A0A077ZHY4_TRITR Loading...

Histone H3

AlphaFold DB , UniProt , Accession A0A077ZHY4, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 148 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	51.1	Low	62.4	Low	186 Å²	186	123.9 Å²	123.9	92%	0.916	60%	0.6	S	S	*	*				0	-45.4	0	-105.5	170.3	178.6	0	0	114.2	S3 C4 V74	M1-S3 VanDerWaalsContact C-N 3.25Å; M1-S3 PolarHBondContact O-N 3.2Å; M1-S3 VanDerWaalsContact O-N 3.12Å; M1-C4 PolarHBondContact O-N 3.17Å; M1-C4 VanDerWaalsContact O-N 3.13Å; M1-V74 HydrophobicContact CE-CG1 4.34Å
2	N	54.7	Low	62.5	Low	127 Å²	127	125.1 Å²	125.1	68%	0.679	60%	0.604	S	S	*	*	H	α-helix	trans	-57.4	-28.5	-176.5	-70.7	-33.5	0	0	0	115.9	K6	N2-K6 WeakPolarHBondContact O-CG 3.26Å; N2-K6 PolarHBondContact O-N 3.12Å
3	S	67.3	Low	62.9	Low	85 Å²	85	129.5 Å²	129.5	59%	0.594	62%	0.619	S	S	*	*	H	α-helix	trans	-64.7	-41.8	176.9	49.2	0	0	0	0	112.4	M1 K6 M7	M1-S3 VanDerWaalsContact C-N 3.25Å; M1-S3 PolarHBondContact O-N 3.2Å; M1-S3 VanDerWaalsContact O-N 3.12Å; S3-K6 PolarHBondContact O-N 3.1Å; S3-M7 WeakPolarHBondContact O-CG 3.5Å; S3-M7 PolarHBondContact O-N 3.44Å
4	C	62.1	Low	62.6	Low	87 Å²	87	128.8 Å²	128.8	59%	0.588	61%	0.607	S	S	*	*	H	α-helix	trans	-64.7	-46.6	-178.6	-172	0	0	0	0	111.4	M1 K6 M7 N8	M1-C4 PolarHBondContact O-N 3.17Å; M1-C4 VanDerWaalsContact O-N 3.13Å; C4-K6 VanDerWaalsContact C-N 3.31Å; C4-K6 PolarHBondContact O-N 3.39Å; C4-M7 WeakPolarHBondContact O-CB 3.41Å; C4-M7 PolarHBondContact O-N 3.05Å; C4-M7 VanDerWaalsContact O-N 3.11Å; C4-N8 PolarHBondContact O-N 3.02Å
5	L	65.3	Low	62.6	Low	109 Å²	109	128.2 Å²	128.2	57%	0.571	63%	0.632	S	S	*	*	H	α-helix	trans	-62.9	-36.5	176.8	-66	175.9	0	0	0	112.5	R9	L5-R9 WeakPolarHBondContact O-CB 3.39Å; L5-R9 WeakPolarHBondContact O-CG 3.48Å; L5-R9 PolarHBondContact O-N 3.11Å
6	K	67.6	Low	63.4	Low	161 Å²	161	125.1 Å²	125.1	70%	0.7	62%	0.616	S	S	*	*	H	α-helix	trans	-65.5	-38.8	173.9	-78.3	-178.4	-179.1	-179	0	112	N2 S3 C4 R10	N2-K6 WeakPolarHBondContact O-CG 3.26Å; N2-K6 PolarHBondContact O-N 3.12Å; S3-K6 PolarHBondContact O-N 3.1Å; C4-K6 VanDerWaalsContact C-N 3.31Å; C4-K6 PolarHBondContact O-N 3.39Å; K6-R10 WeakPolarHBondContact O-CB 3.36Å; K6-R10 PolarHBondContact O-N 3.31Å; K6-R10 VanDerWaalsContact O-N 3.1Å
7	M	57.7	Low	64.2	Low	101 Å²	101	120.5 Å²	120.5	50%	0.498	59%	0.594	S	S	.	*	H	α-helix	trans	-66.7	-47.5	176.4	-73.3	-174.7	65.6	0	0	111.2	S3 C4 R9 R10 Y11	S3-M7 WeakPolarHBondContact O-CG 3.5Å; S3-M7 PolarHBondContact O-N 3.44Å; C4-M7 WeakPolarHBondContact O-CB 3.41Å; C4-M7 PolarHBondContact O-N 3.05Å; C4-M7 VanDerWaalsContact O-N 3.11Å; M7-R9 PolarHBondContact O-N 3Å; M7-R10 WeakPolarHBondContact O-CA 3.41Å; M7-R10 WeakPolarHBondContact O-CB 3.43Å; M7-R10 PolarHBondContact O-N 2.92Å; M7-Y11 HydrophobicContact CB-CD2 4.38Å; M7-Y11 HydrophobicContact CB-CE2 4.1Å; M7-Y11 HydrophobicContact CE-CE2 3.73Å; M7-Y11 WeakPolarHBondContact O-CD2 3.5Å; M7-Y11 PolarHBondContact O-N 3.37Å
8	N	65.3	Low	65.2	Low	83 Å²	83	118.7 Å²	118.7	44%	0.444	59%	0.587	S	S	.	*	H	α-helix	trans	-58	-49.8	178.6	-169.8	-51.9	0	0	0	111.1	C4 R10 Y11 Q12	C4-N8 PolarHBondContact O-N 3.02Å; N8-R10 PolarHBondContact O-N 3.13Å; N8-Y11 PolarHBondContact O-N 3.14Å; N8-Q12 WeakPolarHBondContact O-CB 3.49Å; N8-Q12 WeakPolarHBondContact O-CG 3.39Å; N8-Q12 PolarHBondContact O-N 3.05Å; N8-Q12 WeakPolarHBondContact OD1-CG 3.24Å; N8-Q12 PolarHBondContact OD1-NE2 3.46Å; N8-Q12 VanDerWaalsContact OD1-NE2 3.14Å; N8-Q12 PolarHBondContact OD1-OE1 3.18Å
9	R	70	Confident	66	Low	179 Å²	179	115.8 Å²	115.8	68%	0.675	57%	0.572	S	S	*	*	H	α-helix	trans	-60.4	-28.6	174.8	-73	-179.4	-179.8	-169.4	0.1	114.1	L5 M7 K13	L5-R9 WeakPolarHBondContact O-CB 3.39Å; L5-R9 WeakPolarHBondContact O-CG 3.48Å; L5-R9 PolarHBondContact O-N 3.11Å; M7-R9 PolarHBondContact O-N 3Å; R9-K13 WeakPolarHBondContact O-CB 3.43Å; R9-K13 VanDerWaalsContact O-CG 3.26Å; R9-K13 WeakPolarHBondContact O-CG 3.3Å; R9-K13 PolarHBondContact O-N 3.36Å
10	R	63	Low	67	Low	141 Å²	141	120.6 Å²	120.6	53%	0.532	58%	0.583	S	S	.	*	H	α-helix	trans	-74.7	-43.5	177.8	-177.2	-179.2	173.5	173.1	-0.5	110.9	K6 M7 N8 K13 R14	K6-R10 WeakPolarHBondContact O-CB 3.36Å; K6-R10 PolarHBondContact O-N 3.31Å; K6-R10 VanDerWaalsContact O-N 3.1Å; M7-R10 WeakPolarHBondContact O-CA 3.41Å; M7-R10 WeakPolarHBondContact O-CB 3.43Å; M7-R10 PolarHBondContact O-N 2.92Å; N8-R10 PolarHBondContact O-N 3.13Å; R10-K13 PolarHBondContact O-N 3.41Å; R10-R14 WeakPolarHBondContact O-CG 3.44Å; R10-R14 PolarHBondContact O-N 3.17Å
11	Y	61.9	Low	67.8	Low	104 Å²	104	121.5 Å²	121.5	41%	0.408	58%	0.581	S	S	.	*	H	α-helix	trans	-70	-41.9	177.7	-67.5	-59.1	0	0	0	111.7	M7 N8 K13 R14 L18	M7-Y11 HydrophobicContact CB-CD2 4.38Å; M7-Y11 HydrophobicContact CB-CE2 4.1Å; M7-Y11 HydrophobicContact CE-CE2 3.73Å; M7-Y11 WeakPolarHBondContact O-CD2 3.5Å; M7-Y11 PolarHBondContact O-N 3.37Å; N8-Y11 PolarHBondContact O-N 3.14Å; Y11-K13 PolarHBondContact O-N 2.88Å; Y11-R14 CarbonylContact O-C 3.57Å; Y11-R14 PolarHBondContact O-N 2.96Å; Y11-L18 HydrophobicContact CD1-CD2 3.35Å; Y11-L18 HydrophobicContact CE1-CD2 3.95Å; Y11-L18 HydrophobicContact CG-CD2 3.88Å
12	Q	64.4	Low	69.6	Low	138 Å²	138	117.3 Å²	117.3	65%	0.645	56%	0.562	S	S	*	*	H	α-helix	trans	-60.8	-27.9	174.2	-72.5	-178.1	-24.2	0	0	113.5	N8	N8-Q12 WeakPolarHBondContact O-CB 3.49Å; N8-Q12 WeakPolarHBondContact O-CG 3.39Å; N8-Q12 PolarHBondContact O-N 3.05Å; N8-Q12 WeakPolarHBondContact OD1-CG 3.24Å; N8-Q12 PolarHBondContact OD1-NE2 3.46Å; N8-Q12 VanDerWaalsContact OD1-NE2 3.14Å; N8-Q12 PolarHBondContact OD1-OE1 3.18Å
13	K	67.9	Low	71.3	Confident	183 Å²	183	114.9 Å²	114.9	80%	0.796	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84	-8.2	177.4	-78.7	-177.1	177.3	-167.6	0	114.1	R9 R10 Y11	R9-K13 WeakPolarHBondContact O-CB 3.43Å; R9-K13 VanDerWaalsContact O-CG 3.26Å; R9-K13 WeakPolarHBondContact O-CG 3.3Å; R9-K13 PolarHBondContact O-N 3.36Å; R10-K13 PolarHBondContact O-N 3.41Å; Y11-K13 PolarHBondContact O-N 2.88Å
14	R	57.6	Low	72.2	Confident	119 Å²	119	111.6 Å²	111.6	45%	0.449	53%	0.528	S	S	.	.			trans	-129.8	120.7	-172.1	-68.2	-178.7	170.8	-143.4	-8	109.8	R10 Y11 E16	R10-R14 WeakPolarHBondContact O-CG 3.44Å; R10-R14 PolarHBondContact O-N 3.17Å; Y11-R14 CarbonylContact O-C 3.57Å; Y11-R14 PolarHBondContact O-N 2.96Å; R14-E16 HydrophobicContact CB-CB 4.43Å; R14-E16 HydrophobicContact CB-CG 3.86Å; R14-E16 VanDerWaalsContact CD-OE1 3.3Å; R14-E16 WeakPolarHBondContact CD-OE1 3.41Å; R14-E16 IonicContact NH1-OE1 3.17Å; R14-E16 IonicContact NH1-OE2 3.24Å; R14-E16 PolarHBondContact NH1-OE2 2.94Å; R14-E16 PolarHBondContact O-N 3.17Å
15	A	63.1	Low	73.3	Confident	120 Å²	120	110.5 Å²	110.5	99%	0.992	51%	0.514	S	S	*	.			trans	-76.8	39.5	168.9	0	0	0	0	0	111.8
16	E	75	Confident	74.4	Confident	78 Å²	78	113.2 Å²	113.2	36%	0.364	52%	0.517	S	S	.	.			trans	-87.9	139	176.3	66.9	-169.1	177.2	0	0	109.4	R14 L18	R14-E16 HydrophobicContact CB-CB 4.43Å; R14-E16 HydrophobicContact CB-CG 3.86Å; R14-E16 VanDerWaalsContact CD-OE1 3.3Å; R14-E16 WeakPolarHBondContact CD-OE1 3.41Å; R14-E16 IonicContact NH1-OE1 3.17Å; R14-E16 IonicContact NH1-OE2 3.24Å; R14-E16 PolarHBondContact NH1-OE2 2.94Å; R14-E16 PolarHBondContact O-N 3.17Å; E16-L18 PolarHBondContact O-N 3.2Å
17	L	77	Confident	75.1	Confident	47 Å²	47	109.6 Å²	109.6	25%	0.246	51%	0.505	C	S	.	.			trans	-55.6	123.9	176	-67.2	169.7	0	0	0	110.3	R21 L47 Q50 E51 E54	L17-R21 HydrophobicContact CD1-CG 4.22Å; L17-L47 HydrophobicContact CD1-CD1 3.66Å; L17-Q50 HydrophobicContact CD2-CG 4.15Å; L17-E51 HydrophobicContact CD2-CG 3.74Å; L17-E54 VanDerWaalsContact CA-OE2 3.23Å; L17-E54 WeakPolarHBondContact CA-OE2 3.42Å
18	L	82	Confident	76.1	Confident	89 Å²	89	105.6 Å²	105.6	47%	0.466	49%	0.486	S	S	.	.	S	Bend	trans	-76.4	-30.9	-177.9	-58.1	-179.3	0	0	0	111.4	Y11 E16 E54 V58	Y11-L18 HydrophobicContact CD1-CD2 3.35Å; Y11-L18 HydrophobicContact CE1-CD2 3.95Å; Y11-L18 HydrophobicContact CG-CD2 3.88Å; E16-L18 PolarHBondContact O-N 3.2Å; L18-E54 VanDerWaalsContact N-CD 3.33Å; L18-E54 PolarHBondContact N-OE1 3.45Å; L18-E54 PolarHBondContact N-OE2 3.47Å; L18-V58 HydrophobicContact CD1-CG2 4.04Å
19	M	81.2	Confident	76.9	Confident	63 Å²	63	106.5 Å²	106.5	31%	0.31	48%	0.483	S	S	.	.	S	Bend	trans	-94.7	146.8	178	-61.9	-168.3	-84.7	0	0	112	R21 F24 Q50 T53 E54 M57	M19-R21 PolarHBondContact O-N 3.49Å; M19-F24 HydrophobicContact CE-CD2 3.76Å; M19-F24 HydrophobicContact CE-CE2 3.92Å; M19-F24 HydrophobicContact SD-CD2 4.23Å; M19-Q50 PolarHBondContact O-NE2 3.35Å; M19-T53 HydrophobicContact CE-CG2 4.1Å; M19-E54 WeakPolarHBondContact CA-OE1 3.41Å; M19-E54 VanDerWaalsContact CB-OE1 3.26Å; M19-E54 WeakPolarHBondContact CB-OE1 3.46Å; M19-E54 HydrophobicContact CE-CG 3.39Å; M19-E54 HydrophobicContact CG-CG 4.28Å; M19-E54 PolarHBondContact N-OE1 3.3Å; M19-M57 HydrophobicContact CE-SD 4.18Å
20	R	86.2	Confident	77.6	Confident	211 Å²	211	104.3 Å²	104.3	80%	0.796	48%	0.481	S	S	*	.			trans	-71.4	130.7	171.5	-66	-171.5	-179.2	-151	1.8	109.3	L22 P23 F24	R20-L22 VanDerWaalsContact C-N 3.35Å; R20-L22 PolarHBondContact O-N 3.37Å; R20-P23 HydrophobicContact CB-CG 4.01Å; R20-P23 VanDerWaalsContact O-CD 3.31Å; R20-P23 WeakPolarHBondContact O-CD 3.44Å; R20-F24 PolarHBondContact O-N 3.3Å
