LAP4B_MACFA Loading...

Lysosomal-associated transmembrane protein 4B

Required for optimal lysosomal function. Blocks EGF-stimulated EGFR intraluminal sorting and degradation. Conversely by binding with the phosphatidylinositol 4,5-bisphosphate, regulates its PIP5K1C interaction, inhibits HGS ubiquitination and relieves LAPTM4B inhibition of EGFR degradation. Recruits SLC3A2 and SLC7A5 (the Leu transporter) to the lysosome, promoting entry of leucine and other essential amino acid (EAA) into the lysosome, stimulating activation of proton-transporting vacuolar (V)-ATPase protein pump (V-ATPase) and hence mTORC1 activation. Plays a role as negative regulator of TGFB1 production in regulatory T cells. Binds ceramide and facilitates its exit from late endosome in order to control cell death pathways.

AlphaFold DB , UniProt , Accession Q4R6E8, Species MACFA (Macaca fascicularis, Crab-eating macaque), Gene LAPTM4B, Length 226 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.6	Very low	50.2	Low	242 Å²	242	153.4 Å²	153.4	100%	1.192	72%	0.724	S	S	*	*				0	110	0	-95.2	165	168.1	0	0	108.7	M3	M1-M3 PolarHBondContact O-N 3.39Å
2	K	47.7	Very low	50.3	Low	201 Å²	201	145.9 Å²	145.9	87%	0.874	70%	0.701	S	S	*	*			trans	-72.9	115.5	163.9	-84.8	175.9	174.1	169	0	106.2	V4	K2-V4 VanDerWaalsContact C-N 3.26Å; K2-V4 PolarHBondContact O-N 3.38Å
3	M	47.3	Very low	50.3	Low	188 Å²	188	141.8 Å²	141.8	93%	0.926	69%	0.685	S	S	*	*			trans	-64.6	96.8	168.8	-73.4	-177.2	-164.7	0	0	107.1	M1 A5	M1-M3 PolarHBondContact O-N 3.39Å; M3-A5 VanDerWaalsContact C-N 3.32Å; M3-A5 PolarHBondContact O-N 3.42Å
4	V	51.4	Low	50.2	Low	108 Å²	108	137 Å²	137	66%	0.655	67%	0.673	S	S	*	*			trans	-69	98	168.8	172.4	0	0	0	0	104.6	K2 T8	K2-V4 VanDerWaalsContact C-N 3.26Å; K2-V4 PolarHBondContact O-N 3.38Å; V4-T8 HydrophobicContact CG1-CG2 4.3Å; V4-T8 WeakPolarHBondContact CG1-OG1 3.47Å
5	A	55.8	Low	50.1	Low	47 Å²	47	129 Å²	129	39%	0.388	64%	0.636	S	S	.	*			trans	-53.9	140.3	-179.2	0	0	0	0	0	109	M3 W7 T8	M3-A5 VanDerWaalsContact C-N 3.32Å; M3-A5 PolarHBondContact O-N 3.42Å; A5-W7 PolarHBondContact O-N 3.24Å; A5-T8 PolarHBondContact O-N 2.67Å; A5-T8 PolarHBondContact O-OG1 3.17Å
6	P	51.9	Low	49.9	Very low	105 Å²	105	128 Å²	128	68%	0.682	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-49.5	-30	-174.4	-28.6	34	0	0	0	114.2	T8 R9	P6-T8 PolarHBondContact O-N 2.97Å; P6-R9 PolarHBondContact O-N 3.45Å; P6-R9 VanDerWaalsContact O-N 3.15Å
7	W	55.1	Low	49.8	Very low	197 Å²	197	127.8 Å²	127.8	75%	0.746	64%	0.644	S	S	*	*	G	3₁₀ helix	trans	-60.6	-18.9	175.4	-52.1	105.6	0	0	0	115.7	A5 R9	A5-W7 PolarHBondContact O-N 3.24Å; W7-R9 VanDerWaalsContact C-N 3.3Å
8	T	50.5	Low	49.7	Very low	47 Å²	47	128.1 Å²	128.1	29%	0.288	66%	0.658	S	S	.	*	G	3₁₀ helix	trans	-79.3	-14.2	176.4	61	0	0	0	0	112.7	V4 A5 P6 F10 Y11	V4-T8 HydrophobicContact CG1-CG2 4.3Å; V4-T8 WeakPolarHBondContact CG1-OG1 3.47Å; A5-T8 PolarHBondContact O-N 2.67Å; A5-T8 PolarHBondContact O-OG1 3.17Å; P6-T8 PolarHBondContact O-N 2.97Å; T8-F10 VanDerWaalsContact C-N 3.33Å; T8-Y11 WeakPolarHBondContact O-CB 3.48Å; T8-Y11 PolarHBondContact O-N 3.18Å
9	R	52.3	Low	50.1	Low	229 Å²	229	125.3 Å²	125.3	86%	0.864	65%	0.651	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.3	-17.8	-178.5	-159.7	176.1	-177.9	-176.3	0.4	112.9	P6 W7 Y11	P6-R9 PolarHBondContact O-N 3.45Å; P6-R9 VanDerWaalsContact O-N 3.15Å; W7-R9 VanDerWaalsContact C-N 3.3Å; R9-Y11 PolarHBondContact O-N 3.44Å; R9-Y11 VanDerWaalsContact O-N 3.14Å
10	F	52.3	Low	51.3	Low	166 Å²	166	122.9 Å²	122.9	73%	0.728	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.1	33.1	168.8	-64.1	-73.5	0	0	0	112.3	T8 S12	T8-F10 VanDerWaalsContact C-N 3.33Å; F10-S12 PolarHBondContact O-N 3.16Å
11	Y	45.6	Very low	52.4	Low	157 Å²	157	117.3 Å²	117.3	62%	0.616	61%	0.607	S	S	*	*			trans	-77.2	102.7	172.7	-176.4	-106.6	0	0	0	109.2	T8 R9 N13	T8-Y11 WeakPolarHBondContact O-CB 3.48Å; T8-Y11 PolarHBondContact O-N 3.18Å; R9-Y11 PolarHBondContact O-N 3.44Å; R9-Y11 VanDerWaalsContact O-N 3.14Å; Y11-N13 WeakPolarHBondContact CE2-OD1 3.39Å; Y11-N13 VanDerWaalsContact OH-CG 3.26Å; Y11-N13 PolarHBondContact OH-ND2 3.31Å; Y11-N13 PolarHBondContact OH-OD1 3.09Å
12	S	50.6	Low	54.2	Low	64 Å²	64	108.5 Å²	108.5	45%	0.448	56%	0.561	S	S	.	*			trans	-120.6	123.6	156.5	-177.4	0	0	0	0	107.5	F10 S14	F10-S12 PolarHBondContact O-N 3.16Å; S12-S14 WeakPolarHBondContact CB-O 3.42Å; S12-S14 PolarHBondContact O-N 3.17Å; S12-S14 VanDerWaalsContact O-N 3.1Å; S12-S14 PolarHBondContact OG-N 3.45Å; S12-S14 PolarHBondContact OG-O 3Å
13	N	50.7	Low	56	Low	93 Å²	93	102.7 Å²	102.7	50%	0.497	54%	0.542	S	S	.	.	S	Bend	trans	-63.2	-7.6	168.2	-78	-37.9	0	0	0	112.5	Y11	Y11-N13 WeakPolarHBondContact CE2-OD1 3.39Å; Y11-N13 VanDerWaalsContact OH-CG 3.26Å; Y11-N13 PolarHBondContact OH-ND2 3.31Å; Y11-N13 PolarHBondContact OH-OD1 3.09Å
14	S	48.9	Very low	57.9	Low	74 Å²	74	95.2 Å²	95.2	52%	0.517	51%	0.513	S	S	.	.	S	Bend	trans	-117.4	122.9	178.1	-54.5	0	0	0	0	108.4	S12	S12-S14 WeakPolarHBondContact CB-O 3.42Å; S12-S14 PolarHBondContact O-N 3.17Å; S12-S14 VanDerWaalsContact O-N 3.1Å; S12-S14 PolarHBondContact OG-N 3.45Å; S12-S14 PolarHBondContact OG-O 3Å
15	C	49.4	Very low	59.8	Low	17 Å²	17	90.1 Å²	90.1	12%	0.115	48%	0.483	C	S	.	.			trans	-61.8	157.8	161.6	-152.4	0	0	0	0	109.3	L17 V21 Y171 C175	C15-L17 PolarHBondContact O-N 3.4Å; C15-V21 HydrophobicContact CB-CG1 4.02Å; C15-Y171 VanDerWaalsContact SG-CE2 3.56Å; C15-Y171 VanDerWaalsContact SG-CZ 3.59Å; C15-Y171 PolarHBondContact SG-OH 2.97Å; C15-C175 PolarHBondContact SG-SG 2.98Å
16	C	46.9	Very low	61.4	Low	113 Å²	113	90.1 Å²	90.1	76%	0.764	48%	0.475	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.6	70.3	173.2	-148.2	0	0	0	0	109.5	Y171	C16-Y171 HydrophobicContact CB-CE2 4.17Å; C16-Y171 PolarHBondContact O-OH 3.44Å
17	L	47.7	Very low	63.3	Low	124 Å²	124	90.8 Å²	90.8	65%	0.649	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	179.1	17.2	170.6	-103.1	146	0	0	0	113.7	C15 C19	C15-L17 PolarHBondContact O-N 3.4Å; L17-C19 PolarHBondContact O-N 3.08Å
18	C	48.3	Very low	65	Low	133 Å²	133	82.2 Å²	82.2	90%	0.899	44%	0.441	S	S	*	.	S	Bend	trans	60.5	-10.3	177.1	-56.6	0	0	0	0	116.7
19	C	56.5	Low	67.1	Low	76 Å²	76	80 Å²	80	51%	0.514	43%	0.427	S	S	.	.	S	Bend	trans	-74.8	141	171.3	-67	0	0	0	0	110.4	L17 V21	L17-C19 PolarHBondContact O-N 3.08Å; C19-V21 PolarHBondContact O-N 2.94Å
20	H	75.2	Confident	69.1	Low	77 Å²	77	71.7 Å²	71.7	36%	0.356	40%	0.402	S	S	.	.			trans	-51.5	127.9	171.9	-160.5	-93.3	0	0	0	109	R22 T23 G24 Y182	H20-R22 PolarHBondContact CE1-NH1 3.15Å; H20-R22 VanDerWaalsContact CE1-NH1 3.29Å; H20-R22 WeakPolarHBondContact ND1-CB 3.34Å; H20-R22 PolarHBondContact O-N 3.44Å; H20-T23 WeakPolarHBondContact O-CB 3.4Å; H20-T23 PolarHBondContact O-N 3.14Å; H20-G24 PolarHBondContact O-N 2.99Å; H20-Y182 AromaticContact CE1-CE1 3.61Å; H20-Y182 AromaticContact CE1-CZ 3.58Å; H20-Y182 AromaticContact NE2-CZ 3.59Å; H20-Y182 PolarHBondContact NE2-OH 3.49Å
21	V	73.9	Confident	71	Confident	6 Å²	6	71.3 Å²	71.3	4%	0.036	40%	0.396	C	S	.	.	H	α-helix	trans	-48.6	-31	-177.9	-71.5	0	0	0	0	112.6	C15 C19 G24 T25 N178 Y182	C15-V21 HydrophobicContact CB-CG1 4.02Å; C19-V21 PolarHBondContact O-N 2.94Å; V21-G24 PolarHBondContact O-N 3.01Å; V21-T25 PolarHBondContact O-N 3.37Å; V21-T25 PolarHBondContact O-OG1 3.09Å; V21-N178 HydrophobicContact CG1-CB 4.14Å; V21-Y182 HydrophobicContact CG2-CD1 4.43Å; V21-Y182 HydrophobicContact CG2-CD2 4.32Å; V21-Y182 HydrophobicContact CG2-CG 4Å
22	R	80.3	Confident	73.2	Confident	57 Å²	57	65.4 Å²	65.4	22%	0.215	37%	0.373	C	S	.	.	H	α-helix	trans	-66	-44.1	176.3	-166.1	-168.7	-62.3	142	-18.1	113.1	H20 G24 T25 I26 A93	H20-R22 PolarHBondContact CE1-NH1 3.15Å; H20-R22 VanDerWaalsContact CE1-NH1 3.29Å; H20-R22 WeakPolarHBondContact ND1-CB 3.34Å; H20-R22 PolarHBondContact O-N 3.44Å; R22-G24 VanDerWaalsContact C-N 3.25Å; R22-G24 PolarHBondContact O-N 2.97Å; R22-T25 PolarHBondContact O-N 2.87Å; R22-I26 HydrophobicContact CG-CD1 3.87Å; R22-I26 HydrophobicContact CG-CG1 4.46Å; R22-I26 VanDerWaalsContact O-CG1 3.32Å; R22-I26 WeakPolarHBondContact O-CG1 3.21Å; R22-I26 PolarHBondContact O-N 3.26Å; R22-A93 WeakPolarHBondContact CD-O 3.45Å
