%	0.116	20%	0.198	C	C	.	.	H	α-helix	trans	-64.7	-38.6	176.7	0	0	0	0	0	111.5	S171 I177 W178 P235 R238	S171-A174 PolarHBondContact O-N 3.49Å; S171-A174 WeakPolarHBondContact OG-CB 3.28Å; S171-A174 PolarHBondContact OG-N 3.43Å; A174-I177 WeakPolarHBondContact O-CB 3.48Å; A174-I177 PolarHBondContact O-N 3.47Å; A174-W178 PolarHBondContact O-N 3.02Å; A174-P235 HydrophobicContact CB-CB 3.93Å; A174-R238 PolarHBondContact O-NH1 3Å
175	Q	95.4	Very high	91.5	Very high	2 Å²	2	32.3 Å²	32.3	1%	0.009	16%	0.163	C	C	.	.	H	α-helix	trans	-56.7	-47.4	172.1	168.6	59.9	58	0	0	111.6	F156 Y170 S171 G172 R173 I177 W178 S179	F156-Q175 PolarHBondContact O-NE2 3.42Å; Y170-Q175 HydrophobicContact CD2-CB 4.26Å; Y170-Q175 HydrophobicContact CE2-CB 4.05Å; Y170-Q175 HydrophobicContact CE2-CG 4.22Å; S171-Q175 WeakPolarHBondContact O-CB 3.39Å; S171-Q175 PolarHBondContact O-N 3.32Å; G172-Q175 WeakPolarHBondContact O-CB 3.44Å; G172-Q175 PolarHBondContact O-N 2.9Å; R173-Q175 VanDerWaalsContact C-N 3.32Å; R173-Q175 PolarHBondContact O-N 2.86Å; Q175-I177 VanDerWaalsContact C-N 3.33Å; Q175-I177 PolarHBondContact O-N 3.15Å; Q175-W178 WeakPolarHBondContact O-CB 3.42Å; Q175-W178 PolarHBondContact O-N 3.19Å; Q175-S179 PolarHBondContact NE2-OG 2.91Å; Q175-S179 PolarHBondContact O-N 3.26Å; Q175-S179 PolarHBondContact O-OG 3.23Å
176	D	96.5	Very high	92.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-62.5	-38.3	177.8	-78.4	-19.2	0	0	0	112.3	L103 H107 V112 H113 R114 G172 R173 S179 L180	L103-D176 HydrophobicContact CD1-CB 4Å; L103-D176 HydrophobicContact CD2-CB 3.96Å; L103-D176 HydrophobicContact CG-CB 4.46Å; H107-D176 IonicContact CD2-OD2 3.38Å; H107-D176 IonicContact CE1-OD2 2.64Å; H107-D176 IonicContact NE2-OD2 3.44Å; H107-D176 PolarHBondContact NE2-OD2 2.7Å; V112-D176 WeakPolarHBondContact CA-OD2 3.43Å; H113-D176 PolarHBondContact N-OD1 3.09Å; H113-D176 PolarHBondContact N-OD2 2.83Å; R114-D176 WeakPolarHBondContact CA-OD1 3.27Å; R114-D176 PolarHBondContact N-OD1 2.92Å; G172-D176 PolarHBondContact O-N 3.05Å; R173-D176 PolarHBondContact O-N 3.37Å; D176-S179 PolarHBondContact O-N 2.75Å; D176-L180 WeakPolarHBondContact O-CB 3.24Å; D176-L180 PolarHBondContact O-N 3.5Å
177	I	98.1	Very high	94.1	Very high	7 Å²	7	21 Å²	21	4%	0.036	10%	0.103	C	C	.	.	H	α-helix	trans	-60.1	-46.3	173.5	-64.7	-54.8	0	0	0	111.1	R173 A174 Q175 S179 L180 G181 M230 R238 C239 L241 I244	R173-I177 WeakPolarHBondContact O-CG1 3.45Å; R173-I177 PolarHBondContact O-N 3Å; R173-I177 VanDerWaalsContact O-N 3.12Å; A174-I177 WeakPolarHBondContact O-CB 3.48Å; A174-I177 PolarHBondContact O-N 3.47Å; Q175-I177 VanDerWaalsContact C-N 3.33Å; Q175-I177 PolarHBondContact O-N 3.15Å; I177-S179 PolarHBondContact O-N 3.36Å; I177-L180 WeakPolarHBondContact O-CB 3.5Å; I177-L180 PolarHBondContact O-N 3.24Å; I177-G181 PolarHBondContact O-N 3.04Å; I177-M230 HydrophobicContact CG2-CB 4.25Å; I177-M230 HydrophobicContact CG2-CE 4.21Å; I177-M230 HydrophobicContact CG2-CG 4.25Å; I177-M230 VanDerWaalsContact O-CE 3.29Å; I177-M230 WeakPolarHBondContact O-CE 3.26Å; I177-R238 HydrophobicContact CG2-CG 3.84Å; I177-C239 WeakPolarHBondContact CG2-O 3.36Å; I177-L241 HydrophobicContact CD1-CB 4.46Å; I177-L241 HydrophobicContact CD1-CD2 3.34Å; I177-L241 HydrophobicContact CD1-CG 3.48Å; I177-L241 VanDerWaalsContact CD1-CG 3.48Å; I177-I244 HydrophobicContact CD1-CD1 3.76Å; I177-I244 HydrophobicContact CG2-CD1 4.12Å
178	W	98.4	Very high	95.1	Very high	0 Å²	0	14.1 Å²	14.1	0%	0	7%	0.067	C	C	.	.	H	α-helix	trans	-58.8	-50.2	177.6	174.4	-81.3	0	0	0	110.9	M157 A158 P159 A174 Q175 L180 G181 I182 F194 I206 L231 K233	M157-W178 PolarHBondContact O-NE1 2.88Å; A158-W178 VanDerWaalsContact CA-CD1 3.48Å; A158-W178 HydrophobicContact CB-CB 3.63Å; A158-W178 HydrophobicContact CB-CD2 4Å; A158-W178 HydrophobicContact CB-CG 3.55Å; P159-W178 HydrophobicContact CG-CH2 4.3Å; P159-W178 HydrophobicContact CG-CZ3 4.12Å; A174-W178 PolarHBondContact O-N 3.02Å; Q175-W178 WeakPolarHBondContact O-CB 3.42Å; Q175-W178 PolarHBondContact O-N 3.19Å; W178-L180 VanDerWaalsContact C-N 3.27Å; W178-L180 PolarHBondContact O-N 3.35Å; W178-G181 WeakPolarHBondContact O-CA 3.46Å; W178-G181 PolarHBondContact O-N 3.36Å; W178-I182 HydrophobicContact CZ2-CD1 4.24Å; W178-I182 WeakPolarHBondContact O-CG1 3.27Å; W178-I182 PolarHBondContact O-N 2.7Å; W178-F194 AromaticContact CH2-CE2 3.96Å; W178-F194 HydrophobicContact CH2-CE2 3.96Å; W178-F194 HydrophobicContact CZ2-CD2 4.24Å; W178-F194 AromaticContact CZ2-CE2 3.74Å; W178-F194 HydrophobicContact CZ2-CE2 3.74Å; W178-I206 HydrophobicContact CZ2-CG2 3.93Å; W178-L231 HydrophobicContact CD2-CD2 4Å; W178-L231 HydrophobicContact CE3-CD2 4.14Å; W178-L231 HydrophobicContact CG-CD2 4.41Å; W178-L231 HydrophobicContact CZ3-CB 4.35Å; W178-L231 HydrophobicContact CZ3-CD2 4.47Å; W178-L231 WeakPolarHBondContact CZ3-O 3.44Å; W178-K233 HydrophobicContact CH2-CD 3.78Å; W178-K233 HydrophobicContact CZ3-CD 4.03Å
179	S	98	Very high	95.8	Very high	1 Å²	1	12.4 Å²	12.4	1%	0.007	6%	0.059	C	C	.	.	H	α-helix	trans	-58.9	-38.6	178.3	-59.2	0	0	0	0	112.2	I116 F156 Q175 D176 I177 G181 I182 T183	I116-S179 WeakPolarHBondContact O-CB 3.1Å; F156-S179 PolarHBondContact O-OG 3.48Å; Q175-S179 PolarHBondContact NE2-OG 2.91Å; Q175-S179 PolarHBondContact O-N 3.26Å; Q175-S179 PolarHBondContact O-OG 3.23Å; D176-S179 PolarHBondContact O-N 2.75Å; I177-S179 PolarHBondContact O-N 3.36Å; S179-G181 VanDerWaalsContact C-N 3.34Å; S179-I182 PolarHBondContact O-N 2.96Å; S179-T183 WeakPolarHBondContact O-CB 3.45Å; S179-T183 PolarHBondContact O-N 3.05Å; S179-T183 PolarHBondContact O-OG1 3.37Å
180	L	98.4	Very high	96.4	Very high	1 Å²	1	7.2 Å²	7.2	1%	0.005	4%	0.036	C	C	.	.	H	α-helix	trans	-64.7	-36.6	173.5	-172.8	67.2	0	0	0	111.9	F96 A99 V100 L103 I116 D176 I177 W178 T183 L184 M230 L241	F96-L180 HydrophobicContact CD2-CD1 4.35Å; F96-L180 HydrophobicContact CD2-CG 4.34Å; F96-L180 HydrophobicContact CE2-CD1 4.16Å; F96-L180 HydrophobicContact CE2-CD2 3.92Å; F96-L180 HydrophobicContact CE2-CG 3.66Å; F96-L180 HydrophobicContact CZ-CD2 4.03Å; F96-L180 HydrophobicContact CZ-CG 4.27Å; A99-L180 HydrophobicContact CB-CD1 3.82Å; V100-L180 HydrophobicContact CG2-CD2 3.87Å; L103-L180 HydrophobicContact CD2-CB 4.45Å; L103-L180 HydrophobicContact CD2-CD2 4.09Å; I116-L180 HydrophobicContact CG2-CB 4.32Å; I116-L180 HydrophobicContact CG2-CD1 4.12Å; D176-L180 WeakPolarHBondContact O-CB 3.24Å; D176-L180 PolarHBondContact O-N 3.5Å; I177-L180 WeakPolarHBondContact O-CB 3.5Å; I177-L180 PolarHBondContact O-N 3.24Å; W178-L180 VanDerWaalsContact C-N 3.27Å; W178-L180 PolarHBondContact O-N 3.35Å; L180-T183 WeakPolarHBondContact O-CB 3.33Å; L180-T183 PolarHBondContact O-N 2.94Å; L180-L184 PolarHBondContact O-N 2.98Å; L180-M230 HydrophobicContact CB-CE 3.73Å; L180-M230 HydrophobicContact CD2-CE 3.86Å; L180-M230 HydrophobicContact CG-CE 3.73Å; L180-L241 HydrophobicContact CD2-CD2 4.45Å
181	G	98.6	Very high	96.8	Very high	0 Å²	0	12 Å²	12	0%	0	5%	0.054	C	C	.	.	H	α-helix	trans	-68.2	-42.7	176.4	0	0	0	0	0	112.5	I177 W178 S179 T183 L184 F185 M230	I177-G181 PolarHBondContact O-N 3.04Å; W178-G181 WeakPolarHBondContact O-CA 3.46Å; W178-G181 PolarHBondContact O-N 3.36Å; S179-G181 VanDerWaalsContact C-N 3.34Å; G181-T183 VanDerWaalsContact C-N 3.26Å; G181-T183 PolarHBondContact O-N 3.43Å; G181-L184 PolarHBondContact O-N 2.9Å; G181-F185 PolarHBondContact O-N 3.18Å; G181-M230 VanDerWaalsContact CA-CE 3.43Å
182	I	98.5	Very high	97	Very high	0 Å²	0	11.9 Å²	11.9	0%	0	5%	0.052	C	C	.	.	H	α-helix	trans	-62.3	-39.1	173.3	-60.6	-63.2	0	0	0	110	F156 W178 S179 F185 A186 V192 P193 F194 L231	F156-I182 HydrophobicContact CD1-CB 3.83Å; F156-I182 HydrophobicContact CD1-CG2 3.45Å; F156-I182 VanDerWaalsContact CD1-CG2 3.45Å; F156-I182 HydrophobicContact CE1-CB 4.24Å; F156-I182 HydrophobicContact CE1-CG2 3.55Å; F156-I182 HydrophobicContact CG-CG2 4.08Å; F156-I182 HydrophobicContact CZ-CG2 4.25Å; W178-I182 HydrophobicContact CZ2-CD1 4.24Å; W178-I182 WeakPolarHBondContact O-CG1 3.27Å; W178-I182 PolarHBondContact O-N 2.7Å; S179-I182 PolarHBondContact O-N 2.96Å; I182-F185 PolarHBondContact O-N 2.79Å; I182-A186 WeakPolarHBondContact O-CB 3.47Å; I182-A186 PolarHBondContact O-N 3.17Å; I182-V192 HydrophobicContact CG2-CB 4.32Å; I182-V192 HydrophobicContact CG2-CG1 3.85Å; I182-P193 HydrophobicContact CD1-CG 3.45Å; I182-P193 VanDerWaalsContact CD1-CG 3.45Å; I182-F194 HydrophobicContact CD1-CD2 4.19Å; I182-F194 HydrophobicContact CD1-CE2 4.21Å; I182-L231 HydrophobicContact CD1-CD1 4.17Å; I182-L231 HydrophobicContact CD1-CD2 3.55Å; I182-L231 HydrophobicContact CG1-CD2 3.82Å
183	T	98.3	Very high	97.3	Very high	1 Å²	1	13.3 Å²	13.3	1%	0.006	6%	0.061	C	C	.	.	H	α-helix	trans	-64.1	-44.4	176.3	-61.7	0	0	0	0	112.2	I116 K117 P118 L121 S179 L180 G181 A186 F187	I116-T183 PolarHBondContact O-OG1 3.49Å; K117-T183 WeakPolarHBondContact CA-OG1 3.48Å; P118-T183 HydrophobicContact CG-CG2 4.07Å; L121-T183 HydrophobicContact CD1-CG2 3.64Å; S179-T183 WeakPolarHBondContact O-CB 3.45Å; S179-T183 PolarHBondContact O-N 3.05Å; S179-T183 PolarHBondContact O-OG1 3.37Å; L180-T183 WeakPolarHBondContact O-CB 3.33Å; L180-T183 PolarHBondContact O-N 2.94Å; G181-T183 VanDerWaalsContact C-N 3.26Å; G181-T183 PolarHBondContact O-N 3.43Å; T183-A186 WeakPolarHBondContact O-CB 3.49Å; T183-A186 PolarHBondContact O-N 2.87Å; T183-F187 HydrophobicContact CG2-CD1 4.46Å; T183-F187 HydrophobicContact CG2-CE1 3.94Å; T183-F187 HydrophobicContact CG2-CE2 4.1Å; T183-F187 HydrophobicContact CG2-CZ 3.76Å; T183-F187 WeakPolarHBondContact O-CG 3.23Å; T183-F187 PolarHBondContact O-N 3.13Å
184	L	98.6	Very high	97.5	Very high	0 Å²	0	10.2 Å²	10.2	0%	0	5%	0.05	C	C	.	.	H	α-helix	trans	-62.9	-43.2	175.1	177.5	56.8	0	0	0	111.8	A92 F96 L180 G181 A186 F187 V188 L223 L226 L227 W249	A92-L184 HydrophobicContact CB-CD1 4.33Å; F96-L184 HydrophobicContact CB-CD1 4.23Å; F96-L184 HydrophobicContact CD2-CB 3.75Å; F96-L184 HydrophobicContact CD2-CD1 3.9Å; F96-L184 HydrophobicContact CD2-CD2 3.85Å; F96-L184 HydrophobicContact CD2-CG 4.03Å; F96-L184 HydrophobicContact CE2-CB 3.8Å; F96-L184 HydrophobicContact CE2-CD2 3.67Å; F96-L184 HydrophobicContact CE2-CG 4.2Å; F96-L184 HydrophobicContact CG-CD1 4.19Å; F96-L184 HydrophobicContact CG-CD2 4.36Å; F96-L184 HydrophobicContact CZ-CD2 4.08Å; L180-L184 PolarHBondContact O-N 2.98Å; G181-L184 PolarHBondContact O-N 2.9Å; L184-A186 VanDerWaalsContact C-N 3.29Å; L184-A186 PolarHBondContact O-N 2.87Å; L184-F187 WeakPolarHBondContact O-CB 3.49Å; L184-F187 PolarHBondContact O-N 3.4Å; L184-V188 HydrophobicContact CD1-CG2 4.38Å; L184-V188 WeakPolarHBondContact O-CG2 3.29Å; L184-V188 PolarHBondContact O-N 2.87Å; L184-L223 HydrophobicContact CD1-CD1 4.36Å; L184-L223 HydrophobicContact CD2-CD1 3.72Å; L184-L223 HydrophobicContact CG-CD1 4.12Å; L184-L226 HydrophobicContact CD2-CD2 4.01Å; L184-L226 HydrophobicContact CD2-CG 4.49Å; L184-L227 HydrophobicContact CB-CD2 4.24Å; L184-L227 HydrophobicContact CD2-CD2 4.04Å; L184-L227 HydrophobicContact CG-CD2 3.99Å; L184-W249 HydrophobicContact CD1-CH2 3.53Å; L184-W249 HydrophobicContact CD1-CZ2 4.37Å; L184-W249 HydrophobicContact CD1-CZ3 4.01Å; L184-W249 HydrophobicContact CD2-CH2 4.28Å; L184-W249 HydrophobicContact CD2-CZ3 4.03Å
185	F	98.4	Very high	97.4	Very high	3 Å²	3	15.8 Å²	15.8	1%	0.013	7%	0.072	C	C	.	.	H	α-helix	trans	-57.4	-46.8	173.5	-173.5	-77.2	0	0	0	110.5	G181 I182 F187 V188 F189 R191 P193 L211 P214 L227	G181-F185 PolarHBondContact O-N 3.18Å; I182-F185 PolarHBondContact O-N 2.79Å; F185-F187 VanDerWaalsContact C-N 3.34Å; F185-F187 PolarHBondContact O-N 3.48Å; F185-V188 PolarHBondContact O-N 2.94Å; F185-V188 VanDerWaalsContact O-N 3.12Å; F185-F189 HydrophobicContact CD1-CB 4.18Å; F185-F189 AromaticContact CD1-CD2 3.9Å; F185-F189 HydrophobicContact CD1-CD2 3.9Å; F185-F189 HydrophobicContact CD1-CG 4.43Å; F185-F189 AromaticContact CD2-CD2 3.82Å; F185-F189 HydrophobicContact CD2-CD2 3.82Å; F185-F189 HydrophobicContact CD2-CE2 4.03Å; F185-F189 HydrophobicContact CE1-CB 3.78Å; F185-F189 AromaticContact CE1-CD2 3.77Å; F185-F189 HydrophobicContact CE1-CD2 3.77Å; F185-F189 AromaticContact CE1-CG 4Å; F185-F189 HydrophobicContact CE1-CG 4Å; F185-F189 AromaticContact CE2-CD2 3.69Å; F185-F189 HydrophobicContact CE2-CD2 3.69Å; F185-F189 AromaticContact CE2-CE2 3.86Å; F185-F189 HydrophobicContact CE2-CE2 3.86Å; F185-F189 HydrophobicContact CE2-CG 4.47Å; F185-F189 AromaticContact CG-CD2 3.92Å; F185-F189 HydrophobicContact CG-CD2 3.92Å; F185-F189 HydrophobicContact CZ-CB 4.27Å; F185-F189 AromaticContact CZ-CD2 3.67Å; F185-F189 HydrophobicContact CZ-CD2 3.67Å; F185-F189 HydrophobicContact CZ-CE2 4.22Å; F185-F189 HydrophobicContact CZ-CG 4.02Å; F185-F189 WeakPolarHBondContact O-CD2 3.46Å; F185-F189 PolarHBondContact O-N 3.26Å; F185-R191 WeakPolarHBondContact CD1-O 3.42Å; F185-R191 HydrophobicContact CE1-CG 4.49Å; F185-R191 WeakPolarHBondContact CE1-O 3.32Å; F185-P193 HydrophobicContact CD1-CB 4.04Å; F185-P193 HydrophobicContact CD1-CG 4.13Å; F185-P193 HydrophobicContact CD2-CB 4.08Å; F185-P193 HydrophobicContact CD2-CG 4.38Å; F185-P193 HydrophobicContact CE1-CB 3.85Å; F185-P193 HydrophobicContact CE1-CG 4.43Å; F185-P193 HydrophobicContact CE2-CB 3.89Å; F185-P193 HydrophobicContact CG-CB 4.16Å; F185-P193 HydrophobicContact CG-CG 4.11Å; F185-P193 HydrophobicContact CZ-CB 3.77Å; F185-L211 HydrophobicContact CD2-CD1 4.29Å; F185-L211 HydrophobicContact CE2-CD1 4.23Å; F185-P214 HydrophobicContact CZ-CG 4.35Å; F185-L227 HydrophobicContact CB-CD2 4.06Å; F185-L227 HydrophobicContact CD2-CD1 4.32Å
