A0A2K5XJP6_MANLE Loading...

C-X-C chemokine receptor type 4

Receptor for the C-X-C chemokine CXCL12/SDF-1 that transduces a signal by increasing intracellular calcium ion levels and enhancing MAPK1/MAPK3 activation. Involved in the AKT signaling cascade. Plays a role in regulation of cell migration, e.g. during wound healing. Acts as a receptor for extracellular ubiquitin; leading to enhanced intracellular calcium ions and reduced cellular cAMP levels. Binds bacterial lipopolysaccharide (LPS) et mediates LPS-induced inflammatory response, including TNF secretion by monocytes. Involved in hematopoiesis and in cardiac ventricular septum formation. Also plays an essential role in vascularization of the gastrointestinal tract, probably by regulating vascular branching and/or remodeling processes in endothelial cells. Involved in cerebellar development. In the CNS, could mediate hippocampal-neuron survival.

AlphaFold DB , UniProt , Accession A0A2K5XJP6, Species MANLE (Mandrillus leucophaeus, Drill), Gene CXCR4, Length 352 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	33.5	Very low	30.9	Very low	229 Å²	229	148.6 Å²	148.6	100%	1.128	82%	0.817	S	S	*	*				0	83.1	0	-85.2	169.1	169.1	0	0	105.9
2	E	30.4	Very low	30.9	Very low	196 Å²	196	152.9 Å²	152.9	92%	0.916	81%	0.814	S	S	*	*				57.3	122.3	80	-66.3	-179.2	154	0	0	110.5
3	G	27.7	Very low	31	Very low	76 Å²	76	151.6 Å²	151.6	78%	0.784	82%	0.816	S	S	*	*			cis	-171.3	-178.8	15	0	0	0	0	0	115.4
4	I	34.4	Very low	31.4	Very low	150 Å²	150	154.7 Å²	154.7	77%	0.769	82%	0.822	S	S	*	*			trans	-63.2	150.4	-178.5	-68.4	152.7	0	0	0	112.4	I6	I4-I6 HydrophobicContact CG2-CD1 4.22Å; I4-I6 HydrophobicContact CG2-CG1 4.02Å
5	S	27.1	Very low	31.4	Very low	118 Å²	118	157.4 Å²	157.4	83%	0.825	83%	0.828	S	S	*	*			trans	-146.9	108.3	142.2	46.1	0	0	0	0	110.8
6	I	35.3	Very low	32.1	Very low	140 Å²	140	160.3 Å²	160.3	72%	0.718	84%	0.839	S	S	*	*			trans	-92.7	135.3	167.1	-67.9	165.7	0	0	0	107.6	I4	I4-I6 HydrophobicContact CG2-CD1 4.22Å; I4-I6 HydrophobicContact CG2-CG1 4.02Å
7	Y	29	Very low	32	Very low	213 Å²	213	154.9 Å²	154.9	84%	0.835	83%	0.832	S	S	*	*			trans	-167.2	138.7	158.5	-86	-69.4	0	0	0	106.3
8	T	28	Very low	32.5	Very low	106 Å²	106	154.2 Å²	154.2	65%	0.65	84%	0.841	S	S	*	*			cis	-163.9	153.3	-11.2	-20	0	0	0	0	105.2
9	S	33	Very low	32.6	Very low	111 Å²	111	148.7 Å²	148.7	78%	0.776	82%	0.824	S	S	*	*			trans	-67.3	123.7	165.4	49.7	0	0	0	0	110.9
10	D	27.9	Very low	32.8	Very low	134 Å²	134	149.7 Å²	149.7	72%	0.717	83%	0.828	S	S	*	*			trans	-119	123.4	159.9	-84.6	-31.7	0	0	0	109.9	Y12	D10-Y12 HydrophobicContact CB-CD2 4.18Å; D10-Y12 HydrophobicContact CB-CE2 4.07Å
11	N	34	Very low	33.1	Very low	162 Å²	162	153.2 Å²	153.2	87%	0.866	83%	0.83	S	S	*	*			trans	-92.2	108.8	179.9	-155.9	18.9	0	0	0	106.5
12	Y	29.8	Very low	33.4	Very low	200 Å²	200	149.4 Å²	149.4	78%	0.784	81%	0.814	S	S	*	*			trans	-128	118.8	168.5	-77.6	-80.1	0	0	0	110.1	D10	D10-Y12 HydrophobicContact CB-CD2 4.18Å; D10-Y12 HydrophobicContact CB-CE2 4.07Å
13	T	32.2	Very low	34.1	Very low	136 Å²	136	144.8 Å²	144.8	83%	0.834	80%	0.804	S	S	*	*			trans	-50.9	142.3	170.4	34.9	0	0	0	0	112.9
14	E	36.6	Very low	35	Very low	195 Å²	195	148.6 Å²	148.6	91%	0.911	81%	0.805	S	S	*	*			trans	-50.9	128.3	175.7	-63.8	174.5	149.5	0	0	113.4
15	E	31.7	Very low	35.8	Very low	195 Å²	195	149 Å²	149	91%	0.911	80%	0.801	S	S	*	*			trans	-132.2	129.6	146	-85.1	-167.2	160.7	0	0	109.1	G17	E15-G17 PolarHBondContact O-N 3.4Å
16	M	42.5	Very low	37.1	Very low	203 Å²	203	150.9 Å²	150.9	100%	1	80%	0.797	S	S	*	*			trans	-55	114.7	-177.6	-76.4	175	179.7	0	0	112.3
17	G	31.3	Very low	38.6	Very low	70 Å²	70	148.7 Å²	148.7	72%	0.722	79%	0.791	S	S	*	*			trans	-119.2	110.8	161.4	0	0	0	0	0	109.4	E15 G19	E15-G17 PolarHBondContact O-N 3.4Å; G17-G19 PolarHBondContact O-N 3.49Å
18	S	40.4	Very low	40.4	Very low	141 Å²	141	141.2 Å²	141.2	99%	0.986	77%	0.77	S	S	*	*			trans	-66	99.7	169.7	-174.6	0	0	0	0	108.2
19	G	34.6	Very low	42.3	Very low	51 Å²	51	143.8 Å²	143.8	53%	0.526	77%	0.772	S	S	.	*			trans	-130.4	129.9	174.1	0	0	0	0	0	108.7	G17 Y21	G17-G19 PolarHBondContact O-N 3.49Å; G19-Y21 PolarHBondContact O-N 3.15Å
20	D	36	Very low	43.8	Very low	167 Å²	167	146 Å²	146	89%	0.893	76%	0.763	S	S	*	*			trans	-46.1	112.2	174.8	-82.8	-41.5	0	0	0	110.1	D22	D20-D22 PolarHBondContact O-N 3.35Å
21	Y	39	Very low	45.4	Very low	225 Å²	225	146.9 Å²	146.9	88%	0.882	76%	0.763	S	S	*	*			trans	-68.1	86.3	158.4	-82.5	-94.7	0	0	0	106	G19 S23	G19-Y21 PolarHBondContact O-N 3.15Å; Y21-S23 PolarHBondContact O-N 3.02Å
22	D	41.2	Very low	46.5	Very low	148 Å²	148	143.3 Å²	143.3	79%	0.791	74%	0.741	S	S	*	*			trans	-47.6	111.9	152.5	-99.7	-25.5	0	0	0	105.8	D20 I24	D20-D22 PolarHBondContact O-N 3.35Å; D22-I24 PolarHBondContact O-N 3.32Å
23	S	45.1	Very low	48.2	Very low	100 Å²	100	138.5 Å²	138.5	70%	0.699	73%	0.729	S	S	*	*			trans	-55	105.6	-176.8	61	0	0	0	0	107.5	Y21 K25	Y21-S23 PolarHBondContact O-N 3.02Å; S23-K25 PolarHBondContact O-N 3.44Å
24	I	44.8	Very low	49.7	Very low	156 Å²	156	133.1 Å²	133.1	80%	0.8	70%	0.699	S	S	*	*			trans	-59.1	99.7	165.4	-61.1	174.6	0	0	0	104.1	D22 E26	D22-I24 PolarHBondContact O-N 3.32Å; I24-E26 PolarHBondContact O-N 3.07Å
25	K	52.9	Low	51.7	Low	158 Å²	158	131 Å²	131	69%	0.687	69%	0.688	S	S	*	*			trans	-57.3	108.1	171.8	-92.5	-174.4	174	-176.6	0	105.2	S23	S23-K25 PolarHBondContact O-N 3.44Å
26	E	54.4	Low	54.1	Low	158 Å²	158	126.3 Å²	126.3	74%	0.738	67%	0.665	S	S	*	*			trans	-53.1	132.1	166.5	-76.6	-179.6	155.6	0	0	107.4	I24 C28	I24-E26 PolarHBondContact O-N 3.07Å; E26-C28 PolarHBondContact O-N 3.33Å
27	P	65.4	Low	56	Low	94 Å²	94	117.8 Å²	117.8	61%	0.61	62%	0.623	S	S	*	*			trans	-60.2	114.5	177.1	21.5	-29.5	0	0	0	108.6	F29	P27-F29 HydrophobicContact CB-CE2 4.11Å; P27-F29 HydrophobicContact CB-CZ 4.08Å; P27-F29 HydrophobicContact CG-CE2 3.78Å; P27-F29 HydrophobicContact CG-CZ 3.93Å; P27-F29 VanDerWaalsContact O-CD2 3.25Å; P27-F29 WeakPolarHBondContact O-CD2 3.27Å; P27-F29 WeakPolarHBondContact O-CE2 2.95Å; P27-F29 PolarHBondContact O-N 3.11Å
28	C	67.4	Low	58.6	Low	56 Å²	56	119.3 Å²	119.3	38%	0.378	61%	0.608	S	S	.	*			trans	-69.2	104.7	176.1	-61.7	0	0	0	0	108.9	E26 C274	E26-C28 PolarHBondContact O-N 3.33Å; C28-C274 WeakPolarHBondContact CA-SG 3.29Å; C28-C274 HydrophobicContact CB-CB 3.71Å; C28-C274 WeakPolarHBondContact CB-SG 3.45Å; C28-C274 WeakPolarHBondContact SG-CA 3.37Å; C28-C274 WeakPolarHBondContact SG-CB 3.35Å; C28-C274 CovalentContact SG-SG 2.03Å; C28-C274 PolarHBondContact SG-SG 3.28Å
29	F	67.5	Low	61	Low	159 Å²	159	117.1 Å²	117.1	70%	0.697	58%	0.584	S	S	*	*			trans	-81.2	136.3	168.9	-61.7	-76.1	0	0	0	109.2	P27 E31 N278	P27-F29 HydrophobicContact CB-CE2 4.11Å; P27-F29 HydrophobicContact CB-CZ 4.08Å; P27-F29 HydrophobicContact CG-CE2 3.78Å; P27-F29 HydrophobicContact CG-CZ 3.93Å; P27-F29 VanDerWaalsContact O-CD2 3.25Å; P27-F29 WeakPolarHBondContact O-CD2 3.27Å; P27-F29 WeakPolarHBondContact O-CE2 2.95Å; P27-F29 PolarHBondContact O-N 3.11Å; F29-E31 VanDerWaalsContact C-N 3.32Å; F29-E31 PolarHBondContact O-N 3.19Å; F29-N278 PolarHBondContact O-ND2 3.01Å
30	R	64.1	Low	63.8	Low	157 Å²	157	117 Å²	117	59%	0.592	57%	0.569	S	S	*	*			trans	-69.5	90.8	179	-164.9	175.2	-168	-178.4	0.5	108.8	E32	R30-E32 VanDerWaalsContact C-N 3.34Å; R30-E32 PolarHBondContact O-N 3.38Å
31	E	62.3	Low	66.5	Low	153 Å²	153	109.8 Å²	109.8	72%	0.715	53%	0.53	S	S	*	.			trans	-72.8	93.5	171.6	-74.4	-170.3	162.9	0	0	107.9	F29 N33	F29-E31 VanDerWaalsContact C-N 3.32Å; F29-E31 PolarHBondContact O-N 3.19Å; E31-N33 PolarHBondContact O-N 3.04Å
32	E	57.7	Low	69.2	Low	88 Å²	88	100 Å²	100	41%	0.411	49%	0.494	S	S	.	.			trans	-56.7	118.5	164.4	-76.6	-165.6	166.9	0	0	107.3	R30 A34 R38 R183	R30-E32 VanDerWaalsContact C-N 3.34Å; R30-E32 PolarHBondContact O-N 3.38Å; E32-A34 HydrophobicContact CB-CB 3.87Å; E32-A34 PolarHBondContact O-N 3.16Å; E32-R38 IonicContact OE2-NH2 2.84Å; E32-R183 VanDerWaalsContact CD-NH1 3.31Å; E32-R183 IonicContact OE1-CZ 2.72Å; E32-R183 IonicContact OE1-NH1 2.75Å; E32-R183 PolarHBondContact OE1-NH1 2.95Å; E32-R183 IonicContact OE2-NH1 3.87Å; E32-R183 PolarHBondContact OE2-NH1 3.46Å
33	N	64.5	Low	71.8	Confident	99 Å²	99	96.4 Å²	96.4	53%	0.529	48%	0.478	S	S	.	.			trans	-67.1	60.2	153.9	-97.5	-51.1	0	0	0	108.1	E31 H35 F36 N37 K282	E31-N33 PolarHBondContact O-N 3.04Å; N33-H35 PolarHBondContact O-N 2.98Å; N33-H35 VanDerWaalsContact O-N 3.14Å; N33-F36 PolarHBondContact O-N 3.27Å; N33-F36 VanDerWaalsContact O-N 3.11Å; N33-N37 PolarHBondContact O-N 2.63Å; N33-K282 HydrophobicContact CB-CD 4.28Å
34	A	65.3	Low	74.3	Confident	23 Å²	23	92.5 Å²	92.5	19%	0.19	45%	0.449	C	S	.	.	H	α-helix	trans	-57.3	-38.9	-163	0	0	0	0	0	109.6	E32 F36 R38	E32-A34 HydrophobicContact CB-CB 3.87Å; E32-A34 PolarHBondContact O-N 3.16Å; A34-F36 PolarHBondContact O-N 3.3Å; A34-R38 WeakPolarHBondContact O-CB 3.37Å; A34-R38 WeakPolarHBondContact O-CD 3.04Å; A34-R38 WeakPolarHBondContact O-CG 3.25Å; A34-R38 PolarHBondContact O-N 3.46Å
35	H	77	Confident	76.7	Confident	150 Å²	150	85.7 Å²	85.7	69%	0.694	41%	0.413	S	S	*	.	H	α-helix	trans	-63.8	-41	-177.7	-162.1	-77.4	0	0	0	113.5	N33 I39	N33-H35 PolarHBondContact O-N 2.98Å; N33-H35 VanDerWaalsContact O-N 3.14Å; H35-I39 WeakPolarHBondContact O-CD1 3.38Å; H35-I39 WeakPolarHBondContact O-CG1 3.2Å
36	F	83.3	Confident	78.8	Confident	97 Å²	97	80.8 Å²	80.8	43%	0.425	40%	0.399	S	S	.	.	H	α-helix	trans	-73.5	-48.8	178.5	-178.2	-94.9	0	0	0	111	N33 A34 R38 I39 F40 I286	N33-F36 PolarHBondContact O-N 3.27Å; N33-F36 VanDerWaalsContact O-N 3.11Å; A34-F36 PolarHBondContact O-N 3.3Å; F36-R38 PolarHBondContact O-N 3.14Å; F36-I39 PolarHBondContact O-N 2.97Å; F36-F40 HydrophobicContact CD1-CB 4.11Å; F36-F40 HydrophobicContact CE1-CB 3.75Å; F36-F40 HydrophobicContact CE1-CD1 4.2Å; F36-F40 HydrophobicContact CE1-CD2 4.12Å; F36-F40 AromaticContact CE1-CG 3.75Å; F36-F40 HydrophobicContact CE1-CG 3.75Å; F36-F40 HydrophobicContact CZ-CB 3.98Å; F36-F40 AromaticContact CZ-CD2 3.78Å; F36-F40 HydrophobicContact CZ-CD2 3.78Å; F36-F40 HydrophobicContact CZ-CE2 4.46Å; F36-F40 AromaticContact CZ-CG 3.89Å; F36-F40 HydrophobicContact CZ-CG 3.89Å; F36-F40 WeakPolarHBondContact O-CB 3.36Å; F36-F40 PolarHBondContact O-N 3.49Å; F36-I286 HydrophobicContact CD1-CD1 4.27Å; F36-I286 HydrophobicContact CE1-CD1 3.68Å; F36-I286 HydrophobicContact CE1-CG1 4.13Å
37	N	82.6	Confident	80.8	Confident	23 Å²	23	76.7 Å²	76.7	12%	0.123	38%	0.381	C	S	.	.	H	α-helix	trans	-66.7	-38.4	-176.7	-74.5	-2.5	0	0	0	112.3	N33 I39 F40 L41	N33-N37 PolarHBondContact O-N 2.63Å; N37-I39 PolarHBondContact O-N 2.75Å; N37-F40 PolarHBondContact O-N 3.21Å; N37-L41 HydrophobicContact CB-CD1 3.99Å; N37-L41 HydrophobicContact CB-CG 4.34Å; N37-L41 VanDerWaalsContact O-CB 3.3Å; N37-L41 WeakPolarHBondContact O-CB 3.47Å; N37-L41 WeakPolarHBondContact O-CG 3.37Å; N37-L41 PolarHBondContact O-N 3.01Å
38	R	85.5	Confident	82.3	Confident	103 Å²	103	72.2 Å²	72.2	39%	0.389	35%	0.352	S	S	.	.	H	α-helix	trans	-64.6	-17.4	176.3	-72.7	174.5	-177	-165.5	5.8	113.9	E32 A34 F36 P42 A98	E32-R38 IonicContact OE2-NH2 2.84Å; A34-R38 WeakPolarHBondContact O-CB 3.37Å; A34-R38 WeakPolarHBondContact O-CD 3.04Å; A34-R38 WeakPolarHBondContact O-CG 3.25Å; A34-R38 PolarHBondContact O-N 3.46Å; F36-R38 PolarHBondContact O-N 3.14Å; R38-P42 WeakPolarHBondContact O-CD 3.49Å; R38-P42 WeakPolarHBondContact O-CG 3.37Å; R38-A98 VanDerWaalsContact CG-O 3.3Å; R38-A98 WeakPolarHBondContact CG-O 3.4Å
39	I	90.7	Very high	83.7	Confident	94 Å²	94	72.6 Å²	72.6	48%	0.482	35%	0.348	S	S	.	.	H	α-helix	trans	-101.3	-48.6	174.7	-62.3	172.9	0	0	0	110	H35 F36 N37 T43	H35-I39 WeakPolarHBondContact O-CD1 3.38Å; H35-I39 WeakPolarHBondContact O-CG1 3.2Å; F36-I39 PolarHBondContact O-N 2.97Å; N37-I39 PolarHBondContact O-N 2.75Å; I39-T43 VanDerWaalsContact O-CB 3.31Å; I39-T43 WeakPolarHBondContact O-CB 3.42Å; I39-T43 PolarHBondContact O-N 3.44Å; I39-T43 PolarHBondContact O-OG1 3Å
40	F	93.3	Very high	85.1	Confident	49 Å²	49	70.3 Å²	70.3	22%	0.215	34%	0.342	C	S	.	.	H	α-helix	trans	-65.3	-53	-173.8	-179.9	-96.6	0	0	0	112.4	F36 N37 T43 I44 I286 L290	F36-F40 HydrophobicContact CD1-CB 4.11Å; F36-F40 HydrophobicContact CE1-CB 3.75Å; F36-F40 HydrophobicContact CE1-CD1 4.2Å; F36-F40 HydrophobicContact CE1-CD2 4.12Å; F36-F40 AromaticContact CE1-CG 3.75Å; F36-F40 HydrophobicContact CE1-CG 3.75Å; F36-F40 HydrophobicContact CZ-CB 3.98Å; F36-F40 AromaticContact CZ-CD2 3.78Å; F36-F40 HydrophobicContact CZ-CD2 3.78Å; F36-F40 HydrophobicContact CZ-CE2 4.46Å; F36-F40 AromaticContact CZ-CG 3.89Å; F36-F40 HydrophobicContact CZ-CG 3.89Å; F36-F40 WeakPolarHBondContact O-CB 3.36Å; F36-F40 PolarHBondContact O-N 3.49Å; N37-F40 PolarHBondContact O-N 3.21Å; F40-T43 WeakPolarHBondContact O-CB 3.24Å; F40-T43 PolarHBondContact O-N 3.49Å; F40-I44 HydrophobicContact CD1-CG1 4.27Å; F40-I44 HydrophobicContact CD2-CG1 4.35Å; F40-I44 HydrophobicContact CE1-CG1 3.86Å; F40-I44 HydrophobicContact CE2-CD1 4.18Å; F40-I44 HydrophobicContact CE2-CG1 3.96Å; F40-I44 HydrophobicContact CG-CG1 4.49Å; F40-I44 HydrophobicContact CZ-CD1 4.16Å; F40-I44 HydrophobicContact CZ-CG1 3.7Å; F40-I44 WeakPolarHBondContact O-CG1 3.18Å; F40-I44 PolarHBondContact O-N 3.34Å; F40-I286 HydrophobicContact CD1-CG1 4.24Å; F40-I286 HydrophobicContact CE1-CB 4.23Å; F40-I286 HydrophobicContact CE1-CG1 4.16Å; F40-I286 HydrophobicContact CE1-CG2 3.83Å; F40-I286 HydrophobicContact CZ-CG2 4.05Å; F40-L290 HydrophobicContact CZ-CD2 4.19Å; F40-L290 HydrophobicContact CZ-CG 4.34Å
41	L	93.5	Very high	86.6	Confident	16 Å²	16	66 Å²	66	8%	0.084	33%	0.333	C	S	.	.	H	α-helix	trans	-59.6	-54.7	-175.8	-62.4	175.8	0	0	0	112.7	N37 T43 I44 Y45 A98 A289	N37-L41 HydrophobicContact CB-CD1 3.99Å; N37-L41 HydrophobicContact CB-CG 4.34Å; N37-L41 VanDerWaalsContact O-CB 3.3Å; N37-L41 WeakPolarHBondContact O-CB 3.47Å; N37-L41 WeakPolarHBondContact O-CG 3.37Å; N37-L41 PolarHBondContact O-N 3.01Å; L41-T43 PolarHBondContact O-N 2.89Å; L41-I44 PolarHBondContact O-N 3.08Å; L41-I44 VanDerWaalsContact O-N 3.15Å; L41-Y45 HydrophobicContact CB-CD2 4.42Å; L41-Y45 HydrophobicContact CB-CE2 3.9Å; L41-Y45 WeakPolarHBondContact O-CD2 3.42Å; L41-Y45 PolarHBondContact O-N 3.49Å; L41-A98 HydrophobicContact CB-CB 4.04Å; L41-A98 HydrophobicContact CD1-CB 4.26Å; L41-A289 HydrophobicContact CD2-CB 3.67Å
42	P	95	Very high	88.1	Confident	19 Å²	19	58.7 Å²	58.7	12%	0.123	30%	0.299	C	S	.	.	H	α-helix	trans	-64.4	-30	-179.7	24.5	-33.5	0	0	0	112.7	R38 S46 A95 V99	R38-P42 WeakPolarHBondContact O-CD 3.49Å; R38-P42 WeakPolarHBondContact O-CG 3.37Å; P42-S46 VanDerWaalsContact O-CB 3.23Å; P42-S46 WeakPolarHBondContact O-CB 3.31Å; P42-S46 PolarHBondContact O-N 2.94Å; P42-S46 PolarHBondContact O-OG 3.18Å; P42-A95 HydrophobicContact CB-CB 3.95Å; P42-V99 HydrophobicContact CG-CB 4.42Å
43	T	96	Very high	89.9	Confident	73 Å²	73	57.1 Å²	57.1	45%	0.448	29%	0.293	S	S	.	.	H	α-helix	trans	-63.3	-50	173.6	-60.2	0	0	0	0	110.7	I39 F40 L41 S46 I47	I39-T43 VanDerWaalsContact O-CB 3.31Å; I39-T43 WeakPolarHBondContact O-CB 3.42Å; I39-T43 PolarHBondContact O-N 3.44Å; I39-T43 PolarHBondContact O-OG1 3Å; F40-T43 WeakPolarHBondContact O-CB 3.24Å; F40-T43 PolarHBondContact O-N 3.49Å; L41-T43 PolarHBondContact O-N 2.89Å; T43-S46 PolarHBondContact O-N 2.71Å; T43-I47 HydrophobicContact CG2-CD1 4.04Å; T43-I47 VanDerWaalsContact O-CG1 3.31Å; T43-I47 WeakPolarHBondContact O-CG1 3.42Å; T43-I47 PolarHBondContact O-N 2.91Å
44	I	96.5	Very high	91.3	Very high	18 Å²	18	57.4 Å²	57.4	9%	0.092	30%	0.298	C	S	.	.	H	α-helix	trans	-63.5	-47.1	178.3	-65.1	-58.5	0	0	0	111	F40 L41 S46 I47 I48 A289 L290 F293	F40-I44 HydrophobicContact CD1-CG1 4.27Å; F40-I44 HydrophobicContact CD2-CG1 4.35Å; F40-I44 HydrophobicContact CE1-CG1 3.86Å; F40-I44 HydrophobicContact CE2-CD1 4.18Å; F40-I44 HydrophobicContact CE2-CG1 3.96Å; F40-I44 HydrophobicContact CG-CG1 4.49Å; F40-I44 HydrophobicContact CZ-CD1 4.16Å; F40-I44 HydrophobicContact CZ-CG1 3.7Å; F40-I44 WeakPolarHBondContact O-CG1 3.18Å; F40-I44 PolarHBondContact O-N 3.34Å; L41-I44 PolarHBondContact O-N 3.08Å; L41-I44 VanDerWaalsContact O-N 3.15Å; I44-S46 VanDerWaalsContact C-N 3.29Å; I44-S46 PolarHBondContact O-N 3.5Å; I44-I47 PolarHBondContact O-N 3.33Å; I44-I48 HydrophobicContact CG2-CD1 3.61Å; I44-I48 HydrophobicContact CG2-CG1 4.33Å; I44-I48 VanDerWaalsContact O-CG1 3.31Å; I44-I48 WeakPolarHBondContact O-CG1 3.3Å; I44-I48 PolarHBondContact O-N 3.46Å; I44-A289 HydrophobicContact CB-CB 4.45Å; I44-A289 HydrophobicContact CG2-CB 4.02Å; I44-A289 WeakPolarHBondContact CG2-O 3.19Å; I44-L290 HydrophobicContact CD1-CD2 4.45Å; I44-F293 HydrophobicContact CD1-CE2 4.19Å; I44-F293 HydrophobicContact CD1-CZ 4.36Å; I44-F293 HydrophobicContact CG2-CE2 3.81Å; I44-F293 HydrophobicContact CG2-CZ 4.49Å
45	Y	96.9	Very high	92.6	Very high	12 Å²	12	57 Å²	57	5%	0.047	30%	0.296	C	S	.	.	H	α-helix	trans	-58.9	-40	177.3	-61.8	-24.7	0	0	0	112.3	L41 I48 F49 L91 W94 A95 A98 A289 F292	L41-Y45 HydrophobicContact CB-CD2 4.42Å; L41-Y45 HydrophobicContact CB-CE2 3.9Å; L41-Y45 WeakPolarHBondContact O-CD2 3.42Å; L41-Y45 PolarHBondContact O-N 3.49Å; Y45-I48 PolarHBondContact O-N 3.27Å; Y45-F49 WeakPolarHBondContact O-CB 3.22Å; Y45-F49 PolarHBondContact O-N 3Å; Y45-L91 HydrophobicContact CD1-CD2 4.09Å; Y45-L91 HydrophobicContact CG-CD2 4.39Å; Y45-W94 HydrophobicContact CD2-CB 3.79Å; Y45-W94 HydrophobicContact CE2-CB 3.7Å; Y45-W94 HydrophobicContact CG-CB 4.48Å; Y45-A95 HydrophobicContact CD2-CB 4.29Å; Y45-A98 HydrophobicContact CE2-CB 4.42Å; Y45-A289 HydrophobicContact CD1-CB 4.43Å; Y45-A289 HydrophobicContact CE1-CB 3.68Å; Y45-F292 AromaticContact CD1-CD2 4Å; Y45-F292 HydrophobicContact CD1-CD2 4Å; Y45-F292 HydrophobicContact CD1-CE2 4.22Å; Y45-F292 AromaticContact CE1-CD2 3.7Å; Y45-F292 HydrophobicContact CE1-CD2 3.7Å; Y45-F292 AromaticContact CE1-CE2 3.56Å; Y45-F292 HydrophobicContact CE1-CE2 3.56Å
46	S	96.6	Very high	93.4	Very high	56 Å²	56	49.8 Å²	49.8	39%	0.392	26%	0.263	S	S	.	.	H	α-helix	trans	-66.6	-41.1	176.8	-61.4	0	0	0	0	112.5	P42 T43 I44 F49 L50	P42-S46 VanDerWaalsContact O-CB 3.23Å; P42-S46 WeakPolarHBondContact O-CB 3.31Å; P42-S46 PolarHBondContact O-N 2.94Å; P42-S46 PolarHBondContact O-OG 3.18Å; T43-S46 PolarHBondContact O-N 2.71Å; I44-S46 VanDerWaalsContact C-N 3.29Å; I44-S46 PolarHBondContact O-N 3.5Å; S46-F49 PolarHBondContact O-N 3.33Å; S46-L50 WeakPolarHBondContact O-CG 3.22Å; S46-L50 PolarHBondContact O-N 3.27Å
47	I	96.4	Very high	93.8	Very high	72 Å²	72	46 Å²	46	37%	0.369	25%	0.251	S	S	.	.	H	α-helix	trans	-62	-47.5	176	-69.9	165.6	0	0	0	110.2	T43 I44 L50 T51 F293	T43-I47 HydrophobicContact CG2-CD1 4.04Å; T43-I47 VanDerWaalsContact O-CG1 3.31Å; T43-I47 WeakPolarHBondContact O-CG1 3.42Å; T43-I47 PolarHBondContact O-N 2.91Å; I44-I47 PolarHBondContact O-N 3.33Å; I47-L50 PolarHBondContact O-N 3.15Å; I47-T51 HydrophobicContact CG2-CG2 4.48Å; I47-T51 WeakPolarHBondContact O-CB 3.32Å; I47-T51 WeakPolarHBondContact O-CG2 3.41Å; I47-T51 PolarHBondContact O-N 3.17Å; I47-T51 PolarHBondContact O-OG1 2.87Å; I47-F293 HydrophobicContact CG2-CE1 4.22Å; I47-F293 HydrophobicContact CG2-CZ 4.3Å
48	I	96.6	Very high	94.2	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-67.8	-38.4	-179.3	-62.8	172.7	0	0	0	110.5	I44 Y45 G52 V88 L91 A289 F292 F293	I44-I48 HydrophobicContact CG2-CD1 3.61Å; I44-I48 HydrophobicContact CG2-CG1 4.33Å; I44-I48 VanDerWaalsContact O-CG1 3.31Å; I44-I48 WeakPolarHBondContact O-CG1 3.3Å; I44-I48 PolarHBondContact O-N 3.46Å; Y45-I48 PolarHBondContact O-N 3.27Å; I48-G52 VanDerWaalsContact O-CA 3.29Å; I48-G52 WeakPolarHBondContact O-CA 3.47Å; I48-G52 PolarHBondContact O-N 3.34Å; I48-V88 HydrophobicContact CG2-CG2 4.38Å; I48-L91 HydrophobicContact CB-CD1 3.81Å; I48-L91 HydrophobicContact CG2-CD1 3.47Å; I48-L91 VanDerWaalsContact CG2-CD1 3.47Å; I48-A289 WeakPolarHBondContact CD1-O 3.41Å; I48-F292 HydrophobicContact CD1-CB 3.51Å; I48-F292 HydrophobicContact CG2-CB 4.33Å; I48-F293 HydrophobicContact CD1-CD2 3.79Å; I48-F293 HydrophobicContact CD1-CE2 3.95Å; I48-F293 HydrophobicContact CD1-CG 4.17Å; I48-F293 HydrophobicContact CD1-CZ 4.43Å; I48-F293 HydrophobicContact CG1-CD1 4.27Å; I48-F293 HydrophobicContact CG1-CD2 4.24Å; I48-F293 HydrophobicContact CG1-CE1 4.21Å; I48-F293 HydrophobicContact CG1-CE2 4.19Å; I48-F293 HydrophobicContact CG1-CG 4.29Å; I48-F293 HydrophobicContact CG1-CZ 4.17Å
49	F	97.5	Very high	94.4	Very high	64 Å²	64	42.9 Å²	42.9	28%	0.281	24%	0.242	S	C	.	.	H	α-helix	trans	-53.8	-59.3	171.3	174.1	-111.8	0	0	0	111.4	Y45 S46 T51 G52 I53 V88 L91 P92	Y45-F49 WeakPolarHBondContact O-CB 3.22Å; Y45-F49 PolarHBondContact O-N 3Å; S46-F49 PolarHBondContact O-N 3.33Å; F49-T51 PolarHBondContact O-N 2.98Å; F49-G52 PolarHBondContact O-N 2.84Å; F49-I53 HydrophobicContact CD2-CD1 4.3Å; F49-I53 HydrophobicContact CD2-CG1 3.82Å; F49-I53 HydrophobicContact CE2-CD1 3.84Å; F49-I53 HydrophobicContact CE2-CG1 3.61Å; F49-I53 HydrophobicContact CZ-CG1 4.16Å; F49-I53 WeakPolarHBondContact O-CB 3.43Å; F49-I53 WeakPolarHBondContact O-CG1 3.31Å; F49-I53 PolarHBondContact O-N 3.2Å; F49-V88 HydrophobicContact CD2-CG1 4.23Å; F49-V88 WeakPolarHBondContact CD2-O 3.48Å; F49-V88 WeakPolarHBondContact O-CG1 3.35Å; F49-L91 HydrophobicContact CB-CB 4.26Å; F49-L91 HydrophobicContact CB-CD1 4.41Å; F49-P92 HydrophobicContact CD2-CG 3.88Å; F49-P92 HydrophobicContact CE1-CG 4.5Å; F49-P92 HydrophobicContact CE2-CG 3.85Å; F49-P92 HydrophobicContact CG-CG 4.21Å; F49-P92 HydrophobicContact CZ-CG 4.18Å
50	L	96.3	Very high	94.4	Very high	111 Å²	111	40.5 Å²	40.5	58%	0.581	23%	0.23	S	C	*	.	H	α-helix	trans	-62.9	-48.3	-175.8	-67.5	173.5	0	0	0	112.1	S46 I47 V54	S46-L50 WeakPolarHBondContact O-CG 3.22Å; S46-L50 PolarHBondContact O-N 3.27Å; I47-L50 PolarHBondContact O-N 3.15Å; L50-V54 VanDerWaalsContact O-CG2 3.32Å; L50-V54 WeakPolarHBondContact O-CG2 3.5Å; L50-V54 PolarHBondContact O-N 3.09Å
51	T	94.8	Very high	94.1	Very high	65 Å²	65	43.1 Å²	43.1	40%	0.399	25%	0.245	S	C	.	.	H	α-helix	trans	-70.1	-36.9	-178	55.3	0	0	0	0	112.3	I47 F49 G55 C296	I47-T51 HydrophobicContact CG2-CG2 4.48Å; I47-T51 WeakPolarHBondContact O-CB 3.32Å; I47-T51 WeakPolarHBondContact O-CG2 3.41Å; I47-T51 PolarHBondContact O-N 3.17Å; I47-T51 PolarHBondContact O-OG1 2.87Å; F49-T51 PolarHBondContact O-N 2.98Å; T51-G55 PolarHBondContact O-N 3.5Å; T51-C296 PolarHBondContact OG1-SG 3.43Å
52	G	95.1	Very high	93.7	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-70.5	-42.8	179.6	0	0	0	0	0	113.1	I48 F49 N56	I48-G52 VanDerWaalsContact O-CA 3.29Å; I48-G52 WeakPolarHBondContact O-CA 3.47Å; I48-G52 PolarHBondContact O-N 3.34Å; F49-G52 PolarHBondContact O-N 2.84Å; G52-N56 VanDerWaalsContact O-CB 3.28Å; G52-N56 WeakPolarHBondContact O-CB 3.45Å; G52-N56 PolarHBondContact O-N 2.99Å; G52-N56 PolarHBondContact O-ND2 2.97Å
53	I	95.4	Very high	93.1	Very high	55 Å²	55	41.9 Å²	41.9	28%	0.282	24%	0.238	S	C	.	.	H	α-helix	trans	-60.2	-49.8	175.6	-67.4	-73.6	0	0	0	110.2	F49 G57 L85 V88 I89	F49-I53 HydrophobicContact CD2-CD1 4.3Å; F49-I53 HydrophobicContact CD2-CG1 3.82Å; F49-I53 HydrophobicContact CE2-CD1 3.84Å; F49-I53 HydrophobicContact CE2-CG1 3.61Å; F49-I53 HydrophobicContact CZ-CG1 4.16Å; F49-I53 WeakPolarHBondContact O-CB 3.43Å; F49-I53 WeakPolarHBondContact O-CG1 3.31Å; F49-I53 PolarHBondContact O-N 3.2Å; I53-G57 WeakPolarHBondContact O-CA 3.31Å; I53-G57 PolarHBondContact O-N 3.44Å; I53-L85 HydrophobicContact CD1-CD1 3.74Å; I53-V88 HydrophobicContact CD1-CG1 4.31Å; I53-V88 HydrophobicContact CG1-CG1 4.03Å; I53-I89 HydrophobicContact CD1-CG2 3.49Å; I53-I89 VanDerWaalsContact CD1-CG2 3.49Å
54	V	93.4	Very high	92.3	Very high	105 Å²	105	39.9 Å²	39.9	64%	0.636	23%	0.231	S	C	*	.	H	α-helix	trans	-64.7	-49.5	-179.2	173.9	0	0	0	0	110.7	L50 L58	L50-V54 VanDerWaalsContact O-CG2 3.32Å; L50-V54 WeakPolarHBondContact O-CG2 3.5Å; L50-V54 PolarHBondContact O-N 3.09Å; V54-L58 VanDerWaalsContact O-CB 3.24Å; V54-L58 WeakPolarHBondContact O-CB 3.14Å; V54-L58 PolarHBondContact O-N 3.24Å
55	G	91.6	Very high	91.5	Very high	14 Å²	14	46 Å²	46	14%	0.144	25%	0.254	C	S	.	.	H	α-helix	trans	-65	-56.9	-176.4	0	0	0	0	0	112.8	T51 L58 V59	T51-G55 PolarHBondContact O-N 3.5Å; G55-L58 PolarHBondContact O-N 3.04Å; G55-V59 WeakPolarHBondContact O-CG2 3.37Å; G55-V59 PolarHBondContact O-N 3.26Å; G55-V59 VanDerWaalsContact O-N 3.11Å
56	N	94.1	Very high	90.5	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-71	-35.5	-176.7	-68.9	-62.3	0	0	0	111.9	G52 L58 V59 I60 S81 L85 C295 P299	G52-N56 VanDerWaalsContact O-CB 3.28Å; G52-N56 WeakPolarHBondContact O-CB 3.45Å; G52-N56 PolarHBondContact O-N 2.99Å; G52-N56 PolarHBondContact O-ND2 2.97Å; N56-L58 PolarHBondContact O-N 3.28Å; N56-V59 PolarHBondContact O-N 3.47Å; N56-I60 WeakPolarHBondContact O-CG1 3.34Å; N56-I60 PolarHBondContact O-N 3.43Å; N56-S81 PolarHBondContact OD1-OG 3.42Å; N56-S81 VanDerWaalsContact OD1-OG 3.04Å; N56-L85 HydrophobicContact CB-CB 4.27Å; N56-C295 PolarHBondContact ND2-O 3.44Å; N56-P299 WeakPolarHBondContact OD1-CG 3.4Å
57	G	92.9	Very high	89.3	Confident	18 Å²	18	53.6 Å²	53.6	19%	0.186	28%	0.282	C	S	.	.	H	α-helix	trans	-58.7	-45.1	171.5	0	0	0	0	0	112.2	I53 V59 I60 L61	I53-G57 WeakPolarHBondContact O-CA 3.31Å; I53-G57 PolarHBondContact O-N 3.44Å; G57-V59 PolarHBondContact O-N 2.94Å; G57-I60 PolarHBondContact O-N 3.16Å; G57-L61 WeakPolarHBondContact O-CB 3.23Å; G57-L61 VanDerWaalsContact O-CG 3.27Å; G57-L61 WeakPolarHBondContact O-CG 3.34Å; G57-L61 PolarHBondContact O-N 3.27Å
58	L	90	Very high	87.9	Confident	59 Å²	59	60.2 Å²	60.2	31%	0.309	31%	0.307	S	S	.	.	H	α-helix	trans	-62.4	-42.2	176.3	-176	65.8	0	0	0	112	V54 G55 N56 L61 V62 L317	V54-L58 VanDerWaalsContact O-CB 3.24Å; V54-L58 WeakPolarHBondContact O-CB 3.14Å; V54-L58 PolarHBondContact O-N 3.24Å; G55-L58 PolarHBondContact O-N 3.04Å; N56-L58 PolarHBondContact O-N 3.28Å; L58-L61 PolarHBondContact O-N 3.31Å; L58-V62 HydrophobicContact CD1-CG2 4Å; L58-V62 HydrophobicContact CG-CG2 4.24Å; L58-V62 WeakPolarHBondContact O-CB 3.46Å; L58-V62 VanDerWaalsContact O-CG2 3.26Å; L58-V62 WeakPolarHBondContact O-CG2 3.38Å; L58-V62 PolarHBondContact O-N 3.08Å; L58-L317 HydrophobicContact CD1-CD2 4.49Å
59	V	89.4	Confident	86.5	Confident	1 Å²	1	67.5 Å²	67.5	1%	0.006	35%	0.346	C	S	.	.	H	α-helix	trans	-59.9	-48.4	176.4	174	0	0	0	0	110.9	G55 N56 G57 L61 V62 M63 S81 P299 Y302 F309	G55-V59 WeakPolarHBondContact O-CG2 3.37Å; G55-V59 PolarHBondContact O-N 3.26Å; G55-V59 VanDerWaalsContact O-N 3.11Å; N56-V59 PolarHBondContact O-N 3.47Å; G57-V59 PolarHBondContact O-N 2.94Å; V59-L61 PolarHBondContact O-N 3.01Å; V59-V62 PolarHBondContact O-N 2.86Å; V59-M63 HydrophobicContact CG1-CE 3.64Å; V59-M63 HydrophobicContact CG1-CG 4.39Å; V59-M63 HydrophobicContact CG1-SD 3.67Å; V59-M63 VanDerWaalsContact O-CB 3.31Å; V59-M63 WeakPolarHBondContact O-CB 3.5Å; V59-M63 VanDerWaalsContact O-CG 3.26Å; V59-M63 WeakPolarHBondContact O-CG 3.46Å; V59-M63 PolarHBondContact O-N 3.27Å; V59-S81 VanDerWaalsContact CG1-OG 3.31Å; V59-S81 WeakPolarHBondContact CG1-OG 3.25Å; V59-P299 HydrophobicContact CG2-CB 4.06Å; V59-P299 HydrophobicContact CG2-CG 4.19Å; V59-Y302 HydrophobicContact CG2-CD2 4.24Å; V59-F309 HydrophobicContact CG2-CE2 4.42Å; V59-F309 HydrophobicContact CG2-CZ 3.98Å
60	I	90.5	Very high	85.4	Confident	44 Å²	44	67.4 Å²	67.4	23%	0.226	34%	0.344	C	S	.	.	H	α-helix	trans	-60.5	-45.4	178.6	-69	164.5	0	0	0	110.9	N56 G57 G64 L78 V82 L85	N56-I60 WeakPolarHBondContact O-CG1 3.34Å; N56-I60 PolarHBondContact O-N 3.43Å; G57-I60 PolarHBondContact O-N 3.16Å; I60-G64 WeakPolarHBondContact O-CA 3.37Å; I60-G64 PolarHBondContact O-N 3.22Å; I60-L78 HydrophobicContact CB-CD1 4.24Å; I60-L78 HydrophobicContact CG1-CD1 3.9Å; I60-L78 HydrophobicContact CG2-CD1 4.32Å; I60-V82 HydrophobicContact CD1-CG2 4.05Å; I60-V82 HydrophobicContact CG1-CG2 4.32Å; I60-L85 HydrophobicContact CD1-CB 4.28Å; I60-L85 HydrophobicContact CD1-CD2 3.64Å