23	T	86.5	Confident	75.3	Confident	79 Å²	79	64.3 Å²	64.3	49%	0.485	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-39.6	178.9	-53.3	0	0	0	0	110.4	H20 I26 L27	H20-T23 WeakPolarHBondContact O-CB 3.4Å; H20-T23 PolarHBondContact O-N 3.14Å; T23-I26 PolarHBondContact O-N 2.81Å; T23-L27 VanDerWaalsContact O-CB 3.27Å; T23-L27 WeakPolarHBondContact O-CB 3.34Å; T23-L27 PolarHBondContact O-N 3.02Å
24	G	86.9	Confident	77.3	Confident	31 Å²	31	64.3 Å²	64.3	32%	0.32	36%	0.361	S	S	.	.	H	α-helix	trans	-59.5	-49.2	174.7	0	0	0	0	0	112.5	H20 V21 R22 L27 L28	H20-G24 PolarHBondContact O-N 2.99Å; V21-G24 PolarHBondContact O-N 3.01Å; R22-G24 VanDerWaalsContact C-N 3.25Å; R22-G24 PolarHBondContact O-N 2.97Å; G24-L27 PolarHBondContact O-N 3.41Å; G24-L28 WeakPolarHBondContact O-CB 3.36Å; G24-L28 PolarHBondContact O-N 3.41Å
25	T	89.7	Confident	79.3	Confident	1 Å²	1	64.2 Å²	64.2	1%	0.006	35%	0.354	C	S	.	.	H	α-helix	trans	-66	-38.5	177.7	-55.1	0	0	0	0	113.1	V21 R22 L28 G29 A93 V176 C179	V21-T25 PolarHBondContact O-N 3.37Å; V21-T25 PolarHBondContact O-OG1 3.09Å; R22-T25 PolarHBondContact O-N 2.87Å; T25-L28 PolarHBondContact O-N 3.04Å; T25-G29 PolarHBondContact O-N 3.23Å; T25-A93 HydrophobicContact CG2-CB 4.3Å; T25-V176 HydrophobicContact CG2-CG1 4.44Å; T25-V176 HydrophobicContact CG2-CG2 4.1Å; T25-C179 HydrophobicContact CG2-CB 4.4Å; T25-C179 WeakPolarHBondContact OG1-CB 3.22Å
26	I	91	Very high	81.2	Confident	46 Å²	46	64.2 Å²	64.2	24%	0.236	35%	0.353	C	S	.	.	H	α-helix	trans	-64.7	-49.8	176.7	-69.5	169.9	0	0	0	110.1	R22 T23 L28 G29 V30 T90 A93	R22-I26 HydrophobicContact CG-CD1 3.87Å; R22-I26 HydrophobicContact CG-CG1 4.46Å; R22-I26 VanDerWaalsContact O-CG1 3.32Å; R22-I26 WeakPolarHBondContact O-CG1 3.21Å; R22-I26 PolarHBondContact O-N 3.26Å; T23-I26 PolarHBondContact O-N 2.81Å; I26-L28 VanDerWaalsContact C-N 3.27Å; I26-L28 PolarHBondContact O-N 3.23Å; I26-G29 PolarHBondContact O-N 2.97Å; I26-V30 HydrophobicContact CG2-CG2 4.43Å; I26-V30 VanDerWaalsContact O-CG2 3.3Å; I26-V30 WeakPolarHBondContact O-CG2 3.49Å; I26-V30 PolarHBondContact O-N 3.31Å; I26-T90 HydrophobicContact CG2-CG2 4.17Å; I26-A93 HydrophobicContact CD1-CB 4.44Å; I26-A93 HydrophobicContact CG1-CB 3.75Å
27	L	91.5	Very high	83.5	Confident	120 Å²	120	61.1 Å²	61.1	63%	0.628	34%	0.335	S	S	*	.	H	α-helix	trans	-60.2	-41.4	178.6	-177.4	62.7	0	0	0	111.1	T23 G24 V30 W31	T23-L27 VanDerWaalsContact O-CB 3.27Å; T23-L27 WeakPolarHBondContact O-CB 3.34Å; T23-L27 PolarHBondContact O-N 3.02Å; G24-L27 PolarHBondContact O-N 3.41Å; L27-V30 PolarHBondContact O-N 3.45Å; L27-W31 WeakPolarHBondContact O-CB 3.48Å; L27-W31 PolarHBondContact O-N 3.36Å
28	L	91.3	Very high	85.5	Confident	16 Å²	16	58.9 Å²	58.9	8%	0.084	33%	0.326	C	S	.	.	H	α-helix	trans	-61.9	-49.1	175.6	-168.7	65.7	0	0	0	111.5	G24 T25 I26 V30 W31 Y32 F104 L172 V176	G24-L28 WeakPolarHBondContact O-CB 3.36Å; G24-L28 PolarHBondContact O-N 3.41Å; T25-L28 PolarHBondContact O-N 3.04Å; I26-L28 VanDerWaalsContact C-N 3.27Å; I26-L28 PolarHBondContact O-N 3.23Å; L28-V30 VanDerWaalsContact C-N 3.33Å; L28-V30 PolarHBondContact O-N 3.21Å; L28-W31 WeakPolarHBondContact O-CB 3.46Å; L28-W31 PolarHBondContact O-N 3.01Å; L28-Y32 HydrophobicContact CD1-CD2 4.04Å; L28-Y32 HydrophobicContact CD1-CE2 3.67Å; L28-Y32 HydrophobicContact CG-CD2 4.04Å; L28-Y32 HydrophobicContact CG-CE2 3.95Å; L28-Y32 VanDerWaalsContact O-CD2 3.31Å; L28-Y32 WeakPolarHBondContact O-CD2 3.46Å; L28-Y32 PolarHBondContact O-N 3.38Å; L28-F104 HydrophobicContact CD2-CE1 4.15Å; L28-F104 HydrophobicContact CD2-CZ 4.27Å; L28-F104 HydrophobicContact CG-CE1 4.44Å; L28-F104 HydrophobicContact CG-CZ 4.2Å; L28-L172 HydrophobicContact CD1-CD1 3.89Å; L28-L172 HydrophobicContact CD1-CD2 3.72Å; L28-L172 HydrophobicContact CD1-CG 4.29Å; L28-L172 HydrophobicContact CD2-CB 4.09Å; L28-L172 HydrophobicContact CD2-CD2 4.14Å; L28-V176 HydrophobicContact CD2-CG2 3.81Å
29	G	93.3	Very high	87.4	Confident	0 Å²	0	55.2 Å²	55.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-58.6	-43.4	177.2	0	0	0	0	0	112.5	T25 I26 Y32 L33 T90	T25-G29 PolarHBondContact O-N 3.23Å; I26-G29 PolarHBondContact O-N 2.97Å; G29-Y32 PolarHBondContact O-N 3.39Å; G29-L33 WeakPolarHBondContact O-CG 3.43Å; G29-L33 PolarHBondContact O-N 3.4Å; G29-T90 WeakPolarHBondContact CA-OG1 3.41Å
30	V	94.1	Very high	89	Confident	56 Å²	56	52.9 Å²	52.9	34%	0.339	28%	0.282	S	S	.	.	H	α-helix	trans	-63.8	-41.7	175.4	172.7	0	0	0	0	111.7	I26 L27 L28 L33 I34 T90	I26-V30 HydrophobicContact CG2-CG2 4.43Å; I26-V30 VanDerWaalsContact O-CG2 3.3Å; I26-V30 WeakPolarHBondContact O-CG2 3.49Å; I26-V30 PolarHBondContact O-N 3.31Å; L27-V30 PolarHBondContact O-N 3.45Å; L28-V30 VanDerWaalsContact C-N 3.33Å; L28-V30 PolarHBondContact O-N 3.21Å; V30-L33 WeakPolarHBondContact O-CB 3.33Å; V30-L33 PolarHBondContact O-N 2.85Å; V30-I34 HydrophobicContact CG1-CD1 4.01Å; V30-I34 WeakPolarHBondContact O-CG1 3.3Å; V30-I34 PolarHBondContact O-N 3.48Å; V30-T90 HydrophobicContact CG2-CG2 3.99Å
31	W	93.3	Very high	89.7	Confident	157 Å²	157	54.9 Å²	54.9	60%	0.595	30%	0.295	S	S	*	.	H	α-helix	trans	-60.6	-47.7	177.1	178.9	-102.1	0	0	0	112.1	L27 L28 L33 I34 I35	L27-W31 WeakPolarHBondContact O-CB 3.48Å; L27-W31 PolarHBondContact O-N 3.36Å; L28-W31 WeakPolarHBondContact O-CB 3.46Å; L28-W31 PolarHBondContact O-N 3.01Å; W31-L33 VanDerWaalsContact C-N 3.31Å; W31-L33 PolarHBondContact O-N 3.25Å; W31-I34 PolarHBondContact O-N 2.91Å; W31-I35 HydrophobicContact CD2-CD1 4.38Å; W31-I35 HydrophobicContact CG-CD1 4.47Å; W31-I35 HydrophobicContact CZ2-CD1 3.99Å; W31-I35 PolarHBondContact O-N 3.41Å
32	Y	91.6	Very high	90.4	Very high	33 Å²	33	59.1 Å²	59.1	13%	0.129	32%	0.316	C	S	.	.	H	α-helix	trans	-65.2	-33.9	175.5	-83.8	-90.7	0	0	0	112.4	L28 G29 N36 C86 F104 Y107	L28-Y32 HydrophobicContact CD1-CD2 4.04Å; L28-Y32 HydrophobicContact CD1-CE2 3.67Å; L28-Y32 HydrophobicContact CG-CD2 4.04Å; L28-Y32 HydrophobicContact CG-CE2 3.95Å; L28-Y32 VanDerWaalsContact O-CD2 3.31Å; L28-Y32 WeakPolarHBondContact O-CD2 3.46Å; L28-Y32 PolarHBondContact O-N 3.38Å; G29-Y32 PolarHBondContact O-N 3.39Å; Y32-N36 WeakPolarHBondContact O-CB 3.38Å; Y32-N36 PolarHBondContact O-N 3.07Å; Y32-N36 PolarHBondContact O-ND2 3.48Å; Y32-C86 VanDerWaalsContact CB-SG 3.53Å; Y32-F104 HydrophobicContact CD2-CE2 4.31Å; Y32-F104 HydrophobicContact CD2-CZ 4.05Å; Y32-F104 HydrophobicContact CE2-CZ 4.46Å; Y32-F104 HydrophobicContact CG-CE2 4.35Å; Y32-Y107 HydrophobicContact CE1-CE1 4.28Å
33	L	93.6	Very high	90.7	Very high	41 Å²	41	57.9 Å²	57.9	22%	0.215	31%	0.314	C	S	.	.	H	α-helix	trans	-60.2	-47.2	172.6	-79.8	169.7	0	0	0	111.6	G29 V30 W31 N36 A37 I83 C86 A87	G29-L33 WeakPolarHBondContact O-CG 3.43Å; G29-L33 PolarHBondContact O-N 3.4Å; V30-L33 WeakPolarHBondContact O-CB 3.33Å; V30-L33 PolarHBondContact O-N 2.85Å; W31-L33 VanDerWaalsContact C-N 3.31Å; W31-L33 PolarHBondContact O-N 3.25Å; L33-N36 PolarHBondContact O-N 2.97Å; L33-A37 WeakPolarHBondContact O-CB 3.36Å; L33-A37 PolarHBondContact O-N 2.92Å; L33-I83 HydrophobicContact CD2-CB 4.34Å; L33-I83 HydrophobicContact CD2-CG2 3.83Å; L33-I83 VanDerWaalsContact CD2-O 3.27Å; L33-I83 WeakPolarHBondContact CD2-O 3.45Å; L33-C86 HydrophobicContact CD2-CB 3.75Å; L33-C86 HydrophobicContact CG-CB 3.65Å; L33-A87 HydrophobicContact CD2-CB 4.19Å
34	I	93.9	Very high	90.8	Very high	94 Å²	94	58.1 Å²	58.1	48%	0.482	31%	0.312	S	S	.	.	H	α-helix	trans	-62.4	-48.3	179.8	-67.1	166	0	0	0	110.3	V30 W31 N36 A37 V38	V30-I34 HydrophobicContact CG1-CD1 4.01Å; V30-I34 WeakPolarHBondContact O-CG1 3.3Å; V30-I34 PolarHBondContact O-N 3.48Å; W31-I34 PolarHBondContact O-N 2.91Å; I34-N36 PolarHBondContact O-N 3.1Å; I34-A37 PolarHBondContact O-N 3.31Å; I34-V38 WeakPolarHBondContact O-CG2 3.49Å; I34-V38 PolarHBondContact O-N 2.98Å