186	A	97.8	Very high	97.4	Very high	0 Å²	0	17.5 Å²	17.5	0%	0	8%	0.081	C	C	.	.	H	α-helix	trans	-62.7	-36.9	178.1	0	0	0	0	0	113	L79 I81 P118 I182 T183 L184 V188 G190 R191	L79-A186 VanDerWaalsContact CD2-O 3.23Å; L79-A186 WeakPolarHBondContact CD2-O 3.49Å; I81-A186 HydrophobicContact CD1-CB 4.12Å; I81-A186 HydrophobicContact CG2-CB 4.28Å; P118-A186 HydrophobicContact CG-CB 4.03Å; I182-A186 WeakPolarHBondContact O-CB 3.47Å; I182-A186 PolarHBondContact O-N 3.17Å; T183-A186 WeakPolarHBondContact O-CB 3.49Å; T183-A186 PolarHBondContact O-N 2.87Å; L184-A186 VanDerWaalsContact C-N 3.29Å; L184-A186 PolarHBondContact O-N 2.87Å; A186-V188 VanDerWaalsContact C-N 3.26Å; A186-V188 PolarHBondContact O-N 2.97Å; A186-G190 VanDerWaalsContact O-CA 3.22Å; A186-G190 WeakPolarHBondContact O-CA 3.46Å; A186-G190 PolarHBondContact O-N 3.47Å; A186-R191 WeakPolarHBondContact CA-O 3.48Å
187	F	97.7	Very high	97.3	Very high	1 Å²	1	24 Å²	24	0%	0.004	12%	0.116	C	C	.	.	H	α-helix	trans	-57.9	-39.8	173.1	-73.4	-13.7	0	0	0	112.7	V78 L79 L87 A92 H95 P118 L121 L129 T183 L184 F185	V78-F187 HydrophobicContact CB-CE1 3.94Å; V78-F187 HydrophobicContact CB-CZ 4.04Å; V78-F187 HydrophobicContact CG1-CD1 4.23Å; V78-F187 HydrophobicContact CG1-CE1 3.49Å; V78-F187 VanDerWaalsContact CG1-CE1 3.49Å; V78-F187 HydrophobicContact CG1-CE2 4.35Å; V78-F187 HydrophobicContact CG1-CZ 3.55Å; V78-F187 HydrophobicContact CG2-CZ 4.49Å; L79-F187 HydrophobicContact CB-CD1 4.16Å; L79-F187 HydrophobicContact CB-CE1 4.32Å; L79-F187 HydrophobicContact CD2-CD1 4.28Å; L87-F187 WeakPolarHBondContact CB-O 3.37Å; L87-F187 HydrophobicContact CD1-CB 4.06Å; L87-F187 HydrophobicContact CD1-CD1 4.14Å; L87-F187 HydrophobicContact CD1-CD2 4.49Å; L87-F187 HydrophobicContact CD1-CG 4Å; L87-F187 PolarHBondContact N-O 2.92Å; A92-F187 HydrophobicContact CB-CB 3.92Å; H95-F187 HydrophobicContact CB-CE2 4.01Å; P118-F187 HydrophobicContact CB-CE1 4.1Å; P118-F187 HydrophobicContact CG-CD1 4.42Å; P118-F187 HydrophobicContact CG-CE1 4.18Å; L121-F187 HydrophobicContact CD1-CZ 3.84Å; L129-F187 HydrophobicContact CD1-CZ 4.41Å; T183-F187 HydrophobicContact CG2-CD1 4.46Å; T183-F187 HydrophobicContact CG2-CE1 3.94Å; T183-F187 HydrophobicContact CG2-CE2 4.1Å; T183-F187 HydrophobicContact CG2-CZ 3.76Å; T183-F187 WeakPolarHBondContact O-CG 3.23Å; T183-F187 PolarHBondContact O-N 3.13Å; L184-F187 WeakPolarHBondContact O-CB 3.49Å; L184-F187 PolarHBondContact O-N 3.4Å; F185-F187 VanDerWaalsContact C-N 3.34Å; F185-F187 PolarHBondContact O-N 3.48Å
188	V	97.6	Very high	97	Very high	2 Å²	2	32 Å²	32	1%	0.012	15%	0.146	C	C	.	.	H	α-helix	trans	-92.9	-28.5	-171.9	-179.5	0	0	0	0	112.8	P86 A92 L184 F185 A186 R217 I219 L223	P86-V188 WeakPolarHBondContact CB-O 3.39Å; A92-V188 HydrophobicContact CB-CG2 3.68Å; L184-V188 HydrophobicContact CD1-CG2 4.38Å; L184-V188 WeakPolarHBondContact O-CG2 3.29Å; L184-V188 PolarHBondContact O-N 2.87Å; F185-V188 PolarHBondContact O-N 2.94Å; F185-V188 VanDerWaalsContact O-N 3.12Å; A186-V188 VanDerWaalsContact C-N 3.26Å; A186-V188 PolarHBondContact O-N 2.97Å; V188-R217 VanDerWaalsContact O-CD 3.26Å; V188-R217 WeakPolarHBondContact O-CD 3.43Å; V188-R217 PolarHBondContact O-NH1 3.11Å; V188-I219 HydrophobicContact CG1-CG2 3.52Å; V188-L223 HydrophobicContact CG1-CD2 4.2Å; V188-L223 HydrophobicContact CG2-CD2 3.95Å
189	F	97.3	Very high	96.7	Very high	16 Å²	16	35.2 Å²	35.2	7%	0.07	17%	0.166	C	C	.	.	H	α-helix	trans	-112.9	-7.3	-178	-64.8	-78	0	0	0	113.7	F185 R191 I213 P214 R217 I219 L227	F185-F189 HydrophobicContact CD1-CB 4.18Å; F185-F189 AromaticContact CD1-CD2 3.9Å; F185-F189 HydrophobicContact CD1-CD2 3.9Å; F185-F189 HydrophobicContact CD1-CG 4.43Å; F185-F189 AromaticContact CD2-CD2 3.82Å; F185-F189 HydrophobicContact CD2-CD2 3.82Å; F185-F189 HydrophobicContact CD2-CE2 4.03Å; F185-F189 HydrophobicContact CE1-CB 3.78Å; F185-F189 AromaticContact CE1-CD2 3.77Å; F185-F189 HydrophobicContact CE1-CD2 3.77Å; F185-F189 AromaticContact CE1-CG 4Å; F185-F189 HydrophobicContact CE1-CG 4Å; F185-F189 AromaticContact CE2-CD2 3.69Å; F185-F189 HydrophobicContact CE2-CD2 3.69Å; F185-F189 AromaticContact CE2-CE2 3.86Å; F185-F189 HydrophobicContact CE2-CE2 3.86Å; F185-F189 HydrophobicContact CE2-CG 4.47Å; F185-F189 AromaticContact CG-CD2 3.92Å; F185-F189 HydrophobicContact CG-CD2 3.92Å; F185-F189 HydrophobicContact CZ-CB 4.27Å; F185-F189 AromaticContact CZ-CD2 3.67Å; F185-F189 HydrophobicContact CZ-CD2 3.67Å; F185-F189 HydrophobicContact CZ-CE2 4.22Å; F185-F189 HydrophobicContact CZ-CG 4.02Å; F185-F189 WeakPolarHBondContact O-CD2 3.46Å; F185-F189 PolarHBondContact O-N 3.26Å; F189-R191 HydrophobicContact CB-CG 4.27Å; F189-R191 PolarHBondContact O-N 2.91Å; F189-R191 VanDerWaalsContact O-N 3.15Å; F189-I213 HydrophobicContact CE2-CG2 4.29Å; F189-I213 HydrophobicContact CZ-CG2 3.76Å; F189-P214 HydrophobicContact CD1-CB 4.26Å; F189-P214 HydrophobicContact CD1-CG 4.1Å; F189-P214 HydrophobicContact CE1-CB 4.09Å; F189-P214 HydrophobicContact CE1-CG 4.2Å; F189-R217 HydrophobicContact CD1-CB 4.32Å; F189-R217 HydrophobicContact CE1-CB 4.05Å; F189-I219 HydrophobicContact CE2-CD1 4.35Å; F189-I219 HydrophobicContact CZ-CD1 4.06Å; F189-I219 HydrophobicContact CZ-CG1 4.43Å; F189-I219 HydrophobicContact CZ-CG2 4.15Å; F189-L227 HydrophobicContact CE2-CD1 4.47Å
190	G	96.4	Very high	96.4	Very high	1 Å²	1	40.4 Å²	40.4	1%	0.01	20%	0.198	C	C	.	.	S	Bend	trans	72.7	2.8	178.3	0	0	0	0	0	113.8	P82 T83 A186	P82-G190 CarbonylContact C-O 3.56Å; P82-G190 VanDerWaalsContact CA-O 3.22Å; P82-G190 WeakPolarHBondContact CA-O 3.37Å; T83-G190 PolarHBondContact N-O 3.32Å; A186-G190 VanDerWaalsContact O-CA 3.22Å; A186-G190 WeakPolarHBondContact O-CA 3.46Å; A186-G190 PolarHBondContact O-N 3.47Å
191	R	96.4	Very high	96.2	Very high	112 Å²	112	41.4 Å²	41.4	42%	0.423	21%	0.206	S	C	.	.	S	Bend	trans	-144.4	162.7	-178.4	62.6	-174.8	171.7	-161.9	-10.2	110.1	F185 A186 F189 D216	F185-R191 WeakPolarHBondContact CD1-O 3.42Å; F185-R191 HydrophobicContact CE1-CG 4.49Å; F185-R191 WeakPolarHBondContact CE1-O 3.32Å; A186-R191 WeakPolarHBondContact CA-O 3.48Å; F189-R191 HydrophobicContact CB-CG 4.27Å; F189-R191 PolarHBondContact O-N 2.91Å; F189-R191 VanDerWaalsContact O-N 3.15Å; R191-D216 IonicContact CZ-OD2 4Å; R191-D216 IonicContact NH2-OD1 3.96Å; R191-D216 IonicContact NH2-OD2 2.92Å; R191-D216 PolarHBondContact NH2-OD2 3.43Å
192	V	97.1	Very high	96.1	Very high	21 Å²	21	42 Å²	42	13%	0.127	21%	0.209	C	C	.	.			trans	-81.3	153	172.2	-67.8	0	0	0	0	111	I81 A155 F156 I182 F194 F195	I81-V192 HydrophobicContact CD1-CG1 3.92Å; A155-V192 HydrophobicContact CB-CG1 4.27Å; A155-V192 HydrophobicContact CB-CG2 4.25Å; F156-V192 HydrophobicContact CE1-CG1 4.48Å; F156-V192 HydrophobicContact CE2-CG1 4.16Å; F156-V192 HydrophobicContact CZ-CG1 3.9Å; I182-V192 HydrophobicContact CG2-CB 4.32Å; I182-V192 HydrophobicContact CG2-CG1 3.85Å; V192-F194 VanDerWaalsContact CG2-O 3.23Å; V192-F194 WeakPolarHBondContact CG2-O 3.43Å; V192-F195 HydrophobicContact CG2-CB 4.28Å; V192-F195 HydrophobicContact CG2-CD2 4.43Å
193	P	97.2	Very high	95.9	Very high	30 Å²	30	43.8 Å²	43.8	20%	0.195	22%	0.216	C	C	.	.	S	Bend	trans	-74.2	-26.2	-179.1	27.6	-31.7	0	0	0	113.3	I182 F185 L211 L231	I182-P193 HydrophobicContact CD1-CG 3.45Å; I182-P193 VanDerWaalsContact CD1-CG 3.45Å; F185-P193 HydrophobicContact CD1-CB 4.04Å; F185-P193 HydrophobicContact CD1-CG 4.13Å; F185-P193 HydrophobicContact CD2-CB 4.08Å; F185-P193 HydrophobicContact CD2-CG 4.38Å; F185-P193 HydrophobicContact CE1-CB 3.85Å; F185-P193 HydrophobicContact CE1-CG 4.43Å; F185-P193 HydrophobicContact CE2-CB 3.89Å; F185-P193 HydrophobicContact CG-CB 4.16Å; F185-P193 HydrophobicContact CG-CG 4.11Å; F185-P193 HydrophobicContact CZ-CB 3.77Å; P193-L211 HydrophobicContact CB-CD1 3.71Å; P193-L211 HydrophobicContact CG-CD1 4.23Å; P193-L231 HydrophobicContact CG-CD1 4.42Å
194	F	97.2	Very high	95.8	Very high	3 Å²	3	50.9 Å²	50.9	1%	0.013	24%	0.243	C	C	.	.	S	Bend	trans	-117.8	123.8	177.2	-49.1	-70.4	0	0	0	109.1	W178 I182 V192 L202 I206 E209	W178-F194 AromaticContact CH2-CE2 3.96Å; W178-F194 HydrophobicContact CH2-CE2 3.96Å; W178-F194 HydrophobicContact CZ2-CD2 4.24Å; W178-F194 AromaticContact CZ2-CE2 3.74Å; W178-F194 HydrophobicContact CZ2-CE2 3.74Å; I182-F194 HydrophobicContact CD1-CD2 4.19Å; I182-F194 HydrophobicContact CD1-CE2 4.21Å; V192-F194 VanDerWaalsContact CG2-O 3.23Å; V192-F194 WeakPolarHBondContact CG2-O 3.43Å; F194-L202 HydrophobicContact CB-CD1 4.11Å; F194-L202 WeakPolarHBondContact O-CD1 3.42Å; F194-I206 HydrophobicContact CB-CG1 3.86Å; F194-I206 HydrophobicContact CD2-CG1 4.11Å; F194-I206 HydrophobicContact CG-CG1 4.1Å; F194-E209 HydrophobicContact CD1-CB 4.47Å; F194-E209 HydrophobicContact CE1-CB 4.33Å
195	F	94.6	Very high	95.7	Very high	130 Å²	130	52.8 Å²	52.8	57%	0.57	25%	0.251	S	S	*	.			trans	-143.1	140.2	179.5	-177.2	-96	0	0	0	111.1	V192 K205	V192-F195 HydrophobicContact CG2-CB 4.28Å; V192-F195 HydrophobicContact CG2-CD2 4.43Å; F195-K205 WeakPolarHBondContact O-CD 3.45Å; F195-K205 PolarHBondContact O-NZ 3.22Å
196	D	95.4	Very high	95.7	Very high	39 Å²	39	52.7 Å²	52.7	21%	0.209	25%	0.251	C	S	.	.			trans	-153.8	151.9	167.4	-154.2	-75.5	0	0	0	109.4	Y198 A201 L202 K205	D196-Y198 PolarHBondContact O-N 3.49Å; D196-Y198 PolarHBondContact OD1-N 3.26Å; D196-A201 HydrophobicContact CB-CB 4.05Å; D196-A201 VanDerWaalsContact CG-CB 3.41Å; D196-A201 WeakPolarHBondContact OD1-CB 3.06Å; D196-L202 HydrophobicContact CB-CB 3.93Å; D196-K205 HydrophobicContact CB-CD 4.39Å; D196-K205 WeakPolarHBondContact OD2-CE 3.17Å; D196-K205 IonicContact OD2-NZ 2.66Å; D196-K205 PolarHBondContact OD2-NZ 3.02Å
197	N	93.3	Very high	95.5	Very high	137 Å²	137	57.7 Å²	57.7	73%	0.733	27%	0.27	S	S	*	.	S	Bend	trans	-70.7	-24.6	175.8	-67.6	-35.2	0	0	0	111.8
198	Y	92.9	Very high	95.4	Very high	173 Å²	173	62.3 Å²	62.3	68%	0.678	30%	0.298	S	S	*	.	S	Bend	trans	-108	125.1	179.4	-58.9	-79	0	0	0	110.7	D196 V200 A201 L202	D196-Y198 PolarHBondContact O-N 3.49Å; D196-Y198 PolarHBondContact OD1-N 3.26Å; Y198-V200 VanDerWaalsContact C-N 3.26Å; Y198-V200 PolarHBondContact O-N 2.89Å; Y198-A201 WeakPolarHBondContact O-CB 3.31Å; Y198-A201 PolarHBondContact O-N 2.91Å; Y198-L202 PolarHBondContact O-N 2.78Å
199	V	90.8	Very high	95.4	Very high	69 Å²	69	65.9 Å²	65.9	42%	0.418	32%	0.315	S	S	.	.	H	α-helix	trans	-57.1	-37.6	-175.8	69.5	0	0	0	0	113.1	P154 A201 L202 Y203	P154-V199 HydrophobicContact CB-CG2 4.18Å; P154-V199 HydrophobicContact CG-CG2 4.27Å; V199-A201 PolarHBondContact O-N 2.68Å; V199-L202 WeakPolarHBondContact O-CB 3.27Å; V199-L202 PolarHBondContact O-N 2.95Å; V199-Y203 HydrophobicContact CG2-CD1 4.22Å; V199-Y203 HydrophobicContact CG2-CD2 4.34Å; V199-Y203 HydrophobicContact CG2-CE1 3.65Å; V199-Y203 HydrophobicContact CG2-CE2 3.75Å; V199-Y203 WeakPolarHBondContact O-CD1 3.46Å; V199-Y203 PolarHBondContact O-N 3.46Å
200	V	92.1	Very high	95.3	Very high	109 Å²	109	70.3 Å²	70.3	66%	0.661	35%	0.345	S	S	*	.	H	α-helix	trans	-65	-41.7	178.1	-179.5	0	0	0	0	111.1	Y198 Y203 R204	Y198-V200 VanDerWaalsContact C-N 3.26Å; Y198-V200 PolarHBondContact O-N 2.89Å; V200-Y203 PolarHBondContact O-N 3.38Å; V200-R204 PolarHBondContact O-N 3.45Å; V200-R204 VanDerWaalsContact O-N 3.08Å
201	A	95.1	Very high	95.4	Very high	22 Å²	22	71.9 Å²	71.9	18%	0.182	35%	0.353	C	S	.	.	H	α-helix	trans	-68.5	-41.9	176.3	0	0	0	0	0	110.8	D196 Y198 V199 Y203 R204 K205	D196-A201 HydrophobicContact CB-CB 4.05Å; D196-A201 VanDerWaalsContact CG-CB 3.41Å; D196-A201 WeakPolarHBondContact OD1-CB 3.06Å; Y198-A201 WeakPolarHBondContact O-CB 3.31Å; Y198-A201 PolarHBondContact O-N 2.91Å; V199-A201 PolarHBondContact O-N 2.68Å; A201-Y203 VanDerWaalsContact C-N 3.33Å; A201-Y203 PolarHBondContact O-N 3.34Å; A201-R204 WeakPolarHBondContact O-CB 3.43Å; A201-R204 PolarHBondContact O-N 3.4Å; A201-R204 VanDerWaalsContact O-N 3.13Å; A201-K205 WeakPolarHBondContact O-CG 3.34Å; A201-K205 PolarHBondContact O-N 3.39Å