61	L	88.4	Confident	84.6	Confident	104 Å²	104	64.7 Å²	64.7	55%	0.545	33%	0.334	S	S	.	.	H	α-helix	trans	-62.5	-54	179	-73.2	170.9	0	0	0	111.6	G57 L58 V59 M63 G64 Y65	G57-L61 WeakPolarHBondContact O-CB 3.23Å; G57-L61 VanDerWaalsContact O-CG 3.27Å; G57-L61 WeakPolarHBondContact O-CG 3.34Å; G57-L61 PolarHBondContact O-N 3.27Å; L58-L61 PolarHBondContact O-N 3.31Å; V59-L61 PolarHBondContact O-N 3.01Å; L61-M63 VanDerWaalsContact C-N 3.33Å; L61-M63 PolarHBondContact O-N 3.25Å; L61-G64 WeakPolarHBondContact O-CA 3.5Å; L61-G64 PolarHBondContact O-N 2.9Å; L61-Y65 VanDerWaalsContact O-CD2 3.23Å; L61-Y65 WeakPolarHBondContact O-CD2 3.24Å; L61-Y65 PolarHBondContact O-N 3.4Å
62	V	84.1	Confident	84	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.322	C	S	.	.	H	α-helix	trans	-59	-46.1	-178.5	172	0	0	0	0	110.6	L58 V59 G64 Y65 Q66 F309 A313 A316	L58-V62 HydrophobicContact CD1-CG2 4Å; L58-V62 HydrophobicContact CG-CG2 4.24Å; L58-V62 WeakPolarHBondContact O-CB 3.46Å; L58-V62 VanDerWaalsContact O-CG2 3.26Å; L58-V62 WeakPolarHBondContact O-CG2 3.38Å; L58-V62 PolarHBondContact O-N 3.08Å; V59-V62 PolarHBondContact O-N 2.86Å; V62-G64 VanDerWaalsContact C-N 3.32Å; V62-G64 PolarHBondContact O-N 3.22Å; V62-Y65 PolarHBondContact O-N 2.94Å; V62-Q66 WeakPolarHBondContact O-CG 3.49Å; V62-Q66 PolarHBondContact O-N 3.42Å; V62-Q66 VanDerWaalsContact O-N 3.14Å; V62-F309 HydrophobicContact CB-CE2 4.02Å; V62-F309 HydrophobicContact CB-CZ 4.33Å; V62-F309 HydrophobicContact CG1-CD2 4.2Å; V62-F309 HydrophobicContact CG1-CE2 3.81Å; V62-F309 HydrophobicContact CG1-CZ 4.43Å; V62-F309 HydrophobicContact CG2-CZ 4.37Å; V62-A313 HydrophobicContact CG2-CB 4.11Å; V62-A316 HydrophobicContact CG2-CB 4.2Å
63	M	82.6	Confident	83.3	Confident	8 Å²	8	63.6 Å²	63.6	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-66.1	-37.5	176.8	-68.6	-178.5	177.8	0	0	111.4	V59 L61 Q66 R70 D74 R77 L78	V59-M63 HydrophobicContact CG1-CE 3.64Å; V59-M63 HydrophobicContact CG1-CG 4.39Å; V59-M63 HydrophobicContact CG1-SD 3.67Å; V59-M63 VanDerWaalsContact O-CB 3.31Å; V59-M63 WeakPolarHBondContact O-CB 3.5Å; V59-M63 VanDerWaalsContact O-CG 3.26Å; V59-M63 WeakPolarHBondContact O-CG 3.46Å; V59-M63 PolarHBondContact O-N 3.27Å; L61-M63 VanDerWaalsContact C-N 3.33Å; L61-M63 PolarHBondContact O-N 3.25Å; M63-Q66 CarbonylContact O-C 3.53Å; M63-Q66 PolarHBondContact O-N 3.3Å; M63-R70 VanDerWaalsContact C-NH2 3.26Å; M63-R70 PolarHBondContact O-NE 3.37Å; M63-R70 PolarHBondContact O-NH2 3.03Å; M63-D74 HydrophobicContact CE-CB 4.11Å; M63-D74 VanDerWaalsContact SD-O 3.32Å; M63-R77 HydrophobicContact CE-CB 3.62Å; M63-R77 HydrophobicContact CE-CG 4.46Å; M63-R77 HydrophobicContact SD-CB 4.28Å; M63-L78 HydrophobicContact CB-CD1 4.27Å; M63-L78 HydrophobicContact SD-CB 3.9Å; M63-L78 HydrophobicContact SD-CD1 4.42Å
64	G	80	Confident	82.8	Confident	31 Å²	31	62.8 Å²	62.8	32%	0.32	32%	0.321	S	S	.	.	H	α-helix	trans	-53.6	-48.5	173.2	0	0	0	0	0	113.3	I60 L61 V62 K67	I60-G64 WeakPolarHBondContact O-CA 3.37Å; I60-G64 PolarHBondContact O-N 3.22Å; L61-G64 WeakPolarHBondContact O-CA 3.5Å; L61-G64 PolarHBondContact O-N 2.9Å; V62-G64 VanDerWaalsContact C-N 3.32Å; V62-G64 PolarHBondContact O-N 3.22Å; G64-K67 WeakPolarHBondContact O-CG 3.42Å
65	Y	78.7	Confident	82.5	Confident	147 Å²	147	59.8 Å²	59.8	58%	0.576	30%	0.3	S	S	*	.	H	α-helix	trans	-68.8	-33.1	176.5	-80	-76	0	0	0	112.9	L61 V62 K67 V320	L61-Y65 VanDerWaalsContact O-CD2 3.23Å; L61-Y65 WeakPolarHBondContact O-CD2 3.24Å; L61-Y65 PolarHBondContact O-N 3.4Å; V62-Y65 PolarHBondContact O-N 2.94Å; Y65-K67 VanDerWaalsContact C-N 3.33Å; Y65-K67 PolarHBondContact O-N 3.01Å; Y65-V320 HydrophobicContact CE2-CG2 3.96Å
66	Q	76.2	Confident	82.5	Confident	67 Å²	67	59.1 Å²	59.1	31%	0.313	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.2	31.3	-177.1	-63	-166.9	-35.8	0	0	114.7	V62 M63 K68 L69 R70 S312	V62-Q66 WeakPolarHBondContact O-CG 3.49Å; V62-Q66 PolarHBondContact O-N 3.42Å; V62-Q66 VanDerWaalsContact O-N 3.14Å; M63-Q66 CarbonylContact O-C 3.53Å; M63-Q66 PolarHBondContact O-N 3.3Å; Q66-K68 PolarHBondContact O-N 2.93Å; Q66-L69 PolarHBondContact O-N 2.94Å; Q66-L69 VanDerWaalsContact O-N 3.09Å; Q66-R70 WeakPolarHBondContact O-CG 3.17Å; Q66-S312 VanDerWaalsContact CD-CB 3.49Å; Q66-S312 PolarHBondContact NE2-OG 3.28Å; Q66-S312 PolarHBondContact OE1-OG 3.09Å
67	K	70.8	Confident	82.2	Confident	160 Å²	160	61.2 Å²	61.2	70%	0.696	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-47	-37.7	-175.7	-93	178.9	-177.7	-173.9	0	114.7	G64 Y65 R70	G64-K67 WeakPolarHBondContact O-CG 3.42Å; Y65-K67 VanDerWaalsContact C-N 3.33Å; Y65-K67 PolarHBondContact O-N 3.01Å; K67-R70 VanDerWaalsContact CG-NH2 3.3Å
68	K	68.4	Low	82.1	Confident	210 Å²	210	62 Å²	62	91%	0.913	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-78.5	-17.9	-175	-69.1	-174.4	178.1	-178.4	0	115.2	Q66	Q66-K68 PolarHBondContact O-N 2.93Å
69	L	66.3	Low	82.3	Confident	154 Å²	154	60.5 Å²	60.5	81%	0.806	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-120.4	18.7	-171.1	-70.1	171.8	0	0	0	114.1	Q66 S71	Q66-L69 PolarHBondContact O-N 2.94Å; Q66-L69 VanDerWaalsContact O-N 3.09Å; L69-S71 PolarHBondContact O-N 3.23Å
70	R	75.2	Confident	82.4	Confident	62 Å²	62	60.5 Å²	60.5	23%	0.234	29%	0.292	C	S	.	.			trans	-71.7	128.1	-177.1	-63.1	-172.8	-166.3	165.1	-0.9	111.9	M63 Q66 K67 D74 L78	M63-R70 VanDerWaalsContact C-NH2 3.26Å; M63-R70 PolarHBondContact O-NE 3.37Å; M63-R70 PolarHBondContact O-NH2 3.03Å; Q66-R70 WeakPolarHBondContact O-CG 3.17Å; K67-R70 VanDerWaalsContact CG-NH2 3.3Å; R70-D74 HydrophobicContact CB-CB 4.36Å; R70-L78 VanDerWaalsContact NH1-CD2 3.29Å
71	S	79.2	Confident	82.6	Confident	53 Å²	53	58.4 Å²	58.4	37%	0.371	28%	0.281	S	S	.	.			trans	-71.7	164.5	166	76.9	0	0	0	0	110.9	L69 T73 D74 K75	L69-S71 PolarHBondContact O-N 3.23Å; S71-T73 VanDerWaalsContact C-N 3.26Å; S71-T73 PolarHBondContact O-N 3.44Å; S71-D74 VanDerWaalsContact CB-OD2 3.27Å; S71-D74 WeakPolarHBondContact CB-OD2 3.48Å; S71-D74 PolarHBondContact N-OD2 3.2Å; S71-D74 PolarHBondContact O-N 3.42Å; S71-D74 VanDerWaalsContact O-N 3.12Å; S71-D74 PolarHBondContact OG-N 3.42Å; S71-D74 PolarHBondContact OG-OD2 3.18Å; S71-K75 PolarHBondContact O-N 3.27Å
72	M	82.1	Confident	83	Confident	30 Å²	30	56.5 Å²	56.5	15%	0.148	27%	0.274	C	S	.	.	H	α-helix	trans	-60.5	-37.9	176.1	-61	-55.3	172.2	0	0	112	D74 K75 Y76 K149 A152	M72-D74 VanDerWaalsContact C-N 3.31Å; M72-D74 PolarHBondContact O-N 3.12Å; M72-K75 WeakPolarHBondContact O-CB 3.46Å; M72-K75 PolarHBondContact O-N 3.37Å; M72-K75 HydrophobicContact SD-CD 4.2Å; M72-Y76 VanDerWaalsContact O-CD2 3.32Å; M72-Y76 WeakPolarHBondContact O-CD2 3.14Å; M72-Y76 PolarHBondContact O-N 3.03Å; M72-K149 HydrophobicContact CE-CB 3.83Å; M72-K149 HydrophobicContact CE-CG 4.07Å; M72-A152 HydrophobicContact SD-CB 4.23Å
73	T	81.1	Confident	83.6	Confident	13 Å²	13	56.5 Å²	56.5	8%	0.08	27%	0.274	C	S	.	.	H	α-helix	trans	-63.6	-38.4	175.4	-54.8	0	0	0	0	111.4	S71 K75 Y76 R77 D133 R134	S71-T73 VanDerWaalsContact C-N 3.26Å; S71-T73 PolarHBondContact O-N 3.44Å; T73-K75 PolarHBondContact O-N 3.31Å; T73-Y76 PolarHBondContact O-N 2.96Å; T73-R77 HydrophobicContact CG2-CG 4.45Å; T73-R77 VanDerWaalsContact O-CG 3.27Å; T73-R77 WeakPolarHBondContact O-CG 3.44Å; T73-R77 PolarHBondContact O-N 2.79Å; T73-D133 PolarHBondContact OG1-OD2 3.48Å; T73-R134 PolarHBondContact OG1-NH2 3.44Å
74	D	83.6	Confident	84.2	Confident	37 Å²	37	56.1 Å²	56.1	20%	0.198	27%	0.272	C	S	.	.	H	α-helix	trans	-65.3	-27.8	177.7	-56.3	-40	0	0	0	112.5	M63 R70 S71 M72 R77 L78	M63-D74 HydrophobicContact CE-CB 4.11Å; M63-D74 VanDerWaalsContact SD-O 3.32Å; R70-D74 HydrophobicContact CB-CB 4.36Å; S71-D74 VanDerWaalsContact CB-OD2 3.27Å; S71-D74 WeakPolarHBondContact CB-OD2 3.48Å; S71-D74 PolarHBondContact N-OD2 3.2Å; S71-D74 PolarHBondContact O-N 3.42Å; S71-D74 VanDerWaalsContact O-N 3.12Å; S71-D74 PolarHBondContact OG-N 3.42Å; S71-D74 PolarHBondContact OG-OD2 3.18Å; M72-D74 VanDerWaalsContact C-N 3.31Å; M72-D74 PolarHBondContact O-N 3.12Å; D74-R77 IonicContact OD1-NH1 3.36Å; D74-R77 PolarHBondContact OD1-NH1 2.91Å; D74-L78 PolarHBondContact O-N 2.91Å
75	K	88.4	Confident	85	Confident	42 Å²	42	56.8 Å²	56.8	18%	0.183	27%	0.268	C	S	.	.	H	α-helix	trans	-65.7	-46.1	172.5	-63.8	178.3	-177.9	171	0	111.6	S71 M72 T73 R77 L78 H79 A152 E153	S71-K75 PolarHBondContact O-N 3.27Å; M72-K75 WeakPolarHBondContact O-CB 3.46Å; M72-K75 PolarHBondContact O-N 3.37Å; M72-K75 HydrophobicContact SD-CD 4.2Å; T73-K75 PolarHBondContact O-N 3.31Å; K75-R77 VanDerWaalsContact C-N 3.34Å; K75-R77 PolarHBondContact O-N 3.4Å; K75-L78 WeakPolarHBondContact O-CB 3.45Å; K75-L78 PolarHBondContact O-N 3.15Å; K75-H79 PolarHBondContact O-CD2 3.45Å; K75-H79 VanDerWaalsContact O-CD2 3.23Å; K75-H79 PolarHBondContact O-N 3.32Å; K75-H79 VanDerWaalsContact O-N 3.17Å; K75-A152 HydrophobicContact CD-CB 4.31Å; K75-E153 IonicContact NZ-OE1 2.8Å; K75-E153 PolarHBondContact NZ-OE1 2.93Å
76	Y	90.3	Very high	85.8	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-63.6	-40.1	176.2	-67.9	-62.4	0	0	0	112.5	M72 T73 L78 H79 L80 F129 I130 D133 L151 A152 V156	M72-Y76 VanDerWaalsContact O-CD2 3.32Å; M72-Y76 WeakPolarHBondContact O-CD2 3.14Å; M72-Y76 PolarHBondContact O-N 3.03Å; T73-Y76 PolarHBondContact O-N 2.96Å; Y76-L78 VanDerWaalsContact C-N 3.25Å; Y76-L78 PolarHBondContact O-N 3.03Å; Y76-H79 WeakPolarHBondContact O-CB 3.44Å; Y76-H79 PolarHBondContact O-N 2.88Å; Y76-H79 VanDerWaalsContact O-N 3.15Å; Y76-L80 PolarHBondContact O-N 3Å; Y76-F129 HydrophobicContact CD1-CB 4.22Å; Y76-F129 HydrophobicContact CE1-CB 3.78Å; Y76-F129 AromaticContact CE1-CD1 3.95Å; Y76-F129 HydrophobicContact CE1-CD1 3.95Å; Y76-F129 HydrophobicContact CE1-CG 4.33Å; Y76-I130 HydrophobicContact CD2-CG1 4.1Å; Y76-I130 HydrophobicContact CG-CG1 3.9Å; Y76-D133 HydrophobicContact CE2-CB 3.79Å; Y76-L151 VanDerWaalsContact OH-C 3.31Å; Y76-L151 WeakPolarHBondContact OH-CD2 3.31Å; Y76-L151 WeakPolarHBondContact OH-CG 3.48Å; Y76-A152 HydrophobicContact CE1-CB 4.33Å; Y76-A152 HydrophobicContact CE2-CB 3.96Å; Y76-A152 VanDerWaalsContact OH-CA 3.3Å; Y76-A152 WeakPolarHBondContact OH-CA 3.23Å; Y76-A152 PolarHBondContact OH-N 3.46Å; Y76-V156 HydrophobicContact CD1-CG2 4.33Å; Y76-V156 HydrophobicContact CE1-CB 4.29Å; Y76-V156 HydrophobicContact CE1-CG2 4.16Å
77	R	87.8	Confident	86.9	Confident	45 Å²	45	49.8 Å²	49.8	17%	0.17	24%	0.242	C	C	.	.	H	α-helix	trans	-60.5	-36.7	175	-66	178.4	171.7	159.4	-10	112.4	M63 T73 D74 K75 L80 S81 Y302	M63-R77 HydrophobicContact CE-CB 3.62Å; M63-R77 HydrophobicContact CE-CG 4.46Å; M63-R77 HydrophobicContact SD-CB 4.28Å; T73-R77 HydrophobicContact CG2-CG 4.45Å; T73-R77 VanDerWaalsContact O-CG 3.27Å; T73-R77 WeakPolarHBondContact O-CG 3.44Å; T73-R77 PolarHBondContact O-N 2.79Å; D74-R77 IonicContact OD1-NH1 3.36Å; D74-R77 PolarHBondContact OD1-NH1 2.91Å; K75-R77 VanDerWaalsContact C-N 3.34Å; K75-R77 PolarHBondContact O-N 3.4Å; R77-L80 PolarHBondContact O-N 3.44Å; R77-S81 PolarHBondContact O-N 3.24Å; R77-S81 PolarHBondContact O-OG 3.22Å; R77-Y302 HydrophobicContact CB-CE2 3.95Å; R77-Y302 VanDerWaalsContact CD-CZ 3.47Å; R77-Y302 HydrophobicContact CG-CE1 4.1Å; R77-Y302 HydrophobicContact CG-CE2 3.78Å; R77-Y302 VanDerWaalsContact CG-CZ 3.49Å; R77-Y302 WeakPolarHBondContact CG-OH 3.32Å
78	L	90.9	Very high	88.2	Confident	35 Å²	35	42.1 Å²	42.1	18%	0.183	21%	0.209	C	C	.	.	H	α-helix	trans	-64.1	-45.3	174.2	-177.3	64.5	0	0	0	111.4	I60 M63 R70 D74 K75 Y76 L80 S81 V82	I60-L78 HydrophobicContact CB-CD1 4.24Å; I60-L78 HydrophobicContact CG1-CD1 3.9Å; I60-L78 HydrophobicContact CG2-CD1 4.32Å; M63-L78 HydrophobicContact CB-CD1 4.27Å; M63-L78 HydrophobicContact SD-CB 3.9Å; M63-L78 HydrophobicContact SD-CD1 4.42Å; R70-L78 VanDerWaalsContact NH1-CD2 3.29Å; D74-L78 PolarHBondContact O-N 2.91Å; K75-L78 WeakPolarHBondContact O-CB 3.45Å; K75-L78 PolarHBondContact O-N 3.15Å; Y76-L78 VanDerWaalsContact C-N 3.25Å; Y76-L78 PolarHBondContact O-N 3.03Å; L78-L80 VanDerWaalsContact C-N 3.29Å; L78-L80 PolarHBondContact O-N 3.29Å; L78-S81 PolarHBondContact O-N 2.95Å; L78-V82 VanDerWaalsContact O-CG2 3.29Å; L78-V82 WeakPolarHBondContact O-CG2 3.28Å; L78-V82 PolarHBondContact O-N 2.85Å
79	H	93.8	Very high	89.5	Confident	26 Å²	26	36.1 Å²	36.1	12%	0.12	19%	0.186	C	C	.	.	H	α-helix	trans	-59.2	-42.4	174.4	-76	-77.1	0	0	0	111.9	K75 Y76 V82 A83 I126 Y157 W161	K75-H79 PolarHBondContact O-CD2 3.45Å; K75-H79 VanDerWaalsContact O-CD2 3.23Å; K75-H79 PolarHBondContact O-N 3.32Å; K75-H79 VanDerWaalsContact O-N 3.17Å; Y76-H79 WeakPolarHBondContact O-CB 3.44Å; Y76-H79 PolarHBondContact O-N 2.88Å; Y76-H79 VanDerWaalsContact O-N 3.15Å; H79-V82 PolarHBondContact O-N 3.31Å; H79-A83 PolarHBondContact O-N 2.71Å; H79-I126 HydrophobicContact CB-CD1 3.73Å; H79-I126 HydrophobicContact CB-CG1 4.43Å; H79-Y157 AromaticContact CE1-CE1 3.75Å; H79-Y157 AromaticContact CE1-CZ 3.71Å; H79-W161 HydrophobicContact CB-CZ2 4.25Å; H79-W161 AromaticContact CE1-NE1 3.78Å; H79-W161 AromaticContact CG-NE1 3.88Å; H79-W161 AromaticContact ND1-CE2 3.73Å; H79-W161 AromaticContact ND1-CZ2 3.88Å; H79-W161 AromaticContact ND1-NE1 3.1Å; H79-W161 PolarHBondContact ND1-NE1 3.35Å
80	L	93.2	Very high	91	Very high	2 Å²	2	29 Å²	29	1%	0.01	15%	0.149	C	C	.	.	H	α-helix	trans	-62.9	-49.1	178.7	-169.1	59.5	0	0	0	111.3	Y76 R77 L78 V82 A83 D84 I126 L127 N298	Y76-L80 PolarHBondContact O-N 3Å; R77-L80 PolarHBondContact O-N 3.44Å; L78-L80 VanDerWaalsContact C-N 3.29Å; L78-L80 PolarHBondContact O-N 3.29Å; L80-V82 VanDerWaalsContact C-N 3.25Å; L80-V82 PolarHBondContact O-N 2.89Å; L80-A83 PolarHBondContact O-N 2.91Å; L80-A83 VanDerWaalsContact O-N 3.14Å; L80-D84 WeakPolarHBondContact O-CB 3.16Å; L80-D84 PolarHBondContact O-N 2.82Å; L80-I126 HydrophobicContact CB-CG2 4.13Å; L80-I126 HydrophobicContact CD1-CB 4.47Å; L80-I126 HydrophobicContact CD1-CG2 4.44Å; L80-L127 HydrophobicContact CD2-CD2 4.01Å; L80-N298 HydrophobicContact CD2-CB 4.24Å; L80-N298 VanDerWaalsContact CD2-CG 3.45Å; L80-N298 VanDerWaalsContact CD2-ND2 3.28Å; L80-N298 WeakPolarHBondContact CD2-ND2 3.34Å; L80-N298 WeakPolarHBondContact CG-ND2 3.38Å
81	S	94.2	Very high	92.1	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.138	C	C	.	.	H	α-helix	trans	-64.5	-27.8	176.4	-71.2	0	0	0	0	113.5	N56 V59 R77 L78 L85	N56-S81 PolarHBondContact OD1-OG 3.42Å; N56-S81 VanDerWaalsContact OD1-OG 3.04Å; V59-S81 VanDerWaalsContact CG1-OG 3.31Å; V59-S81 WeakPolarHBondContact CG1-OG 3.25Å; R77-S81 PolarHBondContact O-N 3.24Å; R77-S81 PolarHBondContact O-OG 3.22Å; L78-S81 PolarHBondContact O-N 2.95Å; S81-L85 WeakPolarHBondContact O-CB 3.33Å; S81-L85 PolarHBondContact O-N 3.25Å
82	V	95.8	Very high	93	Very high	63 Å²	63	26 Å²	26	38%	0.382	14%	0.136	S	C	.	.	H	α-helix	trans	-69.8	-45.1	172.1	168.2	0	0	0	0	110.9	I60 L78 H79 L80 L85 L86 W161	I60-V82 HydrophobicContact CD1-CG2 4.05Å; I60-V82 HydrophobicContact CG1-CG2 4.32Å; L78-V82 VanDerWaalsContact O-CG2 3.29Å; L78-V82 WeakPolarHBondContact O-CG2 3.28Å; L78-V82 PolarHBondContact O-N 2.85Å; H79-V82 PolarHBondContact O-N 3.31Å; L80-V82 VanDerWaalsContact C-N 3.25Å; L80-V82 PolarHBondContact O-N 2.89Å; V82-L85 PolarHBondContact O-N 3.44Å; V82-L86 WeakPolarHBondContact O-CB 3.45Å; V82-L86 PolarHBondContact O-N 3.27Å; V82-W161 HydrophobicContact CG1-CH2 4.29Å
83	A	96.3	Very high	93.7	Very high	1 Å²	1	27.2 Å²	27.2	1%	0.008	14%	0.141	C	C	.	.	H	α-helix	trans	-62.2	-46.1	175.9	0	0	0	0	0	111.6	H79 L80 L86 F87 N119 S122 W161	H79-A83 PolarHBondContact O-N 2.71Å; L80-A83 PolarHBondContact O-N 2.91Å; L80-A83 VanDerWaalsContact O-N 3.14Å; A83-L86 PolarHBondContact O-N 2.83Å; A83-F87 PolarHBondContact O-N 3.2Å; A83-N119 PolarHBondContact O-ND2 2.94Å; A83-S122 WeakPolarHBondContact CB-OG 3.28Å; A83-W161 HydrophobicContact CB-CH2 4.02Å
84	D	96.1	Very high	94.4	Very high	0 Å²	0	28.1 Å²	28.1	0%	0	14%	0.143	C	C	.	.	H	α-helix	trans	-62.5	-45.9	177.4	-71.3	-28.2	0	0	0	111.2	L80 L86 F87 V88 N119 H294 C295 N298	L80-D84 WeakPolarHBondContact O-CB 3.16Å; L80-D84 PolarHBondContact O-N 2.82Å; D84-L86 VanDerWaalsContact C-N 3.34Å; D84-L86 PolarHBondContact O-N 3.15Å; D84-F87 PolarHBondContact O-N 2.85Å; D84-V88 WeakPolarHBondContact O-CB 3.42Å; D84-V88 WeakPolarHBondContact O-CG2 3.43Å; D84-V88 PolarHBondContact O-N 3.4Å; D84-N119 WeakPolarHBondContact CA-ND2 3.41Å; D84-N119 PolarHBondContact N-ND2 2.78Å; D84-N119 PolarHBondContact OD1-ND2 3.15Å; D84-H294 IonicContact OD1-NE2 3.91Å; D84-C295 HydrophobicContact CB-CB 4.06Å; D84-C295 PolarHBondContact OD1-SG 2.95Å; D84-C295 VanDerWaalsContact OD1-SG 3.35Å; D84-N298 PolarHBondContact OD2-ND2 3.41Å
85	L	96.6	Very high	94.9	Very high	45 Å²	45	27 Å²	27	24%	0.236	14%	0.138	C	C	.	.	H	α-helix	trans	-62.8	-42.2	179	-175	66.8	0	0	0	111.7	I53 N56 I60 S81 V82 F87 V88 I89	I53-L85 HydrophobicContact CD1-CD1 3.74Å; N56-L85 HydrophobicContact CB-CB 4.27Å; I60-L85 HydrophobicContact CD1-CB 4.28Å; I60-L85 HydrophobicContact CD1-CD2 3.64Å; S81-L85 WeakPolarHBondContact O-CB 3.33Å; S81-L85 PolarHBondContact O-N 3.25Å; V82-L85 PolarHBondContact O-N 3.44Å; L85-F87 VanDerWaalsContact C-N 3.28Å; L85-F87 PolarHBondContact O-N 3.43Å; L85-V88 PolarHBondContact O-N 3.37Å; L85-I89 HydrophobicContact CD1-CG2 4.44Å; L85-I89 WeakPolarHBondContact O-CG1 3.49Å; L85-I89 WeakPolarHBondContact O-CG2 3.23Å; L85-I89 PolarHBondContact O-N 3.39Å; L85-I89 VanDerWaalsContact O-N 3.12Å
86	L	96.7	Very high	95.2	Very high	66 Å²	66	27.3 Å²	27.3	35%	0.346	14%	0.144	S	C	.	.	H	α-helix	trans	-60.7	-37.7	178.5	-176.5	64.9	0	0	0	111.9	V82 A83 D84 I89 I115	V82-L86 WeakPolarHBondContact O-CB 3.45Å; V82-L86 PolarHBondContact O-N 3.27Å; A83-L86 PolarHBondContact O-N 2.83Å; D84-L86 VanDerWaalsContact C-N 3.34Å; D84-L86 PolarHBondContact O-N 3.15Å; L86-I89 HydrophobicContact CD1-CD1 4.26Å; L86-I89 WeakPolarHBondContact O-CG1 3.34Å; L86-I115 HydrophobicContact CD1-CD1 4.41Å; L86-I115 HydrophobicContact CG-CG1 4.33Å; L86-I115 HydrophobicContact CG-CG2 3.99Å; L86-I115 VanDerWaalsContact O-CG2 3.32Å; L86-I115 WeakPolarHBondContact O-CG2 3.5Å
87	F	98.1	Very high	95.3	Very high	1 Å²	1	28.6 Å²	28.6	0%	0.004	15%	0.15	C	C	.	.	H	α-helix	trans	-75.1	-47.6	175.7	170.1	-113.2	0	0	0	112.7	A83 D84 L85 I89 T90 L91 I115 Y116 N119 F292	A83-F87 PolarHBondContact O-N 3.2Å; D84-F87 PolarHBondContact O-N 2.85Å; L85-F87 VanDerWaalsContact C-N 3.28Å; L85-F87 PolarHBondContact O-N 3.43Å; F87-I89 PolarHBondContact O-N 2.97Å; F87-T90 WeakPolarHBondContact O-CA 3.31Å; F87-T90 WeakPolarHBondContact O-CB 3.22Å; F87-T90 PolarHBondContact O-N 3.04Å; F87-T90 PolarHBondContact O-OG1 3.08Å; F87-L91 HydrophobicContact CE1-CD2 4.04Å; F87-L91 HydrophobicContact CE2-CD2 4.37Å; F87-L91 HydrophobicContact CZ-CD2 3.74Å; F87-I115 HydrophobicContact CB-CG2 4.26Å; F87-Y116 AromaticContact CE2-CD2 3.94Å; F87-Y116 HydrophobicContact CE2-CD2 3.94Å; F87-Y116 HydrophobicContact CZ-CD2 4.44Å; F87-N119 HydrophobicContact CB-CB 3.58Å; F87-N119 HydrophobicContact CG-CB 4.08Å; F87-F292 HydrophobicContact CE1-CB 4.1Å; F87-F292 AromaticContact CE1-CD1 3.76Å; F87-F292 HydrophobicContact CE1-CD1 3.76Å; F87-F292 HydrophobicContact CE1-CD2 4.09Å; F87-F292 HydrophobicContact CE1-CE1 4.21Å; F87-F292 HydrophobicContact CE1-CE2 4.49Å; F87-F292 AromaticContact CE1-CG 3.71Å; F87-F292 HydrophobicContact CE1-CG 3.71Å; F87-F292 HydrophobicContact CE2-CZ 4.41Å; F87-F292 AromaticContact CZ-CD1 3.65Å; F87-F292 HydrophobicContact CZ-CD1 3.65Å; F87-F292 AromaticContact CZ-CD2 3.73Å; F87-F292 HydrophobicContact CZ-CD2 3.73Å; F87-F292 AromaticContact CZ-CE1 3.63Å; F87-F292 HydrophobicContact CZ-CE1 3.63Å; F87-F292 AromaticContact CZ-CE2 3.7Å; F87-F292 HydrophobicContact CZ-CE2 3.7Å; F87-F292 AromaticContact CZ-CG 3.72Å; F87-F292 HydrophobicContact CZ-CG 3.72Å; F87-F292 AromaticContact CZ-CZ 3.65Å; F87-F292 HydrophobicContact CZ-CZ 3.65Å
88	V	97.6	Very high	95.4	Very high	0 Å²	0	27.2 Å²	27.2	0%	0	15%	0.149	C	C	.	.	H	α-helix	trans	-59.6	-35.9	-175.6	170.9	0	0	0	0	111.5	I48 F49 I53 D84 L85 T90 L91 C295	I48-V88 HydrophobicContact CG2-CG2 4.38Å; F49-V88 HydrophobicContact CD2-CG1 4.23Å; F49-V88 WeakPolarHBondContact CD2-O 3.48Å; F49-V88 WeakPolarHBondContact O-CG1 3.35Å; I53-V88 HydrophobicContact CD1-CG1 4.31Å; I53-V88 HydrophobicContact CG1-CG1 4.03Å; D84-V88 WeakPolarHBondContact O-CB 3.42Å; D84-V88 WeakPolarHBondContact O-CG2 3.43Å; D84-V88 PolarHBondContact O-N 3.4Å; L85-V88 PolarHBondContact O-N 3.37Å; V88-T90 PolarHBondContact O-N 3.26Å; V88-T90 VanDerWaalsContact O-N 3.12Å; V88-L91 HydrophobicContact CB-CD1 4.37Å; V88-L91 HydrophobicContact CG1-CD1 4.2Å; V88-L91 HydrophobicContact CG2-CD1 4.31Å; V88-L91 WeakPolarHBondContact O-CB 3.35Å; V88-L91 PolarHBondContact O-N 3.34Å; V88-L91 VanDerWaalsContact O-N 3.12Å; V88-C295 HydrophobicContact CG2-CB 3.82Å
89	I	97.4	Very high	95.4	Very high	84 Å²	84	29.1 Å²	29.1	43%	0.431	16%	0.162	S	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-17.9	175	60.6	166.8	0	0	0	113.7	I53 L85 L86 F87 P92	I53-I89 HydrophobicContact CD1-CG2 3.49Å; I53-I89 VanDerWaalsContact CD1-CG2 3.49Å; L85-I89 HydrophobicContact CD1-CG2 4.44Å; L85-I89 WeakPolarHBondContact O-CG1 3.49Å; L85-I89 WeakPolarHBondContact O-CG2 3.23Å; L85-I89 PolarHBondContact O-N 3.39Å; L85-I89 VanDerWaalsContact O-N 3.12Å; L86-I89 HydrophobicContact CD1-CD1 4.26Å; L86-I89 WeakPolarHBondContact O-CG1 3.34Å; F87-I89 PolarHBondContact O-N 2.97Å; I89-P92 WeakPolarHBondContact O-CD 3.35Å
90	T	97.8	Very high	95.1	Very high	5 Å²	5	29.9 Å²	29.9	3%	0.031	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.6	-18.6	177.5	72.1	0	0	0	0	113.3	F87 V88 P92 F93 W94 V112 I115	F87-T90 WeakPolarHBondContact O-CA 3.31Å; F87-T90 WeakPolarHBondContact O-CB 3.22Å; F87-T90 PolarHBondContact O-N 3.04Å; F87-T90 PolarHBondContact O-OG1 3.08Å; V88-T90 PolarHBondContact O-N 3.26Å; V88-T90 VanDerWaalsContact O-N 3.12Å; T90-P92 VanDerWaalsContact C-N 3.29Å; T90-P92 VanDerWaalsContact O-N 3.13Å; T90-F93 WeakPolarHBondContact O-CB 3.3Å; T90-F93 VanDerWaalsContact O-CD2 3.24Å; T90-F93 WeakPolarHBondContact O-CD2 3.18Å; T90-F93 PolarHBondContact O-N 2.95Å; T90-W94 VanDerWaalsContact O-CD1 3.26Å; T90-W94 PolarHBondContact OG1-NE1 2.87Å; T90-V112 HydrophobicContact CG2-CG1 4.37Å; T90-I115 HydrophobicContact CG2-CB 4.2Å; T90-I115 HydrophobicContact CG2-CD1 3.66Å; T90-I115 HydrophobicContact CG2-CG2 3.76Å
91	L	97.4	Very high	95.1	Very high	1 Å²	1	30.9 Å²	30.9	1%	0.005	18%	0.178	C	C	.	.	H	α-helix	trans	-53.1	-32.1	-178.1	-69.4	176.1	0	0	0	115.6	Y45 I48 F49 F87 V88 F93 W94 A95 F292	Y45-L91 HydrophobicContact CD1-CD2 4.09Å; Y45-L91 HydrophobicContact CG-CD2 4.39Å; I48-L91 HydrophobicContact CB-CD1 3.81Å; I48-L91 HydrophobicContact CG2-CD1 3.47Å; I48-L91 VanDerWaalsContact CG2-CD1 3.47Å; F49-L91 HydrophobicContact CB-CB 4.26Å; F49-L91 HydrophobicContact CB-CD1 4.41Å; F87-L91 HydrophobicContact CE1-CD2 4.04Å; F87-L91 HydrophobicContact CE2-CD2 4.37Å; F87-L91 HydrophobicContact CZ-CD2 3.74Å; V88-L91 HydrophobicContact CB-CD1 4.37Å; V88-L91 HydrophobicContact CG1-CD1 4.2Å; V88-L91 HydrophobicContact CG2-CD1 4.31Å; V88-L91 WeakPolarHBondContact O-CB 3.35Å; V88-L91 PolarHBondContact O-N 3.34Å; V88-L91 VanDerWaalsContact O-N 3.12Å; L91-F93 PolarHBondContact O-N 2.81Å; L91-W94 PolarHBondContact O-N 3.44Å; L91-A95 PolarHBondContact O-N 3.35Å; L91-F292 HydrophobicContact CD2-CD2 3.95Å; L91-F292 HydrophobicContact CD2-CE2 4.24Å
92	P	97.6	Very high	95.2	Very high	51 Å²	51	31.3 Å²	31.3	33%	0.331	18%	0.18	S	C	.	.	H	α-helix	trans	-58.3	-34	172.1	-27.3	37.1	0	0	0	113.9	F49 I89 T90 A95 V96	F49-P92 HydrophobicContact CD2-CG 3.88Å; F49-P92 HydrophobicContact CE1-CG 4.5Å; F49-P92 HydrophobicContact CE2-CG 3.85Å; F49-P92 HydrophobicContact CG-CG 4.21Å; F49-P92 HydrophobicContact CZ-CG 4.18Å; I89-P92 WeakPolarHBondContact O-CD 3.35Å; T90-P92 VanDerWaalsContact C-N 3.29Å; T90-P92 VanDerWaalsContact O-N 3.13Å; P92-A95 PolarHBondContact O-N 3.1Å; P92-V96 WeakPolarHBondContact O-CG2 3.21Å; P92-V96 PolarHBondContact O-N 2.72Å; P92-V96 VanDerWaalsContact O-N 3.12Å
93	F	97.1	Very high	95.2	Very high	54 Å²	54	35.7 Å²	35.7	24%	0.237	19%	0.19	C	C	.	.	H	α-helix	trans	-66.3	-45.5	176.3	-58.5	-70.7	0	0	0	111	T90 L91 A95 V96 D97 W102 F104 L108 V112	T90-F93 WeakPolarHBondContact O-CB 3.3Å; T90-F93 VanDerWaalsContact O-CD2 3.24Å; T90-F93 WeakPolarHBondContact O-CD2 3.18Å; T90-F93 PolarHBondContact O-N 2.95Å; L91-F93 PolarHBondContact O-N 2.81Å; F93-A95 VanDerWaalsContact C-N 3.3Å; F93-A95 PolarHBondContact O-N 3Å; F93-V96 PolarHBondContact O-N 3.22Å; F93-D97 WeakPolarHBondContact O-CB 3.46Å; F93-D97 PolarHBondContact O-N 2.88Å; F93-W102 HydrophobicContact CB-CH2 4.22Å; F93-W102 HydrophobicContact CB-CZ3 4.19Å; F93-F104 HydrophobicContact CB-CD2 4.36Å; F93-F104 HydrophobicContact CB-CE2 4.18Å; F93-F104 AromaticContact CD1-CD1 3.6Å; F93-F104 HydrophobicContact CD1-CD1 3.6Å; F93-F104 AromaticContact CD1-CD2 3.73Å; F93-F104 HydrophobicContact CD1-CD2 3.73Å; F93-F104 AromaticContact CD1-CE1 3.59Å; F93-F104 HydrophobicContact CD1-CE1 3.59Å; F93-F104 AromaticContact CD1-CE2 3.73Å; F93-F104 HydrophobicContact CD1-CE2 3.73Å; F93-F104 AromaticContact CD1-CG 3.66Å; F93-F104 HydrophobicContact CD1-CG 3.66Å; F93-F104 AromaticContact CD1-CZ 3.65Å; F93-F104 HydrophobicContact CD1-CZ 3.65Å; F93-F104 AromaticContact CE1-CD1 3.7Å; F93-F104 HydrophobicContact CE1-CD1 3.7Å; F93-F104 AromaticContact CE1-CE1 3.82Å; F93-F104 HydrophobicContact CE1-CE1 3.82Å; F93-F104 HydrophobicContact CE1-CG 4.12Å; F93-F104 HydrophobicContact CE1-CZ 4.33Å; F93-F104 HydrophobicContact CG-CE2 4.46Å; F93-L108 HydrophobicContact CE1-CD1 4.22Å; F93-V112 HydrophobicContact CB-CG1 4.2Å; F93-V112 HydrophobicContact CD2-CG1 3.95Å; F93-V112 HydrophobicContact CG-CG1 4.26Å
94	W	95.5	Very high	95.2	Very high	33 Å²	33	38.5 Å²	38.5	13%	0.125	20%	0.203	C	C	.	.	H	α-helix	trans	-62.2	-36.2	175.8	-60.6	86.5	0	0	0	112.3	Y45 T90 L91 A98 V112 Y116	Y45-W94 HydrophobicContact CD2-CB 3.79Å; Y45-W94 HydrophobicContact CE2-CB 3.7Å; Y45-W94 HydrophobicContact CG-CB 4.48Å; T90-W94 VanDerWaalsContact O-CD1 3.26Å; T90-W94 PolarHBondContact OG1-NE1 2.87Å; L91-W94 PolarHBondContact O-N 3.44Å; W94-A98 VanDerWaalsContact O-CB 3.24Å; W94-A98 WeakPolarHBondContact O-CB 3.36Å; W94-A98 PolarHBondContact O-N 2.92Å; W94-V112 HydrophobicContact CZ2-CB 4.31Å; W94-V112 HydrophobicContact CZ2-CG2 4.25Å; W94-Y116 HydrophobicContact CH2-CD2 4.48Å; W94-Y116 HydrophobicContact CZ2-CD2 4.38Å
95	A	95.3	Very high	95.2	Very high	12 Å²	12	40.2 Å²	40.2	10%	0.099	22%	0.22	C	C	.	.	H	α-helix	trans	-66.9	-41.9	176.8	0	0	0	0	0	112.4	P42 Y45 L91 P92 F93 V99	P42-A95 HydrophobicContact CB-CB 3.95Å; Y45-A95 HydrophobicContact CD2-CB 4.29Å; L91-A95 PolarHBondContact O-N 3.35Å; P92-A95 PolarHBondContact O-N 3.1Å; F93-A95 VanDerWaalsContact C-N 3.3Å; F93-A95 PolarHBondContact O-N 3Å; A95-V99 WeakPolarHBondContact O-CG1 3.24Å; A95-V99 PolarHBondContact O-N 3.15Å
96	V	94.8	Very high	95.2	Very high	50 Å²	50	41.7 Å²	41.7	30%	0.303	23%	0.228	S	C	.	.	H	α-helix	trans	-68.5	-41.8	177.1	172.9	0	0	0	0	111.3	P92 F93 A98 V99 A100 N101 Y103 F104	P92-V96 WeakPolarHBondContact O-CG2 3.21Å; P92-V96 PolarHBondContact O-N 2.72Å; P92-V96 VanDerWaalsContact O-N 3.12Å; F93-V96 PolarHBondContact O-N 3.22Å; V96-A98 VanDerWaalsContact C-N 3.34Å; V96-A98 PolarHBondContact O-N 2.62Å; V96-V99 PolarHBondContact O-N 3.48Å; V96-A100 PolarHBondContact O-N 3.17Å; V96-N101 PolarHBondContact O-N 3.36Å; V96-Y103 HydrophobicContact CG1-CD2 3.71Å; V96-Y103 HydrophobicContact CG1-CE2 3.95Å; V96-F104 HydrophobicContact CB-CE2 3.97Å; V96-F104 HydrophobicContact CB-CZ 3.87Å; V96-F104 HydrophobicContact CG1-CE2 3.91Å; V96-F104 HydrophobicContact CG1-CZ 3.79Å; V96-F104 HydrophobicContact CG2-CZ 4.2Å