35	I	90.6	Very high	90.8	Very high	72 Å²	72	59.2 Å²	59.2	37%	0.369	31%	0.314	S	S	.	.	H	α-helix	trans	-59	-50.8	179.3	-70.5	177.2	0	0	0	110.9	W31 A37 V38 V39	W31-I35 HydrophobicContact CD2-CD1 4.38Å; W31-I35 HydrophobicContact CG-CD1 4.47Å; W31-I35 HydrophobicContact CZ2-CD1 3.99Å; W31-I35 PolarHBondContact O-N 3.41Å; I35-A37 VanDerWaalsContact C-N 3.29Å; I35-A37 PolarHBondContact O-N 3.13Å; I35-V38 PolarHBondContact O-N 3.18Å; I35-V39 HydrophobicContact CG2-CG2 4.42Å; I35-V39 WeakPolarHBondContact O-CG2 3.33Å; I35-V39 PolarHBondContact O-N 2.91Å
36	N	90	Very high	90.5	Very high	17 Å²	17	60.3 Å²	60.3	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-68.6	-29.2	-178.2	-72.6	-79.4	0	0	0	112.3	Y32 L33 I34 L40 M82 I83	Y32-N36 WeakPolarHBondContact O-CB 3.38Å; Y32-N36 PolarHBondContact O-N 3.07Å; Y32-N36 PolarHBondContact O-ND2 3.48Å; L33-N36 PolarHBondContact O-N 2.97Å; I34-N36 PolarHBondContact O-N 3.1Å; N36-L40 WeakPolarHBondContact O-CB 3.38Å; N36-L40 PolarHBondContact O-N 3.44Å; N36-M82 HydrophobicContact CB-CB 4.39Å; N36-M82 WeakPolarHBondContact OD1-CB 3.5Å; N36-I83 HydrophobicContact CB-CD1 4.32Å; N36-I83 HydrophobicContact CB-CG1 3.66Å
37	A	93.2	Very high	90.1	Very high	48 Å²	48	62.8 Å²	62.8	40%	0.397	34%	0.337	S	S	.	.	H	α-helix	trans	-67.7	-40.3	172.7	0	0	0	0	0	112.1	L33 I34 I35 L40 L41	L33-A37 WeakPolarHBondContact O-CB 3.36Å; L33-A37 PolarHBondContact O-N 2.92Å; I34-A37 PolarHBondContact O-N 3.31Å; I35-A37 VanDerWaalsContact C-N 3.29Å; I35-A37 PolarHBondContact O-N 3.13Å; A37-L40 PolarHBondContact O-N 3.35Å; A37-L41 WeakPolarHBondContact O-CB 3.34Å; A37-L41 PolarHBondContact O-N 2.87Å
38	V	91	Very high	89.7	Confident	76 Å²	76	61.3 Å²	61.3	46%	0.461	34%	0.342	S	S	.	.	H	α-helix	trans	-65.8	-45.4	174.3	172.7	0	0	0	0	110.7	I34 I35 L40 L41 I42	I34-V38 WeakPolarHBondContact O-CG2 3.49Å; I34-V38 PolarHBondContact O-N 2.98Å; I35-V38 PolarHBondContact O-N 3.18Å; V38-L40 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 3.22Å; V38-L41 WeakPolarHBondContact O-CB 3.23Å; V38-L41 PolarHBondContact O-N 2.96Å; V38-I42 HydrophobicContact CG1-CD1 3.96Å; V38-I42 WeakPolarHBondContact O-CG1 3.42Å; V38-I42 PolarHBondContact O-N 3.37Å
39	V	87.7	Confident	89	Confident	57 Å²	57	63.4 Å²	63.4	35%	0.345	35%	0.354	S	S	.	.	H	α-helix	trans	-58.8	-46.5	175.4	171.5	0	0	0	0	110.7	I35 L41 I42 L43	I35-V39 HydrophobicContact CG2-CG2 4.42Å; I35-V39 WeakPolarHBondContact O-CG2 3.33Å; I35-V39 PolarHBondContact O-N 2.91Å; V39-L41 VanDerWaalsContact C-N 3.32Å; V39-L41 PolarHBondContact O-N 2.96Å; V39-I42 PolarHBondContact O-N 3.45Å; V39-L43 HydrophobicContact CG1-CD1 3.9Å; V39-L43 HydrophobicContact CG1-CG 4.39Å; V39-L43 VanDerWaalsContact O-CG 3.29Å; V39-L43 WeakPolarHBondContact O-CG 3.12Å; V39-L43 PolarHBondContact O-N 3.47Å
40	L	90.8	Very high	87.8	Confident	26 Å²	26	66.4 Å²	66.4	14%	0.136	37%	0.373	C	S	.	.	H	α-helix	trans	-60.3	-41.9	175.9	-179.4	65.3	0	0	0	111.8	N36 A37 V38 L43 L44 I76 L80 I83	N36-L40 WeakPolarHBondContact O-CB 3.38Å; N36-L40 PolarHBondContact O-N 3.44Å; A37-L40 PolarHBondContact O-N 3.35Å; V38-L40 VanDerWaalsContact C-N 3.33Å; V38-L40 PolarHBondContact O-N 3.22Å; L40-L43 PolarHBondContact O-N 3.06Å; L40-L44 HydrophobicContact CD1-CD1 4.27Å; L40-L44 HydrophobicContact CD1-CG 4.22Å; L40-L44 HydrophobicContact CG-CD1 3.99Å; L40-L44 HydrophobicContact CG-CG 4.34Å; L40-L44 WeakPolarHBondContact O-CB 3.22Å; L40-L44 VanDerWaalsContact O-CG 3.26Å; L40-L44 WeakPolarHBondContact O-CG 3.45Å; L40-L44 PolarHBondContact O-N 3.19Å; L40-I76 HydrophobicContact CD1-CG2 3.93Å; L40-L80 HydrophobicContact CD1-CD2 4.25Å; L40-L80 HydrophobicContact CD1-CG 4.22Å; L40-L80 HydrophobicContact CD2-CD2 3.62Å; L40-L80 HydrophobicContact CD2-CG 4.42Å; L40-I83 HydrophobicContact CB-CD1 4.34Å; L40-I83 HydrophobicContact CD2-CD1 3.73Å
41	L	90	Very high	86.3	Confident	120 Å²	120	70.2 Å²	70.2	63%	0.628	39%	0.391	S	S	*	.	H	α-helix	trans	-62.5	-43	177.5	-176.4	67.1	0	0	0	111.5	A37 V38 V39 L44 S45	A37-L41 WeakPolarHBondContact O-CB 3.34Å; A37-L41 PolarHBondContact O-N 2.87Å; V38-L41 WeakPolarHBondContact O-CB 3.23Å; V38-L41 PolarHBondContact O-N 2.96Å; V39-L41 VanDerWaalsContact C-N 3.32Å; V39-L41 PolarHBondContact O-N 2.96Å; L41-L44 PolarHBondContact O-N 2.69Å; L41-S45 WeakPolarHBondContact O-CB 3.41Å; L41-S45 PolarHBondContact O-N 3.05Å; L41-S45 PolarHBondContact O-OG 2.93Å
42	I	87.4	Confident	84.4	Confident	94 Å²	94	69.7 Å²	69.7	48%	0.482	40%	0.396	S	S	.	.	H	α-helix	trans	-61.3	-48.3	175.5	-67	165.9	0	0	0	109.9	V38 V39 L44 S45 A46	V38-I42 HydrophobicContact CG1-CD1 3.96Å; V38-I42 WeakPolarHBondContact O-CG1 3.42Å; V38-I42 PolarHBondContact O-N 3.37Å; V39-I42 PolarHBondContact O-N 3.45Å; I42-L44 PolarHBondContact O-N 3.37Å; I42-S45 WeakPolarHBondContact CA-OG 3.26Å; I42-S45 PolarHBondContact O-N 2.88Å; I42-S45 PolarHBondContact O-OG 2.9Å; I42-A46 PolarHBondContact O-N 3.17Å
43	L	87.1	Confident	82.5	Confident	32 Å²	32	74.4 Å²	74.4	17%	0.168	41%	0.414	C	S	.	.	H	α-helix	trans	-60.8	-43.4	178	-68.2	169.5	0	0	0	111.9	V39 L40 S45 A46 L47 M72 A75 I76	V39-L43 HydrophobicContact CG1-CD1 3.9Å; V39-L43 HydrophobicContact CG1-CG 4.39Å; V39-L43 VanDerWaalsContact O-CG 3.29Å; V39-L43 WeakPolarHBondContact O-CG 3.12Å; V39-L43 PolarHBondContact O-N 3.47Å; L40-L43 PolarHBondContact O-N 3.06Å; L43-S45 VanDerWaalsContact C-N 3.34Å; L43-S45 PolarHBondContact O-N 3.23Å; L43-A46 PolarHBondContact O-N 3.42Å; L43-L47 PolarHBondContact O-N 3.35Å; L43-M72 WeakPolarHBondContact O-CE 3.38Å; L43-A75 HydrophobicContact CD1-CB 3.95Å; L43-A75 HydrophobicContact CD2-CB 4.22Å; L43-I76 HydrophobicContact CB-CD1 4.36Å; L43-I76 HydrophobicContact CB-CG1 3.76Å; L43-I76 HydrophobicContact CD1-CG1 4Å; L43-I76 HydrophobicContact CG-CG1 4.41Å
44	L	88.5	Confident	80.2	Confident	83 Å²	83	76.6 Å²	76.6	44%	0.435	42%	0.423	S	S	.	.	H	α-helix	trans	-66.8	-35.7	176.7	-70.9	174.5	0	0	0	112.3	L40 L41 I42 L47 A48	L40-L44 HydrophobicContact CD1-CD1 4.27Å; L40-L44 HydrophobicContact CD1-CG 4.22Å; L40-L44 HydrophobicContact CG-CD1 3.99Å; L40-L44 HydrophobicContact CG-CG 4.34Å; L40-L44 WeakPolarHBondContact O-CB 3.22Å; L40-L44 VanDerWaalsContact O-CG 3.26Å; L40-L44 WeakPolarHBondContact O-CG 3.45Å; L40-L44 PolarHBondContact O-N 3.19Å; L41-L44 PolarHBondContact O-N 2.69Å; I42-L44 PolarHBondContact O-N 3.37Å; L44-L47 PolarHBondContact O-N 3.26Å; L44-A48 WeakPolarHBondContact O-CB 3.49Å; L44-A48 PolarHBondContact O-N 3.06Å
45	S	86.5	Confident	77.9	Confident	54 Å²	54	81.2 Å²	81.2	38%	0.378	44%	0.44	S	S	.	.	H	α-helix	trans	-66.7	-40.9	175.8	69.4	0	0	0	0	112	L41 I42 L43 L47 A48 D49	L41-S45 WeakPolarHBondContact O-CB 3.41Å; L41-S45 PolarHBondContact O-N 3.05Å; L41-S45 PolarHBondContact O-OG 2.93Å; I42-S45 WeakPolarHBondContact CA-OG 3.26Å; I42-S45 PolarHBondContact O-N 2.88Å; I42-S45 PolarHBondContact O-OG 2.9Å; L43-S45 VanDerWaalsContact C-N 3.34Å; L43-S45 PolarHBondContact O-N 3.23Å; S45-L47 PolarHBondContact O-N 3.4Å; S45-A48 PolarHBondContact O-N 2.97Å; S45-D49 PolarHBondContact O-N 2.93Å; S45-D49 VanDerWaalsContact O-N 3.09Å
46	A	83.3	Confident	75.7	Confident	25 Å²	25	83.8 Å²	83.8	21%	0.207	46%	0.464	C	S	.	.	H	α-helix	trans	-64.5	-29.8	173.6	0	0	0	0	0	112	I42 L43 Y53 M72	I42-A46 PolarHBondContact O-N 3.17Å; L43-A46 PolarHBondContact O-N 3.42Å; A46-Y53 HydrophobicContact CB-CD2 4.37Å; A46-Y53 HydrophobicContact CB-CE2 4.29Å; A46-M72 HydrophobicContact CB-CE 3.76Å
47	L	82.6	Confident	73.4	Confident	97 Å²	97	85.8 Å²	85.8	51%	0.508	48%	0.48	S	S	.	.	H	α-helix	trans	-76.1	-33	177.5	-161.3	73.2	0	0	0	112	L43 L44 S45 M72 I76	L43-L47 PolarHBondContact O-N 3.35Å; L44-L47 PolarHBondContact O-N 3.26Å; S45-L47 PolarHBondContact O-N 3.4Å; L47-M72 HydrophobicContact CB-CE 3.59Å; L47-M72 HydrophobicContact CD1-CE 3.77Å; L47-M72 HydrophobicContact CD1-SD 3.77Å; L47-M72 HydrophobicContact CG-CE 4.29Å; L47-M72 VanDerWaalsContact N-CE 3.33Å; L47-I76 HydrophobicContact CD2-CD1 4.46Å