202	L	96.2	Very high	95.3	Very high	12 Å²	12	71.1 Å²	71.1	6%	0.063	36%	0.364	C	S	.	.	H	α-helix	trans	-55.6	-47	172.5	174.5	60.5	0	0	0	111.6	P154 A155 F194 D196 Y198 V199 R204 K205 I206	P154-L202 HydrophobicContact CB-CD2 3.92Å; A155-L202 HydrophobicContact CB-CD2 4.34Å; F194-L202 HydrophobicContact CB-CD1 4.11Å; F194-L202 WeakPolarHBondContact O-CD1 3.42Å; D196-L202 HydrophobicContact CB-CB 3.93Å; Y198-L202 PolarHBondContact O-N 2.78Å; V199-L202 WeakPolarHBondContact O-CB 3.27Å; V199-L202 PolarHBondContact O-N 2.95Å; L202-R204 VanDerWaalsContact C-N 3.3Å; L202-R204 PolarHBondContact O-N 2.85Å; L202-K205 WeakPolarHBondContact O-CB 3.42Å; L202-K205 PolarHBondContact O-N 3.26Å; L202-K205 VanDerWaalsContact O-N 3.1Å; L202-I206 HydrophobicContact CD1-CD1 3.91Å; L202-I206 HydrophobicContact CD1-CG1 4.12Å; L202-I206 HydrophobicContact CG-CD1 3.87Å; L202-I206 HydrophobicContact CG-CG1 4.48Å; L202-I206 WeakPolarHBondContact O-CG1 3.38Å; L202-I206 PolarHBondContact O-N 2.86Å
203	Y	94.7	Very high	95.3	Very high	39 Å²	39	71 Å²	71	15%	0.153	36%	0.362	C	S	.	.	H	α-helix	trans	-62.4	-36	177.3	-67.1	-13.5	0	0	0	112.8	P154 L162 V199 V200 A201 R207	P154-Y203 HydrophobicContact CB-CE1 3.87Å; L162-Y203 HydrophobicContact CD1-CD1 3.62Å; L162-Y203 HydrophobicContact CD1-CE1 4.3Å; L162-Y203 HydrophobicContact CD1-CG 3.97Å; L162-Y203 HydrophobicContact CD2-CD1 3.56Å; L162-Y203 HydrophobicContact CD2-CD2 4.33Å; L162-Y203 HydrophobicContact CD2-CE1 3.41Å; L162-Y203 VanDerWaalsContact CD2-CE1 3.41Å; L162-Y203 HydrophobicContact CD2-CE2 4.24Å; L162-Y203 HydrophobicContact CD2-CG 4.02Å; L162-Y203 HydrophobicContact CG-CD1 4.19Å; L162-Y203 HydrophobicContact CG-CE1 4.48Å; L162-Y203 HydrophobicContact CG-CG 4.45Å; V199-Y203 HydrophobicContact CG2-CD1 4.22Å; V199-Y203 HydrophobicContact CG2-CD2 4.34Å; V199-Y203 HydrophobicContact CG2-CE1 3.65Å; V199-Y203 HydrophobicContact CG2-CE2 3.75Å; V199-Y203 WeakPolarHBondContact O-CD1 3.46Å; V199-Y203 PolarHBondContact O-N 3.46Å; V200-Y203 PolarHBondContact O-N 3.38Å; A201-Y203 VanDerWaalsContact C-N 3.33Å; A201-Y203 PolarHBondContact O-N 3.34Å; Y203-R207 WeakPolarHBondContact O-CG 3.33Å; Y203-R207 PolarHBondContact O-N 2.93Å; Y203-R207 PolarHBondContact O-NE 2.81Å; Y203-R207 VanDerWaalsContact O-NE 3.14Å
204	R	95.3	Very high	95.1	Very high	150 Å²	150	70.8 Å²	70.8	57%	0.566	36%	0.361	S	S	*	.	H	α-helix	trans	-63.1	-46.6	171.4	-172.8	-177.1	67.4	172.3	1.3	111	V200 A201 L202 R207 T208	V200-R204 PolarHBondContact O-N 3.45Å; V200-R204 VanDerWaalsContact O-N 3.08Å; A201-R204 WeakPolarHBondContact O-CB 3.43Å; A201-R204 PolarHBondContact O-N 3.4Å; A201-R204 VanDerWaalsContact O-N 3.13Å; L202-R204 VanDerWaalsContact C-N 3.3Å; L202-R204 PolarHBondContact O-N 2.85Å; R204-R207 PolarHBondContact O-N 2.99Å; R204-T208 HydrophobicContact CG-CG2 4.46Å; R204-T208 WeakPolarHBondContact O-CB 3.43Å; R204-T208 PolarHBondContact O-N 2.68Å; R204-T208 PolarHBondContact O-OG1 3.44Å
205	K	96.8	Very high	94.8	Very high	40 Å²	40	77.4 Å²	77.4	17%	0.174	40%	0.396	C	S	.	.	H	α-helix	trans	-60.3	-47	178.2	-64.1	-170.3	176.9	166.3	0	112	F195 D196 A201 L202 R207 T208 E209	F195-K205 WeakPolarHBondContact O-CD 3.45Å; F195-K205 PolarHBondContact O-NZ 3.22Å; D196-K205 HydrophobicContact CB-CD 4.39Å; D196-K205 WeakPolarHBondContact OD2-CE 3.17Å; D196-K205 IonicContact OD2-NZ 2.66Å; D196-K205 PolarHBondContact OD2-NZ 3.02Å; A201-K205 WeakPolarHBondContact O-CG 3.34Å; A201-K205 PolarHBondContact O-N 3.39Å; L202-K205 WeakPolarHBondContact O-CB 3.42Å; L202-K205 PolarHBondContact O-N 3.26Å; L202-K205 VanDerWaalsContact O-N 3.1Å; K205-R207 PolarHBondContact O-N 2.69Å; K205-T208 PolarHBondContact O-N 2.86Å; K205-E209 HydrophobicContact CB-CG 4.23Å; K205-E209 WeakPolarHBondContact CD-OE2 3.44Å; K205-E209 VanDerWaalsContact CG-CD 3.49Å; K205-E209 HydrophobicContact CG-CG 4.32Å; K205-E209 WeakPolarHBondContact CG-OE1 3.34Å; K205-E209 WeakPolarHBondContact O-CB 3.39Å; K205-E209 PolarHBondContact O-N 3.09Å
206	I	97	Very high	94.6	Very high	0 Å²	0	76.5 Å²	76.5	0%	0	40%	0.397	C	S	.	.	H	α-helix	trans	-57.3	-37	177	-69.4	169	0	0	0	111.5	P154 P159 L162 W178 F194 L202 K233	P154-I206 WeakPolarHBondContact O-CD1 3.34Å; P159-I206 HydrophobicContact CB-CG2 4.26Å; L162-I206 HydrophobicContact CD1-CB 3.91Å; L162-I206 HydrophobicContact CD1-CD1 4.07Å; L162-I206 HydrophobicContact CD1-CG2 3.66Å; W178-I206 HydrophobicContact CZ2-CG2 3.93Å; F194-I206 HydrophobicContact CB-CG1 3.86Å; F194-I206 HydrophobicContact CD2-CG1 4.11Å; F194-I206 HydrophobicContact CG-CG1 4.1Å; L202-I206 HydrophobicContact CD1-CD1 3.91Å; L202-I206 HydrophobicContact CD1-CG1 4.12Å; L202-I206 HydrophobicContact CG-CD1 3.87Å; L202-I206 HydrophobicContact CG-CG1 4.48Å; L202-I206 WeakPolarHBondContact O-CG1 3.38Å; L202-I206 PolarHBondContact O-N 2.86Å; I206-K233 WeakPolarHBondContact O-CD 3.43Å; I206-K233 WeakPolarHBondContact O-CE 3.33Å; I206-K233 PolarHBondContact O-NZ 3.16Å
207	R	95.2	Very high	94.4	Very high	106 Å²	106	78.1 Å²	78.1	40%	0.4	40%	0.4	S	S	.	.	H	α-helix	trans	-80.4	-35.8	179	-70.7	179.2	-66	177.9	-0.3	114.1	P159 Y203 R204 K205	P159-R207 HydrophobicContact CB-CG 3.97Å; Y203-R207 WeakPolarHBondContact O-CG 3.33Å; Y203-R207 PolarHBondContact O-N 2.93Å; Y203-R207 PolarHBondContact O-NE 2.81Å; Y203-R207 VanDerWaalsContact O-NE 3.14Å; R204-R207 PolarHBondContact O-N 2.99Å; K205-R207 PolarHBondContact O-N 2.69Å
208	T	95.6	Very high	94.4	Very high	98 Å²	98	77.4 Å²	77.4	60%	0.601	40%	0.403	S	S	*	.	H	α-helix	trans	-114	-33	-163.7	59.9	0	0	0	0	114.9	R204 K205	R204-T208 HydrophobicContact CG-CG2 4.46Å; R204-T208 WeakPolarHBondContact O-CB 3.43Å; R204-T208 PolarHBondContact O-N 2.68Å; R204-T208 PolarHBondContact O-OG1 3.44Å; K205-T208 PolarHBondContact O-N 2.86Å
209	E	96.6	Very high	94.5	Very high	77 Å²	77	70.1 Å²	70.1	36%	0.36	38%	0.376	S	S	.	.	S	Bend	trans	-78.9	135.1	-176.8	-70.2	-178.8	-179.2	0	0	110.8	F194 K205 K233	F194-E209 HydrophobicContact CD1-CB 4.47Å; F194-E209 HydrophobicContact CE1-CB 4.33Å; K205-E209 HydrophobicContact CB-CG 4.23Å; K205-E209 WeakPolarHBondContact CD-OE2 3.44Å; K205-E209 VanDerWaalsContact CG-CD 3.49Å; K205-E209 HydrophobicContact CG-CG 4.32Å; K205-E209 WeakPolarHBondContact CG-OE1 3.34Å; K205-E209 WeakPolarHBondContact O-CB 3.39Å; K205-E209 PolarHBondContact O-N 3.09Å; E209-K233 WeakPolarHBondContact O-CE 3.26Å; E209-K233 PolarHBondContact O-NZ 3.44Å
210	P	96.3	Very high	94.8	Very high	109 Å²	109	68.3 Å²	68.3	71%	0.708	37%	0.366	S	S	*	.			trans	-66.1	155.7	173.6	29.8	-34.7	0	0	0	110.6	C212	P210-C212 PolarHBondContact O-N 2.69Å; P210-C212 VanDerWaalsContact O-N 3.15Å
211	L	96.9	Very high	95	Very high	33 Å²	33	68.2 Å²	68.2	17%	0.173	37%	0.366	C	S	.	.			trans	-65.7	114.5	171.2	176.5	67.1	0	0	0	109.6	F185 P193 I213 L227 R228 L231	F185-L211 HydrophobicContact CD2-CD1 4.29Å; F185-L211 HydrophobicContact CE2-CD1 4.23Å; P193-L211 HydrophobicContact CB-CD1 3.71Å; P193-L211 HydrophobicContact CG-CD1 4.23Å; L211-I213 HydrophobicContact CD2-CD1 4.36Å; L211-I213 HydrophobicContact CD2-CG1 4.21Å; L211-I213 HydrophobicContact CG-CG1 4.21Å; L211-L227 HydrophobicContact CD2-CB 4.35Å; L211-R228 HydrophobicContact CD2-CG 4.21Å; L211-L231 HydrophobicContact CD1-CD1 3.72Å; L211-L231 HydrophobicContact CD2-CB 4.14Å; L211-L231 HydrophobicContact CD2-CD1 3.94Å; L211-L231 HydrophobicContact CG-CD1 4.45Å
212	C	95.7	Very high	95.2	Very high	97 Å²	97	71.2 Å²	71.2	66%	0.655	38%	0.377	S	S	*	.			trans	-96.3	120.1	169.4	-171.1	0	0	0	0	109.4	P210 P214	P210-C212 PolarHBondContact O-N 2.69Å; P210-C212 VanDerWaalsContact O-N 3.15Å; C212-P214 WeakPolarHBondContact O-CD 3.24Å
213	I	95.6	Very high	95.2	Very high	18 Å²	18	70.7 Å²	70.7	9%	0.092	37%	0.374	C	S	.	.			trans	-96.6	115.2	173.9	-61.9	-179.7	0	0	0	106.9	F189 L211 I219 K224 L227	F189-I213 HydrophobicContact CE2-CG2 4.29Å; F189-I213 HydrophobicContact CZ-CG2 3.76Å; L211-I213 HydrophobicContact CD2-CD1 4.36Å; L211-I213 HydrophobicContact CD2-CG1 4.21Å; L211-I213 HydrophobicContact CG-CG1 4.21Å; I213-I219 HydrophobicContact CG2-CD1 3.88Å; I213-I219 HydrophobicContact CG2-CG1 4.42Å; I213-K224 HydrophobicContact CD1-CB 4.05Å; I213-K224 HydrophobicContact CD1-CG 3.98Å; I213-K224 HydrophobicContact CG2-CG 4.48Å; I213-L227 HydrophobicContact CD1-CB 4.46Å; I213-L227 HydrophobicContact CD1-CD1 4.35Å
214	P	94	Very high	95.4	Very high	25 Å²	25	71.4 Å²	71.4	16%	0.162	38%	0.378	C	S	.	.			trans	-59.6	143	179.9	-26.7	36.8	0	0	0	113.3	F185 F189 C212 D216	F185-P214 HydrophobicContact CZ-CG 4.35Å; F189-P214 HydrophobicContact CD1-CB 4.26Å; F189-P214 HydrophobicContact CD1-CG 4.1Å; F189-P214 HydrophobicContact CE1-CB 4.09Å; F189-P214 HydrophobicContact CE1-CG 4.2Å; C212-P214 WeakPolarHBondContact O-CD 3.24Å; P214-D216 WeakPolarHBondContact CB-OD1 3.47Å
215	D	91.4	Very high	95.5	Very high	143 Å²	143	69.5 Å²	69.5	77%	0.765	38%	0.375	S	S	*	.	S	Bend	trans	-88.6	-5.6	174.4	-65.5	-45.4	0	0	0	113.1	R217	D215-R217 PolarHBondContact O-N 2.78Å
216	D	89.9	Confident	95.6	Very high	111 Å²	111	67.6 Å²	67.6	59%	0.594	37%	0.367	S	S	*	.	S	Bend	trans	-65.9	-19.2	178.8	60.3	0.1	0	0	0	113.3	R191 P214	R191-D216 IonicContact CZ-OD2 4Å; R191-D216 IonicContact NH2-OD1 3.96Å; R191-D216 IonicContact NH2-OD2 2.92Å; R191-D216 PolarHBondContact NH2-OD2 3.43Å; P214-D216 WeakPolarHBondContact CB-OD1 3.47Å
217	R	91.1	Very high	95.6	Very high	72 Å²	72	67.6 Å²	67.6	27%	0.272	37%	0.367	S	S	.	.	S	Bend	trans	-133.4	108.8	174.7	-162.1	176.5	-149.6	-150.7	4.3	110.5	P86 L87 V188 F189 D215 I219	P86-R217 PolarHBondContact O-NH2 2.88Å; L87-R217 PolarHBondContact O-NH1 2.88Å; V188-R217 VanDerWaalsContact O-CD 3.26Å; V188-R217 WeakPolarHBondContact O-CD 3.43Å; V188-R217 PolarHBondContact O-NH1 3.11Å; F189-R217 HydrophobicContact CD1-CB 4.32Å; F189-R217 HydrophobicContact CE1-CB 4.05Å; D215-R217 PolarHBondContact O-N 2.78Å; R217-I219 PolarHBondContact O-N 2.9Å
218	P	92.7	Very high	95.8	Very high	122 Å²	122	69.5 Å²	69.5	79%	0.792	37%	0.374	S	S	*	.			trans	-65.6	133.7	179	27	-33.4	0	0	0	110.1
219	I	96.4	Very high	95.9	Very high	20 Å²	20	66.2 Å²	66.2	10%	0.103	36%	0.355	C	S	.	.			trans	-130.7	155.7	175.9	57.5	159.8	0	0	0	109.3	E89 V188 F189 I213 R217 L223 K224 L227	E89-I219 WeakPolarHBondContact OE2-CA 3.05Å; V188-I219 HydrophobicContact CG1-CG2 3.52Å; F189-I219 HydrophobicContact CE2-CD1 4.35Å; F189-I219 HydrophobicContact CZ-CD1 4.06Å; F189-I219 HydrophobicContact CZ-CG1 4.43Å; F189-I219 HydrophobicContact CZ-CG2 4.15Å; I213-I219 HydrophobicContact CG2-CD1 3.88Å; I213-I219 HydrophobicContact CG2-CG1 4.42Å; R217-I219 PolarHBondContact O-N 2.9Å; I219-L223 HydrophobicContact CB-CD2 3.94Å; I219-L223 HydrophobicContact CD1-CB 4.18Å; I219-L223 HydrophobicContact CD1-CD2 3.98Å; I219-L223 HydrophobicContact CD1-CG 3.84Å; I219-L223 HydrophobicContact CG2-CD2 4.03Å; I219-K224 HydrophobicContact CD1-CG 3.49Å; I219-K224 VanDerWaalsContact CD1-CG 3.49Å; I219-K224 HydrophobicContact CG1-CD 4.35Å; I219-K224 HydrophobicContact CG1-CG 3.75Å; I219-L227 HydrophobicContact CD1-CD1 4.16Å
220	S	96.9	Very high	96	Very high	31 Å²	31	62.6 Å²	62.6	22%	0.217	34%	0.338	C	S	.	.			trans	-59	152.9	178.5	64.1	0	0	0	0	113	E89 E222 L223 K224 W249	E89-S220 VanDerWaalsContact OE1-CB 3.28Å; E89-S220 WeakPolarHBondContact OE1-CB 3.34Å; E89-S220 PolarHBondContact OE1-OG 2.83Å; E89-S220 PolarHBondContact OE2-N 3.06Å; S220-E222 WeakPolarHBondContact CB-OE2 3.18Å; S220-E222 PolarHBondContact O-N 3.47Å; S220-L223 PolarHBondContact O-N 3.43Å; S220-L223 WeakPolarHBondContact OG-CB 3.46Å; S220-L223 PolarHBondContact OG-N 3.3Å; S220-K224 PolarHBondContact O-N 2.95Å; S220-K224 VanDerWaalsContact O-N 3.11Å; S220-W249 VanDerWaalsContact OG-CD1 3.31Å
221	T	96.6	Very high	96.1	Very high	107 Å²	107	57.7 Å²	57.7	66%	0.656	31%	0.306	S	S	*	.	H	α-helix	trans	-59.2	-35.4	175	33.5	0	0	0	0	112.1	K224 H225	T221-K224 PolarHBondContact O-N 2.75Å; T221-H225 PolarHBondContact O-N 3.21Å
222	E	97.5	Very high	96.1	Very high	86 Å²	86	59.3 Å²	59.3	40%	0.402	31%	0.312	S	S	.	.	H	α-helix	trans	-67.5	-42.7	178.9	-61.6	80.5	172.8	0	0	110.3	S220 H225 L226 P248 W249	S220-E222 WeakPolarHBondContact CB-OE2 3.18Å; S220-E222 PolarHBondContact O-N 3.47Å; E222-H225 WeakPolarHBondContact O-CB 3.42Å; E222-H225 PolarHBondContact O-N 3.49Å; E222-L226 PolarHBondContact O-N 2.93Å; E222-P248 HydrophobicContact CG-CB 4.24Å; E222-W249 HydrophobicContact CB-CB 3.76Å; E222-W249 HydrophobicContact CB-CG 4.39Å
223	L	98.2	Very high	96.1	Very high	0 Å²	0	57.1 Å²	57.1	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-63.9	-42.5	173.7	-177.4	49.6	0	0	0	111.7	E89 L184 V188 I219 S220 H225 L226 L227 W249	E89-L223 HydrophobicContact CG-CD2 3.86Å; L184-L223 HydrophobicContact CD1-CD1 4.36Å; L184-L223 HydrophobicContact CD2-CD1 3.72Å; L184-L223 HydrophobicContact CG-CD1 4.12Å; V188-L223 HydrophobicContact CG1-CD2 4.2Å; V188-L223 HydrophobicContact CG2-CD2 3.95Å; I219-L223 HydrophobicContact CB-CD2 3.94Å; I219-L223 HydrophobicContact CD1-CB 4.18Å; I219-L223 HydrophobicContact CD1-CD2 3.98Å; I219-L223 HydrophobicContact CD1-CG 3.84Å; I219-L223 HydrophobicContact CG2-CD2 4.03Å; S220-L223 PolarHBondContact O-N 3.43Å; S220-L223 WeakPolarHBondContact OG-CB 3.46Å; S220-L223 PolarHBondContact OG-N 3.3Å; L223-H225 VanDerWaalsContact C-N 3.27Å; L223-H225 PolarHBondContact O-N 3.22Å; L223-L226 PolarHBondContact O-N 3.09Å; L223-L227 HydrophobicContact CD1-CD1 4.14Å; L223-L227 HydrophobicContact CD1-CG 3.97Å; L223-L227 HydrophobicContact CG-CD1 4.09Å; L223-L227 HydrophobicContact CG-CG 4.41Å; L223-L227 WeakPolarHBondContact O-CB 3.44Å; L223-L227 WeakPolarHBondContact O-CG 3.44Å; L223-L227 PolarHBondContact O-N 3.46Å; L223-W249 HydrophobicContact CB-CD2 4.46Å; L223-W249 HydrophobicContact CB-CG 4.17Å; L223-W249 HydrophobicContact CD1-CD2 4.01Å; L223-W249 HydrophobicContact CD1-CE3 4.4Å; L223-W249 HydrophobicContact CD1-CG 4.49Å; L223-W249 HydrophobicContact CD1-CH2 4.2Å; L223-W249 HydrophobicContact CD1-CZ2 3.84Å; L223-W249 HydrophobicContact CD1-CZ3 4.48Å; L223-W249 HydrophobicContact CD2-CZ2 4.14Å; L223-W249 HydrophobicContact CG-CZ2 4.46Å