97	D	92.1	Very high	95.3	Very high	26 Å²	26	46.4 Å²	46.4	14%	0.139	25%	0.246	C	C	.	.	H	α-helix	trans	-59.4	-44.8	175.2	-176.4	71.3	0	0	0	112	F93 V99 W102	F93-D97 WeakPolarHBondContact O-CB 3.46Å; F93-D97 PolarHBondContact O-N 2.88Å; D97-V99 PolarHBondContact O-N 3.36Å; D97-W102 HydrophobicContact CB-CE3 3.93Å; D97-W102 HydrophobicContact CB-CZ3 4.38Å
98	A	89.9	Confident	95.3	Very high	17 Å²	17	49 Å²	49	14%	0.14	26%	0.26	C	S	.	.	H	α-helix	trans	-68.4	-31.4	-178.8	0	0	0	0	0	114.1	R38 L41 Y45 W94 V96	R38-A98 VanDerWaalsContact CG-O 3.3Å; R38-A98 WeakPolarHBondContact CG-O 3.4Å; L41-A98 HydrophobicContact CB-CB 4.04Å; L41-A98 HydrophobicContact CD1-CB 4.26Å; Y45-A98 HydrophobicContact CE2-CB 4.42Å; W94-A98 VanDerWaalsContact O-CB 3.24Å; W94-A98 WeakPolarHBondContact O-CB 3.36Å; W94-A98 PolarHBondContact O-N 2.92Å; V96-A98 VanDerWaalsContact C-N 3.34Å; V96-A98 PolarHBondContact O-N 2.62Å
99	V	89.8	Confident	95.3	Very high	75 Å²	75	49 Å²	49	46%	0.455	26%	0.26	S	S	.	.	H	α-helix	trans	-92.9	-30.3	-177.1	72.1	0	0	0	0	113.1	P42 A95 V96 D97	P42-V99 HydrophobicContact CG-CB 4.42Å; A95-V99 WeakPolarHBondContact O-CG1 3.24Å; A95-V99 PolarHBondContact O-N 3.15Å; V96-V99 PolarHBondContact O-N 3.48Å; D97-V99 PolarHBondContact O-N 3.36Å
100	A	88.8	Confident	95.3	Very high	41 Å²	41	46.7 Å²	46.7	34%	0.339	25%	0.247	S	C	.	.	T	Hydrogen-bonded Turn	trans	-135.5	-89	-169.8	0	0	0	0	0	112.2	V96 Y103	V96-A100 PolarHBondContact O-N 3.17Å; A100-Y103 HydrophobicContact CB-CE2 4.15Å
101	N	92.3	Very high	95.3	Very high	23 Å²	23	47.7 Å²	47.7	12%	0.123	26%	0.256	C	S	.	.			trans	-160.2	156.3	-165.5	-156.7	-31	0	0	0	110.2	V96 Y103 F184	V96-N101 PolarHBondContact O-N 3.36Å; N101-Y103 HydrophobicContact CB-CD1 4.41Å; N101-Y103 HydrophobicContact CB-CE1 3.77Å; N101-Y103 HydrophobicContact CB-CE2 3.94Å; N101-Y103 VanDerWaalsContact O-CD2 3.27Å; N101-Y103 WeakPolarHBondContact O-CD2 3.34Å; N101-Y103 WeakPolarHBondContact O-CE2 3.42Å; N101-Y103 PolarHBondContact O-N 3.21Å; N101-F184 VanDerWaalsContact OD1-CA 3.27Å; N101-F184 WeakPolarHBondContact OD1-CA 3.27Å; N101-F184 WeakPolarHBondContact OD1-CB 3.46Å; N101-F184 PolarHBondContact OD1-N 2.85Å; N101-F184 PolarHBondContact OD1-O 3.39Å
102	W	95.7	Very high	95.4	Very high	10 Å²	10	47.8 Å²	47.8	4%	0.038	26%	0.256	C	S	.	.			trans	-81	93.7	173.2	-173.6	-96.6	0	0	0	112	F93 D97 F104 G105 L108 C109 V112 V177 F184 C186	F93-W102 HydrophobicContact CB-CH2 4.22Å; F93-W102 HydrophobicContact CB-CZ3 4.19Å; D97-W102 HydrophobicContact CB-CE3 3.93Å; D97-W102 HydrophobicContact CB-CZ3 4.38Å; W102-F104 HydrophobicContact CD2-CD2 4Å; W102-F104 AromaticContact CE3-CD2 3.9Å; W102-F104 HydrophobicContact CE3-CD2 3.9Å; W102-F104 HydrophobicContact CH2-CB 4.27Å; W102-F104 AromaticContact CH2-CD2 3.91Å; W102-F104 HydrophobicContact CH2-CD2 3.91Å; W102-F104 HydrophobicContact CZ2-CB 3.63Å; W102-F104 AromaticContact CZ2-CD2 3.99Å; W102-F104 HydrophobicContact CZ2-CD2 3.99Å; W102-F104 HydrophobicContact CZ2-CG 4.28Å; W102-F104 AromaticContact CZ3-CD2 3.87Å; W102-F104 HydrophobicContact CZ3-CD2 3.87Å; W102-F104 HydrophobicContact CZ3-CE2 4.5Å; W102-G105 PolarHBondContact NE1-O 3.05Å; W102-L108 HydrophobicContact CZ2-CB 3.99Å; W102-C109 HydrophobicContact CZ2-CB 3.79Å; W102-V112 HydrophobicContact CH2-CG1 4.25Å; W102-V112 HydrophobicContact CH2-CG2 3.8Å; W102-V112 HydrophobicContact CZ3-CG2 4.37Å; W102-V177 HydrophobicContact CG-CG2 4.35Å; W102-F184 HydrophobicContact CB-CB 4.16Å; W102-F184 VanDerWaalsContact CB-O 3.29Å; W102-F184 WeakPolarHBondContact CB-O 3.45Å; W102-F184 PolarHBondContact N-O 3.3Å; W102-C186 HydrophobicContact CB-CB 4.28Å; W102-C186 HydrophobicContact CD2-CB 3.35Å; W102-C186 HydrophobicContact CE3-CB 3.53Å; W102-C186 HydrophobicContact CG-CB 3.66Å; W102-C186 HydrophobicContact CH2-CB 4.5Å; W102-C186 HydrophobicContact CZ2-CB 4.35Å; W102-C186 HydrophobicContact CZ3-CB 4.11Å
103	Y	95.9	Very high	95.4	Very high	154 Å²	154	45.7 Å²	45.7	60%	0.604	24%	0.242	S	C	*	.			trans	-86.6	-7.1	-179.3	-57.4	-68.1	0	0	0	115	V96 A100 N101	V96-Y103 HydrophobicContact CG1-CD2 3.71Å; V96-Y103 HydrophobicContact CG1-CE2 3.95Å; A100-Y103 HydrophobicContact CB-CE2 4.15Å; N101-Y103 HydrophobicContact CB-CD1 4.41Å; N101-Y103 HydrophobicContact CB-CE1 3.77Å; N101-Y103 HydrophobicContact CB-CE2 3.94Å; N101-Y103 VanDerWaalsContact O-CD2 3.27Å; N101-Y103 WeakPolarHBondContact O-CD2 3.34Å; N101-Y103 WeakPolarHBondContact O-CE2 3.42Å; N101-Y103 PolarHBondContact O-N 3.21Å
104	F	96.8	Very high	95.4	Very high	61 Å²	61	44.5 Å²	44.5	27%	0.268	24%	0.239	S	C	.	.	S	Bend	trans	-94.4	-0.8	-161.2	-50.6	-72.4	0	0	0	114.3	F93 V96 W102 L108	F93-F104 HydrophobicContact CB-CD2 4.36Å; F93-F104 HydrophobicContact CB-CE2 4.18Å; F93-F104 AromaticContact CD1-CD1 3.6Å; F93-F104 HydrophobicContact CD1-CD1 3.6Å; F93-F104 AromaticContact CD1-CD2 3.73Å; F93-F104 HydrophobicContact CD1-CD2 3.73Å; F93-F104 AromaticContact CD1-CE1 3.59Å; F93-F104 HydrophobicContact CD1-CE1 3.59Å; F93-F104 AromaticContact CD1-CE2 3.73Å; F93-F104 HydrophobicContact CD1-CE2 3.73Å; F93-F104 AromaticContact CD1-CG 3.66Å; F93-F104 HydrophobicContact CD1-CG 3.66Å; F93-F104 AromaticContact CD1-CZ 3.65Å; F93-F104 HydrophobicContact CD1-CZ 3.65Å; F93-F104 AromaticContact CE1-CD1 3.7Å; F93-F104 HydrophobicContact CE1-CD1 3.7Å; F93-F104 AromaticContact CE1-CE1 3.82Å; F93-F104 HydrophobicContact CE1-CE1 3.82Å; F93-F104 HydrophobicContact CE1-CG 4.12Å; F93-F104 HydrophobicContact CE1-CZ 4.33Å; F93-F104 HydrophobicContact CG-CE2 4.46Å; V96-F104 HydrophobicContact CB-CE2 3.97Å; V96-F104 HydrophobicContact CB-CZ 3.87Å; V96-F104 HydrophobicContact CG1-CE2 3.91Å; V96-F104 HydrophobicContact CG1-CZ 3.79Å; V96-F104 HydrophobicContact CG2-CZ 4.2Å; W102-F104 HydrophobicContact CD2-CD2 4Å; W102-F104 AromaticContact CE3-CD2 3.9Å; W102-F104 HydrophobicContact CE3-CD2 3.9Å; W102-F104 HydrophobicContact CH2-CB 4.27Å; W102-F104 AromaticContact CH2-CD2 3.91Å; W102-F104 HydrophobicContact CH2-CD2 3.91Å; W102-F104 HydrophobicContact CZ2-CB 3.63Å; W102-F104 AromaticContact CZ2-CD2 3.99Å; W102-F104 HydrophobicContact CZ2-CD2 3.99Å; W102-F104 HydrophobicContact CZ2-CG 4.28Å; W102-F104 AromaticContact CZ3-CD2 3.87Å; W102-F104 HydrophobicContact CZ3-CD2 3.87Å; W102-F104 HydrophobicContact CZ3-CE2 4.5Å; F104-L108 HydrophobicContact CB-CB 3.85Å; F104-L108 HydrophobicContact CB-CD1 3.72Å; F104-L108 HydrophobicContact CB-CG 4.41Å; F104-L108 HydrophobicContact CG-CD1 4.48Å
105	G	96.1	Very high	95.5	Very high	36 Å²	36	44.6 Å²	44.6	37%	0.371	24%	0.242	S	C	.	.	H	α-helix	trans	71.9	177.9	178.8	0	0	0	0	0	114.5	W102 F107 C109	W102-G105 PolarHBondContact NE1-O 3.05Å; G105-F107 PolarHBondContact O-N 3.2Å; G105-C109 PolarHBondContact O-N 2.98Å
106	N	97.3	Very high	95.6	Very high	75 Å²	75	44.2 Å²	44.2	40%	0.401	24%	0.238	S	C	.	.	H	α-helix	trans	-69.6	-33.9	-167.8	-161.5	44.3	0	0	0	114.1	C109 K110 S176 V177	N106-C109 WeakPolarHBondContact O-CB 3.2Å; N106-C109 PolarHBondContact O-N 3.48Å; N106-K110 PolarHBondContact O-N 3.49Å; N106-K110 VanDerWaalsContact O-N 3.15Å; N106-S176 VanDerWaalsContact OD1-CA 3.31Å; N106-S176 WeakPolarHBondContact OD1-CA 3.48Å; N106-V177 HydrophobicContact CB-CG2 4.48Å; N106-V177 PolarHBondContact OD1-N 3.02Å
107	F	97.6	Very high	95.6	Very high	166 Å²	166	41.9 Å²	41.9	73%	0.728	22%	0.223	S	C	*	.	H	α-helix	trans	-63.3	-49.4	-179.9	174.1	-97.1	0	0	0	111.6	G105 C109 K110 A111	G105-F107 PolarHBondContact O-N 3.2Å; F107-C109 PolarHBondContact O-N 3.31Å; F107-K110 PolarHBondContact O-N 3.44Å; F107-A111 WeakPolarHBondContact O-CB 3.35Å; F107-A111 PolarHBondContact O-N 3.35Å
108	L	97.8	Very high	95.9	Very high	55 Å²	55	40.9 Å²	40.9	29%	0.288	22%	0.219	S	C	.	.	H	α-helix	trans	-67.3	-30.3	178.3	-77.1	171.8	0	0	0	111.4	F93 W102 F104 K110 A111 V112	F93-L108 HydrophobicContact CE1-CD1 4.22Å; W102-L108 HydrophobicContact CZ2-CB 3.99Å; F104-L108 HydrophobicContact CB-CB 3.85Å; F104-L108 HydrophobicContact CB-CD1 3.72Å; F104-L108 HydrophobicContact CB-CG 4.41Å; F104-L108 HydrophobicContact CG-CD1 4.48Å; L108-K110 PolarHBondContact O-N 3.3Å; L108-A111 PolarHBondContact O-N 3.48Å; L108-V112 WeakPolarHBondContact O-CG1 3.35Å; L108-V112 WeakPolarHBondContact O-CG2 3.4Å; L108-V112 PolarHBondContact O-N 2.59Å
109	C	98.1	Very high	96.2	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	21%	0.213	C	C	.	.	H	α-helix	trans	-60.5	-48	176.6	179	0	0	0	0	111.2	W102 G105 N106 F107 V112 H113 S176 V177 C186	W102-C109 HydrophobicContact CZ2-CB 3.79Å; G105-C109 PolarHBondContact O-N 2.98Å; N106-C109 WeakPolarHBondContact O-CB 3.2Å; N106-C109 PolarHBondContact O-N 3.48Å; F107-C109 PolarHBondContact O-N 3.31Å; C109-V112 VanDerWaalsContact O-CG2 3.32Å; C109-V112 WeakPolarHBondContact O-CG2 3.14Å; C109-H113 PolarHBondContact O-N 3.36Å; C109-H113 PolarHBondContact O-ND1 3.22Å; C109-S176 PolarHBondContact SG-O 3.27Å; C109-V177 HydrophobicContact CB-CG2 3.8Å; C109-C186 WeakPolarHBondContact CA-SG 3.34Å; C109-C186 HydrophobicContact CB-CB 3.88Å; C109-C186 WeakPolarHBondContact CB-SG 3.41Å; C109-C186 VanDerWaalsContact SG-CA 3.53Å; C109-C186 WeakPolarHBondContact SG-CB 3.27Å; C109-C186 CovalentContact SG-SG 2.03Å; C109-C186 PolarHBondContact SG-SG 3.37Å
110	K	98.2	Very high	96.3	Very high	35 Å²	35	36.9 Å²	36.9	15%	0.152	19%	0.192	C	C	.	.	H	α-helix	trans	-63.9	-42.3	173.3	-67.2	174.9	-178.1	-63.4	0	111.8	N106 F107 L108 H113 V114 F172 I173 A175	N106-K110 PolarHBondContact O-N 3.49Å; N106-K110 VanDerWaalsContact O-N 3.15Å; F107-K110 PolarHBondContact O-N 3.44Å; L108-K110 PolarHBondContact O-N 3.3Å; K110-H113 PolarHBondContact O-N 3.09Å; K110-V114 WeakPolarHBondContact O-CB 3.48Å; K110-V114 VanDerWaalsContact O-CG2 3.28Å; K110-V114 WeakPolarHBondContact O-CG2 3.27Å; K110-V114 PolarHBondContact O-N 3.48Å; K110-F172 HydrophobicContact CB-CD2 4.36Å; K110-F172 HydrophobicContact CD-CD2 4.37Å; K110-F172 HydrophobicContact CD-CE2 4.33Å; K110-F172 WeakPolarHBondContact CD-O 3.47Å; K110-F172 WeakPolarHBondContact CE-O 3.39Å; K110-F172 PolarHBondContact NZ-O 3.46Å; K110-I173 PolarHBondContact NZ-O 3.06Å; K110-I173 VanDerWaalsContact NZ-O 3.1Å; K110-A175 WeakPolarHBondContact CE-O 3.45Å; K110-A175 HydrophobicContact CG-CB 4.18Å; K110-A175 VanDerWaalsContact CG-O 3.25Å; K110-A175 WeakPolarHBondContact CG-O 3.3Å; K110-A175 PolarHBondContact NZ-O 3.49Å
111	A	98	Very high	96.7	Very high	27 Å²	27	34.9 Å²	34.9	22%	0.223	18%	0.176	C	C	.	.	H	α-helix	trans	-63.1	-44.4	-177.5	0	0	0	0	0	112.9	F107 L108 V114 I115	F107-A111 WeakPolarHBondContact O-CB 3.35Å; F107-A111 PolarHBondContact O-N 3.35Å; L108-A111 PolarHBondContact O-N 3.48Å; A111-V114 PolarHBondContact O-N 3.27Å; A111-I115 WeakPolarHBondContact O-CB 3.38Å; A111-I115 VanDerWaalsContact O-CG1 3.26Å; A111-I115 WeakPolarHBondContact O-CG1 3.12Å; A111-I115 PolarHBondContact O-N 3.3Å
112	V	97.9	Very high	96.9	Very high	3 Å²	3	33.8 Å²	33.8	2%	0.018	17%	0.17	C	C	.	.	H	α-helix	trans	-66.7	-37.7	179.7	-61.3	0	0	0	0	111.9	T90 F93 W94 W102 L108 C109 I115 Y116	T90-V112 HydrophobicContact CG2-CG1 4.37Å; F93-V112 HydrophobicContact CB-CG1 4.2Å; F93-V112 HydrophobicContact CD2-CG1 3.95Å; F93-V112 HydrophobicContact CG-CG1 4.26Å; W94-V112 HydrophobicContact CZ2-CB 4.31Å; W94-V112 HydrophobicContact CZ2-CG2 4.25Å; W102-V112 HydrophobicContact CH2-CG1 4.25Å; W102-V112 HydrophobicContact CH2-CG2 3.8Å; W102-V112 HydrophobicContact CZ3-CG2 4.37Å; L108-V112 WeakPolarHBondContact O-CG1 3.35Å; L108-V112 WeakPolarHBondContact O-CG2 3.4Å; L108-V112 PolarHBondContact O-N 2.59Å; C109-V112 VanDerWaalsContact O-CG2 3.32Å; C109-V112 WeakPolarHBondContact O-CG2 3.14Å; V112-I115 PolarHBondContact O-N 2.93Å; V112-Y116 WeakPolarHBondContact O-CB 3.28Å; V112-Y116 PolarHBondContact O-N 2.85Å
113	H	97.4	Very high	96.9	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.028	17%	0.168	C	C	.	.	H	α-helix	trans	-66.9	-43.7	174.9	-78.8	89.1	0	0	0	112.2	C109 K110 I115 Y116 T117 D171 A175 C186	C109-H113 PolarHBondContact O-N 3.36Å; C109-H113 PolarHBondContact O-ND1 3.22Å; K110-H113 PolarHBondContact O-N 3.09Å; H113-I115 VanDerWaalsContact C-N 3.34Å; H113-I115 PolarHBondContact O-N 3.42Å; H113-Y116 WeakPolarHBondContact O-CB 3.1Å; H113-Y116 PolarHBondContact O-N 3.12Å; H113-T117 PolarHBondContact O-N 2.83Å; H113-T117 PolarHBondContact O-OG1 2.87Å; H113-D171 HydrophobicContact CB-CB 4.16Å; H113-A175 HydrophobicContact CB-CB 4.06Å; H113-C186 PolarHBondContact CE1-SG 3.44Å
114	V	97.8	Very high	96.8	Very high	30 Å²	30	26 Å²	26	18%	0.182	14%	0.139	C	C	.	.	H	α-helix	trans	-59.8	-46.2	173.7	166.6	0	0	0	0	110.7	K110 A111 Y116 T117 V118 T168 D171 F172	K110-V114 WeakPolarHBondContact O-CB 3.48Å; K110-V114 VanDerWaalsContact O-CG2 3.28Å; K110-V114 WeakPolarHBondContact O-CG2 3.27Å; K110-V114 PolarHBondContact O-N 3.48Å; A111-V114 PolarHBondContact O-N 3.27Å; V114-Y116 PolarHBondContact O-N 3.48Å; V114-T117 PolarHBondContact O-N 3Å; V114-V118 HydrophobicContact CG1-CG2 4.36Å; V114-V118 WeakPolarHBondContact O-CB 3.34Å; V114-V118 VanDerWaalsContact O-CG2 3.3Å; V114-V118 WeakPolarHBondContact O-CG2 3.46Å; V114-V118 PolarHBondContact O-N 3.25Å; V114-T168 HydrophobicContact CG1-CG2 4.21Å; V114-D171 HydrophobicContact CG2-CB 4.32Å; V114-F172 HydrophobicContact CG2-CB 4.15Å
115	I	98.1	Very high	96.7	Very high	35 Å²	35	24.6 Å²	24.6	18%	0.179	14%	0.135	C	C	.	.	H	α-helix	trans	-63.8	-41.4	179.6	-73.2	167.6	0	0	0	111.4	L86 F87 T90 A111 V112 H113 V118 N119	L86-I115 HydrophobicContact CD1-CD1 4.41Å; L86-I115 HydrophobicContact CG-CG1 4.33Å; L86-I115 HydrophobicContact CG-CG2 3.99Å; L86-I115 VanDerWaalsContact O-CG2 3.32Å; L86-I115 WeakPolarHBondContact O-CG2 3.5Å; F87-I115 HydrophobicContact CB-CG2 4.26Å; T90-I115 HydrophobicContact CG2-CB 4.2Å; T90-I115 HydrophobicContact CG2-CD1 3.66Å; T90-I115 HydrophobicContact CG2-CG2 3.76Å; A111-I115 WeakPolarHBondContact O-CB 3.38Å; A111-I115 VanDerWaalsContact O-CG1 3.26Å; A111-I115 WeakPolarHBondContact O-CG1 3.12Å; A111-I115 PolarHBondContact O-N 3.3Å; V112-I115 PolarHBondContact O-N 2.93Å; H113-I115 VanDerWaalsContact C-N 3.34Å; H113-I115 PolarHBondContact O-N 3.42Å; I115-V118 PolarHBondContact O-N 3.24Å; I115-N119 WeakPolarHBondContact O-CB 3.13Å; I115-N119 PolarHBondContact O-N 3.42Å
116	Y	96.3	Very high	96.6	Very high	4 Å²	4	22.9 Å²	22.9	2%	0.016	12%	0.117	C	C	.	.	H	α-helix	trans	-55.3	-53.2	173.6	168	-84.7	0	0	0	111.1	F87 W94 V112 H113 V114 V118 N119 L120 Y255 E288 F292	F87-Y116 AromaticContact CE2-CD2 3.94Å; F87-Y116 HydrophobicContact CE2-CD2 3.94Å; F87-Y116 HydrophobicContact CZ-CD2 4.44Å; W94-Y116 HydrophobicContact CH2-CD2 4.48Å; W94-Y116 HydrophobicContact CZ2-CD2 4.38Å; V112-Y116 WeakPolarHBondContact O-CB 3.28Å; V112-Y116 PolarHBondContact O-N 2.85Å; H113-Y116 WeakPolarHBondContact O-CB 3.1Å; H113-Y116 PolarHBondContact O-N 3.12Å; V114-Y116 PolarHBondContact O-N 3.48Å; Y116-V118 PolarHBondContact O-N 3.43Å; Y116-N119 PolarHBondContact O-N 2.92Å; Y116-L120 PolarHBondContact O-N 3.43Å; Y116-Y255 PolarHBondContact OH-OH 2.85Å; Y116-E288 WeakPolarHBondContact CE2-OE1 3.35Å; Y116-E288 PolarHBondContact OH-OE1 2.85Å; Y116-F292 HydrophobicContact CD2-CE1 4.12Å; Y116-F292 HydrophobicContact CD2-CZ 4.09Å; Y116-F292 AromaticContact CE2-CE1 3.62Å; Y116-F292 HydrophobicContact CE2-CE1 3.62Å; Y116-F292 AromaticContact CE2-CZ 3.73Å; Y116-F292 HydrophobicContact CE2-CZ 3.73Å
117	T	95.8	Very high	96.4	Very high	0 Å²	0	19.4 Å²	19.4	0%	0	10%	0.098	C	C	.	.	H	α-helix	trans	-66.7	-39.7	-177.1	-57.5	0	0	0	0	111.6	H113 V114 N119 L120 Y121 T168 D171	H113-T117 PolarHBondContact O-N 2.83Å; H113-T117 PolarHBondContact O-OG1 2.87Å; V114-T117 PolarHBondContact O-N 3Å; T117-N119 VanDerWaalsContact C-N 3.35Å; T117-N119 PolarHBondContact O-N 3.28Å; T117-L120 PolarHBondContact O-N 2.94Å; T117-Y121 HydrophobicContact CG2-CD2 3.66Å; T117-Y121 HydrophobicContact CG2-CE2 3.28Å; T117-Y121 PolarHBondContact O-N 3.45Å; T117-Y121 VanDerWaalsContact O-N 3.1Å; T117-T168 HydrophobicContact CG2-CG2 3.76Å; T117-D171 VanDerWaalsContact CB-OD2 3.31Å; T117-D171 WeakPolarHBondContact CB-OD2 3.39Å; T117-D171 WeakPolarHBondContact CG2-OD2 3.49Å; T117-D171 VanDerWaalsContact OG1-CG 3.22Å; T117-D171 PolarHBondContact OG1-OD1 2.98Å; T117-D171 PolarHBondContact OG1-OD2 3.47Å
118	V	97.3	Very high	96.3	Very high	6 Å²	6	11.8 Å²	11.8	4%	0.036	7%	0.066	C	C	.	.	H	α-helix	trans	-58.5	-47.1	172.7	169.3	0	0	0	0	110.6	V114 I115 Y116 S122 W161 L165 T168	V114-V118 HydrophobicContact CG1-CG2 4.36Å; V114-V118 WeakPolarHBondContact O-CB 3.34Å; V114-V118 VanDerWaalsContact O-CG2 3.3Å; V114-V118 WeakPolarHBondContact O-CG2 3.46Å; V114-V118 PolarHBondContact O-N 3.25Å; I115-V118 PolarHBondContact O-N 3.24Å; Y116-V118 PolarHBondContact O-N 3.43Å; V118-S122 WeakPolarHBondContact O-CB 3.28Å; V118-S122 PolarHBondContact O-N 2.93Å; V118-S122 PolarHBondContact O-OG 3.05Å; V118-W161 HydrophobicContact CG1-CZ3 4.13Å; V118-L165 HydrophobicContact CG2-CD2 3.75Å; V118-L165 HydrophobicContact CG2-CG 4.43Å; V118-T168 HydrophobicContact CG2-CG2 3.58Å
119	N	96.4	Very high	96.1	Very high	5 Å²	5	10.5 Å²	10.5	3%	0.027	6%	0.058	C	C	.	.	H	α-helix	trans	-62	-51.3	-180	173.7	-91.8	0	0	0	111.4	A83 D84 F87 I115 Y116 T117 Y121 S122 S123 H294	A83-N119 PolarHBondContact O-ND2 2.94Å; D84-N119 WeakPolarHBondContact CA-ND2 3.41Å; D84-N119 PolarHBondContact N-ND2 2.78Å; D84-N119 PolarHBondContact OD1-ND2 3.15Å; F87-N119 HydrophobicContact CB-CB 3.58Å; F87-N119 HydrophobicContact CG-CB 4.08Å; I115-N119 WeakPolarHBondContact O-CB 3.13Å; I115-N119 PolarHBondContact O-N 3.42Å; Y116-N119 PolarHBondContact O-N 2.92Å; T117-N119 VanDerWaalsContact C-N 3.35Å; T117-N119 PolarHBondContact O-N 3.28Å; N119-Y121 PolarHBondContact O-N 3.06Å; N119-S122 PolarHBondContact O-N 2.97Å; N119-S122 PolarHBondContact O-OG 3.4Å; N119-S123 WeakPolarHBondContact O-CB 3.3Å; N119-S123 PolarHBondContact O-N 2.97Å; N119-S123 PolarHBondContact O-OG 3.43Å; N119-H294 PolarHBondContact OD1-NE2 3.04Å
120	L	93.4	Very high	95.8	Very high	2 Å²	2	10.9 Å²	10.9	1%	0.01	6%	0.06	C	C	.	.	H	α-helix	trans	-52.5	-55.2	-180	177.7	65.7	0	0	0	111.7	Y116 T117 V124 W252	Y116-L120 PolarHBondContact O-N 3.43Å; T117-L120 PolarHBondContact O-N 2.94Å; L120-V124 WeakPolarHBondContact O-CG1 3.38Å; L120-V124 PolarHBondContact O-N 3.21Å; L120-W252 HydrophobicContact CD1-CD2 4.1Å; L120-W252 HydrophobicContact CD1-CE3 4.07Å; L120-W252 HydrophobicContact CD1-CH2 3.48Å; L120-W252 VanDerWaalsContact CD1-CH2 3.48Å; L120-W252 HydrophobicContact CD1-CZ2 3.46Å; L120-W252 VanDerWaalsContact CD1-CZ2 3.46Å; L120-W252 HydrophobicContact CD1-CZ3 3.78Å
121	Y	95.9	Very high	95.5	Very high	0 Å²	0	9.2 Å²	9.2	0%	0	5%	0.053	C	C	.	.	H	α-helix	trans	-72.5	-44.5	-175.3	-63.6	-19.8	0	0	0	112.4	T117 N119 S123 V124 L125 L167 H203 V206	T117-Y121 HydrophobicContact CG2-CD2 3.66Å; T117-Y121 HydrophobicContact CG2-CE2 3.28Å; T117-Y121 PolarHBondContact O-N 3.45Å; T117-Y121 VanDerWaalsContact O-N 3.1Å; N119-Y121 PolarHBondContact O-N 3.06Å; Y121-S123 PolarHBondContact O-N 3.09Å; Y121-V124 WeakPolarHBondContact O-CG1 3.27Å; Y121-L125 VanDerWaalsContact O-CB 3.25Å; Y121-L125 WeakPolarHBondContact O-CB 3.04Å; Y121-L125 WeakPolarHBondContact O-CD1 3.5Å; Y121-L125 WeakPolarHBondContact O-CG 3.38Å; Y121-L125 PolarHBondContact O-N 3.44Å; Y121-L167 HydrophobicContact CD2-CB 3.81Å; Y121-L167 HydrophobicContact CD2-CD1 3.84Å; Y121-L167 HydrophobicContact CE2-CB 3.57Å; Y121-L167 HydrophobicContact CE2-CD1 3.92Å; Y121-L167 HydrophobicContact CE2-CG 4.38Å; Y121-H203 AromaticContact CE1-CD2 4Å; Y121-H203 AromaticContact CZ-CD2 3.92Å; Y121-H203 PolarHBondContact OH-CD2 3.34Å; Y121-H203 VanDerWaalsContact OH-CD2 3.3Å; Y121-H203 PolarHBondContact OH-NE2 2.89Å; Y121-V206 HydrophobicContact CD1-CB 4.1Å; Y121-V206 HydrophobicContact CD1-CG1 3.57Å; Y121-V206 HydrophobicContact CD2-CG1 4.17Å; Y121-V206 HydrophobicContact CE1-CB 3.85Å; Y121-V206 HydrophobicContact CE1-CG1 3.83Å; Y121-V206 HydrophobicContact CE2-CG1 4.37Å; Y121-V206 HydrophobicContact CG-CG1 3.77Å
122	S	96.8	Very high	95.3	Very high	0 Å²	0	10.6 Å²	10.6	0%	0	6%	0.056	C	C	.	.	H	α-helix	trans	-65	-41.9	-179.5	65.6	0	0	0	0	111.6	A83 V118 N119 L125 I126	A83-S122 WeakPolarHBondContact CB-OG 3.28Å; V118-S122 WeakPolarHBondContact O-CB 3.28Å; V118-S122 PolarHBondContact O-N 2.93Å; V118-S122 PolarHBondContact O-OG 3.05Å; N119-S122 PolarHBondContact O-N 2.97Å; N119-S122 PolarHBondContact O-OG 3.4Å; S122-L125 PolarHBondContact O-N 3.01Å; S122-I126 WeakPolarHBondContact O-CB 3.28Å; S122-I126 VanDerWaalsContact O-CD1 3.28Å; S122-I126 WeakPolarHBondContact O-CD1 3.35Å; S122-I126 WeakPolarHBondContact O-CG1 3.33Å; S122-I126 PolarHBondContact O-N 2.76Å
123	S	95.1	Very high	95	Very high	0 Å²	0	10.5 Å²	10.5	0%	0	6%	0.055	C	C	.	.	H	α-helix	trans	-59.9	-52.5	179.8	-70.5	0	0	0	0	111.7	N119 Y121 L125 I126 L127	N119-S123 WeakPolarHBondContact O-CB 3.3Å; N119-S123 PolarHBondContact O-N 2.97Å; N119-S123 PolarHBondContact O-OG 3.43Å; Y121-S123 PolarHBondContact O-N 3.09Å; S123-L125 PolarHBondContact O-N 3.33Å; S123-I126 PolarHBondContact O-N 3.4Å; S123-L127 WeakPolarHBondContact O-CG 3.45Å; S123-L127 PolarHBondContact O-N 3.1Å; S123-L127 VanDerWaalsContact O-N 3.09Å
124	V	94.3	Very high	94.6	Very high	0 Å²	0	11.6 Å²	11.6	0%	0	6%	0.059	C	C	.	.	H	α-helix	trans	-67.5	-38.4	-178.7	73	0	0	0	0	112.6	L120 Y121 I126 L127 A128 P211 F248 F249	L120-V124 WeakPolarHBondContact O-CG1 3.38Å; L120-V124 PolarHBondContact O-N 3.21Å; Y121-V124 WeakPolarHBondContact O-CG1 3.27Å; V124-I126 VanDerWaalsContact C-N 3.33Å; V124-I126 PolarHBondContact O-N 3.33Å; V124-L127 WeakPolarHBondContact O-CB 3.2Å; V124-L127 PolarHBondContact O-N 2.73Å; V124-L127 VanDerWaalsContact O-N 3.12Å; V124-A128 PolarHBondContact O-N 3.31Å; V124-P211 HydrophobicContact CB-CB 4.44Å; V124-P211 HydrophobicContact CB-CG 4.35Å; V124-P211 HydrophobicContact CG1-CB 4.27Å; V124-P211 HydrophobicContact CG1-CG 3.69Å; V124-P211 HydrophobicContact CG2-CB 3.53Å; V124-P211 HydrophobicContact CG2-CG 3.78Å; V124-F248 HydrophobicContact CB-CE1 3.81Å; V124-F248 HydrophobicContact CB-CZ 3.69Å; V124-F248 HydrophobicContact CG2-CD1 4.34Å; V124-F248 HydrophobicContact CG2-CE1 3.57Å; V124-F248 HydrophobicContact CG2-CZ 4.01Å; V124-F249 HydrophobicContact CG2-CE1 4.46Å
125	L	95.4	Very high	94.2	Very high	32 Å²	32	12.5 Å²	12.5	17%	0.168	6%	0.06	C	C	.	.	H	α-helix	trans	-66.7	-36.2	176	-70.9	173	0	0	0	111.1	Y121 S122 S123 L127 A128 F129 V160 P211	Y121-L125 VanDerWaalsContact O-CB 3.25Å; Y121-L125 WeakPolarHBondContact O-CB 3.04Å; Y121-L125 WeakPolarHBondContact O-CD1 3.5Å; Y121-L125 WeakPolarHBondContact O-CG 3.38Å; Y121-L125 PolarHBondContact O-N 3.44Å; S122-L125 PolarHBondContact O-N 3.01Å; S123-L125 PolarHBondContact O-N 3.33Å; L125-L127 VanDerWaalsContact C-N 3.29Å; L125-L127 PolarHBondContact O-N 3.32Å; L125-A128 WeakPolarHBondContact O-CB 3.38Å; L125-A128 PolarHBondContact O-N 3.47Å; L125-F129 VanDerWaalsContact O-CD2 3.28Å; L125-F129 WeakPolarHBondContact O-CD2 3.31Å; L125-F129 PolarHBondContact O-N 3.49Å; L125-V160 HydrophobicContact CB-CB 4.41Å; L125-V160 HydrophobicContact CB-CG1 3.96Å; L125-V160 HydrophobicContact CB-CG2 4.05Å; L125-P211 HydrophobicContact CD2-CG 4.2Å
126	I	94.6	Very high	93.9	Very high	0 Å²	0	12.2 Å²	12.2	0%	0	6%	0.058	C	C	.	.	H	α-helix	trans	-61.4	-38.9	171.4	-70.9	160.6	0	0	0	110.7	H79 L80 S122 S123 V124 A128 F129 I130 V160	H79-I126 HydrophobicContact CB-CD1 3.73Å; H79-I126 HydrophobicContact CB-CG1 4.43Å; L80-I126 HydrophobicContact CB-CG2 4.13Å; L80-I126 HydrophobicContact CD1-CB 4.47Å; L80-I126 HydrophobicContact CD1-CG2 4.44Å; S122-I126 WeakPolarHBondContact O-CB 3.28Å; S122-I126 VanDerWaalsContact O-CD1 3.28Å; S122-I126 WeakPolarHBondContact O-CD1 3.35Å; S122-I126 WeakPolarHBondContact O-CG1 3.33Å; S122-I126 PolarHBondContact O-N 2.76Å; S123-I126 PolarHBondContact O-N 3.4Å; V124-I126 VanDerWaalsContact C-N 3.33Å; V124-I126 PolarHBondContact O-N 3.33Å; I126-A128 VanDerWaalsContact C-N 3.33Å; I126-A128 PolarHBondContact O-N 3.45Å; I126-F129 PolarHBondContact O-N 3.29Å; I126-I130 HydrophobicContact CG2-CD1 4Å; I126-I130 HydrophobicContact CG2-CG1 4.37Å; I126-I130 VanDerWaalsContact O-CG1 3.3Å; I126-I130 WeakPolarHBondContact O-CG1 3.06Å; I126-I130 PolarHBondContact O-N 2.7Å; I126-V160 HydrophobicContact CD1-CG1 4.37Å; I126-V160 HydrophobicContact CG1-CG1 3.89Å
127	L	92.6	Very high	93.5	Very high	2 Å²	2	12.8 Å²	12.8	1%	0.01	6%	0.064	C	C	.	.	H	α-helix	trans	-63.3	-39.1	174.3	-58.8	-169	0	0	0	112.4	L80 S123 V124 L125 I130 S131 I215 L244 F248	L80-L127 HydrophobicContact CD2-CD2 4.01Å; S123-L127 WeakPolarHBondContact O-CG 3.45Å; S123-L127 PolarHBondContact O-N 3.1Å; S123-L127 VanDerWaalsContact O-N 3.09Å; V124-L127 WeakPolarHBondContact O-CB 3.2Å; V124-L127 PolarHBondContact O-N 2.73Å; V124-L127 VanDerWaalsContact O-N 3.12Å; L125-L127 VanDerWaalsContact C-N 3.29Å; L125-L127 PolarHBondContact O-N 3.32Å; L127-I130 HydrophobicContact CD2-CD1 4.18Å; L127-I130 PolarHBondContact O-N 2.94Å; L127-S131 PolarHBondContact O-N 2.84Å; L127-S131 PolarHBondContact O-OG 3.36Å; L127-I215 HydrophobicContact CB-CD1 4.11Å; L127-L244 HydrophobicContact CD1-CD2 4.1Å; L127-L244 HydrophobicContact CD2-CD2 3.19Å; L127-L244 HydrophobicContact CG-CD2 4.27Å; L127-F248 HydrophobicContact CD1-CB 3.57Å; L127-F248 HydrophobicContact CD1-CD1 3.9Å; L127-F248 HydrophobicContact CD1-CD2 3.71Å; L127-F248 HydrophobicContact CD1-CE2 4.39Å; L127-F248 HydrophobicContact CD1-CG 3.43Å; L127-F248 VanDerWaalsContact CD1-CG 3.43Å
128	A	94.7	Very high	93.1	Very high	6 Å²	6	13.9 Å²	13.9	5%	0.05	7%	0.07	C	C	.	.	H	α-helix	trans	-62.5	-43.4	172.8	0	0	0	0	0	111.4	V124 L125 I126 S131 L132 P211 V214 I215	V124-A128 PolarHBondContact O-N 3.31Å; L125-A128 WeakPolarHBondContact O-CB 3.38Å; L125-A128 PolarHBondContact O-N 3.47Å; I126-A128 VanDerWaalsContact C-N 3.33Å; I126-A128 PolarHBondContact O-N 3.45Å; A128-S131 WeakPolarHBondContact O-CB 3.35Å; A128-S131 PolarHBondContact O-N 3.39Å; A128-S131 VanDerWaalsContact O-N 3.15Å; A128-L132 PolarHBondContact O-N 2.95Å; A128-P211 HydrophobicContact CB-CB 4.31Å; A128-V214 HydrophobicContact CB-CB 4.35Å; A128-V214 HydrophobicContact CB-CG1 4.07Å; A128-I215 HydrophobicContact CB-CD1 4.45Å; A128-I215 HydrophobicContact CB-CG1 4.14Å
129	F	94.4	Very high	92.6	Very high	28 Å²	28	15.5 Å²	15.5	12%	0.123	8%	0.08	C	C	.	.	H	α-helix	trans	-65.2	-38.6	175.9	-90	-114.8	0	0	0	113.1	Y76 L125 I126 S131 L132 D133 L151 V155 V156 V160	Y76-F129 HydrophobicContact CD1-CB 4.22Å; Y76-F129 HydrophobicContact CE1-CB 3.78Å; Y76-F129 AromaticContact CE1-CD1 3.95Å; Y76-F129 HydrophobicContact CE1-CD1 3.95Å; Y76-F129 HydrophobicContact CE1-CG 4.33Å; L125-F129 VanDerWaalsContact O-CD2 3.28Å; L125-F129 WeakPolarHBondContact O-CD2 3.31Å; L125-F129 PolarHBondContact O-N 3.49Å; I126-F129 PolarHBondContact O-N 3.29Å; F129-S131 VanDerWaalsContact C-N 3.27Å; F129-S131 PolarHBondContact O-N 3.34Å; F129-L132 PolarHBondContact O-N 3.41Å; F129-D133 WeakPolarHBondContact O-CB 3.42Å; F129-D133 PolarHBondContact O-N 2.92Å; F129-L151 HydrophobicContact CD1-CD1 3.88Å; F129-L151 HydrophobicContact CD1-CD2 4.17Å; F129-L151 HydrophobicContact CD1-CG 3.73Å; F129-L151 HydrophobicContact CE1-CD1 3.58Å; F129-L151 HydrophobicContact CE1-CG 3.9Å; F129-L151 HydrophobicContact CZ-CD1 4.45Å; F129-V155 HydrophobicContact CE1-CB 4.17Å; F129-V155 HydrophobicContact CE1-CG1 3.85Å; F129-V155 HydrophobicContact CZ-CG1 3.98Å; F129-V156 HydrophobicContact CD1-CB 4.49Å; F129-V156 HydrophobicContact CE1-CB 4.49Å; F129-V160 HydrophobicContact CD2-CG2 3.78Å; F129-V160 HydrophobicContact CE1-CG2 4.48Å; F129-V160 HydrophobicContact CE2-CG2 3.66Å; F129-V160 HydrophobicContact CG-CG2 4.24Å; F129-V160 HydrophobicContact CZ-CG2 4.04Å