48	A	83.4	Confident	71	Confident	89 Å²	89	87.2 Å²	87.2	74%	0.736	49%	0.487	S	S	*	.	H	α-helix	trans	-79.7	-28.4	-178.1	0	0	0	0	0	112.9	L44 S45	L44-A48 WeakPolarHBondContact O-CB 3.49Å; L44-A48 PolarHBondContact O-N 3.06Å; S45-A48 PolarHBondContact O-N 2.97Å
49	D	77.3	Confident	68.9	Low	61 Å²	61	92.6 Å²	92.6	33%	0.326	51%	0.507	S	S	.	.			trans	-127.9	76.6	177.7	-168.5	-9	0	0	0	110.6	S45 D51 Q52	S45-D49 PolarHBondContact O-N 2.93Å; S45-D49 VanDerWaalsContact O-N 3.09Å; D49-D51 VanDerWaalsContact C-N 3.25Å; D49-D51 PolarHBondContact O-N 2.77Å; D49-D51 PolarHBondContact OD1-N 3.29Å; D49-Q52 PolarHBondContact OD1-N 3.46Å; D49-Q52 VanDerWaalsContact OD1-N 3.17Å
50	P	68.6	Low	66.5	Low	62 Å²	62	97.6 Å²	97.6	40%	0.403	53%	0.531	S	S	.	.	H	α-helix	trans	-65	-32.4	174.8	26	-32.8	0	0	0	111.7	Q52 Y53 H54	P50-Q52 VanDerWaalsContact C-N 3.3Å; P50-Q52 PolarHBondContact O-N 2.94Å; P50-Y53 PolarHBondContact O-N 3.48Å; P50-H54 PolarHBondContact O-CD2 3.45Å; P50-H54 PolarHBondContact O-N 2.9Å
51	D	62.7	Low	63.9	Low	136 Å²	136	98.8 Å²	98.8	73%	0.727	55%	0.55	S	S	*	.	H	α-helix	trans	-62.7	-33.3	-172.7	-65.7	-26.4	0	0	0	112.7	D49	D49-D51 VanDerWaalsContact C-N 3.25Å; D49-D51 PolarHBondContact O-N 2.77Å; D49-D51 PolarHBondContact OD1-N 3.29Å
52	Q	53	Low	61.5	Low	147 Å²	147	95.2 Å²	95.2	69%	0.687	54%	0.542	S	S	*	.	H	α-helix	trans	-79.6	-21.9	-179.3	-156	166.6	53	0	0	114	D49 P50	D49-Q52 PolarHBondContact OD1-N 3.46Å; D49-Q52 VanDerWaalsContact OD1-N 3.17Å; P50-Q52 VanDerWaalsContact C-N 3.3Å; P50-Q52 PolarHBondContact O-N 2.94Å
53	Y	50.9	Low	59.4	Low	131 Å²	131	98.4 Å²	98.4	51%	0.514	56%	0.56	S	S	.	*	H	α-helix	trans	-96.1	-17.6	179.9	-77.3	-88.9	0	0	0	114.1	A46 P50 F55 S56 S57	A46-Y53 HydrophobicContact CB-CD2 4.37Å; A46-Y53 HydrophobicContact CB-CE2 4.29Å; P50-Y53 PolarHBondContact O-N 3.48Å; Y53-F55 PolarHBondContact O-N 3.25Å; Y53-S56 PolarHBondContact O-N 2.89Å; Y53-S57 PolarHBondContact O-OG 3.49Å
54	H	46.4	Very low	57.3	Low	88 Å²	88	103.2 Å²	103.2	41%	0.407	58%	0.579	S	S	.	*	H	α-helix	trans	-58	-18.6	174.9	-87.5	-70	0	0	0	114.2	P50 S56 S58 E65	P50-H54 PolarHBondContact O-CD2 3.45Å; P50-H54 PolarHBondContact O-N 2.9Å; H54-S56 PolarHBondContact O-N 2.88Å; H54-S58 VanDerWaalsContact O-CB 3.29Å; H54-S58 WeakPolarHBondContact O-CB 3.36Å; H54-S58 PolarHBondContact O-N 3.29Å; H54-S58 PolarHBondContact O-OG 3.49Å; H54-E65 IonicContact CE1-OE1 3.94Å
55	F	44.7	Very low	55.3	Low	191 Å²	191	103.5 Å²	103.5	84%	0.838	58%	0.579	S	S	*	*	H	α-helix	trans	-74.5	-19.2	-177.5	-153.8	-91.9	0	0	0	114.5	Y53	Y53-F55 PolarHBondContact O-N 3.25Å
56	S	45	Very low	53.5	Low	126 Å²	126	109 Å²	109	88%	0.881	60%	0.596	S	S	*	*	H	α-helix	trans	-93.6	-18.4	176.4	-86.7	0	0	0	0	114.6	Y53 H54	Y53-S56 PolarHBondContact O-N 2.89Å; H54-S56 PolarHBondContact O-N 2.88Å
57	S	42.3	Very low	52.2	Low	59 Å²	59	114 Å²	114	41%	0.413	62%	0.616	S	S	.	*	H	α-helix	trans	-112.5	-11.2	-172.1	26	0	0	0	0	114.5	Y53 E59	Y53-S57 PolarHBondContact O-OG 3.49Å; S57-E59 VanDerWaalsContact C-N 3.27Å; S57-E59 PolarHBondContact O-N 3.2Å
58	S	41.2	Very low	51.7	Low	78 Å²	78	111.9 Å²	111.9	55%	0.545	61%	0.606	S	S	.	*	T	Hydrogen-bonded Turn	trans	-69.6	-10.8	-174.6	36.2	0	0	0	0	115.9	H54	H54-S58 VanDerWaalsContact O-CB 3.29Å; H54-S58 WeakPolarHBondContact O-CB 3.36Å; H54-S58 PolarHBondContact O-N 3.29Å; H54-S58 PolarHBondContact O-OG 3.49Å
59	E	46.9	Very low	51.4	Low	189 Å²	189	112.6 Å²	112.6	88%	0.883	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.6	-3.4	-179.2	-70.4	-127	114.2	0	0	115	S57	S57-E59 VanDerWaalsContact C-N 3.27Å; S57-E59 PolarHBondContact O-N 3.2Å
60	L	38.9	Very low	51.6	Low	161 Å²	161	111.6 Å²	111.6	84%	0.843	60%	0.598	S	S	*	*	S	Bend	trans	-153.3	78.1	179.2	-154	71.6	0	0	0	116.3
61	G	35.3	Very low	52.4	Low	52 Å²	52	113.1 Å²	113.1	54%	0.536	60%	0.602	S	S	.	*			trans	93.2	104.7	143.9	0	0	0	0	0	117.9	D63 F64	G61-D63 PolarHBondContact O-N 3.22Å; G61-F64 WeakPolarHBondContact O-CB 3.37Å; G61-F64 PolarHBondContact O-N 3.02Å
62	G	39.5	Very low	53.4	Low	45 Å²	45	108.1 Å²	108.1	46%	0.464	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-60.2	0.9	178.6	0	0	0	0	0	118.3	F64	G62-F64 VanDerWaalsContact C-N 3.33Å
63	D	43.8	Very low	55.1	Low	160 Å²	160	104.9 Å²	104.9	86%	0.856	57%	0.568	S	S	*	*	H	α-helix	trans	-77.1	-24.5	166.5	-72.9	-21	0	0	0	111.7	G61	G61-D63 PolarHBondContact O-N 3.22Å
64	F	42.8	Very low	56.9	Low	133 Å²	133	103 Å²	103	58%	0.583	57%	0.565	S	S	*	*	H	α-helix	trans	-78.8	-30.2	174.8	-156.1	-103.2	0	0	0	111.3	G61 G62 M67 D68	G61-F64 WeakPolarHBondContact O-CB 3.37Å; G61-F64 PolarHBondContact O-N 3.02Å; G62-F64 VanDerWaalsContact C-N 3.33Å; F64-M67 CarbonylContact O-C 3.53Å; F64-M67 WeakPolarHBondContact O-CB 3.3Å; F64-M67 PolarHBondContact O-N 3.27Å; F64-D68 WeakPolarHBondContact CD1-OD2 3.33Å; F64-D68 WeakPolarHBondContact CE1-OD1 3.34Å; F64-D68 VanDerWaalsContact CE1-OD2 3.31Å; F64-D68 WeakPolarHBondContact CE1-OD2 3.24Å; F64-D68 VanDerWaalsContact O-CB 3.29Å; F64-D68 WeakPolarHBondContact O-CB 3.42Å; F64-D68 VanDerWaalsContact O-CG 3.27Å; F64-D68 PolarHBondContact O-N 3.43Å
65	E	45.6	Very low	58.9	Low	90 Å²	90	100.2 Å²	100.2	42%	0.421	56%	0.558	S	S	.	*	H	α-helix	trans	-62.6	-44.8	179.9	-68.9	-175.4	133.3	0	0	113.4	H54 D68 D69	H54-E65 IonicContact CE1-OE1 3.94Å; E65-D68 WeakPolarHBondContact O-CB 3.49Å; E65-D68 PolarHBondContact O-N 3.36Å; E65-D69 PolarHBondContact O-N 3.11Å
66	F	50.3	Low	61	Low	170 Å²	170	92.3 Å²	92.3	75%	0.746	52%	0.524	S	S	*	.	H	α-helix	trans	-71.2	-33.7	176.7	-172.4	-97.9	0	0	0	112.1	D68 A70	F66-D68 VanDerWaalsContact C-N 3.28Å; F66-A70 PolarHBondContact O-N 3.17Å
67	M	55.2	Low	63.3	Low	128 Å²	128	89 Å²	89	63%	0.631	50%	0.504	S	S	*	.	H	α-helix	trans	-64.6	-37.5	170.5	-170.2	80.5	94.3	0	0	110.1	F64 N71	F64-M67 CarbonylContact O-C 3.53Å; F64-M67 WeakPolarHBondContact O-CB 3.3Å; F64-M67 PolarHBondContact O-N 3.27Å; M67-N71 WeakPolarHBondContact O-CB 3.3Å; M67-N71 PolarHBondContact O-N 2.9Å
68	D	71.5	Confident	65.6	Low	53 Å²	53	90.8 Å²	90.8	28%	0.283	51%	0.508	S	S	.	.	H	α-helix	trans	-68.3	-45.2	-178.9	-85.3	-21.4	0	0	0	112.1	F64 E65 F66 A70 N71 M72	F64-D68 WeakPolarHBondContact CD1-OD2 3.33Å; F64-D68 WeakPolarHBondContact CE1-OD1 3.34Å; F64-D68 VanDerWaalsContact CE1-OD2 3.31Å; F64-D68 WeakPolarHBondContact CE1-OD2 3.24Å; F64-D68 VanDerWaalsContact O-CB 3.29Å; F64-D68 WeakPolarHBondContact O-CB 3.42Å; F64-D68 VanDerWaalsContact O-CG 3.27Å; F64-D68 PolarHBondContact O-N 3.43Å; E65-D68 WeakPolarHBondContact O-CB 3.49Å; E65-D68 PolarHBondContact O-N 3.36Å; F66-D68 VanDerWaalsContact C-N 3.28Å; D68-A70 PolarHBondContact O-N 3.47Å; D68-N71 CarbonylContact O-C 3.59Å; D68-N71 PolarHBondContact O-N 3.33Å; D68-M72 WeakPolarHBondContact O-CA 3.36Å; D68-M72 WeakPolarHBondContact O-CB 3.29Å; D68-M72 PolarHBondContact O-N 2.87Å
69	D	76.7	Confident	68	Low	104 Å²	104	87.4 Å²	87.4	56%	0.556	49%	0.485	S	S	*	.	H	α-helix	trans	-60.3	-45.8	176	-79	-16.8	0	0	0	111.5	E65 M72 C73	E65-D69 PolarHBondContact O-N 3.11Å; D69-M72 PolarHBondContact O-N 3.44Å; D69-C73 PolarHBondContact O-N 3.42Å; D69-C73 PolarHBondContact O-SG 3.35Å
70	A	81.7	Confident	70.2	Confident	41 Å²	41	82.4 Å²	82.4	34%	0.339	46%	0.464	S	S	.	.	H	α-helix	trans	-65.1	-44.6	177.1	0	0	0	0	0	111.2	F66 D68 M72 C73 I74	F66-A70 PolarHBondContact O-N 3.17Å; D68-A70 PolarHBondContact O-N 3.47Å; A70-M72 VanDerWaalsContact C-N 3.29Å; A70-M72 PolarHBondContact O-N 3.27Å; A70-C73 PolarHBondContact O-N 2.9Å; A70-I74 WeakPolarHBondContact O-CB 3.37Å; A70-I74 WeakPolarHBondContact O-CD1 3.37Å; A70-I74 WeakPolarHBondContact O-CG1 3.44Å; A70-I74 PolarHBondContact O-N 2.9Å
