A0A3B3V0W8_9TELE Loading...

Mesencephalic astrocyte-derived neurotrophic factor

AlphaFold DB , UniProt , Accession A0A3B3V0W8, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 178 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	40.9	Very low	47.3	Very low	245 Å²	245	138.5 Å²	138.5	100%	1.207	84%	0.843	S	S	*	*				0	107.7	0	-69	-169.3	174	0	0	107.3
2	L	40	Very low	47.8	Very low	171 Å²	171	134.8 Å²	134.8	90%	0.895	84%	0.837	S	S	*	*			trans	-82.9	132.3	-177.4	-83.4	76.9	0	0	0	109.5
3	S	41.7	Very low	48.2	Very low	109 Å²	109	135.5 Å²	135.5	76%	0.762	83%	0.83	S	S	*	*			trans	-121.1	97	162.2	174.7	0	0	0	0	107.6
4	L	44.9	Very low	48.6	Very low	165 Å²	165	131.9 Å²	131.9	86%	0.864	82%	0.821	S	S	*	*			trans	-102.9	103.7	170.6	-131.9	75.7	0	0	0	107.5	G6	L4-G6 PolarHBondContact O-N 3.19Å
5	S	45.7	Very low	48.8	Very low	102 Å²	102	134.3 Å²	134.3	71%	0.713	83%	0.825	S	S	*	*			trans	-73.6	110.5	175.3	-51.7	0	0	0	0	109.1
6	G	49.8	Very low	48.8	Very low	76 Å²	76	135.4 Å²	135.4	78%	0.784	82%	0.823	S	S	*	*			trans	-74.7	120.8	176.8	0	0	0	0	0	111.7	L4	L4-G6 PolarHBondContact O-N 3.19Å
7	L	49.2	Very low	49.1	Very low	161 Å²	161	134.8 Å²	134.8	84%	0.843	82%	0.823	S	S	*	*			trans	-83.7	108.7	161.5	-90.8	88.3	0	0	0	108.8	V9	L7-V9 PolarHBondContact O-N 3.5Å
8	S	52.8	Low	49.2	Very low	124 Å²	124	130.2 Å²	130.2	87%	0.867	81%	0.807	S	S	*	*			trans	-73.9	110.1	162.8	-82.9	0	0	0	0	109.5	A10	S8-A10 PolarHBondContact O-N 3.01Å
9	V	50.1	Low	49.3	Very low	128 Å²	128	129.4 Å²	129.4	78%	0.776	80%	0.804	S	S	*	*			trans	-84.5	100.3	165.9	178.7	0	0	0	0	107.6	L7 L11	L7-V9 PolarHBondContact O-N 3.5Å; V9-L11 PolarHBondContact O-N 3.45Å
10	A	54.4	Low	49.4	Very low	95 Å²	95	129.5 Å²	129.5	79%	0.785	80%	0.803	S	S	*	*			trans	-75.2	105.3	169.9	0	0	0	0	0	108.9	S8 A12	S8-A10 PolarHBondContact O-N 3.01Å; A10-A12 PolarHBondContact O-N 3.38Å; A10-A12 VanDerWaalsContact O-N 3.11Å
11	L	50.9	Low	49.7	Very low	148 Å²	148	131.5 Å²	131.5	78%	0.775	80%	0.803	S	S	*	*			trans	-77.5	91.1	173	-169	68.6	0	0	0	108.7	V9 L13	V9-L11 PolarHBondContact O-N 3.45Å; L11-L13 HydrophobicContact CD2-CD1 4.36Å; L11-L13 PolarHBondContact O-N 3.21Å; L11-L13 VanDerWaalsContact O-N 3.08Å
12	A	53.6	Low	50.6	Low	93 Å²	93	121.8 Å²	121.8	77%	0.769	77%	0.766	S	S	*	*			trans	-70.2	100.2	171.5	0	0	0	0	0	109.2	A10 A14	A10-A12 PolarHBondContact O-N 3.38Å; A10-A12 VanDerWaalsContact O-N 3.11Å; A12-A14 PolarHBondContact O-N 3.05Å
13	L	53.1	Low	51.8	Low	144 Å²	144	115.3 Å²	115.3	75%	0.754	73%	0.732	S	S	*	*			trans	-70.7	93.8	172.3	-135.7	78.1	0	0	0	108.3	L11 L15	L11-L13 HydrophobicContact CD2-CD1 4.36Å; L11-L13 PolarHBondContact O-N 3.21Å; L11-L13 VanDerWaalsContact O-N 3.08Å; L13-L15 PolarHBondContact O-N 2.97Å
14	A	53.7	Low	53.2	Low	85 Å²	85	117.2 Å²	117.2	70%	0.702	73%	0.727	S	S	*	*			trans	-67.1	104.1	171.8	0	0	0	0	0	109.1	A12 L16	A12-A14 PolarHBondContact O-N 3.05Å; A14-L16 VanDerWaalsContact C-N 3.32Å; A14-L16 PolarHBondContact O-N 2.98Å
15	L	50.9	Low	54	Low	168 Å²	168	119.1 Å²	119.1	88%	0.88	73%	0.731	S	S	*	*			trans	-67.5	90.1	166.7	-81.3	153	0	0	0	108.4	L13	L13-L15 PolarHBondContact O-N 2.97Å
16	L	49.7	Very low	55	Low	152 Å²	152	116.3 Å²	116.3	80%	0.796	72%	0.718	S	S	*	*	P	Polyproline II helix	trans	-73	124.7	167	-70.1	172.1	0	0	0	108.5	A14 G18	A14-L16 VanDerWaalsContact C-N 3.32Å; A14-L16 PolarHBondContact O-N 2.98Å; L16-G18 PolarHBondContact O-N 3.48Å; L16-G18 VanDerWaalsContact O-N 3.14Å
17	P	53.1	Low	56.4	Low	125 Å²	125	115.2 Å²	115.2	81%	0.812	69%	0.693	S	S	*	*	P	Polyproline II helix	trans	-61.8	118.6	168.6	23.8	-29.2	0	0	0	108.1
18	G	52	Low	58.3	Low	53 Å²	53	107.5 Å²	107.5	55%	0.546	65%	0.653	S	S	.	*	P	Polyproline II helix	trans	-58.8	156.7	176.6	0	0	0	0	0	111.4	L16 V20	L16-G18 PolarHBondContact O-N 3.48Å; L16-G18 VanDerWaalsContact O-N 3.14Å; G18-V20 PolarHBondContact O-N 3.45Å; G18-V20 VanDerWaalsContact O-N 3.16Å
19	P	49.4	Very low	60	Low	114 Å²	114	104.4 Å²	104.4	74%	0.74	62%	0.624	S	S	*	*	P	Polyproline II helix	trans	-56.7	123.5	177.9	22.4	-30.8	0	0	0	109.8	E21	P19-E21 PolarHBondContact O-N 3.46Å
20	V	51.5	Low	62.1	Low	132 Å²	132	98.3 Å²	98.3	80%	0.8	59%	0.587	S	S	*	*			trans	-75.2	84.8	171.1	-149.2	0	0	0	0	106.1	G18 G22	G18-V20 PolarHBondContact O-N 3.45Å; G18-V20 VanDerWaalsContact O-N 3.16Å; V20-G22 PolarHBondContact O-N 2.93Å
21	E	55.4	Low	64	Low	172 Å²	172	93.8 Å²	93.8	80%	0.804	55%	0.55	S	S	*	.			trans	-68.9	85.4	169.3	-80	174.2	124.9	0	0	108.1	P19	P19-E21 PolarHBondContact O-N 3.46Å
22	G	60.6	Low	66.1	Low	40 Å²	40	88.6 Å²	88.6	41%	0.412	52%	0.524	S	S	.	.	P	Polyproline II helix	trans	-69.8	159.1	168.3	0	0	0	0	0	111.2	V20 K24 E103	V20-G22 PolarHBondContact O-N 2.93Å; G22-K24 PolarHBondContact O-N 2.88Å; G22-E103 VanDerWaalsContact CA-OE1 3.24Å; G22-E103 WeakPolarHBondContact CA-OE1 3.34Å
23	L	65.4	Low	68	Low	35 Å²	35	86 Å²	86	18%	0.183	50%	0.5	C	S	.	.	P	Polyproline II helix	trans	-55.7	128.2	170.3	-132.6	74.3	0	0	0	110	E27 C28 V32 C102 E103	L23-E27 HydrophobicContact CD2-CB 4.41Å; L23-E27 VanDerWaalsContact CD2-O 3.28Å; L23-E27 WeakPolarHBondContact CD2-O 3.36Å; L23-E27 HydrophobicContact CG-CB 3.96Å; L23-C28 VanDerWaalsContact CD1-SG 3.55Å; L23-C28 HydrophobicContact CD2-CB 3.86Å; L23-V32 HydrophobicContact CD2-CG2 3.91Å; L23-C102 HydrophobicContact CD2-CB 4.45Å; L23-E103 HydrophobicContact CB-CG 3.99Å; L23-E103 HydrophobicContact CD1-CB 4.1Å; L23-E103 HydrophobicContact CD1-CG 3.26Å; L23-E103 HydrophobicContact CG-CG 4.18Å; L23-E103 PolarHBondContact N-OE1 3.49Å
24	K	71.6	Confident	70	Confident	150 Å²	150	79.8 Å²	79.8	65%	0.652	47%	0.467	S	S	*	.	P	Polyproline II helix	trans	-71.3	153.1	174	-63.2	-179.6	-178.1	172.3	0	109.8	G22 G26 E27	G22-K24 PolarHBondContact O-N 2.88Å; K24-G26 PolarHBondContact O-N 3.46Å; K24-G26 VanDerWaalsContact O-N 3.17Å; K24-E27 HydrophobicContact CB-CG 4Å; K24-E27 WeakPolarHBondContact O-CB 3.3Å; K24-E27 PolarHBondContact O-N 3.25Å
25	E	62.1	Low	72	Confident	204 Å²	204	75.7 Å²	75.7	95%	0.953	43%	0.434	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	124.5	176.4	-83.9	-175	144.3	0	0	111.3	E27	E25-E27 VanDerWaalsContact C-N 3.34Å; E25-E27 PolarHBondContact O-N 2.62Å
26	G	66.7	Low	74	Confident	44 Å²	44	68.8 Å²	68.8	45%	0.454	40%	0.403	S	S	.	.	T	Hydrogen-bonded Turn	trans	82	-7.7	-178.1	0	0	0	0	0	115.4	K24 R116	K24-G26 PolarHBondContact O-N 3.46Å; K24-G26 VanDerWaalsContact O-N 3.17Å; G26-R116 PolarHBondContact O-NH1 3.12Å; G26-R116 PolarHBondContact O-NH2 2.86Å
27	E	78.5	Confident	76.1	Confident	52 Å²	52	67.9 Å²	67.9	24%	0.243	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	147	171.8	-76.1	-172.2	-178.3	0	0	111.9	L23 K24 E25 E29 K106	L23-E27 HydrophobicContact CD2-CB 4.41Å; L23-E27 VanDerWaalsContact CD2-O 3.28Å; L23-E27 WeakPolarHBondContact CD2-O 3.36Å; L23-E27 HydrophobicContact CG-CB 3.96Å; K24-E27 HydrophobicContact CB-CG 4Å; K24-E27 WeakPolarHBondContact O-CB 3.3Å; K24-E27 PolarHBondContact O-N 3.25Å; E25-E27 VanDerWaalsContact C-N 3.34Å; E25-E27 PolarHBondContact O-N 2.62Å; E27-E29 PolarHBondContact O-N 2.65Å; E27-K106 IonicContact OE1-NZ 3.51Å; E27-K106 IonicContact OE2-NZ 2.74Å; E27-K106 PolarHBondContact OE2-NZ 3.33Å
28	C	88.3	Confident	78.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	54.1	33.7	-176.8	-38.9	0	0	0	0	115.2	L23 V30 C31 V32 C102 C113	L23-C28 VanDerWaalsContact CD1-SG 3.55Å; L23-C28 HydrophobicContact CD2-CB 3.86Å; C28-V30 VanDerWaalsContact C-N 3.31Å; C28-V30 PolarHBondContact O-N 2.93Å; C28-V30 VanDerWaalsContact O-N 3.13Å; C28-C31 HydrophobicContact CB-CB 3.99Å; C28-C31 WeakPolarHBondContact O-CA 3.42Å; C28-C31 WeakPolarHBondContact O-CB 3.47Å; C28-C31 PolarHBondContact O-N 2.79Å; C28-V32 HydrophobicContact CB-CG2 4.31Å; C28-V32 PolarHBondContact O-N 2.99Å; C28-C102 HydrophobicContact CB-CB 4.04Å; C28-C113 HydrophobicContact CB-CB 3.77Å; C28-C113 WeakPolarHBondContact CB-SG 3.38Å; C28-C113 PolarHBondContact N-O 3.14Å; C28-C113 WeakPolarHBondContact SG-CB 3.29Å; C28-C113 CovalentContact SG-SG 2.01Å; C28-C113 PolarHBondContact SG-SG 2.92Å
29	E	90.1	Very high	80	Confident	58 Å²	58	62.7 Å²	62.7	27%	0.271	34%	0.341	S	S	.	.	H	α-helix	trans	-43.8	-49.1	-175.6	-172.3	-175.3	158.6	0	0	114.5	E27 S33 R116 Y117	E27-E29 PolarHBondContact O-N 2.65Å; E29-S33 WeakPolarHBondContact O-CB 3.39Å; E29-S33 PolarHBondContact O-N 3.34Å; E29-R116 WeakPolarHBondContact OE2-CD 3.45Å; E29-R116 IonicContact OE2-CZ 3.44Å; E29-R116 IonicContact OE2-NH1 2.84Å; E29-R116 PolarHBondContact OE2-NH1 3.33Å; E29-Y117 HydrophobicContact CG-CD2 4.05Å
30	V	93.1	Very high	82.1	Confident	0 Å²	0	62 Å²	62	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-67.3	-42.8	179.6	175.5	0	0	0	0	111.5	C28 F34 K66 E67 F70 L115 R116 Y117	C28-V30 VanDerWaalsContact C-N 3.31Å; C28-V30 PolarHBondContact O-N 2.93Å; C28-V30 VanDerWaalsContact O-N 3.13Å; V30-F34 WeakPolarHBondContact O-CB 3.37Å; V30-F34 PolarHBondContact O-N 2.88Å; V30-K66 HydrophobicContact CG1-CB 4.43Å; V30-K66 HydrophobicContact CG2-CB 4.14Å; V30-E67 HydrophobicContact CG1-CG 4.39Å; V30-F70 HydrophobicContact CG1-CB 3.95Å; V30-F70 HydrophobicContact CG1-CG 4.45Å; V30-L115 HydrophobicContact CB-CB 3.94Å; V30-L115 HydrophobicContact CG1-CB 4.43Å; V30-L115 HydrophobicContact CG2-CB 4Å; V30-L115 VanDerWaalsContact CG2-O 3.29Å; V30-L115 WeakPolarHBondContact CG2-O 3.35Å; V30-L115 PolarHBondContact N-O 3.11Å; V30-R116 VanDerWaalsContact CG2-C 3.45Å; V30-Y117 HydrophobicContact CB-CE2 4.3Å; V30-Y117 HydrophobicContact CG2-CD1 4.21Å; V30-Y117 HydrophobicContact CG2-CD2 3.89Å; V30-Y117 HydrophobicContact CG2-CE1 4.27Å; V30-Y117 HydrophobicContact CG2-CE2 3.93Å; V30-Y117 HydrophobicContact CG2-CG 4.03Å
31	C	94.8	Very high	83.9	Confident	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-60.5	-51	178	179.7	0	0	0	0	111.2	C28 L35 F70 C102 I112	C28-C31 HydrophobicContact CB-CB 3.99Å; C28-C31 WeakPolarHBondContact O-CA 3.42Å; C28-C31 WeakPolarHBondContact O-CB 3.47Å; C28-C31 PolarHBondContact O-N 2.79Å; C31-L35 VanDerWaalsContact O-CB 3.3Å; C31-L35 WeakPolarHBondContact O-CB 3.38Å; C31-L35 WeakPolarHBondContact O-CG 3.36Å; C31-L35 PolarHBondContact O-N 2.71Å; C31-F70 HydrophobicContact CB-CD2 4.19Å; C31-F70 HydrophobicContact CB-CE2 3.66Å; C31-F70 HydrophobicContact CB-CZ 4.3Å; C31-C102 HydrophobicContact CB-CB 4Å; C31-C102 WeakPolarHBondContact CB-SG 3.33Å; C31-C102 VanDerWaalsContact SG-CA 3.56Å; C31-C102 WeakPolarHBondContact SG-CB 3.16Å; C31-C102 CovalentContact SG-SG 2.05Å; C31-C102 PolarHBondContact SG-SG 3.34Å; C31-I112 HydrophobicContact CB-CG2 4.29Å
32	V	94.9	Very high	85.4	Confident	39 Å²	39	52.3 Å²	52.3	24%	0.236	28%	0.284	C	S	.	.	H	α-helix	trans	-66.6	-45.9	-176	175.8	0	0	0	0	111.1	L23 C28 G36 V98 D99 C102	L23-V32 HydrophobicContact CD2-CG2 3.91Å; C28-V32 HydrophobicContact CB-CG2 4.31Å; C28-V32 PolarHBondContact O-N 2.99Å; V32-G36 WeakPolarHBondContact O-CA 3.49Å; V32-G36 PolarHBondContact O-N 3.08Å; V32-V98 HydrophobicContact CB-CG1 4.49Å; V32-V98 HydrophobicContact CG1-CG1 4.43Å; V32-D99 WeakPolarHBondContact CG1-OD1 3.44Å; V32-C102 HydrophobicContact CG2-CB 4.08Å
33	S	93.3	Very high	86.4	Confident	38 Å²	38	54.8 Å²	54.8	27%	0.266	28%	0.283	S	S	.	.	H	α-helix	trans	-62.8	-48.2	178.4	167.6	0	0	0	0	112.3	E29 K37 Y117	E29-S33 WeakPolarHBondContact O-CB 3.39Å; E29-S33 PolarHBondContact O-N 3.34Å; S33-K37 WeakPolarHBondContact O-CG 3.29Å; S33-K37 PolarHBondContact O-N 3.4Å; S33-K37 VanDerWaalsContact O-N 3.1Å; S33-Y117 WeakPolarHBondContact OG-CE2 3.48Å; S33-Y117 PolarHBondContact OG-OH 2.93Å; S33-Y117 VanDerWaalsContact OG-OH 3.07Å
34	F	95.1	Very high	87.1	Confident	14 Å²	14	60 Å²	60	6%	0.061	31%	0.311	C	S	.	.	H	α-helix	trans	-67.1	-51.9	-177.1	-179.5	-97.1	0	0	0	111.6	V30 G36 K37 F38 L56 T63 E67 F70	V30-F34 WeakPolarHBondContact O-CB 3.37Å; V30-F34 PolarHBondContact O-N 2.88Å; F34-G36 VanDerWaalsContact C-N 3.29Å; F34-G36 PolarHBondContact O-N 2.9Å; F34-K37 PolarHBondContact O-N 3.34Å; F34-F38 WeakPolarHBondContact O-CB 3.43Å; F34-F38 PolarHBondContact O-N 2.84Å; F34-L56 HydrophobicContact CE1-CD1 3.95Å; F34-T63 HydrophobicContact CD2-CG2 4.4Å; F34-T63 HydrophobicContact CE2-CG2 3.45Å; F34-T63 VanDerWaalsContact CE2-CG2 3.45Å; F34-T63 HydrophobicContact CZ-CG2 4.01Å; F34-E67 HydrophobicContact CD2-CB 4.1Å; F34-E67 HydrophobicContact CD2-CG 3.93Å; F34-E67 HydrophobicContact CE2-CB 4.4Å; F34-F70 AromaticContact CD1-CD1 3.75Å; F34-F70 HydrophobicContact CD1-CD1 3.75Å; F34-F70 AromaticContact CD1-CE1 3.53Å; F34-F70 HydrophobicContact CD1-CE1 3.53Å; F34-F70 HydrophobicContact CE1-CD1 4.25Å; F34-F70 HydrophobicContact CE1-CE1 4.07Å; F34-F70 HydrophobicContact CG-CD1 4.29Å; F34-F70 HydrophobicContact CG-CE1 4.38Å