224	K	97.7	Very high	96.1	Very high	55 Å²	55	62.8 Å²	62.8	24%	0.239	32%	0.316	C	S	.	.	H	α-helix	trans	-59.1	-41.5	175.8	-68.7	-175.3	-176.6	-171.7	0	111.2	I213 I219 S220 T221 R228	I213-K224 HydrophobicContact CD1-CB 4.05Å; I213-K224 HydrophobicContact CD1-CG 3.98Å; I213-K224 HydrophobicContact CG2-CG 4.48Å; I219-K224 HydrophobicContact CD1-CG 3.49Å; I219-K224 VanDerWaalsContact CD1-CG 3.49Å; I219-K224 HydrophobicContact CG1-CD 4.35Å; I219-K224 HydrophobicContact CG1-CG 3.75Å; S220-K224 PolarHBondContact O-N 2.95Å; S220-K224 VanDerWaalsContact O-N 3.11Å; T221-K224 PolarHBondContact O-N 2.75Å; K224-R228 WeakPolarHBondContact O-CG 3.2Å; K224-R228 PolarHBondContact O-N 3.44Å
225	H	97.6	Very high	96.1	Very high	109 Å²	109	63.6 Å²	63.6	51%	0.505	32%	0.321	S	S	.	.	H	α-helix	trans	-63.4	-49.4	176.9	178.7	-92	0	0	0	112	T221 E222 L223 L227 R228 S229 D247	T221-H225 PolarHBondContact O-N 3.21Å; E222-H225 WeakPolarHBondContact O-CB 3.42Å; E222-H225 PolarHBondContact O-N 3.49Å; L223-H225 VanDerWaalsContact C-N 3.27Å; L223-H225 PolarHBondContact O-N 3.22Å; H225-L227 PolarHBondContact O-N 3.31Å; H225-R228 PolarHBondContact O-N 3.06Å; H225-S229 PolarHBondContact O-N 3.38Å; H225-S229 PolarHBondContact O-OG 3.47Å; H225-D247 IonicContact ND1-OD2 3.47Å
226	L	98.4	Very high	96.2	Very high	1 Å²	1	64.2 Å²	64.2	1%	0.005	32%	0.324	C	S	.	.	H	α-helix	trans	-61.1	-46.1	179.2	179.4	60.9	0	0	0	112	F96 L184 E222 L223 R228 S229 M230 I244 D247 W249 V250	F96-L226 HydrophobicContact CE1-CD2 4.12Å; F96-L226 HydrophobicContact CZ-CD2 4.33Å; L184-L226 HydrophobicContact CD2-CD2 4.01Å; L184-L226 HydrophobicContact CD2-CG 4.49Å; E222-L226 PolarHBondContact O-N 2.93Å; L223-L226 PolarHBondContact O-N 3.09Å; L226-R228 VanDerWaalsContact C-N 3.32Å; L226-R228 PolarHBondContact O-N 2.99Å; L226-S229 WeakPolarHBondContact O-CB 3.37Å; L226-S229 PolarHBondContact O-N 3.33Å; L226-S229 VanDerWaalsContact O-N 3.13Å; L226-M230 HydrophobicContact CD1-CG 4.08Å; L226-M230 HydrophobicContact CD1-SD 4.04Å; L226-M230 HydrophobicContact CG-CG 4.48Å; L226-M230 HydrophobicContact CG-SD 4.07Å; L226-M230 WeakPolarHBondContact O-CG 3.48Å; L226-M230 PolarHBondContact O-N 2.76Å; L226-I244 HydrophobicContact CD1-CG1 4.18Å; L226-I244 HydrophobicContact CD1-CG2 4.42Å; L226-D247 HydrophobicContact CD1-CB 4.23Å; L226-W249 HydrophobicContact CD2-CB 4.31Å; L226-W249 HydrophobicContact CD2-CD2 4.17Å; L226-W249 HydrophobicContact CD2-CE3 3.43Å; L226-W249 VanDerWaalsContact CD2-CE3 3.43Å; L226-W249 HydrophobicContact CD2-CZ3 4.06Å; L226-V250 HydrophobicContact CD2-CG2 3.79Å
227	L	98.4	Very high	96.5	Very high	0 Å²	0	63.6 Å²	63.6	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-58.3	-43.1	177.2	-76.6	172.7	0	0	0	112	L184 F185 F189 L211 I213 I219 L223 H225 S229 L231	L184-L227 HydrophobicContact CB-CD2 4.24Å; L184-L227 HydrophobicContact CD2-CD2 4.04Å; L184-L227 HydrophobicContact CG-CD2 3.99Å; F185-L227 HydrophobicContact CB-CD2 4.06Å; F185-L227 HydrophobicContact CD2-CD1 4.32Å; F189-L227 HydrophobicContact CE2-CD1 4.47Å; L211-L227 HydrophobicContact CD2-CB 4.35Å; I213-L227 HydrophobicContact CD1-CB 4.46Å; I213-L227 HydrophobicContact CD1-CD1 4.35Å; I219-L227 HydrophobicContact CD1-CD1 4.16Å; L223-L227 HydrophobicContact CD1-CD1 4.14Å; L223-L227 HydrophobicContact CD1-CG 3.97Å; L223-L227 HydrophobicContact CG-CD1 4.09Å; L223-L227 HydrophobicContact CG-CG 4.41Å; L223-L227 WeakPolarHBondContact O-CB 3.44Å; L223-L227 WeakPolarHBondContact O-CG 3.44Å; L223-L227 PolarHBondContact O-N 3.46Å; H225-L227 PolarHBondContact O-N 3.31Å; L227-S229 VanDerWaalsContact C-N 3.34Å; L227-L231 VanDerWaalsContact O-CB 3.23Å; L227-L231 WeakPolarHBondContact O-CB 3.13Å; L227-L231 WeakPolarHBondContact O-CG 3.27Å; L227-L231 PolarHBondContact O-N 3.41Å
228	R	98	Very high	96.8	Very high	146 Å²	146	60.8 Å²	60.8	55%	0.551	31%	0.31	S	S	*	.	H	α-helix	trans	-66	-36.7	176.6	-74.1	179.4	-179.4	131	-2.3	112.5	L211 K224 H225 L226 H232	L211-R228 HydrophobicContact CD2-CG 4.21Å; K224-R228 WeakPolarHBondContact O-CG 3.2Å; K224-R228 PolarHBondContact O-N 3.44Å; H225-R228 PolarHBondContact O-N 3.06Å; L226-R228 VanDerWaalsContact C-N 3.32Å; L226-R228 PolarHBondContact O-N 2.99Å; R228-H232 PolarHBondContact O-N 3.16Å
229	S	98	Very high	97	Very high	29 Å²	29	55.8 Å²	55.8	20%	0.203	28%	0.278	C	S	.	.	H	α-helix	trans	-68.3	-40.2	178.7	-57	0	0	0	0	112	H225 L226 L227 R238 C239	H225-S229 PolarHBondContact O-N 3.38Å; H225-S229 PolarHBondContact O-OG 3.47Å; L226-S229 WeakPolarHBondContact O-CB 3.37Å; L226-S229 PolarHBondContact O-N 3.33Å; L226-S229 VanDerWaalsContact O-N 3.13Å; L227-S229 VanDerWaalsContact C-N 3.34Å; S229-R238 WeakPolarHBondContact O-CA 3.32Å; S229-C239 VanDerWaalsContact C-SG 3.57Å; S229-C239 PolarHBondContact O-N 3.14Å
230	M	98.5	Very high	97	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-77.4	-35.7	177.9	-67.5	-179.5	73.7	0	0	113.5	F96 I177 L180 G181 L226 H232 R238 C239 I244	F96-M230 HydrophobicContact CE2-CE 3.89Å; F96-M230 HydrophobicContact CE2-SD 3.95Å; F96-M230 HydrophobicContact CZ-CE 3.84Å; F96-M230 HydrophobicContact CZ-SD 3.6Å; I177-M230 HydrophobicContact CG2-CB 4.25Å; I177-M230 HydrophobicContact CG2-CE 4.21Å; I177-M230 HydrophobicContact CG2-CG 4.25Å; I177-M230 VanDerWaalsContact O-CE 3.29Å; I177-M230 WeakPolarHBondContact O-CE 3.26Å; L180-M230 HydrophobicContact CB-CE 3.73Å; L180-M230 HydrophobicContact CD2-CE 3.86Å; L180-M230 HydrophobicContact CG-CE 3.73Å; G181-M230 VanDerWaalsContact CA-CE 3.43Å; L226-M230 HydrophobicContact CD1-CG 4.08Å; L226-M230 HydrophobicContact CD1-SD 4.04Å; L226-M230 HydrophobicContact CG-CG 4.48Å; L226-M230 HydrophobicContact CG-SD 4.07Å; L226-M230 WeakPolarHBondContact O-CG 3.48Å; L226-M230 PolarHBondContact O-N 2.76Å; M230-H232 VanDerWaalsContact C-N 3.28Å; M230-H232 PolarHBondContact O-N 3.14Å; M230-R238 WeakPolarHBondContact O-CD 3.47Å; M230-R238 WeakPolarHBondContact O-CG 3.4Å; M230-R238 PolarHBondContact O-NE 2.83Å; M230-C239 WeakPolarHBondContact CG-SG 3.36Å; M230-I244 HydrophobicContact CE-CD1 4.04Å; M230-I244 HydrophobicContact CG-CD1 4.02Å; M230-I244 HydrophobicContact CG-CG1 4.38Å; M230-I244 HydrophobicContact SD-CD1 4.21Å
231	L	98.3	Very high	96.9	Very high	6 Å²	6	57.5 Å²	57.5	3%	0.031	29%	0.287	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.8	26.3	-177.8	-59.8	178.5	0	0	0	112.3	W178 I182 P193 L211 L227 K233	W178-L231 HydrophobicContact CD2-CD2 4Å; W178-L231 HydrophobicContact CE3-CD2 4.14Å; W178-L231 HydrophobicContact CG-CD2 4.41Å; W178-L231 HydrophobicContact CZ3-CB 4.35Å; W178-L231 HydrophobicContact CZ3-CD2 4.47Å; W178-L231 WeakPolarHBondContact CZ3-O 3.44Å; I182-L231 HydrophobicContact CD1-CD1 4.17Å; I182-L231 HydrophobicContact CD1-CD2 3.55Å; I182-L231 HydrophobicContact CG1-CD2 3.82Å; P193-L231 HydrophobicContact CG-CD1 4.42Å; L211-L231 HydrophobicContact CD1-CD1 3.72Å; L211-L231 HydrophobicContact CD2-CB 4.14Å; L211-L231 HydrophobicContact CD2-CD1 3.94Å; L211-L231 HydrophobicContact CG-CD1 4.45Å; L227-L231 VanDerWaalsContact O-CB 3.23Å; L227-L231 WeakPolarHBondContact O-CB 3.13Å; L227-L231 WeakPolarHBondContact O-CG 3.27Å; L227-L231 PolarHBondContact O-N 3.41Å; L231-K233 PolarHBondContact O-N 3.45Å
232	H	97.5	Very high	96.7	Very high	67 Å²	67	60.2 Å²	60.2	31%	0.31	29%	0.29	S	S	.	.			trans	-68	129.7	170.9	-162.7	-72.9	0	0	0	109.8	R228 M230 K234 N237 R238	R228-H232 PolarHBondContact O-N 3.16Å; M230-H232 VanDerWaalsContact C-N 3.28Å; M230-H232 PolarHBondContact O-N 3.14Å; H232-K234 PolarHBondContact ND1-N 3.3Å; H232-K234 VanDerWaalsContact ND1-N 3.18Å; H232-K234 PolarHBondContact ND1-O 3.27Å; H232-K234 VanDerWaalsContact ND1-O 3.13Å; H232-N237 WeakPolarHBondContact CE1-CB 3.37Å; H232-N237 PolarHBondContact CE1-ND2 3.49Å; H232-N237 VanDerWaalsContact CE1-ND2 3.27Å; H232-N237 WeakPolarHBondContact ND1-CB 3.35Å; H232-R238 HydrophobicContact CB-CB 4.44Å; H232-R238 PolarHBondContact O-NE 3.23Å; H232-R238 VanDerWaalsContact O-NE 3.1Å; H232-R238 PolarHBondContact O-NH2 3.28Å; H232-R238 VanDerWaalsContact O-NH2 3.08Å
233	K	96.1	Very high	96.6	Very high	52 Å²	52	61.1 Å²	61.1	23%	0.226	29%	0.294	C	S	.	.	S	Bend	trans	-65.5	-42.4	-174.5	-58.6	-65	-176.6	175.1	0	112.2	P159 W178 I206 E209 L231 R238	P159-K233 HydrophobicContact CG-CB 4.35Å; P159-K233 HydrophobicContact CG-CD 4.24Å; P159-K233 VanDerWaalsContact CG-O 3.3Å; P159-K233 WeakPolarHBondContact CG-O 3.28Å; W178-K233 HydrophobicContact CH2-CD 3.78Å; W178-K233 HydrophobicContact CZ3-CD 4.03Å; I206-K233 WeakPolarHBondContact O-CD 3.43Å; I206-K233 WeakPolarHBondContact O-CE 3.33Å; I206-K233 PolarHBondContact O-NZ 3.16Å; E209-K233 WeakPolarHBondContact O-CE 3.26Å; E209-K233 PolarHBondContact O-NZ 3.44Å; L231-K233 PolarHBondContact O-N 3.45Å; K233-R238 PolarHBondContact O-NH2 2.87Å
234	K	95	Very high	96.6	Very high	137 Å²	137	61.1 Å²	61.1	60%	0.596	29%	0.294	S	S	*	.	S	Bend	trans	-76	123.1	173.2	-61.4	-174.1	176.9	-176.2	0	109.6	H232 D236 N237 R238	H232-K234 PolarHBondContact ND1-N 3.3Å; H232-K234 VanDerWaalsContact ND1-N 3.18Å; H232-K234 PolarHBondContact ND1-O 3.27Å; H232-K234 VanDerWaalsContact ND1-O 3.13Å; K234-D236 VanDerWaalsContact C-N 3.31Å; K234-D236 PolarHBondContact O-N 3.11Å; K234-N237 HydrophobicContact CB-CB 4.42Å; K234-N237 PolarHBondContact O-N 3.35Å; K234-R238 PolarHBondContact O-N 2.99Å
235	P	94.6	Very high	96.5	Very high	41 Å²	41	59.2 Å²	59.2	27%	0.266	29%	0.286	S	S	.	.	G	3₁₀ helix	trans	-63.3	-34.2	-178.4	24.1	-33.2	0	0	0	112.9	E160 A174 N237 R238	E160-P235 HydrophobicContact CG-CG 4.46Å; A174-P235 HydrophobicContact CB-CB 3.93Å; P235-N237 PolarHBondContact O-N 3.01Å; P235-R238 WeakPolarHBondContact O-CB 3.19Å; P235-R238 PolarHBondContact O-N 3.37Å
236	D	93.8	Very high	96.4	Very high	156 Å²	156	60.3 Å²	60.3	83%	0.834	29%	0.294	S	S	*	.	G	3₁₀ helix	trans	-66.5	-24.2	-179.5	-57	-31.1	0	0	0	113.8	K234	K234-D236 VanDerWaalsContact C-N 3.31Å; K234-D236 PolarHBondContact O-N 3.11Å
237	N	96.2	Very high	96.3	Very high	98 Å²	98	61 Å²	61	52%	0.524	30%	0.298	S	S	.	.	G	3₁₀ helix	trans	-95.7	-1.6	176.8	-69.5	2.7	0	0	0	112	H232 K234 P235	H232-N237 WeakPolarHBondContact CE1-CB 3.37Å; H232-N237 PolarHBondContact CE1-ND2 3.49Å; H232-N237 VanDerWaalsContact CE1-ND2 3.27Å; H232-N237 WeakPolarHBondContact ND1-CB 3.35Å; K234-N237 HydrophobicContact CB-CB 4.42Å; K234-N237 PolarHBondContact O-N 3.35Å; P235-N237 PolarHBondContact O-N 3.01Å
238	R	97.2	Very high	96.2	Very high	13 Å²	13	64.3 Å²	64.3	5%	0.049	32%	0.319	C	S	.	.	S	Bend	trans	-81.1	133.4	-179.3	-165.5	178.8	-62.6	144.3	7.6	108.3	E160 A174 I177 S229 M230 H232 K233 K234 P235	E160-R238 IonicContact OE1-CZ 3.83Å; E160-R238 IonicContact OE1-NH1 2.7Å; E160-R238 PolarHBondContact OE1-NH1 3.36Å; E160-R238 IonicContact OE1-NH2 3.36Å; E160-R238 PolarHBondContact OE1-NH2 3.49Å; E160-R238 IonicContact OE2-CZ 3.53Å; E160-R238 IonicContact OE2-NH1 2.61Å; E160-R238 IonicContact OE2-NH2 3.11Å; E160-R238 PolarHBondContact OE2-NH2 2.92Å; A174-R238 PolarHBondContact O-NH1 3Å; I177-R238 HydrophobicContact CG2-CG 3.84Å; S229-R238 WeakPolarHBondContact O-CA 3.32Å; M230-R238 WeakPolarHBondContact O-CD 3.47Å; M230-R238 WeakPolarHBondContact O-CG 3.4Å; M230-R238 PolarHBondContact O-NE 2.83Å; H232-R238 HydrophobicContact CB-CB 4.44Å; H232-R238 PolarHBondContact O-NE 3.23Å; H232-R238 VanDerWaalsContact O-NE 3.1Å; H232-R238 PolarHBondContact O-NH2 3.28Å; H232-R238 VanDerWaalsContact O-NH2 3.08Å; K233-R238 PolarHBondContact O-NH2 2.87Å; K234-R238 PolarHBondContact O-N 2.99Å; P235-R238 WeakPolarHBondContact O-CB 3.19Å; P235-R238 PolarHBondContact O-N 3.37Å
239	C	96.9	Very high	96.2	Very high	18 Å²	18	57.5 Å²	57.5	12%	0.122	29%	0.294	C	S	.	.	P	Polyproline II helix	trans	-60.4	145	179.3	60.4	0	0	0	0	111.6	I177 S229 M230 E243 I244	I177-C239 WeakPolarHBondContact CG2-O 3.36Å; S229-C239 VanDerWaalsContact C-SG 3.57Å; S229-C239 PolarHBondContact O-N 3.14Å; M230-C239 WeakPolarHBondContact CG-SG 3.36Å; C239-E243 WeakPolarHBondContact CA-OE2 3.35Å; C239-E243 HydrophobicContact CB-CB 4.28Å; C239-I244 HydrophobicContact CB-CG1 4.36Å; C239-I244 VanDerWaalsContact SG-CG1 3.53Å
240	T	95.5	Very high	96.2	Very high	71 Å²	71	56.1 Å²	56.1	44%	0.436	28%	0.284	S	S	.	.	P	Polyproline II helix	trans	-83.8	164.3	175	64.7	0	0	0	0	111.4	K242 E243 I244	T240-K242 PolarHBondContact O-N 3.48Å; T240-E243 WeakPolarHBondContact CB-OE2 3.43Å; T240-E243 PolarHBondContact N-OE2 2.94Å; T240-E243 PolarHBondContact O-N 2.93Å; T240-E243 VanDerWaalsContact O-N 3.15Å; T240-E243 WeakPolarHBondContact OG1-CG 3.42Å; T240-E243 PolarHBondContact OG1-N 3.37Å; T240-E243 PolarHBondContact OG1-OE2 3.28Å; T240-I244 WeakPolarHBondContact O-CG1 3.33Å; T240-I244 PolarHBondContact O-N 2.82Å