71	N	85	Confident	72.9	Confident	93 Å²	93	79.6 Å²	79.6	50%	0.497	45%	0.449	S	S	.	.	H	α-helix	trans	-66.1	-33.7	178.8	-167.3	52.3	0	0	0	111.6	M67 D68 I74 A75	M67-N71 WeakPolarHBondContact O-CB 3.3Å; M67-N71 PolarHBondContact O-N 2.9Å; D68-N71 CarbonylContact O-C 3.59Å; D68-N71 PolarHBondContact O-N 3.33Å; N71-I74 PolarHBondContact O-N 2.75Å; N71-A75 VanDerWaalsContact O-CB 3.28Å; N71-A75 WeakPolarHBondContact O-CB 3.39Å; N71-A75 PolarHBondContact O-N 3.19Å
72	M	84.4	Confident	75.6	Confident	32 Å²	32	77.4 Å²	77.4	16%	0.158	43%	0.425	C	S	.	.	H	α-helix	trans	-67.1	-46.9	173.1	-176.6	-178.9	-169.9	0	0	111	L43 A46 L47 D68 D69 A70 I74 A75 I76	L43-M72 WeakPolarHBondContact O-CE 3.38Å; A46-M72 HydrophobicContact CB-CE 3.76Å; L47-M72 HydrophobicContact CB-CE 3.59Å; L47-M72 HydrophobicContact CD1-CE 3.77Å; L47-M72 HydrophobicContact CD1-SD 3.77Å; L47-M72 HydrophobicContact CG-CE 4.29Å; L47-M72 VanDerWaalsContact N-CE 3.33Å; D68-M72 WeakPolarHBondContact O-CA 3.36Å; D68-M72 WeakPolarHBondContact O-CB 3.29Å; D68-M72 PolarHBondContact O-N 2.87Å; D69-M72 PolarHBondContact O-N 3.44Å; A70-M72 VanDerWaalsContact C-N 3.29Å; A70-M72 PolarHBondContact O-N 3.27Å; M72-I74 VanDerWaalsContact C-N 3.3Å; M72-I74 PolarHBondContact O-N 2.89Å; M72-A75 PolarHBondContact O-N 3.48Å; M72-A75 VanDerWaalsContact O-N 3.17Å; M72-I76 HydrophobicContact CG-CD1 4.29Å; M72-I76 WeakPolarHBondContact O-CG1 3.28Å; M72-I76 PolarHBondContact O-N 3.42Å
73	C	88.7	Confident	78.2	Confident	79 Å²	79	77.1 Å²	77.1	53%	0.534	41%	0.412	S	S	.	.	H	α-helix	trans	-58.9	-42.6	173	-69.5	0	0	0	0	111.5	D69 A70 I76 A77	D69-C73 PolarHBondContact O-N 3.42Å; D69-C73 PolarHBondContact O-SG 3.35Å; A70-C73 PolarHBondContact O-N 2.9Å; C73-I76 PolarHBondContact O-N 3.39Å; C73-A77 WeakPolarHBondContact O-CB 3.4Å; C73-A77 PolarHBondContact O-N 3.32Å
74	I	89.5	Confident	80.7	Confident	90 Å²	90	74.9 Å²	74.9	46%	0.462	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-44	175	-69.1	162.7	0	0	0	110.5	A70 N71 M72 I76 A77 I78	A70-I74 WeakPolarHBondContact O-CB 3.37Å; A70-I74 WeakPolarHBondContact O-CD1 3.37Å; A70-I74 WeakPolarHBondContact O-CG1 3.44Å; A70-I74 PolarHBondContact O-N 2.9Å; N71-I74 PolarHBondContact O-N 2.75Å; M72-I74 VanDerWaalsContact C-N 3.3Å; M72-I74 PolarHBondContact O-N 2.89Å; I74-I76 PolarHBondContact O-N 3.48Å; I74-A77 PolarHBondContact O-N 2.9Å; I74-I78 HydrophobicContact CG2-CD1 3.67Å; I74-I78 HydrophobicContact CG2-CG1 4.3Å; I74-I78 WeakPolarHBondContact O-CB 3.5Å; I74-I78 VanDerWaalsContact O-CG1 3.25Å; I74-I78 WeakPolarHBondContact O-CG1 3.31Å; I74-I78 PolarHBondContact O-N 3.27Å
75	A	87.5	Confident	83.1	Confident	30 Å²	30	70 Å²	70	25%	0.248	38%	0.379	C	S	.	.	H	α-helix	trans	-63.8	-40.2	178.2	0	0	0	0	0	112.3	L43 N71 M72 I78 S79	L43-A75 HydrophobicContact CD1-CB 3.95Å; L43-A75 HydrophobicContact CD2-CB 4.22Å; N71-A75 VanDerWaalsContact O-CB 3.28Å; N71-A75 WeakPolarHBondContact O-CB 3.39Å; N71-A75 PolarHBondContact O-N 3.19Å; M72-A75 PolarHBondContact O-N 3.48Å; M72-A75 VanDerWaalsContact O-N 3.17Å; A75-I78 PolarHBondContact O-N 3.21Å; A75-S79 WeakPolarHBondContact O-CB 3.05Å; A75-S79 PolarHBondContact O-N 2.94Å; A75-S79 PolarHBondContact O-OG 3.22Å
76	I	90.1	Very high	85.4	Confident	26 Å²	26	65.7 Å²	65.7	13%	0.133	36%	0.359	C	S	.	.	H	α-helix	trans	-62.3	-47.6	172.9	-69.7	168.5	0	0	0	109.9	L40 L43 L47 M72 C73 I74 I78 S79 L80	L40-I76 HydrophobicContact CD1-CG2 3.93Å; L43-I76 HydrophobicContact CB-CD1 4.36Å; L43-I76 HydrophobicContact CB-CG1 3.76Å; L43-I76 HydrophobicContact CD1-CG1 4Å; L43-I76 HydrophobicContact CG-CG1 4.41Å; L47-I76 HydrophobicContact CD2-CD1 4.46Å; M72-I76 HydrophobicContact CG-CD1 4.29Å; M72-I76 WeakPolarHBondContact O-CG1 3.28Å; M72-I76 PolarHBondContact O-N 3.42Å; C73-I76 PolarHBondContact O-N 3.39Å; I74-I76 PolarHBondContact O-N 3.48Å; I76-I78 PolarHBondContact O-N 3.08Å; I76-S79 PolarHBondContact O-N 2.69Å; I76-L80 HydrophobicContact CG2-CD1 4.01Å; I76-L80 HydrophobicContact CG2-CG 4.46Å; I76-L80 WeakPolarHBondContact O-CG 3.19Å; I76-L80 PolarHBondContact O-N 2.89Å
77	A	93	Very high	87.5	Confident	56 Å²	56	59.6 Å²	59.6	46%	0.463	34%	0.34	S	S	.	.	H	α-helix	trans	-61.2	-43.9	179	0	0	0	0	0	112.1	C73 I74 L80 L81	C73-A77 WeakPolarHBondContact O-CB 3.4Å; C73-A77 PolarHBondContact O-N 3.32Å; I74-A77 PolarHBondContact O-N 2.9Å; A77-L80 PolarHBondContact O-N 3.04Å; A77-L81 WeakPolarHBondContact O-CB 3.45Å; A77-L81 PolarHBondContact O-N 2.7Å
78	I	90.5	Very high	89.4	Confident	97 Å²	97	57.3 Å²	57.3	50%	0.497	33%	0.329	S	S	.	.	H	α-helix	trans	-61.4	-46.4	174.6	-69	167.4	0	0	0	110	I74 A75 I76 L80 L81 M82	I74-I78 HydrophobicContact CG2-CD1 3.67Å; I74-I78 HydrophobicContact CG2-CG1 4.3Å; I74-I78 WeakPolarHBondContact O-CB 3.5Å; I74-I78 VanDerWaalsContact O-CG1 3.25Å; I74-I78 WeakPolarHBondContact O-CG1 3.31Å; I74-I78 PolarHBondContact O-N 3.27Å; A75-I78 PolarHBondContact O-N 3.21Å; I76-I78 PolarHBondContact O-N 3.08Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 2.76Å; I78-L81 PolarHBondContact O-N 2.77Å; I78-M82 HydrophobicContact CG2-CG 4.28Å; I78-M82 WeakPolarHBondContact O-CB 3.48Å; I78-M82 VanDerWaalsContact O-CG 3.26Å; I78-M82 WeakPolarHBondContact O-CG 3.35Å; I78-M82 PolarHBondContact O-N 3.17Å
79	S	91	Very high	90.4	Very high	7 Å²	7	54.9 Å²	54.9	5%	0.049	32%	0.316	C	S	.	.	H	α-helix	trans	-60.4	-43.6	179.7	-60.7	0	0	0	0	111.8	A75 I76 M82 I83	A75-S79 WeakPolarHBondContact O-CB 3.05Å; A75-S79 PolarHBondContact O-N 2.94Å; A75-S79 PolarHBondContact O-OG 3.22Å; I76-S79 PolarHBondContact O-N 2.69Å; S79-M82 WeakPolarHBondContact O-CB 3.29Å; S79-M82 PolarHBondContact O-N 3.28Å; S79-I83 VanDerWaalsContact O-CG1 3.29Å; S79-I83 WeakPolarHBondContact O-CG1 3.36Å; S79-I83 PolarHBondContact O-N 2.75Å
80	L	93.7	Very high	91.2	Very high	84 Å²	84	51 Å²	51	44%	0.44	30%	0.296	S	S	.	.	H	α-helix	trans	-63.7	-45.5	175.4	-72	172.2	0	0	0	112.1	L40 I76 A77 I78 M82 I83 L84	L40-L80 HydrophobicContact CD1-CD2 4.25Å; L40-L80 HydrophobicContact CD1-CG 4.22Å; L40-L80 HydrophobicContact CD2-CD2 3.62Å; L40-L80 HydrophobicContact CD2-CG 4.42Å; I76-L80 HydrophobicContact CG2-CD1 4.01Å; I76-L80 HydrophobicContact CG2-CG 4.46Å; I76-L80 WeakPolarHBondContact O-CG 3.19Å; I76-L80 PolarHBondContact O-N 2.89Å; A77-L80 PolarHBondContact O-N 3.04Å; I78-L80 VanDerWaalsContact C-N 3.35Å; I78-L80 PolarHBondContact O-N 2.76Å; L80-M82 VanDerWaalsContact C-N 3.27Å; L80-M82 PolarHBondContact O-N 2.73Å; L80-I83 PolarHBondContact O-N 3.26Å; L80-L84 WeakPolarHBondContact O-CG 3.34Å; L80-L84 PolarHBondContact O-N 3.43Å
81	L	94.4	Very high	91.8	Very high	101 Å²	101	53.6 Å²	53.6	53%	0.529	30%	0.298	S	S	.	.	H	α-helix	trans	-59.5	-41.4	176.2	-178.2	67.1	0	0	0	111.1	A77 I78 L84 I85	A77-L81 WeakPolarHBondContact O-CB 3.45Å; A77-L81 PolarHBondContact O-N 2.7Å; I78-L81 PolarHBondContact O-N 2.77Å; L81-L84 PolarHBondContact O-N 3.15Å; L81-I85 HydrophobicContact CD1-CD1 4.33Å; L81-I85 HydrophobicContact CG-CD1 3.98Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 3.05Å
82	M	92.5	Very high	92.1	Very high	7 Å²	7	49.2 Å²	49.2	3%	0.034	27%	0.274	C	S	.	.	H	α-helix	trans	-63.8	-43.8	176.9	-76.5	-48.2	-53	0	0	112.6	N36 I78 S79 L80 L84 I85 C86 Y107	N36-M82 HydrophobicContact CB-CB 4.39Å; N36-M82 WeakPolarHBondContact OD1-CB 3.5Å; I78-M82 HydrophobicContact CG2-CG 4.28Å; I78-M82 WeakPolarHBondContact O-CB 3.48Å; I78-M82 VanDerWaalsContact O-CG 3.26Å; I78-M82 WeakPolarHBondContact O-CG 3.35Å; I78-M82 PolarHBondContact O-N 3.17Å; S79-M82 WeakPolarHBondContact O-CB 3.29Å; S79-M82 PolarHBondContact O-N 3.28Å; L80-M82 VanDerWaalsContact C-N 3.27Å; L80-M82 PolarHBondContact O-N 2.73Å; M82-L84 VanDerWaalsContact C-N 3.32Å; M82-L84 PolarHBondContact O-N 2.99Å; M82-I85 PolarHBondContact O-N 2.93Å; M82-C86 WeakPolarHBondContact O-CB 3.49Å; M82-C86 PolarHBondContact O-N 2.94Å; M82-C86 PolarHBondContact O-SG 2.93Å; M82-Y107 HydrophobicContact CE-CD1 3.46Å; M82-Y107 VanDerWaalsContact CE-CD1 3.46Å; M82-Y107 HydrophobicContact CE-CD2 3.73Å; M82-Y107 HydrophobicContact CE-CE1 3.14Å; M82-Y107 HydrophobicContact CE-CE2 3.45Å; M82-Y107 VanDerWaalsContact CE-CE2 3.45Å; M82-Y107 HydrophobicContact CE-CG 3.72Å; M82-Y107 HydrophobicContact CG-CE2 4.39Å; M82-Y107 HydrophobicContact SD-CD1 4.27Å; M82-Y107 HydrophobicContact SD-CD2 3.37Å; M82-Y107 WeakPolarHBondContact SD-CD2 3.33Å; M82-Y107 HydrophobicContact SD-CE1 4.03Å; M82-Y107 HydrophobicContact SD-CE2 3.08Å; M82-Y107 WeakPolarHBondContact SD-CE2 2.99Å; M82-Y107 HydrophobicContact SD-CG 3.95Å