35	L	95.1	Very high	87.2	Confident	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-68	-29.9	179.8	-67.1	-176.2	0	0	0	112.4	C31 F38 Y39 L56 F70 V88 L92 V98 I101	C31-L35 VanDerWaalsContact O-CB 3.3Å; C31-L35 WeakPolarHBondContact O-CB 3.38Å; C31-L35 WeakPolarHBondContact O-CG 3.36Å; C31-L35 PolarHBondContact O-N 2.71Å; L35-F38 PolarHBondContact O-N 3.24Å; L35-Y39 VanDerWaalsContact O-CB 3.3Å; L35-Y39 WeakPolarHBondContact O-CB 3.48Å; L35-Y39 PolarHBondContact O-N 3.44Å; L35-L56 HydrophobicContact CD2-CD1 4.43Å; L35-F70 HydrophobicContact CD1-CZ 4.04Å; L35-F70 HydrophobicContact CD2-CE1 4.09Å; L35-F70 HydrophobicContact CD2-CZ 4.16Å; L35-F70 HydrophobicContact CG-CE1 4.19Å; L35-F70 HydrophobicContact CG-CZ 3.92Å; L35-V88 HydrophobicContact CD1-CG1 4.02Å; L35-V88 HydrophobicContact CD2-CG1 3.68Å; L35-L92 HydrophobicContact CD2-CD1 4.44Å; L35-V98 HydrophobicContact CB-CB 4.47Å; L35-V98 HydrophobicContact CB-CG1 3.53Å; L35-V98 HydrophobicContact CB-CG2 4.1Å; L35-V98 HydrophobicContact CD1-CG1 4.41Å; L35-I101 HydrophobicContact CD1-CG2 4.13Å
36	G	94.6	Very high	87.9	Confident	23 Å²	23	54.2 Å²	54.2	24%	0.237	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-51.7	172.5	0	0	0	0	0	111.7	V32 F34 F38 Y39 E40	V32-G36 WeakPolarHBondContact O-CA 3.49Å; V32-G36 PolarHBondContact O-N 3.08Å; F34-G36 VanDerWaalsContact C-N 3.29Å; F34-G36 PolarHBondContact O-N 2.9Å; G36-F38 VanDerWaalsContact C-N 3.29Å; G36-F38 PolarHBondContact O-N 3.23Å; G36-Y39 PolarHBondContact O-N 3.45Å; G36-E40 WeakPolarHBondContact O-CG 3.37Å; G36-E40 PolarHBondContact O-N 2.8Å
37	K	93.4	Very high	88.8	Confident	133 Å²	133	53.1 Å²	53.1	58%	0.578	29%	0.285	S	S	*	.	H	α-helix	trans	-59.6	-41.7	175.7	-69.6	172.6	-171.8	175.4	0	112	S33 F34 E40 S41	S33-K37 WeakPolarHBondContact O-CG 3.29Å; S33-K37 PolarHBondContact O-N 3.4Å; S33-K37 VanDerWaalsContact O-N 3.1Å; F34-K37 PolarHBondContact O-N 3.34Å; K37-E40 PolarHBondContact O-N 3.44Å; K37-S41 PolarHBondContact O-N 3.04Å; K37-S41 VanDerWaalsContact O-N 3.16Å
38	F	94.3	Very high	89.4	Confident	9 Å²	9	54.8 Å²	54.8	4%	0.039	30%	0.296	C	S	.	.	H	α-helix	trans	-64.5	-43.9	178	178.4	-109.4	0	0	0	112	F34 L35 G36 E40 S41 L42 V52 E55 L56 S59 L92	F34-F38 WeakPolarHBondContact O-CB 3.43Å; F34-F38 PolarHBondContact O-N 2.84Å; L35-F38 PolarHBondContact O-N 3.24Å; G36-F38 VanDerWaalsContact C-N 3.29Å; G36-F38 PolarHBondContact O-N 3.23Å; F38-E40 VanDerWaalsContact C-N 3.33Å; F38-E40 PolarHBondContact O-N 3.19Å; F38-S41 PolarHBondContact O-N 3.44Å; F38-S41 VanDerWaalsContact O-N 3.15Å; F38-S41 PolarHBondContact O-OG 2.84Å; F38-L42 HydrophobicContact CD1-CD1 3.96Å; F38-L42 HydrophobicContact CD2-CD1 4.43Å; F38-L42 HydrophobicContact CE1-CD1 3.33Å; F38-L42 HydrophobicContact CE1-CG 4.47Å; F38-L42 HydrophobicContact CE2-CD1 3.86Å; F38-L42 HydrophobicContact CE2-CG 4.34Å; F38-L42 HydrophobicContact CG-CD1 4.48Å; F38-L42 HydrophobicContact CZ-CD1 3.28Å; F38-L42 HydrophobicContact CZ-CG 4.22Å; F38-L42 PolarHBondContact O-N 2.7Å; F38-V52 HydrophobicContact CE1-CG1 3.91Å; F38-V52 HydrophobicContact CZ-CG1 4.27Å; F38-E55 HydrophobicContact CE2-CB 4.08Å; F38-E55 HydrophobicContact CZ-CB 4.2Å; F38-L56 HydrophobicContact CD1-CD1 4.2Å; F38-L56 HydrophobicContact CE1-CB 4.03Å; F38-L56 HydrophobicContact CE1-CD1 4.02Å; F38-L56 HydrophobicContact CE1-CG 4.48Å; F38-L56 HydrophobicContact CE2-CB 4.22Å; F38-L56 HydrophobicContact CE2-CD1 4.38Å; F38-L56 HydrophobicContact CG-CD1 4.44Å; F38-L56 HydrophobicContact CZ-CB 3.59Å; F38-L56 HydrophobicContact CZ-CD1 4.11Å; F38-L56 HydrophobicContact CZ-CG 4.41Å; F38-S59 WeakPolarHBondContact CD2-OG 3.22Å; F38-S59 WeakPolarHBondContact CE2-OG 2.98Å; F38-L92 HydrophobicContact CD1-CD1 3.81Å; F38-L92 HydrophobicContact CE1-CD1 3.81Å
39	Y	92.8	Very high	89.4	Confident	60 Å²	60	56.1 Å²	56.1	24%	0.235	31%	0.305	C	S	.	.	H	α-helix	trans	-60.6	-43.2	175.7	177.9	-99.1	0	0	0	111.6	L35 G36 S41 L42 K43 L92 H95	L35-Y39 VanDerWaalsContact O-CB 3.3Å; L35-Y39 WeakPolarHBondContact O-CB 3.48Å; L35-Y39 PolarHBondContact O-N 3.44Å; G36-Y39 PolarHBondContact O-N 3.45Å; Y39-S41 PolarHBondContact O-N 2.97Å; Y39-L42 CarbonylContact O-C 3.08Å; Y39-L42 PolarHBondContact O-N 3.34Å; Y39-K43 HydrophobicContact CE1-CB 4.16Å; Y39-K43 PolarHBondContact O-N 3.5Å; Y39-L92 HydrophobicContact CD2-CD2 4.01Å; Y39-H95 HydrophobicContact CE2-CB 4.28Å; Y39-H95 AromaticContact CE2-ND1 3.58Å; Y39-H95 AromaticContact CZ-ND1 3.83Å; Y39-H95 PolarHBondContact OH-ND1 3.15Å
40	E	92	Very high	89.4	Confident	99 Å²	99	56.4 Å²	56.4	46%	0.463	32%	0.318	S	S	.	.	H	α-helix	trans	-61.4	-32.3	176.5	-69.2	-60.2	127.4	0	0	112.9	G36 K37 F38 L42 K43	G36-E40 WeakPolarHBondContact O-CG 3.37Å; G36-E40 PolarHBondContact O-N 2.8Å; K37-E40 PolarHBondContact O-N 3.44Å; F38-E40 VanDerWaalsContact C-N 3.33Å; F38-E40 PolarHBondContact O-N 3.19Å; E40-L42 VanDerWaalsContact C-N 3.26Å; E40-L42 PolarHBondContact O-N 3.19Å; E40-K43 WeakPolarHBondContact OE2-CD 3.32Å; E40-K43 VanDerWaalsContact OE2-CE 3.31Å; E40-K43 WeakPolarHBondContact OE2-CE 3.4Å; E40-K43 IonicContact OE2-NZ 3.29Å; E40-K43 PolarHBondContact OE2-NZ 3.48Å
41	S	89.8	Confident	89.3	Confident	80 Å²	80	59.8 Å²	59.8	56%	0.559	34%	0.336	S	S	*	.	H	α-helix	trans	-72.4	-18.8	173.2	70.1	0	0	0	0	114	K37 F38 Y39	K37-S41 PolarHBondContact O-N 3.04Å; K37-S41 VanDerWaalsContact O-N 3.16Å; F38-S41 PolarHBondContact O-N 3.44Å; F38-S41 VanDerWaalsContact O-N 3.15Å; F38-S41 PolarHBondContact O-OG 2.84Å; Y39-S41 PolarHBondContact O-N 2.97Å
42	L	88	Confident	89.2	Confident	21 Å²	21	60 Å²	60	11%	0.11	34%	0.337	C	S	.	.	H	α-helix	trans	-107.3	-19.4	-175.6	-71.2	-179.2	0	0	0	114.2	F38 Y39 E40 D44 S45 V52 E55	F38-L42 HydrophobicContact CD1-CD1 3.96Å; F38-L42 HydrophobicContact CD2-CD1 4.43Å; F38-L42 HydrophobicContact CE1-CD1 3.33Å; F38-L42 HydrophobicContact CE1-CG 4.47Å; F38-L42 HydrophobicContact CE2-CD1 3.86Å; F38-L42 HydrophobicContact CE2-CG 4.34Å; F38-L42 HydrophobicContact CG-CD1 4.48Å; F38-L42 HydrophobicContact CZ-CD1 3.28Å; F38-L42 HydrophobicContact CZ-CG 4.22Å; F38-L42 PolarHBondContact O-N 2.7Å; Y39-L42 CarbonylContact O-C 3.08Å; Y39-L42 PolarHBondContact O-N 3.34Å; E40-L42 VanDerWaalsContact C-N 3.26Å; E40-L42 PolarHBondContact O-N 3.19Å; L42-D44 PolarHBondContact O-N 3.41Å; L42-S45 WeakPolarHBondContact O-CA 3.39Å; L42-S45 WeakPolarHBondContact O-CB 2.92Å; L42-S45 PolarHBondContact O-N 2.68Å; L42-S45 VanDerWaalsContact O-O 3.08Å; L42-V52 HydrophobicContact CD1-CG1 4.12Å; L42-V52 HydrophobicContact CD1-CG2 4.21Å; L42-E55 HydrophobicContact CD2-CB 4.28Å; L42-E55 HydrophobicContact CD2-CG 4.34Å
43	K	80.6	Confident	89.1	Confident	91 Å²	91	60.8 Å²	60.8	40%	0.396	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.7	-29.1	-170	70.5	-177.9	178.9	-178.9	0	114.4	Y39 E40 S45	Y39-K43 HydrophobicContact CE1-CB 4.16Å; Y39-K43 PolarHBondContact O-N 3.5Å; E40-K43 WeakPolarHBondContact OE2-CD 3.32Å; E40-K43 VanDerWaalsContact OE2-CE 3.31Å; E40-K43 WeakPolarHBondContact OE2-CE 3.4Å; E40-K43 IonicContact OE2-NZ 3.29Å; E40-K43 PolarHBondContact OE2-NZ 3.48Å; K43-S45 VanDerWaalsContact C-N 3.33Å
44	D	80.3	Confident	89	Confident	145 Å²	145	65.8 Å²	65.8	78%	0.775	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.9	-4	179.3	-59.9	-42.3	0	0	0	112.5	L42	L42-D44 PolarHBondContact O-N 3.41Å
45	S	74.8	Confident	88.9	Confident	62 Å²	62	68.4 Å²	68.4	43%	0.434	37%	0.367	S	S	.	.	S	Bend	trans	-102	129	176.1	-59.7	0	0	0	0	109.8	L42 K43 A47	L42-S45 WeakPolarHBondContact O-CA 3.39Å; L42-S45 WeakPolarHBondContact O-CB 2.92Å; L42-S45 PolarHBondContact O-N 2.68Å; L42-S45 VanDerWaalsContact O-O 3.08Å; K43-S45 VanDerWaalsContact C-N 3.33Å; S45-A47 PolarHBondContact O-N 3.13Å
46	N	76.5	Confident	88.8	Confident	170 Å²	170	68.4 Å²	68.4	91%	0.909	37%	0.367	S	S	*	.			trans	-74.8	54	170.1	-73.5	-54.3	0	0	0	111.1
47	A	85.4	Confident	88.7	Confident	22 Å²	22	71 Å²	71	18%	0.182	38%	0.375	C	S	.	.			trans	-75.1	127.6	-175.1	0	0	0	0	0	110.7	S45 D51 V52	S45-A47 PolarHBondContact O-N 3.13Å; A47-D51 HydrophobicContact CB-CB 3.94Å; A47-V52 HydrophobicContact CB-CG2 3.9Å
48	N	89.7	Confident	88.6	Confident	87 Å²	87	70.5 Å²	70.5	47%	0.465	37%	0.373	S	S	.	.			trans	-78.9	173	173	68.2	44.1	0	0	0	110.8	A50 D51 V52	N48-A50 PolarHBondContact O-N 3.31Å; N48-A50 VanDerWaalsContact O-N 3.11Å; N48-A50 WeakPolarHBondContact OD1-CA 3.43Å; N48-A50 WeakPolarHBondContact OD1-CB 3.35Å; N48-A50 PolarHBondContact OD1-N 3.07Å; N48-D51 PolarHBondContact N-OD2 3.39Å; N48-D51 PolarHBondContact ND2-OD2 3.47Å; N48-D51 PolarHBondContact O-N 3.42Å; N48-D51 VanDerWaalsContact O-N 3.09Å; N48-D51 PolarHBondContact OD1-N 3.32Å; N48-D51 PolarHBondContact OD1-OD2 2.99Å; N48-V52 WeakPolarHBondContact O-CG2 3.23Å; N48-V52 PolarHBondContact O-N 3.46Å
49	S	88.4	Confident	88.5	Confident	28 Å²	28	71.8 Å²	71.8	20%	0.196	38%	0.383	C	S	.	.	H	α-helix	trans	-53.6	-33.3	179.6	175.9	0	0	0	0	114.5	E53 K90	S49-E53 WeakPolarHBondContact O-CB 3.46Å; S49-E53 PolarHBondContact O-N 3.06Å; S49-E53 VanDerWaalsContact O-N 3.07Å; S49-K90 VanDerWaalsContact OG-CG 3.31Å; S49-K90 WeakPolarHBondContact OG-CG 2.94Å
50	A	90.3	Very high	88.5	Confident	64 Å²	64	69 Å²	69	53%	0.529	37%	0.372	S	S	.	.	H	α-helix	trans	-77.1	-37.8	180	0	0	0	0	0	111.5	N48 E53 K54	N48-A50 PolarHBondContact O-N 3.31Å; N48-A50 VanDerWaalsContact O-N 3.11Å; N48-A50 WeakPolarHBondContact OD1-CA 3.43Å; N48-A50 WeakPolarHBondContact OD1-CB 3.35Å; N48-A50 PolarHBondContact OD1-N 3.07Å; A50-E53 PolarHBondContact O-N 3.29Å; A50-K54 WeakPolarHBondContact O-CB 3.45Å; A50-K54 PolarHBondContact O-N 2Å
51	D	91.6	Very high	88.4	Confident	71 Å²	71	68.5 Å²	68.5	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-64.9	-45.1	174.2	-59	-38.4	0	0	0	110.7	A47 N48 E53 K54 E55	A47-D51 HydrophobicContact CB-CB 3.94Å; N48-D51 PolarHBondContact N-OD2 3.39Å; N48-D51 PolarHBondContact ND2-OD2 3.47Å; N48-D51 PolarHBondContact O-N 3.42Å; N48-D51 VanDerWaalsContact O-N 3.09Å; N48-D51 PolarHBondContact OD1-N 3.32Å; N48-D51 PolarHBondContact OD1-OD2 2.99Å; D51-E53 VanDerWaalsContact C-N 3.33Å; D51-E53 PolarHBondContact O-N 3.49Å; D51-K54 PolarHBondContact O-N 2.97Å; D51-E55 PolarHBondContact O-N 2.57Å
52	V	92.4	Very high	88.2	Confident	4 Å²	4	70.7 Å²	70.7	2%	0.024	39%	0.385	C	S	.	.	H	α-helix	trans	-59.7	-44.3	175.2	177	0	0	0	0	110.7	F38 L42 A47 N48 K54 E55 L56 L92	F38-V52 HydrophobicContact CE1-CG1 3.91Å; F38-V52 HydrophobicContact CZ-CG1 4.27Å; L42-V52 HydrophobicContact CD1-CG1 4.12Å; L42-V52 HydrophobicContact CD1-CG2 4.21Å; A47-V52 HydrophobicContact CB-CG2 3.9Å; N48-V52 WeakPolarHBondContact O-CG2 3.23Å; N48-V52 PolarHBondContact O-N 3.46Å; V52-K54 VanDerWaalsContact C-N 3.35Å; V52-K54 PolarHBondContact O-N 3.12Å; V52-E55 PolarHBondContact O-N 3.06Å; V52-L56 WeakPolarHBondContact O-CB 3.42Å; V52-L56 PolarHBondContact O-N 3.21Å; V52-L92 HydrophobicContact CG1-CB 4.04Å; V52-L92 HydrophobicContact CG1-CD1 4.23Å
53	E	92.2	Very high	88.2	Confident	56 Å²	56	70.5 Å²	70.5	26%	0.262	39%	0.385	S	S	.	.	H	α-helix	trans	-60.5	-44.7	177.4	-173.7	168.3	146.6	0	0	111.7	S49 A50 D51 L56 L57 I85	S49-E53 WeakPolarHBondContact O-CB 3.46Å; S49-E53 PolarHBondContact O-N 3.06Å; S49-E53 VanDerWaalsContact O-N 3.07Å; A50-E53 PolarHBondContact O-N 3.29Å; D51-E53 VanDerWaalsContact C-N 3.33Å; D51-E53 PolarHBondContact O-N 3.49Å; E53-L56 PolarHBondContact O-N 3.5Å; E53-L57 WeakPolarHBondContact O-CG 3.42Å; E53-L57 PolarHBondContact O-N 3.03Å; E53-I85 HydrophobicContact CG-CD1 3.67Å; E53-I85 HydrophobicContact CG-CG1 3.99Å; E53-I85 HydrophobicContact CG-CG2 4.12Å
54	K	92.1	Very high	88.5	Confident	143 Å²	143	74.8 Å²	74.8	62%	0.622	40%	0.404	S	S	*	.	H	α-helix	trans	-63.4	-47.1	178.3	-177.8	-175.8	174.1	-172.1	0	112.5	A50 D51 V52 L56 L57 K58	A50-K54 WeakPolarHBondContact O-CB 3.45Å; A50-K54 PolarHBondContact O-N 2Å; D51-K54 PolarHBondContact O-N 2.97Å; V52-K54 VanDerWaalsContact C-N 3.35Å; V52-K54 PolarHBondContact O-N 3.12Å; K54-L56 VanDerWaalsContact C-N 3.28Å; K54-L56 PolarHBondContact O-N 3.11Å; K54-L57 PolarHBondContact O-N 3.31Å; K54-K58 PolarHBondContact O-N 3.11Å; K54-K58 VanDerWaalsContact O-N 3.13Å
55	E	92.8	Very high	88.9	Confident	69 Å²	69	70.8 Å²	70.8	32%	0.322	40%	0.397	S	S	.	.	H	α-helix	trans	-68.3	-30.3	178.2	-69.9	-54.8	136.1	0	0	111.9	F38 L42 D51 V52 K58 S59	F38-E55 HydrophobicContact CE2-CB 4.08Å; F38-E55 HydrophobicContact CZ-CB 4.2Å; L42-E55 HydrophobicContact CD2-CB 4.28Å; L42-E55 HydrophobicContact CD2-CG 4.34Å; D51-E55 PolarHBondContact O-N 2.57Å; V52-E55 PolarHBondContact O-N 3.06Å; E55-K58 PolarHBondContact O-N 3.22Å; E55-K58 IonicContact OE2-NZ 2.72Å; E55-S59 WeakPolarHBondContact O-CB 3.41Å; E55-S59 PolarHBondContact O-N 2.95Å; E55-S59 PolarHBondContact O-OG 3.21Å