21	R	84.2	Confident	78.2	Confident	140 Å²	140	101.9 Å²	101.9	53%	0.528	48%	0.477	S	S	.	.	H	α-helix	trans	-55.1	-42.9	-178	-63.1	-176	178.6	-131.5	-3.6	114	L17 M19 F24 Q25	L17-R21 HydrophobicContact CD1-CG 4.22Å; M19-R21 PolarHBondContact O-N 3.49Å; R21-F24 PolarHBondContact O-N 2.88Å; R21-Q25 WeakPolarHBondContact O-CB 3.07Å; R21-Q25 PolarHBondContact O-N 3.08Å
22	L	88.9	Confident	78.9	Confident	98 Å²	98	98 Å²	98	51%	0.513	47%	0.465	S	S	.	.	H	α-helix	trans	-68.3	-48.4	-174.2	179.9	66.3	0	0	0	113.5	R20 F24 Q25 R26	R20-L22 VanDerWaalsContact C-N 3.35Å; R20-L22 PolarHBondContact O-N 3.37Å; L22-F24 VanDerWaalsContact C-N 3.34Å; L22-F24 PolarHBondContact O-N 3.34Å; L22-Q25 PolarHBondContact O-N 2.93Å; L22-R26 WeakPolarHBondContact O-CG 3.43Å; L22-R26 PolarHBondContact O-N 3.35Å
23	P	88.8	Confident	79.5	Confident	77 Å²	77	97.4 Å²	97.4	50%	0.5	46%	0.462	S	S	.	.	H	α-helix	trans	-56	-44.4	169.7	-28.6	34.9	0	0	0	113.6	R20 Q25 R26 L27	R20-P23 HydrophobicContact CB-CG 4.01Å; R20-P23 VanDerWaalsContact O-CD 3.31Å; R20-P23 WeakPolarHBondContact O-CD 3.44Å; P23-Q25 PolarHBondContact O-N 2.93Å; P23-R26 PolarHBondContact O-N 3.07Å; P23-L27 PolarHBondContact O-N 3.11Å
24	F	86.4	Confident	79.7	Confident	15 Å²	15	93 Å²	93	7%	0.066	46%	0.459	C	S	.	.	H	α-helix	trans	-61.7	-45.6	178.3	-174	-94.9	0	0	0	111.7	M19 R20 R21 L22 R26 L27 V28 V46 L49 Q50 T53	M19-F24 HydrophobicContact CE-CD2 3.76Å; M19-F24 HydrophobicContact CE-CE2 3.92Å; M19-F24 HydrophobicContact SD-CD2 4.23Å; R20-F24 PolarHBondContact O-N 3.3Å; R21-F24 PolarHBondContact O-N 2.88Å; L22-F24 VanDerWaalsContact C-N 3.34Å; L22-F24 PolarHBondContact O-N 3.34Å; F24-R26 VanDerWaalsContact C-N 3.3Å; F24-R26 PolarHBondContact O-N 3.43Å; F24-L27 WeakPolarHBondContact O-CB 3.43Å; F24-L27 PolarHBondContact O-N 2.92Å; F24-L27 VanDerWaalsContact O-N 3.16Å; F24-V28 HydrophobicContact CD1-CG2 3.97Å; F24-V28 HydrophobicContact CE1-CG2 3.55Å; F24-V28 HydrophobicContact CZ-CG2 3.96Å; F24-V28 WeakPolarHBondContact O-CG2 3.47Å; F24-V28 PolarHBondContact O-N 3.39Å; F24-V46 HydrophobicContact CD1-CG1 4.23Å; F24-V46 HydrophobicContact CE1-CG1 4.49Å; F24-L49 HydrophobicContact CE1-CB 4.14Å; F24-L49 HydrophobicContact CZ-CB 4.37Å; F24-Q50 HydrophobicContact CB-CG 4.47Å; F24-Q50 HydrophobicContact CD1-CB 3.63Å; F24-Q50 HydrophobicContact CD1-CG 3.82Å; F24-Q50 HydrophobicContact CD2-CG 4.17Å; F24-Q50 VanDerWaalsContact CE1-CA 3.42Å; F24-Q50 HydrophobicContact CE1-CB 3.53Å; F24-Q50 HydrophobicContact CE1-CG 4.07Å; F24-Q50 HydrophobicContact CE2-CG 4.41Å; F24-Q50 HydrophobicContact CG-CB 4.22Å; F24-Q50 HydrophobicContact CG-CG 3.88Å; F24-Q50 VanDerWaalsContact CZ-CA 3.48Å; F24-Q50 HydrophobicContact CZ-CB 4.04Å; F24-Q50 HydrophobicContact CZ-CG 4.37Å; F24-T53 HydrophobicContact CE2-CG2 4Å
25	Q	85.1	Confident	80.2	Confident	64 Å²	64	95.3 Å²	95.3	30%	0.299	47%	0.473	S	S	.	.	H	α-helix	trans	-60.5	-38.4	175.9	-174	-178	0.9	0	0	112.4	R21 L22 P23 R29 V46	R21-Q25 WeakPolarHBondContact O-CB 3.07Å; R21-Q25 PolarHBondContact O-N 3.08Å; L22-Q25 PolarHBondContact O-N 2.93Å; P23-Q25 PolarHBondContact O-N 2.93Å; Q25-R29 WeakPolarHBondContact O-CG 3.44Å; Q25-R29 PolarHBondContact O-N 3.07Å; Q25-V46 HydrophobicContact CB-CG1 4.12Å; Q25-V46 HydrophobicContact CG-CG1 4.21Å
26	R	88.3	Confident	80.4	Confident	167 Å²	167	95.7 Å²	95.7	63%	0.63	45%	0.452	S	S	*	.	H	α-helix	trans	-64.6	-43.1	175.4	-73.2	175.8	179.5	-174	-1.2	111.4	L22 P23 F24 R29 E30	L22-R26 WeakPolarHBondContact O-CG 3.43Å; L22-R26 PolarHBondContact O-N 3.35Å; P23-R26 PolarHBondContact O-N 3.07Å; F24-R26 VanDerWaalsContact C-N 3.3Å; F24-R26 PolarHBondContact O-N 3.43Å; R26-R29 WeakPolarHBondContact O-CB 3.47Å; R26-R29 PolarHBondContact O-N 3.23Å; R26-E30 WeakPolarHBondContact O-CB 3.35Å; R26-E30 PolarHBondContact O-N 3.36Å
27	L	82.9	Confident	80	Confident	84 Å²	84	96.1 Å²	96.1	44%	0.44	47%	0.469	S	S	.	.	H	α-helix	trans	-61.5	-46.2	176.4	-180	65.1	0	0	0	111.7	P23 F24 R29 E30 I31	P23-L27 PolarHBondContact O-N 3.11Å; F24-L27 WeakPolarHBondContact O-CB 3.43Å; F24-L27 PolarHBondContact O-N 2.92Å; F24-L27 VanDerWaalsContact O-N 3.16Å; L27-R29 VanDerWaalsContact C-N 3.27Å; L27-R29 PolarHBondContact O-N 3.08Å; L27-E30 PolarHBondContact O-N 2.97Å; L27-I31 HydrophobicContact CD1-CD1 3.96Å; L27-I31 HydrophobicContact CD1-CG1 4.23Å; L27-I31 HydrophobicContact CG-CD1 3.85Å; L27-I31 HydrophobicContact CG-CG1 4.48Å; L27-I31 WeakPolarHBondContact O-CG1 3.47Å; L27-I31 PolarHBondContact O-N 2.85Å
28	V	79.1	Confident	79.6	Confident	18 Å²	18	99.1 Å²	99.1	11%	0.109	49%	0.489	C	S	.	.	H	α-helix	trans	-57.8	-42.2	175.2	173.1	0	0	0	0	110.7	F24 T32 F41 L49	F24-V28 HydrophobicContact CD1-CG2 3.97Å; F24-V28 HydrophobicContact CE1-CG2 3.55Å; F24-V28 HydrophobicContact CZ-CG2 3.96Å; F24-V28 WeakPolarHBondContact O-CG2 3.47Å; F24-V28 PolarHBondContact O-N 3.39Å; V28-T32 HydrophobicContact CG1-CG2 4.32Å; V28-T32 VanDerWaalsContact O-CB 3.31Å; V28-T32 WeakPolarHBondContact O-CB 3.43Å; V28-T32 WeakPolarHBondContact O-CG2 3.46Å; V28-T32 PolarHBondContact O-N 3.28Å; V28-T32 PolarHBondContact O-OG1 3.2Å; V28-F41 HydrophobicContact CG1-CD2 4.29Å; V28-F41 HydrophobicContact CG1-CE2 4.11Å; V28-F41 HydrophobicContact CG1-CZ 4.32Å; V28-L49 HydrophobicContact CG1-CD1 4.34Å
29	R	82.9	Confident	79.2	Confident	101 Å²	101	97 Å²	97	38%	0.381	48%	0.478	S	S	.	.	H	α-helix	trans	-65	-43.5	176	-73.1	-178.5	-177.7	-70.3	3.3	112.8	Q25 R26 L27 T32 Q33	Q25-R29 WeakPolarHBondContact O-CG 3.44Å; Q25-R29 PolarHBondContact O-N 3.07Å; R26-R29 WeakPolarHBondContact O-CB 3.47Å; R26-R29 PolarHBondContact O-N 3.23Å; L27-R29 VanDerWaalsContact C-N 3.27Å; L27-R29 PolarHBondContact O-N 3.08Å; R29-T32 WeakPolarHBondContact CA-OG1 3.46Å; R29-T32 PolarHBondContact O-N 2.88Å; R29-T32 PolarHBondContact O-OG1 3.23Å; R29-T32 VanDerWaalsContact O-OG1 3.11Å; R29-Q33 WeakPolarHBondContact O-CB 3.13Å; R29-Q33 WeakPolarHBondContact O-CG 3.4Å; R29-Q33 PolarHBondContact O-N 3.49Å
30	E	83.3	Confident	78.9	Confident	134 Å²	134	105 Å²	105	63%	0.626	51%	0.505	S	S	*	.	H	α-helix	trans	-62.1	-46.6	178.5	-175.9	179.2	168.8	0	0	111.6	R26 L27	R26-E30 WeakPolarHBondContact O-CB 3.35Å; R26-E30 PolarHBondContact O-N 3.36Å; L27-E30 PolarHBondContact O-N 2.97Å
31	I	76.7	Confident	78.5	Confident	89 Å²	89	97.7 Å²	97.7	46%	0.456	48%	0.479	S	S	.	.	H	α-helix	trans	-62.4	-47.3	177.5	-67	169.6	0	0	0	110.2	L27 Q33 A34 F35	L27-I31 HydrophobicContact CD1-CD1 3.96Å; L27-I31 HydrophobicContact CD1-CG1 4.23Å; L27-I31 HydrophobicContact CG-CD1 3.85Å; L27-I31 HydrophobicContact CG-CG1 4.48Å; L27-I31 WeakPolarHBondContact O-CG1 3.47Å; L27-I31 PolarHBondContact O-N 2.85Å; I31-Q33 PolarHBondContact O-N 3.09Å; I31-A34 WeakPolarHBondContact O-CB 3.46Å; I31-A34 PolarHBondContact O-N 3.41Å; I31-F35 HydrophobicContact CG2-CD2 4.5Å; I31-F35 HydrophobicContact CG2-CE2 3.85Å; I31-F35 WeakPolarHBondContact O-CD2 3.34Å; I31-F35 WeakPolarHBondContact O-CE2 3.45Å
32	T	76.8	Confident	78.3	Confident	23 Å²	23	97.5 Å²	97.5	14%	0.141	48%	0.484	C	S	.	.	H	α-helix	trans	-71.2	-28.6	-175	53.5	0	0	0	0	113.4	V28 R29 A34 F35 K36 F41	V28-T32 HydrophobicContact CG1-CG2 4.32Å; V28-T32 VanDerWaalsContact O-CB 3.31Å; V28-T32 WeakPolarHBondContact O-CB 3.43Å; V28-T32 WeakPolarHBondContact O-CG2 3.46Å; V28-T32 PolarHBondContact O-N 3.28Å; V28-T32 PolarHBondContact O-OG1 3.2Å; R29-T32 WeakPolarHBondContact CA-OG1 3.46Å; R29-T32 PolarHBondContact O-N 2.88Å; R29-T32 PolarHBondContact O-OG1 3.23Å; R29-T32 VanDerWaalsContact O-OG1 3.11Å; T32-A34 PolarHBondContact O-N 3.38Å; T32-F35 PolarHBondContact O-N 3.3Å; T32-K36 PolarHBondContact O-N 3.46Å; T32-F41 HydrophobicContact CG2-CE2 3.59Å; T32-F41 HydrophobicContact CG2-CZ 3.39Å
33	Q	76.3	Confident	77.9	Confident	126 Å²	126	98.5 Å²	98.5	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-60.7	-29.8	172.6	-81.7	171.5	-3.8	0	0	112.9	R29 I31 F35	R29-Q33 WeakPolarHBondContact O-CB 3.13Å; R29-Q33 WeakPolarHBondContact O-CG 3.4Å; R29-Q33 PolarHBondContact O-N 3.49Å; I31-Q33 PolarHBondContact O-N 3.09Å; Q33-F35 VanDerWaalsContact C-N 3.25Å; Q33-F35 PolarHBondContact O-N 2.93Å
34	A	71.8	Confident	77.5	Confident	89 Å²	89	98.3 Å²	98.3	74%	0.736	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-23.4	174.9	0	0	0	0	0	113.1	I31 T32	I31-A34 WeakPolarHBondContact O-CB 3.46Å; I31-A34 PolarHBondContact O-N 3.41Å; T32-A34 PolarHBondContact O-N 3.38Å
35	F	68.2	Low	77.1	Confident	168 Å²	168	100 Å²	100	74%	0.737	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	-95.8	-42.3	179.3	-61.8	-84.9	0	0	0	112.5	I31 T32 Q33	I31-F35 HydrophobicContact CG2-CD2 4.5Å; I31-F35 HydrophobicContact CG2-CE2 3.85Å; I31-F35 WeakPolarHBondContact O-CD2 3.34Å; I31-F35 WeakPolarHBondContact O-CE2 3.45Å; T32-F35 PolarHBondContact O-N 3.3Å; Q33-F35 VanDerWaalsContact C-N 3.25Å; Q33-F35 PolarHBondContact O-N 2.93Å