241	L	94.7	Very high	96.1	Very high	15 Å²	15	56.7 Å²	56.7	8%	0.079	29%	0.287	C	S	.	.	H	α-helix	trans	-56.4	-36.3	172.9	-73.8	177.2	0	0	0	112.4	V100 L103 E104 H107 I177 L180 E243 I244 K245	V100-L241 HydrophobicContact CG1-CD2 4.33Å; L103-L241 HydrophobicContact CD2-CD2 4.18Å; L103-L241 HydrophobicContact CG-CD1 4.23Å; E104-L241 HydrophobicContact CB-CD1 3.93Å; H107-L241 HydrophobicContact CB-CD1 4.46Å; H107-L241 WeakPolarHBondContact ND1-CD1 3.3Å; I177-L241 HydrophobicContact CD1-CB 4.46Å; I177-L241 HydrophobicContact CD1-CD2 3.34Å; I177-L241 HydrophobicContact CD1-CG 3.48Å; I177-L241 VanDerWaalsContact CD1-CG 3.48Å; L180-L241 HydrophobicContact CD2-CD2 4.45Å; L241-E243 VanDerWaalsContact C-N 3.34Å; L241-E243 PolarHBondContact O-N 3.34Å; L241-I244 HydrophobicContact CD2-CD1 4.39Å; L241-I244 PolarHBondContact O-N 2.76Å; L241-K245 VanDerWaalsContact O-CG 3.27Å; L241-K245 WeakPolarHBondContact O-CG 3.39Å; L241-K245 PolarHBondContact O-N 3Å
242	K	93.2	Very high	96	Very high	165 Å²	165	60.1 Å²	60.1	72%	0.717	30%	0.304	S	S	*	.	H	α-helix	trans	-61.8	-43.1	178.1	-67.4	-174	178.5	-174.2	0	111.7	T240	T240-K242 PolarHBondContact O-N 3.48Å
243	E	95.9	Very high	95.7	Very high	104 Å²	104	59.8 Å²	59.8	49%	0.486	32%	0.319	S	S	.	.	H	α-helix	trans	-69.8	-41.6	177.4	-69	161.4	141.9	0	0	111.4	C239 T240 L241 K245 I246 D247	C239-E243 WeakPolarHBondContact CA-OE2 3.35Å; C239-E243 HydrophobicContact CB-CB 4.28Å; T240-E243 WeakPolarHBondContact CB-OE2 3.43Å; T240-E243 PolarHBondContact N-OE2 2.94Å; T240-E243 PolarHBondContact O-N 2.93Å; T240-E243 VanDerWaalsContact O-N 3.15Å; T240-E243 WeakPolarHBondContact OG1-CG 3.42Å; T240-E243 PolarHBondContact OG1-N 3.37Å; T240-E243 PolarHBondContact OG1-OE2 3.28Å; L241-E243 VanDerWaalsContact C-N 3.34Å; L241-E243 PolarHBondContact O-N 3.34Å; E243-K245 VanDerWaalsContact C-N 3.26Å; E243-K245 PolarHBondContact O-N 3.16Å; E243-I246 VanDerWaalsContact O-CG1 3.26Å; E243-I246 WeakPolarHBondContact O-CG1 3.48Å; E243-I246 PolarHBondContact O-N 3.3Å; E243-D247 PolarHBondContact O-N 2.89Å; E243-D247 VanDerWaalsContact O-N 3.16Å
244	I	97.2	Very high	95.5	Very high	1 Å²	1	59.6 Å²	59.6	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-57.7	-40.4	176.4	-68.3	166.4	0	0	0	111.2	F96 V100 I177 L226 M230 C239 T240 L241 I246 D247 V250	F96-I244 HydrophobicContact CE1-CG2 3.66Å; F96-I244 HydrophobicContact CZ-CG2 3.92Å; V100-I244 HydrophobicContact CG1-CG2 4.45Å; V100-I244 HydrophobicContact CG2-CG2 3.85Å; I177-I244 HydrophobicContact CD1-CD1 3.76Å; I177-I244 HydrophobicContact CG2-CD1 4.12Å; L226-I244 HydrophobicContact CD1-CG1 4.18Å; L226-I244 HydrophobicContact CD1-CG2 4.42Å; M230-I244 HydrophobicContact CE-CD1 4.04Å; M230-I244 HydrophobicContact CG-CD1 4.02Å; M230-I244 HydrophobicContact CG-CG1 4.38Å; M230-I244 HydrophobicContact SD-CD1 4.21Å; C239-I244 HydrophobicContact CB-CG1 4.36Å; C239-I244 VanDerWaalsContact SG-CG1 3.53Å; T240-I244 WeakPolarHBondContact O-CG1 3.33Å; T240-I244 PolarHBondContact O-N 2.82Å; L241-I244 HydrophobicContact CD2-CD1 4.39Å; L241-I244 PolarHBondContact O-N 2.76Å; I244-I246 PolarHBondContact O-N 3.43Å; I244-D247 VanDerWaalsContact O-CB 3.27Å; I244-D247 WeakPolarHBondContact O-CB 3.22Å; I244-D247 PolarHBondContact O-N 3.33Å; I244-D247 VanDerWaalsContact O-N 3.14Å; I244-V250 HydrophobicContact CG2-CG2 4.12Å; I244-V250 WeakPolarHBondContact O-CB 3.23Å; I244-V250 VanDerWaalsContact O-CG2 3.28Å; I244-V250 WeakPolarHBondContact O-CG2 3.34Å
245	K	94.9	Very high	95.4	Very high	15 Å²	15	61.7 Å²	61.7	7%	0.065	34%	0.341	C	S	.	.	H	α-helix	trans	-64.9	-27	-177.2	-75.6	179.6	64.9	173	0	114.6	V100 E104 L241 E243 T251 L258 Q260	V100-K245 HydrophobicContact CG1-CD 4.32Å; V100-K245 HydrophobicContact CG1-CG 3.63Å; E104-K245 WeakPolarHBondContact OE1-CD 3.3Å; E104-K245 IonicContact OE1-NZ 3.79Å; E104-K245 PolarHBondContact OE1-NZ 3.18Å; E104-K245 WeakPolarHBondContact OE2-CD 3.21Å; E104-K245 IonicContact OE2-NZ 2.89Å; E104-K245 PolarHBondContact OE2-NZ 2.94Å; L241-K245 VanDerWaalsContact O-CG 3.27Å; L241-K245 WeakPolarHBondContact O-CG 3.39Å; L241-K245 PolarHBondContact O-N 3Å; E243-K245 VanDerWaalsContact C-N 3.26Å; E243-K245 PolarHBondContact O-N 3.16Å; K245-T251 WeakPolarHBondContact O-CG2 3.22Å; K245-L258 HydrophobicContact CB-CD2 4.44Å; K245-L258 WeakPolarHBondContact CE-O 3.42Å; K245-L258 HydrophobicContact CG-CD2 3.91Å; K245-L258 HydrophobicContact CG-CG 4.42Å; K245-Q260 VanDerWaalsContact NZ-CB 3.29Å; K245-Q260 VanDerWaalsContact NZ-CD 3.28Å
246	I	95.1	Very high	95.3	Very high	131 Å²	131	64.4 Å²	64.4	67%	0.672	35%	0.35	S	S	*	.	H	α-helix	trans	-100.6	0.2	177.8	64	170.1	0	0	0	112.3	E243 I244	E243-I246 VanDerWaalsContact O-CG1 3.26Å; E243-I246 WeakPolarHBondContact O-CG1 3.48Å; E243-I246 PolarHBondContact O-N 3.3Å; I244-I246 PolarHBondContact O-N 3.43Å
247	D	97.2	Very high	95.2	Very high	15 Å²	15	60.3 Å²	60.3	8%	0.08	33%	0.332	C	S	.	.			trans	-59.6	138.9	-179.3	-178	-86.2	0	0	0	110.9	H225 L226 E243 I244 W249 V250 T251	H225-D247 IonicContact ND1-OD2 3.47Å; L226-D247 HydrophobicContact CD1-CB 4.23Å; E243-D247 PolarHBondContact O-N 2.89Å; E243-D247 VanDerWaalsContact O-N 3.16Å; I244-D247 VanDerWaalsContact O-CB 3.27Å; I244-D247 WeakPolarHBondContact O-CB 3.22Å; I244-D247 PolarHBondContact O-N 3.33Å; I244-D247 VanDerWaalsContact O-N 3.14Å; D247-W249 PolarHBondContact O-N 2.92Å; D247-W249 WeakPolarHBondContact OD1-CA 3.46Å; D247-W249 WeakPolarHBondContact OD1-CB 3.2Å; D247-W249 PolarHBondContact OD1-N 2.77Å; D247-V250 HydrophobicContact CB-CB 4.36Å; D247-V250 HydrophobicContact CB-CG2 4.14Å; D247-V250 PolarHBondContact O-N 3.08Å; D247-V250 VanDerWaalsContact O-N 3.09Å; D247-T251 PolarHBondContact O-N 3.43Å; D247-T251 PolarHBondContact O-OG1 3.19Å
248	P	97.1	Very high	94.9	Very high	70 Å²	70	56.4 Å²	56.4	46%	0.455	31%	0.311	S	S	.	.	H	α-helix	trans	-57.6	-33.7	-179.2	-27.4	35.8	0	0	0	113.9	E222 M252 G253	E222-P248 HydrophobicContact CG-CB 4.24Å; P248-M252 CarbonylContact O-C 3.37Å; P248-M252 WeakPolarHBondContact O-CA 3.26Å; P248-M252 PolarHBondContact O-N 3.32Å; P248-G253 PolarHBondContact O-N 3.29Å
249	W	98.1	Very high	93.9	Very high	4 Å²	4	62.5 Å²	62.5	2%	0.015	34%	0.344	C	S	.	.	H	α-helix	trans	-68.1	-42.3	176.7	-174.5	78.2	0	0	0	111.4	E89 R93 F96 L184 S220 E222 L223 L226 D247	E89-W249 HydrophobicContact CG-CZ2 3.92Å; E89-W249 PolarHBondContact OE1-NE1 3.24Å; R93-W249 HydrophobicContact CB-CH2 3.59Å; R93-W249 HydrophobicContact CB-CZ2 3.69Å; R93-W249 HydrophobicContact CB-CZ3 4.12Å; R93-W249 VanDerWaalsContact CD-O 3.22Å; R93-W249 WeakPolarHBondContact CD-O 3.39Å; R93-W249 HydrophobicContact CG-CE3 4.3Å; R93-W249 HydrophobicContact CG-CH2 4.05Å; R93-W249 HydrophobicContact CG-CZ2 4.25Å; R93-W249 HydrophobicContact CG-CZ3 4.06Å; R93-W249 PolarHBondContact NE-O 3.15Å; F96-W249 HydrophobicContact CB-CH2 4.41Å; F96-W249 HydrophobicContact CB-CZ3 4.19Å; F96-W249 AromaticContact CD1-CZ3 3.8Å; F96-W249 HydrophobicContact CD1-CZ3 3.8Å; F96-W249 HydrophobicContact CE1-CZ3 4.41Å; F96-W249 HydrophobicContact CG-CZ3 4.06Å; L184-W249 HydrophobicContact CD1-CH2 3.53Å; L184-W249 HydrophobicContact CD1-CZ2 4.37Å; L184-W249 HydrophobicContact CD1-CZ3 4.01Å; L184-W249 HydrophobicContact CD2-CH2 4.28Å; L184-W249 HydrophobicContact CD2-CZ3 4.03Å; S220-W249 VanDerWaalsContact OG-CD1 3.31Å; E222-W249 HydrophobicContact CB-CB 3.76Å; E222-W249 HydrophobicContact CB-CG 4.39Å; L223-W249 HydrophobicContact CB-CD2 4.46Å; L223-W249 HydrophobicContact CB-CG 4.17Å; L223-W249 HydrophobicContact CD1-CD2 4.01Å; L223-W249 HydrophobicContact CD1-CE3 4.4Å; L223-W249 HydrophobicContact CD1-CG 4.49Å; L223-W249 HydrophobicContact CD1-CH2 4.2Å; L223-W249 HydrophobicContact CD1-CZ2 3.84Å; L223-W249 HydrophobicContact CD1-CZ3 4.48Å; L223-W249 HydrophobicContact CD2-CZ2 4.14Å; L223-W249 HydrophobicContact CG-CZ2 4.46Å; L226-W249 HydrophobicContact CD2-CB 4.31Å; L226-W249 HydrophobicContact CD2-CD2 4.17Å; L226-W249 HydrophobicContact CD2-CE3 3.43Å; L226-W249 VanDerWaalsContact CD2-CE3 3.43Å; L226-W249 HydrophobicContact CD2-CZ3 4.06Å; D247-W249 PolarHBondContact O-N 2.92Å; D247-W249 WeakPolarHBondContact OD1-CA 3.46Å; D247-W249 WeakPolarHBondContact OD1-CB 3.2Å; D247-W249 PolarHBondContact OD1-N 2.77Å
250	V	97.6	Very high	92.4	Very high	0 Å²	0	65.4 Å²	65.4	0%	0	36%	0.356	C	S	.	.	H	α-helix	trans	-68.2	-42.7	-179.1	175.9	0	0	0	0	110.7	F96 R97 L226 I244 D247 L258	F96-V250 HydrophobicContact CD1-CG2 4.16Å; F96-V250 HydrophobicContact CE1-CG2 3.82Å; R97-V250 HydrophobicContact CG-CG1 3.98Å; R97-V250 PolarHBondContact NH1-O 2.88Å; L226-V250 HydrophobicContact CD2-CG2 3.79Å; I244-V250 HydrophobicContact CG2-CG2 4.12Å; I244-V250 WeakPolarHBondContact O-CB 3.23Å; I244-V250 VanDerWaalsContact O-CG2 3.28Å; I244-V250 WeakPolarHBondContact O-CG2 3.34Å; D247-V250 HydrophobicContact CB-CB 4.36Å; D247-V250 HydrophobicContact CB-CG2 4.14Å; D247-V250 PolarHBondContact O-N 3.08Å; D247-V250 VanDerWaalsContact O-N 3.09Å; V250-L258 HydrophobicContact CG1-CB 4.36Å; V250-L258 HydrophobicContact CG1-CD2 3.76Å
251	T	96.2	Very high	90.6	Very high	11 Å²	11	64.4 Å²	64.4	7%	0.067	35%	0.351	C	S	.	.	H	α-helix	trans	-92	-0.5	-174.8	61.7	0	0	0	0	114.3	K245 D247 G254 F255 Q256	K245-T251 WeakPolarHBondContact O-CG2 3.22Å; D247-T251 PolarHBondContact O-N 3.43Å; D247-T251 PolarHBondContact O-OG1 3.19Å; T251-G254 CarbonylContact O-C 3.5Å; T251-G254 PolarHBondContact O-N 3.34Å; T251-G254 PolarHBondContact OG1-N 3.17Å; T251-G254 VanDerWaalsContact OG1-N 3.13Å; T251-F255 PolarHBondContact O-N 3.2Å; T251-Q256 VanDerWaalsContact CA-O 3.3Å; T251-Q256 WeakPolarHBondContact CA-O 3.45Å; T251-Q256 CarbonylContact O-C 3.51Å; T251-Q256 PolarHBondContact O-N 3.08Å
252	M	95.2	Very high	88.9	Confident	79 Å²	79	71.7 Å²	71.7	39%	0.389	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.7	59	-167.9	-62.5	-176.4	62.2	0	0	110.7	P248 G254 F255 Q256	P248-M252 CarbonylContact O-C 3.37Å; P248-M252 WeakPolarHBondContact O-CA 3.26Å; P248-M252 PolarHBondContact O-N 3.32Å; M252-G254 PolarHBondContact O-N 3.49Å; M252-G254 VanDerWaalsContact O-N 3.13Å; M252-F255 HydrophobicContact CB-CB 4.4Å; M252-F255 WeakPolarHBondContact O-CB 3.38Å; M252-F255 WeakPolarHBondContact O-CD2 3.14Å; M252-F255 PolarHBondContact O-N 3.08Å; M252-Q256 HydrophobicContact SD-CG 4.33Å
253	G	92.8	Very high	87.3	Confident	59 Å²	59	71.2 Å²	71.2	61%	0.608	39%	0.385	S	S	*	.	T	Hydrogen-bonded Turn	trans	60.2	24.5	-179.1	0	0	0	0	0	114.4	P248	P248-G253 PolarHBondContact O-N 3.29Å
254	G	91.3	Very high	85.9	Confident	48 Å²	48	68.6 Å²	68.6	50%	0.495	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	93	-7.9	-176.2	0	0	0	0	0	115.6	T251 M252 Q256	T251-G254 CarbonylContact O-C 3.5Å; T251-G254 PolarHBondContact O-N 3.34Å; T251-G254 PolarHBondContact OG1-N 3.17Å; T251-G254 VanDerWaalsContact OG1-N 3.13Å; M252-G254 PolarHBondContact O-N 3.49Å; M252-G254 VanDerWaalsContact O-N 3.13Å; G254-Q256 PolarHBondContact O-N 2.89Å
255	F	93.5	Very high	84.4	Confident	182 Å²	182	75 Å²	75	80%	0.798	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-25.7	178	-70.1	-66.9	0	0	0	113.4	T251 M252	T251-F255 PolarHBondContact O-N 3.2Å; M252-F255 HydrophobicContact CB-CB 4.4Å; M252-F255 WeakPolarHBondContact O-CB 3.38Å; M252-F255 WeakPolarHBondContact O-CD2 3.14Å; M252-F255 PolarHBondContact O-N 3.08Å
256	Q	92.3	Very high	83.1	Confident	98 Å²	98	81.9 Å²	81.9	46%	0.458	43%	0.434	S	S	.	.	S	Bend	trans	-133.6	77.3	180	-64.7	-171.3	12.1	0	0	110.8	R97 T251 M252 G254	R97-Q256 PolarHBondContact NH1-O 3.47Å; R97-Q256 PolarHBondContact NH2-O 3.22Å; T251-Q256 VanDerWaalsContact CA-O 3.3Å; T251-Q256 WeakPolarHBondContact CA-O 3.45Å; T251-Q256 CarbonylContact O-C 3.51Å; T251-Q256 PolarHBondContact O-N 3.08Å; M252-Q256 HydrophobicContact SD-CG 4.33Å; G254-Q256 PolarHBondContact O-N 2.89Å
257	P	91.6	Very high	82.1	Confident	70 Å²	70	81.2 Å²	81.2	46%	0.455	43%	0.428	S	S	.	.			trans	-57.6	147.2	179.5	24.8	-33.9	0	0	0	111.6	R97 L259	R97-P257 PolarHBondContact NH2-O 3.43Å; P257-L259 HydrophobicContact CB-CD2 4.22Å; P257-L259 HydrophobicContact CB-CG 4.31Å; P257-L259 HydrophobicContact CG-CD2 4.49Å; P257-L259 HydrophobicContact CG-CG 4.33Å; P257-L259 PolarHBondContact O-N 3.13Å
258	L	89.9	Confident	81.2	Confident	16 Å²	16	82.3 Å²	82.3	8%	0.084	44%	0.435	C	S	.	.			trans	-95.8	78.3	173.7	-169.8	58.1	0	0	0	108.9	R97 V100 L101 K245 V250	R97-L258 HydrophobicContact CB-CD1 4.03Å; R97-L258 HydrophobicContact CB-CD2 4.44Å; R97-L258 HydrophobicContact CG-CD1 4.29Å; R97-L258 HydrophobicContact CG-CD2 4.37Å; V100-L258 HydrophobicContact CB-CD2 4.2Å; V100-L258 HydrophobicContact CG1-CD2 3.84Å; L101-L258 HydrophobicContact CD1-CD1 3.84Å; L101-L258 HydrophobicContact CD2-CD1 3.98Å; L101-L258 HydrophobicContact CD2-CG 4.04Å; L101-L258 HydrophobicContact CG-CD1 3.87Å; L101-L258 HydrophobicContact CG-CG 4.33Å; K245-L258 HydrophobicContact CB-CD2 4.44Å; K245-L258 WeakPolarHBondContact CE-O 3.42Å; K245-L258 HydrophobicContact CG-CD2 3.91Å; K245-L258 HydrophobicContact CG-CG 4.42Å; V250-L258 HydrophobicContact CG1-CB 4.36Å; V250-L258 HydrophobicContact CG1-CD2 3.76Å