56	L	93.1	Very high	89.6	Confident	0 Å²	0	71.4 Å²	71.4	0%	0	39%	0.392	C	S	.	.	H	α-helix	trans	-67.3	-43.7	174.3	-176.7	57.2	0	0	0	111.4	F34 L35 F38 V52 E53 K54 K58 S59 C60 I74 A76 I85 V88	F34-L56 HydrophobicContact CE1-CD1 3.95Å; L35-L56 HydrophobicContact CD2-CD1 4.43Å; F38-L56 HydrophobicContact CD1-CD1 4.2Å; F38-L56 HydrophobicContact CE1-CB 4.03Å; F38-L56 HydrophobicContact CE1-CD1 4.02Å; F38-L56 HydrophobicContact CE1-CG 4.48Å; F38-L56 HydrophobicContact CE2-CB 4.22Å; F38-L56 HydrophobicContact CE2-CD1 4.38Å; F38-L56 HydrophobicContact CG-CD1 4.44Å; F38-L56 HydrophobicContact CZ-CB 3.59Å; F38-L56 HydrophobicContact CZ-CD1 4.11Å; F38-L56 HydrophobicContact CZ-CG 4.41Å; V52-L56 WeakPolarHBondContact O-CB 3.42Å; V52-L56 PolarHBondContact O-N 3.21Å; E53-L56 PolarHBondContact O-N 3.5Å; K54-L56 VanDerWaalsContact C-N 3.28Å; K54-L56 PolarHBondContact O-N 3.11Å; L56-K58 VanDerWaalsContact C-N 3.31Å; L56-K58 PolarHBondContact O-N 3.12Å; L56-S59 PolarHBondContact O-N 2.94Å; L56-C60 WeakPolarHBondContact O-CB 3.47Å; L56-C60 PolarHBondContact O-N 3.43Å; L56-C60 PolarHBondContact O-SG 3.02Å; L56-I74 HydrophobicContact CD2-CD1 4.11Å; L56-A76 HydrophobicContact CG-CB 4.47Å; L56-I85 HydrophobicContact CD2-CD1 4.12Å; L56-I85 HydrophobicContact CD2-CG1 3.8Å; L56-I85 HydrophobicContact CG-CD1 4.38Å; L56-V88 HydrophobicContact CD2-CB 4.21Å; L56-V88 HydrophobicContact CD2-CG1 3.78Å
57	L	92.3	Very high	90.4	Very high	76 Å²	76	65.3 Å²	65.3	40%	0.398	36%	0.358	S	S	.	.	H	α-helix	trans	-58.8	-43.6	174.5	-72.2	170.7	0	0	0	111.6	E53 K54 C60 S61 A76 I85	E53-L57 WeakPolarHBondContact O-CG 3.42Å; E53-L57 PolarHBondContact O-N 3.03Å; K54-L57 PolarHBondContact O-N 3.31Å; L57-C60 PolarHBondContact O-N 3.07Å; L57-S61 PolarHBondContact O-N 3.47Å; L57-A76 HydrophobicContact CD2-CB 4.28Å; L57-A76 WeakPolarHBondContact CD2-O 3.4Å; L57-I85 HydrophobicContact CD2-CD1 3.76Å; L57-I85 HydrophobicContact CG-CD1 3.85Å
58	K	92	Very high	90.7	Very high	123 Å²	123	67.5 Å²	67.5	54%	0.535	37%	0.367	S	S	.	.	H	α-helix	trans	-64.9	-44.5	176.3	-176.7	-176.3	172.5	-166.9	0	112	K54 E55 L56 C60 S61	K54-K58 PolarHBondContact O-N 3.11Å; K54-K58 VanDerWaalsContact O-N 3.13Å; E55-K58 PolarHBondContact O-N 3.22Å; E55-K58 IonicContact OE2-NZ 2.72Å; L56-K58 VanDerWaalsContact C-N 3.31Å; L56-K58 PolarHBondContact O-N 3.12Å; K58-C60 PolarHBondContact O-N 3.47Å; K58-S61 PolarHBondContact O-N 3.49Å; K58-S61 PolarHBondContact O-OG 2.87Å
59	S	92.5	Very high	90.8	Very high	36 Å²	36	69.9 Å²	69.9	25%	0.252	37%	0.369	S	S	.	.	H	α-helix	trans	-60.7	-39.7	176.3	-60.1	0	0	0	0	110.9	F38 E55 L56 D62 T63	F38-S59 WeakPolarHBondContact CD2-OG 3.22Å; F38-S59 WeakPolarHBondContact CE2-OG 2.98Å; E55-S59 WeakPolarHBondContact O-CB 3.41Å; E55-S59 PolarHBondContact O-N 2.95Å; E55-S59 PolarHBondContact O-OG 3.21Å; L56-S59 PolarHBondContact O-N 2.94Å; S59-D62 PolarHBondContact O-N 3.38Å; S59-T63 WeakPolarHBondContact O-CG2 3.48Å
60	C	92.3	Very high	91	Very high	1 Å²	1	68.5 Å²	68.5	1%	0.007	36%	0.36	C	S	.	.	H	α-helix	trans	-69.4	-32.7	178.6	-79.9	0	0	0	0	113.9	L56 L57 K58 D62 T63 C71 A76	L56-C60 WeakPolarHBondContact O-CB 3.47Å; L56-C60 PolarHBondContact O-N 3.43Å; L56-C60 PolarHBondContact O-SG 3.02Å; L57-C60 PolarHBondContact O-N 3.07Å; K58-C60 PolarHBondContact O-N 3.47Å; C60-D62 PolarHBondContact O-N 3.35Å; C60-T63 PolarHBondContact O-N 3.21Å; C60-T63 PolarHBondContact O-OG1 3.23Å; C60-C71 WeakPolarHBondContact CA-SG 3.46Å; C60-C71 HydrophobicContact CB-CB 3.53Å; C60-C71 WeakPolarHBondContact CB-SG 3.39Å; C60-C71 WeakPolarHBondContact SG-CB 3.06Å; C60-C71 CovalentContact SG-SG 2.03Å; C60-C71 PolarHBondContact SG-SG 3.17Å; C60-A76 HydrophobicContact CB-CB 4.09Å; C60-A76 WeakPolarHBondContact CB-O 3.4Å; C60-A76 WeakPolarHBondContact SG-CB 3.41Å
61	S	88.8	Confident	91.2	Very high	89 Å²	89	65.5 Å²	65.5	62%	0.622	33%	0.334	S	S	*	.	H	α-helix	trans	-65.6	-25.8	177.8	57.7	0	0	0	0	113.8	L57 K58	L57-S61 PolarHBondContact O-N 3.47Å; K58-S61 PolarHBondContact O-N 3.49Å; K58-S61 PolarHBondContact O-OG 2.87Å
62	D	86.9	Confident	91.2	Very high	126 Å²	126	67.2 Å²	67.2	67%	0.674	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.7	-10.3	-180	-65.3	-22.7	0	0	0	112.7	S59 C60	S59-D62 PolarHBondContact O-N 3.38Å; C60-D62 PolarHBondContact O-N 3.35Å
63	T	87.6	Confident	91.1	Very high	17 Å²	17	68.4 Å²	68.4	10%	0.104	34%	0.341	C	S	.	.			trans	-80.6	153.6	-175.4	64.2	0	0	0	0	113.1	F34 S59 C60 E67 N68	F34-T63 HydrophobicContact CD2-CG2 4.4Å; F34-T63 HydrophobicContact CE2-CG2 3.45Å; F34-T63 VanDerWaalsContact CE2-CG2 3.45Å; F34-T63 HydrophobicContact CZ-CG2 4.01Å; S59-T63 WeakPolarHBondContact O-CG2 3.48Å; C60-T63 PolarHBondContact O-N 3.21Å; C60-T63 PolarHBondContact O-OG1 3.23Å; T63-E67 HydrophobicContact CG2-CB 3.91Å; T63-N68 VanDerWaalsContact OG1-CA 3.31Å; T63-N68 WeakPolarHBondContact OG1-CA 3.35Å; T63-N68 PolarHBondContact OG1-N 3.21Å
64	K	85.9	Confident	91.2	Very high	182 Å²	182	65.8 Å²	65.8	79%	0.791	33%	0.328	S	S	*	.			trans	-134.1	164	175.4	-63.4	-176.6	-176.9	177.8	0	110.6	K66	K64-K66 PolarHBondContact O-N 2.99Å
65	G	88.9	Confident	91.1	Very high	61 Å²	61	59.5 Å²	59.5	63%	0.629	30%	0.304	S	S	*	.	H	α-helix	trans	64.6	-124.6	174.3	0	0	0	0	0	113.5	R69	G65-R69 PolarHBondContact O-N 3.33Å
66	K	90.2	Very high	91.1	Very high	74 Å²	74	56.3 Å²	56.3	32%	0.322	29%	0.29	S	S	.	.	H	α-helix	trans	-69.9	-34.8	-174.2	-59.6	-67.2	-173.3	174.1	0	112.9	V30 K64 R69 F70 R116 D118	V30-K66 HydrophobicContact CG1-CB 4.43Å; V30-K66 HydrophobicContact CG2-CB 4.14Å; K64-K66 PolarHBondContact O-N 2.99Å; K66-R69 PolarHBondContact O-N 3.34Å; K66-F70 PolarHBondContact O-N 2.82Å; K66-R116 WeakPolarHBondContact CD-O 3.42Å; K66-R116 WeakPolarHBondContact CE-O 3.34Å; K66-R116 WeakPolarHBondContact CG-O 3.5Å; K66-D118 WeakPolarHBondContact CE-OD1 3.37Å; K66-D118 IonicContact NZ-OD1 3.98Å
67	E	92.3	Very high	90.8	Very high	42 Å²	42	57.3 Å²	57.3	20%	0.196	30%	0.296	C	S	.	.	H	α-helix	trans	-69.8	-42.1	178.4	-67.2	178.9	169	0	0	110.9	V30 F34 T63 R69 F70 C71 Y117	V30-E67 HydrophobicContact CG1-CG 4.39Å; F34-E67 HydrophobicContact CD2-CB 4.1Å; F34-E67 HydrophobicContact CD2-CG 3.93Å; F34-E67 HydrophobicContact CE2-CB 4.4Å; T63-E67 HydrophobicContact CG2-CB 3.91Å; E67-R69 VanDerWaalsContact C-N 3.27Å; E67-R69 PolarHBondContact O-N 3.35Å; E67-F70 WeakPolarHBondContact O-CA 3.5Å; E67-F70 WeakPolarHBondContact O-CB 3.37Å; E67-F70 PolarHBondContact O-N 2.94Å; E67-F70 VanDerWaalsContact O-N 3.11Å; E67-C71 PolarHBondContact O-N 3.41Å; E67-C71 PolarHBondContact O-SG 3.35Å; E67-C71 VanDerWaalsContact O-SG 3.4Å; E67-Y117 HydrophobicContact CG-CE1 3.84Å; E67-Y117 WeakPolarHBondContact OE1-CE1 3.44Å; E67-Y117 PolarHBondContact OE1-OH 3.34Å
68	N	92	Very high	90.3	Very high	69 Å²	69	60.2 Å²	60.2	37%	0.369	32%	0.323	S	S	.	.	H	α-helix	trans	-60.7	-38.6	172.7	-177.8	70.4	0	0	0	111.9	T63 C71 Y72	T63-N68 VanDerWaalsContact OG1-CA 3.31Å; T63-N68 WeakPolarHBondContact OG1-CA 3.35Å; T63-N68 PolarHBondContact OG1-N 3.21Å; N68-C71 WeakPolarHBondContact O-CB 3.35Å; N68-C71 PolarHBondContact O-N 3.16Å; N68-Y72 PolarHBondContact O-N 2.8Å
69	R	91.4	Very high	89.6	Confident	136 Å²	136	59.6 Å²	59.6	51%	0.513	33%	0.325	S	S	.	.	H	α-helix	trans	-67.5	-36.5	175.8	-166.9	166.9	-176.7	122.5	-1.4	112.4	G65 K66 E67 Y72 Y73 L115	G65-R69 PolarHBondContact O-N 3.33Å; K66-R69 PolarHBondContact O-N 3.34Å; E67-R69 VanDerWaalsContact C-N 3.27Å; E67-R69 PolarHBondContact O-N 3.35Å; R69-Y72 PolarHBondContact O-N 2.65Å; R69-Y73 HydrophobicContact CG-CD2 4.45Å; R69-Y73 HydrophobicContact CG-CE2 3.85Å; R69-Y73 PolarHBondContact NE-OH 3.09Å; R69-Y73 PolarHBondContact NH2-OH 3.43Å; R69-Y73 VanDerWaalsContact O-CD2 3.32Å; R69-Y73 WeakPolarHBondContact O-CD2 3.48Å; R69-Y73 PolarHBondContact O-N 2.66Å; R69-Y73 VanDerWaalsContact O-N 3.13Å; R69-L115 HydrophobicContact CB-CD1 4.49Å; R69-L115 HydrophobicContact CB-CD2 4.46Å; R69-L115 HydrophobicContact CG-CD2 4.18Å
70	F	94.1	Very high	88.8	Confident	0 Å²	0	59 Å²	59	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-61.8	-49.4	170.7	168	-100.2	0	0	0	111.1	V30 C31 F34 L35 K66 E67 Y72 Y73 I74 L105 I112 L115	V30-F70 HydrophobicContact CG1-CB 3.95Å; V30-F70 HydrophobicContact CG1-CG 4.45Å; C31-F70 HydrophobicContact CB-CD2 4.19Å; C31-F70 HydrophobicContact CB-CE2 3.66Å; C31-F70 HydrophobicContact CB-CZ 4.3Å; F34-F70 AromaticContact CD1-CD1 3.75Å; F34-F70 HydrophobicContact CD1-CD1 3.75Å; F34-F70 AromaticContact CD1-CE1 3.53Å; F34-F70 HydrophobicContact CD1-CE1 3.53Å; F34-F70 HydrophobicContact CE1-CD1 4.25Å; F34-F70 HydrophobicContact CE1-CE1 4.07Å; F34-F70 HydrophobicContact CG-CD1 4.29Å; F34-F70 HydrophobicContact CG-CE1 4.38Å; L35-F70 HydrophobicContact CD1-CZ 4.04Å; L35-F70 HydrophobicContact CD2-CE1 4.09Å; L35-F70 HydrophobicContact CD2-CZ 4.16Å; L35-F70 HydrophobicContact CG-CE1 4.19Å; L35-F70 HydrophobicContact CG-CZ 3.92Å; K66-F70 PolarHBondContact O-N 2.82Å; E67-F70 WeakPolarHBondContact O-CA 3.5Å; E67-F70 WeakPolarHBondContact O-CB 3.37Å; E67-F70 PolarHBondContact O-N 2.94Å; E67-F70 VanDerWaalsContact O-N 3.11Å; F70-Y72 VanDerWaalsContact C-N 3.29Å; F70-Y72 PolarHBondContact O-N 2.9Å; F70-Y73 PolarHBondContact O-N 3.07Å; F70-I74 HydrophobicContact CD1-CD1 4.38Å; F70-I74 HydrophobicContact CD2-CG2 4.27Å; F70-I74 HydrophobicContact CE1-CD1 3.71Å; F70-I74 HydrophobicContact CE1-CG1 4.36Å; F70-I74 HydrophobicContact CE1-CG2 4.32Å; F70-I74 HydrophobicContact CE2-CG2 3.68Å; F70-I74 HydrophobicContact CZ-CD1 4.03Å; F70-I74 HydrophobicContact CZ-CG2 3.72Å; F70-I74 PolarHBondContact O-N 3.16Å; F70-L105 HydrophobicContact CE2-CD1 4.42Å; F70-I112 HydrophobicContact CD2-CG2 3.89Å; F70-I112 HydrophobicContact CE2-CG2 3.72Å; F70-L115 HydrophobicContact CB-CD1 3.71Å
71	C	93.8	Very high	87.4	Confident	0 Å²	0	64 Å²	64	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-55.5	-42.3	176.3	-73.2	0	0	0	0	112.5	C60 E67 N68 I74 G75 A76 T77	C60-C71 WeakPolarHBondContact CA-SG 3.46Å; C60-C71 HydrophobicContact CB-CB 3.53Å; C60-C71 WeakPolarHBondContact CB-SG 3.39Å; C60-C71 WeakPolarHBondContact SG-CB 3.06Å; C60-C71 CovalentContact SG-SG 2.03Å; C60-C71 PolarHBondContact SG-SG 3.17Å; E67-C71 PolarHBondContact O-N 3.41Å; E67-C71 PolarHBondContact O-SG 3.35Å; E67-C71 VanDerWaalsContact O-SG 3.4Å; N68-C71 WeakPolarHBondContact O-CB 3.35Å; N68-C71 PolarHBondContact O-N 3.16Å; C71-I74 WeakPolarHBondContact O-CG1 3.49Å; C71-I74 PolarHBondContact O-N 3.34Å; C71-G75 PolarHBondContact O-N 3.46Å; C71-A76 HydrophobicContact CB-CB 4.36Å; C71-A76 PolarHBondContact O-N 2.9Å; C71-T77 HydrophobicContact CB-CG2 3.89Å
72	Y	91.6	Very high	86.4	Confident	108 Å²	108	62.8 Å²	62.8	42%	0.424	35%	0.353	S	S	.	.	H	α-helix	trans	-59.4	-47.4	174	176	-95.9	0	0	0	111.9	N68 R69 F70 I74 G75	N68-Y72 PolarHBondContact O-N 2.8Å; R69-Y72 PolarHBondContact O-N 2.65Å; F70-Y72 VanDerWaalsContact C-N 3.29Å; F70-Y72 PolarHBondContact O-N 2.9Å; Y72-I74 PolarHBondContact O-N 2.83Å; Y72-G75 PolarHBondContact O-N 2.77Å
73	Y	91.4	Very high	85.8	Confident	29 Å²	29	65.4 Å²	65.4	11%	0.114	36%	0.358	C	S	.	.	H	α-helix	trans	-62.5	-42.2	179.1	-66.9	-36.2	0	0	0	112.5	R69 F70 G75 M84 Q111 I112 L115	R69-Y73 HydrophobicContact CG-CD2 4.45Å; R69-Y73 HydrophobicContact CG-CE2 3.85Å; R69-Y73 PolarHBondContact NE-OH 3.09Å; R69-Y73 PolarHBondContact NH2-OH 3.43Å; R69-Y73 VanDerWaalsContact O-CD2 3.32Å; R69-Y73 WeakPolarHBondContact O-CD2 3.48Å; R69-Y73 PolarHBondContact O-N 2.66Å; R69-Y73 VanDerWaalsContact O-N 3.13Å; F70-Y73 PolarHBondContact O-N 3.07Å; Y73-G75 PolarHBondContact O-N 2.74Å; Y73-M84 WeakPolarHBondContact O-CE 3.45Å; Y73-Q111 HydrophobicContact CE2-CB 4.23Å; Y73-I112 HydrophobicContact CD2-CG1 4.26Å; Y73-I112 HydrophobicContact CG-CG1 4.32Å; Y73-L115 HydrophobicContact CD2-CD1 3.74Å; Y73-L115 HydrophobicContact CD2-CG 4.39Å; Y73-L115 HydrophobicContact CE2-CD1 3.82Å; Y73-L115 HydrophobicContact CE2-CD2 4.12Å; Y73-L115 HydrophobicContact CE2-CG 4.06Å
74	I	92.5	Very high	85.7	Confident	0 Å²	0	66.3 Å²	66.3	0%	0	36%	0.362	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.8	0.3	179.3	65.6	163.9	0	0	0	113.9	L56 F70 C71 Y72 A76 M84 I85 V88 L105 I112	L56-I74 HydrophobicContact CD2-CD1 4.11Å; F70-I74 HydrophobicContact CD1-CD1 4.38Å; F70-I74 HydrophobicContact CD2-CG2 4.27Å; F70-I74 HydrophobicContact CE1-CD1 3.71Å; F70-I74 HydrophobicContact CE1-CG1 4.36Å; F70-I74 HydrophobicContact CE1-CG2 4.32Å; F70-I74 HydrophobicContact CE2-CG2 3.68Å; F70-I74 HydrophobicContact CZ-CD1 4.03Å; F70-I74 HydrophobicContact CZ-CG2 3.72Å; F70-I74 PolarHBondContact O-N 3.16Å; C71-I74 WeakPolarHBondContact O-CG1 3.49Å; C71-I74 PolarHBondContact O-N 3.34Å; Y72-I74 PolarHBondContact O-N 2.83Å; I74-A76 HydrophobicContact CD1-CB 3.88Å; I74-A76 HydrophobicContact CG1-CB 3.84Å; I74-M84 CarbonylContact O-C 3.18Å; I74-M84 WeakPolarHBondContact O-CB 3.33Å; I74-I85 WeakPolarHBondContact O-CA 3.5Å; I74-I85 PolarHBondContact O-N 2.01Å; I74-V88 HydrophobicContact CB-CG2 4.46Å; I74-V88 HydrophobicContact CD1-CG2 4.41Å; I74-V88 HydrophobicContact CG2-CG2 4.4Å; I74-L105 HydrophobicContact CG2-CD1 4.06Å; I74-L105 HydrophobicContact CG2-CD2 4.47Å; I74-I112 HydrophobicContact CG2-CD1 4.23Å
75	G	91.3	Very high	86	Confident	11 Å²	11	58 Å²	58	11%	0.113	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	80.1	23.1	179.6	0	0	0	0	0	114.6	C71 Y72 Y73	C71-G75 PolarHBondContact O-N 3.46Å; Y72-G75 PolarHBondContact O-N 2.77Å; Y73-G75 PolarHBondContact O-N 2.74Å