36	K	67.5	Low	76.7	Confident	128 Å²	128	97.7 Å²	97.7	56%	0.557	49%	0.494	S	S	*	.			trans	-153.2	128.2	178.5	-174.9	168.2	-178.4	170.2	0	110.7	T32 V38 L39	T32-K36 PolarHBondContact O-N 3.46Å; K36-V38 PolarHBondContact O-N 3.44Å; K36-V38 VanDerWaalsContact O-N 3.11Å; K36-L39 HydrophobicContact CB-CD1 3.81Å; K36-L39 HydrophobicContact CB-CG 3.95Å; K36-L39 HydrophobicContact CD-CD2 4.28Å; K36-L39 HydrophobicContact CD-CG 4.25Å; K36-L39 HydrophobicContact CG-CG 4.25Å
37	A	67.2	Low	76.4	Confident	87 Å²	87	91.8 Å²	91.8	72%	0.719	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.9	-26.1	-171.3	0	0	0	0	0	114.8
38	V	68.7	Low	76.2	Confident	110 Å²	110	89.8 Å²	89.8	67%	0.667	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	-134.1	68.6	-175.4	-165.8	0	0	0	0	111.4	K36	K36-V38 PolarHBondContact O-N 3.44Å; K36-V38 VanDerWaalsContact O-N 3.11Å
39	L	71.9	Confident	76.2	Confident	45 Å²	45	91.4 Å²	91.4	24%	0.236	47%	0.474	C	S	.	.			trans	-93.3	126.1	166.5	-78.6	163.4	0	0	0	110.5	K36 F41 M116	K36-L39 HydrophobicContact CB-CD1 3.81Å; K36-L39 HydrophobicContact CB-CG 3.95Å; K36-L39 HydrophobicContact CD-CD2 4.28Å; K36-L39 HydrophobicContact CD-CG 4.25Å; K36-L39 HydrophobicContact CG-CG 4.25Å; L39-F41 HydrophobicContact CB-CE2 4.06Å; L39-F41 HydrophobicContact CB-CZ 4.39Å; L39-M116 HydrophobicContact CD2-SD 4.07Å
40	R	76.9	Confident	76.1	Confident	231 Å²	231	86.7 Å²	86.7	87%	0.872	46%	0.456	S	S	*	.			trans	-105.3	115.8	174	-68.5	-175	178.9	-178.2	1.2	109.2
41	F	76.3	Confident	75.9	Confident	58 Å²	58	84.8 Å²	84.8	25%	0.254	45%	0.447	S	S	.	.			trans	-89.5	138.9	172.4	-65.8	-82.9	0	0	0	110.8	V28 T32 L39 T45 V46	V28-F41 HydrophobicContact CG1-CD2 4.29Å; V28-F41 HydrophobicContact CG1-CE2 4.11Å; V28-F41 HydrophobicContact CG1-CZ 4.32Å; T32-F41 HydrophobicContact CG2-CE2 3.59Å; T32-F41 HydrophobicContact CG2-CZ 3.39Å; L39-F41 HydrophobicContact CB-CE2 4.06Å; L39-F41 HydrophobicContact CB-CZ 4.39Å; F41-T45 HydrophobicContact CD1-CG2 4.18Å; F41-V46 HydrophobicContact CB-CG2 3.64Å; F41-V46 HydrophobicContact CG-CG2 4.33Å
42	Q	81.2	Confident	76	Confident	136 Å²	136	83.3 Å²	83.3	64%	0.636	45%	0.448	S	S	*	.			trans	-70.3	149	164.5	-57.3	-175.8	1.6	0	0	109.4	P44 T45 V46	Q42-P44 HydrophobicContact CB-CG 4.16Å; Q42-T45 WeakPolarHBondContact O-CB 3.46Å; Q42-T45 PolarHBondContact O-N 2.94Å; Q42-T45 VanDerWaalsContact O-N 3.16Å; Q42-V46 PolarHBondContact O-N 2.96Å
43	V	79.6	Confident	76.1	Confident	118 Å²	118	84.6 Å²	84.6	72%	0.715	46%	0.456	S	S	*	.	H	α-helix	trans	-54	-47.7	177.2	178.3	0	0	0	0	113.1	T45 V46 L47	V43-T45 VanDerWaalsContact C-N 3.29Å; V43-T45 PolarHBondContact O-N 2.75Å; V43-V46 PolarHBondContact O-N 3.13Å; V43-L47 PolarHBondContact O-N 3.49Å
44	P	80.4	Confident	76.4	Confident	74 Å²	74	79.5 Å²	79.5	48%	0.481	43%	0.432	S	S	.	.	H	α-helix	trans	-62.5	-33.7	177.5	23.2	-34.9	0	0	0	113.1	Q42 V46 L47 V48	Q42-P44 HydrophobicContact CB-CG 4.16Å; P44-V46 VanDerWaalsContact C-N 3.35Å; P44-V46 PolarHBondContact O-N 3.02Å; P44-L47 WeakPolarHBondContact O-CB 2.98Å; P44-L47 PolarHBondContact O-N 2.89Å; P44-L47 VanDerWaalsContact O-N 3.15Å; P44-V48 WeakPolarHBondContact O-CG2 3.24Å; P44-V48 PolarHBondContact O-N 2.65Å
45	T	77.8	Confident	76.7	Confident	51 Å²	51	78 Å²	78	31%	0.313	42%	0.42	S	S	.	.	H	α-helix	trans	-61.9	-43.1	177.3	-47.8	0	0	0	0	111.7	F41 Q42 V43 L47 V48 L49	F41-T45 HydrophobicContact CD1-CG2 4.18Å; Q42-T45 WeakPolarHBondContact O-CB 3.46Å; Q42-T45 PolarHBondContact O-N 2.94Å; Q42-T45 VanDerWaalsContact O-N 3.16Å; V43-T45 VanDerWaalsContact C-N 3.29Å; V43-T45 PolarHBondContact O-N 2.75Å; T45-L47 VanDerWaalsContact C-N 3.26Å; T45-L47 PolarHBondContact O-N 2.94Å; T45-V48 PolarHBondContact O-N 2.83Å; T45-L49 HydrophobicContact CG2-CD1 4.45Å; T45-L49 VanDerWaalsContact O-CG 3.31Å; T45-L49 WeakPolarHBondContact O-CG 3.43Å; T45-L49 PolarHBondContact O-N 2.81Å
46	V	77.9	Confident	77.1	Confident	14 Å²	14	76 Å²	76	9%	0.085	41%	0.408	C	S	.	.	H	α-helix	trans	-65.3	-34.1	177.5	-177.7	0	0	0	0	111.2	F24 Q25 F41 Q42 V43 P44 Q50	F24-V46 HydrophobicContact CD1-CG1 4.23Å; F24-V46 HydrophobicContact CE1-CG1 4.49Å; Q25-V46 HydrophobicContact CB-CG1 4.12Å; Q25-V46 HydrophobicContact CG-CG1 4.21Å; F41-V46 HydrophobicContact CB-CG2 3.64Å; F41-V46 HydrophobicContact CG-CG2 4.33Å; Q42-V46 PolarHBondContact O-N 2.96Å; V43-V46 PolarHBondContact O-N 3.13Å; P44-V46 VanDerWaalsContact C-N 3.35Å; P44-V46 PolarHBondContact O-N 3.02Å; V46-Q50 WeakPolarHBondContact O-CB 3.26Å; V46-Q50 PolarHBondContact O-N 3.47Å
47	L	80.3	Confident	77.8	Confident	44 Å²	44	73.4 Å²	73.4	23%	0.23	40%	0.399	C	S	.	.	H	α-helix	trans	-65.6	-49.1	176.4	177.9	60.4	0	0	0	111.6	L17 V43 P44 T45 L49 Q50 E51	L17-L47 HydrophobicContact CD1-CD1 3.66Å; V43-L47 PolarHBondContact O-N 3.49Å; P44-L47 WeakPolarHBondContact O-CB 2.98Å; P44-L47 PolarHBondContact O-N 2.89Å; P44-L47 VanDerWaalsContact O-N 3.15Å; T45-L47 VanDerWaalsContact C-N 3.26Å; T45-L47 PolarHBondContact O-N 2.94Å; L47-L49 VanDerWaalsContact C-N 3.3Å; L47-L49 PolarHBondContact O-N 3.14Å; L47-Q50 WeakPolarHBondContact O-CA 3.5Å; L47-Q50 WeakPolarHBondContact O-CB 3.23Å; L47-Q50 PolarHBondContact O-N 2.75Å; L47-E51 HydrophobicContact CD1-CG 4.3Å; L47-E51 WeakPolarHBondContact O-CG 3.49Å; L47-E51 PolarHBondContact O-N 2.85Å
48	V	78.6	Confident	78.4	Confident	41 Å²	41	72.2 Å²	72.2	25%	0.248	38%	0.383	C	S	.	.	H	α-helix	trans	-60	-43.1	177.6	172.9	0	0	0	0	110.8	P44 T45 Q50 E51 A52	P44-V48 WeakPolarHBondContact O-CG2 3.24Å; P44-V48 PolarHBondContact O-N 2.65Å; T45-V48 PolarHBondContact O-N 2.83Å; V48-Q50 VanDerWaalsContact C-N 3.26Å; V48-Q50 PolarHBondContact O-N 3.29Å; V48-E51 PolarHBondContact O-N 3.09Å; V48-A52 WeakPolarHBondContact O-CB 3.37Å; V48-A52 PolarHBondContact O-N 3.37Å
49	L	79.1	Confident	79	Confident	52 Å²	52	68 Å²	68	27%	0.272	36%	0.362	S	S	.	.	H	α-helix	trans	-59.8	-39.1	174.3	-71.7	173.9	0	0	0	111.8	F24 V28 T45 L47 T53	F24-L49 HydrophobicContact CE1-CB 4.14Å; F24-L49 HydrophobicContact CZ-CB 4.37Å; V28-L49 HydrophobicContact CG1-CD1 4.34Å; T45-L49 HydrophobicContact CG2-CD1 4.45Å; T45-L49 VanDerWaalsContact O-CG 3.31Å; T45-L49 WeakPolarHBondContact O-CG 3.43Å; T45-L49 PolarHBondContact O-N 2.81Å; L47-L49 VanDerWaalsContact C-N 3.3Å; L47-L49 PolarHBondContact O-N 3.14Å; L49-T53 VanDerWaalsContact O-CB 3.29Å; L49-T53 WeakPolarHBondContact O-CB 3.45Å; L49-T53 PolarHBondContact O-N 3.06Å; L49-T53 PolarHBondContact O-OG1 3.46Å
50	Q	81.1	Confident	79.3	Confident	2 Å²	2	66.7 Å²	66.7	1%	0.009	36%	0.355	C	S	.	.	H	α-helix	trans	-66.8	-47	177.9	-168.3	179.6	-26.2	0	0	111.3	L17 M19 F24 V46 L47 V48 T53 E54	L17-Q50 HydrophobicContact CD2-CG 4.15Å; M19-Q50 PolarHBondContact O-NE2 3.35Å; F24-Q50 HydrophobicContact CB-CG 4.47Å; F24-Q50 HydrophobicContact CD1-CB 3.63Å; F24-Q50 HydrophobicContact CD1-CG 3.82Å; F24-Q50 HydrophobicContact CD2-CG 4.17Å; F24-Q50 VanDerWaalsContact CE1-CA 3.42Å; F24-Q50 HydrophobicContact CE1-CB 3.53Å; F24-Q50 HydrophobicContact CE1-CG 4.07Å; F24-Q50 HydrophobicContact CE2-CG 4.41Å; F24-Q50 HydrophobicContact CG-CB 4.22Å; F24-Q50 HydrophobicContact CG-CG 3.88Å; F24-Q50 VanDerWaalsContact CZ-CA 3.48Å; F24-Q50 HydrophobicContact CZ-CB 4.04Å; F24-Q50 HydrophobicContact CZ-CG 4.37Å; V46-Q50 WeakPolarHBondContact O-CB 3.26Å; V46-Q50 PolarHBondContact O-N 3.47Å; L47-Q50 WeakPolarHBondContact O-CA 3.5Å; L47-Q50 WeakPolarHBondContact O-CB 3.23Å; L47-Q50 PolarHBondContact O-N 2.75Å; V48-Q50 VanDerWaalsContact C-N 3.26Å; V48-Q50 PolarHBondContact O-N 3.29Å; Q50-T53 PolarHBondContact O-N 2.99Å; Q50-E54 HydrophobicContact CG-CG 4.47Å; Q50-E54 PolarHBondContact NE2-OE1 2.88Å; Q50-E54 WeakPolarHBondContact O-CB 3.32Å; Q50-E54 WeakPolarHBondContact O-CG 3.41Å; Q50-E54 PolarHBondContact O-N 2.89Å
51	E	80.3	Confident	79.5	Confident	95 Å²	95	60 Å²	60	44%	0.444	33%	0.332	S	S	.	.	H	α-helix	trans	-59.9	-48.3	178.5	-71.7	172.6	175.5	0	0	111.3	L17 L47 V48 T53 E54 A55	L17-E51 HydrophobicContact CD2-CG 3.74Å; L47-E51 HydrophobicContact CD1-CG 4.3Å; L47-E51 WeakPolarHBondContact O-CG 3.49Å; L47-E51 PolarHBondContact O-N 2.85Å; V48-E51 PolarHBondContact O-N 3.09Å; E51-T53 PolarHBondContact O-N 3.23Å; E51-E54 PolarHBondContact O-N 3.41Å; E51-A55 WeakPolarHBondContact O-CB 3.26Å; E51-A55 PolarHBondContact O-N 3.24Å
52	A	78.3	Confident	80	Confident	57 Å²	57	62.1 Å²	62.1	47%	0.471	34%	0.343	S	S	.	.	H	α-helix	trans	-61.3	-43	176.5	0	0	0	0	0	112.3	V48 Y56	V48-A52 WeakPolarHBondContact O-CB 3.37Å; V48-A52 PolarHBondContact O-N 3.37Å; A52-Y56 WeakPolarHBondContact O-CB 3.49Å; A52-Y56 PolarHBondContact O-N 2.96Å
53	T	79.5	Confident	80.1	Confident	51 Å²	51	57.5 Å²	57.5	31%	0.313	32%	0.323	S	S	.	.	H	α-helix	trans	-65.3	-42.5	178.9	-55.8	0	0	0	0	111.5	M19 F24 L49 Q50 E51 Y56 M57	M19-T53 HydrophobicContact CE-CG2 4.1Å; F24-T53 HydrophobicContact CE2-CG2 4Å; L49-T53 VanDerWaalsContact O-CB 3.29Å; L49-T53 WeakPolarHBondContact O-CB 3.45Å; L49-T53 PolarHBondContact O-N 3.06Å; L49-T53 PolarHBondContact O-OG1 3.46Å; Q50-T53 PolarHBondContact O-N 2.99Å; E51-T53 PolarHBondContact O-N 3.23Å; T53-Y56 PolarHBondContact O-N 2.97Å; T53-M57 HydrophobicContact CG2-CG 4.44Å; T53-M57 HydrophobicContact CG2-SD 4.12Å; T53-M57 WeakPolarHBondContact O-CB 3.44Å; T53-M57 VanDerWaalsContact O-CG 3.26Å; T53-M57 WeakPolarHBondContact O-CG 3.03Å; T53-M57 PolarHBondContact O-N 3.37Å