130	I	91.5	Very high	92	Very high	8 Å²	8	19.6 Å²	19.6	4%	0.041	10%	0.099	C	C	.	.	H	α-helix	trans	-59.3	-43.9	171.9	-71.2	167.6	0	0	0	109.6	Y76 I126 L127 D133 R134 T241	Y76-I130 HydrophobicContact CD2-CG1 4.1Å; Y76-I130 HydrophobicContact CG-CG1 3.9Å; I126-I130 HydrophobicContact CG2-CD1 4Å; I126-I130 HydrophobicContact CG2-CG1 4.37Å; I126-I130 VanDerWaalsContact O-CG1 3.3Å; I126-I130 WeakPolarHBondContact O-CG1 3.06Å; I126-I130 PolarHBondContact O-N 2.7Å; L127-I130 HydrophobicContact CD2-CD1 4.18Å; L127-I130 PolarHBondContact O-N 2.94Å; I130-D133 PolarHBondContact O-N 3.46Å; I130-R134 WeakPolarHBondContact O-CG 3.24Å; I130-R134 PolarHBondContact O-N 2.91Å; I130-T241 HydrophobicContact CG2-CG2 3.82Å
131	S	91.8	Very high	91.5	Very high	0 Å²	0	21.8 Å²	21.8	0%	0	12%	0.117	C	C	.	.	H	α-helix	trans	-63.9	-41.3	179	-54.6	0	0	0	0	111.8	L127 A128 F129 R134 Y135 Y219 I245	L127-S131 PolarHBondContact O-N 2.84Å; L127-S131 PolarHBondContact O-OG 3.36Å; A128-S131 WeakPolarHBondContact O-CB 3.35Å; A128-S131 PolarHBondContact O-N 3.39Å; A128-S131 VanDerWaalsContact O-N 3.15Å; F129-S131 VanDerWaalsContact C-N 3.27Å; F129-S131 PolarHBondContact O-N 3.34Å; S131-R134 PolarHBondContact O-N 3.34Å; S131-Y135 WeakPolarHBondContact O-CB 3.32Å; S131-Y135 PolarHBondContact O-N 3.11Å; S131-Y219 WeakPolarHBondContact OG-CE2 3.49Å; S131-I245 WeakPolarHBondContact OG-CD1 3.36Å
132	L	93.4	Very high	90.8	Very high	56 Å²	56	28.2 Å²	28.2	29%	0.293	16%	0.156	S	C	.	.	H	α-helix	trans	-66.7	-40.4	175.4	-163.4	66.8	0	0	0	112.2	A128 F129 R134 Y135 L136 L151	A128-L132 PolarHBondContact O-N 2.95Å; F129-L132 PolarHBondContact O-N 3.41Å; L132-R134 VanDerWaalsContact C-N 3.33Å; L132-R134 PolarHBondContact O-N 2.92Å; L132-Y135 HydrophobicContact CD1-CD1 4.17Å; L132-Y135 WeakPolarHBondContact O-CB 3.37Å; L132-Y135 PolarHBondContact O-N 3.42Å; L132-L136 WeakPolarHBondContact O-CG 3.23Å; L132-L136 PolarHBondContact O-N 3.14Å; L132-L151 HydrophobicContact CB-CD2 4.23Å; L132-L151 HydrophobicContact CD2-CD1 4.1Å; L132-L151 HydrophobicContact CD2-CD2 3.95Å; L132-L151 HydrophobicContact CG-CD2 4.23Å
133	D	91.3	Very high	90.2	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.19	C	C	.	.	H	α-helix	trans	-61.1	-40.5	172.6	166.6	68.2	0	0	0	111.8	T73 Y76 F129 I130 A137 R148	T73-D133 PolarHBondContact OG1-OD2 3.48Å; Y76-D133 HydrophobicContact CE2-CB 3.79Å; F129-D133 WeakPolarHBondContact O-CB 3.42Å; F129-D133 PolarHBondContact O-N 2.92Å; I130-D133 PolarHBondContact O-N 3.46Å; D133-A137 VanDerWaalsContact O-CB 3.31Å; D133-A137 WeakPolarHBondContact O-CB 3.28Å; D133-A137 PolarHBondContact O-N 2.99Å; D133-R148 PolarHBondContact O-NE 2.72Å; D133-R148 IonicContact OD1-CZ 2.63Å; D133-R148 VanDerWaalsContact OD1-CZ 3.28Å; D133-R148 IonicContact OD1-NE 3.72Å; D133-R148 PolarHBondContact OD1-NE 2.75Å; D133-R148 IonicContact OD1-NH2 3.28Å; D133-R148 PolarHBondContact OD1-NH2 3.42Å; D133-R148 IonicContact OD2-NH2 2.94Å
134	R	88.9	Confident	89.8	Confident	30 Å²	30	34.8 Å²	34.8	11%	0.113	19%	0.192	C	C	.	.	H	α-helix	trans	-65.5	-43.8	174.1	-67.7	-56.3	90.5	-143.5	8.6	111.5	T73 I130 S131 L132 A137 I138 I222 T241	T73-R134 PolarHBondContact OG1-NH2 3.44Å; I130-R134 WeakPolarHBondContact O-CG 3.24Å; I130-R134 PolarHBondContact O-N 2.91Å; S131-R134 PolarHBondContact O-N 3.34Å; L132-R134 VanDerWaalsContact C-N 3.33Å; L132-R134 PolarHBondContact O-N 2.92Å; R134-A137 PolarHBondContact O-N 3.29Å; R134-I138 WeakPolarHBondContact O-CG1 3.46Å; R134-I138 PolarHBondContact O-N 2.98Å; R134-I138 VanDerWaalsContact O-N 3.09Å; R134-I222 HydrophobicContact CB-CD1 4.14Å; R134-T241 HydrophobicContact CG-CG2 4.03Å
135	Y	90.8	Very high	89.5	Confident	48 Å²	48	40.8 Å²	40.8	19%	0.188	22%	0.22	C	C	.	.	H	α-helix	trans	-55.5	-53.5	175.2	162.9	-98.2	0	0	0	110.8	S131 L132 A137 I138 V139 H140 I221	S131-Y135 WeakPolarHBondContact O-CB 3.32Å; S131-Y135 PolarHBondContact O-N 3.11Å; L132-Y135 HydrophobicContact CD1-CD1 4.17Å; L132-Y135 WeakPolarHBondContact O-CB 3.37Å; L132-Y135 PolarHBondContact O-N 3.42Å; Y135-A137 VanDerWaalsContact C-N 3.31Å; Y135-A137 PolarHBondContact O-N 3.27Å; Y135-I138 PolarHBondContact O-N 3.42Å; Y135-V139 HydrophobicContact CD2-CB 4.07Å; Y135-V139 HydrophobicContact CD2-CG2 3.56Å; Y135-V139 HydrophobicContact CE2-CB 3.82Å; Y135-V139 HydrophobicContact CE2-CG1 3.92Å; Y135-V139 HydrophobicContact CE2-CG2 3.63Å; Y135-V139 HydrophobicContact CG-CG2 4.45Å; Y135-V139 WeakPolarHBondContact O-CB 3.48Å; Y135-V139 WeakPolarHBondContact O-CG2 3.36Å; Y135-V139 PolarHBondContact O-N 3.44Å; Y135-H140 AromaticContact CE1-CD2 3.74Å; Y135-H140 AromaticContact CE1-NE2 3.93Å; Y135-H140 AromaticContact CZ-CD2 3.83Å; Y135-H140 AromaticContact CZ-NE2 3.67Å; Y135-H140 PolarHBondContact OH-NE2 2.8Å; Y135-I221 HydrophobicContact CD2-CB 4.42Å; Y135-I221 HydrophobicContact CD2-CG2 4.37Å; Y135-I221 HydrophobicContact CE2-CB 4.3Å; Y135-I221 HydrophobicContact CE2-CD1 4.02Å; Y135-I221 HydrophobicContact CE2-CG2 3.91Å
136	L	91.3	Very high	89.2	Confident	29 Å²	29	48.1 Å²	48.1	15%	0.152	25%	0.25	C	S	.	.	H	α-helix	trans	-59.8	-41	178.7	-68.9	174.7	0	0	0	112	L132 I138 H140 S144 P147 R148 L151	L132-L136 WeakPolarHBondContact O-CG 3.23Å; L132-L136 PolarHBondContact O-N 3.14Å; L136-I138 VanDerWaalsContact C-N 3.3Å; L136-I138 PolarHBondContact O-N 2.98Å; L136-H140 CarbonylContact O-C 3.36Å; L136-H140 WeakPolarHBondContact O-CA 3.03Å; L136-H140 PolarHBondContact O-N 3.47Å; L136-S144 WeakPolarHBondContact O-CB 3.36Å; L136-P147 HydrophobicContact CD1-CB 4.4Å; L136-R148 HydrophobicContact CB-CG 3.65Å; L136-R148 HydrophobicContact CD1-CG 3.88Å; L136-R148 HydrophobicContact CG-CG 4.44Å; L136-L151 HydrophobicContact CD1-CD2 4.48Å
137	A	88.1	Confident	89.1	Confident	17 Å²	17	50.7 Å²	50.7	14%	0.14	27%	0.267	C	S	.	.	H	α-helix	trans	-66.4	-28.9	-179.2	0	0	0	0	0	113.9	D133 R134 Y135	D133-A137 VanDerWaalsContact O-CB 3.31Å; D133-A137 WeakPolarHBondContact O-CB 3.28Å; D133-A137 PolarHBondContact O-N 2.99Å; R134-A137 PolarHBondContact O-N 3.29Å; Y135-A137 VanDerWaalsContact C-N 3.31Å; Y135-A137 PolarHBondContact O-N 3.27Å
138	I	86.3	Confident	89.1	Confident	22 Å²	22	51.9 Å²	51.9	11%	0.113	27%	0.271	C	S	.	.	H	α-helix	trans	-99.7	-49.2	-173.9	-64.3	169	0	0	0	110.9	R134 Y135 L136 I222 L226 L238	R134-I138 WeakPolarHBondContact O-CG1 3.46Å; R134-I138 PolarHBondContact O-N 2.98Å; R134-I138 VanDerWaalsContact O-N 3.09Å; Y135-I138 PolarHBondContact O-N 3.42Å; L136-I138 VanDerWaalsContact C-N 3.3Å; L136-I138 PolarHBondContact O-N 2.98Å; I138-I222 HydrophobicContact CD1-CG2 3.73Å; I138-L226 HydrophobicContact CD1-CD1 4.36Å; I138-L226 HydrophobicContact CG2-CD1 4.47Å; I138-L226 HydrophobicContact CG2-CG 4.31Å; I138-L238 HydrophobicContact CD1-CD1 4.41Å
139	V	86.9	Confident	88.9	Confident	40 Å²	40	56.5 Å²	56.5	24%	0.242	29%	0.291	C	S	.	.	H	α-helix	trans	-78.9	-42.2	-174.7	-178	0	0	0	0	111.2	Y135 I221	Y135-V139 HydrophobicContact CD2-CB 4.07Å; Y135-V139 HydrophobicContact CD2-CG2 3.56Å; Y135-V139 HydrophobicContact CE2-CB 3.82Å; Y135-V139 HydrophobicContact CE2-CG1 3.92Å; Y135-V139 HydrophobicContact CE2-CG2 3.63Å; Y135-V139 HydrophobicContact CG-CG2 4.45Å; Y135-V139 WeakPolarHBondContact O-CB 3.48Å; Y135-V139 WeakPolarHBondContact O-CG2 3.36Å; Y135-V139 PolarHBondContact O-N 3.44Å; V139-I221 HydrophobicContact CG2-CG2 4.12Å
140	H	85.4	Confident	88.8	Confident	92 Å²	92	59.6 Å²	59.6	43%	0.426	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	-107.3	36	-176.9	-66.1	-70	0	0	0	112.7	Y135 L136 T142 N143 S144	Y135-H140 AromaticContact CE1-CD2 3.74Å; Y135-H140 AromaticContact CE1-NE2 3.93Å; Y135-H140 AromaticContact CZ-CD2 3.83Å; Y135-H140 AromaticContact CZ-NE2 3.67Å; Y135-H140 PolarHBondContact OH-NE2 2.8Å; L136-H140 CarbonylContact O-C 3.36Å; L136-H140 WeakPolarHBondContact O-CA 3.03Å; L136-H140 PolarHBondContact O-N 3.47Å; H140-T142 PolarHBondContact O-N 3.06Å; H140-N143 PolarHBondContact O-N 3.46Å; H140-N143 VanDerWaalsContact O-N 3.15Å; H140-S144 VanDerWaalsContact O-CB 3.24Å; H140-S144 WeakPolarHBondContact O-CB 3.31Å; H140-S144 PolarHBondContact O-N 3.5Å; H140-S144 VanDerWaalsContact O-N 3.11Å
141	A	81.8	Confident	88.8	Confident	48 Å²	48	60 Å²	60	40%	0.397	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-49.6	-38.7	-167.2	0	0	0	0	0	114.5	N143 S144	A141-N143 PolarHBondContact O-N 3.38Å; A141-S144 PolarHBondContact O-OG 3.46Å
142	T	80.8	Confident	88.7	Confident	134 Å²	134	60.1 Å²	60.1	82%	0.822	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-39	-176	-43.7	0	0	0	0	113.7	H140	H140-T142 PolarHBondContact O-N 3.06Å
143	N	84.7	Confident	88.6	Confident	132 Å²	132	61.3 Å²	61.3	71%	0.706	32%	0.315	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.6	17	-173.6	-69.4	-26.3	0	0	0	113.3	H140 A141 Q145 P147	H140-N143 PolarHBondContact O-N 3.46Å; H140-N143 VanDerWaalsContact O-N 3.15Å; A141-N143 PolarHBondContact O-N 3.38Å; N143-Q145 PolarHBondContact O-N 2.97Å; N143-P147 VanDerWaalsContact O-CD 3.27Å; N143-P147 WeakPolarHBondContact O-CD 3.29Å
144	S	87.3	Confident	88.7	Confident	7 Å²	7	68.1 Å²	68.1	5%	0.049	35%	0.345	C	S	.	.			trans	-75	-18.2	-170	64.8	0	0	0	0	115.7	L136 H140 A141 P147 R148	L136-S144 WeakPolarHBondContact O-CB 3.36Å; H140-S144 VanDerWaalsContact O-CB 3.24Å; H140-S144 WeakPolarHBondContact O-CB 3.31Å; H140-S144 PolarHBondContact O-N 3.5Å; H140-S144 VanDerWaalsContact O-N 3.11Å; A141-S144 PolarHBondContact O-OG 3.46Å; S144-P147 WeakPolarHBondContact O-CD 3.44Å; S144-P147 WeakPolarHBondContact O-CG 3.31Å; S144-R148 WeakPolarHBondContact O-CB 3.26Å; S144-R148 VanDerWaalsContact O-CD 3.25Å; S144-R148 WeakPolarHBondContact O-CD 3.4Å; S144-R148 WeakPolarHBondContact O-CG 3.42Å; S144-R148 PolarHBondContact O-N 3.33Å
145	Q	87.9	Confident	89.1	Confident	125 Å²	125	69 Å²	69	58%	0.584	35%	0.353	S	S	*	.	H	α-helix	trans	-63.9	-50.1	-171.1	-77.3	-71	-2.6	0	0	113.8	N143 K149	N143-Q145 PolarHBondContact O-N 2.97Å; Q145-K149 WeakPolarHBondContact O-CB 3.41Å; Q145-K149 PolarHBondContact O-N 2.64Å
146	K	89.6	Confident	89.2	Confident	186 Å²	186	66.7 Å²	66.7	81%	0.809	34%	0.344	S	S	*	.	H	α-helix	trans	-59.7	-54.2	178.7	-70.9	-176.4	179.9	179.8	0	112.6	R148 K149 L150	K146-R148 PolarHBondContact O-N 3.14Å; K146-K149 PolarHBondContact O-N 2.78Å; K146-L150 PolarHBondContact O-N 3.33Å
147	P	91.6	Very high	89.5	Confident	54 Å²	54	71 Å²	71	35%	0.351	36%	0.359	S	S	.	.	H	α-helix	trans	-65.2	-37.1	-179.1	24	-33.6	0	0	0	112.5	L136 N143 S144 K149 L150 L151	L136-P147 HydrophobicContact CD1-CB 4.4Å; N143-P147 VanDerWaalsContact O-CD 3.27Å; N143-P147 WeakPolarHBondContact O-CD 3.29Å; S144-P147 WeakPolarHBondContact O-CD 3.44Å; S144-P147 WeakPolarHBondContact O-CG 3.31Å; P147-K149 PolarHBondContact O-N 3.18Å; P147-L150 PolarHBondContact O-N 3Å; P147-L151 WeakPolarHBondContact O-CB 3.45Å; P147-L151 PolarHBondContact O-N 3.47Å
148	R	92.8	Very high	89.8	Confident	27 Å²	27	74.6 Å²	74.6	10%	0.102	38%	0.379	C	S	.	.	H	α-helix	trans	-65.8	-39	177	-69.7	171	65	-143.1	-9.8	112.6	D133 L136 S144 K146 L151 A152	D133-R148 PolarHBondContact O-NE 2.72Å; D133-R148 IonicContact OD1-CZ 2.63Å; D133-R148 VanDerWaalsContact OD1-CZ 3.28Å; D133-R148 IonicContact OD1-NE 3.72Å; D133-R148 PolarHBondContact OD1-NE 2.75Å; D133-R148 IonicContact OD1-NH2 3.28Å; D133-R148 PolarHBondContact OD1-NH2 3.42Å; D133-R148 IonicContact OD2-NH2 2.94Å; L136-R148 HydrophobicContact CB-CG 3.65Å; L136-R148 HydrophobicContact CD1-CG 3.88Å; L136-R148 HydrophobicContact CG-CG 4.44Å; S144-R148 WeakPolarHBondContact O-CB 3.26Å; S144-R148 VanDerWaalsContact O-CD 3.25Å; S144-R148 WeakPolarHBondContact O-CD 3.4Å; S144-R148 WeakPolarHBondContact O-CG 3.42Å; S144-R148 PolarHBondContact O-N 3.33Å; K146-R148 PolarHBondContact O-N 3.14Å; R148-L151 PolarHBondContact O-N 3.18Å; R148-A152 WeakPolarHBondContact O-CB 3.48Å; R148-A152 PolarHBondContact O-N 3.48Å; R148-A152 VanDerWaalsContact O-N 3.08Å
149	K	90.6	Very high	90.2	Very high	104 Å²	104	74.8 Å²	74.8	45%	0.452	39%	0.386	S	S	.	.	H	α-helix	trans	-64.4	-46.2	174.3	-174.3	177.9	176.7	-178.4	0	111.1	M72 Q145 K146 P147 L151 A152 E153	M72-K149 HydrophobicContact CE-CB 3.83Å; M72-K149 HydrophobicContact CE-CG 4.07Å; Q145-K149 WeakPolarHBondContact O-CB 3.41Å; Q145-K149 PolarHBondContact O-N 2.64Å; K146-K149 PolarHBondContact O-N 2.78Å; P147-K149 PolarHBondContact O-N 3.18Å; K149-L151 VanDerWaalsContact C-N 3.32Å; K149-L151 PolarHBondContact O-N 2.92Å; K149-A152 PolarHBondContact O-N 3.47Å; K149-E153 VanDerWaalsContact CE-CD 3.46Å; K149-E153 VanDerWaalsContact CE-OE1 3.29Å; K149-E153 WeakPolarHBondContact CE-OE1 3.39Å; K149-E153 WeakPolarHBondContact CE-OE2 3.11Å; K149-E153 HydrophobicContact CG-CG 4.34Å; K149-E153 WeakPolarHBondContact CG-OE2 3.49Å; K149-E153 WeakPolarHBondContact O-CB 3.47Å; K149-E153 PolarHBondContact O-N 2.95Å
150	L	91.9	Very high	90.7	Very high	92 Å²	92	72.9 Å²	72.9	48%	0.482	38%	0.375	S	S	.	.	H	α-helix	trans	-58.3	-45.3	176.7	179.5	65	0	0	0	111.5	K146 P147 A152 K154 V155	K146-L150 PolarHBondContact O-N 3.33Å; P147-L150 PolarHBondContact O-N 3Å; L150-A152 PolarHBondContact O-N 3.1Å; L150-K154 HydrophobicContact CD1-CB 4.06Å; L150-K154 HydrophobicContact CD1-CD 3.8Å; L150-K154 HydrophobicContact CD1-CG 4.16Å; L150-K154 PolarHBondContact O-N 3.32Å; L150-V155 HydrophobicContact CG-CG2 4.15Å; L150-V155 PolarHBondContact O-N 2.89Å; L150-V155 VanDerWaalsContact O-N 3.14Å
151	L	92.3	Very high	91.2	Very high	18 Å²	18	70.3 Å²	70.3	9%	0.094	36%	0.362	C	S	.	.	I	π-helix	trans	-59.5	-48	179.2	-165.8	74.8	0	0	0	111.3	Y76 F129 L132 L136 P147 R148 K149 V155 V156	Y76-L151 VanDerWaalsContact OH-C 3.31Å; Y76-L151 WeakPolarHBondContact OH-CD2 3.31Å; Y76-L151 WeakPolarHBondContact OH-CG 3.48Å; F129-L151 HydrophobicContact CD1-CD1 3.88Å; F129-L151 HydrophobicContact CD1-CD2 4.17Å; F129-L151 HydrophobicContact CD1-CG 3.73Å; F129-L151 HydrophobicContact CE1-CD1 3.58Å; F129-L151 HydrophobicContact CE1-CG 3.9Å; F129-L151 HydrophobicContact CZ-CD1 4.45Å; L132-L151 HydrophobicContact CB-CD2 4.23Å; L132-L151 HydrophobicContact CD2-CD1 4.1Å; L132-L151 HydrophobicContact CD2-CD2 3.95Å; L132-L151 HydrophobicContact CG-CD2 4.23Å; L136-L151 HydrophobicContact CD1-CD2 4.48Å; P147-L151 WeakPolarHBondContact O-CB 3.45Å; P147-L151 PolarHBondContact O-N 3.47Å; R148-L151 PolarHBondContact O-N 3.18Å; K149-L151 VanDerWaalsContact C-N 3.32Å; K149-L151 PolarHBondContact O-N 2.92Å; L151-V155 HydrophobicContact CD1-CB 3.97Å; L151-V155 HydrophobicContact CD1-CG1 3.97Å; L151-V155 HydrophobicContact CD1-CG2 4.36Å; L151-V155 PolarHBondContact O-N 3.37Å; L151-V156 PolarHBondContact O-N 2.85Å
152	A	90.2	Very high	92	Very high	2 Å²	2	72.2 Å²	72.2	2%	0.017	36%	0.364	C	S	.	.	I	π-helix	trans	-77.5	-25	-175	0	0	0	0	0	114.7	M72 K75 Y76 R148 K149 L150 V156	M72-A152 HydrophobicContact SD-CB 4.23Å; K75-A152 HydrophobicContact CD-CB 4.31Å; Y76-A152 HydrophobicContact CE1-CB 4.33Å; Y76-A152 HydrophobicContact CE2-CB 3.96Å; Y76-A152 VanDerWaalsContact OH-CA 3.3Å; Y76-A152 WeakPolarHBondContact OH-CA 3.23Å; Y76-A152 PolarHBondContact OH-N 3.46Å; R148-A152 WeakPolarHBondContact O-CB 3.48Å; R148-A152 PolarHBondContact O-N 3.48Å; R148-A152 VanDerWaalsContact O-N 3.08Å; K149-A152 PolarHBondContact O-N 3.47Å; L150-A152 PolarHBondContact O-N 3.1Å; A152-V156 WeakPolarHBondContact O-CG1 3.46Å
153	E	91.1	Very high	92.7	Very high	81 Å²	81	67.9 Å²	67.9	38%	0.379	34%	0.338	S	S	.	.	I	π-helix	trans	-105.7	-21.8	-175.2	-67.8	179	-177.9	0	0	113.9	K75 K149 Y157	K75-E153 IonicContact NZ-OE1 2.8Å; K75-E153 PolarHBondContact NZ-OE1 2.93Å; K149-E153 VanDerWaalsContact CE-CD 3.46Å; K149-E153 VanDerWaalsContact CE-OE1 3.29Å; K149-E153 WeakPolarHBondContact CE-OE1 3.39Å; K149-E153 WeakPolarHBondContact CE-OE2 3.11Å; K149-E153 HydrophobicContact CG-CG 4.34Å; K149-E153 WeakPolarHBondContact CG-OE2 3.49Å; K149-E153 WeakPolarHBondContact O-CB 3.47Å; K149-E153 PolarHBondContact O-N 2.95Å; E153-Y157 VanDerWaalsContact O-CE2 3.31Å; E153-Y157 WeakPolarHBondContact O-CE2 3.29Å
154	K	93.2	Very high	93.3	Very high	143 Å²	143	61.6 Å²	61.6	62%	0.622	30%	0.304	S	S	*	.	I	π-helix	trans	-126.5	-54.2	-177.2	-59.6	-165	-179.5	-175.4	0	112.3	L150 V156 Y157	L150-K154 HydrophobicContact CD1-CB 4.06Å; L150-K154 HydrophobicContact CD1-CD 3.8Å; L150-K154 HydrophobicContact CD1-CG 4.16Å; L150-K154 PolarHBondContact O-N 3.32Å; K154-V156 VanDerWaalsContact C-N 3.28Å; K154-V156 PolarHBondContact O-N 3.38Å; K154-Y157 PolarHBondContact O-N 2.97Å; K154-Y157 VanDerWaalsContact O-N 3.16Å
155	V	95.9	Very high	93.7	Very high	48 Å²	48	65.7 Å²	65.7	29%	0.291	33%	0.326	S	S	.	.	I	π-helix	trans	-66.3	-31.8	-171.4	-172.7	0	0	0	0	111.7	F129 L150 L151 Y157 V158 G159	F129-V155 HydrophobicContact CE1-CB 4.17Å; F129-V155 HydrophobicContact CE1-CG1 3.85Å; F129-V155 HydrophobicContact CZ-CG1 3.98Å; L150-V155 HydrophobicContact CG-CG2 4.15Å; L150-V155 PolarHBondContact O-N 2.89Å; L150-V155 VanDerWaalsContact O-N 3.14Å; L151-V155 HydrophobicContact CD1-CB 3.97Å; L151-V155 HydrophobicContact CD1-CG1 3.97Å; L151-V155 HydrophobicContact CD1-CG2 4.36Å; L151-V155 PolarHBondContact O-N 3.37Å; V155-Y157 PolarHBondContact O-N 2.9Å; V155-V158 HydrophobicContact CG1-CG2 4.49Å; V155-V158 WeakPolarHBondContact O-CG2 3.42Å; V155-V158 PolarHBondContact O-N 3.04Å; V155-G159 WeakPolarHBondContact O-CA 3.28Å; V155-G159 PolarHBondContact O-N 3.23Å
156	V	94.7	Very high	94.2	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-56.1	-35	176	70.7	0	0	0	0	112.8	Y76 F129 L151 A152 K154 V160 W161	Y76-V156 HydrophobicContact CD1-CG2 4.33Å; Y76-V156 HydrophobicContact CE1-CB 4.29Å; Y76-V156 HydrophobicContact CE1-CG2 4.16Å; F129-V156 HydrophobicContact CD1-CB 4.49Å; F129-V156 HydrophobicContact CE1-CB 4.49Å; L151-V156 PolarHBondContact O-N 2.85Å; A152-V156 WeakPolarHBondContact O-CG1 3.46Å; K154-V156 VanDerWaalsContact C-N 3.28Å; K154-V156 PolarHBondContact O-N 3.38Å; V156-V160 HydrophobicContact CG2-CB 4.3Å; V156-V160 HydrophobicContact CG2-CG2 3.94Å; V156-V160 WeakPolarHBondContact O-CA 3.35Å; V156-V160 WeakPolarHBondContact O-CB 3.41Å; V156-V160 PolarHBondContact O-N 2.64Å; V156-W161 PolarHBondContact O-N 3.14Å
157	Y	95.7	Very high	94.4	Very high	119 Å²	119	58.2 Å²	58.2	47%	0.467	30%	0.297	S	S	.	.	I	π-helix	trans	-71.8	-45.4	-179.9	-64.4	-77.5	0	0	0	111.9	H79 E153 K154 V155 W161 I162	H79-Y157 AromaticContact CE1-CE1 3.75Å; H79-Y157 AromaticContact CE1-CZ 3.71Å; E153-Y157 VanDerWaalsContact O-CE2 3.31Å; E153-Y157 WeakPolarHBondContact O-CE2 3.29Å; K154-Y157 PolarHBondContact O-N 2.97Å; K154-Y157 VanDerWaalsContact O-N 3.16Å; V155-Y157 PolarHBondContact O-N 2.9Å; Y157-W161 PolarHBondContact O-N 3.41Å; Y157-I162 PolarHBondContact O-N 3.17Å
158	V	96.2	Very high	94.7	Very high	92 Å²	92	56.1 Å²	56.1	56%	0.558	28%	0.284	S	S	*	.	I	π-helix	trans	-81.6	-23.6	-178.4	-63.5	0	0	0	0	113.7	V155 I162 P163	V155-V158 HydrophobicContact CG1-CG2 4.49Å; V155-V158 WeakPolarHBondContact O-CG2 3.42Å; V155-V158 PolarHBondContact O-N 3.04Å; V158-I162 HydrophobicContact CG1-CD1 4.09Å; V158-P163 WeakPolarHBondContact O-CD 3.28Å; V158-P163 WeakPolarHBondContact O-CG 3.39Å
159	G	94.2	Very high	94.8	Very high	26 Å²	26	59.1 Å²	59.1	27%	0.268	30%	0.301	S	S	.	.	I	π-helix	trans	-104	-8.5	-176.8	0	0	0	0	0	114.7	V155	V155-G159 WeakPolarHBondContact O-CA 3.28Å; V155-G159 PolarHBondContact O-N 3.23Å
160	V	96.3	Very high	95	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	29%	0.287	C	S	.	.	I	π-helix	trans	-126.4	-63.9	176.3	-179.3	0	0	0	0	110.3	L125 I126 F129 V156 P163 A164	L125-V160 HydrophobicContact CB-CB 4.41Å; L125-V160 HydrophobicContact CB-CG1 3.96Å; L125-V160 HydrophobicContact CB-CG2 4.05Å; I126-V160 HydrophobicContact CD1-CG1 4.37Å; I126-V160 HydrophobicContact CG1-CG1 3.89Å; F129-V160 HydrophobicContact CD2-CG2 3.78Å; F129-V160 HydrophobicContact CE1-CG2 4.48Å; F129-V160 HydrophobicContact CE2-CG2 3.66Å; F129-V160 HydrophobicContact CG-CG2 4.24Å; F129-V160 HydrophobicContact CZ-CG2 4.04Å; V156-V160 HydrophobicContact CG2-CB 4.3Å; V156-V160 HydrophobicContact CG2-CG2 3.94Å; V156-V160 WeakPolarHBondContact O-CA 3.35Å; V156-V160 WeakPolarHBondContact O-CB 3.41Å; V156-V160 PolarHBondContact O-N 2.64Å; V160-P163 WeakPolarHBondContact O-CD 3.4Å; V160-A164 WeakPolarHBondContact O-CB 3.09Å; V160-A164 PolarHBondContact O-N 3.44Å
161	W	97.6	Very high	95.1	Very high	39 Å²	39	51.1 Å²	51.1	15%	0.148	27%	0.265	C	S	.	.	I	π-helix	trans	-70	-47.6	-167.8	-72	96.4	0	0	0	113.5	H79 V82 A83 V118 V156 Y157 A164 L165	H79-W161 HydrophobicContact CB-CZ2 4.25Å; H79-W161 AromaticContact CE1-NE1 3.78Å; H79-W161 AromaticContact CG-NE1 3.88Å; H79-W161 AromaticContact ND1-CE2 3.73Å; H79-W161 AromaticContact ND1-CZ2 3.88Å; H79-W161 AromaticContact ND1-NE1 3.1Å; H79-W161 PolarHBondContact ND1-NE1 3.35Å; V82-W161 HydrophobicContact CG1-CH2 4.29Å; A83-W161 HydrophobicContact CB-CH2 4.02Å; V118-W161 HydrophobicContact CG1-CZ3 4.13Å; V156-W161 PolarHBondContact O-N 3.14Å; Y157-W161 PolarHBondContact O-N 3.41Å; W161-A164 PolarHBondContact O-N 3.37Å; W161-L165 WeakPolarHBondContact O-CB 3.3Å; W161-L165 WeakPolarHBondContact O-CG 3.26Å; W161-L165 PolarHBondContact O-N 3.16Å
162	I	97.2	Very high	95.3	Very high	88 Å²	88	56.1 Å²	56.1	45%	0.451	29%	0.286	S	S	.	.	H	α-helix	trans	-61.6	-51.5	177.8	-67.9	176.3	0	0	0	110.8	Y157 V158 A164 L165 L166	Y157-I162 PolarHBondContact O-N 3.17Å; V158-I162 HydrophobicContact CG1-CD1 4.09Å; I162-A164 VanDerWaalsContact C-N 3.35Å; I162-A164 PolarHBondContact O-N 3.23Å; I162-L165 PolarHBondContact O-N 3.12Å; I162-L166 HydrophobicContact CG2-CD1 3.76Å; I162-L166 HydrophobicContact CG2-CG 4.21Å; I162-L166 WeakPolarHBondContact O-CG 3.44Å; I162-L166 PolarHBondContact O-N 3.42Å
163	P	96.1	Very high	95.5	Very high	42 Å²	42	60.8 Å²	60.8	27%	0.273	31%	0.309	S	S	.	.	H	α-helix	trans	-58.2	-43.7	175.9	-26.4	34.9	0	0	0	113.2	V158 V160 L165 L166 L167	V158-P163 WeakPolarHBondContact O-CD 3.28Å; V158-P163 WeakPolarHBondContact O-CG 3.39Å; V160-P163 WeakPolarHBondContact O-CD 3.4Å; P163-L165 VanDerWaalsContact C-N 3.29Å; P163-L165 PolarHBondContact O-N 3.37Å; P163-L166 PolarHBondContact O-N 2.93Å; P163-L167 WeakPolarHBondContact O-CB 3.37Å; P163-L167 VanDerWaalsContact O-CG 3.24Å; P163-L167 WeakPolarHBondContact O-CG 3.27Å; P163-L167 PolarHBondContact O-N 3.49Å
164	A	96.5	Very high	95.8	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-59.5	-40	178.5	0	0	0	0	0	112	V160 W161 I162 T168	V160-A164 WeakPolarHBondContact O-CB 3.09Å; V160-A164 PolarHBondContact O-N 3.44Å; W161-A164 PolarHBondContact O-N 3.37Å; I162-A164 VanDerWaalsContact C-N 3.35Å; I162-A164 PolarHBondContact O-N 3.23Å; A164-T168 WeakPolarHBondContact O-CG2 3.42Å
165	L	96.9	Very high	96	Very high	94 Å²	94	51.7 Å²	51.7	49%	0.492	27%	0.269	S	S	.	.	H	α-helix	trans	-72	-38.4	175.6	-73.3	167.4	0	0	0	113.1	V118 W161 I162 P163 L167 T168	V118-L165 HydrophobicContact CG2-CD2 3.75Å; V118-L165 HydrophobicContact CG2-CG 4.43Å; W161-L165 WeakPolarHBondContact O-CB 3.3Å; W161-L165 WeakPolarHBondContact O-CG 3.26Å; W161-L165 PolarHBondContact O-N 3.16Å; I162-L165 PolarHBondContact O-N 3.12Å; P163-L165 VanDerWaalsContact C-N 3.29Å; P163-L165 PolarHBondContact O-N 3.37Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L165-T168 PolarHBondContact O-N 2.81Å; L165-T168 PolarHBondContact O-OG1 2.89Å
166	L	97.1	Very high	96.1	Very high	105 Å²	105	51.2 Å²	51.2	55%	0.55	27%	0.267	S	S	.	.	H	α-helix	trans	-66.9	-36.5	177.9	-70.9	174.6	0	0	0	111.6	I162 P163 T168 I169	I162-L166 HydrophobicContact CG2-CD1 3.76Å; I162-L166 HydrophobicContact CG2-CG 4.21Å; I162-L166 WeakPolarHBondContact O-CG 3.44Å; I162-L166 PolarHBondContact O-N 3.42Å; P163-L166 PolarHBondContact O-N 2.93Å; L166-T168 PolarHBondContact O-N 3.49Å; L166-I169 HydrophobicContact CD2-CD1 4.4Å; L166-I169 WeakPolarHBondContact O-CB 3.48Å; L166-I169 WeakPolarHBondContact O-CD1 3.27Å; L166-I169 VanDerWaalsContact O-CG1 3.23Å; L166-I169 WeakPolarHBondContact O-CG1 3.28Å; L166-I169 PolarHBondContact O-N 2.94Å
167	L	95.4	Very high	96.2	Very high	48 Å²	48	53.2 Å²	53.2	25%	0.251	28%	0.28	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.6	-5.3	179.6	-67.5	171.1	0	0	0	113.7	Y121 P163 L165 P170 V206	Y121-L167 HydrophobicContact CD2-CB 3.81Å; Y121-L167 HydrophobicContact CD2-CD1 3.84Å; Y121-L167 HydrophobicContact CE2-CB 3.57Å; Y121-L167 HydrophobicContact CE2-CD1 3.92Å; Y121-L167 HydrophobicContact CE2-CG 4.38Å; P163-L167 WeakPolarHBondContact O-CB 3.37Å; P163-L167 VanDerWaalsContact O-CG 3.24Å; P163-L167 WeakPolarHBondContact O-CG 3.27Å; P163-L167 PolarHBondContact O-N 3.49Å; L165-L167 VanDerWaalsContact C-N 3.31Å; L167-P170 WeakPolarHBondContact O-CD 3.26Å; L167-V206 HydrophobicContact CD1-CG1 3.88Å; L167-V206 HydrophobicContact CD1-CG2 4.22Å
168	T	96.1	Very high	96.1	Very high	10 Å²	10	49.8 Å²	49.8	6%	0.061	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.7	173.7	72	0	0	0	0	113.6	V114 T117 V118 A164 L165 L166 P170 D171 F172	V114-T168 HydrophobicContact CG1-CG2 4.21Å; T117-T168 HydrophobicContact CG2-CG2 3.76Å; V118-T168 HydrophobicContact CG2-CG2 3.58Å; A164-T168 WeakPolarHBondContact O-CG2 3.42Å; L165-T168 PolarHBondContact O-N 2.81Å; L165-T168 PolarHBondContact O-OG1 2.89Å; L166-T168 PolarHBondContact O-N 3.49Å; T168-P170 VanDerWaalsContact C-CD 3.43Å; T168-P170 VanDerWaalsContact C-N 3.27Å; T168-D171 WeakPolarHBondContact O-CB 3.36Å; T168-D171 PolarHBondContact O-N 3.18Å; T168-D171 VanDerWaalsContact O-N 3.08Å; T168-F172 PolarHBondContact O-N 3.22Å
169	I	96.1	Very high	95.9	Very high	91 Å²	91	51.7 Å²	51.7	47%	0.467	28%	0.276	S	S	.	.	H	α-helix	trans	-52.2	-43.1	175.3	-68.6	168.8	0	0	0	111.6	L166 F172 I173	L166-I169 HydrophobicContact CD2-CD1 4.4Å; L166-I169 WeakPolarHBondContact O-CB 3.48Å; L166-I169 WeakPolarHBondContact O-CD1 3.27Å; L166-I169 VanDerWaalsContact O-CG1 3.23Å; L166-I169 WeakPolarHBondContact O-CG1 3.28Å; L166-I169 PolarHBondContact O-N 2.94Å; I169-F172 PolarHBondContact O-N 2.98Å; I169-I173 HydrophobicContact CG2-CD1 3.74Å; I169-I173 HydrophobicContact CG2-CG1 4.46Å; I169-I173 WeakPolarHBondContact O-CG1 3.23Å; I169-I173 PolarHBondContact O-N 3.34Å
170	P	94.6	Very high	95.4	Very high	23 Å²	23	52.2 Å²	52.2	15%	0.149	28%	0.278	C	S	.	.	H	α-helix	trans	-59.2	-46.5	174.2	-25.2	36.4	0	0	0	113.4	L167 T168 F172 I173 F174 F199	L167-P170 WeakPolarHBondContact O-CD 3.26Å; T168-P170 VanDerWaalsContact C-CD 3.43Å; T168-P170 VanDerWaalsContact C-N 3.27Å; P170-F172 VanDerWaalsContact C-N 3.28Å; P170-F172 PolarHBondContact O-N 2.68Å; P170-I173 PolarHBondContact O-N 3.02Å; P170-I173 VanDerWaalsContact O-N 3.11Å; P170-F174 HydrophobicContact CB-CD2 4.2Å; P170-F174 HydrophobicContact CB-CE2 4.46Å; P170-F174 VanDerWaalsContact O-CD2 3.23Å; P170-F174 WeakPolarHBondContact O-CD2 3.22Å; P170-F174 PolarHBondContact O-N 2.92Å; P170-F199 HydrophobicContact CB-CD1 4.07Å; P170-F199 HydrophobicContact CB-CE1 3.47Å; P170-F199 VanDerWaalsContact CB-CE1 3.47Å; P170-F199 HydrophobicContact CB-CE2 4.36Å; P170-F199 HydrophobicContact CB-CZ 3.64Å; P170-F199 HydrophobicContact CG-CD1 4.24Å; P170-F199 HydrophobicContact CG-CE1 3.51Å; P170-F199 HydrophobicContact CG-CZ 4.05Å
171	D	93.3	Very high	94.8	Very high	4 Å²	4	59.7 Å²	59.7	2%	0.021	32%	0.318	C	S	.	.	H	α-helix	trans	-57.4	-44	175.7	-70.1	-76.8	0	0	0	111.4	H113 V114 T117 T168 I173 A175 R188	H113-D171 HydrophobicContact CB-CB 4.16Å; V114-D171 HydrophobicContact CG2-CB 4.32Å; T117-D171 VanDerWaalsContact CB-OD2 3.31Å; T117-D171 WeakPolarHBondContact CB-OD2 3.39Å; T117-D171 WeakPolarHBondContact CG2-OD2 3.49Å; T117-D171 VanDerWaalsContact OG1-CG 3.22Å; T117-D171 PolarHBondContact OG1-OD1 2.98Å; T117-D171 PolarHBondContact OG1-OD2 3.47Å; T168-D171 WeakPolarHBondContact O-CB 3.36Å; T168-D171 PolarHBondContact O-N 3.18Å; T168-D171 VanDerWaalsContact O-N 3.08Å; D171-I173 VanDerWaalsContact C-N 3.27Å; D171-I173 PolarHBondContact O-N 3.44Å; D171-A175 WeakPolarHBondContact O-CB 3.48Å; D171-A175 PolarHBondContact O-N 3.42Å; D171-R188 IonicContact OD1-CZ 3.84Å; D171-R188 IonicContact OD1-NE 2.75Å; D171-R188 PolarHBondContact OD1-NE 3.39Å; D171-R188 IonicContact OD1-NH2 3.29Å; D171-R188 PolarHBondContact OD1-NH2 3.19Å