76	A	92.2	Very high	86.1	Confident	3 Å²	3	57.2 Å²	57.2	3%	0.025	31%	0.307	C	S	.	.			trans	-101.2	16.8	-177.4	0	0	0	0	0	113.6	L56 L57 C60 C71 I74 I85	L56-A76 HydrophobicContact CG-CB 4.47Å; L57-A76 HydrophobicContact CD2-CB 4.28Å; L57-A76 WeakPolarHBondContact CD2-O 3.4Å; C60-A76 HydrophobicContact CB-CB 4.09Å; C60-A76 WeakPolarHBondContact CB-O 3.4Å; C60-A76 WeakPolarHBondContact SG-CB 3.41Å; C71-A76 HydrophobicContact CB-CB 4.36Å; C71-A76 PolarHBondContact O-N 2.9Å; I74-A76 HydrophobicContact CD1-CB 3.88Å; I74-A76 HydrophobicContact CG1-CB 3.84Å; A76-I85 HydrophobicContact CB-CD1 3.82Å; A76-I85 HydrophobicContact CB-CG1 4.45Å
77	T	87.8	Confident	86.2	Confident	21 Å²	21	56 Å²	56	13%	0.129	30%	0.302	C	S	.	.	S	Bend	trans	-116.6	153.5	172.4	61.6	0	0	0	0	110.1	C71 D79 A80	C71-T77 HydrophobicContact CB-CG2 3.89Å; T77-D79 WeakPolarHBondContact CB-OD1 3.31Å; T77-D79 PolarHBondContact O-N 2.86Å; T77-D79 PolarHBondContact OG1-OD1 2.82Å; T77-A80 WeakPolarHBondContact O-CB 3.4Å; T77-A80 PolarHBondContact O-N 2.67Å; T77-A80 VanDerWaalsContact O-N 3.08Å
78	S	80.1	Confident	86.2	Confident	137 Å²	137	54 Å²	54	96%	0.958	29%	0.293	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	-20.2	-175.6	51.8	0	0	0	0	114.2
79	D	77.7	Confident	86.3	Confident	110 Å²	110	50.7 Å²	50.7	59%	0.588	28%	0.275	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-3	177.8	66.4	-36.4	0	0	0	113.4	T77	T77-D79 WeakPolarHBondContact CB-OD1 3.31Å; T77-D79 PolarHBondContact O-N 2.86Å; T77-D79 PolarHBondContact OG1-OD1 2.82Å
80	A	75.7	Confident	86.4	Confident	22 Å²	22	49 Å²	49	18%	0.182	27%	0.272	C	S	.	.			trans	-80.9	131.5	-177.5	0	0	0	0	0	112.2	T77 T82	T77-A80 WeakPolarHBondContact O-CB 3.4Å; T77-A80 PolarHBondContact O-N 2.67Å; T77-A80 VanDerWaalsContact O-N 3.08Å; A80-T82 VanDerWaalsContact C-N 3.34Å; A80-T82 PolarHBondContact O-N 3.21Å
81	A	63.5	Low	86.4	Confident	107 Å²	107	50 Å²	50	88%	0.884	28%	0.278	S	S	*	.			trans	-81.3	-8.8	-175	0	0	0	0	0	114.3
82	T	68.4	Low	86.3	Confident	64 Å²	64	50.3 Å²	50.3	39%	0.393	28%	0.28	S	S	.	.			trans	-109.9	145.8	-167.4	76.8	0	0	0	0	113	A80 M84	A80-T82 VanDerWaalsContact C-N 3.34Å; A80-T82 PolarHBondContact O-N 3.21Å; T82-M84 PolarHBondContact O-N 3.23Å
83	K	73.1	Confident	86.3	Confident	180 Å²	180	46.1 Å²	46.1	78%	0.783	27%	0.266	S	S	*	.			trans	-85.7	26.8	170	-66.9	-170.1	176.7	-174	0	112.7	I85 N86	K83-I85 PolarHBondContact O-N 3.48Å; K83-I85 VanDerWaalsContact O-N 3.16Å; K83-N86 PolarHBondContact O-N 3.19Å; K83-N86 PolarHBondContact O-ND2 3.46Å
84	M	87.1	Confident	86.4	Confident	37 Å²	37	52.9 Å²	52.9	18%	0.182	29%	0.293	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.1	-14.9	-177.7	-72.4	-150.1	-58.1	0	0	113.3	Y73 I74 T82 N86 E87 K108 I112	Y73-M84 WeakPolarHBondContact O-CE 3.45Å; I74-M84 CarbonylContact O-C 3.18Å; I74-M84 WeakPolarHBondContact O-CB 3.33Å; T82-M84 PolarHBondContact O-N 3.23Å; M84-N86 PolarHBondContact O-N 3.26Å; M84-N86 VanDerWaalsContact O-N 3.11Å; M84-E87 VanDerWaalsContact O-CB 3.29Å; M84-E87 WeakPolarHBondContact O-CB 3.33Å; M84-E87 PolarHBondContact O-N 2.87Å; M84-K108 HydrophobicContact SD-CB 4.4Å; M84-K108 HydrophobicContact SD-CD 4.4Å; M84-I112 HydrophobicContact CE-CD1 4.45Å
85	I	90.6	Very high	86.3	Confident	7 Å²	7	57.5 Å²	57.5	4%	0.036	31%	0.314	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.5	-30	176.1	-164.7	166.7	0	0	0	112.2	E53 L56 L57 I74 A76 K83 E87 V88 S89	E53-I85 HydrophobicContact CG-CD1 3.67Å; E53-I85 HydrophobicContact CG-CG1 3.99Å; E53-I85 HydrophobicContact CG-CG2 4.12Å; L56-I85 HydrophobicContact CD2-CD1 4.12Å; L56-I85 HydrophobicContact CD2-CG1 3.8Å; L56-I85 HydrophobicContact CG-CD1 4.38Å; L57-I85 HydrophobicContact CD2-CD1 3.76Å; L57-I85 HydrophobicContact CG-CD1 3.85Å; I74-I85 WeakPolarHBondContact O-CA 3.5Å; I74-I85 PolarHBondContact O-N 2.01Å; A76-I85 HydrophobicContact CB-CD1 3.82Å; A76-I85 HydrophobicContact CB-CG1 4.45Å; K83-I85 PolarHBondContact O-N 3.48Å; K83-I85 VanDerWaalsContact O-N 3.16Å; I85-E87 PolarHBondContact O-N 2.99Å; I85-V88 WeakPolarHBondContact O-CB 3.22Å; I85-V88 PolarHBondContact O-N 3.01Å; I85-S89 PolarHBondContact O-N 2.97Å; I85-S89 PolarHBondContact O-OG 3.38Å
86	N	91.3	Very high	86.4	Confident	44 Å²	44	59.4 Å²	59.4	24%	0.235	32%	0.324	C	S	.	.	H	α-helix	trans	-63.7	-26	174.6	-77.7	-81.3	0	0	0	113.8	K83 M84 V88 K90	K83-N86 PolarHBondContact O-N 3.19Å; K83-N86 PolarHBondContact O-ND2 3.46Å; M84-N86 PolarHBondContact O-N 3.26Å; M84-N86 VanDerWaalsContact O-N 3.11Å; N86-V88 PolarHBondContact O-N 2.92Å; N86-K90 WeakPolarHBondContact O-CB 3.39Å; N86-K90 WeakPolarHBondContact O-CG 3.06Å; N86-K90 PolarHBondContact O-N 3.13Å; N86-K90 WeakPolarHBondContact OD1-CE 3.41Å
87	E	92.4	Very high	86.4	Confident	48 Å²	48	63 Å²	63	22%	0.224	35%	0.347	C	S	.	.	H	α-helix	trans	-77.4	-6.7	176.1	-60.1	-72.2	179.4	0	0	112.1	M84 I85 P91 K104 L105 K108	M84-E87 VanDerWaalsContact O-CB 3.29Å; M84-E87 WeakPolarHBondContact O-CB 3.33Å; M84-E87 PolarHBondContact O-N 2.87Å; I85-E87 PolarHBondContact O-N 2.99Å; E87-P91 WeakPolarHBondContact O-CG 3.42Å; E87-K104 VanDerWaalsContact OE2-CE 3.3Å; E87-K104 WeakPolarHBondContact OE2-CE 3.44Å; E87-K104 IonicContact OE2-NZ 2.77Å; E87-K104 PolarHBondContact OE2-NZ 2.89Å; E87-L105 HydrophobicContact CB-CD2 4.2Å; E87-K108 VanDerWaalsContact CD-NZ 3.28Å; E87-K108 HydrophobicContact CG-CD 4.11Å; E87-K108 VanDerWaalsContact OE1-CE 3.28Å; E87-K108 WeakPolarHBondContact OE1-CE 3.43Å; E87-K108 IonicContact OE1-NZ 2.67Å; E87-K108 PolarHBondContact OE1-NZ 3.24Å; E87-K108 IonicContact OE2-NZ 2.82Å
88	V	93.4	Very high	86.7	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	35%	0.346	C	S	.	.	H	α-helix	trans	-110.4	-53.5	175.6	-178	0	0	0	0	110.1	L35 L56 I74 I85 N86 K90 P91 L92 I101 L105	L35-V88 HydrophobicContact CD1-CG1 4.02Å; L35-V88 HydrophobicContact CD2-CG1 3.68Å; L56-V88 HydrophobicContact CD2-CB 4.21Å; L56-V88 HydrophobicContact CD2-CG1 3.78Å; I74-V88 HydrophobicContact CB-CG2 4.46Å; I74-V88 HydrophobicContact CD1-CG2 4.41Å; I74-V88 HydrophobicContact CG2-CG2 4.4Å; I85-V88 WeakPolarHBondContact O-CB 3.22Å; I85-V88 PolarHBondContact O-N 3.01Å; N86-V88 PolarHBondContact O-N 2.92Å; V88-K90 PolarHBondContact O-N 2.94Å; V88-P91 VanDerWaalsContact O-CD 3.3Å; V88-P91 WeakPolarHBondContact O-CD 3.47Å; V88-P91 WeakPolarHBondContact O-CG 3.3Å; V88-L92 HydrophobicContact CG1-CD1 3.67Å; V88-L92 HydrophobicContact CG1-CG 4.36Å; V88-L92 WeakPolarHBondContact O-CB 3.24Å; V88-L92 VanDerWaalsContact O-CG 3.32Å; V88-L92 WeakPolarHBondContact O-CG 3.16Å; V88-L92 PolarHBondContact O-N 3.43Å; V88-I101 HydrophobicContact CG2-CG2 4.35Å; V88-L105 HydrophobicContact CG2-CD1 3.88Å; V88-L105 HydrophobicContact CG2-CD2 4.1Å; V88-L105 HydrophobicContact CG2-CG 4.45Å
89	S	93	Very high	87.2	Confident	0 Å²	0	60.1 Å²	60.1	0%	0	32%	0.321	C	S	.	.	H	α-helix	trans	-62.4	-44.6	-173.9	63	0	0	0	0	113.1	I85 S93	I85-S89 PolarHBondContact O-N 2.97Å; I85-S89 PolarHBondContact O-OG 3.38Å; S89-S93 WeakPolarHBondContact O-CB 3.16Å; S89-S93 PolarHBondContact O-N 3.41Å
90	K	93.1	Very high	88	Confident	100 Å²	100	59 Å²	59	44%	0.435	31%	0.31	S	S	.	.	H	α-helix	trans	-62	-57.8	178	-67.2	178.1	-179.5	179.8	0	112.7	S49 N86 V88 L92 S93 Y94	S49-K90 VanDerWaalsContact OG-CG 3.31Å; S49-K90 WeakPolarHBondContact OG-CG 2.94Å; N86-K90 WeakPolarHBondContact O-CB 3.39Å; N86-K90 WeakPolarHBondContact O-CG 3.06Å; N86-K90 PolarHBondContact O-N 3.13Å; N86-K90 WeakPolarHBondContact OD1-CE 3.41Å; V88-K90 PolarHBondContact O-N 2.94Å; K90-L92 VanDerWaalsContact C-N 3.3Å; K90-L92 PolarHBondContact O-N 3.49Å; K90-S93 PolarHBondContact O-N 2.94Å; K90-S93 VanDerWaalsContact O-N 3.16Å; K90-S93 PolarHBondContact O-OG 3.02Å; K90-Y94 HydrophobicContact CB-CE2 4.41Å; K90-Y94 WeakPolarHBondContact O-CD2 3.28Å; K90-Y94 PolarHBondContact O-N 2.83Å
91	P	93.9	Very high	88.8	Confident	21 Å²	21	58.1 Å²	58.1	14%	0.136	30%	0.302	C	S	.	.	H	α-helix	trans	-63.2	-34.3	-179.9	22.1	-30.8	0	0	0	113	E87 V88 S93 Y94 H95 V96 I101	E87-P91 WeakPolarHBondContact O-CG 3.42Å; V88-P91 VanDerWaalsContact O-CD 3.3Å; V88-P91 WeakPolarHBondContact O-CD 3.47Å; V88-P91 WeakPolarHBondContact O-CG 3.3Å; P91-S93 PolarHBondContact O-N 3.3Å; P91-Y94 CarbonylContact O-C 3.51Å; P91-Y94 PolarHBondContact O-N 3.27Å; P91-Y94 VanDerWaalsContact O-N 3.17Å; P91-H95 PolarHBondContact O-N 3.38Å; P91-V96 HydrophobicContact CB-CB 3.82Å; P91-V96 HydrophobicContact CB-CG1 4.29Å; P91-V96 HydrophobicContact CB-CG2 3.83Å; P91-V96 VanDerWaalsContact O-CB 3.3Å; P91-V96 WeakPolarHBondContact O-CB 3.29Å; P91-V96 WeakPolarHBondContact O-CG2 3.35Å; P91-V96 PolarHBondContact O-N 3Å; P91-I101 HydrophobicContact CB-CD1 3.9Å; P91-I101 HydrophobicContact CB-CG1 3.93Å; P91-I101 HydrophobicContact CG-CD1 3.98Å; P91-I101 HydrophobicContact CG-CG1 4.02Å; P91-I101 HydrophobicContact CG-CG2 4.42Å
92	L	92.5	Very high	90.3	Very high	7 Å²	7	53 Å²	53	4%	0.037	26%	0.26	C	S	.	.	H	α-helix	trans	-62.8	-40.2	173.1	-77.9	177.8	0	0	0	112.6	L35 F38 Y39 V52 V88 K90 Y94 H95 V98 I101	L35-L92 HydrophobicContact CD2-CD1 4.44Å; F38-L92 HydrophobicContact CD1-CD1 3.81Å; F38-L92 HydrophobicContact CE1-CD1 3.81Å; Y39-L92 HydrophobicContact CD2-CD2 4.01Å; V52-L92 HydrophobicContact CG1-CB 4.04Å; V52-L92 HydrophobicContact CG1-CD1 4.23Å; V88-L92 HydrophobicContact CG1-CD1 3.67Å; V88-L92 HydrophobicContact CG1-CG 4.36Å; V88-L92 WeakPolarHBondContact O-CB 3.24Å; V88-L92 VanDerWaalsContact O-CG 3.32Å; V88-L92 WeakPolarHBondContact O-CG 3.16Å; V88-L92 PolarHBondContact O-N 3.43Å; K90-L92 VanDerWaalsContact C-N 3.3Å; K90-L92 PolarHBondContact O-N 3.49Å; L92-Y94 PolarHBondContact O-N 2.82Å; L92-H95 WeakPolarHBondContact O-CA 3.37Å; L92-H95 PolarHBondContact O-N 3.46Å; L92-V98 HydrophobicContact CD2-CG2 4.24Å; L92-I101 HydrophobicContact CB-CD1 4.49Å; L92-I101 HydrophobicContact CD2-CD1 3.56Å; L92-I101 HydrophobicContact CG-CD1 3.63Å
93	S	91.8	Very high	91.4	Very high	20 Å²	20	51.3 Å²	51.3	14%	0.14	25%	0.248	C	C	.	.	H	α-helix	trans	-64.8	-19.9	176	73.5	0	0	0	0	113.7	S89 K90 P91	S89-S93 WeakPolarHBondContact O-CB 3.16Å; S89-S93 PolarHBondContact O-N 3.41Å; K90-S93 PolarHBondContact O-N 2.94Å; K90-S93 VanDerWaalsContact O-N 3.16Å; K90-S93 PolarHBondContact O-OG 3.02Å; P91-S93 PolarHBondContact O-N 3.3Å
94	Y	92.5	Very high	92.3	Very high	171 Å²	171	47.7 Å²	47.7	67%	0.671	23%	0.232	S	C	*	.	T	Hydrogen-bonded Turn	trans	-98	13.1	172.6	-54.8	-51.2	0	0	0	112.6	K90 P91 L92 V96	K90-Y94 HydrophobicContact CB-CE2 4.41Å; K90-Y94 WeakPolarHBondContact O-CD2 3.28Å; K90-Y94 PolarHBondContact O-N 2.83Å; P91-Y94 CarbonylContact O-C 3.51Å; P91-Y94 PolarHBondContact O-N 3.27Å; P91-Y94 VanDerWaalsContact O-N 3.17Å; L92-Y94 PolarHBondContact O-N 2.82Å; Y94-V96 PolarHBondContact O-N 3.34Å
95	H	90.6	Very high	92.6	Very high	98 Å²	98	46 Å²	46	45%	0.454	22%	0.224	S	C	.	.	T	Hydrogen-bonded Turn	trans	54	33.3	-178.2	-51.1	-78.2	0	0	0	113.9	Y39 P91 L92	Y39-H95 HydrophobicContact CE2-CB 4.28Å; Y39-H95 AromaticContact CE2-ND1 3.58Å; Y39-H95 AromaticContact CZ-ND1 3.83Å; Y39-H95 PolarHBondContact OH-ND1 3.15Å; P91-H95 PolarHBondContact O-N 3.38Å; L92-H95 WeakPolarHBondContact O-CA 3.37Å; L92-H95 PolarHBondContact O-N 3.46Å
96	V	93.1	Very high	92.6	Very high	50 Å²	50	49.3 Å²	49.3	30%	0.303	24%	0.238	S	C	.	.			trans	-64.5	133.6	171.6	177	0	0	0	0	108.6	P91 Y94 V98 K100 I101	P91-V96 HydrophobicContact CB-CB 3.82Å; P91-V96 HydrophobicContact CB-CG1 4.29Å; P91-V96 HydrophobicContact CB-CG2 3.83Å; P91-V96 VanDerWaalsContact O-CB 3.3Å; P91-V96 WeakPolarHBondContact O-CB 3.29Å; P91-V96 WeakPolarHBondContact O-CG2 3.35Å; P91-V96 PolarHBondContact O-N 3Å; Y94-V96 PolarHBondContact O-N 3.34Å; V96-V98 PolarHBondContact O-N 3.4Å; V96-K100 HydrophobicContact CG1-CB 4.08Å; V96-I101 HydrophobicContact CB-CD1 4.41Å; V96-I101 HydrophobicContact CB-CG1 4.37Å; V96-I101 HydrophobicContact CG1-CG1 4.03Å
97	P	92.4	Very high	92.6	Very high	79 Å²	79	55.9 Å²	55.9	51%	0.513	27%	0.265	S	S	.	.			trans	-55.7	138	178.5	-26.9	34.7	0	0	0	112.5	D99 K100 I101	P97-D99 PolarHBondContact O-N 2.63Å; P97-K100 WeakPolarHBondContact O-CB 3.46Å; P97-K100 PolarHBondContact O-N 3.34Å; P97-I101 PolarHBondContact O-N 3.1Å
98	V	93.9	Very high	92.4	Very high	19 Å²	19	58.7 Å²	58.7	12%	0.115	28%	0.276	C	S	.	.	H	α-helix	trans	-56.2	-38.9	-176.4	170.2	0	0	0	0	112.3	V32 L35 L92 V96 K100 I101 C102	V32-V98 HydrophobicContact CB-CG1 4.49Å; V32-V98 HydrophobicContact CG1-CG1 4.43Å; L35-V98 HydrophobicContact CB-CB 4.47Å; L35-V98 HydrophobicContact CB-CG1 3.53Å; L35-V98 HydrophobicContact CB-CG2 4.1Å; L35-V98 HydrophobicContact CD1-CG1 4.41Å; L92-V98 HydrophobicContact CD2-CG2 4.24Å; V96-V98 PolarHBondContact O-N 3.4Å; V98-K100 PolarHBondContact O-N 3.06Å; V98-I101 WeakPolarHBondContact O-CB 3.42Å; V98-I101 PolarHBondContact O-N 3.15Å; V98-C102 PolarHBondContact O-N 3.14Å; V98-C102 PolarHBondContact O-SG 3.01Å
99	D	92.2	Very high	92.2	Very high	79 Å²	79	60.4 Å²	60.4	42%	0.422	29%	0.285	S	S	.	.	H	α-helix	trans	-57.2	-40.1	178.6	-57.3	-49.3	0	0	0	111.9	V32 P97 C102 E103	V32-D99 WeakPolarHBondContact CG1-OD1 3.44Å; P97-D99 PolarHBondContact O-N 2.63Å; D99-C102 PolarHBondContact O-N 2.94Å; D99-E103 WeakPolarHBondContact O-CB 3.48Å; D99-E103 WeakPolarHBondContact O-CG 3.43Å; D99-E103 PolarHBondContact O-N 3.25Å