54	E	81.1	Confident	80.2	Confident	18 Å²	18	51.9 Å²	51.9	8%	0.084	29%	0.289	C	S	.	.	H	α-helix	trans	-66.1	-43.8	179.1	-75.1	-176.8	-166.2	0	0	111.8	L17 L18 M19 Q50 E51 Y56 M57 V58	L17-E54 VanDerWaalsContact CA-OE2 3.23Å; L17-E54 WeakPolarHBondContact CA-OE2 3.42Å; L18-E54 VanDerWaalsContact N-CD 3.33Å; L18-E54 PolarHBondContact N-OE1 3.45Å; L18-E54 PolarHBondContact N-OE2 3.47Å; M19-E54 WeakPolarHBondContact CA-OE1 3.41Å; M19-E54 VanDerWaalsContact CB-OE1 3.26Å; M19-E54 WeakPolarHBondContact CB-OE1 3.46Å; M19-E54 HydrophobicContact CE-CG 3.39Å; M19-E54 HydrophobicContact CG-CG 4.28Å; M19-E54 PolarHBondContact N-OE1 3.3Å; Q50-E54 HydrophobicContact CG-CG 4.47Å; Q50-E54 PolarHBondContact NE2-OE1 2.88Å; Q50-E54 WeakPolarHBondContact O-CB 3.32Å; Q50-E54 WeakPolarHBondContact O-CG 3.41Å; Q50-E54 PolarHBondContact O-N 2.89Å; E51-E54 PolarHBondContact O-N 3.41Å; E54-Y56 VanDerWaalsContact C-N 3.34Å; E54-Y56 PolarHBondContact O-N 2.9Å; E54-M57 PolarHBondContact O-N 2.97Å; E54-V58 WeakPolarHBondContact O-CG2 3.5Å; E54-V58 PolarHBondContact O-N 3.35Å
55	A	78.2	Confident	80.5	Confident	57 Å²	57	51.6 Å²	51.6	47%	0.471	28%	0.283	S	S	.	.	H	α-helix	trans	-58.2	-47.5	175.6	0	0	0	0	0	111.4	E51 M57 V58 G59	E51-A55 WeakPolarHBondContact O-CB 3.26Å; E51-A55 PolarHBondContact O-N 3.24Å; A55-M57 VanDerWaalsContact C-N 3.34Å; A55-M57 PolarHBondContact O-N 3.04Å; A55-V58 PolarHBondContact O-N 2.9Å; A55-G59 PolarHBondContact O-N 3.5Å; A55-G59 VanDerWaalsContact O-N 3.09Å
56	Y	78.2	Confident	81	Confident	128 Å²	128	54.3 Å²	54.3	50%	0.502	30%	0.295	S	S	.	.	H	α-helix	trans	-59.2	-43.9	176.1	174.6	-99.3	0	0	0	112.4	A52 T53 E54 V58 G59 L60 L88	A52-Y56 WeakPolarHBondContact O-CB 3.49Å; A52-Y56 PolarHBondContact O-N 2.96Å; T53-Y56 PolarHBondContact O-N 2.97Å; E54-Y56 VanDerWaalsContact C-N 3.34Å; E54-Y56 PolarHBondContact O-N 2.9Å; Y56-V58 PolarHBondContact O-N 2.97Å; Y56-G59 PolarHBondContact O-N 3.1Å; Y56-L60 HydrophobicContact CE1-CD2 4.2Å; Y56-L60 WeakPolarHBondContact O-CB 3.44Å; Y56-L60 PolarHBondContact O-N 3.01Å; Y56-L88 HydrophobicContact CE2-CD1 4.27Å
57	M	80.4	Confident	81.4	Confident	72 Å²	72	54.9 Å²	54.9	36%	0.355	30%	0.3	S	S	.	.	H	α-helix	trans	-65.4	-38.3	178.6	-73.1	-178.5	73.9	0	0	112.2	M19 T53 E54 A55 F61	M19-M57 HydrophobicContact CE-SD 4.18Å; T53-M57 HydrophobicContact CG2-CG 4.44Å; T53-M57 HydrophobicContact CG2-SD 4.12Å; T53-M57 WeakPolarHBondContact O-CB 3.44Å; T53-M57 VanDerWaalsContact O-CG 3.26Å; T53-M57 WeakPolarHBondContact O-CG 3.03Å; T53-M57 PolarHBondContact O-N 3.37Å; E54-M57 PolarHBondContact O-N 2.97Å; A55-M57 VanDerWaalsContact C-N 3.34Å; A55-M57 PolarHBondContact O-N 3.04Å; M57-F61 HydrophobicContact CB-CD2 4.49Å; M57-F61 HydrophobicContact CB-CE2 4.39Å; M57-F61 HydrophobicContact CE-CE2 3.98Å; M57-F61 WeakPolarHBondContact O-CB 3.36Å; M57-F61 WeakPolarHBondContact O-CD2 3.33Å; M57-F61 WeakPolarHBondContact O-CG 3.45Å; M57-F61 PolarHBondContact O-N 3.31Å
58	V	80	Confident	81.7	Confident	62 Å²	62	52.8 Å²	52.8	38%	0.376	29%	0.289	S	S	.	.	H	α-helix	trans	-62.2	-52.2	176.7	171.2	0	0	0	0	110.4	L18 E54 A55 Y56 L60 F61 E62	L18-V58 HydrophobicContact CD1-CG2 4.04Å; E54-V58 WeakPolarHBondContact O-CG2 3.5Å; E54-V58 PolarHBondContact O-N 3.35Å; A55-V58 PolarHBondContact O-N 2.9Å; Y56-V58 PolarHBondContact O-N 2.97Å; V58-L60 PolarHBondContact O-N 3.42Å; V58-F61 PolarHBondContact O-N 3.21Å; V58-F61 VanDerWaalsContact O-N 3.13Å; V58-E62 WeakPolarHBondContact O-CG 3.37Å; V58-E62 PolarHBondContact O-N 3.08Å
59	G	81.4	Confident	82.2	Confident	23 Å²	23	55.6 Å²	55.6	24%	0.237	30%	0.301	C	S	.	.	H	α-helix	trans	-58.6	-46.9	178.2	0	0	0	0	0	112.4	A55 Y56 F61 E62 D63	A55-G59 PolarHBondContact O-N 3.5Å; A55-G59 VanDerWaalsContact O-N 3.09Å; Y56-G59 PolarHBondContact O-N 3.1Å; G59-F61 VanDerWaalsContact C-N 3.27Å; G59-F61 PolarHBondContact O-N 3.42Å; G59-E62 WeakPolarHBondContact O-CB 3.44Å; G59-E62 PolarHBondContact O-N 3.41Å; G59-E62 VanDerWaalsContact O-N 3.07Å; G59-D63 PolarHBondContact O-N 3.39Å; G59-D63 VanDerWaalsContact O-N 3.08Å
60	L	78.6	Confident	82.7	Confident	17 Å²	17	61.2 Å²	61.2	9%	0.089	33%	0.326	C	S	.	.	H	α-helix	trans	-57.2	-39.6	176.3	-179.7	66.5	0	0	0	112.6	Y56 V58 T64 I81 A84 K85 L88	Y56-L60 HydrophobicContact CE1-CD2 4.2Å; Y56-L60 WeakPolarHBondContact O-CB 3.44Å; Y56-L60 PolarHBondContact O-N 3.01Å; V58-L60 PolarHBondContact O-N 3.42Å; L60-T64 VanDerWaalsContact O-CB 3.24Å; L60-T64 WeakPolarHBondContact O-CB 3.32Å; L60-T64 PolarHBondContact O-N 3.29Å; L60-T64 PolarHBondContact O-OG1 3.49Å; L60-I81 HydrophobicContact CD1-CG2 4.43Å; L60-I81 HydrophobicContact CD2-CG2 4.28Å; L60-A84 HydrophobicContact CD1-CB 4.29Å; L60-K85 HydrophobicContact CD1-CG 4.07Å; L60-L88 HydrophobicContact CB-CD1 4.14Å; L60-L88 HydrophobicContact CD1-CD1 3.81Å
61	F	82.2	Confident	83.2	Confident	89 Å²	89	63.6 Å²	63.6	39%	0.39	35%	0.346	S	S	.	.	H	α-helix	trans	-75.3	-28.7	178.4	-76.6	-52.6	0	0	0	113.3	M57 V58 G59 N65 I76 I81	M57-F61 HydrophobicContact CB-CD2 4.49Å; M57-F61 HydrophobicContact CB-CE2 4.39Å; M57-F61 HydrophobicContact CE-CE2 3.98Å; M57-F61 WeakPolarHBondContact O-CB 3.36Å; M57-F61 WeakPolarHBondContact O-CD2 3.33Å; M57-F61 WeakPolarHBondContact O-CG 3.45Å; M57-F61 PolarHBondContact O-N 3.31Å; V58-F61 PolarHBondContact O-N 3.21Å; V58-F61 VanDerWaalsContact O-N 3.13Å; G59-F61 VanDerWaalsContact C-N 3.27Å; G59-F61 PolarHBondContact O-N 3.42Å; F61-N65 WeakPolarHBondContact O-CB 3.31Å; F61-N65 PolarHBondContact O-N 3.29Å; F61-I76 HydrophobicContact CD1-CD1 3.86Å; F61-I76 HydrophobicContact CE1-CD1 3.99Å; F61-I81 HydrophobicContact CE1-CD1 4.43Å
62	E	85	Confident	83.6	Confident	103 Å²	103	62.5 Å²	62.5	48%	0.481	36%	0.36	S	S	.	.	H	α-helix	trans	-63.3	-48.9	172.1	-72.6	177.6	174.5	0	0	110.3	V58 G59 N65 L66	V58-E62 WeakPolarHBondContact O-CG 3.37Å; V58-E62 PolarHBondContact O-N 3.08Å; G59-E62 WeakPolarHBondContact O-CB 3.44Å; G59-E62 PolarHBondContact O-N 3.41Å; G59-E62 VanDerWaalsContact O-N 3.07Å; E62-N65 WeakPolarHBondContact O-CB 3.29Å; E62-N65 PolarHBondContact O-N 2.84Å; E62-L66 WeakPolarHBondContact O-CG 3.36Å; E62-L66 PolarHBondContact O-N 2.86Å
63	D	83.2	Confident	84.1	Confident	39 Å²	39	62.1 Å²	62.1	21%	0.209	35%	0.348	C	S	.	.	H	α-helix	trans	-65.1	-43.8	176.4	-69.1	-19.4	0	0	0	112.6	G59 N65 L66 C67 A84 L88	G59-D63 PolarHBondContact O-N 3.39Å; G59-D63 VanDerWaalsContact O-N 3.08Å; D63-N65 PolarHBondContact O-N 3.41Å; D63-L66 WeakPolarHBondContact O-CB 3.39Å; D63-L66 PolarHBondContact O-N 3Å; D63-L66 VanDerWaalsContact O-N 3.08Å; D63-C67 PolarHBondContact O-N 3.17Å; D63-C67 PolarHBondContact O-SG 3.26Å; D63-C67 VanDerWaalsContact O-SG 3.41Å; D63-A84 HydrophobicContact CB-CB 3.72Å; D63-L88 WeakPolarHBondContact OD2-CD2 3.29Å; D63-L88 WeakPolarHBondContact OD2-CG 3.33Å
64	T	81.8	Confident	84.4	Confident	0 Å²	0	65.5 Å²	65.5	0%	0	37%	0.369	C	S	.	.	H	α-helix	trans	-57.6	-41.2	175	-62.1	0	0	0	0	110.7	L60 C67 A68 I76 D80 I81	L60-T64 VanDerWaalsContact O-CB 3.24Å; L60-T64 WeakPolarHBondContact O-CB 3.32Å; L60-T64 PolarHBondContact O-N 3.29Å; L60-T64 PolarHBondContact O-OG1 3.49Å; T64-C67 PolarHBondContact O-N 3.28Å; T64-A68 PolarHBondContact O-N 3.13Å; T64-I76 HydrophobicContact CG2-CB 3.83Å; T64-I76 HydrophobicContact CG2-CD1 4.38Å; T64-I76 HydrophobicContact CG2-CG2 3.85Å; T64-D80 HydrophobicContact CG2-CB 3.76Å; T64-I81 HydrophobicContact CG2-CB 4.38Å; T64-I81 HydrophobicContact CG2-CG1 3.44Å; T64-I81 VanDerWaalsContact CG2-CG1 3.44Å
65	N	88.2	Confident	84.7	Confident	69 Å²	69	69.6 Å²	69.6	37%	0.369	40%	0.395	S	S	.	.	H	α-helix	trans	-67.5	-38.1	177.4	179.7	71.3	0	0	0	111.5	F61 E62 D63 A68 I69 I76	F61-N65 WeakPolarHBondContact O-CB 3.31Å; F61-N65 PolarHBondContact O-N 3.29Å; E62-N65 WeakPolarHBondContact O-CB 3.29Å; E62-N65 PolarHBondContact O-N 2.84Å; D63-N65 PolarHBondContact O-N 3.41Å; N65-A68 PolarHBondContact O-N 2.6Å; N65-I69 WeakPolarHBondContact ND2-CD1 3.36Å; N65-I69 WeakPolarHBondContact O-CB 3.09Å; N65-I69 VanDerWaalsContact O-CG1 3.24Å; N65-I69 WeakPolarHBondContact O-CG1 3.42Å; N65-I69 PolarHBondContact O-N 3.13Å; N65-I76 HydrophobicContact CB-CG2 4.34Å
66	L	87.7	Confident	85	Confident	108 Å²	108	70.2 Å²	70.2	57%	0.565	39%	0.389	S	S	*	.	H	α-helix	trans	-62	-43.5	172.3	-68.9	174.9	0	0	0	111.8	E62 D63 A68 I69 H70	E62-L66 WeakPolarHBondContact O-CG 3.36Å; E62-L66 PolarHBondContact O-N 2.86Å; D63-L66 WeakPolarHBondContact O-CB 3.39Å; D63-L66 PolarHBondContact O-N 3Å; D63-L66 VanDerWaalsContact O-N 3.08Å; L66-A68 PolarHBondContact O-N 3.21Å; L66-I69 PolarHBondContact O-N 3.03Å; L66-H70 WeakPolarHBondContact O-CB 3.01Å; L66-H70 PolarHBondContact O-N 2.78Å