172	F	96.1	Very high	94.2	Very high	123 Å²	123	65.2 Å²	65.2	54%	0.539	35%	0.35	S	S	.	.	H	α-helix	trans	-62.9	-34.4	178.6	-177.7	-99.4	0	0	0	112.6	K110 V114 T168 I169 P170	K110-F172 HydrophobicContact CB-CD2 4.36Å; K110-F172 HydrophobicContact CD-CD2 4.37Å; K110-F172 HydrophobicContact CD-CE2 4.33Å; K110-F172 WeakPolarHBondContact CD-O 3.47Å; K110-F172 WeakPolarHBondContact CE-O 3.39Å; K110-F172 PolarHBondContact NZ-O 3.46Å; V114-F172 HydrophobicContact CG2-CB 4.15Å; T168-F172 PolarHBondContact O-N 3.22Å; I169-F172 PolarHBondContact O-N 2.98Å; P170-F172 VanDerWaalsContact C-N 3.28Å; P170-F172 PolarHBondContact O-N 2.68Å
173	I	96.4	Very high	93.7	Very high	100 Å²	100	62.6 Å²	62.6	51%	0.513	34%	0.335	S	S	.	.	H	α-helix	trans	-77.8	-55	179.3	-66.9	168.4	0	0	0	110.4	K110 I169 P170 D171	K110-I173 PolarHBondContact NZ-O 3.06Å; K110-I173 VanDerWaalsContact NZ-O 3.1Å; I169-I173 HydrophobicContact CG2-CD1 3.74Å; I169-I173 HydrophobicContact CG2-CG1 4.46Å; I169-I173 WeakPolarHBondContact O-CG1 3.23Å; I169-I173 PolarHBondContact O-N 3.34Å; P170-I173 PolarHBondContact O-N 3.02Å; P170-I173 VanDerWaalsContact O-N 3.11Å; D171-I173 VanDerWaalsContact C-N 3.27Å; D171-I173 PolarHBondContact O-N 3.44Å
174	F	96.7	Very high	93.6	Very high	34 Å²	34	65 Å²	65	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-90	-18.9	-166.5	-62.5	-66.8	0	0	0	114.9	P170 S176 F189 Y190 P191 W195 F199	P170-F174 HydrophobicContact CB-CD2 4.2Å; P170-F174 HydrophobicContact CB-CE2 4.46Å; P170-F174 VanDerWaalsContact O-CD2 3.23Å; P170-F174 WeakPolarHBondContact O-CD2 3.22Å; P170-F174 PolarHBondContact O-N 2.92Å; F174-S176 PolarHBondContact O-N 3.46Å; F174-F189 WeakPolarHBondContact CD1-O 3.26Å; F174-F189 PolarHBondContact O-N 3.28Å; F174-Y190 HydrophobicContact CB-CD1 3.93Å; F174-Y190 HydrophobicContact CB-CE1 3.74Å; F174-Y190 AromaticContact CD1-CD1 3.92Å; F174-Y190 HydrophobicContact CD1-CD1 3.92Å; F174-Y190 HydrophobicContact CD1-CE1 4.44Å; F174-Y190 AromaticContact CD2-CD1 3.87Å; F174-Y190 HydrophobicContact CD2-CD1 3.87Å; F174-Y190 AromaticContact CD2-CE1 3.67Å; F174-Y190 HydrophobicContact CD2-CE1 3.67Å; F174-Y190 HydrophobicContact CE1-CD1 4.39Å; F174-Y190 HydrophobicContact CE2-CD1 4.36Å; F174-Y190 HydrophobicContact CE2-CE1 4.4Å; F174-Y190 AromaticContact CG-CD1 3.63Å; F174-Y190 HydrophobicContact CG-CD1 3.63Å; F174-Y190 AromaticContact CG-CE1 3.7Å; F174-Y190 HydrophobicContact CG-CE1 3.7Å; F174-P191 HydrophobicContact CE1-CG 4.27Å; F174-W195 HydrophobicContact CE2-CE3 4.46Å; F174-W195 HydrophobicContact CE2-CZ3 4.36Å; F174-W195 HydrophobicContact CZ-CE3 4.27Å; F174-W195 HydrophobicContact CZ-CH2 4.44Å; F174-W195 HydrophobicContact CZ-CZ3 4.14Å; F174-F199 AromaticContact CD2-CE2 3.89Å; F174-F199 HydrophobicContact CD2-CE2 3.89Å; F174-F199 HydrophobicContact CD2-CZ 4.17Å; F174-F199 AromaticContact CE2-CE2 3.65Å; F174-F199 HydrophobicContact CE2-CE2 3.65Å; F174-F199 AromaticContact CE2-CZ 3.69Å; F174-F199 HydrophobicContact CE2-CZ 3.69Å; F174-F199 HydrophobicContact CZ-CE2 4.46Å
175	A	97.3	Very high	93.2	Very high	0 Å²	0	66.9 Å²	66.9	0%	0	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	121.9	173.8	0	0	0	0	0	109.8	K110 H113 D171 D187	K110-A175 WeakPolarHBondContact CE-O 3.45Å; K110-A175 HydrophobicContact CG-CB 4.18Å; K110-A175 VanDerWaalsContact CG-O 3.25Å; K110-A175 WeakPolarHBondContact CG-O 3.3Å; K110-A175 PolarHBondContact NZ-O 3.49Å; H113-A175 HydrophobicContact CB-CB 4.06Å; D171-A175 WeakPolarHBondContact O-CB 3.48Å; D171-A175 PolarHBondContact O-N 3.42Å; A175-D187 WeakPolarHBondContact CA-O 3.21Å
176	S	97.3	Very high	93.2	Very high	37 Å²	37	63 Å²	63	26%	0.259	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-146.8	169	176.4	57.7	0	0	0	0	111.8	N106 C109 F174 D187 F189	N106-S176 VanDerWaalsContact OD1-CA 3.31Å; N106-S176 WeakPolarHBondContact OD1-CA 3.48Å; C109-S176 PolarHBondContact SG-O 3.27Å; F174-S176 PolarHBondContact O-N 3.46Å; S176-D187 PolarHBondContact N-O 3.31Å; S176-D187 PolarHBondContact O-N 3.36Å; S176-D187 VanDerWaalsContact O-N 3.17Å; S176-D187 VanDerWaalsContact O-O 3.11Å; S176-F189 WeakPolarHBondContact O-CE2 3.11Å; S176-F189 WeakPolarHBondContact OG-CD2 3.39Å
177	V	97.1	Very high	93	Very high	42 Å²	42	60.9 Å²	60.9	26%	0.255	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	126.6	173.2	-178.2	0	0	0	0	108.7	W102 N106 C109 F184 I185	W102-V177 HydrophobicContact CG-CG2 4.35Å; N106-V177 HydrophobicContact CB-CG2 4.48Å; N106-V177 PolarHBondContact OD1-N 3.02Å; C109-V177 HydrophobicContact CB-CG2 3.8Å; V177-F184 HydrophobicContact CG1-CB 3.78Å; V177-F184 HydrophobicContact CG1-CD1 4.01Å; V177-F184 HydrophobicContact CG1-CG 4.27Å; V177-I185 WeakPolarHBondContact CA-O 3.45Å
178	S	93.2	Very high	92.9	Very high	47 Å²	47	60.9 Å²	60.9	33%	0.329	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	149.9	172.4	-168.8	0	0	0	0	110.4	F184 I185	S178-F184 WeakPolarHBondContact O-CA 3.43Å; S178-I185 PolarHBondContact N-O 3.49Å; S178-I185 PolarHBondContact O-N 3.15Å
179	E	92.6	Very high	92.8	Very high	132 Å²	132	64.4 Å²	64.4	62%	0.617	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.6	128.8	170	-170.6	172.4	-176.8	0	0	109.1	R183 F184	E179-R183 WeakPolarHBondContact CA-O 3.31Å; E179-F184 HydrophobicContact CB-CD1 4.26Å; E179-F184 HydrophobicContact CB-CE1 4.16Å; E179-F184 HydrophobicContact CG-CE1 4.36Å
180	A	84.6	Confident	92.6	Very high	38 Å²	38	62.5 Å²	62.5	31%	0.314	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.2	133.7	175.2	0	0	0	0	0	108.1	D182 R183 I185	A180-D182 PolarHBondContact O-N 3.09Å; A180-R183 PolarHBondContact N-O 3.19Å; A180-R183 WeakPolarHBondContact O-CG 3.25Å; A180-R183 PolarHBondContact O-N 2.92Å; A180-I185 HydrophobicContact CB-CD1 3.91Å
181	D	81.9	Confident	92.5	Very high	156 Å²	156	65.8 Å²	65.8	83%	0.834	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.8	50.5	177.2	-54.7	-37.6	0	0	0	114.6	R183	D181-R183 PolarHBondContact O-N 3.04Å; D181-R183 VanDerWaalsContact O-N 3.11Å
182	D	85.9	Confident	92.3	Very high	156 Å²	156	69.4 Å²	69.4	83%	0.834	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.9	19	-178.7	-59	-40.4	0	0	0	115.2	A180	A180-D182 PolarHBondContact O-N 3.09Å
183	R	87.1	Confident	91.8	Very high	33 Å²	33	68.8 Å²	68.8	13%	0.125	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	148.9	174.7	56.8	-176.3	-66.5	-148	4.7	112	E32 E179 A180 D181 I185	E32-R183 VanDerWaalsContact CD-NH1 3.31Å; E32-R183 IonicContact OE1-CZ 2.72Å; E32-R183 IonicContact OE1-NH1 2.75Å; E32-R183 PolarHBondContact OE1-NH1 2.95Å; E32-R183 IonicContact OE2-NH1 3.87Å; E32-R183 PolarHBondContact OE2-NH1 3.46Å; E179-R183 WeakPolarHBondContact CA-O 3.31Å; A180-R183 PolarHBondContact N-O 3.19Å; A180-R183 WeakPolarHBondContact O-CG 3.25Å; A180-R183 PolarHBondContact O-N 2.92Å; D181-R183 PolarHBondContact O-N 3.04Å; D181-R183 VanDerWaalsContact O-N 3.11Å; R183-I185 HydrophobicContact CG-CD1 4.32Å; R183-I185 HydrophobicContact CG-CG1 4.09Å
184	F	93.3	Very high	91.5	Very high	92 Å²	92	69.5 Å²	69.5	40%	0.404	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	126.9	166.3	-60.9	-74.9	0	0	0	108.9	N101 W102 V177 S178 E179	N101-F184 VanDerWaalsContact OD1-CA 3.27Å; N101-F184 WeakPolarHBondContact OD1-CA 3.27Å; N101-F184 WeakPolarHBondContact OD1-CB 3.46Å; N101-F184 PolarHBondContact OD1-N 2.85Å; N101-F184 PolarHBondContact OD1-O 3.39Å; W102-F184 HydrophobicContact CB-CB 4.16Å; W102-F184 VanDerWaalsContact CB-O 3.29Å; W102-F184 WeakPolarHBondContact CB-O 3.45Å; W102-F184 PolarHBondContact N-O 3.3Å; V177-F184 HydrophobicContact CG1-CB 3.78Å; V177-F184 HydrophobicContact CG1-CD1 4.01Å; V177-F184 HydrophobicContact CG1-CG 4.27Å; S178-F184 WeakPolarHBondContact O-CA 3.43Å; E179-F184 HydrophobicContact CB-CD1 4.26Å; E179-F184 HydrophobicContact CB-CE1 4.16Å; E179-F184 HydrophobicContact CG-CE1 4.36Å
185	I	89.5	Confident	91.3	Very high	40 Å²	40	72.7 Å²	72.7	21%	0.205	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131	178.3	-55.5	-179.9	0	0	0	107.7	V177 S178 A180 R183 D187	V177-I185 WeakPolarHBondContact CA-O 3.45Å; S178-I185 PolarHBondContact N-O 3.49Å; S178-I185 PolarHBondContact O-N 3.15Å; A180-I185 HydrophobicContact CB-CD1 3.91Å; R183-I185 HydrophobicContact CG-CD1 4.32Å; R183-I185 HydrophobicContact CG-CG1 4.09Å; I185-D187 HydrophobicContact CG2-CB 4.25Å
186	C	94.9	Very high	90.9	Very high	11 Å²	11	74.3 Å²	74.3	7%	0.074	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.2	109.3	169.8	168.9	0	0	0	0	109.5	W102 C109 H113	W102-C186 HydrophobicContact CB-CB 4.28Å; W102-C186 HydrophobicContact CD2-CB 3.35Å; W102-C186 HydrophobicContact CE3-CB 3.53Å; W102-C186 HydrophobicContact CG-CB 3.66Å; W102-C186 HydrophobicContact CH2-CB 4.5Å; W102-C186 HydrophobicContact CZ2-CB 4.35Å; W102-C186 HydrophobicContact CZ3-CB 4.11Å; C109-C186 WeakPolarHBondContact CA-SG 3.34Å; C109-C186 HydrophobicContact CB-CB 3.88Å; C109-C186 WeakPolarHBondContact CB-SG 3.41Å; C109-C186 VanDerWaalsContact SG-CA 3.53Å; C109-C186 WeakPolarHBondContact SG-CB 3.27Å; C109-C186 CovalentContact SG-SG 2.03Å; C109-C186 PolarHBondContact SG-SG 3.37Å; H113-C186 PolarHBondContact CE1-SG 3.44Å
187	D	93.1	Very high	90.6	Very high	62 Å²	62	73.6 Å²	73.6	33%	0.332	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	174.4	-178.9	-152.6	-14.1	0	0	0	111	A175 S176 I185 F189	A175-D187 WeakPolarHBondContact CA-O 3.21Å; S176-D187 PolarHBondContact N-O 3.31Å; S176-D187 PolarHBondContact O-N 3.36Å; S176-D187 VanDerWaalsContact O-N 3.17Å; S176-D187 VanDerWaalsContact O-O 3.11Å; I185-D187 HydrophobicContact CG2-CB 4.25Å; D187-F189 HydrophobicContact CB-CE2 3.94Å; D187-F189 HydrophobicContact CB-CZ 4.1Å; D187-F189 VanDerWaalsContact O-CD2 3.26Å; D187-F189 WeakPolarHBondContact O-CD2 3.26Å; D187-F189 WeakPolarHBondContact O-CE2 3.23Å
188	R	93.9	Very high	90.4	Very high	47 Å²	47	75 Å²	75	18%	0.177	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.1	109	175.7	-62.3	163.1	174.7	139.3	-5.9	109.5	D171 Y190	D171-R188 IonicContact OD1-CZ 3.84Å; D171-R188 IonicContact OD1-NE 2.75Å; D171-R188 PolarHBondContact OD1-NE 3.39Å; D171-R188 IonicContact OD1-NH2 3.29Å; D171-R188 PolarHBondContact OD1-NH2 3.19Å; R188-Y190 HydrophobicContact CB-CE1 4.44Å; R188-Y190 HydrophobicContact CB-CE2 3.82Å; R188-Y190 WeakPolarHBondContact CD-OH 3.45Å
189	F	93.3	Very high	90.4	Very high	85 Å²	85	73.4 Å²	73.4	37%	0.373	38%	0.377	S	S	.	.			trans	-97.8	114.4	179.6	-64.7	-88.6	0	0	0	110	F174 S176 D187	F174-F189 WeakPolarHBondContact CD1-O 3.26Å; F174-F189 PolarHBondContact O-N 3.28Å; S176-F189 WeakPolarHBondContact O-CE2 3.11Å; S176-F189 WeakPolarHBondContact OG-CD2 3.39Å; D187-F189 HydrophobicContact CB-CE2 3.94Å; D187-F189 HydrophobicContact CB-CZ 4.1Å; D187-F189 VanDerWaalsContact O-CD2 3.26Å; D187-F189 WeakPolarHBondContact O-CD2 3.26Å; D187-F189 WeakPolarHBondContact O-CE2 3.23Å
190	Y	93	Very high	90.3	Very high	51 Å²	51	68.5 Å²	68.5	20%	0.2	35%	0.354	C	S	.	.			trans	-104.6	154.4	-179.1	-58.5	-67.8	0	0	0	112.4	F174 R188 N192 W195 V196 F199	F174-Y190 HydrophobicContact CB-CD1 3.93Å; F174-Y190 HydrophobicContact CB-CE1 3.74Å; F174-Y190 AromaticContact CD1-CD1 3.92Å; F174-Y190 HydrophobicContact CD1-CD1 3.92Å; F174-Y190 HydrophobicContact CD1-CE1 4.44Å; F174-Y190 AromaticContact CD2-CD1 3.87Å; F174-Y190 HydrophobicContact CD2-CD1 3.87Å; F174-Y190 AromaticContact CD2-CE1 3.67Å; F174-Y190 HydrophobicContact CD2-CE1 3.67Å; F174-Y190 HydrophobicContact CE1-CD1 4.39Å; F174-Y190 HydrophobicContact CE2-CD1 4.36Å; F174-Y190 HydrophobicContact CE2-CE1 4.4Å; F174-Y190 AromaticContact CG-CD1 3.63Å; F174-Y190 HydrophobicContact CG-CD1 3.63Å; F174-Y190 AromaticContact CG-CE1 3.7Å; F174-Y190 HydrophobicContact CG-CE1 3.7Å; R188-Y190 HydrophobicContact CB-CE1 4.44Å; R188-Y190 HydrophobicContact CB-CE2 3.82Å; R188-Y190 WeakPolarHBondContact CD-OH 3.45Å; Y190-N192 VanDerWaalsContact C-N 3.3Å; Y190-N192 PolarHBondContact O-N 3.19Å; Y190-W195 HydrophobicContact CD1-CB 4.01Å; Y190-W195 HydrophobicContact CG-CB 3.92Å; Y190-V196 HydrophobicContact CD2-CB 4.49Å; Y190-V196 HydrophobicContact CD2-CG2 3.6Å; Y190-V196 HydrophobicContact CE2-CG2 4.21Å; Y190-V196 HydrophobicContact CG-CG2 4.43Å; Y190-F199 AromaticContact CD1-CD2 3.8Å; Y190-F199 HydrophobicContact CD1-CD2 3.8Å; Y190-F199 AromaticContact CD1-CE2 3.74Å; Y190-F199 HydrophobicContact CD1-CE2 3.74Å; Y190-F199 AromaticContact CE1-CD2 3.15Å; Y190-F199 HydrophobicContact CE1-CD2 3.15Å; Y190-F199 AromaticContact CE1-CE2 3.33Å; Y190-F199 HydrophobicContact CE1-CE2 3.33Å; Y190-F199 HydrophobicContact CE1-CG 4.23Å; Y190-F199 HydrophobicContact CE2-CD2 4.47Å; Y190-F199 AromaticContact CZ-CD2 3.52Å
191	P	91.1	Very high	90.6	Very high	92 Å²	92	72.4 Å²	72.4	60%	0.597	36%	0.364	S	S	*	.	S	Bend	trans	-63.7	-28.8	179.7	-24.4	33.8	0	0	0	115.3	F174	F174-P191 HydrophobicContact CE1-CG 4.27Å
192	N	90.1	Very high	91.2	Very high	80 Å²	80	67.3 Å²	67.3	43%	0.428	34%	0.335	S	S	.	.	S	Bend	trans	-161.5	167.9	179.4	60.2	52.8	0	0	0	110.5	Y190 L194 W195	Y190-N192 VanDerWaalsContact C-N 3.3Å; Y190-N192 PolarHBondContact O-N 3.19Å; N192-L194 PolarHBondContact O-N 2.97Å; N192-L194 VanDerWaalsContact OD1-CB 3.29Å; N192-L194 WeakPolarHBondContact OD1-CB 3.43Å; N192-L194 PolarHBondContact OD1-N 2.91Å; N192-W195 WeakPolarHBondContact O-CB 3.34Å; N192-W195 PolarHBondContact O-N 2.88Å; N192-W195 VanDerWaalsContact O-N 3.16Å; N192-W195 PolarHBondContact OD1-N 3.35Å
193	D	86.3	Confident	91.4	Very high	110 Å²	110	60.6 Å²	60.6	59%	0.588	30%	0.299	S	S	*	.	H	α-helix	trans	-64.5	-24.6	-175.4	-56.2	-34.9	0	0	0	113.7	W195 V196 V197	D193-W195 VanDerWaalsContact C-N 3.27Å; D193-W195 PolarHBondContact O-N 3.47Å; D193-V196 VanDerWaalsContact O-CB 3.3Å; D193-V196 WeakPolarHBondContact O-CB 3.39Å; D193-V196 PolarHBondContact O-N 3.29Å; D193-V196 VanDerWaalsContact O-N 3.12Å; D193-V197 PolarHBondContact O-N 3.4Å
194	L	88.8	Confident	91.7	Very high	115 Å²	115	60 Å²	60	60%	0.602	30%	0.298	S	S	*	.	H	α-helix	trans	-62.3	-37.1	176.6	-178.9	65.8	0	0	0	111.4	N192 V196 V197 V198	N192-L194 PolarHBondContact O-N 2.97Å; N192-L194 VanDerWaalsContact OD1-CB 3.29Å; N192-L194 WeakPolarHBondContact OD1-CB 3.43Å; N192-L194 PolarHBondContact OD1-N 2.91Å; L194-V196 VanDerWaalsContact C-N 3.29Å; L194-V196 PolarHBondContact O-N 2.93Å; L194-V197 PolarHBondContact O-N 2.99Å; L194-V198 HydrophobicContact CG-CG2 4.39Å; L194-V198 VanDerWaalsContact O-CG2 3.28Å; L194-V198 WeakPolarHBondContact O-CG2 3.32Å; L194-V198 PolarHBondContact O-N 2.74Å
195	W	92.6	Very high	91.7	Very high	101 Å²	101	57.8 Å²	57.8	38%	0.383	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-36.3	175.7	-73	97.5	0	0	0	112.2	F174 Y190 N192 D193 V198 F199	F174-W195 HydrophobicContact CE2-CE3 4.46Å; F174-W195 HydrophobicContact CE2-CZ3 4.36Å; F174-W195 HydrophobicContact CZ-CE3 4.27Å; F174-W195 HydrophobicContact CZ-CH2 4.44Å; F174-W195 HydrophobicContact CZ-CZ3 4.14Å; Y190-W195 HydrophobicContact CD1-CB 4.01Å; Y190-W195 HydrophobicContact CG-CB 3.92Å; N192-W195 WeakPolarHBondContact O-CB 3.34Å; N192-W195 PolarHBondContact O-N 2.88Å; N192-W195 VanDerWaalsContact O-N 3.16Å; N192-W195 PolarHBondContact OD1-N 3.35Å; D193-W195 VanDerWaalsContact C-N 3.27Å; D193-W195 PolarHBondContact O-N 3.47Å; W195-V198 PolarHBondContact O-N 2.93Å; W195-F199 HydrophobicContact CB-CD2 4.45Å; W195-F199 HydrophobicContact CB-CE2 4.37Å; W195-F199 HydrophobicContact CD2-CE2 4.35Å; W195-F199 HydrophobicContact CE3-CD2 4.35Å; W195-F199 AromaticContact CE3-CE2 3.39Å; W195-F199 HydrophobicContact CE3-CE2 3.39Å; W195-F199 AromaticContact CE3-CZ 3.61Å; W195-F199 HydrophobicContact CE3-CZ 3.61Å; W195-F199 HydrophobicContact CZ3-CE2 4.03Å; W195-F199 AromaticContact CZ3-CZ 3.78Å; W195-F199 HydrophobicContact CZ3-CZ 3.78Å; W195-F199 WeakPolarHBondContact O-CD2 3.47Å; W195-F199 PolarHBondContact O-N 3.4Å
196	V	90.1	Very high	91.9	Very high	33 Å²	33	57 Å²	57	20%	0.2	29%	0.287	C	S	.	.	H	α-helix	trans	-58.3	-52.7	174.8	178	0	0	0	0	109.1	Y190 D193 L194 V198 F199 Q200 L266	Y190-V196 HydrophobicContact CD2-CB 4.49Å; Y190-V196 HydrophobicContact CD2-CG2 3.6Å; Y190-V196 HydrophobicContact CE2-CG2 4.21Å; Y190-V196 HydrophobicContact CG-CG2 4.43Å; D193-V196 VanDerWaalsContact O-CB 3.3Å; D193-V196 WeakPolarHBondContact O-CB 3.39Å; D193-V196 PolarHBondContact O-N 3.29Å; D193-V196 VanDerWaalsContact O-N 3.12Å; L194-V196 VanDerWaalsContact C-N 3.29Å; L194-V196 PolarHBondContact O-N 2.93Å; V196-V198 PolarHBondContact O-N 2.89Å; V196-F199 PolarHBondContact O-N 2.87Å; V196-Q200 HydrophobicContact CG1-CG 4.3Å; V196-Q200 WeakPolarHBondContact O-CB 3.26Å; V196-Q200 VanDerWaalsContact O-CG 3.26Å; V196-Q200 WeakPolarHBondContact O-CG 3.41Å; V196-Q200 PolarHBondContact O-N 2.88Å; V196-L266 HydrophobicContact CB-CD1 4.31Å; V196-L266 HydrophobicContact CG1-CD1 3.75Å
197	V	90.3	Very high	91.6	Very high	22 Å²	22	56.5 Å²	56.5	13%	0.133	28%	0.283	C	S	.	.	H	α-helix	trans	-60.8	-43.6	179.4	179.3	0	0	0	0	111.6	D193 L194 F199 Q200 F201 L266 L267	D193-V197 PolarHBondContact O-N 3.4Å; L194-V197 PolarHBondContact O-N 2.99Å; V197-F199 PolarHBondContact O-N 3.39Å; V197-Q200 PolarHBondContact O-N 3.4Å; V197-F201 VanDerWaalsContact O-CB 3.28Å; V197-F201 WeakPolarHBondContact O-CB 3.32Å; V197-F201 PolarHBondContact O-N 3.42Å; V197-L266 HydrophobicContact CG2-CB 4.13Å; V197-L266 HydrophobicContact CG2-CD1 4.26Å; V197-L267 HydrophobicContact CG1-CD1 4.13Å; V197-L267 HydrophobicContact CG1-CD2 4.23Å; V197-L267 HydrophobicContact CG1-CG 4.3Å; V197-L267 HydrophobicContact CG2-CD2 4.24Å; V197-L267 HydrophobicContact CG2-CG 4.27Å
198	V	92.5	Very high	91.5	Very high	72 Å²	72	55.6 Å²	55.6	44%	0.436	28%	0.278	S	S	.	.	H	α-helix	trans	-60.4	-47.8	179.5	167.4	0	0	0	0	111.4	L194 W195 V196 F201 Q202	L194-V198 HydrophobicContact CG-CG2 4.39Å; L194-V198 VanDerWaalsContact O-CG2 3.28Å; L194-V198 WeakPolarHBondContact O-CG2 3.32Å; L194-V198 PolarHBondContact O-N 2.74Å; W195-V198 PolarHBondContact O-N 2.93Å; V196-V198 PolarHBondContact O-N 2.89Å; V198-F201 PolarHBondContact O-N 3.12Å; V198-Q202 PolarHBondContact O-N 2.98Å
199	F	92.9	Very high	91.4	Very high	14 Å²	14	56.5 Å²	56.5	6%	0.061	29%	0.286	C	S	.	.	H	α-helix	trans	-74.7	-32.5	-179.4	-68.8	-54.9	0	0	0	112.9	P170 F174 Y190 W195 V196 V197 Q202 H203	P170-F199 HydrophobicContact CB-CD1 4.07Å; P170-F199 HydrophobicContact CB-CE1 3.47Å; P170-F199 VanDerWaalsContact CB-CE1 3.47Å; P170-F199 HydrophobicContact CB-CE2 4.36Å; P170-F199 HydrophobicContact CB-CZ 3.64Å; P170-F199 HydrophobicContact CG-CD1 4.24Å; P170-F199 HydrophobicContact CG-CE1 3.51Å; P170-F199 HydrophobicContact CG-CZ 4.05Å; F174-F199 AromaticContact CD2-CE2 3.89Å; F174-F199 HydrophobicContact CD2-CE2 3.89Å; F174-F199 HydrophobicContact CD2-CZ 4.17Å; F174-F199 AromaticContact CE2-CE2 3.65Å; F174-F199 HydrophobicContact CE2-CE2 3.65Å; F174-F199 AromaticContact CE2-CZ 3.69Å; F174-F199 HydrophobicContact CE2-CZ 3.69Å; F174-F199 HydrophobicContact CZ-CE2 4.46Å; Y190-F199 AromaticContact CD1-CD2 3.8Å; Y190-F199 HydrophobicContact CD1-CD2 3.8Å; Y190-F199 AromaticContact CD1-CE2 3.74Å; Y190-F199 HydrophobicContact CD1-CE2 3.74Å; Y190-F199 AromaticContact CE1-CD2 3.15Å; Y190-F199 HydrophobicContact CE1-CD2 3.15Å; Y190-F199 AromaticContact CE1-CE2 3.33Å; Y190-F199 HydrophobicContact CE1-CE2 3.33Å; Y190-F199 HydrophobicContact CE1-CG 4.23Å; Y190-F199 HydrophobicContact CE2-CD2 4.47Å; Y190-F199 AromaticContact CZ-CD2 3.52Å; W195-F199 HydrophobicContact CB-CD2 4.45Å; W195-F199 HydrophobicContact CB-CE2 4.37Å; W195-F199 HydrophobicContact CD2-CE2 4.35Å; W195-F199 HydrophobicContact CE3-CD2 4.35Å; W195-F199 AromaticContact CE3-CE2 3.39Å; W195-F199 HydrophobicContact CE3-CE2 3.39Å; W195-F199 AromaticContact CE3-CZ 3.61Å; W195-F199 HydrophobicContact CE3-CZ 3.61Å; W195-F199 HydrophobicContact CZ3-CE2 4.03Å; W195-F199 AromaticContact CZ3-CZ 3.78Å; W195-F199 HydrophobicContact CZ3-CZ 3.78Å; W195-F199 WeakPolarHBondContact O-CD2 3.47Å; W195-F199 PolarHBondContact O-N 3.4Å; V196-F199 PolarHBondContact O-N 2.87Å; V197-F199 PolarHBondContact O-N 3.39Å; F199-Q202 PolarHBondContact O-N 3.28Å; F199-H203 WeakPolarHBondContact O-CB 3.04Å; F199-H203 PolarHBondContact O-N 3.18Å; F199-H203 PolarHBondContact O-ND1 2.93Å
200	Q	91.8	Very high	91.5	Very high	28 Å²	28	57.3 Å²	57.3	13%	0.131	29%	0.293	C	S	.	.	H	α-helix	trans	-62.2	-45.4	170.1	-73.8	-170.3	31.3	0	0	110.7	V196 V197 Q202 H203 I204 I259 D262 S263	V196-Q200 HydrophobicContact CG1-CG 4.3Å; V196-Q200 WeakPolarHBondContact O-CB 3.26Å; V196-Q200 VanDerWaalsContact O-CG 3.26Å; V196-Q200 WeakPolarHBondContact O-CG 3.41Å; V196-Q200 PolarHBondContact O-N 2.88Å; V197-Q200 PolarHBondContact O-N 3.4Å; Q200-Q202 PolarHBondContact O-N 3.48Å; Q200-H203 WeakPolarHBondContact O-CB 3.38Å; Q200-H203 PolarHBondContact O-N 2.9Å; Q200-H203 VanDerWaalsContact O-N 3.15Å; Q200-I204 WeakPolarHBondContact O-CG1 3.12Å; Q200-I204 PolarHBondContact O-N 3.34Å; Q200-I259 PolarHBondContact OE1-O 3.44Å; Q200-D262 PolarHBondContact NE2-OD2 2.97Å; Q200-S263 PolarHBondContact OE1-OG 3.41Å
201	F	91.2	Very high	91.5	Very high	120 Å²	120	55 Å²	55	53%	0.526	28%	0.284	S	S	.	.	H	α-helix	trans	-60.9	-43.9	175.8	-176	-100	0	0	0	111.9	V197 V198 H203 I204 M205	V197-F201 VanDerWaalsContact O-CB 3.28Å; V197-F201 WeakPolarHBondContact O-CB 3.32Å; V197-F201 PolarHBondContact O-N 3.42Å; V198-F201 PolarHBondContact O-N 3.12Å; F201-H203 VanDerWaalsContact C-N 3.33Å; F201-H203 PolarHBondContact O-N 2.93Å; F201-I204 PolarHBondContact O-N 2.97Å; F201-M205 HydrophobicContact CD1-CG 3.93Å; F201-M205 HydrophobicContact CD2-CE 4Å; F201-M205 HydrophobicContact CE1-CE 4.24Å; F201-M205 HydrophobicContact CE1-CG 3.55Å; F201-M205 HydrophobicContact CE1-SD 4.2Å; F201-M205 HydrophobicContact CE2-CE 3.38Å; F201-M205 HydrophobicContact CE2-CG 4.34Å; F201-M205 HydrophobicContact CE2-SD 4.33Å; F201-M205 HydrophobicContact CG-CG 4.46Å; F201-M205 HydrophobicContact CZ-CE 3.51Å; F201-M205 HydrophobicContact CZ-CG 3.79Å; F201-M205 HydrophobicContact CZ-SD 3.83Å; F201-M205 WeakPolarHBondContact O-CG 3.41Å; F201-M205 PolarHBondContact O-N 3.27Å
202	Q	93.4	Very high	91.6	Very high	49 Å²	49	51 Å²	51	23%	0.229	26%	0.26	C	S	.	.	H	α-helix	trans	-57.2	-46.2	173	-176.1	-173.9	-79.5	0	0	111.5	V198 F199 Q200 I204 M205 V206	V198-Q202 PolarHBondContact O-N 2.98Å; F199-Q202 PolarHBondContact O-N 3.28Å; Q200-Q202 PolarHBondContact O-N 3.48Å; Q202-I204 VanDerWaalsContact C-N 3.33Å; Q202-I204 PolarHBondContact O-N 3.02Å; Q202-M205 PolarHBondContact O-N 3.29Å; Q202-V206 HydrophobicContact CG-CG2 4.28Å; Q202-V206 WeakPolarHBondContact O-CB 3.39Å; Q202-V206 WeakPolarHBondContact O-CG2 3.4Å; Q202-V206 PolarHBondContact O-N 3.47Å
203	H	90.9	Very high	91.8	Very high	15 Å²	15	51.6 Å²	51.6	7%	0.069	26%	0.262	C	S	.	.	H	α-helix	trans	-58.7	-43.3	177.2	-84	95.1	0	0	0	112.1	Y121 F199 Q200 F201 G207	Y121-H203 AromaticContact CE1-CD2 4Å; Y121-H203 AromaticContact CZ-CD2 3.92Å; Y121-H203 PolarHBondContact OH-CD2 3.34Å; Y121-H203 VanDerWaalsContact OH-CD2 3.3Å; Y121-H203 PolarHBondContact OH-NE2 2.89Å; F199-H203 WeakPolarHBondContact O-CB 3.04Å; F199-H203 PolarHBondContact O-N 3.18Å; F199-H203 PolarHBondContact O-ND1 2.93Å; Q200-H203 WeakPolarHBondContact O-CB 3.38Å; Q200-H203 PolarHBondContact O-N 2.9Å; Q200-H203 VanDerWaalsContact O-N 3.15Å; F201-H203 VanDerWaalsContact C-N 3.33Å; F201-H203 PolarHBondContact O-N 2.93Å; H203-G207 WeakPolarHBondContact O-CA 3.35Å; H203-G207 PolarHBondContact O-N 3.38Å
204	I	92.1	Very high	92.2	Very high	21 Å²	21	49.2 Å²	49.2	11%	0.108	25%	0.252	C	S	.	.	H	α-helix	trans	-66.8	-44.7	176.8	-64	166	0	0	0	110.8	Q200 F201 Q202 L208 I209 Y256 I259	Q200-I204 WeakPolarHBondContact O-CG1 3.12Å; Q200-I204 PolarHBondContact O-N 3.34Å; F201-I204 PolarHBondContact O-N 2.97Å; Q202-I204 VanDerWaalsContact C-N 3.33Å; Q202-I204 PolarHBondContact O-N 3.02Å; I204-L208 WeakPolarHBondContact O-CA 3.44Å; I204-L208 VanDerWaalsContact O-CB 3.28Å; I204-L208 WeakPolarHBondContact O-CB 3.26Å; I204-L208 PolarHBondContact O-N 3.33Å; I204-I209 HydrophobicContact CG2-CD1 4.19Å; I204-I209 HydrophobicContact CG2-CG1 4.1Å; I204-I209 PolarHBondContact O-N 3.47Å; I204-Y256 HydrophobicContact CG1-CD1 4.27Å; I204-I259 HydrophobicContact CD1-CD1 4.15Å; I204-I259 HydrophobicContact CD1-CG1 4.15Å; I204-I259 HydrophobicContact CG1-CD1 3.8Å; I204-I259 HydrophobicContact CG1-CG1 4.32Å
205	M	93.3	Very high	92.4	Very high	46 Å²	46	44 Å²	44	23%	0.227	22%	0.224	C	C	.	.	I	π-helix	trans	-62.2	-50.2	-179	-72.4	-56.9	117.8	0	0	112.1	F201 Q202 I209 L210	F201-M205 HydrophobicContact CD1-CG 3.93Å; F201-M205 HydrophobicContact CD2-CE 4Å; F201-M205 HydrophobicContact CE1-CE 4.24Å; F201-M205 HydrophobicContact CE1-CG 3.55Å; F201-M205 HydrophobicContact CE1-SD 4.2Å; F201-M205 HydrophobicContact CE2-CE 3.38Å; F201-M205 HydrophobicContact CE2-CG 4.34Å; F201-M205 HydrophobicContact CE2-SD 4.33Å; F201-M205 HydrophobicContact CG-CG 4.46Å; F201-M205 HydrophobicContact CZ-CE 3.51Å; F201-M205 HydrophobicContact CZ-CG 3.79Å; F201-M205 HydrophobicContact CZ-SD 3.83Å; F201-M205 WeakPolarHBondContact O-CG 3.41Å; F201-M205 PolarHBondContact O-N 3.27Å; Q202-M205 PolarHBondContact O-N 3.29Å; M205-I209 HydrophobicContact CE-CD1 3.29Å; M205-I209 HydrophobicContact CE-CG1 4.04Å; M205-I209 PolarHBondContact O-N 2.89Å; M205-I209 HydrophobicContact SD-CB 4.24Å; M205-I209 HydrophobicContact SD-CD1 4.03Å; M205-I209 HydrophobicContact SD-CG1 4.42Å; M205-I209 HydrophobicContact SD-CG2 4.48Å; M205-L210 WeakPolarHBondContact O-CB 3.23Å; M205-L210 WeakPolarHBondContact O-CG 3.43Å; M205-L210 PolarHBondContact O-N 3.16Å
206	V	93.7	Very high	92.4	Very high	24 Å²	24	44.6 Å²	44.6	15%	0.145	23%	0.234	C	C	.	.	I	π-helix	trans	-80.8	-37.5	-175.7	-178.7	0	0	0	0	111.5	Y121 L167 Q202 P211	Y121-V206 HydrophobicContact CD1-CB 4.1Å; Y121-V206 HydrophobicContact CD1-CG1 3.57Å; Y121-V206 HydrophobicContact CD2-CG1 4.17Å; Y121-V206 HydrophobicContact CE1-CB 3.85Å; Y121-V206 HydrophobicContact CE1-CG1 3.83Å; Y121-V206 HydrophobicContact CE2-CG1 4.37Å; Y121-V206 HydrophobicContact CG-CG1 3.77Å; L167-V206 HydrophobicContact CD1-CG1 3.88Å; L167-V206 HydrophobicContact CD1-CG2 4.22Å; Q202-V206 HydrophobicContact CG-CG2 4.28Å; Q202-V206 WeakPolarHBondContact O-CB 3.39Å; Q202-V206 WeakPolarHBondContact O-CG2 3.4Å; Q202-V206 PolarHBondContact O-N 3.47Å; V206-P211 VanDerWaalsContact O-CD 3.23Å; V206-P211 WeakPolarHBondContact O-CD 3.28Å; V206-P211 WeakPolarHBondContact O-CG 3.42Å
207	G	90.3	Very high	92.6	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.245	C	C	.	.	I	π-helix	trans	-81.1	-22.5	-176.6	0	0	0	0	0	114.7	H203 Y256	H203-G207 WeakPolarHBondContact O-CA 3.35Å; H203-G207 PolarHBondContact O-N 3.38Å; G207-Y256 WeakPolarHBondContact CA-OH 3.35Å; G207-Y256 PolarHBondContact O-OH 3.38Å
208	L	90	Very high	92.7	Very high	42 Å²	42	45.3 Å²	45.3	22%	0.22	24%	0.242	C	C	.	.	I	π-helix	trans	-131.4	-60.1	-175	-177.4	63.6	0	0	0	113	I204 G212 F249 Y256	I204-L208 WeakPolarHBondContact O-CA 3.44Å; I204-L208 VanDerWaalsContact O-CB 3.28Å; I204-L208 WeakPolarHBondContact O-CB 3.26Å; I204-L208 PolarHBondContact O-N 3.33Å; L208-G212 WeakPolarHBondContact O-CA 3.47Å; L208-G212 PolarHBondContact O-N 3.03Å; L208-F249 HydrophobicContact CD1-CD1 3.47Å; L208-F249 VanDerWaalsContact CD1-CD1 3.47Å; L208-F249 HydrophobicContact CD1-CE1 3.57Å; L208-Y256 HydrophobicContact CB-CD2 4.03Å; L208-Y256 HydrophobicContact CB-CE2 3.69Å; L208-Y256 HydrophobicContact CD1-CD2 3.96Å; L208-Y256 HydrophobicContact CD1-CE2 3.92Å; L208-Y256 HydrophobicContact CD2-CD2 3.68Å; L208-Y256 HydrophobicContact CD2-CE2 4.22Å; L208-Y256 HydrophobicContact CD2-CG 4Å; L208-Y256 HydrophobicContact CG-CD2 4.1Å; L208-Y256 HydrophobicContact CG-CE2 4.15Å