100	K	93.1	Very high	92	Very high	86 Å²	86	63.3 Å²	63.3	37%	0.374	31%	0.306	S	S	.	.	H	α-helix	trans	-71.2	-32.4	178.2	-64.4	-49.7	-171.5	-169.6	0	112.7	V96 P97 V98 E103 K104	V96-K100 HydrophobicContact CG1-CB 4.08Å; P97-K100 WeakPolarHBondContact O-CB 3.46Å; P97-K100 PolarHBondContact O-N 3.34Å; V98-K100 PolarHBondContact O-N 3.06Å; K100-E103 WeakPolarHBondContact CD-OE2 3.3Å; K100-E103 IonicContact NZ-OE1 2.66Å; K100-E103 PolarHBondContact NZ-OE1 3.46Å; K100-E103 IonicContact NZ-OE2 2.9Å; K100-E103 PolarHBondContact NZ-OE2 3.16Å; K100-K104 PolarHBondContact O-N 2.05Å; K100-K104 VanDerWaalsContact O-N 3.1Å
101	I	94.1	Very high	91.8	Very high	3 Å²	3	63 Å²	63	2%	0.015	31%	0.306	C	S	.	.	H	α-helix	trans	-66.9	-48.5	173.3	-58.4	177.8	0	0	0	109.3	L35 V88 P91 L92 V96 P97 V98 E103 K104 L105	L35-I101 HydrophobicContact CD1-CG2 4.13Å; V88-I101 HydrophobicContact CG2-CG2 4.35Å; P91-I101 HydrophobicContact CB-CD1 3.9Å; P91-I101 HydrophobicContact CB-CG1 3.93Å; P91-I101 HydrophobicContact CG-CD1 3.98Å; P91-I101 HydrophobicContact CG-CG1 4.02Å; P91-I101 HydrophobicContact CG-CG2 4.42Å; L92-I101 HydrophobicContact CB-CD1 4.49Å; L92-I101 HydrophobicContact CD2-CD1 3.56Å; L92-I101 HydrophobicContact CG-CD1 3.63Å; V96-I101 HydrophobicContact CB-CD1 4.41Å; V96-I101 HydrophobicContact CB-CG1 4.37Å; V96-I101 HydrophobicContact CG1-CG1 4.03Å; P97-I101 PolarHBondContact O-N 3.1Å; V98-I101 WeakPolarHBondContact O-CB 3.42Å; V98-I101 PolarHBondContact O-N 3.15Å; I101-E103 PolarHBondContact O-N 3.3Å; I101-K104 WeakPolarHBondContact O-CB 3.49Å; I101-K104 PolarHBondContact O-N 3.39Å; I101-K104 VanDerWaalsContact O-N 3.1Å; I101-L105 HydrophobicContact CG2-CD1 4.26Å; I101-L105 HydrophobicContact CG2-CG 4.47Å; I101-L105 WeakPolarHBondContact O-CG 3.42Å; I101-L105 PolarHBondContact O-N 2.98Å
102	C	93.9	Very high	91.6	Very high	0 Å²	0	62 Å²	62	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-63.1	-38.2	177.4	-64.9	0	0	0	0	112.5	L23 C28 C31 V32 V98 D99 K104 L105 K106	L23-C102 HydrophobicContact CD2-CB 4.45Å; C28-C102 HydrophobicContact CB-CB 4.04Å; C31-C102 HydrophobicContact CB-CB 4Å; C31-C102 WeakPolarHBondContact CB-SG 3.33Å; C31-C102 VanDerWaalsContact SG-CA 3.56Å; C31-C102 WeakPolarHBondContact SG-CB 3.16Å; C31-C102 CovalentContact SG-SG 2.05Å; C31-C102 PolarHBondContact SG-SG 3.34Å; V32-C102 HydrophobicContact CG2-CB 4.08Å; V98-C102 PolarHBondContact O-N 3.14Å; V98-C102 PolarHBondContact O-SG 3.01Å; D99-C102 PolarHBondContact O-N 2.94Å; C102-K104 VanDerWaalsContact C-N 3.32Å; C102-K104 PolarHBondContact O-N 2.9Å; C102-L105 PolarHBondContact O-N 3.41Å; C102-K106 WeakPolarHBondContact O-CB 3.48Å; C102-K106 PolarHBondContact O-N 3.5Å
103	E	92.4	Very high	91.5	Very high	29 Å²	29	62.2 Å²	62.2	14%	0.136	30%	0.301	C	S	.	.	H	α-helix	trans	-57.2	-43.6	170.7	-80.1	174.7	-158.6	0	0	111.8	G22 L23 D99 K100 I101 K106 K107	G22-E103 VanDerWaalsContact CA-OE1 3.24Å; G22-E103 WeakPolarHBondContact CA-OE1 3.34Å; L23-E103 HydrophobicContact CB-CG 3.99Å; L23-E103 HydrophobicContact CD1-CB 4.1Å; L23-E103 HydrophobicContact CD1-CG 3.26Å; L23-E103 HydrophobicContact CG-CG 4.18Å; L23-E103 PolarHBondContact N-OE1 3.49Å; D99-E103 WeakPolarHBondContact O-CB 3.48Å; D99-E103 WeakPolarHBondContact O-CG 3.43Å; D99-E103 PolarHBondContact O-N 3.25Å; K100-E103 WeakPolarHBondContact CD-OE2 3.3Å; K100-E103 IonicContact NZ-OE1 2.66Å; K100-E103 PolarHBondContact NZ-OE1 3.46Å; K100-E103 IonicContact NZ-OE2 2.9Å; K100-E103 PolarHBondContact NZ-OE2 3.16Å; I101-E103 PolarHBondContact O-N 3.3Å; E103-K106 WeakPolarHBondContact O-CB 3.09Å; E103-K106 PolarHBondContact O-N 3.44Å; E103-K107 PolarHBondContact O-N 2.85Å
104	K	92.1	Very high	91.4	Very high	104 Å²	104	67.2 Å²	67.2	45%	0.452	32%	0.323	S	S	.	.	H	α-helix	trans	-69.6	-40.3	179.3	-165.8	-174.3	-173.1	-164.2	0	111.7	E87 K100 I101 C102 K107	E87-K104 VanDerWaalsContact OE2-CE 3.3Å; E87-K104 WeakPolarHBondContact OE2-CE 3.44Å; E87-K104 IonicContact OE2-NZ 2.77Å; E87-K104 PolarHBondContact OE2-NZ 2.89Å; K100-K104 PolarHBondContact O-N 2.05Å; K100-K104 VanDerWaalsContact O-N 3.1Å; I101-K104 WeakPolarHBondContact O-CB 3.49Å; I101-K104 PolarHBondContact O-N 3.39Å; I101-K104 VanDerWaalsContact O-N 3.1Å; C102-K104 VanDerWaalsContact C-N 3.32Å; C102-K104 PolarHBondContact O-N 2.9Å; K104-K107 PolarHBondContact O-N 3.27Å
105	L	91.9	Very high	91.2	Very high	1 Å²	1	59.8 Å²	59.8	1%	0.005	29%	0.294	C	S	.	.	H	α-helix	trans	-63	-42	175.1	-70.9	175.6	0	0	0	111.4	F70 I74 E87 V88 I101 C102 K107 K108 D109 I112	F70-L105 HydrophobicContact CE2-CD1 4.42Å; I74-L105 HydrophobicContact CG2-CD1 4.06Å; I74-L105 HydrophobicContact CG2-CD2 4.47Å; E87-L105 HydrophobicContact CB-CD2 4.2Å; V88-L105 HydrophobicContact CG2-CD1 3.88Å; V88-L105 HydrophobicContact CG2-CD2 4.1Å; V88-L105 HydrophobicContact CG2-CG 4.45Å; I101-L105 HydrophobicContact CG2-CD1 4.26Å; I101-L105 HydrophobicContact CG2-CG 4.47Å; I101-L105 WeakPolarHBondContact O-CG 3.42Å; I101-L105 PolarHBondContact O-N 2.98Å; C102-L105 PolarHBondContact O-N 3.41Å; L105-K107 PolarHBondContact O-N 3.26Å; L105-K108 WeakPolarHBondContact O-CA 3.39Å; L105-K108 WeakPolarHBondContact O-CB 3.3Å; L105-K108 PolarHBondContact O-N 3.35Å; L105-D109 PolarHBondContact O-N 3.05Å; L105-I112 HydrophobicContact CB-CD1 3.99Å; L105-I112 HydrophobicContact CB-CG2 4.28Å; L105-I112 HydrophobicContact CD1-CG2 4.48Å; L105-I112 HydrophobicContact CD2-CD1 4.37Å
106	K	91.2	Very high	91	Very high	77 Å²	77	59.8 Å²	59.8	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-53.1	-39.6	175.3	-167.8	178.8	177.7	-174.7	0	112.9	E27 C102 E103 K108 D109 S110 C113	E27-K106 IonicContact OE1-NZ 3.51Å; E27-K106 IonicContact OE2-NZ 2.74Å; E27-K106 PolarHBondContact OE2-NZ 3.33Å; C102-K106 WeakPolarHBondContact O-CB 3.48Å; C102-K106 PolarHBondContact O-N 3.5Å; E103-K106 WeakPolarHBondContact O-CB 3.09Å; E103-K106 PolarHBondContact O-N 3.44Å; K106-K108 VanDerWaalsContact C-N 3.28Å; K106-K108 PolarHBondContact O-N 3.06Å; K106-D109 CarbonylContact O-C 3.16Å; K106-S110 PolarHBondContact O-N 2.88Å; K106-C113 HydrophobicContact CB-CB 4.33Å; K106-C113 WeakPolarHBondContact CB-SG 3.07Å; K106-C113 HydrophobicContact CD-CB 4.16Å; K106-C113 HydrophobicContact CG-CB 3.91Å
107	K	90.5	Very high	90.5	Very high	182 Å²	182	60.2 Å²	60.2	79%	0.791	29%	0.287	S	S	*	.	H	α-helix	trans	-70.3	-23.9	179.2	-68.2	176.4	-178	178.5	0	112.8	E103 K104 L105	E103-K107 PolarHBondContact O-N 2.85Å; K104-K107 PolarHBondContact O-N 3.27Å; L105-K107 PolarHBondContact O-N 3.26Å
108	K	89.2	Confident	89.6	Confident	106 Å²	106	60.6 Å²	60.6	46%	0.461	29%	0.285	S	S	.	.	H	α-helix	trans	-88.1	-42.7	176.5	-70.7	176.2	176.7	-99	0	111.6	M84 E87 L105 K106	M84-K108 HydrophobicContact SD-CB 4.4Å; M84-K108 HydrophobicContact SD-CD 4.4Å; E87-K108 VanDerWaalsContact CD-NZ 3.28Å; E87-K108 HydrophobicContact CG-CD 4.11Å; E87-K108 VanDerWaalsContact OE1-CE 3.28Å; E87-K108 WeakPolarHBondContact OE1-CE 3.43Å; E87-K108 IonicContact OE1-NZ 2.67Å; E87-K108 PolarHBondContact OE1-NZ 3.24Å; E87-K108 IonicContact OE2-NZ 2.82Å; L105-K108 WeakPolarHBondContact O-CA 3.39Å; L105-K108 WeakPolarHBondContact O-CB 3.3Å; L105-K108 PolarHBondContact O-N 3.35Å; K106-K108 VanDerWaalsContact C-N 3.28Å; K106-K108 PolarHBondContact O-N 3.06Å
109	D	88.8	Confident	88.4	Confident	36 Å²	36	68 Å²	68	19%	0.193	32%	0.315	C	S	.	.			trans	-147	110.5	178.2	-175.5	-11.4	0	0	0	109.3	L105 K106 Q111 I112	L105-D109 PolarHBondContact O-N 3.05Å; K106-D109 CarbonylContact O-C 3.16Å; D109-Q111 PolarHBondContact O-N 3.42Å; D109-Q111 WeakPolarHBondContact OD1-CB 3.49Å; D109-Q111 VanDerWaalsContact OD1-CG 3.26Å; D109-Q111 WeakPolarHBondContact OD1-CG 3.49Å; D109-Q111 PolarHBondContact OD1-N 2.85Å; D109-I112 HydrophobicContact CB-CD1 3.9Å; D109-I112 HydrophobicContact CB-CG1 4.08Å; D109-I112 WeakPolarHBondContact O-CB 3.47Å; D109-I112 PolarHBondContact O-N 3.33Å
110	S	89.3	Confident	87	Confident	62 Å²	62	72.8 Å²	72.8	43%	0.434	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-25.1	179.9	66	0	0	0	0	112.3	K106 I112 C113 E114	K106-S110 PolarHBondContact O-N 2.88Å; S110-I112 PolarHBondContact O-N 3.19Å; S110-C113 PolarHBondContact O-N 2.95Å; S110-E114 WeakPolarHBondContact O-CG 3.49Å; S110-E114 PolarHBondContact O-N 3.31Å; S110-E114 PolarHBondContact OG-OE1 3.11Å
111	Q	88.1	Confident	85.7	Confident	93 Å²	93	71 Å²	71	44%	0.435	33%	0.329	S	S	.	.	H	α-helix	trans	-63.9	-28.2	-177.8	-54.1	-168.9	-91.8	0	0	111.8	Y73 D109 C113 E114 L115	Y73-Q111 HydrophobicContact CE2-CB 4.23Å; D109-Q111 PolarHBondContact O-N 3.42Å; D109-Q111 WeakPolarHBondContact OD1-CB 3.49Å; D109-Q111 VanDerWaalsContact OD1-CG 3.26Å; D109-Q111 WeakPolarHBondContact OD1-CG 3.49Å; D109-Q111 PolarHBondContact OD1-N 2.85Å; Q111-C113 VanDerWaalsContact C-N 3.25Å; Q111-C113 PolarHBondContact O-N 2.92Å; Q111-E114 PolarHBondContact O-N 3.01Å; Q111-L115 PolarHBondContact O-N 2.94Å
112	I	90.8	Very high	84.5	Confident	0 Å²	0	74.3 Å²	74.3	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-55.8	-44	174.2	-67.6	174.8	0	0	0	110.6	C31 F70 Y73 I74 M84 L105 D109 S110 L115	C31-I112 HydrophobicContact CB-CG2 4.29Å; F70-I112 HydrophobicContact CD2-CG2 3.89Å; F70-I112 HydrophobicContact CE2-CG2 3.72Å; Y73-I112 HydrophobicContact CD2-CG1 4.26Å; Y73-I112 HydrophobicContact CG-CG1 4.32Å; I74-I112 HydrophobicContact CG2-CD1 4.23Å; M84-I112 HydrophobicContact CE-CD1 4.45Å; L105-I112 HydrophobicContact CB-CD1 3.99Å; L105-I112 HydrophobicContact CB-CG2 4.28Å; L105-I112 HydrophobicContact CD1-CG2 4.48Å; L105-I112 HydrophobicContact CD2-CD1 4.37Å; D109-I112 HydrophobicContact CB-CD1 3.9Å; D109-I112 HydrophobicContact CB-CG1 4.08Å; D109-I112 WeakPolarHBondContact O-CB 3.47Å; D109-I112 PolarHBondContact O-N 3.33Å; S110-I112 PolarHBondContact O-N 3.19Å; I112-L115 WeakPolarHBondContact O-CB 3.32Å
113	C	90.4	Very high	83.7	Confident	12 Å²	12	75.1 Å²	75.1	8%	0.081	35%	0.351	C	S	.	.	H	α-helix	trans	-87.6	-11.8	-176.1	-75.7	0	0	0	0	114.3	C28 K106 S110 Q111 L115	C28-C113 HydrophobicContact CB-CB 3.77Å; C28-C113 WeakPolarHBondContact CB-SG 3.38Å; C28-C113 PolarHBondContact N-O 3.14Å; C28-C113 WeakPolarHBondContact SG-CB 3.29Å; C28-C113 CovalentContact SG-SG 2.01Å; C28-C113 PolarHBondContact SG-SG 2.92Å; K106-C113 HydrophobicContact CB-CB 4.33Å; K106-C113 WeakPolarHBondContact CB-SG 3.07Å; K106-C113 HydrophobicContact CD-CB 4.16Å; K106-C113 HydrophobicContact CG-CB 3.91Å; S110-C113 PolarHBondContact O-N 2.95Å; Q111-C113 VanDerWaalsContact C-N 3.25Å; Q111-C113 PolarHBondContact O-N 2.92Å; C113-L115 VanDerWaalsContact C-N 3.3Å
114	E	88.6	Confident	82.8	Confident	125 Å²	125	76.2 Å²	76.2	58%	0.584	36%	0.36	S	S	*	.	H	α-helix	trans	-77.9	-17.7	170.2	-68	169.4	-156.1	0	0	111.9	S110 Q111 R116	S110-E114 WeakPolarHBondContact O-CG 3.49Å; S110-E114 PolarHBondContact O-N 3.31Å; S110-E114 PolarHBondContact OG-OE1 3.11Å; Q111-E114 PolarHBondContact O-N 3.01Å; E114-R116 PolarHBondContact O-N 3.2Å
115	L	89.4	Confident	82	Confident	14 Å²	14	76.6 Å²	76.6	7%	0.073	37%	0.371	C	S	.	.			trans	-64.6	117.4	173.6	-67.8	178.2	0	0	0	110.7	V30 R69 F70 Y73 Q111 I112 C113	V30-L115 HydrophobicContact CB-CB 3.94Å; V30-L115 HydrophobicContact CG1-CB 4.43Å; V30-L115 HydrophobicContact CG2-CB 4Å; V30-L115 VanDerWaalsContact CG2-O 3.29Å; V30-L115 WeakPolarHBondContact CG2-O 3.35Å; V30-L115 PolarHBondContact N-O 3.11Å; R69-L115 HydrophobicContact CB-CD1 4.49Å; R69-L115 HydrophobicContact CB-CD2 4.46Å; R69-L115 HydrophobicContact CG-CD2 4.18Å; F70-L115 HydrophobicContact CB-CD1 3.71Å; Y73-L115 HydrophobicContact CD2-CD1 3.74Å; Y73-L115 HydrophobicContact CD2-CG 4.39Å; Y73-L115 HydrophobicContact CE2-CD1 3.82Å; Y73-L115 HydrophobicContact CE2-CD2 4.12Å; Y73-L115 HydrophobicContact CE2-CG 4.06Å; Q111-L115 PolarHBondContact O-N 2.94Å; I112-L115 WeakPolarHBondContact O-CB 3.32Å; C113-L115 VanDerWaalsContact C-N 3.3Å
116	R	86.7	Confident	81.4	Confident	99 Å²	99	78.3 Å²	78.3	37%	0.374	38%	0.382	S	S	.	.			trans	-115	145	171.3	-56.6	-50	-160.9	119.3	-9.2	110.1	G26 E29 V30 K66 E114	G26-R116 PolarHBondContact O-NH1 3.12Å; G26-R116 PolarHBondContact O-NH2 2.86Å; E29-R116 WeakPolarHBondContact OE2-CD 3.45Å; E29-R116 IonicContact OE2-CZ 3.44Å; E29-R116 IonicContact OE2-NH1 2.84Å; E29-R116 PolarHBondContact OE2-NH1 3.33Å; V30-R116 VanDerWaalsContact CG2-C 3.45Å; K66-R116 WeakPolarHBondContact CD-O 3.42Å; K66-R116 WeakPolarHBondContact CE-O 3.34Å; K66-R116 WeakPolarHBondContact CG-O 3.5Å; E114-R116 PolarHBondContact O-N 3.2Å
117	Y	81.4	Confident	80.9	Confident	58 Å²	58	77.6 Å²	77.6	23%	0.227	38%	0.382	C	S	.	.			trans	-62.2	144.6	162.4	-66.9	-74.2	0	0	0	107.8	E29 V30 S33 E67 K119	E29-Y117 HydrophobicContact CG-CD2 4.05Å; V30-Y117 HydrophobicContact CB-CE2 4.3Å; V30-Y117 HydrophobicContact CG2-CD1 4.21Å; V30-Y117 HydrophobicContact CG2-CD2 3.89Å; V30-Y117 HydrophobicContact CG2-CE1 4.27Å; V30-Y117 HydrophobicContact CG2-CE2 3.93Å; V30-Y117 HydrophobicContact CG2-CG 4.03Å; S33-Y117 WeakPolarHBondContact OG-CE2 3.48Å; S33-Y117 PolarHBondContact OG-OH 2.93Å; S33-Y117 VanDerWaalsContact OG-OH 3.07Å; E67-Y117 HydrophobicContact CG-CE1 3.84Å; E67-Y117 WeakPolarHBondContact OE1-CE1 3.44Å; E67-Y117 PolarHBondContact OE1-OH 3.34Å; Y117-K119 PolarHBondContact O-N 2.85Å