67	C	86.1	Confident	85.2	Confident	26 Å²	26	67.6 Å²	67.6	18%	0.176	38%	0.383	C	S	.	.	H	α-helix	trans	-61.4	-42.7	174.8	-67.1	0	0	0	0	112.4	D63 T64 H70 A71 D80 L83	D63-C67 PolarHBondContact O-N 3.17Å; D63-C67 PolarHBondContact O-SG 3.26Å; D63-C67 VanDerWaalsContact O-SG 3.41Å; T64-C67 PolarHBondContact O-N 3.28Å; C67-H70 WeakPolarHBondContact O-CB 3.36Å; C67-H70 PolarHBondContact O-N 3.22Å; C67-A71 PolarHBondContact O-N 2.75Å; C67-A71 VanDerWaalsContact O-N 3.07Å; C67-D80 HydrophobicContact CB-CB 4.06Å; C67-L83 HydrophobicContact CB-CD2 4.21Å
68	A	86.5	Confident	85.2	Confident	0 Å²	0	67.5 Å²	67.5	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-64.1	-45.1	177	0	0	0	0	0	111.7	T64 N65 L66 H70 A71 G72 Q73 I76	T64-A68 PolarHBondContact O-N 3.13Å; N65-A68 PolarHBondContact O-N 2.6Å; L66-A68 PolarHBondContact O-N 3.21Å; A68-H70 VanDerWaalsContact C-N 3.3Å; A68-H70 PolarHBondContact O-N 3.14Å; A68-A71 CarbonylContact O-C 3.5Å; A68-A71 PolarHBondContact O-N 3.05Å; A68-A71 VanDerWaalsContact O-N 3.11Å; A68-G72 PolarHBondContact O-N 3.39Å; A68-Q73 CarbonylContact C-O 3.46Å; A68-Q73 HydrophobicContact CB-CB 4.36Å; A68-Q73 WeakPolarHBondContact O-CA 3.11Å; A68-Q73 WeakPolarHBondContact O-CB 3.39Å; A68-Q73 PolarHBondContact O-N 3.15Å; A68-I76 HydrophobicContact CB-CG2 4Å
69	I	90.3	Very high	85.2	Confident	100 Å²	100	69.8 Å²	69.8	51%	0.513	40%	0.398	S	S	.	.	H	α-helix	trans	-61.4	-41.2	176.2	-70.3	166.9	0	0	0	110.6	N65 L66 A71 G72	N65-I69 WeakPolarHBondContact ND2-CD1 3.36Å; N65-I69 WeakPolarHBondContact O-CB 3.09Å; N65-I69 VanDerWaalsContact O-CG1 3.24Å; N65-I69 WeakPolarHBondContact O-CG1 3.42Å; N65-I69 PolarHBondContact O-N 3.13Å; L66-I69 PolarHBondContact O-N 3.03Å; I69-A71 PolarHBondContact O-N 3.03Å; I69-G72 WeakPolarHBondContact O-CA 3.37Å; I69-G72 PolarHBondContact O-N 2.76Å
70	H	89.3	Confident	85.1	Confident	170 Å²	170	69 Å²	69	79%	0.787	39%	0.389	S	S	*	.	H	α-helix	trans	-59.6	-37.2	175.8	-175.4	75.8	0	0	0	112	L66 C67 A68 G72	L66-H70 WeakPolarHBondContact O-CB 3.01Å; L66-H70 PolarHBondContact O-N 2.78Å; C67-H70 WeakPolarHBondContact O-CB 3.36Å; C67-H70 PolarHBondContact O-N 3.22Å; A68-H70 VanDerWaalsContact C-N 3.3Å; A68-H70 PolarHBondContact O-N 3.14Å; H70-G72 PolarHBondContact O-N 3.42Å
71	A	90.1	Very high	85	Confident	52 Å²	52	70.4 Å²	70.4	43%	0.43	40%	0.396	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.1	7.4	173.6	0	0	0	0	0	114.3	C67 A68 I69 Q73	C67-A71 PolarHBondContact O-N 2.75Å; C67-A71 VanDerWaalsContact O-N 3.07Å; A68-A71 CarbonylContact O-C 3.5Å; A68-A71 PolarHBondContact O-N 3.05Å; A68-A71 VanDerWaalsContact O-N 3.11Å; I69-A71 PolarHBondContact O-N 3.03Å; A71-Q73 VanDerWaalsContact C-N 3.25Å; A71-Q73 HydrophobicContact CB-CG 4.44Å; A71-Q73 PolarHBondContact O-N 3.43Å
72	G	90.2	Very high	84.9	Confident	71 Å²	71	72.8 Å²	72.8	73%	0.732	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.6	19.7	-177.4	0	0	0	0	0	114	A68 I69 H70	A68-G72 PolarHBondContact O-N 3.39Å; I69-G72 WeakPolarHBondContact O-CA 3.37Å; I69-G72 PolarHBondContact O-N 2.76Å; H70-G72 PolarHBondContact O-N 3.42Å
73	Q	88.4	Confident	84.6	Confident	50 Å²	50	73.2 Å²	73.2	23%	0.234	41%	0.413	C	S	.	.			trans	-101.1	147	-178.3	-68.9	152.5	8.7	0	0	110.9	A68 A71 M77	A68-Q73 CarbonylContact C-O 3.46Å; A68-Q73 HydrophobicContact CB-CB 4.36Å; A68-Q73 WeakPolarHBondContact O-CA 3.11Å; A68-Q73 WeakPolarHBondContact O-CB 3.39Å; A68-Q73 PolarHBondContact O-N 3.15Å; A71-Q73 VanDerWaalsContact C-N 3.25Å; A71-Q73 HydrophobicContact CB-CG 4.44Å; A71-Q73 PolarHBondContact O-N 3.43Å; Q73-M77 HydrophobicContact CG-CE 4.04Å; Q73-M77 VanDerWaalsContact NE2-CE 3.34Å
74	V	84.7	Confident	84.4	Confident	122 Å²	122	71.4 Å²	71.4	74%	0.739	40%	0.404	S	S	*	.	S	Bend	trans	-99.1	-19.1	172.8	-175.5	0	0	0	0	111.1	M1	M1-V74 HydrophobicContact CE-CG1 4.34Å
75	T	87.7	Confident	83.9	Confident	104 Å²	104	77 Å²	77	64%	0.638	43%	0.428	S	S	*	.	S	Bend	trans	-107.1	120.7	-178.9	-55.3	0	0	0	0	108.9
76	I	84.3	Confident	82.6	Confident	69 Å²	69	77.4 Å²	77.4	35%	0.354	43%	0.434	S	S	.	.			trans	-64.9	141.1	172.7	61.2	171.9	0	0	0	111	F61 T64 N65 A68	F61-I76 HydrophobicContact CD1-CD1 3.86Å; F61-I76 HydrophobicContact CE1-CD1 3.99Å; T64-I76 HydrophobicContact CG2-CB 3.83Å; T64-I76 HydrophobicContact CG2-CD1 4.38Å; T64-I76 HydrophobicContact CG2-CG2 3.85Å; N65-I76 HydrophobicContact CB-CG2 4.34Å; A68-I76 HydrophobicContact CB-CG2 4Å
77	M	82.9	Confident	81.2	Confident	74 Å²	74	74.8 Å²	74.8	37%	0.365	43%	0.428	S	S	.	.			trans	-124.6	163.1	177.8	-71.3	-174.9	-85	0	0	111.2	Q73 K79 D80 I81	Q73-M77 HydrophobicContact CG-CE 4.04Å; Q73-M77 VanDerWaalsContact NE2-CE 3.34Å; M77-K79 HydrophobicContact CB-CG 4Å; M77-K79 PolarHBondContact O-N 2.99Å; M77-K79 VanDerWaalsContact O-N 3.14Å; M77-D80 WeakPolarHBondContact CB-OD2 3.39Å; M77-D80 PolarHBondContact N-OD2 3.4Å; M77-D80 WeakPolarHBondContact O-CB 3.37Å; M77-D80 PolarHBondContact O-N 3.01Å; M77-I81 PolarHBondContact O-N 3.35Å
78	A	80.6	Confident	79.9	Confident	70 Å²	70	75.6 Å²	75.6	58%	0.579	43%	0.431	S	S	*	.	H	α-helix	trans	-56.2	-32.8	179.5	0	0	0	0	0	113.2	D80 I81 Q82	A78-D80 VanDerWaalsContact C-N 3.31Å; A78-D80 PolarHBondContact O-N 3.41Å; A78-I81 PolarHBondContact O-N 3.37Å; A78-Q82 WeakPolarHBondContact O-CG 3.46Å; A78-Q82 PolarHBondContact O-N 3.16Å; A78-Q82 VanDerWaalsContact O-N 3.1Å
79	K	79.6	Confident	78.4	Confident	109 Å²	109	83.1 Å²	83.1	47%	0.474	46%	0.463	S	S	.	.	H	α-helix	trans	-65.3	-31.2	175.4	61.6	174.1	179.9	-179.7	0	113.3	M77 Q82 L83	M77-K79 HydrophobicContact CB-CG 4Å; M77-K79 PolarHBondContact O-N 2.99Å; M77-K79 VanDerWaalsContact O-N 3.14Å; K79-Q82 PolarHBondContact O-N 3.27Å; K79-L83 PolarHBondContact O-N 3.29Å; K79-L83 VanDerWaalsContact O-N 3.08Å
80	D	79.2	Confident	76.6	Confident	7 Å²	7	85.8 Å²	85.8	4%	0.037	47%	0.473	C	S	.	.	H	α-helix	trans	-73.7	-37.8	-179.8	-50.2	-39.4	0	0	0	109.6	T64 C67 M77 A78 Q82 L83 A84	T64-D80 HydrophobicContact CG2-CB 3.76Å; C67-D80 HydrophobicContact CB-CB 4.06Å; M77-D80 WeakPolarHBondContact CB-OD2 3.39Å; M77-D80 PolarHBondContact N-OD2 3.4Å; M77-D80 WeakPolarHBondContact O-CB 3.37Å; M77-D80 PolarHBondContact O-N 3.01Å; A78-D80 VanDerWaalsContact C-N 3.31Å; A78-D80 PolarHBondContact O-N 3.41Å; D80-Q82 VanDerWaalsContact C-N 3.34Å; D80-Q82 PolarHBondContact O-N 3.3Å; D80-L83 PolarHBondContact O-N 3.4Å; D80-A84 WeakPolarHBondContact O-CB 3.46Å; D80-A84 PolarHBondContact O-N 2.66Å
81	I	76.5	Confident	74.8	Confident	47 Å²	47	83.9 Å²	83.9	24%	0.241	47%	0.465	C	S	.	.	H	α-helix	trans	-64.6	-40.9	173.7	-59.3	173	0	0	0	110.6	L60 F61 T64 M77 A78 L83 A84 K85	L60-I81 HydrophobicContact CD1-CG2 4.43Å; L60-I81 HydrophobicContact CD2-CG2 4.28Å; F61-I81 HydrophobicContact CE1-CD1 4.43Å; T64-I81 HydrophobicContact CG2-CB 4.38Å; T64-I81 HydrophobicContact CG2-CG1 3.44Å; T64-I81 VanDerWaalsContact CG2-CG1 3.44Å; M77-I81 PolarHBondContact O-N 3.35Å; A78-I81 PolarHBondContact O-N 3.37Å; I81-L83 PolarHBondContact O-N 2.99Å; I81-A84 PolarHBondContact O-N 2.93Å; I81-K85 WeakPolarHBondContact O-CB 3.31Å; I81-K85 WeakPolarHBondContact O-CG 3.42Å; I81-K85 PolarHBondContact O-N 3.4Å
82	Q	81	Confident	73	Confident	138 Å²	138	88.3 Å²	88.3	65%	0.645	48%	0.477	S	S	*	.	H	α-helix	trans	-63.3	-33.4	176.3	-73.2	174.4	-3.9	0	0	112.1	A78 K79 D80 P86	A78-Q82 WeakPolarHBondContact O-CG 3.46Å; A78-Q82 PolarHBondContact O-N 3.16Å; A78-Q82 VanDerWaalsContact O-N 3.1Å; K79-Q82 PolarHBondContact O-N 3.27Å; D80-Q82 VanDerWaalsContact C-N 3.34Å; D80-Q82 PolarHBondContact O-N 3.3Å; Q82-P86 WeakPolarHBondContact O-CD 3.47Å
83	L	79	Confident	71	Confident	113 Å²	113	91.4 Å²	91.4	59%	0.592	48%	0.477	S	S	*	.	H	α-helix	trans	-77.4	-35.3	176.4	-171.6	64.4	0	0	0	112.7	C67 K79 D80 I81 P86	C67-L83 HydrophobicContact CB-CD2 4.21Å; K79-L83 PolarHBondContact O-N 3.29Å; K79-L83 VanDerWaalsContact O-N 3.08Å; D80-L83 PolarHBondContact O-N 3.4Å; I81-L83 PolarHBondContact O-N 2.99Å; L83-P86 WeakPolarHBondContact O-CD 3.45Å
84	A	77.8	Confident	69.2	Low	1 Å²	1	96 Å²	96	1%	0.008	50%	0.501	C	S	.	.	H	α-helix	trans	-72.2	-34.7	177.6	0	0	0	0	0	113	L60 D63 D80 I81 A87 L88	L60-A84 HydrophobicContact CD1-CB 4.29Å; D63-A84 HydrophobicContact CB-CB 3.72Å; D80-A84 WeakPolarHBondContact O-CB 3.46Å; D80-A84 PolarHBondContact O-N 2.66Å; I81-A84 PolarHBondContact O-N 2.93Å; A84-A87 WeakPolarHBondContact O-CB 3.32Å; A84-A87 PolarHBondContact O-N 3.49Å; A84-L88 PolarHBondContact O-N 3.41Å
85	K	71.1	Confident	67.3	Low	118 Å²	118	91.8 Å²	91.8	51%	0.513	48%	0.479	S	S	.	.	H	α-helix	trans	-53.4	-45.3	-177.6	-92.4	-176.8	176.7	-175.1	0	114.9	L60 I81	L60-K85 HydrophobicContact CD1-CG 4.07Å; I81-K85 WeakPolarHBondContact O-CB 3.31Å; I81-K85 WeakPolarHBondContact O-CG 3.42Å; I81-K85 PolarHBondContact O-N 3.4Å
86	P	61.6	Low	65.6	Low	76 Å²	76	94 Å²	94	49%	0.494	48%	0.482	S	S	.	.	H	α-helix	trans	-68.1	-33.7	175	-23	33.2	0	0	0	113.9	Q82 L83 L88 K89	Q82-P86 WeakPolarHBondContact O-CD 3.47Å; L83-P86 WeakPolarHBondContact O-CD 3.45Å; P86-L88 VanDerWaalsContact C-N 3.31Å; P86-L88 PolarHBondContact O-N 3.16Å; P86-K89 WeakPolarHBondContact O-CB 3.22Å; P86-K89 PolarHBondContact O-N 3.06Å
87	A	58.6	Low	63.7	Low	53 Å²	53	99.4 Å²	99.4	44%	0.438	51%	0.506	S	S	.	.	H	α-helix	trans	-62.6	-39	-177.3	0	0	0	0	0	111.8	A84 K89 E90	A84-A87 WeakPolarHBondContact O-CB 3.32Å; A84-A87 PolarHBondContact O-N 3.49Å; A87-K89 PolarHBondContact O-N 3.34Å; A87-E90 PolarHBondContact O-N 2.86Å; A87-E90 VanDerWaalsContact O-N 3.09Å