83	I	94.7	Very high	92.4	Very high	39 Å²	39	47.7 Å²	47.7	20%	0.2	27%	0.267	C	S	.	.	H	α-helix	trans	-58.7	-46.9	173.9	-70.4	165.2	0	0	0	110.2	L33 N36 L40 S79 L80 I85 C86 A87	L33-I83 HydrophobicContact CD2-CB 4.34Å; L33-I83 HydrophobicContact CD2-CG2 3.83Å; L33-I83 VanDerWaalsContact CD2-O 3.27Å; L33-I83 WeakPolarHBondContact CD2-O 3.45Å; N36-I83 HydrophobicContact CB-CD1 4.32Å; N36-I83 HydrophobicContact CB-CG1 3.66Å; L40-I83 HydrophobicContact CB-CD1 4.34Å; L40-I83 HydrophobicContact CD2-CD1 3.73Å; S79-I83 VanDerWaalsContact O-CG1 3.29Å; S79-I83 WeakPolarHBondContact O-CG1 3.36Å; S79-I83 PolarHBondContact O-N 2.75Å; L80-I83 PolarHBondContact O-N 3.26Å; I83-I85 PolarHBondContact O-N 3.48Å; I83-C86 PolarHBondContact O-N 2.92Å; I83-A87 WeakPolarHBondContact O-CB 3.32Å; I83-A87 PolarHBondContact O-N 3.22Å
84	L	94.9	Very high	92.4	Very high	112 Å²	112	52.2 Å²	52.2	59%	0.586	27%	0.274	S	S	*	.	H	α-helix	trans	-59.7	-49.6	178.6	-70.8	175.2	0	0	0	111.6	L80 L81 M82 C86 A87 M88	L80-L84 WeakPolarHBondContact O-CG 3.34Å; L80-L84 PolarHBondContact O-N 3.43Å; L81-L84 PolarHBondContact O-N 3.15Å; M82-L84 VanDerWaalsContact C-N 3.32Å; M82-L84 PolarHBondContact O-N 2.99Å; L84-C86 VanDerWaalsContact C-N 3.31Å; L84-C86 PolarHBondContact O-N 3.45Å; L84-A87 PolarHBondContact O-N 3.39Å; L84-M88 WeakPolarHBondContact O-CB 3.29Å; L84-M88 WeakPolarHBondContact O-CG 3.47Å; L84-M88 PolarHBondContact O-N 2.92Å
85	I	94.7	Very high	92.5	Very high	31 Å²	31	53 Å²	53	16%	0.159	27%	0.274	C	S	.	.	H	α-helix	trans	-59.2	-43.7	178.9	-69.5	168.2	0	0	0	111.1	L81 M82 I83 M88 A89 P103 F104	L81-I85 HydrophobicContact CD1-CD1 4.33Å; L81-I85 HydrophobicContact CG-CD1 3.98Å; L81-I85 WeakPolarHBondContact O-CG1 3.44Å; L81-I85 PolarHBondContact O-N 3.05Å; M82-I85 PolarHBondContact O-N 2.93Å; I83-I85 PolarHBondContact O-N 3.48Å; I85-M88 PolarHBondContact O-N 3.27Å; I85-A89 WeakPolarHBondContact O-CB 3.38Å; I85-A89 PolarHBondContact O-N 3.33Å; I85-P103 HydrophobicContact CG2-CB 4.23Å; I85-F104 HydrophobicContact CG2-CB 3.77Å; I85-F104 HydrophobicContact CG2-CD2 4.1Å; I85-F104 HydrophobicContact CG2-CG 4.46Å
86	C	94.3	Very high	92.4	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-68.7	-38.1	-179.9	-62.7	0	0	0	0	112.1	Y32 L33 M82 I83 L84 A89 T90	Y32-C86 VanDerWaalsContact CB-SG 3.53Å; L33-C86 HydrophobicContact CD2-CB 3.75Å; L33-C86 HydrophobicContact CG-CB 3.65Å; M82-C86 WeakPolarHBondContact O-CB 3.49Å; M82-C86 PolarHBondContact O-N 2.94Å; M82-C86 PolarHBondContact O-SG 2.93Å; I83-C86 PolarHBondContact O-N 2.92Å; L84-C86 VanDerWaalsContact C-N 3.31Å; L84-C86 PolarHBondContact O-N 3.45Å; C86-A89 PolarHBondContact O-N 3.42Å; C86-T90 WeakPolarHBondContact O-CB 3.38Å; C86-T90 PolarHBondContact O-N 3.17Å; C86-T90 PolarHBondContact O-OG1 2.94Å
87	A	94.5	Very high	92.3	Very high	42 Å²	42	59 Å²	59	35%	0.347	29%	0.29	S	S	.	.	H	α-helix	trans	-63.3	-46.2	174.7	0	0	0	0	0	111	L33 I83 L84 A89 T90 Y91	L33-A87 HydrophobicContact CD2-CB 4.19Å; I83-A87 WeakPolarHBondContact O-CB 3.32Å; I83-A87 PolarHBondContact O-N 3.22Å; L84-A87 PolarHBondContact O-N 3.39Å; A87-A89 PolarHBondContact O-N 3.26Å; A87-T90 PolarHBondContact O-N 3.44Å; A87-Y91 WeakPolarHBondContact O-CB 3.2Å; A87-Y91 PolarHBondContact O-N 2.69Å
88	M	93.9	Very high	92.1	Very high	80 Å²	80	56.6 Å²	56.6	39%	0.394	27%	0.271	S	S	.	.	H	α-helix	trans	-61.6	-42.7	177.9	-65.9	-67.1	-77.6	0	0	111.7	L84 I85 G92 W100	L84-M88 WeakPolarHBondContact O-CB 3.29Å; L84-M88 WeakPolarHBondContact O-CG 3.47Å; L84-M88 PolarHBondContact O-N 2.92Å; I85-M88 PolarHBondContact O-N 3.27Å; M88-G92 PolarHBondContact O-N 3.2Å; M88-W100 HydrophobicContact CB-CE3 4.25Å; M88-W100 HydrophobicContact CE-CD2 3.79Å; M88-W100 HydrophobicContact CE-CE3 3.16Å; M88-W100 HydrophobicContact CE-CH2 3.64Å; M88-W100 HydrophobicContact CE-CZ2 4.2Å; M88-W100 HydrophobicContact CE-CZ3 3.1Å; M88-W100 HydrophobicContact SD-CE3 3.53Å; M88-W100 VanDerWaalsContact SD-CE3 3.53Å; M88-W100 HydrophobicContact SD-CH2 4.17Å; M88-W100 HydrophobicContact SD-CZ3 3.25Å; M88-W100 WeakPolarHBondContact SD-CZ3 3.46Å
89	A	93.4	Very high	92.1	Very high	1 Å²	1	55 Å²	55	1%	0.008	27%	0.272	C	S	.	.	H	α-helix	trans	-68.2	-43.3	177.8	0	0	0	0	0	112.8	I85 C86 A87 Y91 G92 A93 F104	I85-A89 WeakPolarHBondContact O-CB 3.38Å; I85-A89 PolarHBondContact O-N 3.33Å; C86-A89 PolarHBondContact O-N 3.42Å; A87-A89 PolarHBondContact O-N 3.26Å; A89-Y91 VanDerWaalsContact C-N 3.35Å; A89-G92 PolarHBondContact O-N 3.4Å; A89-A93 WeakPolarHBondContact O-CB 3.4Å; A89-A93 PolarHBondContact O-N 3.26Å; A89-F104 HydrophobicContact CB-CB 3.39Å; A89-F104 HydrophobicContact CB-CD1 3.85Å; A89-F104 HydrophobicContact CB-CD2 4.49Å; A89-F104 HydrophobicContact CB-CG 3.69Å
90	T	93.5	Very high	92.2	Very high	23 Å²	23	59.4 Å²	59.4	14%	0.141	29%	0.287	C	S	.	.	H	α-helix	trans	-61.6	-46	176.7	-54.3	0	0	0	0	110.4	I26 G29 V30 C86 A87 A93 Y94	I26-T90 HydrophobicContact CG2-CG2 4.17Å; G29-T90 WeakPolarHBondContact CA-OG1 3.41Å; V30-T90 HydrophobicContact CG2-CG2 3.99Å; C86-T90 WeakPolarHBondContact O-CB 3.38Å; C86-T90 PolarHBondContact O-N 3.17Å; C86-T90 PolarHBondContact O-OG1 2.94Å; A87-T90 PolarHBondContact O-N 3.44Å; T90-A93 PolarHBondContact O-N 3.09Å; T90-Y94 PolarHBondContact O-N 3.37Å
91	Y	93.4	Very high	92.1	Very high	96 Å²	96	55.4 Å²	55.4	38%	0.376	27%	0.266	S	S	.	.	H	α-helix	trans	-64.7	-41.1	176.2	-178.9	-102.1	0	0	0	112.4	A87 A89 Y94 K95 W100	A87-Y91 WeakPolarHBondContact O-CB 3.2Å; A87-Y91 PolarHBondContact O-N 2.69Å; A89-Y91 VanDerWaalsContact C-N 3.35Å; Y91-Y94 PolarHBondContact O-N 3.48Å; Y91-K95 HydrophobicContact CE1-CD 4.02Å; Y91-K95 HydrophobicContact CE1-CG 4.45Å; Y91-K95 HydrophobicContact CE2-CD 3.79Å; Y91-K95 HydrophobicContact CE2-CG 4.07Å; Y91-K95 VanDerWaalsContact CZ-CD 3.44Å; Y91-K95 VanDerWaalsContact CZ-CE 3.48Å; Y91-K95 PolarHBondContact O-N 3.19Å; Y91-K95 WeakPolarHBondContact OH-CD 3.49Å; Y91-K95 WeakPolarHBondContact OH-CE 3.41Å; Y91-K95 PolarHBondContact OH-NZ 2.9Å; Y91-W100 HydrophobicContact CD1-CD2 4.43Å; Y91-W100 AromaticContact CD1-CE3 3.6Å; Y91-W100 HydrophobicContact CD1-CE3 3.6Å; Y91-W100 HydrophobicContact CD1-CH2 4.31Å; Y91-W100 AromaticContact CD1-CZ3 3.5Å; Y91-W100 HydrophobicContact CD1-CZ3 3.5Å; Y91-W100 HydrophobicContact CE1-CE3 4.14Å; Y91-W100 HydrophobicContact CE1-CH2 4.07Å; Y91-W100 AromaticContact CE1-CZ3 3.72Å; Y91-W100 HydrophobicContact CE1-CZ3 3.72Å
92	G	91.8	Very high	92	Very high	0 Å²	0	53.9 Å²	53.9	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-61.8	-43	175.6	0	0	0	0	0	113	M88 A89 Y94 Q96 R97	M88-G92 PolarHBondContact O-N 3.2Å; A89-G92 PolarHBondContact O-N 3.4Å; G92-Y94 VanDerWaalsContact C-N 3.34Å; G92-Q96 PolarHBondContact O-N 3.34Å; G92-R97 PolarHBondContact O-N 2.87Å
93	A	90.3	Very high	92.1	Very high	0 Å²	0	56.4 Å²	56.4	0%	0	28%	0.275	C	S	.	.	H	α-helix	trans	-65.7	-36.5	175.7	0	0	0	0	0	112.3	R22 T25 I26 A89 T90 Q96 I101	R22-A93 WeakPolarHBondContact CD-O 3.45Å; T25-A93 HydrophobicContact CG2-CB 4.3Å; I26-A93 HydrophobicContact CD1-CB 4.44Å; I26-A93 HydrophobicContact CG1-CB 3.75Å; A89-A93 WeakPolarHBondContact O-CB 3.4Å; A89-A93 PolarHBondContact O-N 3.26Å; T90-A93 PolarHBondContact O-N 3.09Å; A93-Q96 PolarHBondContact O-NE2 3.32Å; A93-I101 HydrophobicContact CB-CD1 4.2Å