118	D	73.6	Confident	80.7	Confident	88 Å²	88	69.3 Å²	69.3	47%	0.471	35%	0.346	S	S	.	.			trans	-66.1	114.6	171.6	-71.7	-30.4	0	0	0	107.7	K66 Q120 K138	K66-D118 WeakPolarHBondContact CE-OD1 3.37Å; K66-D118 IonicContact NZ-OD1 3.98Å; D118-Q120 PolarHBondContact O-N 3.4Å; D118-K138 IonicContact OD1-NZ 3.98Å; D118-K138 IonicContact OD2-NZ 2.69Å; D118-K138 PolarHBondContact OD2-NZ 3.2Å
119	K	68.6	Low	80.5	Confident	173 Å²	173	71.7 Å²	71.7	75%	0.752	36%	0.356	S	S	*	.			trans	-56.4	117.5	173.1	-66.6	-172.7	178.9	-172.5	0	107.1	Y117 L121	Y117-K119 PolarHBondContact O-N 2.85Å; K119-L121 PolarHBondContact O-N 2.81Å; K119-L121 VanDerWaalsContact O-N 3.07Å
120	Q	62.1	Low	80.3	Confident	180 Å²	180	78 Å²	78	84%	0.841	38%	0.382	S	S	*	.			trans	-57.9	118.6	166.9	-69.8	-172	12.6	0	0	106.3	D118 D122	D118-Q120 PolarHBondContact O-N 3.4Å; Q120-D122 PolarHBondContact O-N 2.82Å
121	L	66.9	Low	80.2	Confident	48 Å²	48	75.8 Å²	75.8	25%	0.251	37%	0.365	S	S	.	.			trans	-70.1	108.2	177.3	-71.5	170.3	0	0	0	106.4	K119 L123 L131 D135 I139	K119-L121 PolarHBondContact O-N 2.81Å; K119-L121 VanDerWaalsContact O-N 3.07Å; L121-L123 VanDerWaalsContact C-N 3.31Å; L121-L123 HydrophobicContact CB-CD2 4.48Å; L121-L123 PolarHBondContact O-N 3.26Å; L121-L131 HydrophobicContact CD1-CD1 4.19Å; L121-L131 HydrophobicContact CD1-CD2 4.48Å; L121-L131 HydrophobicContact CD2-CD2 4Å; L121-D135 HydrophobicContact CD1-CB 3.93Å; L121-I139 HydrophobicContact CD1-CD1 3.91Å; L121-I139 HydrophobicContact CD1-CG1 3.93Å
122	D	69.7	Low	80.1	Confident	74 Å²	74	78.9 Å²	78.9	40%	0.396	38%	0.377	S	S	.	.			trans	-68	98.6	171.2	177.5	14	0	0	0	108.6	Q120 T124 T125 V126	Q120-D122 PolarHBondContact O-N 2.82Å; D122-T124 PolarHBondContact O-N 2.65Å; D122-T124 VanDerWaalsContact O-N 3.11Å; D122-T124 VanDerWaalsContact OD1-CB 3.3Å; D122-T124 WeakPolarHBondContact OD1-CB 2.99Å; D122-T124 WeakPolarHBondContact OD1-CG2 3.45Å; D122-T124 PolarHBondContact OD1-N 2.81Å; D122-T124 PolarHBondContact OD1-OG1 2.03Å; D122-T124 PolarHBondContact OD2-OG1 3.47Å; D122-T125 PolarHBondContact O-N 3.33Å; D122-T125 PolarHBondContact O-OG1 2.74Å; D122-T125 WeakPolarHBondContact OD2-CG2 3.22Å; D122-T125 PolarHBondContact OD2-OG1 3.23Å; D122-V126 WeakPolarHBondContact O-CB 3.31Å; D122-V126 WeakPolarHBondContact O-CG1 3.46Å; D122-V126 PolarHBondContact O-N 3.31Å; D122-V126 VanDerWaalsContact O-N 3.12Å
123	L	75.4	Confident	79.9	Confident	16 Å²	16	81.5 Å²	81.5	8%	0.084	39%	0.393	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.3	-13.2	180	-62.1	178.5	0	0	0	112	L121 V126 L128 I139 W143 A168 A171 R175	L121-L123 VanDerWaalsContact C-N 3.31Å; L121-L123 HydrophobicContact CB-CD2 4.48Å; L121-L123 PolarHBondContact O-N 3.26Å; L123-V126 HydrophobicContact CD2-CG1 4.36Å; L123-L128 HydrophobicContact CD2-CD2 4.37Å; L123-I139 HydrophobicContact CD1-CG2 4.1Å; L123-I139 HydrophobicContact CD2-CD1 3.53Å; L123-I139 HydrophobicContact CD2-CG1 4.01Å; L123-I139 HydrophobicContact CD2-CG2 4.27Å; L123-W143 HydrophobicContact CD1-CH2 4.03Å; L123-W143 HydrophobicContact CD1-CZ2 3.29Å; L123-A168 HydrophobicContact CD1-CB 4.01Å; L123-A171 HydrophobicContact CB-CB 3.66Å; L123-R175 PolarHBondContact O-NH1 3.33Å; L123-R175 PolarHBondContact O-NH2 3.34Å
124	T	73.4	Confident	79.6	Confident	53 Å²	53	89 Å²	89	33%	0.325	42%	0.424	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.7	-32	177.7	72	0	0	0	0	112.5	D122 A171	D122-T124 PolarHBondContact O-N 2.65Å; D122-T124 VanDerWaalsContact O-N 3.11Å; D122-T124 VanDerWaalsContact OD1-CB 3.3Å; D122-T124 WeakPolarHBondContact OD1-CB 2.99Å; D122-T124 WeakPolarHBondContact OD1-CG2 3.45Å; D122-T124 PolarHBondContact OD1-N 2.81Å; D122-T124 PolarHBondContact OD1-OG1 2.03Å; D122-T124 PolarHBondContact OD2-OG1 3.47Å; T124-A171 HydrophobicContact CG2-CB 3.86Å
125	T	75.7	Confident	79.5	Confident	112 Å²	112	85.6 Å²	85.6	69%	0.687	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.7	-22.6	-171.9	51.9	0	0	0	0	113.9	D122	D122-T125 PolarHBondContact O-N 3.33Å; D122-T125 PolarHBondContact O-OG1 2.74Å; D122-T125 WeakPolarHBondContact OD2-CG2 3.22Å; D122-T125 PolarHBondContact OD2-OG1 3.23Å
126	V	79.4	Confident	79.4	Confident	36 Å²	36	84.9 Å²	84.9	22%	0.218	41%	0.406	C	S	.	.			trans	-79.6	145.4	-174.4	80.2	0	0	0	0	112.4	D122 L123 L131 R175	D122-V126 WeakPolarHBondContact O-CB 3.31Å; D122-V126 WeakPolarHBondContact O-CG1 3.46Å; D122-V126 PolarHBondContact O-N 3.31Å; D122-V126 VanDerWaalsContact O-N 3.12Å; L123-V126 HydrophobicContact CD2-CG1 4.36Å; V126-L131 HydrophobicContact CG1-CD1 4.13Å; V126-L131 HydrophobicContact CG2-CD1 4.28Å; V126-L131 HydrophobicContact CG2-CD2 3.71Å; V126-L131 HydrophobicContact CG2-CG 4.04Å; V126-R175 PolarHBondContact O-NH2 3.01Å
127	D	81.9	Confident	79.4	Confident	63 Å²	63	85.5 Å²	85.5	34%	0.337	41%	0.412	S	S	.	.			trans	-90.8	116	170.5	178.8	-1.3	0	0	0	109.8	K129 K130 L131	D127-K129 PolarHBondContact O-N 3.07Å; D127-K129 VanDerWaalsContact O-N 3.14Å; D127-K129 VanDerWaalsContact OD1-CB 3.29Å; D127-K129 WeakPolarHBondContact OD1-CB 3.32Å; D127-K129 PolarHBondContact OD1-N 3.1Å; D127-K130 HydrophobicContact CB-CB 4.29Å; D127-K130 HydrophobicContact CB-CD 4.02Å; D127-K130 HydrophobicContact CB-CG 4.02Å; D127-K130 PolarHBondContact O-N 3.1Å; D127-K130 WeakPolarHBondContact OD2-CE 3.26Å; D127-L131 PolarHBondContact O-N 3.47Å
128	L	84.9	Confident	79.6	Confident	7 Å²	7	85.5 Å²	85.5	4%	0.037	41%	0.413	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-28.1	179.3	-59.9	-178.8	0	0	0	112.3	L123 K130 L131 L136 I139 I157 I160 M164	L123-L128 HydrophobicContact CD2-CD2 4.37Å; L128-K130 VanDerWaalsContact C-N 3.29Å; L128-K130 PolarHBondContact O-N 3.43Å; L128-L131 HydrophobicContact CD2-CD1 4.08Å; L128-L131 PolarHBondContact O-N 2.93Å; L128-L136 HydrophobicContact CB-CD2 4.38Å; L128-L136 HydrophobicContact CD2-CD2 4.32Å; L128-I139 HydrophobicContact CD2-CD1 4.4Å; L128-I157 HydrophobicContact CB-CG1 4.18Å; L128-I157 HydrophobicContact CB-CG2 4.03Å; L128-I157 HydrophobicContact CD1-CG2 4.06Å; L128-I160 HydrophobicContact CD1-CB 4.48Å; L128-I160 HydrophobicContact CD1-CG2 3.88Å; L128-I160 HydrophobicContact CD2-CG2 4.17Å; L128-M164 HydrophobicContact CD1-CE 3.87Å
129	K	85.2	Confident	80.2	Confident	156 Å²	156	81.4 Å²	81.4	68%	0.678	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.3	-24	177.1	-61.8	176.2	-177.7	171	0	112.4	D127 K153 I157	D127-K129 PolarHBondContact O-N 3.07Å; D127-K129 VanDerWaalsContact O-N 3.14Å; D127-K129 VanDerWaalsContact OD1-CB 3.29Å; D127-K129 WeakPolarHBondContact OD1-CB 3.32Å; D127-K129 PolarHBondContact OD1-N 3.1Å; K129-K153 WeakPolarHBondContact O-CE 3.48Å; K129-K153 PolarHBondContact O-NZ 3.43Å; K129-I157 HydrophobicContact CG-CD1 4.26Å
130	K	85.9	Confident	81	Confident	170 Å²	170	73.3 Å²	73.3	74%	0.739	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.2	-18.9	178.6	-65.7	-178.1	-172.1	174.2	0	113.3	D127 L128	D127-K130 HydrophobicContact CB-CB 4.29Å; D127-K130 HydrophobicContact CB-CD 4.02Å; D127-K130 HydrophobicContact CB-CG 4.02Å; D127-K130 PolarHBondContact O-N 3.1Å; D127-K130 WeakPolarHBondContact OD2-CE 3.26Å; L128-K130 VanDerWaalsContact C-N 3.29Å; L128-K130 PolarHBondContact O-N 3.43Å
131	L	85.3	Confident	82.2	Confident	15 Å²	15	70.9 Å²	70.9	8%	0.079	35%	0.349	C	S	.	.	S	Bend	trans	-68.3	152.2	178.2	-68.7	-178.3	0	0	0	112.7	L121 V126 D127 L128 D135 L136 I139 K153	L121-L131 HydrophobicContact CD1-CD1 4.19Å; L121-L131 HydrophobicContact CD1-CD2 4.48Å; L121-L131 HydrophobicContact CD2-CD2 4Å; V126-L131 HydrophobicContact CG1-CD1 4.13Å; V126-L131 HydrophobicContact CG2-CD1 4.28Å; V126-L131 HydrophobicContact CG2-CD2 3.71Å; V126-L131 HydrophobicContact CG2-CG 4.04Å; D127-L131 PolarHBondContact O-N 3.47Å; L128-L131 HydrophobicContact CD2-CD1 4.08Å; L128-L131 PolarHBondContact O-N 2.93Å; L131-D135 HydrophobicContact CB-CB 4.23Å; L131-D135 HydrophobicContact CD2-CB 4.28Å; L131-L136 HydrophobicContact CB-CD2 3.94Å; L131-L136 HydrophobicContact CB-CG 4.17Å; L131-L136 HydrophobicContact CD1-CD2 3.98Å; L131-I139 HydrophobicContact CD1-CD1 3.91Å; L131-K153 WeakPolarHBondContact O-CE 3.16Å; L131-K153 PolarHBondContact O-NZ 3.32Å
132	K	86.1	Confident	83	Confident	158 Å²	158	73.8 Å²	73.8	69%	0.687	36%	0.361	S	S	*	.			trans	-80.3	157.2	171.9	-64.8	178.8	-179.9	176	0	109.6	K134 D135 L136	K132-K134 PolarHBondContact O-N 3.21Å; K132-K134 VanDerWaalsContact O-N 3.12Å; K132-D135 WeakPolarHBondContact CB-OD2 3.08Å; K132-D135 PolarHBondContact N-OD2 3.49Å; K132-D135 WeakPolarHBondContact O-CB 3.07Å; K132-D135 PolarHBondContact O-N 3.17Å; K132-L136 PolarHBondContact O-N 3.35Å; K132-L136 VanDerWaalsContact O-N 3.11Å
133	V	87.4	Confident	83.7	Confident	54 Å²	54	72.2 Å²	72.2	33%	0.327	35%	0.35	S	S	.	.	H	α-helix	trans	-55.4	-33	177.4	175.3	0	0	0	0	112	D135 L136 K137 K153 F156	V133-D135 PolarHBondContact O-N 3.3Å; V133-L136 PolarHBondContact O-N 2.87Å; V133-K137 HydrophobicContact CG1-CD 4.22Å; V133-K137 HydrophobicContact CG1-CG 4.4Å; V133-K137 WeakPolarHBondContact O-CB 3.3Å; V133-K137 WeakPolarHBondContact O-CG 3.39Å; V133-K137 PolarHBondContact O-N 3.22Å; V133-K153 HydrophobicContact CG2-CB 3.97Å; V133-K153 HydrophobicContact CG2-CG 4.05Å; V133-F156 HydrophobicContact CG1-CD2 4.07Å; V133-F156 HydrophobicContact CG1-CE2 3.9Å; V133-F156 HydrophobicContact CG1-CZ 4.46Å
134	K	84.4	Confident	84	Confident	171 Å²	171	74.8 Å²	74.8	74%	0.743	38%	0.379	S	S	*	.	H	α-helix	trans	-60.8	-42.9	174.8	-175.8	179.1	177	179.3	0	112.5	K132 K137 K138	K132-K134 PolarHBondContact O-N 3.21Å; K132-K134 VanDerWaalsContact O-N 3.12Å; K134-K137 PolarHBondContact O-N 2.99Å; K134-K138 PolarHBondContact O-N 2.69Å
135	D	85.7	Confident	84.7	Confident	52 Å²	52	74.8 Å²	74.8	28%	0.278	38%	0.376	S	S	.	.	H	α-helix	trans	-70.6	-39.5	-179.5	-55.8	-37.6	0	0	0	110.6	L121 L131 K132 V133 K138 I139	L121-D135 HydrophobicContact CD1-CB 3.93Å; L131-D135 HydrophobicContact CB-CB 4.23Å; L131-D135 HydrophobicContact CD2-CB 4.28Å; K132-D135 WeakPolarHBondContact CB-OD2 3.08Å; K132-D135 PolarHBondContact N-OD2 3.49Å; K132-D135 WeakPolarHBondContact O-CB 3.07Å; K132-D135 PolarHBondContact O-N 3.17Å; V133-D135 PolarHBondContact O-N 3.3Å; D135-K138 WeakPolarHBondContact O-CB 3.48Å; D135-K138 PolarHBondContact O-N 3.37Å; D135-I139 WeakPolarHBondContact O-CG1 3.48Å; D135-I139 PolarHBondContact O-N 2.84Å; D135-I139 VanDerWaalsContact O-N 3.11Å
136	L	88.1	Confident	84.9	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-62.5	-44.2	174	-61.5	173.9	0	0	0	112.1	L128 L131 K132 V133 K138 I139 L140 K153 F156 I157 I160	L128-L136 HydrophobicContact CB-CD2 4.38Å; L128-L136 HydrophobicContact CD2-CD2 4.32Å; L131-L136 HydrophobicContact CB-CD2 3.94Å; L131-L136 HydrophobicContact CB-CG 4.17Å; L131-L136 HydrophobicContact CD1-CD2 3.98Å; K132-L136 PolarHBondContact O-N 3.35Å; K132-L136 VanDerWaalsContact O-N 3.11Å; V133-L136 PolarHBondContact O-N 2.87Å; L136-K138 PolarHBondContact O-N 3.04Å; L136-I139 PolarHBondContact O-N 3.45Å; L136-L140 PolarHBondContact O-N 3.16Å; L136-K153 HydrophobicContact CD1-CG 3.8Å; L136-F156 HydrophobicContact CB-CB 4Å; L136-F156 HydrophobicContact CD1-CB 4.05Å; L136-I157 HydrophobicContact CD1-CD1 4.43Å; L136-I157 HydrophobicContact CD1-CG1 3.78Å; L136-I157 HydrophobicContact CD2-CG1 4.22Å; L136-I160 HydrophobicContact CB-CD1 3.77Å; L136-I160 HydrophobicContact CD2-CD1 3.63Å; L136-I160 HydrophobicContact CG-CD1 4.28Å; L136-I160 WeakPolarHBondContact O-CD1 3.47Å
137	K	87.1	Confident	85.2	Confident	112 Å²	112	73.5 Å²	73.5	49%	0.487	37%	0.372	S	S	.	.	H	α-helix	trans	-60.5	-37.9	174.6	-76.8	177.7	177.6	-175.6	0	111.8	V133 K134 L140 D141 F156	V133-K137 HydrophobicContact CG1-CD 4.22Å; V133-K137 HydrophobicContact CG1-CG 4.4Å; V133-K137 WeakPolarHBondContact O-CB 3.3Å; V133-K137 WeakPolarHBondContact O-CG 3.39Å; V133-K137 PolarHBondContact O-N 3.22Å; K134-K137 PolarHBondContact O-N 2.99Å; K137-L140 PolarHBondContact O-N 3.41Å; K137-D141 WeakPolarHBondContact O-CB 3.33Å; K137-D141 PolarHBondContact O-N 3.41Å; K137-F156 HydrophobicContact CD-CE1 4.29Å; K137-F156 HydrophobicContact CD-CZ 4.34Å; K137-F156 HydrophobicContact CG-CD1 4.02Å; K137-F156 HydrophobicContact CG-CE1 3.58Å; K137-F156 HydrophobicContact CG-CZ 4.08Å
138	K	85.6	Confident	85.1	Confident	57 Å²	57	79.9 Å²	79.9	25%	0.248	40%	0.397	C	S	.	.	H	α-helix	trans	-64.4	-41.2	178.7	-167.2	-179.9	-174.2	179.5	0	112.6	D118 K134 D135 L136 L140 D141 E142	D118-K138 IonicContact OD1-NZ 3.98Å; D118-K138 IonicContact OD2-NZ 2.69Å; D118-K138 PolarHBondContact OD2-NZ 3.2Å; K134-K138 PolarHBondContact O-N 2.69Å; D135-K138 WeakPolarHBondContact O-CB 3.48Å; D135-K138 PolarHBondContact O-N 3.37Å; L136-K138 PolarHBondContact O-N 3.04Å; K138-L140 VanDerWaalsContact C-N 3.3Å; K138-L140 PolarHBondContact O-N 3.45Å; K138-D141 PolarHBondContact O-N 3Å; K138-E142 WeakPolarHBondContact CE-OE1 3.32Å; K138-E142 HydrophobicContact CG-CG 4.42Å; K138-E142 IonicContact NZ-OE1 3.88Å; K138-E142 WeakPolarHBondContact O-CB 3.49Å; K138-E142 WeakPolarHBondContact O-CG 3.34Å; K138-E142 PolarHBondContact O-N 3.06Å