209	I	92.7	Very high	92.5	Very high	66 Å²	66	42.8 Å²	42.8	34%	0.338	23%	0.225	S	C	.	.	I	π-helix	trans	-72.6	-55.6	-163.2	-57.7	-158.5	0	0	0	112.4	I204 M205 G212 I213	I204-I209 HydrophobicContact CG2-CD1 4.19Å; I204-I209 HydrophobicContact CG2-CG1 4.1Å; I204-I209 PolarHBondContact O-N 3.47Å; M205-I209 HydrophobicContact CE-CD1 3.29Å; M205-I209 HydrophobicContact CE-CG1 4.04Å; M205-I209 PolarHBondContact O-N 2.89Å; M205-I209 HydrophobicContact SD-CB 4.24Å; M205-I209 HydrophobicContact SD-CD1 4.03Å; M205-I209 HydrophobicContact SD-CG1 4.42Å; M205-I209 HydrophobicContact SD-CG2 4.48Å; I209-G212 PolarHBondContact O-N 2.85Å; I209-I213 HydrophobicContact CG2-CD1 3.72Å; I209-I213 HydrophobicContact CG2-CG1 4.34Å; I209-I213 VanDerWaalsContact O-CG1 3.31Å; I209-I213 WeakPolarHBondContact O-CG1 3.4Å; I209-I213 PolarHBondContact O-N 3.44Å
210	L	93.9	Very high	92.3	Very high	102 Å²	102	45.8 Å²	45.8	53%	0.534	25%	0.246	S	C	.	.	H	α-helix	trans	-62.1	-49.6	-176.4	-65.2	173	0	0	0	112.2	M205 G212 I213 V214	M205-L210 WeakPolarHBondContact O-CB 3.23Å; M205-L210 WeakPolarHBondContact O-CG 3.43Å; M205-L210 PolarHBondContact O-N 3.16Å; L210-G212 VanDerWaalsContact C-N 3.3Å; L210-G212 PolarHBondContact O-N 2.83Å; L210-I213 PolarHBondContact O-N 3.35Å; L210-V214 WeakPolarHBondContact O-CG2 3.42Å; L210-V214 PolarHBondContact O-N 3.17Å
211	P	93.1	Very high	92.3	Very high	2 Å²	2	48.3 Å²	48.3	1%	0.013	26%	0.26	C	S	.	.	H	α-helix	trans	-64	-37.6	174.9	-17.3	30.7	0	0	0	111.9	V124 L125 A128 V206 V214 I215	V124-P211 HydrophobicContact CB-CB 4.44Å; V124-P211 HydrophobicContact CB-CG 4.35Å; V124-P211 HydrophobicContact CG1-CB 4.27Å; V124-P211 HydrophobicContact CG1-CG 3.69Å; V124-P211 HydrophobicContact CG2-CB 3.53Å; V124-P211 HydrophobicContact CG2-CG 3.78Å; L125-P211 HydrophobicContact CD2-CG 4.2Å; A128-P211 HydrophobicContact CB-CB 4.31Å; V206-P211 VanDerWaalsContact O-CD 3.23Å; V206-P211 WeakPolarHBondContact O-CD 3.28Å; V206-P211 WeakPolarHBondContact O-CG 3.42Å; P211-V214 PolarHBondContact O-N 3.5Å; P211-I215 WeakPolarHBondContact O-CB 3.15Å; P211-I215 WeakPolarHBondContact O-CD1 3.4Å; P211-I215 WeakPolarHBondContact O-CG1 3.32Å; P211-I215 PolarHBondContact O-N 3.26Å
212	G	93.1	Very high	92.1	Very high	9 Å²	9	42.6 Å²	42.6	9%	0.093	24%	0.235	C	C	.	.	H	α-helix	trans	-58	-47.5	176.8	0	0	0	0	0	112.3	L208 I209 L210 V214 I215 L216	L208-G212 WeakPolarHBondContact O-CA 3.47Å; L208-G212 PolarHBondContact O-N 3.03Å; I209-G212 PolarHBondContact O-N 2.85Å; L210-G212 VanDerWaalsContact C-N 3.3Å; L210-G212 PolarHBondContact O-N 2.83Å; G212-V214 PolarHBondContact O-N 2.81Å; G212-I215 PolarHBondContact O-N 3.39Å; G212-L216 VanDerWaalsContact O-CB 3.3Å; G212-L216 WeakPolarHBondContact O-CB 3.43Å; G212-L216 WeakPolarHBondContact O-CG 3.34Å; G212-L216 PolarHBondContact O-N 2.87Å
213	I	94.7	Very high	91.7	Very high	92 Å²	92	45 Å²	45	47%	0.472	25%	0.248	S	C	.	.	H	α-helix	trans	-59.7	-45.6	176.5	-69.3	166.1	0	0	0	110.8	I209 L210 S217	I209-I213 HydrophobicContact CG2-CD1 3.72Å; I209-I213 HydrophobicContact CG2-CG1 4.34Å; I209-I213 VanDerWaalsContact O-CG1 3.31Å; I209-I213 WeakPolarHBondContact O-CG1 3.4Å; I209-I213 PolarHBondContact O-N 3.44Å; L210-I213 PolarHBondContact O-N 3.35Å; I213-S217 VanDerWaalsContact O-CB 3.22Å; I213-S217 WeakPolarHBondContact O-CB 3.39Å; I213-S217 PolarHBondContact O-N 2.9Å; I213-S217 PolarHBondContact O-OG 3.11Å
214	V	94.8	Very high	91.5	Very high	61 Å²	61	48 Å²	48	37%	0.37	27%	0.271	S	S	.	.	H	α-helix	trans	-62.1	-46.9	179	173.1	0	0	0	0	110.8	A128 L210 P211 G212 C218	A128-V214 HydrophobicContact CB-CB 4.35Å; A128-V214 HydrophobicContact CB-CG1 4.07Å; L210-V214 WeakPolarHBondContact O-CG2 3.42Å; L210-V214 PolarHBondContact O-N 3.17Å; P211-V214 PolarHBondContact O-N 3.5Å; G212-V214 PolarHBondContact O-N 2.81Å; V214-C218 WeakPolarHBondContact O-CB 3.46Å; V214-C218 PolarHBondContact O-N 3.45Å; V214-C218 PolarHBondContact O-SG 3.21Å
215	I	93.6	Very high	91	Very high	4 Å²	4	52.9 Å²	52.9	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-60.9	-55.4	179.2	-72.5	168.6	0	0	0	110.1	L127 A128 P211 G212 S217 C218 Y219 I245 F249	L127-I215 HydrophobicContact CB-CD1 4.11Å; A128-I215 HydrophobicContact CB-CD1 4.45Å; A128-I215 HydrophobicContact CB-CG1 4.14Å; P211-I215 WeakPolarHBondContact O-CB 3.15Å; P211-I215 WeakPolarHBondContact O-CD1 3.4Å; P211-I215 WeakPolarHBondContact O-CG1 3.32Å; P211-I215 PolarHBondContact O-N 3.26Å; G212-I215 PolarHBondContact O-N 3.39Å; I215-S217 VanDerWaalsContact C-N 3.35Å; I215-S217 PolarHBondContact O-N 3.06Å; I215-C218 WeakPolarHBondContact O-CB 2.73Å; I215-C218 PolarHBondContact O-N 3.39Å; I215-C218 VanDerWaalsContact O-N 3.17Å; I215-Y219 HydrophobicContact CG2-CD2 3.84Å; I215-Y219 HydrophobicContact CG2-CE2 4.02Å; I215-Y219 VanDerWaalsContact O-CD2 3.24Å; I215-Y219 WeakPolarHBondContact O-CD2 3.45Å; I215-Y219 PolarHBondContact O-N 3.37Å; I215-I245 HydrophobicContact CG2-CD1 3.9Å; I215-I245 HydrophobicContact CG2-CG2 3.69Å; I215-F249 HydrophobicContact CD1-CE2 3.89Å; I215-F249 HydrophobicContact CD1-CZ 3.9Å
216	L	91.9	Very high	90.3	Very high	114 Å²	114	51.2 Å²	51.2	60%	0.597	28%	0.284	S	S	*	.	H	α-helix	trans	-56.3	-50	-179.2	-72.4	170.8	0	0	0	110.7	G212 C218 Y219 C220	G212-L216 VanDerWaalsContact O-CB 3.3Å; G212-L216 WeakPolarHBondContact O-CB 3.43Å; G212-L216 WeakPolarHBondContact O-CG 3.34Å; G212-L216 PolarHBondContact O-N 2.87Å; L216-C218 VanDerWaalsContact C-N 3.32Å; L216-C218 PolarHBondContact O-N 2.82Å; L216-Y219 PolarHBondContact O-N 3.32Å; L216-Y219 VanDerWaalsContact O-N 3.15Å; L216-C220 WeakPolarHBondContact O-CB 3.4Å; L216-C220 PolarHBondContact O-N 3.13Å; L216-C220 PolarHBondContact O-SG 3.42Å
217	S	93.6	Very high	89.4	Confident	61 Å²	61	54 Å²	54	43%	0.427	30%	0.304	S	S	.	.	H	α-helix	trans	-56.5	-45.8	177.9	-57.8	0	0	0	0	112	I213 I215 Y219 I221	I213-S217 VanDerWaalsContact O-CB 3.22Å; I213-S217 WeakPolarHBondContact O-CB 3.39Å; I213-S217 PolarHBondContact O-N 2.9Å; I213-S217 PolarHBondContact O-OG 3.11Å; I215-S217 VanDerWaalsContact C-N 3.35Å; I215-S217 PolarHBondContact O-N 3.06Å; S217-Y219 PolarHBondContact O-N 3.08Å; S217-I221 WeakPolarHBondContact O-CD1 3.48Å; S217-I221 VanDerWaalsContact O-CG1 3.31Å; S217-I221 WeakPolarHBondContact O-CG1 3.4Å; S217-I221 PolarHBondContact O-N 2.65Å
218	C	93	Very high	88.5	Confident	9 Å²	9	62.1 Å²	62.1	6%	0.061	34%	0.342	C	S	.	.	H	α-helix	trans	-59.7	-48.3	176.7	-72.5	0	0	0	0	111.8	V214 I215 L216 I221 I222	V214-C218 WeakPolarHBondContact O-CB 3.46Å; V214-C218 PolarHBondContact O-N 3.45Å; V214-C218 PolarHBondContact O-SG 3.21Å; I215-C218 WeakPolarHBondContact O-CB 2.73Å; I215-C218 PolarHBondContact O-N 3.39Å; I215-C218 VanDerWaalsContact O-N 3.17Å; L216-C218 VanDerWaalsContact C-N 3.32Å; L216-C218 PolarHBondContact O-N 2.82Å; C218-I221 PolarHBondContact O-N 3.18Å; C218-I222 WeakPolarHBondContact O-CB 3.39Å; C218-I222 WeakPolarHBondContact O-CD1 3.32Å; C218-I222 WeakPolarHBondContact O-CG1 3.18Å; C218-I222 PolarHBondContact O-N 3.36Å
219	Y	89.3	Confident	87.5	Confident	19 Å²	19	62.8 Å²	62.8	8%	0.075	35%	0.35	C	S	.	.	H	α-helix	trans	-71.8	-35.6	-177.2	-80.9	-79	0	0	0	113.5	S131 I215 L216 S217 I221 I222 I223 L238 T241 V242 I245	S131-Y219 WeakPolarHBondContact OG-CE2 3.49Å; I215-Y219 HydrophobicContact CG2-CD2 3.84Å; I215-Y219 HydrophobicContact CG2-CE2 4.02Å; I215-Y219 VanDerWaalsContact O-CD2 3.24Å; I215-Y219 WeakPolarHBondContact O-CD2 3.45Å; I215-Y219 PolarHBondContact O-N 3.37Å; L216-Y219 PolarHBondContact O-N 3.32Å; L216-Y219 VanDerWaalsContact O-N 3.15Å; S217-Y219 PolarHBondContact O-N 3.08Å; Y219-I221 VanDerWaalsContact C-N 3.32Å; Y219-I221 PolarHBondContact O-N 3.07Å; Y219-I222 HydrophobicContact CD1-CD1 4.39Å; Y219-I222 PolarHBondContact O-N 3.45Å; Y219-I223 WeakPolarHBondContact O-CB 3.34Å; Y219-I223 WeakPolarHBondContact O-CD1 3.33Å; Y219-I223 WeakPolarHBondContact O-CG1 3.39Å; Y219-I223 PolarHBondContact O-N 3.18Å; Y219-L238 HydrophobicContact CD1-CD1 3.92Å; Y219-L238 HydrophobicContact CE1-CD1 3.53Å; Y219-L238 HydrophobicContact CE1-CG 4.37Å; Y219-T241 WeakPolarHBondContact OH-CB 3.47Å; Y219-T241 PolarHBondContact OH-OG1 3.45Å; Y219-V242 HydrophobicContact CD1-CG2 3.71Å; Y219-V242 HydrophobicContact CE1-CG2 3.35Å; Y219-I245 HydrophobicContact CD2-CD1 4.25Å; Y219-I245 HydrophobicContact CE2-CD1 3.23Å; Y219-I245 VanDerWaalsContact OH-CD1 3.31Å; Y219-I245 WeakPolarHBondContact OH-CD1 3.14Å
220	C	89	Confident	85.9	Confident	77 Å²	77	69.9 Å²	69.9	52%	0.52	38%	0.378	S	S	.	.	H	α-helix	trans	-54.1	-51.4	171.9	-71.9	0	0	0	0	110.2	L216 I222 I223 S224	L216-C220 WeakPolarHBondContact O-CB 3.4Å; L216-C220 PolarHBondContact O-N 3.13Å; L216-C220 PolarHBondContact O-SG 3.42Å; C220-I222 PolarHBondContact O-N 3.14Å; C220-I223 PolarHBondContact O-N 3.24Å; C220-S224 WeakPolarHBondContact O-CB 3.15Å; C220-S224 PolarHBondContact O-N 3.29Å; C220-S224 PolarHBondContact O-OG 3.5Å; C220-S224 VanDerWaalsContact O-OG 3.04Å
221	I	90.4	Very high	84.4	Confident	82 Å²	82	66.2 Å²	66.2	42%	0.421	37%	0.365	S	S	.	.	H	α-helix	trans	-65.8	-42.1	179.9	-56	161.6	0	0	0	111.5	Y135 V139 S217 C218 Y219 S224 K225	Y135-I221 HydrophobicContact CD2-CB 4.42Å; Y135-I221 HydrophobicContact CD2-CG2 4.37Å; Y135-I221 HydrophobicContact CE2-CB 4.3Å; Y135-I221 HydrophobicContact CE2-CD1 4.02Å; Y135-I221 HydrophobicContact CE2-CG2 3.91Å; V139-I221 HydrophobicContact CG2-CG2 4.12Å; S217-I221 WeakPolarHBondContact O-CD1 3.48Å; S217-I221 VanDerWaalsContact O-CG1 3.31Å; S217-I221 WeakPolarHBondContact O-CG1 3.4Å; S217-I221 PolarHBondContact O-N 2.65Å; C218-I221 PolarHBondContact O-N 3.18Å; Y219-I221 VanDerWaalsContact C-N 3.32Å; Y219-I221 PolarHBondContact O-N 3.07Å; I221-S224 PolarHBondContact O-N 3.28Å; I221-K225 PolarHBondContact O-N 3.45Å
222	I	88.2	Confident	82.9	Confident	0 Å²	0	74.1 Å²	74.1	0%	0	40%	0.401	C	S	.	.	H	α-helix	trans	-60.6	-47.4	179	-71.5	163.4	0	0	0	111.1	R134 I138 C218 Y219 C220 K225 L226 L238	R134-I222 HydrophobicContact CB-CD1 4.14Å; I138-I222 HydrophobicContact CD1-CG2 3.73Å; C218-I222 WeakPolarHBondContact O-CB 3.39Å; C218-I222 WeakPolarHBondContact O-CD1 3.32Å; C218-I222 WeakPolarHBondContact O-CG1 3.18Å; C218-I222 PolarHBondContact O-N 3.36Å; Y219-I222 HydrophobicContact CD1-CD1 4.39Å; Y219-I222 PolarHBondContact O-N 3.45Å; C220-I222 PolarHBondContact O-N 3.14Å; I222-K225 PolarHBondContact O-N 3.48Å; I222-L226 HydrophobicContact CG2-CD1 3.49Å; I222-L226 VanDerWaalsContact CG2-CD1 3.49Å; I222-L226 WeakPolarHBondContact O-CB 3.44Å; I222-L226 PolarHBondContact O-N 2.87Å; I222-L238 HydrophobicContact CG2-CD1 3.52Å; I222-L238 HydrophobicContact CG2-CD2 4.36Å
223	I	84.9	Confident	81.2	Confident	99 Å²	99	82.1 Å²	82.1	51%	0.508	44%	0.436	S	S	.	.	H	α-helix	trans	-63.3	-46.7	179.8	-68.9	165.8	0	0	0	109.9	Y219 C220 K225 L226 S227	Y219-I223 WeakPolarHBondContact O-CB 3.34Å; Y219-I223 WeakPolarHBondContact O-CD1 3.33Å; Y219-I223 WeakPolarHBondContact O-CG1 3.39Å; Y219-I223 PolarHBondContact O-N 3.18Å; C220-I223 PolarHBondContact O-N 3.24Å; I223-K225 PolarHBondContact O-N 2.96Å; I223-L226 PolarHBondContact O-N 3.49Å; I223-L226 VanDerWaalsContact O-N 3.16Å; I223-S227 PolarHBondContact O-N 3.29Å
224	S	85.2	Confident	79.8	Confident	78 Å²	78	82.4 Å²	82.4	55%	0.545	43%	0.434	S	S	.	.	H	α-helix	trans	-59.8	-32.4	176.1	-62.8	0	0	0	0	112.9	C220 I221 S227 H228	C220-S224 WeakPolarHBondContact O-CB 3.15Å; C220-S224 PolarHBondContact O-N 3.29Å; C220-S224 PolarHBondContact O-OG 3.5Å; C220-S224 VanDerWaalsContact O-OG 3.04Å; I221-S224 PolarHBondContact O-N 3.28Å; S224-S227 PolarHBondContact O-OG 3.44Å; S224-H228 PolarHBondContact O-CD2 3.18Å; S224-H228 VanDerWaalsContact O-CD2 3.31Å
225	K	82.3	Confident	78.5	Confident	124 Å²	124	85.8 Å²	85.8	54%	0.539	44%	0.44	S	S	.	.	H	α-helix	trans	-80.3	-33.1	176.5	-167.4	60.9	172.4	-177.1	0	112.9	I221 I222 I223	I221-K225 PolarHBondContact O-N 3.45Å; I222-K225 PolarHBondContact O-N 3.48Å; I223-K225 PolarHBondContact O-N 2.96Å
226	L	79.4	Confident	77.3	Confident	11 Å²	11	92.1 Å²	92.1	6%	0.058	47%	0.468	C	S	.	.	H	α-helix	trans	-78.1	-25.4	-178.9	-86.6	159.3	0	0	0	113.8	I138 I222 I223 H228 S229 K234 L238	I138-L226 HydrophobicContact CD1-CD1 4.36Å; I138-L226 HydrophobicContact CG2-CD1 4.47Å; I138-L226 HydrophobicContact CG2-CG 4.31Å; I222-L226 HydrophobicContact CG2-CD1 3.49Å; I222-L226 VanDerWaalsContact CG2-CD1 3.49Å; I222-L226 WeakPolarHBondContact O-CB 3.44Å; I222-L226 PolarHBondContact O-N 2.87Å; I223-L226 PolarHBondContact O-N 3.49Å; I223-L226 VanDerWaalsContact O-N 3.16Å; L226-H228 PolarHBondContact O-N 3.01Å; L226-S229 PolarHBondContact O-N 2.95Å; L226-S229 VanDerWaalsContact O-N 3.08Å; L226-S229 VanDerWaalsContact O-O 3.1Å; L226-K234 HydrophobicContact CD2-CB 4.43Å; L226-L238 HydrophobicContact CD1-CD2 3.68Å
227	S	74.5	Confident	75.9	Confident	82 Å²	82	89 Å²	89	57%	0.573	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-33.3	171.9	60.9	0	0	0	0	111.4	I223 S224	I223-S227 PolarHBondContact O-N 3.29Å; S224-S227 PolarHBondContact O-OG 3.44Å
228	H	71.5	Confident	75	Confident	171 Å²	171	87.2 Å²	87.2	79%	0.792	44%	0.444	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.3	0.9	178	-64.9	-77.6	0	0	0	114.8	S224 L226	S224-H228 PolarHBondContact O-CD2 3.18Å; S224-H228 VanDerWaalsContact O-CD2 3.31Å; L226-H228 PolarHBondContact O-N 3.01Å
229	S	67.5	Low	74.3	Confident	56 Å²	56	93.3 Å²	93.3	39%	0.392	47%	0.469	S	S	.	.			trans	-128.8	135.2	-173	-171.1	0	0	0	0	114.3	L226 G231	L226-S229 PolarHBondContact O-N 2.95Å; L226-S229 VanDerWaalsContact O-N 3.08Å; L226-S229 VanDerWaalsContact O-O 3.1Å; S229-G231 PolarHBondContact O-N 2.76Å
230	K	59	Low	73.5	Confident	215 Å²	215	93.2 Å²	93.2	94%	0.935	47%	0.471	S	S	*	.			trans	-88	21.7	-176.1	-64.9	-172.8	177.9	-179.1	0	115.6	H232	K230-H232 PolarHBondContact O-N 3.08Å
231	G	63.3	Low	72.8	Confident	25 Å²	25	90 Å²	90	26%	0.258	45%	0.448	S	S	.	.			trans	-82.5	107.3	-174.3	0	0	0	0	0	115.8	S229	S229-G231 PolarHBondContact O-N 2.76Å
232	H	60.8	Low	72.4	Confident	167 Å²	167	88.3 Å²	88.3	77%	0.773	44%	0.442	S	S	*	.	H	α-helix	trans	-69.3	-42.4	-175.4	-160.9	85.7	0	0	0	115	K230 K234 R235	K230-H232 PolarHBondContact O-N 3.08Å; H232-K234 VanDerWaalsContact C-N 3.34Å; H232-K234 PolarHBondContact O-N 3.26Å; H232-R235 PolarHBondContact O-N 2.89Å
233	Q	58	Low	72.2	Confident	178 Å²	178	91 Å²	91	83%	0.832	46%	0.456	S	S	*	.	H	α-helix	trans	-65.4	-33.8	179.6	-91.1	-170.2	-6.8	0	0	113.4	R235 K236	Q233-R235 VanDerWaalsContact C-N 3.3Å; Q233-R235 PolarHBondContact O-N 3.17Å; Q233-K236 PolarHBondContact O-N 2.93Å
234	K	64.8	Low	71.9	Confident	97 Å²	97	86.7 Å²	86.7	42%	0.422	43%	0.434	S	S	.	.	H	α-helix	trans	-66.5	-32.8	178.7	-66.7	-174.5	178.9	-177.3	0	111.7	L226 H232 L238	L226-K234 HydrophobicContact CD2-CB 4.43Å; H232-K234 VanDerWaalsContact C-N 3.34Å; H232-K234 PolarHBondContact O-N 3.26Å; K234-L238 PolarHBondContact O-N 3.45Å
235	R	69.1	Low	71.9	Confident	133 Å²	133	83.6 Å²	83.6	50%	0.502	41%	0.411	S	S	.	.	H	α-helix	trans	-67.5	-34.8	175.9	-68.2	-177.3	179.1	-153.9	-1.5	113.1	H232 Q233 L238 K239	H232-R235 PolarHBondContact O-N 2.89Å; Q233-R235 VanDerWaalsContact C-N 3.3Å; Q233-R235 PolarHBondContact O-N 3.17Å; R235-L238 PolarHBondContact O-N 2.99Å; R235-K239 PolarHBondContact O-N 3.07Å
236	K	66.8	Low	72.1	Confident	137 Å²	137	83 Å²	83	60%	0.596	41%	0.413	S	S	*	.	H	α-helix	trans	-68.3	-44.1	179.1	-170.8	172.9	-177.9	172.8	0	112.5	Q233 L238 K239 T240	Q233-K236 PolarHBondContact O-N 2.93Å; K236-L238 VanDerWaalsContact C-N 3.32Å; K236-L238 PolarHBondContact O-N 3.01Å; K236-K239 PolarHBondContact O-N 3.04Å; K236-T240 PolarHBondContact O-N 2.95Å
237	A	63.2	Low	72.5	Confident	48 Å²	48	83.6 Å²	83.6	40%	0.397	42%	0.419	S	S	.	.	H	α-helix	trans	-65.1	-36.4	176.4	0	0	0	0	0	112.2	T241	A237-T241 PolarHBondContact O-N 3.47Å
238	L	74.8	Confident	73	Confident	24 Å²	24	80 Å²	80	13%	0.126	39%	0.393	C	S	.	.	H	α-helix	trans	-62.8	-44.2	173.5	-171	76.8	0	0	0	112.3	I138 Y219 I222 L226 K234 R235 K236 T240 T241 V242	I138-L238 HydrophobicContact CD1-CD1 4.41Å; Y219-L238 HydrophobicContact CD1-CD1 3.92Å; Y219-L238 HydrophobicContact CE1-CD1 3.53Å; Y219-L238 HydrophobicContact CE1-CG 4.37Å; I222-L238 HydrophobicContact CG2-CD1 3.52Å; I222-L238 HydrophobicContact CG2-CD2 4.36Å; L226-L238 HydrophobicContact CD1-CD2 3.68Å; K234-L238 PolarHBondContact O-N 3.45Å; R235-L238 PolarHBondContact O-N 2.99Å; K236-L238 VanDerWaalsContact C-N 3.32Å; K236-L238 PolarHBondContact O-N 3.01Å; L238-T240 VanDerWaalsContact C-N 3.28Å; L238-T240 PolarHBondContact O-N 3.32Å; L238-T241 PolarHBondContact O-N 3.46Å; L238-T241 PolarHBondContact O-OG1 2.99Å; L238-T241 VanDerWaalsContact O-OG1 3.05Å; L238-V242 HydrophobicContact CG-CG2 4.23Å; L238-V242 WeakPolarHBondContact O-CG2 3.17Å; L238-V242 PolarHBondContact O-N 3.35Å
239	K	79.3	Confident	73.8	Confident	136 Å²	136	73.8 Å²	73.8	59%	0.591	36%	0.364	S	S	*	.	H	α-helix	trans	-56.4	-43.4	179.6	-176.4	177.1	179.1	177.8	0	111.5	R235 K236 I243	R235-K239 PolarHBondContact O-N 3.07Å; K236-K239 PolarHBondContact O-N 3.04Å; K239-I243 HydrophobicContact CD-CD1 4.47Å; K239-I243 HydrophobicContact CG-CD1 3.79Å; K239-I243 HydrophobicContact CG-CG1 4.47Å; K239-I243 WeakPolarHBondContact O-CB 3.5Å; K239-I243 WeakPolarHBondContact O-CD1 3.46Å; K239-I243 VanDerWaalsContact O-CG1 3.22Å; K239-I243 WeakPolarHBondContact O-CG1 3.42Å; K239-I243 PolarHBondContact O-N 3.21Å
240	T	71.2	Confident	75	Confident	17 Å²	17	74.2 Å²	74.2	10%	0.104	37%	0.371	C	S	.	.	H	α-helix	trans	-64.6	-42	179.6	-56.9	0	0	0	0	112.6	K236 L238 L244 L305	K236-T240 PolarHBondContact O-N 2.95Å; L238-T240 VanDerWaalsContact C-N 3.28Å; L238-T240 PolarHBondContact O-N 3.32Å; T240-L244 WeakPolarHBondContact O-CB 3.33Å; T240-L244 PolarHBondContact O-N 3Å; T240-L305 HydrophobicContact CG2-CB 4.17Å; T240-L305 HydrophobicContact CG2-CD1 3.97Å
241	T	74.4	Confident	76.5	Confident	9 Å²	9	65.2 Å²	65.2	6%	0.055	34%	0.335	C	S	.	.	H	α-helix	trans	-73.5	-37.2	-178.6	55.9	0	0	0	0	112	I130 R134 Y219 A237 L238 L244 I245	I130-T241 HydrophobicContact CG2-CG2 3.82Å; R134-T241 HydrophobicContact CG-CG2 4.03Å; Y219-T241 WeakPolarHBondContact OH-CB 3.47Å; Y219-T241 PolarHBondContact OH-OG1 3.45Å; A237-T241 PolarHBondContact O-N 3.47Å; L238-T241 PolarHBondContact O-N 3.46Å; L238-T241 PolarHBondContact O-OG1 2.99Å; L238-T241 VanDerWaalsContact O-OG1 3.05Å; T241-L244 PolarHBondContact O-N 2.9Å; T241-I245 WeakPolarHBondContact O-CD1 3.14Å; T241-I245 VanDerWaalsContact O-CG1 3.24Å; T241-I245 WeakPolarHBondContact O-CG1 3.31Å; T241-I245 PolarHBondContact O-N 3.15Å; T241-I245 VanDerWaalsContact O-N 3.09Å
242	V	82.4	Confident	77.9	Confident	48 Å²	48	64.1 Å²	64.1	29%	0.291	32%	0.323	S	S	.	.	H	α-helix	trans	-62.8	-46.8	173.7	173.1	0	0	0	0	111.6	Y219 L238 L244 I245 L246	Y219-V242 HydrophobicContact CD1-CG2 3.71Å; Y219-V242 HydrophobicContact CE1-CG2 3.35Å; L238-V242 HydrophobicContact CG-CG2 4.23Å; L238-V242 WeakPolarHBondContact O-CG2 3.17Å; L238-V242 PolarHBondContact O-N 3.35Å; V242-L244 VanDerWaalsContact C-N 3.28Å; V242-L244 PolarHBondContact O-N 3.17Å; V242-I245 PolarHBondContact O-N 3.07Å; V242-L246 HydrophobicContact CG1-CD1 3.82Å; V242-L246 HydrophobicContact CG1-CG 4.24Å; V242-L246 WeakPolarHBondContact O-CG 3.39Å; V242-L246 PolarHBondContact O-N 3.26Å
243	I	83.6	Confident	79.4	Confident	55 Å²	55	60.4 Å²	60.4	28%	0.282	31%	0.309	S	S	.	.	H	α-helix	trans	-58.4	-44.2	178.1	-71.1	168.2	0	0	0	110.6	K239 I245 L246 A247 L301 L305	K239-I243 HydrophobicContact CD-CD1 4.47Å; K239-I243 HydrophobicContact CG-CD1 3.79Å; K239-I243 HydrophobicContact CG-CG1 4.47Å; K239-I243 WeakPolarHBondContact O-CB 3.5Å; K239-I243 WeakPolarHBondContact O-CD1 3.46Å; K239-I243 VanDerWaalsContact O-CG1 3.22Å; K239-I243 WeakPolarHBondContact O-CG1 3.42Å; K239-I243 PolarHBondContact O-N 3.21Å; I243-I245 VanDerWaalsContact C-N 3.34Å; I243-I245 PolarHBondContact O-N 3.31Å; I243-L246 PolarHBondContact O-N 3.04Å; I243-A247 VanDerWaalsContact O-CB 3.26Å; I243-A247 WeakPolarHBondContact O-CB 3.35Å; I243-A247 PolarHBondContact O-N 3.11Å; I243-L301 HydrophobicContact CG2-CD1 4.23Å; I243-L301 HydrophobicContact CG2-CD2 3.56Å; I243-L305 HydrophobicContact CD1-CD1 4.1Å
244	L	79.6	Confident	81.2	Confident	10 Å²	10	54.7 Å²	54.7	5%	0.052	29%	0.287	C	S	.	.	H	α-helix	trans	-64	-40.5	-178.4	-168	148.7	0	0	0	112.1	L127 T240 T241 V242 F248 N298 L301 Y302	L127-L244 HydrophobicContact CD1-CD2 4.1Å; L127-L244 HydrophobicContact CD2-CD2 3.19Å; L127-L244 HydrophobicContact CG-CD2 4.27Å; T240-L244 WeakPolarHBondContact O-CB 3.33Å; T240-L244 PolarHBondContact O-N 3Å; T241-L244 PolarHBondContact O-N 2.9Å; V242-L244 VanDerWaalsContact C-N 3.28Å; V242-L244 PolarHBondContact O-N 3.17Å; L244-F248 WeakPolarHBondContact O-CB 3.35Å; L244-F248 PolarHBondContact O-N 3.05Å; L244-N298 WeakPolarHBondContact CD1-OD1 3.36Å; L244-L301 HydrophobicContact CB-CD1 3.87Å; L244-L301 HydrophobicContact CD1-CD1 4.23Å; L244-L301 HydrophobicContact CG-CD1 3.95Å; L244-Y302 HydrophobicContact CD1-CE1 3.61Å; L244-Y302 VanDerWaalsContact CD1-OH 3.28Å; L244-Y302 WeakPolarHBondContact CD1-OH 3.39Å
245	I	83.9	Confident	82.6	Confident	12 Å²	12	51 Å²	51	6%	0.062	27%	0.27	C	S	.	.	H	α-helix	trans	-67.7	-47.1	177.4	-72.2	165.8	0	0	0	111.6	S131 I215 Y219 T241 V242 I243 A247 F248 F249	S131-I245 WeakPolarHBondContact OG-CD1 3.36Å; I215-I245 HydrophobicContact CG2-CD1 3.9Å; I215-I245 HydrophobicContact CG2-CG2 3.69Å; Y219-I245 HydrophobicContact CD2-CD1 4.25Å; Y219-I245 HydrophobicContact CE2-CD1 3.23Å; Y219-I245 VanDerWaalsContact OH-CD1 3.31Å; Y219-I245 WeakPolarHBondContact OH-CD1 3.14Å; T241-I245 WeakPolarHBondContact O-CD1 3.14Å; T241-I245 VanDerWaalsContact O-CG1 3.24Å; T241-I245 WeakPolarHBondContact O-CG1 3.31Å; T241-I245 PolarHBondContact O-N 3.15Å; T241-I245 VanDerWaalsContact O-N 3.09Å; V242-I245 PolarHBondContact O-N 3.07Å; I243-I245 VanDerWaalsContact C-N 3.34Å; I243-I245 PolarHBondContact O-N 3.31Å; I245-A247 VanDerWaalsContact C-N 3.28Å; I245-A247 PolarHBondContact O-N 3.46Å; I245-F248 PolarHBondContact O-N 2.99Å; I245-F249 HydrophobicContact CG2-CD2 3.73Å; I245-F249 HydrophobicContact CG2-CE2 3.67Å; I245-F249 VanDerWaalsContact O-CD2 3.27Å; I245-F249 WeakPolarHBondContact O-CD2 3.47Å; I245-F249 PolarHBondContact O-N 3.32Å
246	L	87.4	Confident	83.7	Confident	113 Å²	113	44.9 Å²	44.9	59%	0.592	25%	0.247	S	C	*	.	H	α-helix	trans	-61.3	-41	177.6	-72.1	175.5	0	0	0	111	V242 I243 A250	V242-L246 HydrophobicContact CG1-CD1 3.82Å; V242-L246 HydrophobicContact CG1-CG 4.24Å; V242-L246 WeakPolarHBondContact O-CG 3.39Å; V242-L246 PolarHBondContact O-N 3.26Å; I243-L246 PolarHBondContact O-N 3.04Å; L246-A250 WeakPolarHBondContact O-CB 3.43Å; L246-A250 PolarHBondContact O-N 3.45Å
247	A	86.5	Confident	85	Confident	22 Å²	22	42.5 Å²	42.5	18%	0.182	24%	0.24	C	C	.	.	H	α-helix	trans	-66.9	-40.4	178.2	0	0	0	0	0	111.8	I243 I245 A250 C251 L297	I243-A247 VanDerWaalsContact O-CB 3.26Å; I243-A247 WeakPolarHBondContact O-CB 3.35Å; I243-A247 PolarHBondContact O-N 3.11Å; I245-A247 VanDerWaalsContact C-N 3.28Å; I245-A247 PolarHBondContact O-N 3.46Å; A247-A250 PolarHBondContact O-N 3.01Å; A247-C251 PolarHBondContact O-N 3.42Å; A247-C251 PolarHBondContact O-SG 2.84Å; A247-C251 VanDerWaalsContact O-SG 3.33Å; A247-L297 HydrophobicContact CB-CD1 3.71Å
248	F	86.1	Confident	86.5	Confident	6 Å²	6	40.6 Å²	40.6	3%	0.026	23%	0.226	C	C	.	.	H	α-helix	trans	-59	-53.1	174.2	-178.4	-87.8	0	0	0	111.7	V124 L127 L244 I245 A250 C251 W252 H294	V124-F248 HydrophobicContact CB-CE1 3.81Å; V124-F248 HydrophobicContact CB-CZ 3.69Å; V124-F248 HydrophobicContact CG2-CD1 4.34Å; V124-F248 HydrophobicContact CG2-CE1 3.57Å; V124-F248 HydrophobicContact CG2-CZ 4.01Å; L127-F248 HydrophobicContact CD1-CB 3.57Å; L127-F248 HydrophobicContact CD1-CD1 3.9Å; L127-F248 HydrophobicContact CD1-CD2 3.71Å; L127-F248 HydrophobicContact CD1-CE2 4.39Å; L127-F248 HydrophobicContact CD1-CG 3.43Å; L127-F248 VanDerWaalsContact CD1-CG 3.43Å; L244-F248 WeakPolarHBondContact O-CB 3.35Å; L244-F248 PolarHBondContact O-N 3.05Å; I245-F248 PolarHBondContact O-N 2.99Å; F248-A250 VanDerWaalsContact C-N 3.34Å; F248-A250 PolarHBondContact O-N 3.35Å; F248-C251 PolarHBondContact O-N 3.19Å; F248-W252 AromaticContact CE1-CD1 3.68Å; F248-W252 HydrophobicContact CE1-CG 4.39Å; F248-W252 AromaticContact CE2-CD1 3.72Å; F248-W252 AromaticContact CE2-NE1 3.54Å; F248-W252 AromaticContact CZ-CD1 3.5Å; F248-W252 VanDerWaalsContact CZ-CD1 3.5Å; F248-W252 HydrophobicContact CZ-CG 4.4Å; F248-W252 AromaticContact CZ-NE1 3.53Å; F248-W252 PolarHBondContact O-N 2.84Å; F248-H294 HydrophobicContact CD2-CB 4.02Å; F248-H294 AromaticContact CD2-CD2 3.82Å; F248-H294 HydrophobicContact CE2-CB 4.42Å; F248-H294 AromaticContact CE2-CD2 3.55Å
249	F	89.2	Confident	87.3	Confident	42 Å²	42	39.8 Å²	39.8	18%	0.184	22%	0.221	C	C	.	.	H	α-helix	trans	-67.5	-34.2	-179.8	-71.4	-59.5	0	0	0	112.5	V124 L208 I215 I245 C251 W252 L253	V124-F249 HydrophobicContact CG2-CE1 4.46Å; L208-F249 HydrophobicContact CD1-CD1 3.47Å; L208-F249 VanDerWaalsContact CD1-CD1 3.47Å; L208-F249 HydrophobicContact CD1-CE1 3.57Å; I215-F249 HydrophobicContact CD1-CE2 3.89Å; I215-F249 HydrophobicContact CD1-CZ 3.9Å; I245-F249 HydrophobicContact CG2-CD2 3.73Å; I245-F249 HydrophobicContact CG2-CE2 3.67Å; I245-F249 VanDerWaalsContact O-CD2 3.27Å; I245-F249 WeakPolarHBondContact O-CD2 3.47Å; I245-F249 PolarHBondContact O-N 3.32Å; F249-C251 VanDerWaalsContact C-N 3.32Å; F249-C251 PolarHBondContact O-N 2.85Å; F249-W252 PolarHBondContact O-N 3.22Å; F249-L253 WeakPolarHBondContact O-CB 3.36Å; F249-L253 PolarHBondContact O-N 3.02Å
250	A	90.9	Very high	87.9	Confident	65 Å²	65	35 Å²	35	54%	0.537	21%	0.205	S	C	.	.	H	α-helix	trans	-63.7	-36.7	174.8	0	0	0	0	0	112.5	L246 A247 F248 P254	L246-A250 WeakPolarHBondContact O-CB 3.43Å; L246-A250 PolarHBondContact O-N 3.45Å; A247-A250 PolarHBondContact O-N 3.01Å; F248-A250 VanDerWaalsContact C-N 3.34Å; F248-A250 PolarHBondContact O-N 3.35Å; A250-P254 WeakPolarHBondContact O-CD 3.24Å
251	C	91.3	Very high	88.9	Confident	26 Å²	26	36.7 Å²	36.7	18%	0.176	21%	0.213	C	C	.	.	H	α-helix	trans	-66.6	-42.2	174.6	-75.4	0	0	0	0	112.3	A247 F248 F249 A291 H294 L297	A247-C251 PolarHBondContact O-N 3.42Å; A247-C251 PolarHBondContact O-SG 2.84Å; A247-C251 VanDerWaalsContact O-SG 3.33Å; F248-C251 PolarHBondContact O-N 3.19Å; F249-C251 VanDerWaalsContact C-N 3.32Å; F249-C251 PolarHBondContact O-N 2.85Å; C251-A291 WeakPolarHBondContact O-CA 3.4Å; C251-A291 WeakPolarHBondContact O-CB 3.4Å; C251-H294 HydrophobicContact CB-CB 4.27Å; C251-L297 VanDerWaalsContact SG-CD1 3.5Å