88	L	57.5	Low	62.1	Low	44 Å²	44	103.4 Å²	103.4	23%	0.23	52%	0.524	C	S	.	.	H	α-helix	trans	-62.3	-24.1	174.2	-72.3	175.1	0	0	0	113.9	Y56 L60 D63 A84 P86 E90	Y56-L88 HydrophobicContact CE2-CD1 4.27Å; L60-L88 HydrophobicContact CB-CD1 4.14Å; L60-L88 HydrophobicContact CD1-CD1 3.81Å; D63-L88 WeakPolarHBondContact OD2-CD2 3.29Å; D63-L88 WeakPolarHBondContact OD2-CG 3.33Å; A84-L88 PolarHBondContact O-N 3.41Å; P86-L88 VanDerWaalsContact C-N 3.31Å; P86-L88 PolarHBondContact O-N 3.16Å; L88-E90 VanDerWaalsContact C-N 3.28Å
89	K	55.1	Low	60.6	Low	157 Å²	157	102.5 Å²	102.5	68%	0.683	51%	0.511	S	S	*	.	H	α-helix	trans	-72.2	-23.9	176.1	-74.2	-173.1	166.3	-170.5	0	112.7	P86 A87	P86-K89 WeakPolarHBondContact O-CB 3.22Å; P86-K89 PolarHBondContact O-N 3.06Å; A87-K89 PolarHBondContact O-N 3.34Å
90	E	52.5	Low	59.3	Low	156 Å²	156	102.2 Å²	102.2	73%	0.729	51%	0.511	S	S	*	.	H	α-helix	trans	-87.6	-21.8	-177.6	-56.4	-144.7	170.4	0	0	112.4	A87 L88 E92	A87-E90 PolarHBondContact O-N 2.86Å; A87-E90 VanDerWaalsContact O-N 3.09Å; L88-E90 VanDerWaalsContact C-N 3.28Å; E90-E92 VanDerWaalsContact C-N 3.27Å; E90-E92 PolarHBondContact O-N 2.81Å
91	E	51.8	Low	58.1	Low	131 Å²	131	107.4 Å²	107.4	61%	0.612	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-74.3	-13.7	173.8	-72.5	-158.4	162.6	0	0	113.8	D93 I94	E91-D93 PolarHBondContact O-N 3.43Å; E91-D93 VanDerWaalsContact O-N 3.14Å; E91-I94 PolarHBondContact O-N 2.8Å
92	E	52.3	Low	57	Low	145 Å²	145	112.5 Å²	112.5	68%	0.678	56%	0.556	S	S	*	*	G	3₁₀ helix	trans	-57.6	-25.9	173.2	-87.9	-179.3	155.2	0	0	112.2	E90	E90-E92 VanDerWaalsContact C-N 3.27Å; E90-E92 PolarHBondContact O-N 2.81Å
93	D	48.3	Very low	55.6	Low	136 Å²	136	111.6 Å²	111.6	73%	0.727	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-78.1	-18.7	-178.6	-77	-16.4	0	0	0	114.5	E91	E91-D93 PolarHBondContact O-N 3.43Å; E91-D93 VanDerWaalsContact O-N 3.14Å
94	I	50.1	Low	54.3	Low	145 Å²	145	111.7 Å²	111.7	74%	0.744	54%	0.544	S	S	*	.	T	Hydrogen-bonded Turn	trans	-97.7	-22.4	-177.6	-46.6	178	0	0	0	111.3	E91 E96	E91-I94 PolarHBondContact O-N 2.8Å; I94-E96 VanDerWaalsContact C-N 3.32Å; I94-E96 PolarHBondContact O-N 3.34Å
95	A	46.2	Very low	53.2	Low	35 Å²	35	115.4 Å²	115.4	29%	0.289	56%	0.562	S	S	.	*	G	3₁₀ helix	trans	-80.6	-2.9	-171.9	0	0	0	0	0	114.4	H97 E98 V99	A95-H97 PolarHBondContact O-N 2.68Å; A95-E98 CarbonylContact O-C 3.55Å; A95-E98 PolarHBondContact O-N 2.87Å; A95-V99 VanDerWaalsContact C-CG2 3.4Å; A95-V99 HydrophobicContact CB-CG2 3.72Å; A95-V99 WeakPolarHBondContact O-CB 3.15Å; A95-V99 WeakPolarHBondContact O-CG2 3.36Å; A95-V99 PolarHBondContact O-N 3.18Å
96	E	51.5	Low	52.3	Low	150 Å²	150	114.7 Å²	114.7	70%	0.701	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-49.6	-22.4	-172.8	-73.4	-166.6	161.9	0	0	115	I94	I94-E96 VanDerWaalsContact C-N 3.32Å; I94-E96 PolarHBondContact O-N 3.34Å
97	H	45.3	Very low	52.1	Low	183 Å²	183	113.5 Å²	113.5	85%	0.847	55%	0.551	S	S	*	*	G	3₁₀ helix	trans	-86.8	-31.5	174.3	-158.3	24.3	0	0	0	115.7	A95	A95-H97 PolarHBondContact O-N 2.68Å
98	E	48.4	Very low	51.9	Low	157 Å²	157	115.6 Å²	115.6	73%	0.734	55%	0.552	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.7	-18.8	168.7	-93.2	-177.5	157.3	0	0	112	A95 E100 D101	A95-E98 CarbonylContact O-C 3.55Å; A95-E98 PolarHBondContact O-N 2.87Å; E98-E100 PolarHBondContact O-N 3.05Å; E98-E100 VanDerWaalsContact O-N 3.13Å; E98-D101 PolarHBondContact O-N 3.01Å
99	V	50.3	Low	51.9	Low	52 Å²	52	117.7 Å²	117.7	32%	0.315	56%	0.563	S	S	.	*	H	α-helix	trans	-59.8	-21.1	176.1	163.7	0	0	0	0	111	A95 D101 Y102 R103	A95-V99 VanDerWaalsContact C-CG2 3.4Å; A95-V99 HydrophobicContact CB-CG2 3.72Å; A95-V99 WeakPolarHBondContact O-CB 3.15Å; A95-V99 WeakPolarHBondContact O-CG2 3.36Å; A95-V99 PolarHBondContact O-N 3.18Å; V99-D101 VanDerWaalsContact C-N 3.27Å; V99-D101 PolarHBondContact O-N 2.92Å; V99-Y102 CarbonylContact O-C 3.47Å; V99-Y102 PolarHBondContact O-N 3.22Å; V99-Y102 VanDerWaalsContact O-N 3.13Å; V99-R103 HydrophobicContact CG1-CB 4.27Å; V99-R103 WeakPolarHBondContact O-CA 3.06Å; V99-R103 WeakPolarHBondContact O-CB 3.41Å; V99-R103 PolarHBondContact O-N 3.2Å
100	E	50.3	Low	52.3	Low	102 Å²	102	115.3 Å²	115.3	48%	0.477	56%	0.555	S	S	.	*	H	α-helix	trans	-64.2	-32.6	179.5	-149.7	58.3	-157.4	0	0	113	E98 R103 Q104	E98-E100 PolarHBondContact O-N 3.05Å; E98-E100 VanDerWaalsContact O-N 3.13Å; E100-R103 WeakPolarHBondContact OE1-CD 3.32Å; E100-R103 IonicContact OE1-NE 2.74Å; E100-R103 PolarHBondContact OE1-NE 2.68Å; E100-R103 VanDerWaalsContact OE2-CD 3.29Å; E100-R103 WeakPolarHBondContact OE2-CD 3.27Å; E100-Q104 PolarHBondContact O-N 3.34Å; E100-Q104 VanDerWaalsContact O-N 3.17Å
101	D	54.8	Low	52.5	Low	117 Å²	117	114 Å²	114	63%	0.626	54%	0.543	S	S	*	.	H	α-helix	trans	-73.9	-35.6	174.8	-78	-11.6	0	0	0	111.6	E98 V99	E98-D101 PolarHBondContact O-N 3.01Å; V99-D101 VanDerWaalsContact C-N 3.27Å; V99-D101 PolarHBondContact O-N 2.92Å
102	Y	53.7	Low	52.6	Low	154 Å²	154	111.1 Å²	111.1	60%	0.604	53%	0.534	S	S	*	.	H	α-helix	trans	-78.4	-26.3	173.7	-74	-75.9	0	0	0	113.3	V99 Q104 H105 L106	V99-Y102 CarbonylContact O-C 3.47Å; V99-Y102 PolarHBondContact O-N 3.22Å; V99-Y102 VanDerWaalsContact O-N 3.13Å; Y102-Q104 VanDerWaalsContact C-N 3.28Å; Y102-H105 CarbonylContact O-C 3.56Å; Y102-H105 WeakPolarHBondContact O-CA 3.09Å; Y102-H105 WeakPolarHBondContact O-CB 3.31Å; Y102-H105 PolarHBondContact O-N 3.19Å; Y102-L106 PolarHBondContact O-N 2.96Å
103	R	50.8	Low	53.2	Low	118 Å²	118	108 Å²	108	45%	0.445	52%	0.521	S	S	.	.	H	α-helix	trans	-68.1	-34.3	174.9	180	-175.9	156.5	93.3	15.8	108.7	V99 E100 H105 L106 E107	V99-R103 HydrophobicContact CG1-CB 4.27Å; V99-R103 WeakPolarHBondContact O-CA 3.06Å; V99-R103 WeakPolarHBondContact O-CB 3.41Å; V99-R103 PolarHBondContact O-N 3.2Å; E100-R103 WeakPolarHBondContact OE1-CD 3.32Å; E100-R103 IonicContact OE1-NE 2.74Å; E100-R103 PolarHBondContact OE1-NE 2.68Å; E100-R103 VanDerWaalsContact OE2-CD 3.29Å; E100-R103 WeakPolarHBondContact OE2-CD 3.27Å; R103-H105 VanDerWaalsContact C-N 3.3Å; R103-H105 PolarHBondContact O-N 3.3Å; R103-L106 PolarHBondContact O-N 2.74Å; R103-E107 HydrophobicContact CG-CG 4.06Å; R103-E107 IonicContact CZ-OE1 3.29Å; R103-E107 VanDerWaalsContact CZ-OE1 3.24Å; R103-E107 IonicContact NE-OE1 3.75Å; R103-E107 PolarHBondContact NE-OE1 3.36Å; R103-E107 IonicContact NH2-OE1 2.94Å; R103-E107 PolarHBondContact NH2-OE1 2.75Å; R103-E107 WeakPolarHBondContact O-CA 3.33Å; R103-E107 WeakPolarHBondContact O-CB 3.16Å; R103-E107 WeakPolarHBondContact O-CG 3.37Å; R103-E107 PolarHBondContact O-N 2.94Å
104	Q	52.7	Low	53.9	Low	115 Å²	115	106.3 Å²	106.3	54%	0.537	51%	0.512	S	S	.	.	H	α-helix	trans	-60.5	-40.4	168.2	-70.5	179.5	13.2	0	0	112.1	E100 Y102 M108	E100-Q104 PolarHBondContact O-N 3.34Å; E100-Q104 VanDerWaalsContact O-N 3.17Å; Y102-Q104 VanDerWaalsContact C-N 3.28Å; Q104-M108 WeakPolarHBondContact O-CB 3.17Å; Q104-M108 PolarHBondContact O-N 2.91Å
105	H	54	Low	54.3	Low	80 Å²	80	105.2 Å²	105.2	37%	0.37	51%	0.507	S	S	.	.	H	α-helix	trans	-69.4	-41.1	174.6	-84	144.4	0	0	0	112.9	Y102 R103 M108 L109	Y102-H105 CarbonylContact O-C 3.56Å; Y102-H105 WeakPolarHBondContact O-CA 3.09Å; Y102-H105 WeakPolarHBondContact O-CB 3.31Å; Y102-H105 PolarHBondContact O-N 3.19Å; R103-H105 VanDerWaalsContact C-N 3.3Å; R103-H105 PolarHBondContact O-N 3.3Å; H105-M108 WeakPolarHBondContact O-CB 3.48Å; H105-M108 PolarHBondContact O-N 2.89Å; H105-L109 PolarHBondContact O-N 2.77Å
106	L	53.5	Low	54.6	Low	103 Å²	103	108.2 Å²	108.2	54%	0.539	52%	0.516	S	S	.	.	H	α-helix	trans	-70	-39.5	177.7	-164.1	70.9	0	0	0	111	Y102 R103 M108 L109 H110	Y102-L106 PolarHBondContact O-N 2.96Å; R103-L106 PolarHBondContact O-N 2.74Å; L106-M108 VanDerWaalsContact C-N 3.3Å; L106-L109 CarbonylContact O-C 3.56Å; L106-L109 WeakPolarHBondContact O-CA 3.48Å; L106-L109 WeakPolarHBondContact O-CB 3.16Å; L106-L109 PolarHBondContact O-N 3.11Å; L106-H110 PolarHBondContact O-N 3.04Å
107	E	56	Low	55.2	Low	51 Å²	51	104.3 Å²	104.3	24%	0.238	51%	0.506	C	S	.	.	H	α-helix	trans	-65.5	-33.3	169.6	-76.4	-174.2	179.5	0	0	111.3	R103 L109 R111	R103-E107 HydrophobicContact CG-CG 4.06Å; R103-E107 IonicContact CZ-OE1 3.29Å; R103-E107 VanDerWaalsContact CZ-OE1 3.24Å; R103-E107 IonicContact NE-OE1 3.75Å; R103-E107 PolarHBondContact NE-OE1 3.36Å; R103-E107 IonicContact NH2-OE1 2.94Å; R103-E107 PolarHBondContact NH2-OE1 2.75Å; R103-E107 WeakPolarHBondContact O-CA 3.33Å; R103-E107 WeakPolarHBondContact O-CB 3.16Å; R103-E107 WeakPolarHBondContact O-CG 3.37Å; R103-E107 PolarHBondContact O-N 2.94Å; E107-L109 VanDerWaalsContact C-N 3.34Å; E107-R111 VanDerWaalsContact CB-NH2 3.28Å; E107-R111 WeakPolarHBondContact O-CB 3.13Å; E107-R111 VanDerWaalsContact O-CG 3.27Å; E107-R111 WeakPolarHBondContact O-CG 3.43Å; E107-R111 PolarHBondContact O-N 3.44Å; E107-R111 IonicContact OE2-CZ 3.06Å; E107-R111 VanDerWaalsContact OE2-CZ 3.29Å; E107-R111 IonicContact OE2-NH1 2.81Å; E107-R111 PolarHBondContact OE2-NH1 3.44Å; E107-R111 IonicContact OE2-NH2 3.41Å; E107-R111 PolarHBondContact OE2-NH2 2.75Å