139	I	85.4	Confident	85	Confident	2 Å²	2	83.1 Å²	83.1	1%	0.01	43%	0.433	C	S	.	.	H	α-helix	trans	-58.1	-45.2	175.8	-66.1	161.1	0	0	0	110.8	L121 L123 L128 L131 D135 L136 E142 W143 I160	L121-I139 HydrophobicContact CD1-CD1 3.91Å; L121-I139 HydrophobicContact CD1-CG1 3.93Å; L123-I139 HydrophobicContact CD1-CG2 4.1Å; L123-I139 HydrophobicContact CD2-CD1 3.53Å; L123-I139 HydrophobicContact CD2-CG1 4.01Å; L123-I139 HydrophobicContact CD2-CG2 4.27Å; L128-I139 HydrophobicContact CD2-CD1 4.4Å; L131-I139 HydrophobicContact CD1-CD1 3.91Å; D135-I139 WeakPolarHBondContact O-CG1 3.48Å; D135-I139 PolarHBondContact O-N 2.84Å; D135-I139 VanDerWaalsContact O-N 3.11Å; L136-I139 PolarHBondContact O-N 3.45Å; I139-E142 PolarHBondContact O-N 3.13Å; I139-W143 HydrophobicContact CG2-CD2 4.03Å; I139-W143 HydrophobicContact CG2-CE3 4.07Å; I139-W143 HydrophobicContact CG2-CH2 3.66Å; I139-W143 HydrophobicContact CG2-CZ2 3.61Å; I139-W143 HydrophobicContact CG2-CZ3 3.88Å; I139-W143 PolarHBondContact O-N 3.01Å; I139-I160 HydrophobicContact CB-CD1 4.24Å; I139-I160 HydrophobicContact CD1-CD1 4.26Å; I139-I160 HydrophobicContact CG2-CD1 4.37Å; I139-I160 HydrophobicContact CG2-CG1 4.27Å; I139-I160 HydrophobicContact CG2-CG2 4.17Å
140	L	86.5	Confident	85.1	Confident	4 Å²	4	76.7 Å²	76.7	2%	0.021	41%	0.407	C	S	.	.	H	α-helix	trans	-64.3	-44.3	177.6	-67.4	174.4	0	0	0	111.6	L136 K137 K138 E142 W143 G144 E145 C147 F156 K159 I160 L163	L136-L140 PolarHBondContact O-N 3.16Å; K137-L140 PolarHBondContact O-N 3.41Å; K138-L140 VanDerWaalsContact C-N 3.3Å; K138-L140 PolarHBondContact O-N 3.45Å; L140-E142 PolarHBondContact O-N 3.34Å; L140-W143 HydrophobicContact CD2-CE3 4.21Å; L140-W143 HydrophobicContact CD2-CZ3 4.45Å; L140-W143 CarbonylContact O-C 3.39Å; L140-W143 WeakPolarHBondContact O-CA 3.48Å; L140-W143 PolarHBondContact O-N 3.49Å; L140-W143 VanDerWaalsContact O-N 3.09Å; L140-G144 PolarHBondContact O-N 2.84Å; L140-G144 VanDerWaalsContact O-N 3.16Å; L140-E145 CarbonylContact C-O 3.52Å; L140-E145 WeakPolarHBondContact CB-O 3.33Å; L140-E145 HydrophobicContact CD2-CB 4.35Å; L140-E145 PolarHBondContact O-N 3.34Å; L140-C147 HydrophobicContact CD1-CB 3.94Å; L140-F156 HydrophobicContact CD1-CD1 3.93Å; L140-K159 HydrophobicContact CD2-CG 4.14Å; L140-I160 HydrophobicContact CD1-CG1 4.39Å; L140-I160 HydrophobicContact CD2-CG1 3.68Å; L140-I160 HydrophobicContact CG-CD1 4.37Å; L140-I160 HydrophobicContact CG-CG1 3.79Å; L140-L163 HydrophobicContact CD2-CD1 4.03Å
141	D	85.8	Confident	85	Confident	129 Å²	129	73 Å²	73	69%	0.69	41%	0.409	S	S	*	.	H	α-helix	trans	-62.5	-40.1	178.5	-165.2	54	0	0	0	112.3	K137 K138 W143 G144	K137-D141 WeakPolarHBondContact O-CB 3.33Å; K137-D141 PolarHBondContact O-N 3.41Å; K138-D141 PolarHBondContact O-N 3Å; D141-W143 PolarHBondContact O-N 2.91Å; D141-G144 WeakPolarHBondContact O-CA 2.99Å; D141-G144 PolarHBondContact O-N 3.21Å
142	E	83.2	Confident	85.2	Confident	109 Å²	109	78.5 Å²	78.5	51%	0.509	43%	0.434	S	S	.	.	H	α-helix	trans	-62.1	-31.3	173.5	-75.7	174.9	-175.8	0	0	112.5	K138 I139 L140 G144	K138-E142 WeakPolarHBondContact CE-OE1 3.32Å; K138-E142 HydrophobicContact CG-CG 4.42Å; K138-E142 IonicContact NZ-OE1 3.88Å; K138-E142 WeakPolarHBondContact O-CB 3.49Å; K138-E142 WeakPolarHBondContact O-CG 3.34Å; K138-E142 PolarHBondContact O-N 3.06Å; I139-E142 PolarHBondContact O-N 3.13Å; L140-E142 PolarHBondContact O-N 3.34Å; E142-G144 VanDerWaalsContact C-N 3.28Å
143	W	84.6	Confident	85.3	Confident	41 Å²	41	74.6 Å²	74.6	16%	0.155	42%	0.417	C	S	.	.	T	Hydrogen-bonded Turn	trans	-83.1	-2.6	172.9	-60.7	-18.7	0	0	0	113.6	L123 I139 L140 D141 E145 I160 L163 M164 Y167 A168	L123-W143 HydrophobicContact CD1-CH2 4.03Å; L123-W143 HydrophobicContact CD1-CZ2 3.29Å; I139-W143 HydrophobicContact CG2-CD2 4.03Å; I139-W143 HydrophobicContact CG2-CE3 4.07Å; I139-W143 HydrophobicContact CG2-CH2 3.66Å; I139-W143 HydrophobicContact CG2-CZ2 3.61Å; I139-W143 HydrophobicContact CG2-CZ3 3.88Å; I139-W143 PolarHBondContact O-N 3.01Å; L140-W143 HydrophobicContact CD2-CE3 4.21Å; L140-W143 HydrophobicContact CD2-CZ3 4.45Å; L140-W143 CarbonylContact O-C 3.39Å; L140-W143 WeakPolarHBondContact O-CA 3.48Å; L140-W143 PolarHBondContact O-N 3.49Å; L140-W143 VanDerWaalsContact O-N 3.09Å; D141-W143 PolarHBondContact O-N 2.91Å; W143-E145 HydrophobicContact CB-CB 4.41Å; W143-E145 HydrophobicContact CB-CG 4.1Å; W143-E145 PolarHBondContact O-N 3.47Å; W143-I160 HydrophobicContact CH2-CG2 3.78Å; W143-I160 HydrophobicContact CZ3-CB 4.32Å; W143-I160 HydrophobicContact CZ3-CG1 4.42Å; W143-I160 HydrophobicContact CZ3-CG2 3.97Å; W143-L163 HydrophobicContact CE3-CB 4.07Å; W143-L163 HydrophobicContact CZ3-CB 3.85Å; W143-M164 HydrophobicContact CH2-CB 4.28Å; W143-Y167 HydrophobicContact CB-CD1 4.11Å; W143-Y167 HydrophobicContact CB-CD2 4.02Å; W143-Y167 HydrophobicContact CB-CE1 4.33Å; W143-Y167 HydrophobicContact CB-CE2 4.22Å; W143-Y167 HydrophobicContact CB-CG 3.96Å; W143-Y167 AromaticContact CD2-CD2 3.89Å; W143-Y167 HydrophobicContact CD2-CD2 3.89Å; W143-Y167 AromaticContact CD2-CG 3.93Å; W143-Y167 HydrophobicContact CD2-CG 3.93Å; W143-Y167 AromaticContact CE3-CD2 3.93Å; W143-Y167 HydrophobicContact CE3-CD2 3.93Å; W143-Y167 HydrophobicContact CE3-CG 4.42Å; W143-Y167 HydrophobicContact CG-CD1 4.2Å; W143-Y167 AromaticContact CG-CD2 3.96Å; W143-Y167 HydrophobicContact CG-CD2 3.96Å; W143-Y167 AromaticContact CG-CG 3.71Å; W143-Y167 HydrophobicContact CG-CG 3.71Å; W143-A168 HydrophobicContact CZ2-CB 4.22Å
144	G	83.3	Confident	85.4	Confident	69 Å²	69	75 Å²	75	71%	0.711	42%	0.422	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	19	-173.3	0	0	0	0	0	113.3	L140 D141 E142	L140-G144 PolarHBondContact O-N 2.84Å; L140-G144 VanDerWaalsContact O-N 3.16Å; D141-G144 WeakPolarHBondContact O-CA 2.99Å; D141-G144 PolarHBondContact O-N 3.21Å; E142-G144 VanDerWaalsContact C-N 3.28Å
145	E	86.4	Confident	85.7	Confident	54 Å²	54	68.5 Å²	68.5	25%	0.252	40%	0.395	S	S	.	.			trans	-104.8	145	-176.5	-66.9	-78.9	-175.9	0	0	109.7	L140 W143 L163 Y167	L140-E145 CarbonylContact C-O 3.52Å; L140-E145 WeakPolarHBondContact CB-O 3.33Å; L140-E145 HydrophobicContact CD2-CB 4.35Å; L140-E145 PolarHBondContact O-N 3.34Å; W143-E145 HydrophobicContact CB-CB 4.41Å; W143-E145 HydrophobicContact CB-CG 4.1Å; W143-E145 PolarHBondContact O-N 3.47Å; E145-L163 HydrophobicContact CB-CD1 3.83Å; E145-L163 HydrophobicContact CG-CD1 3.7Å; E145-Y167 HydrophobicContact CG-CE2 3.8Å; E145-Y167 PolarHBondContact OE1-OH 3.18Å
146	S	81.6	Confident	86	Confident	83 Å²	83	66.7 Å²	66.7	58%	0.58	39%	0.385	S	S	*	.			trans	-127.7	135.8	175.5	62.1	0	0	0	0	109.7	K148	S146-K148 PolarHBondContact O-N 3.48Å
147	C	84.6	Confident	86.1	Confident	37 Å²	37	68.1 Å²	68.1	25%	0.25	39%	0.392	C	S	.	.			trans	-88.8	97.3	174.5	-171.9	0	0	0	0	110.9	L140 G149 C150 F156 K159	L140-C147 HydrophobicContact CD1-CB 3.94Å; C147-G149 PolarHBondContact O-N 2.94Å; C147-C150 HydrophobicContact CB-CB 3.7Å; C147-C150 WeakPolarHBondContact CB-SG 3.34Å; C147-C150 WeakPolarHBondContact SG-CB 3.18Å; C147-C150 CovalentContact SG-SG 2Å; C147-C150 PolarHBondContact SG-SG 2.9Å; C147-F156 HydrophobicContact CB-CD1 4.28Å; C147-F156 HydrophobicContact CB-CE1 4.15Å; C147-K159 HydrophobicContact CB-CG 4.42Å
148	K	81	Confident	86.2	Confident	197 Å²	197	70.8 Å²	70.8	86%	0.857	40%	0.399	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.4	111.5	170.7	-66.3	-177.1	-179.9	178.3	0	109.2	S146	S146-K148 PolarHBondContact O-N 3.48Å
149	G	82.8	Confident	86.4	Confident	76 Å²	76	70.4 Å²	70.4	78%	0.784	40%	0.398	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.2	5.8	178.1	0	0	0	0	0	116	C147 A151	C147-G149 PolarHBondContact O-N 2.94Å; G149-A151 PolarHBondContact O-N 3.25Å
150	C	87.1	Confident	86.6	Confident	21 Å²	21	70.3 Å²	70.3	14%	0.142	40%	0.397	C	S	.	.			trans	-71.7	108.3	168.7	-79.2	0	0	0	0	110.1	C147 D155 F156	C147-C150 HydrophobicContact CB-CB 3.7Å; C147-C150 WeakPolarHBondContact CB-SG 3.34Å; C147-C150 WeakPolarHBondContact SG-CB 3.18Å; C147-C150 CovalentContact SG-SG 2Å; C147-C150 PolarHBondContact SG-SG 2.9Å; C150-D155 HydrophobicContact CB-CB 3.74Å; C150-D155 WeakPolarHBondContact SG-CB 3.3Å; C150-F156 HydrophobicContact CB-CD1 3.93Å; C150-F156 HydrophobicContact CB-CD2 3.85Å; C150-F156 HydrophobicContact CB-CE1 3.6Å; C150-F156 HydrophobicContact CB-CE2 3.51Å; C150-F156 HydrophobicContact CB-CG 4.03Å; C150-F156 HydrophobicContact CB-CZ 3.36Å; C150-F156 PolarHBondContact SG-N 3.34Å
151	A	83.5	Confident	86.7	Confident	93 Å²	93	72.5 Å²	72.5	77%	0.769	41%	0.411	S	S	*	.			trans	-97.7	-35.5	174.1	0	0	0	0	0	111	G149 D155	G149-A151 PolarHBondContact O-N 3.25Å; A151-D155 PolarHBondContact N-OD2 3.36Å
152	E	88.9	Confident	86.8	Confident	129 Å²	129	72.1 Å²	72.1	60%	0.603	41%	0.405	S	S	*	.	S	Bend	trans	-107.2	159.2	-175.9	-61.3	-164	134.7	0	0	112.6	S154 D155 F156	E152-S154 WeakPolarHBondContact CB-OG 3.48Å; E152-S154 PolarHBondContact O-N 3.43Å; E152-S154 PolarHBondContact OE2-OG 3.34Å; E152-D155 PolarHBondContact N-OD2 3.44Å; E152-D155 WeakPolarHBondContact O-CB 3.49Å; E152-D155 PolarHBondContact O-N 3.46Å; E152-D155 VanDerWaalsContact O-N 3.12Å; E152-F156 VanDerWaalsContact O-CD2 3.22Å; E152-F156 WeakPolarHBondContact O-CD2 3.39Å
153	K	88.1	Confident	87	Confident	77 Å²	77	67.8 Å²	67.8	34%	0.335	39%	0.385	S	S	.	.	H	α-helix	trans	-58	-38.7	176.7	-175.4	-178.8	-179.9	175.5	0	112.2	K129 L131 V133 L136 D155 F156 I157	K129-K153 WeakPolarHBondContact O-CE 3.48Å; K129-K153 PolarHBondContact O-NZ 3.43Å; L131-K153 WeakPolarHBondContact O-CE 3.16Å; L131-K153 PolarHBondContact O-NZ 3.32Å; V133-K153 HydrophobicContact CG2-CB 3.97Å; V133-K153 HydrophobicContact CG2-CG 4.05Å; L136-K153 HydrophobicContact CD1-CG 3.8Å; K153-D155 VanDerWaalsContact C-N 3.29Å; K153-D155 PolarHBondContact O-N 2.98Å; K153-F156 PolarHBondContact O-N 3.36Å; K153-I157 HydrophobicContact CG-CD1 4.17Å; K153-I157 WeakPolarHBondContact O-CG1 3.45Å; K153-I157 PolarHBondContact O-N 3.28Å; K153-I157 VanDerWaalsContact O-N 3.13Å
154	S	89.7	Confident	87.1	Confident	62 Å²	62	66 Å²	66	43%	0.434	38%	0.379	S	S	.	.	H	α-helix	trans	-56.1	-40.2	175.4	40.7	0	0	0	0	112.3	E152 I157 R158	E152-S154 WeakPolarHBondContact CB-OG 3.48Å; E152-S154 PolarHBondContact O-N 3.43Å; E152-S154 PolarHBondContact OE2-OG 3.34Å; S154-I157 PolarHBondContact O-N 2.87Å; S154-R158 WeakPolarHBondContact O-CB 3.31Å; S154-R158 PolarHBondContact O-N 3.11Å
155	D	91.4	Very high	87.2	Confident	35 Å²	35	66.4 Å²	66.4	19%	0.187	37%	0.369	C	S	.	.	H	α-helix	trans	-64.2	-44.3	179.2	-61	-44.9	0	0	0	111.7	C150 A151 E152 K153 I157 R158 K159	C150-D155 HydrophobicContact CB-CB 3.74Å; C150-D155 WeakPolarHBondContact SG-CB 3.3Å; A151-D155 PolarHBondContact N-OD2 3.36Å; E152-D155 PolarHBondContact N-OD2 3.44Å; E152-D155 WeakPolarHBondContact O-CB 3.49Å; E152-D155 PolarHBondContact O-N 3.46Å; E152-D155 VanDerWaalsContact O-N 3.12Å; K153-D155 VanDerWaalsContact C-N 3.29Å; K153-D155 PolarHBondContact O-N 2.98Å; D155-I157 VanDerWaalsContact C-N 3.35Å; D155-I157 PolarHBondContact O-N 3.27Å; D155-R158 PolarHBondContact O-N 3.08Å; D155-R158 IonicContact OD1-NH2 3.97Å; D155-R158 PolarHBondContact OD1-NH2 3.44Å; D155-K159 PolarHBondContact O-N 2.85Å
156	F	90.6	Very high	87.2	Confident	14 Å²	14	70.7 Å²	70.7	6%	0.061	39%	0.386	C	S	.	.	H	α-helix	trans	-62.4	-43.2	176.8	-70.2	-78.9	0	0	0	111.3	V133 L136 K137 L140 C147 C150 E152 K153 K159 I160	V133-F156 HydrophobicContact CG1-CD2 4.07Å; V133-F156 HydrophobicContact CG1-CE2 3.9Å; V133-F156 HydrophobicContact CG1-CZ 4.46Å; L136-F156 HydrophobicContact CB-CB 4Å; L136-F156 HydrophobicContact CD1-CB 4.05Å; K137-F156 HydrophobicContact CD-CE1 4.29Å; K137-F156 HydrophobicContact CD-CZ 4.34Å; K137-F156 HydrophobicContact CG-CD1 4.02Å; K137-F156 HydrophobicContact CG-CE1 3.58Å; K137-F156 HydrophobicContact CG-CZ 4.08Å; L140-F156 HydrophobicContact CD1-CD1 3.93Å; C147-F156 HydrophobicContact CB-CD1 4.28Å; C147-F156 HydrophobicContact CB-CE1 4.15Å; C150-F156 HydrophobicContact CB-CD1 3.93Å; C150-F156 HydrophobicContact CB-CD2 3.85Å; C150-F156 HydrophobicContact CB-CE1 3.6Å; C150-F156 HydrophobicContact CB-CE2 3.51Å; C150-F156 HydrophobicContact CB-CG 4.03Å; C150-F156 HydrophobicContact CB-CZ 3.36Å; C150-F156 PolarHBondContact SG-N 3.34Å; E152-F156 VanDerWaalsContact O-CD2 3.22Å; E152-F156 WeakPolarHBondContact O-CD2 3.39Å; K153-F156 PolarHBondContact O-N 3.36Å; F156-K159 PolarHBondContact O-N 3.13Å; F156-I160 WeakPolarHBondContact O-CB 3.28Å; F156-I160 WeakPolarHBondContact O-CD1 3.35Å; F156-I160 VanDerWaalsContact O-CG1 3.23Å; F156-I160 WeakPolarHBondContact O-CG1 3.29Å; F156-I160 PolarHBondContact O-N 2.79Å