94	Y	89.5	Confident	92.1	Very high	174 Å²	174	54.6 Å²	54.6	68%	0.682	27%	0.266	S	S	*	.	H	α-helix	trans	-68.6	-55.7	175.1	-174.8	-104.3	0	0	0	111.9	T90 Y91 G92 Q96	T90-Y94 PolarHBondContact O-N 3.37Å; Y91-Y94 PolarHBondContact O-N 3.48Å; G92-Y94 VanDerWaalsContact C-N 3.34Å; Y94-Q96 VanDerWaalsContact C-N 3.26Å; Y94-Q96 PolarHBondContact O-N 3.25Å; Y94-Q96 PolarHBondContact O-NE2 3.13Å; Y94-Q96 VanDerWaalsContact O-NE2 3.11Å
95	K	90.2	Very high	92	Very high	106 Å²	106	50.9 Å²	50.9	46%	0.461	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80.2	9	-177.7	-73.1	-151.6	177.9	178.8	0	115.5	Y91 R97	Y91-K95 HydrophobicContact CE1-CD 4.02Å; Y91-K95 HydrophobicContact CE1-CG 4.45Å; Y91-K95 HydrophobicContact CE2-CD 3.79Å; Y91-K95 HydrophobicContact CE2-CG 4.07Å; Y91-K95 VanDerWaalsContact CZ-CD 3.44Å; Y91-K95 VanDerWaalsContact CZ-CE 3.48Å; Y91-K95 PolarHBondContact O-N 3.19Å; Y91-K95 WeakPolarHBondContact OH-CD 3.49Å; Y91-K95 WeakPolarHBondContact OH-CE 3.41Å; Y91-K95 PolarHBondContact OH-NZ 2.9Å; K95-R97 VanDerWaalsContact C-N 3.29Å; K95-R97 HydrophobicContact CB-CG 4.34Å; K95-R97 PolarHBondContact O-N 2.92Å
96	Q	86.2	Confident	92	Very high	36 Å²	36	52.7 Å²	52.7	17%	0.168	26%	0.26	C	S	.	.	T	Hydrogen-bonded Turn	trans	55.8	40.7	-178.7	-47.9	-54.5	-67.9	0	0	113.1	G92 A93 Y94 I183 N187	G92-Q96 PolarHBondContact O-N 3.34Å; A93-Q96 PolarHBondContact O-NE2 3.32Å; Y94-Q96 VanDerWaalsContact C-N 3.26Å; Y94-Q96 PolarHBondContact O-N 3.25Å; Y94-Q96 PolarHBondContact O-NE2 3.13Å; Y94-Q96 VanDerWaalsContact O-NE2 3.11Å; Q96-I183 HydrophobicContact CB-CG2 4.05Å; Q96-I183 WeakPolarHBondContact O-CG2 3.34Å; Q96-N187 PolarHBondContact O-ND2 3.1Å
97	R	88.8	Confident	91.9	Very high	146 Å²	146	55.5 Å²	55.5	55%	0.551	27%	0.271	S	S	*	.			trans	-106.3	94.7	176.1	-67.5	-70.6	-167.5	-107.8	4.7	109.8	G92 K95 A99 W100	G92-R97 PolarHBondContact O-N 2.87Å; K95-R97 VanDerWaalsContact C-N 3.29Å; K95-R97 HydrophobicContact CB-CG 4.34Å; K95-R97 PolarHBondContact O-N 2.92Å; R97-A99 VanDerWaalsContact C-N 3.3Å; R97-A99 PolarHBondContact O-N 3.2Å; R97-W100 HydrophobicContact CB-CG 4.17Å; R97-W100 PolarHBondContact O-N 2.66Å
98	A	88.1	Confident	91.9	Very high	7 Å²	7	53.8 Å²	53.8	6%	0.058	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-56.3	-40	-175.2	0	0	0	0	0	113.5	W100 I101 Y180 I183 N184	A98-W100 PolarHBondContact O-N 2.86Å; A98-W100 VanDerWaalsContact O-N 3.13Å; A98-I101 WeakPolarHBondContact O-CB 3.31Å; A98-I101 PolarHBondContact O-N 3.19Å; A98-I101 VanDerWaalsContact O-N 3.1Å; A98-Y180 HydrophobicContact CB-CD2 3.84Å; A98-Y180 HydrophobicContact CB-CE2 3.69Å; A98-Y180 VanDerWaalsContact O-CD2 3.3Å; A98-Y180 WeakPolarHBondContact O-CD2 3.39Å; A98-Y180 WeakPolarHBondContact O-CE2 3.3Å; A98-I183 HydrophobicContact CB-CB 4.33Å; A98-I183 HydrophobicContact CB-CG2 3.88Å; A98-N184 HydrophobicContact CB-CB 4.26Å
99	A	90.7	Very high	91.9	Very high	64 Å²	64	53.6 Å²	53.6	53%	0.529	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-59.5	-27.9	-177.4	0	0	0	0	0	114.1	R97 I101 I102	R97-A99 VanDerWaalsContact C-N 3.3Å; R97-A99 PolarHBondContact O-N 3.2Å; A99-I101 VanDerWaalsContact C-N 3.27Å; A99-I101 PolarHBondContact O-N 3.37Å; A99-I102 PolarHBondContact O-N 2.98Å
100	W	92.1	Very high	91.9	Very high	98 Å²	98	59.4 Å²	59.4	37%	0.371	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-78.8	-14.7	-176.9	-68.4	50.3	0	0	0	112.5	M88 Y91 R97 A98	M88-W100 HydrophobicContact CB-CE3 4.25Å; M88-W100 HydrophobicContact CE-CD2 3.79Å; M88-W100 HydrophobicContact CE-CE3 3.16Å; M88-W100 HydrophobicContact CE-CH2 3.64Å; M88-W100 HydrophobicContact CE-CZ2 4.2Å; M88-W100 HydrophobicContact CE-CZ3 3.1Å; M88-W100 HydrophobicContact SD-CE3 3.53Å; M88-W100 VanDerWaalsContact SD-CE3 3.53Å; M88-W100 HydrophobicContact SD-CH2 4.17Å; M88-W100 HydrophobicContact SD-CZ3 3.25Å; M88-W100 WeakPolarHBondContact SD-CZ3 3.46Å; Y91-W100 HydrophobicContact CD1-CD2 4.43Å; Y91-W100 AromaticContact CD1-CE3 3.6Å; Y91-W100 HydrophobicContact CD1-CE3 3.6Å; Y91-W100 HydrophobicContact CD1-CH2 4.31Å; Y91-W100 AromaticContact CD1-CZ3 3.5Å; Y91-W100 HydrophobicContact CD1-CZ3 3.5Å; Y91-W100 HydrophobicContact CE1-CE3 4.14Å; Y91-W100 HydrophobicContact CE1-CH2 4.07Å; Y91-W100 AromaticContact CE1-CZ3 3.72Å; Y91-W100 HydrophobicContact CE1-CZ3 3.72Å; R97-W100 HydrophobicContact CB-CG 4.17Å; R97-W100 PolarHBondContact O-N 2.66Å; A98-W100 PolarHBondContact O-N 2.86Å; A98-W100 VanDerWaalsContact O-N 3.13Å
101	I	92	Very high	91.8	Very high	0 Å²	0	59.5 Å²	59.5	0%	0	28%	0.28	C	S	.	.	T	Hydrogen-bonded Turn	trans	-86.2	-22.2	178	-58.2	175	0	0	0	110.8	A93 A98 A99 F104 F105 V176 I183	A93-I101 HydrophobicContact CB-CD1 4.2Å; A98-I101 WeakPolarHBondContact O-CB 3.31Å; A98-I101 PolarHBondContact O-N 3.19Å; A98-I101 VanDerWaalsContact O-N 3.1Å; A99-I101 VanDerWaalsContact C-N 3.27Å; A99-I101 PolarHBondContact O-N 3.37Å; I101-F104 PolarHBondContact O-N 3.02Å; I101-F105 PolarHBondContact O-N 3.48Å; I101-V176 HydrophobicContact CG2-CG1 3.6Å; I101-I183 HydrophobicContact CD1-CD1 3.38Å
102	I	92.9	Very high	91.9	Very high	69 Å²	69	58.3 Å²	58.3	35%	0.354	28%	0.277	S	S	.	.	H	α-helix	trans	-56.4	-47.3	-176.1	-59.6	174.4	0	0	0	112.4	A99 F104 F105 C106 Y180	A99-I102 PolarHBondContact O-N 2.98Å; I102-F104 VanDerWaalsContact C-N 3.31Å; I102-F104 PolarHBondContact O-N 3.16Å; I102-F105 WeakPolarHBondContact O-CB 3.38Å; I102-F105 PolarHBondContact O-N 2.88Å; I102-C106 PolarHBondContact O-N 3.29Å; I102-C106 PolarHBondContact O-SG 3.05Å; I102-C106 VanDerWaalsContact O-SG 3.35Å; I102-Y180 HydrophobicContact CD1-CE2 3.91Å; I102-Y180 HydrophobicContact CG1-CD2 4.15Å; I102-Y180 HydrophobicContact CG1-CE2 3.6Å
103	P	94.6	Very high	92	Very high	61 Å²	61	60.7 Å²	60.7	40%	0.396	30%	0.297	S	S	.	.	H	α-helix	trans	-60.3	-39.8	-179.5	-24.4	35.5	0	0	0	113.1	I85 C106 Y107	I85-P103 HydrophobicContact CG2-CB 4.23Å; P103-C106 PolarHBondContact O-N 3.17Å; P103-Y107 PolarHBondContact O-N 2.79Å
104	F	93.5	Very high	92	Very high	0 Å²	0	64.3 Å²	64.3	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-70.1	-36.9	177.7	-178	-116.9	0	0	0	112.1	L28 Y32 I85 A89 I101 I102 Y107 Q108 V176	L28-F104 HydrophobicContact CD2-CE1 4.15Å; L28-F104 HydrophobicContact CD2-CZ 4.27Å; L28-F104 HydrophobicContact CG-CE1 4.44Å; L28-F104 HydrophobicContact CG-CZ 4.2Å; Y32-F104 HydrophobicContact CD2-CE2 4.31Å; Y32-F104 HydrophobicContact CD2-CZ 4.05Å; Y32-F104 HydrophobicContact CE2-CZ 4.46Å; Y32-F104 HydrophobicContact CG-CE2 4.35Å; I85-F104 HydrophobicContact CG2-CB 3.77Å; I85-F104 HydrophobicContact CG2-CD2 4.1Å; I85-F104 HydrophobicContact CG2-CG 4.46Å; A89-F104 HydrophobicContact CB-CB 3.39Å; A89-F104 HydrophobicContact CB-CD1 3.85Å; A89-F104 HydrophobicContact CB-CD2 4.49Å; A89-F104 HydrophobicContact CB-CG 3.69Å; I101-F104 PolarHBondContact O-N 3.02Å; I102-F104 VanDerWaalsContact C-N 3.31Å; I102-F104 PolarHBondContact O-N 3.16Å; F104-Y107 PolarHBondContact O-N 3.28Å; F104-Q108 HydrophobicContact CZ-CG 4.48Å; F104-Q108 WeakPolarHBondContact O-CG 3.44Å; F104-Q108 PolarHBondContact O-N 3.19Å; F104-V176 HydrophobicContact CD1-CG1 4.2Å; F104-V176 HydrophobicContact CD1-CG2 4.26Å; F104-V176 HydrophobicContact CE1-CG2 3.95Å