108	M	55.2	Low	55.9	Low	96 Å²	96	98.6 Å²	98.6	47%	0.473	49%	0.486	S	S	.	.	H	α-helix	trans	-65.6	-41.8	171.6	-172	-169.5	-57.2	0	0	109.9	Q104 H105 L106 V112	Q104-M108 WeakPolarHBondContact O-CB 3.17Å; Q104-M108 PolarHBondContact O-N 2.91Å; H105-M108 WeakPolarHBondContact O-CB 3.48Å; H105-M108 PolarHBondContact O-N 2.89Å; L106-M108 VanDerWaalsContact C-N 3.3Å; M108-V112 WeakPolarHBondContact O-CB 3.48Å; M108-V112 WeakPolarHBondContact O-CG2 3.22Å; M108-V112 PolarHBondContact O-N 2.88Å
109	L	57.8	Low	56.3	Low	88 Å²	88	93.4 Å²	93.4	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-62	-48	173.5	-111.9	158.3	0	0	0	111.7	H105 L106 E107 V112 I113	H105-L109 PolarHBondContact O-N 2.77Å; L106-L109 CarbonylContact O-C 3.56Å; L106-L109 WeakPolarHBondContact O-CA 3.48Å; L106-L109 WeakPolarHBondContact O-CB 3.16Å; L106-L109 PolarHBondContact O-N 3.11Å; E107-L109 VanDerWaalsContact C-N 3.34Å; L109-V112 PolarHBondContact O-N 3.08Å; L109-I113 HydrophobicContact CD2-CD1 4.21Å; L109-I113 WeakPolarHBondContact O-CB 3.33Å; L109-I113 WeakPolarHBondContact O-CD1 3.43Å; L109-I113 VanDerWaalsContact O-CG1 3.22Å; L109-I113 WeakPolarHBondContact O-CG1 3.38Å; L109-I113 PolarHBondContact O-N 2.95Å
110	H	61.8	Low	56.5	Low	108 Å²	108	92 Å²	92	50%	0.5	47%	0.466	S	S	.	.	H	α-helix	trans	-63.6	-46.8	175.3	-80.1	-179.8	0	0	0	112	L106 V112 I113 D114	L106-H110 PolarHBondContact O-N 3.04Å; H110-V112 VanDerWaalsContact C-N 3.27Å; H110-V112 PolarHBondContact O-N 3.04Å; H110-I113 CarbonylContact O-C 3.49Å; H110-I113 PolarHBondContact O-N 3.31Å; H110-I113 VanDerWaalsContact O-N 3.08Å; H110-D114 WeakPolarHBondContact O-CB 3.13Å; H110-D114 VanDerWaalsContact O-CG 3.24Å; H110-D114 PolarHBondContact O-N 3.19Å
111	R	58.7	Low	56.6	Low	129 Å²	129	93.5 Å²	93.5	49%	0.487	47%	0.473	S	S	.	.	H	α-helix	trans	-59.5	-38.2	176	-80.5	-174.5	-82.5	-101.9	-0.3	111.9	E107 L115	E107-R111 VanDerWaalsContact CB-NH2 3.28Å; E107-R111 WeakPolarHBondContact O-CB 3.13Å; E107-R111 VanDerWaalsContact O-CG 3.27Å; E107-R111 WeakPolarHBondContact O-CG 3.43Å; E107-R111 PolarHBondContact O-N 3.44Å; E107-R111 IonicContact OE2-CZ 3.06Å; E107-R111 VanDerWaalsContact OE2-CZ 3.29Å; E107-R111 IonicContact OE2-NH1 2.81Å; E107-R111 PolarHBondContact OE2-NH1 3.44Å; E107-R111 IonicContact OE2-NH2 3.41Å; E107-R111 PolarHBondContact OE2-NH2 2.75Å; R111-L115 VanDerWaalsContact O-CB 3.31Å; R111-L115 WeakPolarHBondContact O-CB 3.39Å; R111-L115 WeakPolarHBondContact O-CD1 3.34Å; R111-L115 PolarHBondContact O-N 3.22Å
112	V	52.6	Low	56.6	Low	69 Å²	69	90.2 Å²	90.2	42%	0.418	46%	0.462	S	S	.	.	H	α-helix	trans	-68.6	-41.7	175.1	169.1	0	0	0	0	110.9	M108 L109 H110 M116	M108-V112 WeakPolarHBondContact O-CB 3.48Å; M108-V112 WeakPolarHBondContact O-CG2 3.22Å; M108-V112 PolarHBondContact O-N 2.88Å; L109-V112 PolarHBondContact O-N 3.08Å; H110-V112 VanDerWaalsContact C-N 3.27Å; H110-V112 PolarHBondContact O-N 3.04Å; V112-M116 HydrophobicContact CG1-CG 4.5Å; V112-M116 HydrophobicContact CG1-SD 4.42Å; V112-M116 WeakPolarHBondContact O-CB 3.4Å; V112-M116 WeakPolarHBondContact O-CG 3.31Å; V112-M116 PolarHBondContact O-N 2.82Å
113	I	64.4	Low	56.7	Low	79 Å²	79	89.3 Å²	89.3	41%	0.405	46%	0.463	S	S	.	.	H	α-helix	trans	-63.1	-44.5	175.2	-70.2	164.1	0	0	0	110.6	L109 H110 M116 S117	L109-I113 HydrophobicContact CD2-CD1 4.21Å; L109-I113 WeakPolarHBondContact O-CB 3.33Å; L109-I113 WeakPolarHBondContact O-CD1 3.43Å; L109-I113 VanDerWaalsContact O-CG1 3.22Å; L109-I113 WeakPolarHBondContact O-CG1 3.38Å; L109-I113 PolarHBondContact O-N 2.95Å; H110-I113 CarbonylContact O-C 3.49Å; H110-I113 PolarHBondContact O-N 3.31Å; H110-I113 VanDerWaalsContact O-N 3.08Å; I113-M116 CarbonylContact O-C 3.58Å; I113-M116 PolarHBondContact O-N 3.43Å; I113-S117 PolarHBondContact O-N 3.32Å
114	D	63.7	Low	56.7	Low	101 Å²	101	88.3 Å²	88.3	54%	0.54	47%	0.466	S	S	.	.	H	α-helix	trans	-65.6	-44.8	179.1	-69.1	-19.3	0	0	0	111.5	H110 M116 S117 S118	H110-D114 WeakPolarHBondContact O-CB 3.13Å; H110-D114 VanDerWaalsContact O-CG 3.24Å; H110-D114 PolarHBondContact O-N 3.19Å; D114-M116 VanDerWaalsContact C-N 3.26Å; D114-M116 PolarHBondContact O-N 3.11Å; D114-S117 PolarHBondContact O-N 3.41Å; D114-S118 WeakPolarHBondContact O-CB 3.43Å; D114-S118 PolarHBondContact O-N 3.44Å; D114-S118 PolarHBondContact O-OG 3.03Å
115	L	58	Low	56.9	Low	123 Å²	123	89.4 Å²	89.4	64%	0.644	47%	0.471	S	S	*	.	H	α-helix	trans	-62.6	-33.2	173.4	-103.7	124.1	0	0	0	112.3	R111 S118 A119	R111-L115 VanDerWaalsContact O-CB 3.31Å; R111-L115 WeakPolarHBondContact O-CB 3.39Å; R111-L115 WeakPolarHBondContact O-CD1 3.34Å; R111-L115 PolarHBondContact O-N 3.22Å; L115-S118 PolarHBondContact O-OG 2.95Å; L115-A119 WeakPolarHBondContact O-CB 3.2Å; L115-A119 PolarHBondContact O-N 3.37Å
116	M	52.3	Low	57.1	Low	98 Å²	98	90.9 Å²	90.9	48%	0.483	48%	0.481	S	S	.	.	H	α-helix	trans	-75.8	-33.4	175.9	-74.3	-165.2	-37.3	0	0	112.5	L39 V112 I113 D114 G120	L39-M116 HydrophobicContact CD2-SD 4.07Å; V112-M116 HydrophobicContact CG1-CG 4.5Å; V112-M116 HydrophobicContact CG1-SD 4.42Å; V112-M116 WeakPolarHBondContact O-CB 3.4Å; V112-M116 WeakPolarHBondContact O-CG 3.31Å; V112-M116 PolarHBondContact O-N 2.82Å; I113-M116 CarbonylContact O-C 3.58Å; I113-M116 PolarHBondContact O-N 3.43Å; D114-M116 VanDerWaalsContact C-N 3.26Å; D114-M116 PolarHBondContact O-N 3.11Å; M116-G120 PolarHBondContact O-N 3.1Å; M116-G120 VanDerWaalsContact O-N 3.16Å
117	S	65.9	Low	57	Low	68 Å²	68	92 Å²	92	48%	0.476	48%	0.484	S	S	.	.	H	α-helix	trans	-68.7	-48.8	172.8	-105.5	0	0	0	0	111	I113 D114 A119 G120 E121	I113-S117 PolarHBondContact O-N 3.32Å; D114-S117 PolarHBondContact O-N 3.41Å; S117-A119 VanDerWaalsContact C-N 3.33Å; S117-A119 PolarHBondContact O-N 3.22Å; S117-G120 WeakPolarHBondContact O-CA 3.45Å; S117-G120 PolarHBondContact O-N 3.27Å; S117-E121 PolarHBondContact O-N 3.07Å
118	S	58.3	Low	57.1	Low	62 Å²	62	95.3 Å²	95.3	43%	0.434	50%	0.499	S	S	.	.	H	α-helix	trans	-66.9	-34.4	-179.6	71.7	0	0	0	0	112.3	D114 L115 G120 E121 A122	D114-S118 WeakPolarHBondContact O-CB 3.43Å; D114-S118 PolarHBondContact O-N 3.44Å; D114-S118 PolarHBondContact O-OG 3.03Å; L115-S118 PolarHBondContact O-OG 2.95Å; S118-G120 VanDerWaalsContact C-N 3.29Å; S118-E121 PolarHBondContact O-N 2.83Å; S118-A122 PolarHBondContact O-N 2.97Å
119	A	58	Low	57.6	Low	48 Å²	48	96.1 Å²	96.1	40%	0.397	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-34.6	172	0	0	0	0	0	111.7	L115 S117 E123	L115-A119 WeakPolarHBondContact O-CB 3.2Å; L115-A119 PolarHBondContact O-N 3.37Å; S117-A119 VanDerWaalsContact C-N 3.33Å; S117-A119 PolarHBondContact O-N 3.22Å; A119-E123 WeakPolarHBondContact O-CB 3.45Å; A119-E123 WeakPolarHBondContact O-CG 3.33Å; A119-E123 PolarHBondContact O-N 3.16Å; A119-E123 VanDerWaalsContact O-N 3.1Å
120	G	54.9	Low	58	Low	22 Å²	22	100.1 Å²	100.1	23%	0.227	51%	0.511	C	S	.	.	H	α-helix	trans	-65.8	-43.5	173.9	0	0	0	0	0	112.6	M116 S117 S118 E123 I124	M116-G120 PolarHBondContact O-N 3.1Å; M116-G120 VanDerWaalsContact O-N 3.16Å; S117-G120 WeakPolarHBondContact O-CA 3.45Å; S117-G120 PolarHBondContact O-N 3.27Å; S118-G120 VanDerWaalsContact C-N 3.29Å; G120-E123 PolarHBondContact O-N 3.47Å; G120-I124 WeakPolarHBondContact O-CD1 3.36Å; G120-I124 VanDerWaalsContact O-CG1 3.23Å; G120-I124 WeakPolarHBondContact O-CG1 3.23Å; G120-I124 PolarHBondContact O-N 2.97Å; G120-I124 VanDerWaalsContact O-N 3.08Å
121	E	52.5	Low	57.7	Low	135 Å²	135	100.3 Å²	100.3	63%	0.631	51%	0.514	S	S	*	.	H	α-helix	trans	-64.5	-44.3	178.3	-70.3	173.8	-175.5	0	0	111.6	S117 S118 E123 I124 E125	S117-E121 PolarHBondContact O-N 3.07Å; S118-E121 PolarHBondContact O-N 2.83Å; E121-E123 PolarHBondContact O-N 3.45Å; E121-I124 PolarHBondContact O-N 3.24Å; E121-E125 PolarHBondContact O-N 3.25Å
122	A	54.6	Low	58	Low	48 Å²	48	101.2 Å²	101.2	40%	0.397	52%	0.524	S	S	.	.	H	α-helix	trans	-66.9	-35.8	178.1	0	0	0	0	0	113.2	S118 L126	S118-A122 PolarHBondContact O-N 2.97Å; A122-L126 WeakPolarHBondContact O-CG 3.49Å; A122-L126 PolarHBondContact O-N 3.08Å; A122-L126 VanDerWaalsContact O-N 3.15Å
123	E	54.9	Low	58.5	Low	135 Å²	135	103 Å²	103	63%	0.631	53%	0.531	S	S	*	.	H	α-helix	trans	-69.3	-33.6	174.9	-79.3	-175.9	173.2	0	0	112.2	A119 G120 E121 Q127	A119-E123 WeakPolarHBondContact O-CB 3.45Å; A119-E123 WeakPolarHBondContact O-CG 3.33Å; A119-E123 PolarHBondContact O-N 3.16Å; A119-E123 VanDerWaalsContact O-N 3.1Å; G120-E123 PolarHBondContact O-N 3.47Å; E121-E123 PolarHBondContact O-N 3.45Å; E123-Q127 WeakPolarHBondContact O-CG 3.48Å; E123-Q127 PolarHBondContact O-N 3.15Å
124	I	52	Low	58.2	Low	96 Å²	96	105 Å²	105	49%	0.492	54%	0.538	S	S	.	.	H	α-helix	trans	-69.4	-46.1	175.6	-68.3	165.6	0	0	0	110.1	G120 E121 L126 Q127 E128	G120-I124 WeakPolarHBondContact O-CD1 3.36Å; G120-I124 VanDerWaalsContact O-CG1 3.23Å; G120-I124 WeakPolarHBondContact O-CG1 3.23Å; G120-I124 PolarHBondContact O-N 2.97Å; G120-I124 VanDerWaalsContact O-N 3.08Å; E121-I124 PolarHBondContact O-N 3.24Å; I124-L126 VanDerWaalsContact C-N 3.35Å; I124-L126 PolarHBondContact O-N 3.03Å; I124-Q127 WeakPolarHBondContact O-CB 3.45Å; I124-Q127 PolarHBondContact O-N 3.39Å; I124-E128 HydrophobicContact CG2-CG 4.42Å; I124-E128 PolarHBondContact O-N 2.96Å