157	I	90.3	Very high	87.3	Confident	30 Å²	30	70.5 Å²	70.5	15%	0.154	37%	0.373	C	S	.	.	H	α-helix	trans	-61.1	-47.7	177.3	-65.6	171	0	0	0	110.1	L128 K129 L136 K153 S154 D155 K159 I160 T161	L128-I157 HydrophobicContact CB-CG1 4.18Å; L128-I157 HydrophobicContact CB-CG2 4.03Å; L128-I157 HydrophobicContact CD1-CG2 4.06Å; K129-I157 HydrophobicContact CG-CD1 4.26Å; L136-I157 HydrophobicContact CD1-CD1 4.43Å; L136-I157 HydrophobicContact CD1-CG1 3.78Å; L136-I157 HydrophobicContact CD2-CG1 4.22Å; K153-I157 HydrophobicContact CG-CD1 4.17Å; K153-I157 WeakPolarHBondContact O-CG1 3.45Å; K153-I157 PolarHBondContact O-N 3.28Å; K153-I157 VanDerWaalsContact O-N 3.13Å; S154-I157 PolarHBondContact O-N 2.87Å; D155-I157 VanDerWaalsContact C-N 3.35Å; D155-I157 PolarHBondContact O-N 3.27Å; I157-K159 VanDerWaalsContact C-N 3.33Å; I157-K159 PolarHBondContact O-N 3.03Å; I157-I160 PolarHBondContact O-N 3.4Å; I157-T161 PolarHBondContact O-N 3.27Å; I157-T161 PolarHBondContact O-OG1 3.24Å; I157-T161 VanDerWaalsContact O-OG1 3.08Å
158	R	89.9	Confident	87.2	Confident	167 Å²	167	69.6 Å²	69.6	63%	0.63	37%	0.369	S	S	*	.	H	α-helix	trans	-59.3	-44.6	179.5	-173.8	174.4	61.6	-162.1	-9.4	111.6	S154 D155 I160 T161 E162	S154-R158 WeakPolarHBondContact O-CB 3.31Å; S154-R158 PolarHBondContact O-N 3.11Å; D155-R158 PolarHBondContact O-N 3.08Å; D155-R158 IonicContact OD1-NH2 3.97Å; D155-R158 PolarHBondContact OD1-NH2 3.44Å; R158-I160 PolarHBondContact O-N 2.72Å; R158-T161 PolarHBondContact O-N 2.87Å; R158-E162 WeakPolarHBondContact O-CB 3.35Å; R158-E162 PolarHBondContact O-N 2.81Å
159	K	90.3	Very high	87.1	Confident	50 Å²	50	63.7 Å²	63.7	22%	0.217	35%	0.35	C	S	.	.	H	α-helix	trans	-65.4	-39.5	178.7	-170.1	57.8	176.8	175.4	0	112.3	L140 C147 D155 F156 I157 E162 L163	L140-K159 HydrophobicContact CD2-CG 4.14Å; C147-K159 HydrophobicContact CB-CG 4.42Å; D155-K159 PolarHBondContact O-N 2.85Å; F156-K159 PolarHBondContact O-N 3.13Å; I157-K159 VanDerWaalsContact C-N 3.33Å; I157-K159 PolarHBondContact O-N 3.03Å; K159-E162 IonicContact NZ-OE1 3.69Å; K159-E162 PolarHBondContact NZ-OE1 3.31Å; K159-E162 IonicContact NZ-OE2 3.82Å; K159-E162 PolarHBondContact NZ-OE2 3.26Å; K159-E162 PolarHBondContact O-N 3.16Å; K159-L163 HydrophobicContact CD-CD1 4.2Å; K159-L163 HydrophobicContact CD-CG 4.42Å; K159-L163 HydrophobicContact CG-CD1 4.11Å; K159-L163 WeakPolarHBondContact O-CG 3.37Å; K159-L163 PolarHBondContact O-N 2.69Å; K159-L163 VanDerWaalsContact O-N 3.15Å
160	I	89.3	Confident	86.9	Confident	0 Å²	0	63.3 Å²	63.3	0%	0	34%	0.34	C	S	.	.	H	α-helix	trans	-63.1	-46.8	175.7	-71.2	164	0	0	0	110.3	L128 L136 I139 L140 W143 F156 I157 R158 E162 L163 M164	L128-I160 HydrophobicContact CD1-CB 4.48Å; L128-I160 HydrophobicContact CD1-CG2 3.88Å; L128-I160 HydrophobicContact CD2-CG2 4.17Å; L136-I160 HydrophobicContact CB-CD1 3.77Å; L136-I160 HydrophobicContact CD2-CD1 3.63Å; L136-I160 HydrophobicContact CG-CD1 4.28Å; L136-I160 WeakPolarHBondContact O-CD1 3.47Å; I139-I160 HydrophobicContact CB-CD1 4.24Å; I139-I160 HydrophobicContact CD1-CD1 4.26Å; I139-I160 HydrophobicContact CG2-CD1 4.37Å; I139-I160 HydrophobicContact CG2-CG1 4.27Å; I139-I160 HydrophobicContact CG2-CG2 4.17Å; L140-I160 HydrophobicContact CD1-CG1 4.39Å; L140-I160 HydrophobicContact CD2-CG1 3.68Å; L140-I160 HydrophobicContact CG-CD1 4.37Å; L140-I160 HydrophobicContact CG-CG1 3.79Å; W143-I160 HydrophobicContact CH2-CG2 3.78Å; W143-I160 HydrophobicContact CZ3-CB 4.32Å; W143-I160 HydrophobicContact CZ3-CG1 4.42Å; W143-I160 HydrophobicContact CZ3-CG2 3.97Å; F156-I160 WeakPolarHBondContact O-CB 3.28Å; F156-I160 WeakPolarHBondContact O-CD1 3.35Å; F156-I160 VanDerWaalsContact O-CG1 3.23Å; F156-I160 WeakPolarHBondContact O-CG1 3.29Å; F156-I160 PolarHBondContact O-N 2.79Å; I157-I160 PolarHBondContact O-N 3.4Å; R158-I160 PolarHBondContact O-N 2.72Å; I160-E162 VanDerWaalsContact C-N 3.34Å; I160-E162 PolarHBondContact O-N 3.45Å; I160-L163 PolarHBondContact O-N 3.29Å; I160-M164 HydrophobicContact CG2-CE 3.69Å; I160-M164 VanDerWaalsContact O-CB 3.29Å; I160-M164 WeakPolarHBondContact O-CB 3.42Å; I160-M164 PolarHBondContact O-N 3.09Å
161	T	87.6	Confident	86.5	Confident	50 Å²	50	62.5 Å²	62.5	31%	0.307	34%	0.335	S	S	.	.	H	α-helix	trans	-61.2	-40.7	178.2	-58.8	0	0	0	0	112.3	I157 R158 L163 M164 P165 L178	I157-T161 PolarHBondContact O-N 3.27Å; I157-T161 PolarHBondContact O-OG1 3.24Å; I157-T161 VanDerWaalsContact O-OG1 3.08Å; R158-T161 PolarHBondContact O-N 2.87Å; T161-L163 VanDerWaalsContact C-N 3.33Å; T161-L163 PolarHBondContact O-N 3.11Å; T161-M164 PolarHBondContact O-N 3.33Å; T161-P165 WeakPolarHBondContact O-CD 2.83Å; T161-L178 HydrophobicContact CG2-CD2 4.09Å
162	E	87.9	Confident	86.3	Confident	121 Å²	121	59 Å²	59	57%	0.565	31%	0.306	S	S	*	.	H	α-helix	trans	-60.5	-41.6	176.1	-175.9	-163.6	134.4	0	0	112.1	R158 K159 I160	R158-E162 WeakPolarHBondContact O-CB 3.35Å; R158-E162 PolarHBondContact O-N 2.81Å; K159-E162 IonicContact NZ-OE1 3.69Å; K159-E162 PolarHBondContact NZ-OE1 3.31Å; K159-E162 IonicContact NZ-OE2 3.82Å; K159-E162 PolarHBondContact NZ-OE2 3.26Å; K159-E162 PolarHBondContact O-N 3.16Å; I160-E162 VanDerWaalsContact C-N 3.34Å; I160-E162 PolarHBondContact O-N 3.45Å
163	L	88.9	Confident	85.7	Confident	17 Å²	17	61.7 Å²	61.7	9%	0.089	32%	0.315	C	S	.	.	H	α-helix	trans	-88.4	-16.3	-176.2	-66.3	176.4	0	0	0	113.5	L140 W143 E145 K159 I160 T161 K166 Y167	L140-L163 HydrophobicContact CD2-CD1 4.03Å; W143-L163 HydrophobicContact CE3-CB 4.07Å; W143-L163 HydrophobicContact CZ3-CB 3.85Å; E145-L163 HydrophobicContact CB-CD1 3.83Å; E145-L163 HydrophobicContact CG-CD1 3.7Å; K159-L163 HydrophobicContact CD-CD1 4.2Å; K159-L163 HydrophobicContact CD-CG 4.42Å; K159-L163 HydrophobicContact CG-CD1 4.11Å; K159-L163 WeakPolarHBondContact O-CG 3.37Å; K159-L163 PolarHBondContact O-N 2.69Å; K159-L163 VanDerWaalsContact O-N 3.15Å; I160-L163 PolarHBondContact O-N 3.29Å; T161-L163 VanDerWaalsContact C-N 3.33Å; T161-L163 PolarHBondContact O-N 3.11Å; L163-K166 WeakPolarHBondContact O-CB 3.44Å; L163-K166 PolarHBondContact O-N 3.11Å; L163-Y167 HydrophobicContact CB-CD2 3.95Å; L163-Y167 HydrophobicContact CB-CE2 4.11Å; L163-Y167 HydrophobicContact CD1-CE2 4.48Å; L163-Y167 HydrophobicContact CD2-CE2 4.19Å; L163-Y167 HydrophobicContact CG-CE2 4.5Å; L163-Y167 WeakPolarHBondContact O-CD2 3.37Å; L163-Y167 PolarHBondContact O-N 2.87Å
164	M	86.5	Confident	85	Confident	5 Å²	5	60.8 Å²	60.8	3%	0.025	32%	0.322	C	S	.	.	H	α-helix	trans	-57.1	-41.7	-175.4	-167.9	174.9	-64.1	0	0	114.5	L128 W143 I160 T161 K166 Y167 A168 A171 A172 R175	L128-M164 HydrophobicContact CD1-CE 3.87Å; W143-M164 HydrophobicContact CH2-CB 4.28Å; I160-M164 HydrophobicContact CG2-CE 3.69Å; I160-M164 VanDerWaalsContact O-CB 3.29Å; I160-M164 WeakPolarHBondContact O-CB 3.42Å; I160-M164 PolarHBondContact O-N 3.09Å; T161-M164 PolarHBondContact O-N 3.33Å; M164-K166 PolarHBondContact O-N 2.92Å; M164-Y167 PolarHBondContact O-N 3.07Å; M164-A168 HydrophobicContact CG-CB 4.21Å; M164-A168 CarbonylContact O-C 3.52Å; M164-A168 VanDerWaalsContact O-CA 3.32Å; M164-A168 WeakPolarHBondContact O-CA 3.47Å; M164-A168 PolarHBondContact O-N 3.08Å; M164-A171 HydrophobicContact CG-CB 4.34Å; M164-A171 HydrophobicContact SD-CB 4.18Å; M164-A172 HydrophobicContact CG-CB 4.12Å; M164-R175 PolarHBondContact SD-NH1 3.45Å
165	P	85.1	Confident	84	Confident	77 Å²	77	59.9 Å²	59.9	50%	0.5	31%	0.309	S	S	.	.	H	α-helix	trans	-61	-27	177.1	-23.3	34.7	0	0	0	113.5	T161 A172	T161-P165 WeakPolarHBondContact O-CD 2.83Å; P165-A172 HydrophobicContact CB-CB 4.22Å; P165-A172 HydrophobicContact CG-CB 4.08Å
166	K	85.9	Confident	82.6	Confident	144 Å²	144	64.5 Å²	64.5	63%	0.626	34%	0.339	S	S	*	.	H	α-helix	trans	-81.8	-45.2	-179.3	-175	-175.8	175.6	-162.8	0	112.2	L163 M164	L163-K166 WeakPolarHBondContact O-CB 3.44Å; L163-K166 PolarHBondContact O-N 3.11Å; M164-K166 PolarHBondContact O-N 2.92Å
167	Y	83.8	Confident	81.1	Confident	78 Å²	78	70.1 Å²	70.1	31%	0.306	37%	0.37	S	S	.	.	H	α-helix	trans	-99.8	-23.6	-172.4	-63	-73.1	0	0	0	114.1	W143 E145 L163 M164	W143-Y167 HydrophobicContact CB-CD1 4.11Å; W143-Y167 HydrophobicContact CB-CD2 4.02Å; W143-Y167 HydrophobicContact CB-CE1 4.33Å; W143-Y167 HydrophobicContact CB-CE2 4.22Å; W143-Y167 HydrophobicContact CB-CG 3.96Å; W143-Y167 AromaticContact CD2-CD2 3.89Å; W143-Y167 HydrophobicContact CD2-CD2 3.89Å; W143-Y167 AromaticContact CD2-CG 3.93Å; W143-Y167 HydrophobicContact CD2-CG 3.93Å; W143-Y167 AromaticContact CE3-CD2 3.93Å; W143-Y167 HydrophobicContact CE3-CD2 3.93Å; W143-Y167 HydrophobicContact CE3-CG 4.42Å; W143-Y167 HydrophobicContact CG-CD1 4.2Å; W143-Y167 AromaticContact CG-CD2 3.96Å; W143-Y167 HydrophobicContact CG-CD2 3.96Å; W143-Y167 AromaticContact CG-CG 3.71Å; W143-Y167 HydrophobicContact CG-CG 3.71Å; E145-Y167 HydrophobicContact CG-CE2 3.8Å; E145-Y167 PolarHBondContact OE1-OH 3.18Å; L163-Y167 HydrophobicContact CB-CD2 3.95Å; L163-Y167 HydrophobicContact CB-CE2 4.11Å; L163-Y167 HydrophobicContact CD1-CE2 4.48Å; L163-Y167 HydrophobicContact CD2-CE2 4.19Å; L163-Y167 HydrophobicContact CG-CE2 4.5Å; L163-Y167 WeakPolarHBondContact O-CD2 3.37Å; L163-Y167 PolarHBondContact O-N 2.87Å; M164-Y167 PolarHBondContact O-N 3.07Å
168	A	82.4	Confident	79	Confident	19 Å²	19	77.9 Å²	77.9	16%	0.157	41%	0.411	C	S	.	.			trans	-140.9	65.1	-179.5	0	0	0	0	0	111.2	L123 W143 M164 A170 A171 A172	L123-A168 HydrophobicContact CD1-CB 4.01Å; W143-A168 HydrophobicContact CZ2-CB 4.22Å; M164-A168 HydrophobicContact CG-CB 4.21Å; M164-A168 CarbonylContact O-C 3.52Å; M164-A168 VanDerWaalsContact O-CA 3.32Å; M164-A168 WeakPolarHBondContact O-CA 3.47Å; M164-A168 PolarHBondContact O-N 3.08Å; A168-A170 VanDerWaalsContact C-N 3.25Å; A168-A170 PolarHBondContact O-N 3.18Å; A168-A171 HydrophobicContact CB-CB 3.92Å; A168-A171 WeakPolarHBondContact O-CB 3.35Å; A168-A171 PolarHBondContact O-N 3.21Å; A168-A172 PolarHBondContact O-N 3.4Å
169	P	79	Confident	78.4	Confident	72 Å²	72	73.4 Å²	73.4	47%	0.468	40%	0.4	S	S	.	.	H	α-helix	trans	-61.1	-30.7	-174.7	22.9	-33.8	0	0	0	113.6	K173	P169-K173 WeakPolarHBondContact O-CG 3.08Å; P169-K173 PolarHBondContact O-N 3.18Å
170	A	77.9	Confident	77.8	Confident	69 Å²	69	74.6 Å²	74.6	57%	0.57	41%	0.409	S	S	*	.	H	α-helix	trans	-65.2	-40.7	173.5	0	0	0	0	0	111.9	A168 K173 A174	A168-A170 VanDerWaalsContact C-N 3.25Å; A168-A170 PolarHBondContact O-N 3.18Å; A170-K173 PolarHBondContact O-N 2.95Å; A170-A174 WeakPolarHBondContact O-CB 3.43Å; A170-A174 PolarHBondContact O-N 2.57Å
171	A	78.9	Confident	77.2	Confident	3 Å²	3	78.8 Å²	78.8	3%	0.025	43%	0.432	C	S	.	.	H	α-helix	trans	-70.5	-37.9	176.4	0	0	0	0	0	112.4	L123 T124 M164 A168 K173 A174 R175	L123-A171 HydrophobicContact CB-CB 3.66Å; T124-A171 HydrophobicContact CG2-CB 3.86Å; M164-A171 HydrophobicContact CG-CB 4.34Å; M164-A171 HydrophobicContact SD-CB 4.18Å; A168-A171 HydrophobicContact CB-CB 3.92Å; A168-A171 WeakPolarHBondContact O-CB 3.35Å; A168-A171 PolarHBondContact O-N 3.21Å; A171-K173 VanDerWaalsContact C-N 3.33Å; A171-K173 PolarHBondContact O-N 2.92Å; A171-A174 PolarHBondContact O-N 3Å; A171-R175 PolarHBondContact O-N 3.37Å
172	A	78.8	Confident	76.6	Confident	20 Å²	20	80.5 Å²	80.5	17%	0.165	44%	0.439	C	S	.	.	H	α-helix	trans	-62.5	-40.5	174.3	0	0	0	0	0	111.9	M164 P165 A168	M164-A172 HydrophobicContact CG-CB 4.12Å; P165-A172 HydrophobicContact CB-CB 4.22Å; P165-A172 HydrophobicContact CG-CB 4.08Å; A168-A172 PolarHBondContact O-N 3.4Å
173	K	76.4	Confident	75.9	Confident	185 Å²	185	77.9 Å²	77.9	80%	0.804	43%	0.431	S	S	*	.	H	α-helix	trans	-72.2	-32.8	176.9	-73.7	179.4	-179.3	-175.8	0	113.6	P169 A170 A171 R175	P169-K173 WeakPolarHBondContact O-CG 3.08Å; P169-K173 PolarHBondContact O-N 3.18Å; A170-K173 PolarHBondContact O-N 2.95Å; A171-K173 VanDerWaalsContact C-N 3.33Å; A171-K173 PolarHBondContact O-N 2.92Å; K173-R175 VanDerWaalsContact C-N 3.31Å
174	A	74.3	Confident	75	Confident	58 Å²	58	82 Å²	82	48%	0.479	45%	0.454	S	S	.	.	H	α-helix	trans	-73.6	-23.5	179.4	0	0	0	0	0	112.8	A170 A171	A170-A174 WeakPolarHBondContact O-CB 3.43Å; A170-A174 PolarHBondContact O-N 2.57Å; A171-A174 PolarHBondContact O-N 3Å
175	R	69.7	Low	74.2	Confident	43 Å²	43	87.5 Å²	87.5	16%	0.162	49%	0.485	C	S	.	.			trans	-83.9	119.9	176.8	-74.1	-156.7	172.5	83.7	3.2	111.2	L123 V126 M164 A171 K173 D177	L123-R175 PolarHBondContact O-NH1 3.33Å; L123-R175 PolarHBondContact O-NH2 3.34Å; V126-R175 PolarHBondContact O-NH2 3.01Å; M164-R175 PolarHBondContact SD-NH1 3.45Å; A171-R175 PolarHBondContact O-N 3.37Å; K173-R175 VanDerWaalsContact C-N 3.31Å; R175-D177 VanDerWaalsContact C-N 3.31Å
176	T	61.2	Low	73.3	Confident	132 Å²	132	88.3 Å²	88.3	81%	0.81	48%	0.484	S	S	*	.			trans	-88.6	6.2	174.5	44.9	0	0	0	0	113.6
177	D	58	Low	72.3	Confident	132 Å²	132	83.7 Å²	83.7	71%	0.706	47%	0.472	S	S	*	.			trans	-97.2	17	-165.7	-45.2	-30	0	0	0	114	R175	R175-D177 VanDerWaalsContact C-N 3.31Å
178	L	47	Very low	71.2	Confident	193 Å²	193	84.2 Å²	84.2	100%	1.01	49%	0.487	S	S	*	.			trans	-88.4	0	174.7	-85.3	166.4	0	0	0	111.4	T161	T161-L178 HydrophobicContact CG2-CD2 4.09Å

Retrieved 178 of 178 residues in 194.7 ms (Link to these results)

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