259	L	74.8	Confident	80.1	Confident	140 Å²	140	84.5 Å²	84.5	73%	0.733	45%	0.447	S	S	*	.	P	Polyproline II helix	trans	-67.8	139.9	-176.2	-63.4	175.4	0	0	0	111.4	P257	P257-L259 HydrophobicContact CB-CD2 4.22Å; P257-L259 HydrophobicContact CB-CG 4.31Å; P257-L259 HydrophobicContact CG-CD2 4.49Å; P257-L259 HydrophobicContact CG-CG 4.33Å; P257-L259 PolarHBondContact O-N 3.13Å
260	Q	66.1	Low	78.9	Confident	80 Å²	80	87 Å²	87	37%	0.374	46%	0.46	S	S	.	.	P	Polyproline II helix	trans	-95.2	137.8	177.2	-147.7	172.7	55.6	0	0	108.9	E104 K245 Q262	E104-Q260 PolarHBondContact OE1-NE2 3.2Å; E104-Q260 WeakPolarHBondContact OE2-CG 3.34Å; E104-Q260 PolarHBondContact OE2-NE2 3.13Å; K245-Q260 VanDerWaalsContact NZ-CB 3.29Å; K245-Q260 VanDerWaalsContact NZ-CD 3.28Å; Q260-Q262 PolarHBondContact O-N 2.81Å
261	S	57.2	Low	77.9	Confident	49 Å²	49	89.5 Å²	89.5	34%	0.343	48%	0.478	S	S	.	.	P	Polyproline II helix	trans	-77.9	117.1	163.8	-50.8	0	0	0	0	107.8	Q263 Y264	S261-Q263 PolarHBondContact O-N 2.91Å; S261-Y264 VanDerWaalsContact CB-CE2 3.43Å; S261-Y264 PolarHBondContact O-N 3.01Å; S261-Y264 WeakPolarHBondContact OG-CE2 3.43Å
262	Q	59.4	Low	76.9	Confident	169 Å²	169	98.1 Å²	98.1	79%	0.79	51%	0.514	S	S	*	.	G	3₁₀ helix	trans	-49.6	-23.8	171.6	-71.6	178.1	-19.8	0	0	112.5	Q260 Y264 E265	Q260-Q262 PolarHBondContact O-N 2.81Å; Q262-Y264 PolarHBondContact O-N 2.94Å; Q262-Y264 VanDerWaalsContact O-N 3.12Å; Q262-E265 PolarHBondContact O-N 2.91Å
263	Q	59.4	Low	76	Confident	154 Å²	154	98.5 Å²	98.5	72%	0.72	52%	0.515	S	S	*	.	G	3₁₀ helix	trans	-56.9	-21.7	175.7	-65	179.4	-22.6	0	0	114.5	S261	S261-Q263 PolarHBondContact O-N 2.91Å
264	Y	67.4	Low	75.2	Confident	50 Å²	50	98 Å²	98	20%	0.196	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-88.7	-3.2	-176.1	-59.6	-39.7	0	0	0	114.8	H59 P60 Y105 S261 Q262 Q266	H59-Y264 AromaticContact CD2-CD1 3.96Å; H59-Y264 AromaticContact CD2-CD2 3.91Å; H59-Y264 AromaticContact CD2-CE1 3.66Å; H59-Y264 AromaticContact CD2-CE2 3.57Å; H59-Y264 AromaticContact CD2-CZ 3.46Å; H59-Y264 VanDerWaalsContact CD2-CZ 3.46Å; H59-Y264 AromaticContact NE2-CD2 3.94Å; H59-Y264 AromaticContact NE2-CE2 3.5Å; H59-Y264 WeakPolarHBondContact NE2-CE2 3.48Å; H59-Y264 AromaticContact NE2-CZ 3.8Å; P60-Y264 WeakPolarHBondContact CD-OH 3.46Å; Y105-Y264 AromaticContact CD2-CD1 3.81Å; Y105-Y264 HydrophobicContact CD2-CD1 3.81Å; Y105-Y264 HydrophobicContact CD2-CG 4Å; Y105-Y264 HydrophobicContact CE2-CD1 4.12Å; S261-Y264 VanDerWaalsContact CB-CE2 3.43Å; S261-Y264 PolarHBondContact O-N 3.01Å; S261-Y264 WeakPolarHBondContact OG-CE2 3.43Å; Q262-Y264 PolarHBondContact O-N 2.94Å; Q262-Y264 VanDerWaalsContact O-N 3.12Å; Y264-Q266 VanDerWaalsContact C-N 3.32Å
265	E	65	Low	74.2	Confident	135 Å²	135	97 Å²	97	63%	0.631	48%	0.483	S	S	*	.	G	3₁₀ helix	trans	-77.9	-18.6	176.6	-63.6	-172.4	164.8	0	0	112.9	Q262 Q267	Q262-E265 PolarHBondContact O-N 2.91Å; E265-Q267 PolarHBondContact O-N 3.09Å
266	Q	68.7	Low	73.1	Confident	160 Å²	160	96.8 Å²	96.8	75%	0.748	48%	0.477	S	S	*	.	S	Bend	trans	-75.7	124.8	177.7	-65.9	-174.3	-3.5	0	0	110.6	Q109 Y264	Q109-Q266 PolarHBondContact NE2-O 2.74Å; Y264-Q266 VanDerWaalsContact C-N 3.32Å
267	Q	73.9	Confident	72	Confident	117 Å²	117	96.2 Å²	96.2	55%	0.547	48%	0.477	S	S	.	.			trans	-69.2	134.8	174.2	-70.1	-172.2	-20.7	0	0	110.7	K110 E265 T269	K110-Q267 VanDerWaalsContact CG-NE2 3.29Å; E265-Q267 PolarHBondContact O-N 3.09Å; Q267-T269 PolarHBondContact O-N 3.24Å; Q267-T269 VanDerWaalsContact O-N 3.17Å
268	V	76.8	Confident	70.7	Confident	37 Å²	37	92.9 Å²	92.9	22%	0.224	46%	0.455	C	S	.	.			trans	-61.3	115.9	174.6	169.2	0	0	0	0	108.9	K56 Q109	K56-V268 HydrophobicContact CB-CG1 3.37Å; K56-V268 HydrophobicContact CD-CG1 3.77Å; K56-V268 HydrophobicContact CG-CG1 4.25Å; Q109-V268 HydrophobicContact CG-CG2 4.47Å
269	T	74.5	Confident	69.5	Low	116 Å²	116	93.2 Å²	93.2	71%	0.712	46%	0.458	S	S	*	.	P	Polyproline II helix	trans	-82.6	126.3	175.8	56.2	0	0	0	0	110.7	K56 Q267	K56-T269 PolarHBondContact NZ-O 3.47Å; Q267-T269 PolarHBondContact O-N 3.24Å; Q267-T269 VanDerWaalsContact O-N 3.17Å
270	I	73	Confident	68.9	Low	56 Å²	56	93.6 Å²	93.6	29%	0.287	45%	0.449	S	S	.	.	P	Polyproline II helix	trans	-98.5	128.7	174.5	-42.2	165.9	0	0	0	109	D49 A52 I53 D274 V275	D49-I270 HydrophobicContact CB-CD1 4.38Å; A52-I270 HydrophobicContact CB-CD1 4.48Å; A52-I270 HydrophobicContact CB-CG2 3.56Å; I53-I270 HydrophobicContact CB-CD1 4.45Å; I53-I270 HydrophobicContact CD1-CD1 3.79Å; I53-I270 HydrophobicContact CG1-CD1 3.16Å; I53-I270 HydrophobicContact CG1-CG1 3.73Å; I270-D274 HydrophobicContact CG2-CB 3.7Å; I270-V275 HydrophobicContact CG2-CG2 3.57Å
271	S	77.6	Confident	68.5	Low	54 Å²	54	99.9 Å²	99.9	38%	0.378	47%	0.47	S	S	.	.	P	Polyproline II helix	trans	-87.9	159.7	168.8	77.2	0	0	0	0	110.7	E273 D274 V275	S271-E273 PolarHBondContact O-N 3.42Å; S271-E273 VanDerWaalsContact O-N 3.12Å; S271-E273 PolarHBondContact OG-N 3.36Å; S271-D274 WeakPolarHBondContact CA-OD2 3.17Å; S271-D274 WeakPolarHBondContact CB-OD2 3.5Å; S271-D274 PolarHBondContact N-OD2 2.8Å; S271-D274 WeakPolarHBondContact O-CB 3.44Å; S271-D274 PolarHBondContact O-N 2.8Å; S271-D274 PolarHBondContact OG-N 2.95Å; S271-D274 PolarHBondContact OG-OD2 3.41Å; S271-V275 PolarHBondContact O-N 2.78Å
272	K	75.1	Confident	68.5	Low	192 Å²	192	100 Å²	100	84%	0.835	47%	0.466	S	S	*	.	H	α-helix	trans	-55.8	-30.2	173.5	-67.8	-176.7	177.7	179.4	0	112.8	R276	K272-R276 WeakPolarHBondContact O-CB 3.4Å; K272-R276 PolarHBondContact O-N 3.27Å; K272-R276 VanDerWaalsContact O-N 3.08Å
273	E	75.1	Confident	68.3	Low	87 Å²	87	99.9 Å²	99.9	41%	0.407	47%	0.469	S	S	.	.	H	α-helix	trans	-72.4	-35.8	178.6	-169.9	57.3	-157.3	0	0	111.8	S271 R276 N277	S271-E273 PolarHBondContact O-N 3.42Å; S271-E273 VanDerWaalsContact O-N 3.12Å; S271-E273 PolarHBondContact OG-N 3.36Å; E273-R276 PolarHBondContact O-N 3.34Å; E273-R276 IonicContact OE2-CZ 2.68Å; E273-R276 IonicContact OE2-NH1 2.82Å; E273-R276 PolarHBondContact OE2-NH1 3.28Å; E273-N277 WeakPolarHBondContact O-CB 3.47Å; E273-N277 PolarHBondContact O-N 3.5Å; E273-N277 PolarHBondContact O-ND2 3.09Å; E273-N277 PolarHBondContact OE1-ND2 3.35Å
274	D	75.8	Confident	68.5	Low	49 Å²	49	93.8 Å²	93.8	26%	0.262	45%	0.447	S	S	.	.	H	α-helix	trans	-64.7	-41.3	174.6	-58	-65.2	0	0	0	111.6	A52 K56 I270 S271 N277 S278	A52-D274 HydrophobicContact CB-CB 4.39Å; K56-D274 WeakPolarHBondContact CE-OD1 3.47Å; K56-D274 WeakPolarHBondContact CE-OD2 3.32Å; K56-D274 VanDerWaalsContact NZ-CG 3.26Å; K56-D274 IonicContact NZ-OD1 3.75Å; K56-D274 PolarHBondContact NZ-OD1 3.03Å; K56-D274 IonicContact NZ-OD2 3.73Å; K56-D274 PolarHBondContact NZ-OD2 3.12Å; I270-D274 HydrophobicContact CG2-CB 3.7Å; S271-D274 WeakPolarHBondContact CA-OD2 3.17Å; S271-D274 WeakPolarHBondContact CB-OD2 3.5Å; S271-D274 PolarHBondContact N-OD2 2.8Å; S271-D274 WeakPolarHBondContact O-CB 3.44Å; S271-D274 PolarHBondContact O-N 2.8Å; S271-D274 PolarHBondContact OG-N 2.95Å; S271-D274 PolarHBondContact OG-OD2 3.41Å; D274-N277 CarbonylContact O-C 3.54Å; D274-N277 PolarHBondContact O-N 2.9Å; D274-S278 WeakPolarHBondContact O-CA 3.17Å; D274-S278 WeakPolarHBondContact O-CB 3.39Å; D274-S278 PolarHBondContact O-N 2.88Å
275	V	71.8	Confident	68.1	Low	27 Å²	27	97.7 Å²	97.7	16%	0.164	47%	0.471	C	S	.	.	H	α-helix	trans	-62.9	-46	175.5	-176.4	0	0	0	0	110.2	Y48 D49 A52 I270 S271 N277 S278	Y48-V275 VanDerWaalsContact CB-CG1 3.48Å; D49-V275 WeakPolarHBondContact OD1-CG2 3.29Å; A52-V275 HydrophobicContact CB-CG2 4.34Å; I270-V275 HydrophobicContact CG2-CG2 3.57Å; S271-V275 PolarHBondContact O-N 2.78Å; V275-N277 VanDerWaalsContact C-N 3.32Å; V275-N277 PolarHBondContact O-N 3.35Å; V275-S278 WeakPolarHBondContact O-CB 3.4Å; V275-S278 PolarHBondContact O-N 2.97Å; V275-S278 PolarHBondContact O-OG 3.4Å
276	R	70.2	Confident	67.9	Low	177 Å²	177	93.7 Å²	93.7	67%	0.668	45%	0.454	S	S	*	.	H	α-helix	trans	-60.1	-41.3	178	-176.6	-175.8	-72.2	157.2	-10.6	112.1	K272 E273 S278	K272-R276 WeakPolarHBondContact O-CB 3.4Å; K272-R276 PolarHBondContact O-N 3.27Å; K272-R276 VanDerWaalsContact O-N 3.08Å; E273-R276 PolarHBondContact O-N 3.34Å; E273-R276 IonicContact OE2-CZ 2.68Å; E273-R276 IonicContact OE2-NH1 2.82Å; E273-R276 PolarHBondContact OE2-NH1 3.28Å; R276-S278 VanDerWaalsContact C-N 3.35Å
277	N	68.9	Low	67.6	Low	86 Å²	86	88.1 Å²	88.1	46%	0.46	43%	0.431	S	S	.	.	H	α-helix	trans	-89.1	-0.4	-178.7	-64.1	-31.8	0	0	0	113.5	K55 E273 D274 V275 V279	K55-N277 PolarHBondContact NZ-O 3.11Å; E273-N277 WeakPolarHBondContact O-CB 3.47Å; E273-N277 PolarHBondContact O-N 3.5Å; E273-N277 PolarHBondContact O-ND2 3.09Å; E273-N277 PolarHBondContact OE1-ND2 3.35Å; D274-N277 CarbonylContact O-C 3.54Å; D274-N277 PolarHBondContact O-N 2.9Å; V275-N277 VanDerWaalsContact C-N 3.32Å; V275-N277 PolarHBondContact O-N 3.35Å; N277-V279 VanDerWaalsContact C-N 3.28Å; N277-V279 PolarHBondContact O-N 3.24Å
278	S	64.8	Low	66.9	Low	0 Å²	0	84.5 Å²	84.5	0%	0	42%	0.415	C	S	.	.	H	α-helix	trans	-65.3	-33	179.9	70.1	0	0	0	0	112	Y48 K55 D274 V275 R276	Y48-S278 PolarHBondContact O-OG 3.25Å; K55-S278 WeakPolarHBondContact CE-O 3.49Å; K55-S278 PolarHBondContact NZ-O 3.18Å; D274-S278 WeakPolarHBondContact O-CA 3.17Å; D274-S278 WeakPolarHBondContact O-CB 3.39Å; D274-S278 PolarHBondContact O-N 2.88Å; V275-S278 WeakPolarHBondContact O-CB 3.4Å; V275-S278 PolarHBondContact O-N 2.97Å; V275-S278 PolarHBondContact O-OG 3.4Å; R276-S278 VanDerWaalsContact C-N 3.35Å
279	V	63	Low	66.3	Low	22 Å²	22	86 Å²	86	13%	0.133	42%	0.424	C	S	.	.			trans	-133.5	129	-173.8	177.3	0	0	0	0	112.1	Y48 N277 L336	Y48-V279 HydrophobicContact CD1-CB 3.83Å; Y48-V279 HydrophobicContact CD1-CG2 3.4Å; Y48-V279 VanDerWaalsContact CD1-CG2 3.4Å; Y48-V279 HydrophobicContact CE1-CB 3.62Å; Y48-V279 HydrophobicContact CE1-CG1 3.9Å; Y48-V279 HydrophobicContact CE1-CG2 3.6Å; N277-V279 VanDerWaalsContact C-N 3.28Å; N277-V279 PolarHBondContact O-N 3.24Å; V279-L336 HydrophobicContact CB-CB 4.26Å; V279-L336 HydrophobicContact CG1-CB 3.52Å; V279-L336 HydrophobicContact CG2-CB 3.66Å; V279-L336 HydrophobicContact CG2-CD1 3.36Å; V279-L336 HydrophobicContact CG2-CG 4.11Å
280	R	63	Low	65.7	Low	148 Å²	148	82.7 Å²	82.7	56%	0.558	40%	0.402	S	S	*	.	P	Polyproline II helix	trans	-97.1	139.9	171.3	-64.9	-176	176.6	-169.1	-0.5	110.5	E67 L335	E67-R280 IonicContact OE1-CZ 2.69Å; E67-R280 IonicContact OE1-NE 3.47Å; E67-R280 IonicContact OE1-NH1 3.77Å; E67-R280 IonicContact OE1-NH2 2.75Å; E67-R280 PolarHBondContact OE1-NH2 3.17Å; R280-L335 HydrophobicContact CB-CD2 4.31Å
281	R	58.9	Low	65.1	Low	212 Å²	212	81.1 Å²	81.1	80%	0.8	39%	0.394	S	S	*	.	P	Polyproline II helix	trans	-79.8	127.3	172	-73.9	-174.1	-179.2	-171.8	3.2	110.1
282	I	56.6	Low	64.1	Low	51 Å²	51	85.8 Å²	85.8	26%	0.262	41%	0.407	S	S	.	.	P	Polyproline II helix	trans	-88.3	128.3	165.2	-52.2	179.4	0	0	0	107.8	T287 I291 L335	I282-T287 HydrophobicContact CG2-CG2 3.64Å; I282-I291 HydrophobicContact CD1-CD1 3.44Å; I282-I291 VanDerWaalsContact CD1-CD1 3.44Å; I282-L335 HydrophobicContact CD1-CB 4.31Å; I282-L335 HydrophobicContact CD1-CD1 3.75Å; I282-L335 HydrophobicContact CD1-CD2 3.63Å; I282-L335 HydrophobicContact CD1-CG 4.08Å; I282-L335 HydrophobicContact CG1-CD1 4.27Å; I282-L335 HydrophobicContact CG1-CD2 3.43Å; I282-L335 VanDerWaalsContact CG1-CD2 3.43Å; I282-L335 HydrophobicContact CG1-CG 4.38Å
283	I	53.9	Low	63.2	Low	168 Å²	168	79.3 Å²	79.3	86%	0.862	38%	0.381	S	S	*	.			trans	-101.1	-25.2	-174.8	-54.4	173.9	0	0	0	111.3
284	G	64.1	Low	62.4	Low	25 Å²	25	76.2 Å²	76.2	26%	0.258	37%	0.367	S	S	.	.			trans	-89.6	125.5	-175.3	0	0	0	0	0	114.5	D286 T287 L288	G284-D286 VanDerWaalsContact C-N 3.28Å; G284-D286 VanDerWaalsContact C-OD1 3.24Å; G284-D286 VanDerWaalsContact CA-OD1 3.23Å; G284-D286 WeakPolarHBondContact CA-OD1 3.42Å; G284-D286 PolarHBondContact O-N 2.81Å; G284-T287 WeakPolarHBondContact O-CB 3.49Å; G284-T287 PolarHBondContact O-N 3.44Å; G284-L288 PolarHBondContact O-N 3.17Å; G284-L288 VanDerWaalsContact O-N 3.11Å
285	L	58.6	Low	61.1	Low	132 Å²	132	76.1 Å²	76.1	69%	0.691	38%	0.378	S	S	*	.	H	α-helix	trans	-63.1	-35.9	172.6	-179.6	66.4	0	0	0	111.8	T287 L288 V289	L285-T287 VanDerWaalsContact C-N 3.34Å; L285-L288 WeakPolarHBondContact O-CB 3.19Å; L285-L288 PolarHBondContact O-N 2.87Å; L285-V289 HydrophobicContact CG-CG2 4.45Å; L285-V289 WeakPolarHBondContact O-CB 3.42Å; L285-V289 VanDerWaalsContact O-CG2 3.25Å; L285-V289 WeakPolarHBondContact O-CG2 3.38Å; L285-V289 PolarHBondContact O-N 2.76Å