252	W	92.8	Very high	89.7	Confident	2 Å²	2	37.2 Å²	37.2	1%	0.008	22%	0.215	C	C	.	.	H	α-helix	trans	-88.3	-23.3	-173.4	-79.7	100.7	0	0	0	114.7	L120 F248 F249 Y255 Y256 A291 F292 H294	L120-W252 HydrophobicContact CD1-CD2 4.1Å; L120-W252 HydrophobicContact CD1-CE3 4.07Å; L120-W252 HydrophobicContact CD1-CH2 3.48Å; L120-W252 VanDerWaalsContact CD1-CH2 3.48Å; L120-W252 HydrophobicContact CD1-CZ2 3.46Å; L120-W252 VanDerWaalsContact CD1-CZ2 3.46Å; L120-W252 HydrophobicContact CD1-CZ3 3.78Å; F248-W252 AromaticContact CE1-CD1 3.68Å; F248-W252 HydrophobicContact CE1-CG 4.39Å; F248-W252 AromaticContact CE2-CD1 3.72Å; F248-W252 AromaticContact CE2-NE1 3.54Å; F248-W252 AromaticContact CZ-CD1 3.5Å; F248-W252 VanDerWaalsContact CZ-CD1 3.5Å; F248-W252 HydrophobicContact CZ-CG 4.4Å; F248-W252 AromaticContact CZ-NE1 3.53Å; F248-W252 PolarHBondContact O-N 2.84Å; F249-W252 PolarHBondContact O-N 3.22Å; W252-Y255 AromaticContact CE3-CD1 3.71Å; W252-Y255 HydrophobicContact CE3-CD1 3.71Å; W252-Y255 HydrophobicContact CE3-CE1 4.32Å; W252-Y255 HydrophobicContact CE3-CG 4.35Å; W252-Y255 AromaticContact CZ3-CD1 3.71Å; W252-Y255 HydrophobicContact CZ3-CD1 3.71Å; W252-Y255 AromaticContact CZ3-CE1 3.91Å; W252-Y255 HydrophobicContact CZ3-CE1 3.91Å; W252-Y255 HydrophobicContact CZ3-CG 4.35Å; W252-Y255 WeakPolarHBondContact O-CB 3.34Å; W252-Y255 PolarHBondContact O-N 3.01Å; W252-Y256 HydrophobicContact CB-CD2 3.91Å; W252-Y256 HydrophobicContact CB-CE2 3.54Å; W252-Y256 HydrophobicContact CE3-CE2 4.39Å; W252-Y256 HydrophobicContact CG-CE2 4.25Å; W252-Y256 VanDerWaalsContact O-CD2 3.28Å; W252-Y256 WeakPolarHBondContact O-CD2 3.07Å; W252-Y256 PolarHBondContact O-N 3.37Å; W252-A291 HydrophobicContact CD2-CB 3.77Å; W252-A291 HydrophobicContact CE3-CB 3.79Å; W252-A291 HydrophobicContact CG-CB 4.25Å; W252-A291 HydrophobicContact CH2-CB 4.29Å; W252-A291 HydrophobicContact CZ2-CB 4.31Å; W252-A291 HydrophobicContact CZ3-CB 4.06Å; W252-F292 HydrophobicContact CH2-CD1 4.42Å; W252-F292 HydrophobicContact CH2-CE1 4.22Å; W252-H294 AromaticContact CE2-CE1 3.9Å; W252-H294 AromaticContact CE2-ND1 3.72Å; W252-H294 AromaticContact CZ2-CE1 3.58Å; W252-H294 AromaticContact CZ2-ND1 3.76Å; W252-H294 AromaticContact NE1-CD2 4Å; W252-H294 AromaticContact NE1-CE1 3.61Å; W252-H294 AromaticContact NE1-CG 3.48Å; W252-H294 AromaticContact NE1-ND1 3.21Å; W252-H294 PolarHBondContact NE1-ND1 3.36Å
253	L	91.7	Very high	90.1	Very high	89 Å²	89	35.4 Å²	35.4	47%	0.466	21%	0.205	S	C	.	.	H	α-helix	trans	-56.7	-45.1	-175.9	179.7	65.2	0	0	0	113.6	F249 Y255 Y256 I257	F249-L253 WeakPolarHBondContact O-CB 3.36Å; F249-L253 PolarHBondContact O-N 3.02Å; L253-Y255 VanDerWaalsContact C-N 3.29Å; L253-Y255 PolarHBondContact O-N 3.48Å; L253-Y256 PolarHBondContact O-N 3.48Å; L253-I257 HydrophobicContact CD1-CD1 4.12Å; L253-I257 HydrophobicContact CD1-CG1 4.26Å; L253-I257 HydrophobicContact CG-CD1 3.92Å; L253-I257 HydrophobicContact CG-CG1 4.5Å; L253-I257 VanDerWaalsContact O-CG1 3.31Å; L253-I257 WeakPolarHBondContact O-CG1 2.96Å; L253-I257 PolarHBondContact O-N 3.44Å
254	P	95.4	Very high	90.4	Very high	58 Å²	58	37.1 Å²	37.1	38%	0.377	21%	0.211	S	C	.	.	H	α-helix	trans	-60.2	-38.7	178.5	-24.2	35.8	0	0	0	113	A250 I257 G258 T287	A250-P254 WeakPolarHBondContact O-CD 3.24Å; P254-I257 PolarHBondContact O-N 2.99Å; P254-G258 PolarHBondContact O-N 3.49Å; P254-G258 VanDerWaalsContact O-N 3.07Å; P254-T287 HydrophobicContact CB-CG2 3.52Å
255	Y	94.7	Very high	90.9	Very high	19 Å²	19	37.6 Å²	37.6	8%	0.075	21%	0.213	C	C	.	.	H	α-helix	trans	-65.5	-47.2	176.2	171.6	-101.9	0	0	0	111.6	Y116 W252 L253 I257 G258 I259 I284 T287 E288	Y116-Y255 PolarHBondContact OH-OH 2.85Å; W252-Y255 AromaticContact CE3-CD1 3.71Å; W252-Y255 HydrophobicContact CE3-CD1 3.71Å; W252-Y255 HydrophobicContact CE3-CE1 4.32Å; W252-Y255 HydrophobicContact CE3-CG 4.35Å; W252-Y255 AromaticContact CZ3-CD1 3.71Å; W252-Y255 HydrophobicContact CZ3-CD1 3.71Å; W252-Y255 AromaticContact CZ3-CE1 3.91Å; W252-Y255 HydrophobicContact CZ3-CE1 3.91Å; W252-Y255 HydrophobicContact CZ3-CG 4.35Å; W252-Y255 WeakPolarHBondContact O-CB 3.34Å; W252-Y255 PolarHBondContact O-N 3.01Å; L253-Y255 VanDerWaalsContact C-N 3.29Å; L253-Y255 PolarHBondContact O-N 3.48Å; Y255-I257 VanDerWaalsContact C-N 3.26Å; Y255-I257 PolarHBondContact O-N 3Å; Y255-G258 WeakPolarHBondContact O-CA 3.35Å; Y255-G258 PolarHBondContact O-N 3.01Å; Y255-I259 HydrophobicContact CD1-CD1 4.29Å; Y255-I259 HydrophobicContact CD2-CG2 4.27Å; Y255-I259 HydrophobicContact CE1-CD1 3.85Å; Y255-I259 HydrophobicContact CE1-CG2 4.12Å; Y255-I259 HydrophobicContact CE2-CG2 3.81Å; Y255-I259 PolarHBondContact O-N 3.43Å; Y255-I284 HydrophobicContact CD2-CG2 4.22Å; Y255-I284 HydrophobicContact CE2-CG2 3.9Å; Y255-T287 WeakPolarHBondContact CA-OG1 3.35Å; Y255-E288 HydrophobicContact CD2-CB 3.52Å; Y255-E288 HydrophobicContact CD2-CG 4.08Å; Y255-E288 HydrophobicContact CE2-CB 3.66Å; Y255-E288 HydrophobicContact CE2-CG 3.84Å; Y255-E288 HydrophobicContact CG-CB 4.47Å; Y255-E288 PolarHBondContact OH-OE1 3Å
256	Y	92.8	Very high	91.1	Very high	4 Å²	4	40 Å²	40	2%	0.016	23%	0.225	C	C	.	.	H	α-helix	trans	-62.1	-33.7	178.4	-69.7	-47.8	0	0	0	112.9	I204 G207 L208 W252 L253 I259 S260	I204-Y256 HydrophobicContact CG1-CD1 4.27Å; G207-Y256 WeakPolarHBondContact CA-OH 3.35Å; G207-Y256 PolarHBondContact O-OH 3.38Å; L208-Y256 HydrophobicContact CB-CD2 4.03Å; L208-Y256 HydrophobicContact CB-CE2 3.69Å; L208-Y256 HydrophobicContact CD1-CD2 3.96Å; L208-Y256 HydrophobicContact CD1-CE2 3.92Å; L208-Y256 HydrophobicContact CD2-CD2 3.68Å; L208-Y256 HydrophobicContact CD2-CE2 4.22Å; L208-Y256 HydrophobicContact CD2-CG 4Å; L208-Y256 HydrophobicContact CG-CD2 4.1Å; L208-Y256 HydrophobicContact CG-CE2 4.15Å; W252-Y256 HydrophobicContact CB-CD2 3.91Å; W252-Y256 HydrophobicContact CB-CE2 3.54Å; W252-Y256 HydrophobicContact CE3-CE2 4.39Å; W252-Y256 HydrophobicContact CG-CE2 4.25Å; W252-Y256 VanDerWaalsContact O-CD2 3.28Å; W252-Y256 WeakPolarHBondContact O-CD2 3.07Å; W252-Y256 PolarHBondContact O-N 3.37Å; L253-Y256 PolarHBondContact O-N 3.48Å; Y256-I259 HydrophobicContact CD1-CD1 3.74Å; Y256-I259 HydrophobicContact CE1-CD1 4.4Å; Y256-I259 WeakPolarHBondContact O-CG1 3.4Å; Y256-S260 WeakPolarHBondContact O-CB 3.35Å; Y256-S260 PolarHBondContact O-N 2.98Å; Y256-S260 VanDerWaalsContact O-N 3.11Å; Y256-S260 PolarHBondContact O-OG 3.36Å
257	I	93.5	Very high	91.1	Very high	87 Å²	87	38.8 Å²	38.8	45%	0.446	22%	0.219	S	C	.	.	H	α-helix	trans	-64.8	-47.4	172	-67.8	165.5	0	0	0	110.1	L253 P254 Y255 S260 I261	L253-I257 HydrophobicContact CD1-CD1 4.12Å; L253-I257 HydrophobicContact CD1-CG1 4.26Å; L253-I257 HydrophobicContact CG-CD1 3.92Å; L253-I257 HydrophobicContact CG-CG1 4.5Å; L253-I257 VanDerWaalsContact O-CG1 3.31Å; L253-I257 WeakPolarHBondContact O-CG1 2.96Å; L253-I257 PolarHBondContact O-N 3.44Å; P254-I257 PolarHBondContact O-N 2.99Å; Y255-I257 VanDerWaalsContact C-N 3.26Å; Y255-I257 PolarHBondContact O-N 3Å; I257-S260 PolarHBondContact O-N 3.17Å; I257-I261 HydrophobicContact CG2-CD1 3.85Å; I257-I261 WeakPolarHBondContact O-CG1 3.42Å; I257-I261 PolarHBondContact O-N 3.24Å
258	G	94.1	Very high	91.2	Very high	9 Å²	9	43 Å²	43	9%	0.093	24%	0.235	C	C	.	.	H	α-helix	trans	-56.2	-52.7	179.1	0	0	0	0	0	112.9	P254 Y255 S260 I261 D262	P254-G258 PolarHBondContact O-N 3.49Å; P254-G258 VanDerWaalsContact O-N 3.07Å; Y255-G258 WeakPolarHBondContact O-CA 3.35Å; Y255-G258 PolarHBondContact O-N 3.01Å; G258-S260 VanDerWaalsContact C-N 3.27Å; G258-S260 PolarHBondContact O-N 3.37Å; G258-I261 PolarHBondContact O-N 3.26Å; G258-I261 VanDerWaalsContact O-N 3.17Å; G258-D262 PolarHBondContact O-N 2.86Å
259	I	92.6	Very high	91.3	Very high	7 Å²	7	48 Å²	48	4%	0.036	26%	0.261	C	S	.	.	H	α-helix	trans	-66.5	-28.9	179.1	69	-177.1	0	0	0	112.5	Q200 I204 Y255 Y256 D262 S263 I284	Q200-I259 PolarHBondContact OE1-O 3.44Å; I204-I259 HydrophobicContact CD1-CD1 4.15Å; I204-I259 HydrophobicContact CD1-CG1 4.15Å; I204-I259 HydrophobicContact CG1-CD1 3.8Å; I204-I259 HydrophobicContact CG1-CG1 4.32Å; Y255-I259 HydrophobicContact CD1-CD1 4.29Å; Y255-I259 HydrophobicContact CD2-CG2 4.27Å; Y255-I259 HydrophobicContact CE1-CD1 3.85Å; Y255-I259 HydrophobicContact CE1-CG2 4.12Å; Y255-I259 HydrophobicContact CE2-CG2 3.81Å; Y255-I259 PolarHBondContact O-N 3.43Å; Y256-I259 HydrophobicContact CD1-CD1 3.74Å; Y256-I259 HydrophobicContact CE1-CD1 4.4Å; Y256-I259 WeakPolarHBondContact O-CG1 3.4Å; I259-D262 PolarHBondContact O-N 2.98Å; I259-S263 WeakPolarHBondContact O-CB 3.39Å; I259-S263 PolarHBondContact O-N 3.17Å; I259-S263 PolarHBondContact O-OG 3.12Å; I259-I284 HydrophobicContact CG2-CD1 4.38Å; I259-I284 HydrophobicContact CG2-CG1 4.46Å; I259-I284 HydrophobicContact CG2-CG2 4.17Å
260	S	91.8	Very high	91.3	Very high	36 Å²	36	48.7 Å²	48.7	25%	0.252	27%	0.266	S	S	.	.	H	α-helix	trans	-67.8	-39.6	174.1	-59.6	0	0	0	0	111.5	Y256 I257 G258 S263 F264	Y256-S260 WeakPolarHBondContact O-CB 3.35Å; Y256-S260 PolarHBondContact O-N 2.98Å; Y256-S260 VanDerWaalsContact O-N 3.11Å; Y256-S260 PolarHBondContact O-OG 3.36Å; I257-S260 PolarHBondContact O-N 3.17Å; G258-S260 VanDerWaalsContact C-N 3.27Å; G258-S260 PolarHBondContact O-N 3.37Å; S260-S263 PolarHBondContact O-N 3.47Å; S260-F264 WeakPolarHBondContact O-CD2 3.41Å; S260-F264 VanDerWaalsContact O-CG 3.23Å; S260-F264 WeakPolarHBondContact O-CG 3.12Å; S260-F264 PolarHBondContact O-N 3.48Å
261	I	92.9	Very high	91.1	Very high	52 Å²	52	52.4 Å²	52.4	27%	0.267	27%	0.27	S	S	.	.	H	α-helix	trans	-65.4	-44.3	175.1	-65.4	165.7	0	0	0	110.1	I257 G258 S263 F264 I265 F276 V280	I257-I261 HydrophobicContact CG2-CD1 3.85Å; I257-I261 WeakPolarHBondContact O-CG1 3.42Å; I257-I261 PolarHBondContact O-N 3.24Å; G258-I261 PolarHBondContact O-N 3.26Å; G258-I261 VanDerWaalsContact O-N 3.17Å; I261-S263 PolarHBondContact O-N 2.03Å; I261-F264 WeakPolarHBondContact O-CB 3.36Å; I261-F264 PolarHBondContact O-N 2.66Å; I261-I265 HydrophobicContact CG2-CD1 4.19Å; I261-I265 WeakPolarHBondContact O-CG1 3.48Å; I261-I265 PolarHBondContact O-N 3.12Å; I261-F276 HydrophobicContact CG2-CE1 4.12Å; I261-F276 HydrophobicContact CG2-CZ 4.12Å; I261-V280 HydrophobicContact CB-CG1 4.5Å; I261-V280 HydrophobicContact CG2-CG1 4.2Å; I261-V280 HydrophobicContact CG2-CG2 3.78Å
262	D	91.2	Very high	90.8	Very high	19 Å²	19	56.8 Å²	56.8	10%	0.102	29%	0.288	C	S	.	.	H	α-helix	trans	-58.3	-45.6	175.2	-174.3	63.1	0	0	0	111.9	Q200 G258 I259 F264 I265 L266 V280 H281 I284	Q200-D262 PolarHBondContact NE2-OD2 2.97Å; G258-D262 PolarHBondContact O-N 2.86Å; I259-D262 PolarHBondContact O-N 2.98Å; D262-F264 VanDerWaalsContact C-N 3.29Å; D262-F264 PolarHBondContact O-N 2.9Å; D262-I265 WeakPolarHBondContact O-CB 3.24Å; D262-I265 PolarHBondContact O-N 2.97Å; D262-I265 VanDerWaalsContact O-N 3.15Å; D262-L266 WeakPolarHBondContact O-CG 3.28Å; D262-L266 PolarHBondContact O-N 3.21Å; D262-V280 HydrophobicContact CB-CG1 4.2Å; D262-H281 IonicContact OD1-CD2 3.15Å; D262-H281 PolarHBondContact OD1-CD2 2.99Å; D262-H281 IonicContact OD1-NE2 3Å; D262-H281 PolarHBondContact OD1-NE2 2.86Å; D262-I284 HydrophobicContact CB-CD1 3.8Å
263	S	90	Very high	90.6	Very high	11 Å²	11	59.1 Å²	59.1	8%	0.077	31%	0.312	C	S	.	.	H	α-helix	trans	-58.1	-37.8	172.2	-74.1	0	0	0	0	113	Q200 I259 S260 I261 L266 L267	Q200-S263 PolarHBondContact OE1-OG 3.41Å; I259-S263 WeakPolarHBondContact O-CB 3.39Å; I259-S263 PolarHBondContact O-N 3.17Å; I259-S263 PolarHBondContact O-OG 3.12Å; S260-S263 PolarHBondContact O-N 3.47Å; I261-S263 PolarHBondContact O-N 2.03Å; S263-L266 PolarHBondContact O-N 3.43Å; S263-L267 WeakPolarHBondContact O-CB 3.39Å; S263-L267 VanDerWaalsContact O-CG 3.27Å; S263-L267 WeakPolarHBondContact O-CG 3.47Å; S263-L267 PolarHBondContact O-N 2.99Å
264	F	90.9	Very high	90.3	Very high	91 Å²	91	56.5 Å²	56.5	40%	0.399	30%	0.302	S	S	.	.	H	α-helix	trans	-71.5	-30.2	177.5	-65.6	-20.2	0	0	0	113.4	S260 I261 D262 E268 I269 I270	S260-F264 WeakPolarHBondContact O-CD2 3.41Å; S260-F264 VanDerWaalsContact O-CG 3.23Å; S260-F264 WeakPolarHBondContact O-CG 3.12Å; S260-F264 PolarHBondContact O-N 3.48Å; I261-F264 WeakPolarHBondContact O-CB 3.36Å; I261-F264 PolarHBondContact O-N 2.66Å; D262-F264 VanDerWaalsContact C-N 3.29Å; D262-F264 PolarHBondContact O-N 2.9Å; F264-E268 PolarHBondContact O-N 2.97Å; F264-I269 HydrophobicContact CB-CB 4.25Å; F264-I269 HydrophobicContact CD1-CD1 3.82Å; F264-I269 HydrophobicContact CE1-CD1 4.39Å; F264-I269 PolarHBondContact O-N 2.77Å; F264-I270 HydrophobicContact CB-CD1 3.86Å; F264-I270 HydrophobicContact CB-CG1 4.12Å; F264-I270 HydrophobicContact CD2-CD1 4.12Å; F264-I270 HydrophobicContact CG-CD1 4.49Å; F264-I270 PolarHBondContact O-N 2.89Å
265	I	90.2	Very high	89.9	Confident	19 Å²	19	61.6 Å²	61.6	10%	0.097	32%	0.32	C	S	.	.	H	α-helix	trans	-67.2	-49.7	171.5	-65.7	162.2	0	0	0	109.2	I261 D262 L267 E268 F276 E277 V280	I261-I265 HydrophobicContact CG2-CD1 4.19Å; I261-I265 WeakPolarHBondContact O-CG1 3.48Å; I261-I265 PolarHBondContact O-N 3.12Å; D262-I265 WeakPolarHBondContact O-CB 3.24Å; D262-I265 PolarHBondContact O-N 2.97Å; D262-I265 VanDerWaalsContact O-N 3.15Å; I265-L267 VanDerWaalsContact C-N 3.31Å; I265-L267 PolarHBondContact O-N 2.73Å; I265-E268 PolarHBondContact O-N 2.85Å; I265-F276 HydrophobicContact CD1-CD1 4.01Å; I265-F276 HydrophobicContact CD1-CE1 3.84Å; I265-F276 HydrophobicContact CG1-CE1 4.3Å; I265-E277 HydrophobicContact CD1-CG 4.35Å; I265-E277 HydrophobicContact CG2-CG 4Å; I265-E277 WeakPolarHBondContact CG2-OE1 3.24Å; I265-V280 HydrophobicContact CD1-CB 4.48Å; I265-V280 HydrophobicContact CD1-CG1 4.47Å; I265-V280 HydrophobicContact CD1-CG2 4.2Å
266	L	87.6	Confident	89.7	Confident	63 Å²	63	64.2 Å²	64.2	33%	0.33	33%	0.332	S	S	.	.	H	α-helix	trans	-62	-34.7	179.5	-69.8	173.4	0	0	0	113.4	V196 V197 D262 S263 E268	V196-L266 HydrophobicContact CB-CD1 4.31Å; V196-L266 HydrophobicContact CG1-CD1 3.75Å; V197-L266 HydrophobicContact CG2-CB 4.13Å; V197-L266 HydrophobicContact CG2-CD1 4.26Å; D262-L266 WeakPolarHBondContact O-CG 3.28Å; D262-L266 PolarHBondContact O-N 3.21Å; S263-L266 PolarHBondContact O-N 3.43Å; L266-E268 PolarHBondContact O-N 3.3Å
267	L	87.8	Confident	89.5	Confident	88 Å²	88	66.3 Å²	66.3	46%	0.461	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	7.3	176.1	-68.8	175.1	0	0	0	113.7	V197 S263 I265 I269	V197-L267 HydrophobicContact CG1-CD1 4.13Å; V197-L267 HydrophobicContact CG1-CD2 4.23Å; V197-L267 HydrophobicContact CG1-CG 4.3Å; V197-L267 HydrophobicContact CG2-CD2 4.24Å; V197-L267 HydrophobicContact CG2-CG 4.27Å; S263-L267 WeakPolarHBondContact O-CB 3.39Å; S263-L267 VanDerWaalsContact O-CG 3.27Å; S263-L267 WeakPolarHBondContact O-CG 3.47Å; S263-L267 PolarHBondContact O-N 2.99Å; I265-L267 VanDerWaalsContact C-N 3.31Å; I265-L267 PolarHBondContact O-N 2.73Å; L267-I269 HydrophobicContact CB-CD1 3.98Å; L267-I269 HydrophobicContact CB-CG1 4Å; L267-I269 HydrophobicContact CD1-CD1 4.22Å; L267-I269 PolarHBondContact O-N 3.46Å; L267-I269 VanDerWaalsContact O-N 3.09Å
268	E	88	Confident	89.2	Confident	110 Å²	110	63.7 Å²	63.7	51%	0.514	33%	0.329	S	S	.	.	T	Hydrogen-bonded Turn	trans	56.7	20.8	-177.5	-61.2	-162.3	-176	0	0	115.1	F264 I265 L266 K271	F264-E268 PolarHBondContact O-N 2.97Å; I265-E268 PolarHBondContact O-N 2.85Å; L266-E268 PolarHBondContact O-N 3.3Å; E268-K271 WeakPolarHBondContact OE2-CE 3.29Å; E268-K271 IonicContact OE2-NZ 2.71Å; E268-K271 PolarHBondContact OE2-NZ 3.48Å
269	I	89.2	Confident	89	Confident	111 Å²	111	66.2 Å²	66.2	57%	0.569	34%	0.343	S	S	*	.	S	Bend	trans	-72.4	-36.8	175.9	-62	171.8	0	0	0	109.7	F264 L267	F264-I269 HydrophobicContact CB-CB 4.25Å; F264-I269 HydrophobicContact CD1-CD1 3.82Å; F264-I269 HydrophobicContact CE1-CD1 4.39Å; F264-I269 PolarHBondContact O-N 2.77Å; L267-I269 HydrophobicContact CB-CD1 3.98Å; L267-I269 HydrophobicContact CB-CG1 4Å; L267-I269 HydrophobicContact CD1-CD1 4.22Å; L267-I269 PolarHBondContact O-N 3.46Å; L267-I269 VanDerWaalsContact O-N 3.09Å
270	I	88.5	Confident	89	Confident	56 Å²	56	66.5 Å²	66.5	29%	0.287	34%	0.344	S	S	.	.	S	Bend	trans	-116.5	120.7	175.4	-60.9	174.5	0	0	0	107.5	F264 Q272 F276	F264-I270 HydrophobicContact CB-CD1 3.86Å; F264-I270 HydrophobicContact CB-CG1 4.12Å; F264-I270 HydrophobicContact CD2-CD1 4.12Å; F264-I270 HydrophobicContact CG-CD1 4.49Å; F264-I270 PolarHBondContact O-N 2.89Å; I270-Q272 HydrophobicContact CG2-CG 3.64Å; I270-F276 HydrophobicContact CG2-CE1 4.37Å
271	K	85.9	Confident	88.8	Confident	143 Å²	143	67.1 Å²	67.1	62%	0.622	34%	0.343	S	S	*	.			trans	-109.9	104.2	176.6	-62.7	-171.6	175.9	-162	0	108.7	E268	E268-K271 WeakPolarHBondContact OE2-CE 3.29Å; E268-K271 IonicContact OE2-NZ 2.71Å; E268-K271 PolarHBondContact OE2-NZ 3.48Å
272	Q	86.4	Confident	88.6	Confident	118 Å²	118	67.5 Å²	67.5	55%	0.551	34%	0.343	S	S	*	.			trans	-131.5	167.5	179.4	-66.3	-72.3	79.2	0	0	109.7	I270 F276	I270-Q272 HydrophobicContact CG2-CG 3.64Å; Q272-F276 HydrophobicContact CB-CB 3.79Å; Q272-F276 HydrophobicContact CB-CD1 3.63Å; Q272-F276 HydrophobicContact CB-CE1 4.43Å; Q272-F276 HydrophobicContact CB-CG 3.85Å; Q272-F276 HydrophobicContact CG-CD1 3.9Å; Q272-F276 HydrophobicContact CG-CE1 4.25Å; Q272-F276 HydrophobicContact CG-CG 4.17Å
273	G	87	Confident	88.6	Confident	51 Å²	51	73.8 Å²	73.8	53%	0.526	37%	0.365	S	S	.	.			trans	-76.8	169.1	178.6	0	0	0	0	0	113.8	E275 F276	G273-E275 PolarHBondContact O-N 3.12Å; G273-E275 VanDerWaalsContact O-N 3.14Å; G273-F276 WeakPolarHBondContact O-CB 3.38Å; G273-F276 PolarHBondContact O-N 3.19Å
274	C	86.3	Confident	88.8	Confident	35 Å²	35	74.2 Å²	74.2	24%	0.236	37%	0.367	C	S	.	.	H	α-helix	trans	-56.7	-31	-176	-54.9	0	0	0	0	114.5	C28 F276 E277 N278	C28-C274 WeakPolarHBondContact CA-SG 3.29Å; C28-C274 HydrophobicContact CB-CB 3.71Å; C28-C274 WeakPolarHBondContact CB-SG 3.45Å; C28-C274 WeakPolarHBondContact SG-CA 3.37Å; C28-C274 WeakPolarHBondContact SG-CB 3.35Å; C28-C274 CovalentContact SG-SG 2.03Å; C28-C274 PolarHBondContact SG-SG 3.28Å; C274-F276 VanDerWaalsContact C-N 3.25Å; C274-F276 PolarHBondContact O-N 3.12Å; C274-E277 PolarHBondContact O-N 3.06Å; C274-N278 WeakPolarHBondContact O-CB 3.44Å; C274-N278 PolarHBondContact O-N 3.33Å
275	E	87.5	Confident	88.8	Confident	164 Å²	164	71.2 Å²	71.2	77%	0.766	36%	0.357	S	S	*	.	H	α-helix	trans	-59.8	-37.9	176.6	-171.3	-173.3	170.1	0	0	111.9	G273 T279	G273-E275 PolarHBondContact O-N 3.12Å; G273-E275 VanDerWaalsContact O-N 3.14Å; E275-T279 WeakPolarHBondContact O-CB 3.36Å; E275-T279 PolarHBondContact O-N 3.3Å; E275-T279 PolarHBondContact O-OG1 2.9Å
276	F	89.9	Confident	88.9	Confident	74 Å²	74	71 Å²	71	33%	0.325	36%	0.356	S	S	.	.	H	α-helix	trans	-69.2	-45.2	177.9	-176.9	-103.5	0	0	0	111.2	I261 I265 I270 Q272 G273 C274 T279 V280	I261-F276 HydrophobicContact CG2-CE1 4.12Å; I261-F276 HydrophobicContact CG2-CZ 4.12Å; I265-F276 HydrophobicContact CD1-CD1 4.01Å; I265-F276 HydrophobicContact CD1-CE1 3.84Å; I265-F276 HydrophobicContact CG1-CE1 4.3Å; I270-F276 HydrophobicContact CG2-CE1 4.37Å; Q272-F276 HydrophobicContact CB-CB 3.79Å; Q272-F276 HydrophobicContact CB-CD1 3.63Å; Q272-F276 HydrophobicContact CB-CE1 4.43Å; Q272-F276 HydrophobicContact CB-CG 3.85Å; Q272-F276 HydrophobicContact CG-CD1 3.9Å; Q272-F276 HydrophobicContact CG-CE1 4.25Å; Q272-F276 HydrophobicContact CG-CG 4.17Å; G273-F276 WeakPolarHBondContact O-CB 3.38Å; G273-F276 PolarHBondContact O-N 3.19Å; C274-F276 VanDerWaalsContact C-N 3.25Å; C274-F276 PolarHBondContact O-N 3.12Å; F276-T279 WeakPolarHBondContact O-CB 3.29Å; F276-T279 PolarHBondContact O-N 3.49Å; F276-V280 HydrophobicContact CD1-CG2 4.26Å; F276-V280 HydrophobicContact CE1-CG2 3.94Å; F276-V280 HydrophobicContact CE2-CG2 4.47Å; F276-V280 HydrophobicContact CZ-CG2 4.05Å; F276-V280 WeakPolarHBondContact O-CG2 3.37Å; F276-V280 PolarHBondContact O-N 3.4Å
277	E	88.9	Confident	89.3	Confident	49 Å²	49	68.7 Å²	68.7	23%	0.229	35%	0.345	C	S	.	.	H	α-helix	trans	-61	-48.1	177.9	-57.8	-170.9	-179.4	0	0	111.5	I265 C274 T279 V280 H281	I265-E277 HydrophobicContact CD1-CG 4.35Å; I265-E277 HydrophobicContact CG2-CG 4Å; I265-E277 WeakPolarHBondContact CG2-OE1 3.24Å; C274-E277 PolarHBondContact O-N 3.06Å; E277-T279 VanDerWaalsContact C-N 3.26Å; E277-T279 PolarHBondContact O-N 3.14Å; E277-V280 PolarHBondContact O-N 2.8Å; E277-V280 VanDerWaalsContact O-N 3.1Å; E277-H281 PolarHBondContact O-N 3.36Å
278	N	87.4	Confident	89.6	Confident	32 Å²	32	66 Å²	66	17%	0.171	33%	0.329	C	S	.	.	H	α-helix	trans	-60	-37.7	176.4	-77	-24.2	0	0	0	111.8	F29 C274 K282	F29-N278 PolarHBondContact O-ND2 3.01Å; C274-N278 WeakPolarHBondContact O-CB 3.44Å; C274-N278 PolarHBondContact O-N 3.33Å; N278-K282 WeakPolarHBondContact O-CB 3.43Å; N278-K282 PolarHBondContact O-N 3.3Å; N278-K282 VanDerWaalsContact O-N 3.09Å
279	T	89.1	Confident	89.9	Confident	62 Å²	62	60.7 Å²	60.7	38%	0.38	31%	0.305	S	S	.	.	H	α-helix	trans	-65.3	-44.4	174.9	-63.7	0	0	0	0	111.5	E275 F276 E277 K282 W283	E275-T279 WeakPolarHBondContact O-CB 3.36Å; E275-T279 PolarHBondContact O-N 3.3Å; E275-T279 PolarHBondContact O-OG1 2.9Å; F276-T279 WeakPolarHBondContact O-CB 3.29Å; F276-T279 PolarHBondContact O-N 3.49Å; E277-T279 VanDerWaalsContact C-N 3.26Å; E277-T279 PolarHBondContact O-N 3.14Å; T279-K282 PolarHBondContact O-N 3.41Å; T279-W283 PolarHBondContact O-N 3.37Å
280	V	91.6	Very high	90.1	Very high	12 Å²	12	59 Å²	59	7%	0.073	30%	0.296	C	S	.	.	H	α-helix	trans	-60.5	-49.2	177.6	169.9	0	0	0	0	110.9	I261 D262 I265 F276 E277 K282 W283 I284	I261-V280 HydrophobicContact CB-CG1 4.5Å; I261-V280 HydrophobicContact CG2-CG1 4.2Å; I261-V280 HydrophobicContact CG2-CG2 3.78Å; D262-V280 HydrophobicContact CB-CG1 4.2Å; I265-V280 HydrophobicContact CD1-CB 4.48Å; I265-V280 HydrophobicContact CD1-CG1 4.47Å; I265-V280 HydrophobicContact CD1-CG2 4.2Å; F276-V280 HydrophobicContact CD1-CG2 4.26Å; F276-V280 HydrophobicContact CE1-CG2 3.94Å; F276-V280 HydrophobicContact CE2-CG2 4.47Å; F276-V280 HydrophobicContact CZ-CG2 4.05Å; F276-V280 WeakPolarHBondContact O-CG2 3.37Å; F276-V280 PolarHBondContact O-N 3.4Å; E277-V280 PolarHBondContact O-N 2.8Å; E277-V280 VanDerWaalsContact O-N 3.1Å; V280-K282 VanDerWaalsContact C-N 3.33Å; V280-K282 PolarHBondContact O-N 3.03Å; V280-W283 PolarHBondContact O-N 3.13Å; V280-W283 VanDerWaalsContact O-N 3.15Å; V280-I284 HydrophobicContact CG1-CD1 3.8Å; V280-I284 HydrophobicContact CG1-CG1 4.39Å; V280-I284 WeakPolarHBondContact O-CG1 3.35Å; V280-I284 PolarHBondContact O-N 2.85Å
281	H	88.8	Confident	90.5	Very high	49 Å²	49	56.3 Å²	56.3	23%	0.227	28%	0.283	C	S	.	.	H	α-helix	trans	-61.8	-38.7	179.1	-69.6	169.5	0	0	0	113.3	D262 E277 I284 S285	D262-H281 IonicContact OD1-CD2 3.15Å; D262-H281 PolarHBondContact OD1-CD2 2.99Å; D262-H281 IonicContact OD1-NE2 3Å; D262-H281 PolarHBondContact OD1-NE2 2.86Å; E277-H281 PolarHBondContact O-N 3.36Å; H281-I284 PolarHBondContact O-N 3.36Å; H281-S285 PolarHBondContact O-N 2.87Å; H281-S285 VanDerWaalsContact O-N 3.14Å; H281-S285 PolarHBondContact O-OG 2.88Å
282	K	88.1	Confident	90.9	Very high	60 Å²	60	49.5 Å²	49.5	26%	0.261	25%	0.253	S	S	.	.	H	α-helix	trans	-60.1	-48.7	173	177.4	-177.5	178	178.4	0	111.2	N33 N278 T279 V280 S285 I286	N33-K282 HydrophobicContact CB-CD 4.28Å; N278-K282 WeakPolarHBondContact O-CB 3.43Å; N278-K282 PolarHBondContact O-N 3.3Å; N278-K282 VanDerWaalsContact O-N 3.09Å; T279-K282 PolarHBondContact O-N 3.41Å; V280-K282 VanDerWaalsContact C-N 3.33Å; V280-K282 PolarHBondContact O-N 3.03Å; K282-S285 PolarHBondContact O-N 2.7Å; K282-I286 HydrophobicContact CG-CD1 3.98Å; K282-I286 WeakPolarHBondContact O-CG1 3.28Å; K282-I286 PolarHBondContact O-N 3.38Å; K282-I286 VanDerWaalsContact O-N 3.09Å
283	W	91.7	Very high	91.2	Very high	151 Å²	151	46.9 Å²	46.9	57%	0.572	24%	0.24	S	C	*	.	H	α-helix	trans	-67.3	-34.2	179.7	-83.2	104.4	0	0	0	112.9	T279 V280 S285 I286 T287	T279-W283 PolarHBondContact O-N 3.37Å; V280-W283 PolarHBondContact O-N 3.13Å; V280-W283 VanDerWaalsContact O-N 3.15Å; W283-S285 VanDerWaalsContact C-N 3.34Å; W283-S285 PolarHBondContact O-N 2.94Å; W283-I286 HydrophobicContact CE3-CG2 4.42Å; W283-I286 PolarHBondContact O-N 3.28Å; W283-T287 HydrophobicContact CE3-CG2 4.32Å; W283-T287 VanDerWaalsContact O-CB 3.32Å; W283-T287 WeakPolarHBondContact O-CB 3.42Å; W283-T287 VanDerWaalsContact O-CG2 3.28Å; W283-T287 WeakPolarHBondContact O-CG2 3.42Å; W283-T287 PolarHBondContact O-N 3.21Å; W283-T287 PolarHBondContact O-OG1 2.91Å
284	I	93.2	Very high	91.5	Very high	21 Å²	21	44.5 Å²	44.5	11%	0.108	22%	0.215	C	C	.	.	H	α-helix	trans	-58	-48.7	172.2	-71.9	168.2	0	0	0	110.1	Y255 I259 D262 V280 H281 I286 T287 E288	Y255-I284 HydrophobicContact CD2-CG2 4.22Å; Y255-I284 HydrophobicContact CE2-CG2 3.9Å; I259-I284 HydrophobicContact CG2-CD1 4.38Å; I259-I284 HydrophobicContact CG2-CG1 4.46Å; I259-I284 HydrophobicContact CG2-CG2 4.17Å; D262-I284 HydrophobicContact CB-CD1 3.8Å; V280-I284 HydrophobicContact CG1-CD1 3.8Å; V280-I284 HydrophobicContact CG1-CG1 4.39Å; V280-I284 WeakPolarHBondContact O-CG1 3.35Å; V280-I284 PolarHBondContact O-N 2.85Å; H281-I284 PolarHBondContact O-N 3.36Å; I284-I286 PolarHBondContact O-N 3.14Å; I284-T287 PolarHBondContact O-N 2.82Å; I284-T287 PolarHBondContact O-OG1 3.33Å; I284-T287 VanDerWaalsContact O-OG1 3.13Å; I284-E288 VanDerWaalsContact O-CB 3.24Å; I284-E288 WeakPolarHBondContact O-CB 3.32Å; I284-E288 PolarHBondContact O-N 3.15Å
285	S	91.6	Very high	91.8	Very high	28 Å²	28	42.8 Å²	42.8	20%	0.196	20%	0.204	C	C	.	.	H	α-helix	trans	-60.2	-44.3	178.7	-53.6	0	0	0	0	112.2	H281 K282 W283 A289	H281-S285 PolarHBondContact O-N 2.87Å; H281-S285 VanDerWaalsContact O-N 3.14Å; H281-S285 PolarHBondContact O-OG 2.88Å; K282-S285 PolarHBondContact O-N 2.7Å; W283-S285 VanDerWaalsContact C-N 3.34Å; W283-S285 PolarHBondContact O-N 2.94Å; S285-A289 PolarHBondContact O-N 3.03Å; S285-A289 VanDerWaalsContact O-N 3.14Å
286	I	92	Very high	91.8	Very high	14 Å²	14	35.3 Å²	35.3	7%	0.072	17%	0.169	C	C	.	.	H	α-helix	trans	-64.8	-49.5	178.9	-69	168.5	0	0	0	110.9	F36 F40 K282 W283 I284 E288 A289 L290	F36-I286 HydrophobicContact CD1-CD1 4.27Å; F36-I286 HydrophobicContact CE1-CD1 3.68Å; F36-I286 HydrophobicContact CE1-CG1 4.13Å; F40-I286 HydrophobicContact CD1-CG1 4.24Å; F40-I286 HydrophobicContact CE1-CB 4.23Å; F40-I286 HydrophobicContact CE1-CG1 4.16Å; F40-I286 HydrophobicContact CE1-CG2 3.83Å; F40-I286 HydrophobicContact CZ-CG2 4.05Å; K282-I286 HydrophobicContact CG-CD1 3.98Å; K282-I286 WeakPolarHBondContact O-CG1 3.28Å; K282-I286 PolarHBondContact O-N 3.38Å; K282-I286 VanDerWaalsContact O-N 3.09Å; W283-I286 HydrophobicContact CE3-CG2 4.42Å; W283-I286 PolarHBondContact O-N 3.28Å; I284-I286 PolarHBondContact O-N 3.14Å; I286-E288 VanDerWaalsContact C-N 3.35Å; I286-A289 PolarHBondContact O-N 2.74Å; I286-L290 HydrophobicContact CG2-CD1 4.11Å; I286-L290 WeakPolarHBondContact O-CG 3.27Å; I286-L290 PolarHBondContact O-N 3.29Å
287	T	95.6	Very high	91.4	Very high	15 Å²	15	33.9 Å²	33.9	9%	0.092	17%	0.165	C	C	.	.	H	α-helix	trans	-69.4	-33.5	-176.5	53.1	0	0	0	0	112	P254 Y255 W283 I284 L290 A291	P254-T287 HydrophobicContact CB-CG2 3.52Å; Y255-T287 WeakPolarHBondContact CA-OG1 3.35Å; W283-T287 HydrophobicContact CE3-CG2 4.32Å; W283-T287 VanDerWaalsContact O-CB 3.32Å; W283-T287 WeakPolarHBondContact O-CB 3.42Å; W283-T287 VanDerWaalsContact O-CG2 3.28Å; W283-T287 WeakPolarHBondContact O-CG2 3.42Å; W283-T287 PolarHBondContact O-N 3.21Å; W283-T287 PolarHBondContact O-OG1 2.91Å; I284-T287 PolarHBondContact O-N 2.82Å; I284-T287 PolarHBondContact O-OG1 3.33Å; I284-T287 VanDerWaalsContact O-OG1 3.13Å; T287-L290 PolarHBondContact O-N 3.41Å; T287-A291 WeakPolarHBondContact O-CB 3.32Å; T287-A291 PolarHBondContact O-N 3.32Å
288	E	94.9	Very high	90.8	Very high	30 Å²	30	31.8 Å²	31.8	14%	0.14	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-49.7	171.5	-173.9	166.8	-138.9	0	0	111.6	Y116 Y255 I284 I286 L290 A291 F292	Y116-E288 WeakPolarHBondContact CE2-OE1 3.35Å; Y116-E288 PolarHBondContact OH-OE1 2.85Å; Y255-E288 HydrophobicContact CD2-CB 3.52Å; Y255-E288 HydrophobicContact CD2-CG 4.08Å; Y255-E288 HydrophobicContact CE2-CB 3.66Å; Y255-E288 HydrophobicContact CE2-CG 3.84Å; Y255-E288 HydrophobicContact CG-CB 4.47Å; Y255-E288 PolarHBondContact OH-OE1 3Å; I284-E288 VanDerWaalsContact O-CB 3.24Å; I284-E288 WeakPolarHBondContact O-CB 3.32Å; I284-E288 PolarHBondContact O-N 3.15Å; I286-E288 VanDerWaalsContact C-N 3.35Å; E288-L290 PolarHBondContact O-N 3.24Å; E288-A291 WeakPolarHBondContact O-CB 3.24Å; E288-A291 PolarHBondContact O-N 3.42Å; E288-F292 HydrophobicContact CG-CE1 3.89Å; E288-F292 HydrophobicContact CG-CE2 4.47Å; E288-F292 HydrophobicContact CG-CZ 3.68Å; E288-F292 PolarHBondContact O-N 3.12Å
289	A	94.5	Very high	90.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-60.5	-37.8	178.3	0	0	0	0	0	111.8	L41 I44 Y45 I48 S285 I286 F292	L41-A289 HydrophobicContact CD2-CB 3.67Å; I44-A289 HydrophobicContact CB-CB 4.45Å; I44-A289 HydrophobicContact CG2-CB 4.02Å; I44-A289 WeakPolarHBondContact CG2-O 3.19Å; Y45-A289 HydrophobicContact CD1-CB 4.43Å; Y45-A289 HydrophobicContact CE1-CB 3.68Å; I48-A289 WeakPolarHBondContact CD1-O 3.41Å; S285-A289 PolarHBondContact O-N 3.03Å; S285-A289 VanDerWaalsContact O-N 3.14Å; I286-A289 PolarHBondContact O-N 2.74Å; A289-F292 PolarHBondContact O-N 2.95Å