125	E	56.6	Low	58.3	Low	139 Å²	139	101.9 Å²	101.9	65%	0.65	53%	0.529	S	S	*	.	H	α-helix	trans	-62.9	-39.9	-178.8	-164.2	163.7	-155	0	0	112	E121 Q127 E128 E129	E121-E125 PolarHBondContact O-N 3.25Å; E125-Q127 VanDerWaalsContact C-N 3.3Å; E125-Q127 PolarHBondContact O-N 3.32Å; E125-E128 PolarHBondContact O-N 3.39Å; E125-E129 PolarHBondContact O-N 2.92Å
126	L	57.3	Low	58.4	Low	110 Å²	110	101 Å²	101	58%	0.576	53%	0.525	S	S	*	.	H	α-helix	trans	-68.2	-26.8	174.1	-71.1	174.6	0	0	0	113.5	A122 I124 R130	A122-L126 WeakPolarHBondContact O-CG 3.49Å; A122-L126 PolarHBondContact O-N 3.08Å; A122-L126 VanDerWaalsContact O-N 3.15Å; I124-L126 VanDerWaalsContact C-N 3.35Å; I124-L126 PolarHBondContact O-N 3.03Å; L126-R130 WeakPolarHBondContact O-CB 3.26Å; L126-R130 PolarHBondContact O-N 3.25Å
127	Q	50.9	Low	58.8	Low	128 Å²	128	102.9 Å²	102.9	60%	0.598	53%	0.533	S	S	*	.	H	α-helix	trans	-76.3	-40.4	173.4	-77.1	-171.7	2.2	0	0	111.4	E123 I124 E125 R130 I131	E123-Q127 WeakPolarHBondContact O-CG 3.48Å; E123-Q127 PolarHBondContact O-N 3.15Å; I124-Q127 WeakPolarHBondContact O-CB 3.45Å; I124-Q127 PolarHBondContact O-N 3.39Å; E125-Q127 VanDerWaalsContact C-N 3.3Å; E125-Q127 PolarHBondContact O-N 3.32Å; Q127-R130 PolarHBondContact O-N 2.97Å; Q127-I131 VanDerWaalsContact O-CG1 3.26Å; Q127-I131 WeakPolarHBondContact O-CG1 3.38Å; Q127-I131 PolarHBondContact O-N 3.31Å
128	E	59	Low	58.4	Low	120 Å²	120	105.6 Å²	105.6	56%	0.561	54%	0.538	S	S	*	.	H	α-helix	trans	-61.9	-46.5	175.3	-70.9	-178.4	167.4	0	0	111	I124 E125 R130 I131 E132	I124-E128 HydrophobicContact CG2-CG 4.42Å; I124-E128 PolarHBondContact O-N 2.96Å; E125-E128 PolarHBondContact O-N 3.39Å; E128-R130 VanDerWaalsContact C-N 3.32Å; E128-R130 PolarHBondContact O-N 3.35Å; E128-I131 PolarHBondContact O-N 3.41Å; E128-I131 VanDerWaalsContact O-N 3.15Å; E128-E132 PolarHBondContact O-N 2.95Å
129	E	65.6	Low	58.4	Low	112 Å²	112	108.1 Å²	108.1	52%	0.523	55%	0.546	S	S	.	.	H	α-helix	trans	-61.2	-39.3	176.2	-168.4	-179.2	-170.9	0	0	111.9	E125 E132 L133	E125-E129 PolarHBondContact O-N 2.92Å; E129-E132 PolarHBondContact O-N 3.15Å; E129-L133 HydrophobicContact CG-CD1 4.45Å; E129-L133 WeakPolarHBondContact O-CG 3.42Å; E129-L133 PolarHBondContact O-N 3.1Å
130	R	66.4	Low	58.4	Low	173 Å²	173	113.2 Å²	113.2	65%	0.653	56%	0.559	S	S	*	*	H	α-helix	trans	-65.1	-40.3	176.2	-174.4	-175.5	-65.1	-100.9	-0.8	112	L126 Q127 E128 Q134	L126-R130 WeakPolarHBondContact O-CB 3.26Å; L126-R130 PolarHBondContact O-N 3.25Å; Q127-R130 PolarHBondContact O-N 2.97Å; E128-R130 VanDerWaalsContact C-N 3.32Å; E128-R130 PolarHBondContact O-N 3.35Å; R130-Q134 WeakPolarHBondContact O-CG 3.33Å; R130-Q134 PolarHBondContact O-N 3.03Å; R130-Q134 VanDerWaalsContact O-N 3.1Å
131	I	56.3	Low	58.5	Low	112 Å²	112	118.2 Å²	118.2	57%	0.574	58%	0.58	S	S	*	*	H	α-helix	trans	-67	-41.4	178.3	-69.1	165.2	0	0	0	110.2	Q127 E128 Q134 G135	Q127-I131 VanDerWaalsContact O-CG1 3.26Å; Q127-I131 WeakPolarHBondContact O-CG1 3.38Å; Q127-I131 PolarHBondContact O-N 3.31Å; E128-I131 PolarHBondContact O-N 3.41Å; E128-I131 VanDerWaalsContact O-N 3.15Å; I131-Q134 PolarHBondContact O-N 3.38Å; I131-G135 PolarHBondContact O-N 3.4Å
132	E	64.8	Low	58.8	Low	147 Å²	147	118.9 Å²	118.9	69%	0.687	58%	0.581	S	S	*	*	H	α-helix	trans	-62.3	-43.8	176.2	-73.4	-169.1	168.8	0	0	112.4	E128 E129 Q134 G135 N136	E128-E132 PolarHBondContact O-N 2.95Å; E129-E132 PolarHBondContact O-N 3.15Å; E132-Q134 PolarHBondContact O-N 3.02Å; E132-G135 PolarHBondContact O-N 3.33Å; E132-N136 PolarHBondContact O-N 3.5Å
133	L	62	Low	58.9	Low	108 Å²	108	120.5 Å²	120.5	57%	0.565	59%	0.589	S	S	*	*	H	α-helix	trans	-63.5	-42	177.6	-71.3	174.1	0	0	0	112.2	E129 N136 E137	E129-L133 HydrophobicContact CG-CD1 4.45Å; E129-L133 WeakPolarHBondContact O-CG 3.42Å; E129-L133 PolarHBondContact O-N 3.1Å; L133-N136 PolarHBondContact O-N 3.36Å; L133-E137 PolarHBondContact O-N 3.07Å; L133-E137 VanDerWaalsContact O-N 3.11Å
134	Q	59.3	Low	59	Low	121 Å²	121	116.2 Å²	116.2	57%	0.565	58%	0.582	S	S	*	*	H	α-helix	trans	-64.8	-41.6	175.8	-73.8	-172	-58.8	0	0	112.1	R130 I131 E132 N136 E137 E138	R130-Q134 WeakPolarHBondContact O-CG 3.33Å; R130-Q134 PolarHBondContact O-N 3.03Å; R130-Q134 VanDerWaalsContact O-N 3.1Å; I131-Q134 PolarHBondContact O-N 3.38Å; E132-Q134 PolarHBondContact O-N 3.02Å; Q134-N136 VanDerWaalsContact C-N 3.3Å; Q134-N136 PolarHBondContact O-N 2.96Å; Q134-E137 PolarHBondContact O-N 3.4Å; Q134-E138 PolarHBondContact O-N 3.11Å; Q134-E138 VanDerWaalsContact O-N 3.07Å
135	G	65.4	Low	59	Low	34 Å²	34	119.6 Å²	119.6	35%	0.351	60%	0.595	S	S	.	*	H	α-helix	trans	-61.5	-37.9	176.2	0	0	0	0	0	112.8	I131 E132 L139	I131-G135 PolarHBondContact O-N 3.4Å; E132-G135 PolarHBondContact O-N 3.33Å; G135-L139 WeakPolarHBondContact O-CG 3.47Å; G135-L139 PolarHBondContact O-N 3.43Å; G135-L139 VanDerWaalsContact O-N 3.14Å
136	N	59.5	Low	58.6	Low	104 Å²	104	121.1 Å²	121.1	56%	0.556	60%	0.602	S	S	*	*	H	α-helix	trans	-73.2	-35	-179.9	-127.4	-4.7	0	0	0	112.9	E132 L133 Q134 K140	E132-N136 PolarHBondContact O-N 3.5Å; L133-N136 PolarHBondContact O-N 3.36Å; Q134-N136 VanDerWaalsContact C-N 3.3Å; Q134-N136 PolarHBondContact O-N 2.96Å; N136-K140 PolarHBondContact O-N 3.06Å
137	E	60.8	Low	58.2	Low	139 Å²	139	123.7 Å²	123.7	65%	0.65	61%	0.611	S	S	*	*	H	α-helix	trans	-67.7	-40.5	172.6	-74.9	-159.1	152.7	0	0	112.3	L133 Q134 L139 K140 L141	L133-E137 PolarHBondContact O-N 3.07Å; L133-E137 VanDerWaalsContact O-N 3.11Å; Q134-E137 PolarHBondContact O-N 3.4Å; E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 3.25Å; E137-K140 PolarHBondContact O-N 3.24Å; E137-L141 PolarHBondContact O-N 3.22Å
138	E	57.6	Low	58	Low	124 Å²	124	130.9 Å²	130.9	58%	0.579	64%	0.641	S	S	*	*	H	α-helix	trans	-64	-36.5	176.2	-75.8	-166.9	179.5	0	0	112.7	Q134 L141 K142	Q134-E138 PolarHBondContact O-N 3.11Å; Q134-E138 VanDerWaalsContact O-N 3.07Å; E138-L141 PolarHBondContact O-N 3.47Å; E138-K142 WeakPolarHBondContact O-CG 3.41Å; E138-K142 PolarHBondContact O-N 3.03Å
139	L	57.1	Low	58	Low	116 Å²	116	131.5 Å²	131.5	61%	0.607	65%	0.645	S	S	*	*	H	α-helix	trans	-65.1	-40.2	174.8	-77.1	167.7	0	0	0	112	G135 E137 K142 S143	G135-L139 WeakPolarHBondContact O-CG 3.47Å; G135-L139 PolarHBondContact O-N 3.43Å; G135-L139 VanDerWaalsContact O-N 3.14Å; E137-L139 VanDerWaalsContact C-N 3.32Å; E137-L139 PolarHBondContact O-N 3.25Å; L139-K142 PolarHBondContact O-N 3.14Å; L139-S143 PolarHBondContact O-N 3.43Å; L139-S143 VanDerWaalsContact O-N 3.08Å
140	K	59.3	Low	57.6	Low	155 Å²	155	132.5 Å²	132.5	67%	0.674	65%	0.651	S	S	*	*	H	α-helix	trans	-65.5	-40	175	-78.1	-176.4	179.3	176.4	0	112.5	N136 E137 S143 G144	N136-K140 PolarHBondContact O-N 3.06Å; E137-K140 PolarHBondContact O-N 3.24Å; K140-S143 PolarHBondContact O-N 3.08Å; K140-S143 PolarHBondContact O-OG 3.43Å; K140-G144 PolarHBondContact O-N 3.39Å
141	L	56.6	Low	57.1	Low	126 Å²	126	130.2 Å²	130.2	66%	0.66	65%	0.651	S	S	*	*	H	α-helix	trans	-67.2	-39	178.1	-110	94.5	0	0	0	112	E137 E138 G144 H145	E137-L141 PolarHBondContact O-N 3.22Å; E138-L141 PolarHBondContact O-N 3.47Å; L141-G144 PolarHBondContact O-N 3.42Å; L141-H145 PolarHBondContact O-N 3.05Å
142	K	58.8	Low	57.1	Low	150 Å²	150	131.3 Å²	131.3	65%	0.652	66%	0.656	S	S	*	*	H	α-helix	trans	-69.4	-34.8	177.5	-72.8	179	-177.1	168	0	112.6	E138 L139	E138-K142 WeakPolarHBondContact O-CG 3.41Å; E138-K142 PolarHBondContact O-N 3.03Å; L139-K142 PolarHBondContact O-N 3.14Å
143	S	57.6	Low	56.7	Low	81 Å²	81	130.3 Å²	130.3	57%	0.566	65%	0.654	S	S	*	*	H	α-helix	trans	-73.6	-30.7	175.2	78.6	0	0	0	0	112.9	L139 K140 H145	L139-S143 PolarHBondContact O-N 3.43Å; L139-S143 VanDerWaalsContact O-N 3.08Å; K140-S143 PolarHBondContact O-N 3.08Å; K140-S143 PolarHBondContact O-OG 3.43Å; S143-H145 VanDerWaalsContact C-N 3.27Å; S143-H145 PolarHBondContact O-N 3.47Å
144	G	56.2	Low	56.3	Low	46 Å²	46	131.8 Å²	131.8	47%	0.474	66%	0.66	S	S	.	*	H	α-helix	trans	-71.5	-16	177.8	0	0	0	0	0	114.7	K140 L141	K140-G144 PolarHBondContact O-N 3.39Å; L141-G144 PolarHBondContact O-N 3.42Å
145	H	52.4	Low	56.1	Low	166 Å²	166	132.6 Å²	132.6	77%	0.769	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	10.7	178.6	-87.6	-0.7	0	0	0	114.9	L141 S143	L141-H145 PolarHBondContact O-N 3.05Å; S143-H145 VanDerWaalsContact C-N 3.27Å; S143-H145 PolarHBondContact O-N 3.47Å
146	Q	47.9	Very low	55.4	Low	172 Å²	172	140.2 Å²	140.2	80%	0.804	69%	0.691	S	S	*	*	S	Bend	trans	-105.5	17.2	171.6	-109.5	178.5	-11.6	0	0	114.5
147	Q	48.7	Very low	55	Low	164 Å²	164	143.2 Å²	143.2	77%	0.766	70%	0.702	S	S	*	*			trans	-126.2	61.9	172.8	-68.6	-168.6	-23.1	0	0	112.1
148	F	47.4	Very low	54.5	Low	279 Å²	279	143.5 Å²	143.5	100%	1.224	71%	0.707	S	S	*	*			trans	-153.9	0	149.6	-76	-68.4	0	0	0	108.5

Retrieved 148 of 148 residues in 141 ms (Link to these results)

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