286	D	61.7	Low	60.3	Low	51 Å²	51	82.6 Å²	82.6	27%	0.273	41%	0.406	S	S	.	.	H	α-helix	trans	-58.3	-44.8	173.4	60.1	-23.1	0	0	0	112.2	G284 L288 V289 L290	G284-D286 VanDerWaalsContact C-N 3.28Å; G284-D286 VanDerWaalsContact C-OD1 3.24Å; G284-D286 VanDerWaalsContact CA-OD1 3.23Å; G284-D286 WeakPolarHBondContact CA-OD1 3.42Å; G284-D286 PolarHBondContact O-N 2.81Å; D286-L288 VanDerWaalsContact C-N 3.33Å; D286-V289 PolarHBondContact O-N 3.37Å; D286-L290 VanDerWaalsContact O-CB 3.27Å; D286-L290 WeakPolarHBondContact O-CB 3.15Å; D286-L290 PolarHBondContact O-N 2.72Å
287	T	62.4	Low	59.4	Low	43 Å²	43	79.1 Å²	79.1	26%	0.264	40%	0.397	S	S	.	.	H	α-helix	trans	-65	-40.6	176.5	-54.5	0	0	0	0	110.3	I282 G284 L285 L290 I291	I282-T287 HydrophobicContact CG2-CG2 3.64Å; G284-T287 WeakPolarHBondContact O-CB 3.49Å; G284-T287 PolarHBondContact O-N 3.44Å; L285-T287 VanDerWaalsContact C-N 3.34Å; T287-L290 PolarHBondContact O-N 3.23Å; T287-I291 HydrophobicContact CG2-CD1 3.92Å; T287-I291 WeakPolarHBondContact O-CB 3.22Å; T287-I291 WeakPolarHBondContact O-CD1 3.41Å; T287-I291 WeakPolarHBondContact O-CG1 3.05Å; T287-I291 PolarHBondContact O-N 3.41Å
288	L	58.9	Low	58.4	Low	41 Å²	41	86.4 Å²	86.4	22%	0.215	42%	0.418	C	S	.	.	H	α-helix	trans	-66.9	-41.2	177.1	-168.6	141.6	0	0	0	112.3	G284 L285 D286 K292 L337	G284-L288 PolarHBondContact O-N 3.17Å; G284-L288 VanDerWaalsContact O-N 3.11Å; L285-L288 WeakPolarHBondContact O-CB 3.19Å; L285-L288 PolarHBondContact O-N 2.87Å; D286-L288 VanDerWaalsContact C-N 3.33Å; L288-K292 VanDerWaalsContact O-CB 3.3Å; L288-K292 WeakPolarHBondContact O-CB 3.41Å; L288-K292 PolarHBondContact O-N 3.36Å; L288-L337 HydrophobicContact CD1-CD2 3.19Å; L288-L337 HydrophobicContact CG-CD2 3.68Å
289	V	64.1	Low	57.3	Low	69 Å²	69	89 Å²	89	42%	0.418	44%	0.436	S	S	.	.	H	α-helix	trans	-63.4	-46.1	173.9	168.6	0	0	0	0	110.5	L285 D286 K292 L293	L285-V289 HydrophobicContact CG-CG2 4.45Å; L285-V289 WeakPolarHBondContact O-CB 3.42Å; L285-V289 VanDerWaalsContact O-CG2 3.25Å; L285-V289 WeakPolarHBondContact O-CG2 3.38Å; L285-V289 PolarHBondContact O-N 2.76Å; D286-V289 PolarHBondContact O-N 3.37Å; V289-K292 PolarHBondContact O-N 3.12Å; V289-L293 HydrophobicContact CG1-CD1 3.83Å; V289-L293 HydrophobicContact CG1-CG 4.39Å; V289-L293 WeakPolarHBondContact O-CB 3.22Å; V289-L293 VanDerWaalsContact O-CG 3.28Å; V289-L293 WeakPolarHBondContact O-CG 3.23Å; V289-L293 PolarHBondContact O-N 2.88Å
290	L	63.2	Low	56.7	Low	47 Å²	47	90.9 Å²	90.9	25%	0.246	44%	0.443	C	S	.	.	H	α-helix	trans	-57.4	-51.3	176.9	178.8	63.7	0	0	0	111.2	D286 T287 K292 L293 M294 P303	D286-L290 VanDerWaalsContact O-CB 3.27Å; D286-L290 WeakPolarHBondContact O-CB 3.15Å; D286-L290 PolarHBondContact O-N 2.72Å; T287-L290 PolarHBondContact O-N 3.23Å; L290-K292 VanDerWaalsContact C-N 3.33Å; L290-K292 PolarHBondContact O-N 2.87Å; L290-L293 PolarHBondContact O-N 3.41Å; L290-M294 HydrophobicContact CD1-SD 4.2Å; L290-M294 HydrophobicContact CG-SD 3.88Å; L290-M294 VanDerWaalsContact O-CG 3.24Å; L290-M294 WeakPolarHBondContact O-CG 3.28Å; L290-M294 PolarHBondContact O-N 2.76Å; L290-P303 HydrophobicContact CD1-CG 3.5Å
291	I	59.4	Low	55.8	Low	22 Å²	22	85.5 Å²	85.5	11%	0.113	43%	0.433	C	S	.	.	H	α-helix	trans	-58.9	-43.8	177.6	-73.4	168.5	0	0	0	111.5	M15 I282 T287 L293 M294 G295 L335	M15-I291 HydrophobicContact CE-CG2 3.54Å; M15-I291 HydrophobicContact SD-CG2 3.24Å; M15-I291 WeakPolarHBondContact SD-CG2 3.35Å; I282-I291 HydrophobicContact CD1-CD1 3.44Å; I282-I291 VanDerWaalsContact CD1-CD1 3.44Å; T287-I291 HydrophobicContact CG2-CD1 3.92Å; T287-I291 WeakPolarHBondContact O-CB 3.22Å; T287-I291 WeakPolarHBondContact O-CD1 3.41Å; T287-I291 WeakPolarHBondContact O-CG1 3.05Å; T287-I291 PolarHBondContact O-N 3.41Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 PolarHBondContact O-N 3.24Å; I291-M294 PolarHBondContact O-N 3.43Å; I291-G295 PolarHBondContact O-N 3.24Å; I291-L335 HydrophobicContact CD1-CD1 4.47Å
292	K	56.3	Low	55.3	Low	153 Å²	153	80.1 Å²	80.1	67%	0.665	42%	0.417	S	S	*	.	H	α-helix	trans	-65.9	-37.5	179.4	-165.2	174	-173.9	176.1	0	112	L288 V289 L290 H296	L288-K292 VanDerWaalsContact O-CB 3.3Å; L288-K292 WeakPolarHBondContact O-CB 3.41Å; L288-K292 PolarHBondContact O-N 3.36Å; V289-K292 PolarHBondContact O-N 3.12Å; L290-K292 VanDerWaalsContact C-N 3.33Å; L290-K292 PolarHBondContact O-N 2.87Å; K292-H296 PolarHBondContact O-N 3.22Å
293	L	56	Low	54.7	Low	55 Å²	55	78.6 Å²	78.6	29%	0.288	41%	0.411	S	S	.	.	H	α-helix	trans	-66.7	-43.5	174.7	-74.2	169	0	0	0	111.7	V289 L290 I291 G295 H296 Q297 P303 F304	V289-L293 HydrophobicContact CG1-CD1 3.83Å; V289-L293 HydrophobicContact CG1-CG 4.39Å; V289-L293 WeakPolarHBondContact O-CB 3.22Å; V289-L293 VanDerWaalsContact O-CG 3.28Å; V289-L293 WeakPolarHBondContact O-CG 3.23Å; V289-L293 PolarHBondContact O-N 2.88Å; L290-L293 PolarHBondContact O-N 3.41Å; I291-L293 VanDerWaalsContact C-N 3.34Å; I291-L293 PolarHBondContact O-N 3.24Å; L293-G295 PolarHBondContact O-N 3.41Å; L293-H296 PolarHBondContact O-N 3.23Å; L293-Q297 WeakPolarHBondContact O-CG 3.42Å; L293-Q297 PolarHBondContact O-N 2.73Å; L293-P303 HydrophobicContact CB-CB 4.16Å; L293-P303 HydrophobicContact CB-CG 4.04Å; L293-P303 HydrophobicContact CD1-CG 4.24Å; L293-F304 HydrophobicContact CD1-CE2 4.33Å; L293-F304 HydrophobicContact CD1-CZ 3.77Å
294	M	57.9	Low	54.5	Low	23 Å²	23	71.8 Å²	71.8	11%	0.113	38%	0.375	C	S	.	.	H	α-helix	trans	-60.7	-44.4	176.2	-68.1	163.8	76.1	0	0	111.5	L290 I291 H296 Q297 R298 S299 F300	L290-M294 HydrophobicContact CD1-SD 4.2Å; L290-M294 HydrophobicContact CG-SD 3.88Å; L290-M294 VanDerWaalsContact O-CG 3.24Å; L290-M294 WeakPolarHBondContact O-CG 3.28Å; L290-M294 PolarHBondContact O-N 2.76Å; I291-M294 PolarHBondContact O-N 3.43Å; M294-H296 VanDerWaalsContact C-N 3.34Å; M294-H296 PolarHBondContact O-N 3.15Å; M294-Q297 PolarHBondContact O-N 3.31Å; M294-R298 PolarHBondContact O-N 3.01Å; M294-S299 WeakPolarHBondContact CA-O 3.34Å; M294-S299 WeakPolarHBondContact CB-O 3.46Å; M294-S299 PolarHBondContact O-N 2.85Å; M294-F300 HydrophobicContact CE-CB 3.92Å; M294-F300 HydrophobicContact CE-CD1 3.64Å; M294-F300 HydrophobicContact CE-CG 4.23Å; M294-F300 WeakPolarHBondContact CE-O 3.48Å
295	G	50.1	Low	53.9	Low	47 Å²	47	73 Å²	73	49%	0.485	39%	0.387	S	S	.	.	H	α-helix	trans	-62.3	-38.3	175	0	0	0	0	0	113.2	I291 L293 R298	I291-G295 PolarHBondContact O-N 3.24Å; L293-G295 PolarHBondContact O-N 3.41Å; G295-R298 PolarHBondContact O-N 2.84Å
296	H	55.2	Low	53.4	Low	163 Å²	163	76.4 Å²	76.4	76%	0.755	40%	0.399	S	S	*	.	H	α-helix	trans	-69	-37.5	176.7	-168.4	43.4	0	0	0	112.6	K292 L293 M294 R298	K292-H296 PolarHBondContact O-N 3.22Å; L293-H296 PolarHBondContact O-N 3.23Å; M294-H296 VanDerWaalsContact C-N 3.34Å; M294-H296 PolarHBondContact O-N 3.15Å; H296-R298 VanDerWaalsContact C-N 3.29Å; H296-R298 PolarHBondContact O-N 2.96Å
297	Q	50	Low	52.6	Low	104 Å²	104	83.5 Å²	83.5	49%	0.486	43%	0.428	S	S	.	.	H	α-helix	trans	-81.7	-3.8	178.8	-69.1	-176.1	-4.7	0	0	113.8	L293 M294 S299	L293-Q297 WeakPolarHBondContact O-CG 3.42Å; L293-Q297 PolarHBondContact O-N 2.73Å; M294-Q297 PolarHBondContact O-N 3.31Å; Q297-S299 PolarHBondContact O-N 3.3Å; Q297-S299 VanDerWaalsContact O-N 3.08Å
298	R	48	Very low	51.8	Low	239 Å²	239	86.3 Å²	86.3	90%	0.902	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	48.9	32.3	-171.9	-59.9	-176.9	176.7	176.5	-1.2	112.4	M294 G295 H296	M294-R298 PolarHBondContact O-N 3.01Å; G295-R298 PolarHBondContact O-N 2.84Å; H296-R298 VanDerWaalsContact C-N 3.29Å; H296-R298 PolarHBondContact O-N 2.96Å
299	S	42.9	Very low	51	Low	53 Å²	53	88.8 Å²	88.8	37%	0.371	46%	0.456	S	S	.	.			trans	-138.9	129.6	-174.6	177.9	0	0	0	0	108.8	M294 Q297 G301	M294-S299 WeakPolarHBondContact CA-O 3.34Å; M294-S299 WeakPolarHBondContact CB-O 3.46Å; M294-S299 PolarHBondContact O-N 2.85Å; Q297-S299 PolarHBondContact O-N 3.3Å; Q297-S299 VanDerWaalsContact O-N 3.08Å; S299-G301 PolarHBondContact O-N 2.82Å; S299-G301 PolarHBondContact OG-N 3.17Å
300	F	50.2	Low	49.9	Very low	63 Å²	63	95 Å²	95	28%	0.276	47%	0.474	S	S	.	.			trans	-86.5	10.3	172.6	-67.7	-83.2	0	0	0	112.5	F11 Q13 M294 I332	F11-F300 HydrophobicContact CB-CD2 4.23Å; Q13-F300 HydrophobicContact CB-CE1 4.2Å; Q13-F300 HydrophobicContact CB-CE2 4.06Å; Q13-F300 HydrophobicContact CB-CZ 3.82Å; Q13-F300 WeakPolarHBondContact O-CZ 3.49Å; M294-F300 HydrophobicContact CE-CB 3.92Å; M294-F300 HydrophobicContact CE-CD1 3.64Å; M294-F300 HydrophobicContact CE-CG 4.23Å; M294-F300 WeakPolarHBondContact CE-O 3.48Å; F300-I332 HydrophobicContact CD1-CD1 3.45Å; F300-I332 VanDerWaalsContact CD1-CD1 3.45Å; F300-I332 HydrophobicContact CE1-CD1 3.53Å
301	G	44.4	Very low	48.9	Very low	35 Å²	35	96.3 Å²	96.3	36%	0.361	48%	0.48	S	S	.	.	S	Bend	trans	-69.7	152.3	167.7	0	0	0	0	0	111.4	S299 P303	S299-G301 PolarHBondContact O-N 2.82Å; S299-G301 PolarHBondContact OG-N 3.17Å; G301-P303 WeakPolarHBondContact O-CD 3.39Å; G301-P303 VanDerWaalsContact O-N 3.16Å
302	H	47.2	Very low	47.9	Very low	99 Å²	99	99.7 Å²	99.7	46%	0.458	49%	0.494	S	S	.	.			trans	-59.6	119.5	173.2	-164.2	-92.2	0	0	0	108.6	F304	H302-F304 AromaticContact CE1-CD2 3.67Å; H302-F304 PolarHBondContact ND1-N 3.1Å; H302-F304 PolarHBondContact ND1-O 2.73Å; H302-F304 PolarHBondContact O-N 3.05Å; H302-F304 VanDerWaalsContact O-N 3.08Å
303	P	43.8	Very low	47.2	Very low	19 Å²	19	94.9 Å²	94.9	12%	0.123	48%	0.48	C	S	.	.	S	Bend	trans	-67.1	-16.8	-171.9	26.3	-33.1	0	0	0	112.2	L290 L293 G301	L290-P303 HydrophobicContact CD1-CG 3.5Å; L293-P303 HydrophobicContact CB-CB 4.16Å; L293-P303 HydrophobicContact CB-CG 4.04Å; L293-P303 HydrophobicContact CD1-CG 4.24Å; G301-P303 WeakPolarHBondContact O-CD 3.39Å; G301-P303 VanDerWaalsContact O-N 3.16Å
304	F	50	Low	46.5	Very low	25 Å²	25	98 Å²	98	11%	0.11	50%	0.496	C	S	.	.	S	Bend	trans	-101	86.7	170.7	-45	-69.9	0	0	0	108.8	L293 H302 L311 V315	L293-F304 HydrophobicContact CD1-CE2 4.33Å; L293-F304 HydrophobicContact CD1-CZ 3.77Å; H302-F304 AromaticContact CE1-CD2 3.67Å; H302-F304 PolarHBondContact ND1-N 3.1Å; H302-F304 PolarHBondContact ND1-O 2.73Å; H302-F304 PolarHBondContact O-N 3.05Å; H302-F304 VanDerWaalsContact O-N 3.08Å; F304-L311 HydrophobicContact CD1-CB 3.73Å; F304-L311 HydrophobicContact CD1-CD1 4.22Å; F304-L311 HydrophobicContact CD1-CG 4.42Å; F304-L311 HydrophobicContact CE1-CB 3.74Å; F304-L311 HydrophobicContact CE1-CD1 3.88Å; F304-L311 HydrophobicContact CE1-CD2 3.89Å; F304-L311 HydrophobicContact CE1-CG 4.03Å; F304-L311 HydrophobicContact CG-CB 4.45Å; F304-L311 HydrophobicContact CZ-CB 4.44Å; F304-L311 HydrophobicContact CZ-CD2 4.23Å; F304-V315 HydrophobicContact CE2-CG2 4.13Å
305	G	50.8	Low	45.7	Very low	49 Å²	49	99.2 Å²	99.2	51%	0.505	50%	0.504	S	S	.	.			trans	-72.3	178.5	163.3	0	0	0	0	0	111.2	K307 Q308	G305-K307 PolarHBondContact O-N 3.21Å; G305-Q308 PolarHBondContact O-N 3.27Å
306	E	49	Very low	45.2	Very low	204 Å²	204	102.1 Å²	102.1	95%	0.953	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51	-10.4	-177.8	-70.2	-178.6	151.7	0	0	115.7
307	K	45.6	Very low	44.5	Very low	201 Å²	201	105 Å²	105	87%	0.874	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.5	-3.1	-176.8	-61.5	-172.2	178.2	-177.1	0	115.6	G305	G305-K307 PolarHBondContact O-N 3.21Å
308	Q	45.4	Very low	43.8	Very low	102 Å²	102	102.7 Å²	102.7	48%	0.477	51%	0.512	S	S	.	.			trans	-139.9	69.9	-179.9	-68.9	-173.2	-0.7	0	0	114.7	G305 Y310 L311	G305-Q308 PolarHBondContact O-N 3.27Å; Q308-Y310 VanDerWaalsContact C-N 3.28Å; Q308-Y310 PolarHBondContact O-N 3.49Å; Q308-L311 PolarHBondContact O-N 3.46Å
309	P	41.1	Very low	43.3	Very low	92 Å²	92	92.3 Å²	92.3	60%	0.597	48%	0.477	S	S	*	.	H	α-helix	trans	-64	-23.8	-177.5	23.3	-32.6	0	0	0	114.9	F312 S313	P309-F312 WeakPolarHBondContact O-CB 3.26Å; P309-F312 PolarHBondContact O-N 2.75Å; P309-S313 PolarHBondContact O-N 2.6Å
310	Y	41.6	Very low	43	Very low	201 Å²	201	95.3 Å²	95.3	79%	0.788	49%	0.494	S	S	*	.	H	α-helix	trans	-71.2	-39.3	179.9	-88.2	-92.7	0	0	0	113.3	Q308 F312 S313	Q308-Y310 VanDerWaalsContact C-N 3.28Å; Q308-Y310 PolarHBondContact O-N 3.49Å; Y310-F312 VanDerWaalsContact C-N 3.32Å; Y310-S313 PolarHBondContact O-N 2.97Å; Y310-S313 PolarHBondContact O-OG 3.02Å
311	L	42.9	Very low	42.4	Very low	73 Å²	73	98.9 Å²	98.9	38%	0.382	52%	0.52	S	S	.	.	H	α-helix	trans	-70.6	-32.3	175.8	-89.1	149.4	0	0	0	111.6	F304 Q308 S313 I314 V315	F304-L311 HydrophobicContact CD1-CB 3.73Å; F304-L311 HydrophobicContact CD1-CD1 4.22Å; F304-L311 HydrophobicContact CD1-CG 4.42Å; F304-L311 HydrophobicContact CE1-CB 3.74Å; F304-L311 HydrophobicContact CE1-CD1 3.88Å; F304-L311 HydrophobicContact CE1-CD2 3.89Å; F304-L311 HydrophobicContact CE1-CG 4.03Å; F304-L311 HydrophobicContact CG-CB 4.45Å; F304-L311 HydrophobicContact CZ-CB 4.44Å; F304-L311 HydrophobicContact CZ-CD2 4.23Å; Q308-L311 PolarHBondContact O-N 3.46Å; L311-S313 PolarHBondContact O-N 2.76Å; L311-I314 PolarHBondContact O-N 3.41Å; L311-V315 PolarHBondContact O-N 2.89Å