290	L	94.1	Very high	89.9	Confident	74 Å²	74	31.8 Å²	31.8	39%	0.387	15%	0.153	S	C	.	.	H	α-helix	trans	-70	-31.4	173.8	-68.5	177	0	0	0	112.8	F40 I44 I286 T287 E288 F292 F293	F40-L290 HydrophobicContact CZ-CD2 4.19Å; F40-L290 HydrophobicContact CZ-CG 4.34Å; I44-L290 HydrophobicContact CD1-CD2 4.45Å; I286-L290 HydrophobicContact CG2-CD1 4.11Å; I286-L290 WeakPolarHBondContact O-CG 3.27Å; I286-L290 PolarHBondContact O-N 3.29Å; T287-L290 PolarHBondContact O-N 3.41Å; E288-L290 PolarHBondContact O-N 3.24Å; L290-F292 PolarHBondContact O-N 2.96Å; L290-F293 HydrophobicContact CD2-CD2 4.28Å; L290-F293 HydrophobicContact CD2-CE2 3.96Å; L290-F293 WeakPolarHBondContact O-CB 3.29Å; L290-F293 WeakPolarHBondContact O-CD2 3.42Å; L290-F293 PolarHBondContact O-N 2.81Å
291	A	95	Very high	88.9	Confident	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.155	C	C	.	.	H	α-helix	trans	-64.1	-30.1	177.4	0	0	0	0	0	112.1	C251 W252 T287 E288 F293 H294	C251-A291 WeakPolarHBondContact O-CA 3.4Å; C251-A291 WeakPolarHBondContact O-CB 3.4Å; W252-A291 HydrophobicContact CD2-CB 3.77Å; W252-A291 HydrophobicContact CE3-CB 3.79Å; W252-A291 HydrophobicContact CG-CB 4.25Å; W252-A291 HydrophobicContact CH2-CB 4.29Å; W252-A291 HydrophobicContact CZ2-CB 4.31Å; W252-A291 HydrophobicContact CZ3-CB 4.06Å; T287-A291 WeakPolarHBondContact O-CB 3.32Å; T287-A291 PolarHBondContact O-N 3.32Å; E288-A291 WeakPolarHBondContact O-CB 3.24Å; E288-A291 PolarHBondContact O-N 3.42Å; A291-F293 PolarHBondContact O-N 3.43Å; A291-F293 VanDerWaalsContact O-N 3.12Å; A291-H294 WeakPolarHBondContact O-CB 3.21Å; A291-H294 PolarHBondContact O-N 3.45Å; A291-H294 VanDerWaalsContact O-N 3.08Å; A291-H294 PolarHBondContact O-ND1 3.34Å
292	F	95.1	Very high	87.9	Confident	1 Å²	1	30.2 Å²	30.2	0%	0.004	15%	0.145	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.6	-16.4	176.6	-61.7	-16.2	0	0	0	114	Y45 I48 F87 L91 Y116 W252 E288 A289 L290 H294 C295	Y45-F292 AromaticContact CD1-CD2 4Å; Y45-F292 HydrophobicContact CD1-CD2 4Å; Y45-F292 HydrophobicContact CD1-CE2 4.22Å; Y45-F292 AromaticContact CE1-CD2 3.7Å; Y45-F292 HydrophobicContact CE1-CD2 3.7Å; Y45-F292 AromaticContact CE1-CE2 3.56Å; Y45-F292 HydrophobicContact CE1-CE2 3.56Å; I48-F292 HydrophobicContact CD1-CB 3.51Å; I48-F292 HydrophobicContact CG2-CB 4.33Å; F87-F292 HydrophobicContact CE1-CB 4.1Å; F87-F292 AromaticContact CE1-CD1 3.76Å; F87-F292 HydrophobicContact CE1-CD1 3.76Å; F87-F292 HydrophobicContact CE1-CD2 4.09Å; F87-F292 HydrophobicContact CE1-CE1 4.21Å; F87-F292 HydrophobicContact CE1-CE2 4.49Å; F87-F292 AromaticContact CE1-CG 3.71Å; F87-F292 HydrophobicContact CE1-CG 3.71Å; F87-F292 HydrophobicContact CE2-CZ 4.41Å; F87-F292 AromaticContact CZ-CD1 3.65Å; F87-F292 HydrophobicContact CZ-CD1 3.65Å; F87-F292 AromaticContact CZ-CD2 3.73Å; F87-F292 HydrophobicContact CZ-CD2 3.73Å; F87-F292 AromaticContact CZ-CE1 3.63Å; F87-F292 HydrophobicContact CZ-CE1 3.63Å; F87-F292 AromaticContact CZ-CE2 3.7Å; F87-F292 HydrophobicContact CZ-CE2 3.7Å; F87-F292 AromaticContact CZ-CG 3.72Å; F87-F292 HydrophobicContact CZ-CG 3.72Å; F87-F292 AromaticContact CZ-CZ 3.65Å; F87-F292 HydrophobicContact CZ-CZ 3.65Å; L91-F292 HydrophobicContact CD2-CD2 3.95Å; L91-F292 HydrophobicContact CD2-CE2 4.24Å; Y116-F292 HydrophobicContact CD2-CE1 4.12Å; Y116-F292 HydrophobicContact CD2-CZ 4.09Å; Y116-F292 AromaticContact CE2-CE1 3.62Å; Y116-F292 HydrophobicContact CE2-CE1 3.62Å; Y116-F292 AromaticContact CE2-CZ 3.73Å; Y116-F292 HydrophobicContact CE2-CZ 3.73Å; W252-F292 HydrophobicContact CH2-CD1 4.42Å; W252-F292 HydrophobicContact CH2-CE1 4.22Å; E288-F292 HydrophobicContact CG-CE1 3.89Å; E288-F292 HydrophobicContact CG-CE2 4.47Å; E288-F292 HydrophobicContact CG-CZ 3.68Å; E288-F292 PolarHBondContact O-N 3.12Å; A289-F292 PolarHBondContact O-N 2.95Å; L290-F292 PolarHBondContact O-N 2.96Å; F292-H294 PolarHBondContact O-N 2.97Å; F292-C295 WeakPolarHBondContact O-CB 3.4Å; F292-C295 PolarHBondContact O-N 2.92Å
293	F	93.8	Very high	86.9	Confident	62 Å²	62	29 Å²	29	27%	0.272	15%	0.147	S	C	.	.	T	Hydrogen-bonded Turn	trans	-59.2	-19.2	171.5	-83.8	-86	0	0	0	112.9	I44 I47 I48 L290 A291 C295 C296 L297	I44-F293 HydrophobicContact CD1-CE2 4.19Å; I44-F293 HydrophobicContact CD1-CZ 4.36Å; I44-F293 HydrophobicContact CG2-CE2 3.81Å; I44-F293 HydrophobicContact CG2-CZ 4.49Å; I47-F293 HydrophobicContact CG2-CE1 4.22Å; I47-F293 HydrophobicContact CG2-CZ 4.3Å; I48-F293 HydrophobicContact CD1-CD2 3.79Å; I48-F293 HydrophobicContact CD1-CE2 3.95Å; I48-F293 HydrophobicContact CD1-CG 4.17Å; I48-F293 HydrophobicContact CD1-CZ 4.43Å; I48-F293 HydrophobicContact CG1-CD1 4.27Å; I48-F293 HydrophobicContact CG1-CD2 4.24Å; I48-F293 HydrophobicContact CG1-CE1 4.21Å; I48-F293 HydrophobicContact CG1-CE2 4.19Å; I48-F293 HydrophobicContact CG1-CG 4.29Å; I48-F293 HydrophobicContact CG1-CZ 4.17Å; L290-F293 HydrophobicContact CD2-CD2 4.28Å; L290-F293 HydrophobicContact CD2-CE2 3.96Å; L290-F293 WeakPolarHBondContact O-CB 3.29Å; L290-F293 WeakPolarHBondContact O-CD2 3.42Å; L290-F293 PolarHBondContact O-N 2.81Å; A291-F293 PolarHBondContact O-N 3.43Å; A291-F293 VanDerWaalsContact O-N 3.12Å; F293-C295 PolarHBondContact O-N 3.48Å; F293-C296 PolarHBondContact O-N 2.96Å; F293-L297 WeakPolarHBondContact O-CG 3.35Å; F293-L297 PolarHBondContact O-N 3Å; F293-L297 VanDerWaalsContact O-N 3.13Å
294	H	92.5	Very high	85.5	Confident	1 Å²	1	29.1 Å²	29.1	1%	0.005	15%	0.152	C	C	.	.	H	α-helix	trans	-54.4	-33.4	172.8	84.2	-86	0	0	0	112.9	D84 N119 F248 C251 W252 A291 F292 C296 L297 N298	D84-H294 IonicContact OD1-NE2 3.91Å; N119-H294 PolarHBondContact OD1-NE2 3.04Å; F248-H294 HydrophobicContact CD2-CB 4.02Å; F248-H294 AromaticContact CD2-CD2 3.82Å; F248-H294 HydrophobicContact CE2-CB 4.42Å; F248-H294 AromaticContact CE2-CD2 3.55Å; C251-H294 HydrophobicContact CB-CB 4.27Å; W252-H294 AromaticContact CE2-CE1 3.9Å; W252-H294 AromaticContact CE2-ND1 3.72Å; W252-H294 AromaticContact CZ2-CE1 3.58Å; W252-H294 AromaticContact CZ2-ND1 3.76Å; W252-H294 AromaticContact NE1-CD2 4Å; W252-H294 AromaticContact NE1-CE1 3.61Å; W252-H294 AromaticContact NE1-CG 3.48Å; W252-H294 AromaticContact NE1-ND1 3.21Å; W252-H294 PolarHBondContact NE1-ND1 3.36Å; A291-H294 WeakPolarHBondContact O-CB 3.21Å; A291-H294 PolarHBondContact O-N 3.45Å; A291-H294 VanDerWaalsContact O-N 3.08Å; A291-H294 PolarHBondContact O-ND1 3.34Å; F292-H294 PolarHBondContact O-N 2.97Å; H294-C296 PolarHBondContact O-N 2.96Å; H294-L297 PolarHBondContact O-N 2.69Å; H294-N298 PolarHBondContact O-ND2 3.4Å
295	C	92.3	Very high	83.7	Confident	0 Å²	0	30.6 Å²	30.6	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-64.6	-25.3	176	-61.2	0	0	0	0	112.9	N56 D84 V88 F292 F293	N56-C295 PolarHBondContact ND2-O 3.44Å; D84-C295 HydrophobicContact CB-CB 4.06Å; D84-C295 PolarHBondContact OD1-SG 2.95Å; D84-C295 VanDerWaalsContact OD1-SG 3.35Å; V88-C295 HydrophobicContact CG2-CB 3.82Å; F292-C295 WeakPolarHBondContact O-CB 3.4Å; F292-C295 PolarHBondContact O-N 2.92Å; F293-C295 PolarHBondContact O-N 3.48Å
296	C	88	Confident	82.2	Confident	6 Å²	6	30.3 Å²	30.3	4%	0.041	16%	0.161	C	C	.	.	H	α-helix	trans	-94.9	-21.6	-179.3	-58.5	0	0	0	0	112.7	T51 F293 H294 N298 P299 I300	T51-C296 PolarHBondContact OG1-SG 3.43Å; F293-C296 PolarHBondContact O-N 2.96Å; H294-C296 PolarHBondContact O-N 2.96Å; C296-N298 PolarHBondContact O-N 3.05Å; C296-P299 WeakPolarHBondContact O-CD 3.49Å; C296-I300 WeakPolarHBondContact O-CD1 3.33Å; C296-I300 VanDerWaalsContact O-CG1 3.29Å; C296-I300 WeakPolarHBondContact O-CG1 3.39Å
297	L	80.3	Confident	80.5	Confident	44 Å²	44	32.8 Å²	32.8	23%	0.23	18%	0.183	C	C	.	.	H	α-helix	trans	-67.5	-34.9	-179.4	-71.2	174.9	0	0	0	112.3	A247 C251 F293 H294 I300 L301	A247-L297 HydrophobicContact CB-CD1 3.71Å; C251-L297 VanDerWaalsContact SG-CD1 3.5Å; F293-L297 WeakPolarHBondContact O-CG 3.35Å; F293-L297 PolarHBondContact O-N 3Å; F293-L297 VanDerWaalsContact O-N 3.13Å; H294-L297 PolarHBondContact O-N 2.69Å; L297-I300 PolarHBondContact O-N 3.37Å; L297-L301 HydrophobicContact CB-CD1 4.45Å; L297-L301 VanDerWaalsContact O-CB 3.32Å; L297-L301 WeakPolarHBondContact O-CB 3.08Å; L297-L301 WeakPolarHBondContact O-CG 3.05Å; L297-L301 PolarHBondContact O-N 2.87Å
298	N	77.9	Confident	78.9	Confident	6 Å²	6	40.8 Å²	40.8	3%	0.032	22%	0.217	C	C	.	.	H	α-helix	trans	-60.1	-54.8	-176.2	-60.8	-42.2	0	0	0	112.3	L80 D84 L244 H294 C296 I300 L301 Y302	L80-N298 HydrophobicContact CD2-CB 4.24Å; L80-N298 VanDerWaalsContact CD2-CG 3.45Å; L80-N298 VanDerWaalsContact CD2-ND2 3.28Å; L80-N298 WeakPolarHBondContact CD2-ND2 3.34Å; L80-N298 WeakPolarHBondContact CG-ND2 3.38Å; D84-N298 PolarHBondContact OD2-ND2 3.41Å; L244-N298 WeakPolarHBondContact CD1-OD1 3.36Å; H294-N298 PolarHBondContact O-ND2 3.4Å; C296-N298 PolarHBondContact O-N 3.05Å; N298-I300 PolarHBondContact O-N 3.09Å; N298-L301 PolarHBondContact O-N 3.01Å; N298-Y302 HydrophobicContact CB-CE2 4.09Å; N298-Y302 WeakPolarHBondContact O-CD2 3.43Å; N298-Y302 WeakPolarHBondContact O-CE2 3.41Å; N298-Y302 PolarHBondContact O-N 3.04Å; N298-Y302 VanDerWaalsContact O-N 3.14Å
299	P	80.8	Confident	77.2	Confident	12 Å²	12	40.8 Å²	40.8	8%	0.078	22%	0.216	C	C	.	.	H	α-helix	trans	-60.5	-41.9	175.4	-24.4	34.8	0	0	0	114	N56 V59 C296 Y302 A303	N56-P299 WeakPolarHBondContact OD1-CG 3.4Å; V59-P299 HydrophobicContact CG2-CB 4.06Å; V59-P299 HydrophobicContact CG2-CG 4.19Å; C296-P299 WeakPolarHBondContact O-CD 3.49Å; P299-Y302 PolarHBondContact O-N 3.34Å; P299-A303 WeakPolarHBondContact O-CB 3.31Å; P299-A303 PolarHBondContact O-N 3.35Å
300	I	75.8	Confident	75.9	Confident	81 Å²	81	45.8 Å²	45.8	42%	0.415	24%	0.238	S	C	.	.	H	α-helix	trans	-59.7	-50.9	179.8	-70.4	173	0	0	0	109.8	C296 L297 N298 Y302 A303 F304	C296-I300 WeakPolarHBondContact O-CD1 3.33Å; C296-I300 VanDerWaalsContact O-CG1 3.29Å; C296-I300 WeakPolarHBondContact O-CG1 3.39Å; L297-I300 PolarHBondContact O-N 3.37Å; N298-I300 PolarHBondContact O-N 3.09Å; I300-Y302 VanDerWaalsContact C-N 3.26Å; I300-Y302 PolarHBondContact O-N 2.92Å; I300-A303 PolarHBondContact O-N 2.95Å; I300-F304 HydrophobicContact CG2-CD2 3.71Å; I300-F304 HydrophobicContact CG2-CE2 3.88Å; I300-F304 WeakPolarHBondContact O-CD2 3.25Å; I300-F304 PolarHBondContact O-N 3.43Å
301	L	70.3	Confident	74.6	Confident	24 Å²	24	45.6 Å²	45.6	13%	0.126	24%	0.24	C	C	.	.	H	α-helix	trans	-61.8	-35.2	179.9	-69.9	174.3	0	0	0	111.8	I243 L244 L297 N298 L305	I243-L301 HydrophobicContact CG2-CD1 4.23Å; I243-L301 HydrophobicContact CG2-CD2 3.56Å; L244-L301 HydrophobicContact CB-CD1 3.87Å; L244-L301 HydrophobicContact CD1-CD1 4.23Å; L244-L301 HydrophobicContact CG-CD1 3.95Å; L297-L301 HydrophobicContact CB-CD1 4.45Å; L297-L301 VanDerWaalsContact O-CB 3.32Å; L297-L301 WeakPolarHBondContact O-CB 3.08Å; L297-L301 WeakPolarHBondContact O-CG 3.05Å; L297-L301 PolarHBondContact O-N 2.87Å; N298-L301 PolarHBondContact O-N 3.01Å; L301-L305 HydrophobicContact CB-CD1 4.32Å; L301-L305 HydrophobicContact CD2-CD1 3.96Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 WeakPolarHBondContact O-CG 3.27Å; L301-L305 PolarHBondContact O-N 3.09Å
302	Y	68.8	Low	73.2	Confident	4 Å²	4	46.5 Å²	46.5	2%	0.016	25%	0.247	C	C	.	.	H	α-helix	trans	-71.9	-41	175.2	-56	-26.8	0	0	0	112.8	V59 R77 L244 N298 P299 I300 F304 G306	V59-Y302 HydrophobicContact CG2-CD2 4.24Å; R77-Y302 HydrophobicContact CB-CE2 3.95Å; R77-Y302 VanDerWaalsContact CD-CZ 3.47Å; R77-Y302 HydrophobicContact CG-CE1 4.1Å; R77-Y302 HydrophobicContact CG-CE2 3.78Å; R77-Y302 VanDerWaalsContact CG-CZ 3.49Å; R77-Y302 WeakPolarHBondContact CG-OH 3.32Å; L244-Y302 HydrophobicContact CD1-CE1 3.61Å; L244-Y302 VanDerWaalsContact CD1-OH 3.28Å; L244-Y302 WeakPolarHBondContact CD1-OH 3.39Å; N298-Y302 HydrophobicContact CB-CE2 4.09Å; N298-Y302 WeakPolarHBondContact O-CD2 3.43Å; N298-Y302 WeakPolarHBondContact O-CE2 3.41Å; N298-Y302 PolarHBondContact O-N 3.04Å; N298-Y302 VanDerWaalsContact O-N 3.14Å; P299-Y302 PolarHBondContact O-N 3.34Å; I300-Y302 VanDerWaalsContact C-N 3.26Å; I300-Y302 PolarHBondContact O-N 2.92Å; Y302-F304 VanDerWaalsContact C-N 3.35Å; Y302-F304 PolarHBondContact O-N 2.81Å; Y302-G306 WeakPolarHBondContact O-CA 3.48Å; Y302-G306 PolarHBondContact O-N 2.03Å
303	A	67.1	Low	71.8	Confident	36 Å²	36	47 Å²	47	30%	0.298	25%	0.251	S	S	.	.	H	α-helix	trans	-60.9	-43.8	176.6	0	0	0	0	0	111.1	P299 I300 K310	P299-A303 WeakPolarHBondContact O-CB 3.31Å; P299-A303 PolarHBondContact O-N 3.35Å; I300-A303 PolarHBondContact O-N 2.95Å; A303-K310 WeakPolarHBondContact O-CE 3.34Å; A303-K310 WeakPolarHBondContact O-CG 3.45Å
304	F	61.2	Low	70.9	Confident	153 Å²	153	50.2 Å²	50.2	67%	0.671	27%	0.267	S	S	*	.	H	α-helix	trans	-85	-35.1	-176.9	-70.2	-72.8	0	0	0	114.3	I300 Y302	I300-F304 HydrophobicContact CG2-CD2 3.71Å; I300-F304 HydrophobicContact CG2-CE2 3.88Å; I300-F304 WeakPolarHBondContact O-CD2 3.25Å; I300-F304 PolarHBondContact O-N 3.43Å; Y302-F304 VanDerWaalsContact C-N 3.35Å; Y302-F304 PolarHBondContact O-N 2.81Å
305	L	57.2	Low	70	Confident	51 Å²	51	56 Å²	56	27%	0.267	29%	0.294	S	S	.	.	H	α-helix	trans	-97.2	-17.6	-174.6	-57.9	167.8	0	0	0	113.8	T240 I243 L301	T240-L305 HydrophobicContact CG2-CB 4.17Å; T240-L305 HydrophobicContact CG2-CD1 3.97Å; I243-L305 HydrophobicContact CD1-CD1 4.1Å; L301-L305 HydrophobicContact CB-CD1 4.32Å; L301-L305 HydrophobicContact CD2-CD1 3.96Å; L301-L305 WeakPolarHBondContact O-CB 3.46Å; L301-L305 WeakPolarHBondContact O-CG 3.27Å; L301-L305 PolarHBondContact O-N 3.09Å
306	G	59.8	Low	68.9	Low	23 Å²	23	56.6 Å²	56.6	24%	0.237	30%	0.298	C	S	.	.			trans	-100	89.5	-176.5	0	0	0	0	0	113.7	Y302 K308 F309 K310	Y302-G306 WeakPolarHBondContact O-CA 3.48Å; Y302-G306 PolarHBondContact O-N 2.03Å; G306-K308 PolarHBondContact O-N 3.29Å; G306-F309 WeakPolarHBondContact O-CB 2.95Å; G306-F309 PolarHBondContact O-N 3.22Å; G306-K310 PolarHBondContact O-N 2.92Å
307	A	56.5	Low	68.2	Low	65 Å²	65	61.2 Å²	61.2	54%	0.537	32%	0.322	S	S	.	.	H	α-helix	trans	-54.5	-37.4	174.2	0	0	0	0	0	112.7	F309 K310 T311	A307-F309 PolarHBondContact O-N 3.05Å; A307-K310 PolarHBondContact O-N 2.83Å; A307-T311 PolarHBondContact O-N 3.14Å; A307-T311 PolarHBondContact O-OG1 2.79Å
308	K	60.6	Low	67.8	Low	184 Å²	184	62.9 Å²	62.9	80%	0.8	33%	0.334	S	S	*	.	H	α-helix	trans	-66.5	-33.2	175.2	-68.4	-170.3	176.4	-173	0	113.2	G306 S312	G306-K308 PolarHBondContact O-N 3.29Å; K308-S312 VanDerWaalsContact O-CB 3.23Å; K308-S312 WeakPolarHBondContact O-CB 3.3Å; K308-S312 PolarHBondContact O-N 3.3Å; K308-S312 VanDerWaalsContact O-N 3.14Å; K308-S312 PolarHBondContact O-OG 3.03Å
309	F	60.2	Low	67.1	Low	29 Å²	29	65.3 Å²	65.3	13%	0.127	35%	0.352	C	S	.	.	H	α-helix	trans	-71.9	-39.8	179.5	-172.8	-97.6	0	0	0	111	V59 V62 G306 A307 T311 S312 A313	V59-F309 HydrophobicContact CG2-CE2 4.42Å; V59-F309 HydrophobicContact CG2-CZ 3.98Å; V62-F309 HydrophobicContact CB-CE2 4.02Å; V62-F309 HydrophobicContact CB-CZ 4.33Å; V62-F309 HydrophobicContact CG1-CD2 4.2Å; V62-F309 HydrophobicContact CG1-CE2 3.81Å; V62-F309 HydrophobicContact CG1-CZ 4.43Å; V62-F309 HydrophobicContact CG2-CZ 4.37Å; G306-F309 WeakPolarHBondContact O-CB 2.95Å; G306-F309 PolarHBondContact O-N 3.22Å; A307-F309 PolarHBondContact O-N 3.05Å; F309-T311 PolarHBondContact O-N 2.97Å; F309-S312 WeakPolarHBondContact O-CB 3.49Å; F309-S312 PolarHBondContact O-N 3.1Å; F309-A313 WeakPolarHBondContact O-CB 3.05Å; F309-A313 PolarHBondContact O-N 3.03Å
310	K	66.4	Low	66	Low	105 Å²	105	67.6 Å²	67.6	46%	0.457	37%	0.365	S	S	.	.	H	α-helix	trans	-57.2	-51.5	175.5	-67.8	-170.4	179.5	-171.8	0	112.4	A303 G306 A307 S312 A313 Q314	A303-K310 WeakPolarHBondContact O-CE 3.34Å; A303-K310 WeakPolarHBondContact O-CG 3.45Å; G306-K310 PolarHBondContact O-N 2.92Å; A307-K310 PolarHBondContact O-N 2.83Å; K310-S312 VanDerWaalsContact C-N 3.3Å; K310-S312 PolarHBondContact O-N 3.04Å; K310-A313 PolarHBondContact O-N 3.29Å; K310-Q314 WeakPolarHBondContact O-CG 3.37Å; K310-Q314 PolarHBondContact O-N 3.01Å
311	T	66.2	Low	65.1	Low	71 Å²	71	67.3 Å²	67.3	44%	0.436	37%	0.371	S	S	.	.	H	α-helix	trans	-62.6	-40.6	178.6	-46	0	0	0	0	111.2	A307 F309 Q314 H315	A307-T311 PolarHBondContact O-N 3.14Å; A307-T311 PolarHBondContact O-OG1 2.79Å; F309-T311 PolarHBondContact O-N 2.97Å; T311-Q314 PolarHBondContact O-N 3.43Å; T311-H315 PolarHBondContact O-CD2 3Å; T311-H315 PolarHBondContact O-N 3.42Å
312	S	65.9	Low	64.3	Low	19 Å²	19	75.4 Å²	75.4	13%	0.133	40%	0.399	C	S	.	.	H	α-helix	trans	-64.9	-42.3	178.5	-63.5	0	0	0	0	113.2	Q66 K308 F309 K310 H315 A316	Q66-S312 VanDerWaalsContact CD-CB 3.49Å; Q66-S312 PolarHBondContact NE2-OG 3.28Å; Q66-S312 PolarHBondContact OE1-OG 3.09Å; K308-S312 VanDerWaalsContact O-CB 3.23Å; K308-S312 WeakPolarHBondContact O-CB 3.3Å; K308-S312 PolarHBondContact O-N 3.3Å; K308-S312 VanDerWaalsContact O-N 3.14Å; K308-S312 PolarHBondContact O-OG 3.03Å; F309-S312 WeakPolarHBondContact O-CB 3.49Å; F309-S312 PolarHBondContact O-N 3.1Å; K310-S312 VanDerWaalsContact C-N 3.3Å; K310-S312 PolarHBondContact O-N 3.04Å; S312-H315 PolarHBondContact O-N 3.49Å; S312-A316 WeakPolarHBondContact O-CB 3.21Å; S312-A316 PolarHBondContact O-N 3.45Å
313	A	67	Low	63.5	Low	12 Å²	12	77.1 Å²	77.1	10%	0.099	42%	0.418	C	S	.	.	H	α-helix	trans	-64.7	-42.4	176	0	0	0	0	0	111.2	V62 F309 K310 H315 A316 L317	V62-A313 HydrophobicContact CG2-CB 4.11Å; F309-A313 WeakPolarHBondContact O-CB 3.05Å; F309-A313 PolarHBondContact O-N 3.03Å; K310-A313 PolarHBondContact O-N 3.29Å; A313-H315 PolarHBondContact O-N 2.75Å; A313-A316 PolarHBondContact O-N 3.22Å; A313-L317 WeakPolarHBondContact O-CB 3.23Å; A313-L317 WeakPolarHBondContact O-CD1 3.4Å; A313-L317 VanDerWaalsContact O-CG 3.23Å; A313-L317 WeakPolarHBondContact O-CG 3.3Å; A313-L317 PolarHBondContact O-N 3.11Å
314	Q	74.4	Confident	62.6	Low	128 Å²	128	78.7 Å²	78.7	60%	0.598	43%	0.427	S	S	*	.	H	α-helix	trans	-60.3	-44.4	174.4	-72.3	173.7	-20.8	0	0	112.1	K310 T311 T318	K310-Q314 WeakPolarHBondContact O-CG 3.37Å; K310-Q314 PolarHBondContact O-N 3.01Å; T311-Q314 PolarHBondContact O-N 3.43Å; Q314-T318 WeakPolarHBondContact O-CB 3.47Å; Q314-T318 VanDerWaalsContact O-CG2 3.28Å; Q314-T318 WeakPolarHBondContact O-CG2 3.31Å; Q314-T318 PolarHBondContact O-N 2.97Å; Q314-T318 PolarHBondContact O-OG1 2.99Å
315	H	73	Confident	61.9	Low	124 Å²	124	74.8 Å²	74.8	57%	0.574	42%	0.419	S	S	*	.	H	α-helix	trans	-66.6	-38.2	175.8	-76.3	-63.9	0	0	0	113.1	T311 S312 A313 T318 S319	T311-H315 PolarHBondContact O-CD2 3Å; T311-H315 PolarHBondContact O-N 3.42Å; S312-H315 PolarHBondContact O-N 3.49Å; A313-H315 PolarHBondContact O-N 2.75Å; H315-T318 WeakPolarHBondContact CA-OG1 3.31Å; H315-T318 PolarHBondContact O-OG1 3.29Å; H315-S319 VanDerWaalsContact O-CB 3.26Å; H315-S319 WeakPolarHBondContact O-CB 3.01Å; H315-S319 PolarHBondContact O-N 3.48Å; H315-S319 PolarHBondContact O-OG 3Å
316	A	69	Low	61.3	Low	11 Å²	11	78.7 Å²	78.7	9%	0.091	44%	0.439	C	S	.	.	H	α-helix	trans	-66.2	-46.9	175.7	0	0	0	0	0	111.4	V62 S312 A313 T318 S319 V320	V62-A316 HydrophobicContact CG2-CB 4.2Å; S312-A316 WeakPolarHBondContact O-CB 3.21Å; S312-A316 PolarHBondContact O-N 3.45Å; A313-A316 PolarHBondContact O-N 3.22Å; A316-T318 PolarHBondContact O-N 2.7Å; A316-S319 WeakPolarHBondContact CA-OG 3.03Å; A316-S319 PolarHBondContact O-N 3.03Å; A316-S319 PolarHBondContact O-OG 3.47Å; A316-V320 WeakPolarHBondContact O-CB 3.41Å; A316-V320 WeakPolarHBondContact O-CG2 3.41Å; A316-V320 PolarHBondContact O-N 3.19Å
317	L	73.5	Confident	60.5	Low	103 Å²	103	86 Å²	86	54%	0.539	46%	0.464	S	S	.	.	H	α-helix	trans	-65.4	-39.4	179.9	-69.7	164.8	0	0	0	112.2	L58 A313 S321	L58-L317 HydrophobicContact CD1-CD2 4.49Å; A313-L317 WeakPolarHBondContact O-CB 3.23Å; A313-L317 WeakPolarHBondContact O-CD1 3.4Å; A313-L317 VanDerWaalsContact O-CG 3.23Å; A313-L317 WeakPolarHBondContact O-CG 3.3Å; A313-L317 PolarHBondContact O-N 3.11Å; L317-S321 WeakPolarHBondContact O-CB 3.49Å; L317-S321 PolarHBondContact O-N 3.25Å
318	T	72.9	Confident	60	Low	80 Å²	80	89.7 Å²	89.7	49%	0.491	47%	0.474	S	S	.	.	H	α-helix	trans	-72.3	-34.4	176.2	51.9	0	0	0	0	113.1	Q314 H315 A316 R322	Q314-T318 WeakPolarHBondContact O-CB 3.47Å; Q314-T318 VanDerWaalsContact O-CG2 3.28Å; Q314-T318 WeakPolarHBondContact O-CG2 3.31Å; Q314-T318 PolarHBondContact O-N 2.97Å; Q314-T318 PolarHBondContact O-OG1 2.99Å; H315-T318 WeakPolarHBondContact CA-OG1 3.31Å; H315-T318 PolarHBondContact O-OG1 3.29Å; A316-T318 PolarHBondContact O-N 2.7Å; T318-R322 PolarHBondContact O-N 3.15Å
319	S	62.2	Low	59.3	Low	57 Å²	57	88.1 Å²	88.1	40%	0.399	47%	0.473	S	S	.	.	H	α-helix	trans	-74.1	-34.3	174.7	57.8	0	0	0	0	112.9	H315 A316 R322 G323	H315-S319 VanDerWaalsContact O-CB 3.26Å; H315-S319 WeakPolarHBondContact O-CB 3.01Å; H315-S319 PolarHBondContact O-N 3.48Å; H315-S319 PolarHBondContact O-OG 3Å; A316-S319 WeakPolarHBondContact CA-OG 3.03Å; A316-S319 PolarHBondContact O-N 3.03Å; A316-S319 PolarHBondContact O-OG 3.47Å; S319-R322 PolarHBondContact O-N 2.85Å; S319-G323 PolarHBondContact O-N 3.2Å
320	V	59.1	Low	58.5	Low	60 Å²	60	91.8 Å²	91.8	36%	0.364	50%	0.502	S	S	.	.	H	α-helix	trans	-63.4	-44.8	169.3	169.9	0	0	0	0	110.2	Y65 A316 R322 G323 S324	Y65-V320 HydrophobicContact CE2-CG2 3.96Å; A316-V320 WeakPolarHBondContact O-CB 3.41Å; A316-V320 WeakPolarHBondContact O-CG2 3.41Å; A316-V320 PolarHBondContact O-N 3.19Å; V320-R322 PolarHBondContact O-N 2.99Å; V320-G323 PolarHBondContact O-N 2.86Å; V320-S324 PolarHBondContact O-N 3.46Å; V320-S324 PolarHBondContact O-OG 3.27Å
321	S	56.9	Low	57.4	Low	75 Å²	75	96.4 Å²	96.4	52%	0.524	52%	0.522	S	S	.	.	H	α-helix	trans	-58.4	-43.2	174.2	178.8	0	0	0	0	112.4	L317 S324 S325	L317-S321 WeakPolarHBondContact O-CB 3.49Å; L317-S321 PolarHBondContact O-N 3.25Å; S321-S324 PolarHBondContact O-N 3.03Å; S321-S325 PolarHBondContact O-N 3.29Å; S321-S325 PolarHBondContact O-OG 3.32Å
322	R	53.3	Low	56.3	Low	193 Å²	193	96.1 Å²	96.1	73%	0.728	53%	0.534	S	S	*	.	H	α-helix	trans	-69.1	-37	175.3	-78.4	-179.2	167.4	172	-3.3	113.8	T318 S319 V320 S324 S325 L326	T318-R322 PolarHBondContact O-N 3.15Å; S319-R322 PolarHBondContact O-N 2.85Å; V320-R322 PolarHBondContact O-N 2.99Å; R322-S324 VanDerWaalsContact C-N 3.32Å; R322-S325 PolarHBondContact O-N 2.83Å; R322-L326 PolarHBondContact O-N 3.23Å
323	G	50.5	Low	55.2	Low	40 Å²	40	105.1 Å²	105.1	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-67.1	-31.3	176.4	0	0	0	0	0	113.3	S319 V320	S319-G323 PolarHBondContact O-N 3.2Å; V320-G323 PolarHBondContact O-N 2.86Å
324	S	47.9	Very low	53.9	Low	70 Å²	70	117 Å²	117	49%	0.49	61%	0.613	S	S	.	*	H	α-helix	trans	-71.9	-40.7	172.2	-56.6	0	0	0	0	112.1	V320 S321 R322 K327	V320-S324 PolarHBondContact O-N 3.46Å; V320-S324 PolarHBondContact O-OG 3.27Å; S321-S324 PolarHBondContact O-N 3.03Å; R322-S324 VanDerWaalsContact C-N 3.32Å; S324-K327 PolarHBondContact O-N 3.14Å
325	S	46.8	Very low	52.1	Low	70 Å²	70	114.7 Å²	114.7	49%	0.49	62%	0.623	S	S	.	*	H	α-helix	trans	-70.4	-33.7	176.8	-65.3	0	0	0	0	113.7	S321 R322 K327 I328 L329	S321-S325 PolarHBondContact O-N 3.29Å; S321-S325 PolarHBondContact O-OG 3.32Å; R322-S325 PolarHBondContact O-N 2.83Å; S325-K327 VanDerWaalsContact C-N 3.32Å; S325-K327 PolarHBondContact O-N 3.42Å; S325-I328 PolarHBondContact O-N 2.69Å; S325-L329 PolarHBondContact O-N 3.23Å
326	L	46.2	Very low	50.3	Low	133 Å²	133	112 Å²	112	70%	0.696	63%	0.629	S	S	*	*	H	α-helix	trans	-69.4	-27.4	177.2	-117	100.7	0	0	0	113.3	R322 I328 S330	R322-L326 PolarHBondContact O-N 3.23Å; L326-I328 VanDerWaalsContact C-N 3.3Å; L326-S330 PolarHBondContact O-N 2.67Å
327	K	41.7	Very low	48.7	Very low	177 Å²	177	120.7 Å²	120.7	77%	0.77	67%	0.667	S	S	*	*	H	α-helix	trans	-73.3	-20.8	175	-81.5	-174.5	177.3	-179.2	0	113.3	S324 S325	S324-K327 PolarHBondContact O-N 3.14Å; S325-K327 VanDerWaalsContact C-N 3.32Å; S325-K327 PolarHBondContact O-N 3.42Å
328	I	47.1	Very low	47	Very low	142 Å²	142	121 Å²	121	73%	0.728	68%	0.678	S	S	*	*	H	α-helix	trans	-84.2	-30.9	175.8	-63.7	175.8	0	0	0	111.1	S325 L326	S325-I328 PolarHBondContact O-N 2.69Å; L326-I328 VanDerWaalsContact C-N 3.3Å
329	L	44.9	Very low	45.2	Very low	152 Å²	152	122.9 Å²	122.9	80%	0.796	69%	0.694	S	S	*	*	H	α-helix	trans	-83.8	-14.1	178.5	-105.5	109	0	0	0	115.5	S325 K331	S325-L329 PolarHBondContact O-N 3.23Å; L329-K331 PolarHBondContact O-N 3.11Å
330	S	43.8	Very low	44.1	Very low	105 Å²	105	126.6 Å²	126.6	73%	0.734	72%	0.715	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.8	-2	-178.3	-178.6	0	0	0	0	114.7	L326	L326-S330 PolarHBondContact O-N 2.67Å
331	K	42.3	Very low	42.8	Very low	202 Å²	202	128.5 Å²	128.5	88%	0.878	73%	0.731	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.4	7.7	-174.7	-126.7	179.4	-177.8	-177.1	0	115.2	L329	L329-K331 PolarHBondContact O-N 3.11Å
332	G	43.4	Very low	41.7	Very low	66 Å²	66	131.4 Å²	131.4	68%	0.68	75%	0.745	S	S	*	*	S	Bend	trans	-131.1	53.8	-174.5	0	0	0	0	0	115.1
333	K	42.6	Very low	40.9	Very low	208 Å²	208	131.3 Å²	131.3	90%	0.904	75%	0.753	S	S	*	*			trans	-164.8	82.4	157.5	-120.1	175.4	-178.6	179.5	0	111.5
334	R	41.5	Very low	40	Very low	262 Å²	262	135.1 Å²	135.1	99%	0.989	77%	0.774	S	S	*	*			trans	-136.8	99.5	156.4	-105.5	-176.7	175.7	175.6	-1.6	107.3
335	G	35.4	Very low	39.4	Very low	78 Å²	78	141.2 Å²	141.2	80%	0.804	79%	0.794	S	S	*	*			trans	-164.6	100.8	174.7	0	0	0	0	0	109.3
336	G	35.6	Very low	38.7	Very low	68 Å²	68	142.9 Å²	142.9	70%	0.701	81%	0.806	S	S	*	*			trans	48.7	113.3	154.7	0	0	0	0	0	119.8
337	H	35.5	Very low	38.2	Very low	193 Å²	193	141.2 Å²	141.2	89%	0.894	81%	0.806	S	S	*	*				-178	128.9	86	-111.1	-103.7	0	0	0	109.9
338	S	38.3	Very low	37.9	Very low	109 Å²	109	138 Å²	138	76%	0.762	81%	0.805	S	S	*	*			trans	-81.3	130.9	169.3	46.3	0	0	0	0	110.3
339	S	35.3	Very low	37.4	Very low	120 Å²	120	140 Å²	140	84%	0.839	81%	0.809	S	S	*	*			trans	-143.5	112.3	149.7	57	0	0	0	0	108.9
340	V	37.8	Very low	36.9	Very low	136 Å²	136	140.4 Å²	140.4	82%	0.824	81%	0.806	S	S	*	*			trans	-71.7	139.6	171.2	167.1	0	0	0	0	109.1
341	S	32.8	Very low	36.7	Very low	100 Å²	100	139.8 Å²	139.8	70%	0.699	80%	0.802	S	S	*	*				178.2	119.7	125.3	49.8	0	0	0	0	113.9
342	T	32.1	Very low	36.7	Very low	135 Å²	135	139.7 Å²	139.7	83%	0.828	83%	0.827	S	S	*	*			trans	67.6	115.8	140.1	38.8	0	0	0	0	122.5
343	E	36.8	Very low	36.3	Very low	191 Å²	191	143.4 Å²	143.4	89%	0.893	83%	0.834	S	S	*	*			trans	-59.5	145.7	151.8	-66.7	171.4	142.1	0	0	112.2
344	S	32	Very low	36	Very low	121 Å²	121	140 Å²	140	85%	0.846	83%	0.831	S	S	*	*			trans	-163.5	121.3	134.1	40.5	0	0	0	0	109.8
345	E	36.3	Very low	35.7	Very low	197 Å²	197	133.2 Å²	133.2	92%	0.921	82%	0.822	S	S	*	*			trans	-60.7	144.5	166.3	-65.6	171.9	121.7	0	0	111.3
346	S	32.3	Very low	35.7	Very low	105 Å²	105	136.5 Å²	136.5	73%	0.734	82%	0.823	S	S	*	*				178.7	135.3	112.5	101.7	0	0	0	0	111.7
347	S	35.9	Very low	35.7	Very low	99 Å²	99	140.8 Å²	140.8	69%	0.692	83%	0.831	S	S	*	*			trans	14.4	129.3	144.8	51.1	0	0	0	0	121.2
348	S	33.7	Very low	35.7	Very low	109 Å²	109	137.3 Å²	137.3	76%	0.762	83%	0.827	S	S	*	*				154.2	134.3	97.5	55.3	0	0	0	0	113.3
349	F	36.9	Very low	35.6	Very low	185 Å²	185	139.3 Å²	139.3	81%	0.811	83%	0.831	S	S	*	*			trans	37.9	135.5	142.9	-87	-87.7	0	0	0	124
350	H	35.3	Very low	35.6	Very low	159 Å²	159	140.8 Å²	140.8	74%	0.736	83%	0.83	S	S	*	*			trans	99	112.5	136.4	-96.2	-54.8	0	0	0	121.4
351	S	39	Very low	35.4	Very low	92 Å²	92	141.2 Å²	141.2	64%	0.643	83%	0.831	S	S	*	*				102.6	127.1	124.2	-58.2	0	0	0	0	120.1
352	S	41.8	Very low	35.6	Very low	201 Å²	201	144.9 Å²	144.9	100%	1.406	84%	0.843	S	S	*	*			trans	89.4	0	159.2	-55.5	0	0	0	0	117.9

Retrieved 352 of 352 residues in 2290.7 ms (Link to these results)

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