312	F	38.6	Very low	42.1	Very low	93 Å²	93	101.6 Å²	101.6	41%	0.408	53%	0.526	S	S	.	.	H	α-helix	trans	-57.9	-36.2	173.6	-155.7	-98.9	0	0	0	112.5	P309 Y310 K316	P309-F312 WeakPolarHBondContact O-CB 3.26Å; P309-F312 PolarHBondContact O-N 2.75Å; Y310-F312 VanDerWaalsContact C-N 3.32Å; F312-K316 HydrophobicContact CD1-CD 4.23Å; F312-K316 HydrophobicContact CE1-CD 4.09Å; F312-K316 HydrophobicContact CE1-CG 4.49Å; F312-K316 WeakPolarHBondContact O-CB 3.46Å; F312-K316 PolarHBondContact O-N 3.26Å; F312-K316 VanDerWaalsContact O-N 3.09Å
313	S	39.9	Very low	41.3	Very low	52 Å²	52	101.7 Å²	101.7	36%	0.364	53%	0.527	S	S	.	.	H	α-helix	trans	-73	-31.3	179.7	78.7	0	0	0	0	113.8	P309 Y310 L311 R317	P309-S313 PolarHBondContact O-N 2.6Å; Y310-S313 PolarHBondContact O-N 2.97Å; Y310-S313 PolarHBondContact O-OG 3.02Å; L311-S313 PolarHBondContact O-N 2.76Å; S313-R317 PolarHBondContact O-N 2.97Å
314	I	41.1	Very low	40.7	Very low	122 Å²	122	108.8 Å²	108.8	63%	0.626	56%	0.564	S	S	*	*	H	α-helix	trans	-73.2	-39.5	179.4	-65.3	172.9	0	0	0	110.3	L311	L311-I314 PolarHBondContact O-N 3.41Å
315	V	41.5	Very low	39.8	Very low	48 Å²	48	115.4 Å²	115.4	29%	0.291	60%	0.595	S	S	.	*	H	α-helix	trans	-71.6	-38.5	176.3	-179.9	0	0	0	0	111.2	F304 L311 R317 G318 A319	F304-V315 HydrophobicContact CE2-CG2 4.13Å; L311-V315 PolarHBondContact O-N 2.89Å; V315-R317 VanDerWaalsContact C-N 3.3Å; V315-R317 PolarHBondContact O-N 3.44Å; V315-G318 PolarHBondContact O-N 2.85Å; V315-A319 WeakPolarHBondContact O-CB 3.04Å; V315-A319 PolarHBondContact O-N 3.24Å
316	K	40.4	Very low	38.7	Very low	108 Å²	108	119.2 Å²	119.2	47%	0.47	60%	0.602	S	S	.	*	H	α-helix	trans	-61.9	-29.4	177.9	-98.4	-168.1	169	-177.8	0	114.7	F312 G318	F312-K316 HydrophobicContact CD1-CD 4.23Å; F312-K316 HydrophobicContact CE1-CD 4.09Å; F312-K316 HydrophobicContact CE1-CG 4.49Å; F312-K316 WeakPolarHBondContact O-CB 3.46Å; F312-K316 PolarHBondContact O-N 3.26Å; F312-K316 VanDerWaalsContact O-N 3.09Å; K316-G318 VanDerWaalsContact C-N 3.31Å; K316-G318 PolarHBondContact O-N 3.36Å
317	R	39.7	Very low	37.8	Very low	223 Å²	223	117 Å²	117	84%	0.842	60%	0.596	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.7	-14.6	-178.9	-74.7	-178	-177.1	-172.9	1.4	113.9	S313 V315	S313-R317 PolarHBondContact O-N 2.97Å; V315-R317 VanDerWaalsContact C-N 3.3Å; V315-R317 PolarHBondContact O-N 3.44Å
318	G	36.4	Very low	37	Very low	55 Å²	55	114.5 Å²	114.5	57%	0.567	59%	0.587	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.3	-9.3	173.9	0	0	0	0	0	114.8	V315 K316	V315-G318 PolarHBondContact O-N 2.85Å; K316-G318 VanDerWaalsContact C-N 3.31Å; K316-G318 PolarHBondContact O-N 3.36Å
319	A	37.8	Very low	36.4	Very low	22 Å²	22	113.9 Å²	113.9	18%	0.182	59%	0.592	C	S	.	*			trans	-109.4	28.9	-164.4	0	0	0	0	0	114.5	V315 T321 L322	V315-A319 WeakPolarHBondContact O-CB 3.04Å; V315-A319 PolarHBondContact O-N 3.24Å; A319-T321 PolarHBondContact O-N 2.93Å; A319-L322 PolarHBondContact O-N 3.38Å
320	T	35	Very low	35.9	Very low	116 Å²	116	114.3 Å²	114.3	71%	0.712	60%	0.595	S	S	*	*	T	Hydrogen-bonded Turn	trans	-66.2	0.9	-179.2	33.7	0	0	0	0	114.9
321	T	37.7	Very low	35.5	Very low	137 Å²	137	108.7 Å²	108.7	84%	0.84	58%	0.583	S	S	*	*	T	Hydrogen-bonded Turn	trans	-104.5	-4.1	176.5	-40.1	0	0	0	0	113.8	A319	A319-T321 PolarHBondContact O-N 2.93Å
322	L	37.8	Very low	34.9	Very low	92 Å²	92	106.9 Å²	106.9	48%	0.482	57%	0.573	S	S	.	*	T	Hydrogen-bonded Turn	trans	-123.7	1.2	-173.8	-80.5	162.1	0	0	0	115.4	A319 N324 E325 I326	A319-L322 PolarHBondContact O-N 3.38Å; L322-N324 PolarHBondContact O-N 3.37Å; L322-N324 VanDerWaalsContact O-N 3.11Å; L322-E325 PolarHBondContact O-N 3.24Å; L322-I326 WeakPolarHBondContact O-CD1 3.27Å; L322-I326 WeakPolarHBondContact O-CG1 3.24Å
323	Q	31.2	Very low	34.6	Very low	102 Å²	102	102.9 Å²	102.9	48%	0.477	56%	0.557	S	S	.	*	T	Hydrogen-bonded Turn	trans	-70.1	-5.8	-174.6	-85.2	179.2	-9.3	0	0	115.9
324	N	31.5	Very low	34.2	Very low	167 Å²	167	101 Å²	101	89%	0.893	55%	0.545	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.1	5.8	178.4	-76.1	-10.7	0	0	0	115.2	L322	L322-N324 PolarHBondContact O-N 3.37Å; L322-N324 VanDerWaalsContact O-N 3.11Å
325	E	30.9	Very low	33.9	Very low	164 Å²	164	96.7 Å²	96.7	77%	0.766	52%	0.522	S	S	*	.	S	Bend	trans	-126.2	8.5	-178.8	-70.9	-162.6	154.8	0	0	115.5	L322 I327	L322-E325 PolarHBondContact O-N 3.24Å; E325-I327 PolarHBondContact O-N 3.29Å
326	I	27.5	Very low	33.5	Very low	129 Å²	129	94.9 Å²	94.9	66%	0.662	51%	0.511	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.1	77.6	-168.1	-54.2	169	0	0	0	111.5	L322	L322-I326 WeakPolarHBondContact O-CD1 3.27Å; L322-I326 WeakPolarHBondContact O-CG1 3.24Å
327	I	30.7	Very low	33.2	Very low	159 Å²	159	90.6 Å²	90.6	82%	0.815	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.1	-1.9	154.6	-69.1	-179.5	0	0	0	111.4	E325	E325-I327 PolarHBondContact O-N 3.29Å
328	Q	29	Very low	32.7	Very low	147 Å²	147	81.9 Å²	81.9	69%	0.687	46%	0.463	S	S	*	.	S	Bend	trans	-143.3	142	177.2	-71.1	-75.3	-54.9	0	0	109.5
329	P	32.2	Very low	32.3	Very low	89 Å²	89	82.6 Å²	82.6	58%	0.578	45%	0.454	S	S	*	.			trans	-56.7	139.1	173.1	25.4	-32.6	0	0	0	109.1
330	P	29.8	Very low	31.8	Very low	101 Å²	101	85.3 Å²	85.3	66%	0.656	47%	0.471	S	S	*	.			trans	-60.6	151.7	-176	26.6	-34.2	0	0	0	109.7	I332	P330-I332 PolarHBondContact O-N 3.09Å
331	P	33.4	Very low	31.4	Very low	84 Å²	84	88.4 Å²	88.4	55%	0.545	48%	0.475	S	S	.	.			trans	-67.1	108.7	-173.7	5.9	0.6	0	0	0	110.7	V68 S333	V68-P331 HydrophobicContact CB-CB 3.13Å; V68-P331 HydrophobicContact CG1-CB 3.19Å; V68-P331 VanDerWaalsContact CG2-C 3.46Å; V68-P331 HydrophobicContact CG2-CB 3.62Å; P331-S333 VanDerWaalsContact C-N 3.33Å; P331-S333 PolarHBondContact O-N 3.4Å
332	I	31.6	Very low	30.7	Very low	35 Å²	35	85.6 Å²	85.6	18%	0.179	46%	0.461	C	S	.	.			trans	-77.1	83.1	175.4	-50.7	-171.4	0	0	0	110.6	V68 F300 P330	V68-I332 VanDerWaalsContact CG2-O 3.27Å; V68-I332 WeakPolarHBondContact CG2-O 3.38Å; F300-I332 HydrophobicContact CD1-CD1 3.45Å; F300-I332 VanDerWaalsContact CD1-CD1 3.45Å; F300-I332 HydrophobicContact CE1-CD1 3.53Å; P330-I332 PolarHBondContact O-N 3.09Å
333	S	31.2	Very low	30.1	Very low	9 Å²	9	88.7 Å²	88.7	6%	0.063	47%	0.474	C	S	.	.			trans	-76.5	152.3	159.7	56.3	0	0	0	0	107.7	P331 L335	P331-S333 VanDerWaalsContact C-N 3.33Å; P331-S333 PolarHBondContact O-N 3.4Å; S333-L335 PolarHBondContact O-N 2.86Å
334	A	32.3	Very low	29.8	Very low	13 Å²	13	89 Å²	89	11%	0.107	49%	0.485	C	S	.	.			trans	-44.5	98.4	-178.5	0	0	0	0	0	112.2	V51 L65 L336	V51-A334 HydrophobicContact CG1-CB 4.36Å; L65-A334 HydrophobicContact CD1-CB 4.26Å; L65-A334 HydrophobicContact CD2-CB 3.67Å; L65-A334 HydrophobicContact CG-CB 4.42Å; A334-L336 PolarHBondContact O-N 2.7Å
335	L	33.9	Very low	29.6	Very low	30 Å²	30	87 Å²	87	16%	0.157	48%	0.479	C	S	.	.			trans	-95.2	99.4	-178.1	-93.1	165.9	0	0	0	107.8	R280 I282 I291 S333 L337	R280-L335 HydrophobicContact CB-CD2 4.31Å; I282-L335 HydrophobicContact CD1-CB 4.31Å; I282-L335 HydrophobicContact CD1-CD1 3.75Å; I282-L335 HydrophobicContact CD1-CD2 3.63Å; I282-L335 HydrophobicContact CD1-CG 4.08Å; I282-L335 HydrophobicContact CG1-CD1 4.27Å; I282-L335 HydrophobicContact CG1-CD2 3.43Å; I282-L335 VanDerWaalsContact CG1-CD2 3.43Å; I282-L335 HydrophobicContact CG1-CG 4.38Å; I291-L335 HydrophobicContact CD1-CD1 4.47Å; S333-L335 PolarHBondContact O-N 2.86Å; L335-L337 PolarHBondContact O-N 2.66Å
336	L	32.9	Very low	29.3	Very low	10 Å²	10	86.7 Å²	86.7	5%	0.052	48%	0.481	C	S	.	.			trans	-74.3	100.7	169.8	-118.6	156.4	0	0	0	108.1	K16 V18 I47 V51 V279 A334 I338	K16-L336 WeakPolarHBondContact O-CA 3.47Å; V18-L336 HydrophobicContact CB-CD2 3.38Å; V18-L336 HydrophobicContact CG1-CD2 4.12Å; V18-L336 HydrophobicContact CG2-CD2 3.32Å; V18-L336 HydrophobicContact CG2-CG 4.34Å; I47-L336 HydrophobicContact CG2-CD1 3.63Å; I47-L336 HydrophobicContact CG2-CD2 3.81Å; I47-L336 HydrophobicContact CG2-CG 4.39Å; V51-L336 HydrophobicContact CB-CD1 4.19Å; V51-L336 HydrophobicContact CG2-CD1 3.33Å; V279-L336 HydrophobicContact CB-CB 4.26Å; V279-L336 HydrophobicContact CG1-CB 3.52Å; V279-L336 HydrophobicContact CG2-CB 3.66Å; V279-L336 HydrophobicContact CG2-CD1 3.36Å; V279-L336 HydrophobicContact CG2-CG 4.11Å; A334-L336 PolarHBondContact O-N 2.7Å; L336-I338 PolarHBondContact O-N 2.92Å
337	L	34.5	Very low	29.4	Very low	19 Å²	19	85.6 Å²	85.6	10%	0.099	48%	0.484	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-57.7	133.8	168.6	-92.9	161.7	0	0	0	108.8	I17 V18 L288 L335	I17-L337 HydrophobicContact CB-CD1 4.21Å; I17-L337 HydrophobicContact CD1-CD1 3.82Å; I17-L337 HydrophobicContact CG1-CD1 3.83Å; I17-L337 HydrophobicContact CG2-CB 3.9Å; I17-L337 HydrophobicContact CG2-CD1 3.62Å; I17-L337 HydrophobicContact CG2-CG 4.37Å; V18-L337 CarbonylContact C-O 3.47Å; V18-L337 CarbonylContact O-C 3.57Å; L288-L337 HydrophobicContact CD1-CD2 3.19Å; L288-L337 HydrophobicContact CG-CD2 3.68Å; L335-L337 PolarHBondContact O-N 2.66Å
338	I	29.4	Very low	29.2	Very low	40 Å²	40	81.9 Å²	81.9	21%	0.205	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	98.6	171.1	-70.1	176.6	0	0	0	106	K20 Y48 L336 C340	K20-I338 HydrophobicContact CB-CG2 3.88Å; K20-I338 HydrophobicContact CD-CG2 3.34Å; K20-I338 HydrophobicContact CG-CG2 4.23Å; Y48-I338 HydrophobicContact CE1-CD1 4.27Å; Y48-I338 WeakPolarHBondContact OH-CD1 3.23Å; L336-I338 PolarHBondContact O-N 2.92Å; I338-C340 PolarHBondContact O-N 3.09Å
339	D	28.7	Very low	29.2	Very low	69 Å²	69	80.8 Å²	80.8	37%	0.369	48%	0.483	S	S	.	.			trans	-69.7	119	178.6	-91.5	-28	0	0	0	111.4
340	C	25.9	Very low	29.4	Very low	80 Å²	80	86.6 Å²	86.6	54%	0.541	50%	0.499	S	S	.	.			trans	-111.5	26.9	177	-90.1	0	0	0	0	113.3	I338	I338-C340 PolarHBondContact O-N 3.09Å
341	F	27	Very low	29.5	Very low	181 Å²	181	87.8 Å²	87.8	79%	0.794	51%	0.505	S	S	*	.			trans	-140.3	117.8	175.8	-85.9	-78.6	0	0	0	115.4	R21	R21-F341 PolarHBondContact NH1-O 2.9Å; R21-F341 VanDerWaalsContact NH2-CA 3.26Å; R21-F341 VanDerWaalsContact NH2-N 3.11Å
342	S	24.3	Very low	29.8	Very low	78 Å²	78	89.3 Å²	89.3	55%	0.545	52%	0.518	S	S	.	.			trans	-102.5	107.5	178.5	-102.8	0	0	0	0	102.7	R21	R21-S342 VanDerWaalsContact CZ-CA 3.47Å; R21-S342 PolarHBondContact NE-OG 3.17Å; R21-S342 PolarHBondContact NH1-OG 3.26Å; R21-S342 PolarHBondContact NH2-OG 3.04Å
343	M	24.2	Very low	30	Very low	156 Å²	156	96.8 Å²	96.8	77%	0.768	55%	0.549	S	S	*	.			trans	-134.2	123.2	163.6	-74.2	-101.3	94.6	0	0	106.2	V345	M343-V345 PolarHBondContact O-N 3.3Å
344	P	23.9	Very low	30.3	Very low	109 Å²	109	108.1 Å²	108.1	71%	0.708	59%	0.59	S	S	*	*			trans	-75	118.7	166.6	30.8	-26	0	0	0	106.7	I346	P344-I346 PolarHBondContact O-N 3.09Å
345	V	28	Very low	30.6	Very low	125 Å²	125	113.2 Å²	113.2	76%	0.758	63%	0.625	S	S	*	*			trans	-94.7	94.4	165.5	-176.2	0	0	0	0	107.2	M343	M343-V345 PolarHBondContact O-N 3.3Å
346	I	24.4	Very low	30.8	Very low	157 Å²	157	120.1 Å²	120.1	81%	0.805	66%	0.661	S	S	*	*			trans	-69.4	116.9	156	-62.6	166.7	0	0	0	105.5	P344	P344-I346 PolarHBondContact O-N 3.09Å
347	S	29.7	Very low	31.1	Very low	106 Å²	106	123.5 Å²	123.5	74%	0.741	69%	0.69	S	S	*	*			trans	-121.5	107.5	165.5	65	0	0	0	0	109.5
348	A	27.5	Very low	31.5	Very low	82 Å²	82	130.2 Å²	130.2	68%	0.678	73%	0.727	S	S	*	*			trans	-61.4	158.7	174.3	0	0	0	0	0	112.6
349	P	27.9	Very low	32	Very low	123 Å²	123	133.5 Å²	133.5	80%	0.799	75%	0.753	S	S	*	*			trans	-74.4	132.7	-175.8	30.1	-31.2	0	0	0	110.9	V351	P349-V351 PolarHBondContact O-N 3.49Å
350	K	37.5	Very low	32.3	Very low	211 Å²	211	139.5 Å²	139.5	92%	0.917	78%	0.781	S	S	*	*			trans	-84.5	105.7	169.1	-80.2	-175.7	176.7	178.7	0	109.7
351	V	32.3	Very low	33.2	Very low	126 Å²	126	144.5 Å²	144.5	76%	0.764	82%	0.817	S	S	*	*			trans	-65.8	125.3	162.8	175.3	0	0	0	0	108.7	P349	P349-V351 PolarHBondContact O-N 3.49Å
352	S	39.2	Very low	33.5	Very low	117 Å²	117	142.7 Å²	142.7	82%	0.818	82%	0.818	S	S	*	*			trans	-84.6	116.1	169.1	69.8	0	0	0	0	109.6
353	K	34.7	Very low	34	Very low	191 Å²	191	146.1 Å²	146.1	83%	0.83	83%	0.832	S	S	*	*			trans	-99	113.6	156.7	-80.9	-175.3	175.9	-178.4	0	106.6
354	R	37.5	Very low	34.5	Very low	248 Å²	248	145.5 Å²	145.5	94%	0.936	84%	0.836	S	S	*	*			trans	166	96.1	146	-93.7	166.3	-175.8	-167.5	2	111
355	S	40.1	Very low	35.1	Very low	120 Å²	120	147.6 Å²	147.6	84%	0.839	84%	0.843	S	S	*	*				-157.4	96.3	126.8	62.7	0	0	0	0	107.9
356	L	37.1	Very low	35.6	Very low	174 Å²	174	149.1 Å²	149.1	91%	0.911	85%	0.849	S	S	*	*			trans	-68.6	150.1	159.4	-93.2	119.2	0	0	0	108.8
357	A	40.5	Very low	36.3	Very low	81 Å²	81	148.5 Å²	148.5	67%	0.669	85%	0.852	S	S	*	*			trans	94.4	124.1	152.6	0	0	0	0	0	118.5
358	N	41.8	Very low	36.8	Very low	161 Å²	161	151.6 Å²	151.6	86%	0.861	86%	0.86	S	S	*	*			trans	84.2	118.2	157.7	-52.8	-16.4	0	0	0	114.9
359	S	39	Very low	37.5	Very low	109 Å²	109	156.9 Å²	156.9	76%	0.762	87%	0.874	S	S	*	*			cis	-151.4	145.1	25	55.5	0	0	0	0	112.6
360	M	35.7	Very low	38.3	Very low	194 Å²	194	159.8 Å²	159.8	96%	0.956	88%	0.88	S	S	*	*			trans	-74.8	121.6	161.7	-67.8	171	104.6	0	0	109.5
361	S	44.8	Very low	38.4	Very low	185 Å²	185	155.1 Å²	155.1	100%	1.294	88%	0.876	S	S	*	*			trans	-172.2	0	141.4	63.2	0	0	0	0	108.1

Retrieved 361 of 361 residues in 735.2 ms (Link to these results)

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