105	F	93.9	Very high	92.1	Very high	35 Å²	35	58.3 Å²	58.3	15%	0.154	30%	0.296	C	S	.	.	H	α-helix	trans	-61.4	-45.7	172.5	178.3	-108.9	0	0	0	112	I101 I102 Y107 Q108 I109 I173 V176 W177	I101-F105 PolarHBondContact O-N 3.48Å; I102-F105 WeakPolarHBondContact O-CB 3.38Å; I102-F105 PolarHBondContact O-N 2.88Å; F105-Y107 VanDerWaalsContact C-N 3.31Å; F105-Y107 PolarHBondContact O-N 3.46Å; F105-Q108 PolarHBondContact O-N 2.8Å; F105-I109 HydrophobicContact CD1-CD1 3.94Å; F105-I109 HydrophobicContact CE1-CD1 3.39Å; F105-I109 HydrophobicContact CE1-CG1 4.47Å; F105-I109 HydrophobicContact CE2-CD1 4.18Å; F105-I109 HydrophobicContact CZ-CD1 3.53Å; F105-I109 HydrophobicContact CZ-CG1 4.31Å; F105-I109 PolarHBondContact O-N 3.34Å; F105-I109 VanDerWaalsContact O-N 3.12Å; F105-I173 HydrophobicContact CD2-CG2 4.39Å; F105-I173 HydrophobicContact CE2-CG2 3.66Å; F105-I173 HydrophobicContact CZ-CG2 4.43Å; F105-V176 HydrophobicContact CB-CG1 4.11Å; F105-V176 HydrophobicContact CD2-CG1 4.21Å; F105-W177 HydrophobicContact CD1-CE3 4.2Å; F105-W177 HydrophobicContact CD1-CZ3 4.35Å; F105-W177 HydrophobicContact CD2-CB 4.44Å; F105-W177 HydrophobicContact CD2-CE3 4.32Å; F105-W177 AromaticContact CE1-CE3 3.6Å; F105-W177 HydrophobicContact CE1-CE3 3.6Å; F105-W177 AromaticContact CE1-CZ3 3.73Å; F105-W177 HydrophobicContact CE1-CZ3 3.73Å; F105-W177 HydrophobicContact CE2-CB 3.79Å; F105-W177 HydrophobicContact CE2-CD2 4.29Å; F105-W177 AromaticContact CE2-CE3 3.75Å; F105-W177 HydrophobicContact CE2-CE3 3.75Å; F105-W177 HydrophobicContact CE2-CG 4.36Å; F105-W177 HydrophobicContact CZ-CB 4.38Å; F105-W177 HydrophobicContact CZ-CD2 4.03Å; F105-W177 AromaticContact CZ-CE3 3.33Å; F105-W177 HydrophobicContact CZ-CE3 3.33Å; F105-W177 HydrophobicContact CZ-CG 4.48Å; F105-W177 AromaticContact CZ-CZ3 3.9Å; F105-W177 HydrophobicContact CZ-CZ3 3.9Å
106	C	95	Very high	92.2	Very high	69 Å²	69	55.2 Å²	55.2	47%	0.466	29%	0.286	S	S	.	.	H	α-helix	trans	-60.4	-42	175	-65.6	0	0	0	0	111.8	I102 P103 Q108 I109 F110	I102-C106 PolarHBondContact O-N 3.29Å; I102-C106 PolarHBondContact O-SG 3.05Å; I102-C106 VanDerWaalsContact O-SG 3.35Å; P103-C106 PolarHBondContact O-N 3.17Å; C106-Q108 PolarHBondContact O-N 2.91Å; C106-I109 PolarHBondContact O-N 2.92Å; C106-F110 PolarHBondContact O-N 3.12Å
107	Y	92.3	Very high	92.5	Very high	59 Å²	59	58.6 Å²	58.6	23%	0.231	30%	0.304	C	S	.	.	H	α-helix	trans	-59.7	-43.9	175.3	174.1	-97.9	0	0	0	112.2	Y32 M82 P103 F104 F105 I109 F110 D111	Y32-Y107 HydrophobicContact CE1-CE1 4.28Å; M82-Y107 HydrophobicContact CE-CD1 3.46Å; M82-Y107 VanDerWaalsContact CE-CD1 3.46Å; M82-Y107 HydrophobicContact CE-CD2 3.73Å; M82-Y107 HydrophobicContact CE-CE1 3.14Å; M82-Y107 HydrophobicContact CE-CE2 3.45Å; M82-Y107 VanDerWaalsContact CE-CE2 3.45Å; M82-Y107 HydrophobicContact CE-CG 3.72Å; M82-Y107 HydrophobicContact CG-CE2 4.39Å; M82-Y107 HydrophobicContact SD-CD1 4.27Å; M82-Y107 HydrophobicContact SD-CD2 3.37Å; M82-Y107 WeakPolarHBondContact SD-CD2 3.33Å; M82-Y107 HydrophobicContact SD-CE1 4.03Å; M82-Y107 HydrophobicContact SD-CE2 3.08Å; M82-Y107 WeakPolarHBondContact SD-CE2 2.99Å; M82-Y107 HydrophobicContact SD-CG 3.95Å; P103-Y107 PolarHBondContact O-N 2.79Å; F104-Y107 PolarHBondContact O-N 3.28Å; F105-Y107 VanDerWaalsContact C-N 3.31Å; F105-Y107 PolarHBondContact O-N 3.46Å; Y107-I109 VanDerWaalsContact C-N 3.33Å; Y107-I109 PolarHBondContact O-N 2.83Å; Y107-F110 PolarHBondContact O-N 3.26Å; Y107-D111 HydrophobicContact CE1-CB 4.31Å; Y107-D111 WeakPolarHBondContact O-CB 3.2Å; Y107-D111 PolarHBondContact O-N 3.28Å
108	Q	93.7	Very high	92.5	Very high	5 Å²	5	55.8 Å²	55.8	2%	0.023	30%	0.303	C	S	.	.	H	α-helix	trans	-64.5	-36.7	178.6	-70.1	-175.5	-4.5	0	0	113.1	F104 F105 C106 F112 I173 V176	F104-Q108 HydrophobicContact CZ-CG 4.48Å; F104-Q108 WeakPolarHBondContact O-CG 3.44Å; F104-Q108 PolarHBondContact O-N 3.19Å; F105-Q108 PolarHBondContact O-N 2.8Å; C106-Q108 PolarHBondContact O-N 2.91Å; Q108-F112 VanDerWaalsContact O-CB 3.31Å; Q108-F112 WeakPolarHBondContact O-CB 3.31Å; Q108-F112 PolarHBondContact O-N 3.25Å; Q108-I173 HydrophobicContact CB-CD1 4.49Å; Q108-I173 HydrophobicContact CB-CG1 3.74Å; Q108-V176 VanDerWaalsContact NE2-CG2 3.33Å; Q108-V176 VanDerWaalsContact OE1-CG2 3.32Å
109	I	94.9	Very high	92.5	Very high	77 Å²	77	55.7 Å²	55.7	40%	0.395	30%	0.302	S	S	.	.	H	α-helix	trans	-64.2	-44.6	174.3	-68.2	169.6	0	0	0	110.3	F105 C106 Y107 F112 A113 I173	F105-I109 HydrophobicContact CD1-CD1 3.94Å; F105-I109 HydrophobicContact CE1-CD1 3.39Å; F105-I109 HydrophobicContact CE1-CG1 4.47Å; F105-I109 HydrophobicContact CE2-CD1 4.18Å; F105-I109 HydrophobicContact CZ-CD1 3.53Å; F105-I109 HydrophobicContact CZ-CG1 4.31Å; F105-I109 PolarHBondContact O-N 3.34Å; F105-I109 VanDerWaalsContact O-N 3.12Å; C106-I109 PolarHBondContact O-N 2.92Å; Y107-I109 VanDerWaalsContact C-N 3.33Å; Y107-I109 PolarHBondContact O-N 2.83Å; I109-F112 PolarHBondContact O-N 3.43Å; I109-A113 PolarHBondContact O-N 2.92Å; I109-I173 HydrophobicContact CG1-CG2 4.45Å
110	F	93.6	Very high	92.5	Very high	123 Å²	123	56.9 Å²	56.9	54%	0.539	30%	0.299	S	S	.	.	H	α-helix	trans	-63.8	-45.8	177.9	179.3	-107.4	0	0	0	111.9	C106 Y107 F112 A113 L114	C106-F110 PolarHBondContact O-N 3.12Å; Y107-F110 PolarHBondContact O-N 3.26Å; F110-F112 PolarHBondContact O-N 3.49Å; F110-A113 WeakPolarHBondContact O-CB 3.45Å; F110-A113 PolarHBondContact O-N 3.49Å; F110-A113 VanDerWaalsContact O-N 3.13Å; F110-L114 HydrophobicContact CD1-CD1 3.99Å; F110-L114 HydrophobicContact CD1-CG 4.38Å; F110-L114 HydrophobicContact CE1-CD1 3.39Å; F110-L114 HydrophobicContact CE1-CG 3.97Å; F110-L114 HydrophobicContact CE2-CD2 4.37Å; F110-L114 HydrophobicContact CE2-CG 4.33Å; F110-L114 HydrophobicContact CZ-CD1 3.73Å; F110-L114 HydrophobicContact CZ-CD2 4.04Å; F110-L114 HydrophobicContact CZ-CG 3.93Å; F110-L114 PolarHBondContact O-N 2.87Å
111	D	90.4	Very high	92.3	Very high	24 Å²	24	55.7 Å²	55.7	13%	0.128	30%	0.303	C	S	.	.	H	α-helix	trans	-57.8	-47.5	173.7	175.9	59.4	0	0	0	110.6	Y107 A113 L114 N115 K169	Y107-D111 HydrophobicContact CE1-CB 4.31Å; Y107-D111 WeakPolarHBondContact O-CB 3.2Å; Y107-D111 PolarHBondContact O-N 3.28Å; D111-A113 VanDerWaalsContact C-N 3.3Å; D111-A113 PolarHBondContact O-N 3.39Å; D111-L114 PolarHBondContact O-N 3.22Å; D111-N115 PolarHBondContact O-N 3.38Å; D111-N115 PolarHBondContact O-ND2 3.41Å; D111-N115 PolarHBondContact OD1-ND2 2.79Å; D111-K169 VanDerWaalsContact CG-NZ 3.33Å; D111-K169 IonicContact OD1-NZ 3.22Å; D111-K169 PolarHBondContact OD1-NZ 2.96Å; D111-K169 WeakPolarHBondContact OD2-CE 3.42Å; D111-K169 IonicContact OD2-NZ 2.69Å; D111-K169 PolarHBondContact OD2-NZ 3.4Å
112	F	94.5	Very high	92	Very high	71 Å²	71	57.3 Å²	57.3	31%	0.311	31%	0.313	S	S	.	.	H	α-helix	trans	-57.8	-40.8	174.6	175.5	-93.8	0	0	0	112.9	Q108 I109 F110 N115 T116 L166 K169 I173	Q108-F112 VanDerWaalsContact O-CB 3.31Å; Q108-F112 WeakPolarHBondContact O-CB 3.31Å; Q108-F112 PolarHBondContact O-N 3.25Å; I109-F112 PolarHBondContact O-N 3.43Å; F110-F112 PolarHBondContact O-N 3.49Å; F112-N115 PolarHBondContact O-N 3Å; F112-T116 WeakPolarHBondContact O-CB 3.28Å; F112-T116 PolarHBondContact O-N 2.76Å; F112-T116 PolarHBondContact O-OG1 3.41Å; F112-L166 HydrophobicContact CD2-CD2 4.37Å; F112-L166 HydrophobicContact CE2-CB 4.25Å; F112-L166 HydrophobicContact CE2-CD2 4.11Å; F112-K169 HydrophobicContact CD2-CB 3.98Å; F112-I173 HydrophobicContact CB-CD1 3.6Å; F112-I173 HydrophobicContact CD2-CD1 4.29Å; F112-I173 HydrophobicContact CG-CD1 3.95Å
113	A	95.6	Very high	91.6	Very high	51 Å²	51	57.8 Å²	57.8	42%	0.421	32%	0.315	S	S	.	.	H	α-helix	trans	-63.6	-45.1	175.7	0	0	0	0	0	112.1	I109 F110 D111 N115 T116 L117	I109-A113 PolarHBondContact O-N 2.92Å; F110-A113 WeakPolarHBondContact O-CB 3.45Å; F110-A113 PolarHBondContact O-N 3.49Å; F110-A113 VanDerWaalsContact O-N 3.13Å; D111-A113 VanDerWaalsContact C-N 3.3Å; D111-A113 PolarHBondContact O-N 3.39Å; A113-N115 PolarHBondContact O-N 3.19Å; A113-T116 PolarHBondContact O-N 2.89Å; A113-L117 PolarHBondContact O-N 2.87Å
114	L	90.2	Very high	91.3	Very high	76 Å²	76	59.1 Å²	59.1	40%	0.398	32%	0.322	S	S	.	.	H	α-helix	trans	-61.5	-43.5	175.6	-71.2	-177.4	0	0	0	112	F110 D111 T116 L117 V118	F110-L114 HydrophobicContact CD1-CD1 3.99Å; F110-L114 HydrophobicContact CD1-CG 4.38Å; F110-L114 HydrophobicContact CE1-CD1 3.39Å; F110-L114 HydrophobicContact CE1-CG 3.97Å; F110-L114 HydrophobicContact CE2-CD2 4.37Å; F110-L114 HydrophobicContact CE2-CG 4.33Å; F110-L114 HydrophobicContact CZ-CD1 3.73Å; F110-L114 HydrophobicContact CZ-CD2 4.04Å; F110-L114 HydrophobicContact CZ-CG 3.93Å; F110-L114 PolarHBondContact O-N 2.87Å; D111-L114 PolarHBondContact O-N 3.22Å; L114-T116 VanDerWaalsContact C-N 3.3Å; L114-T116 PolarHBondContact O-N 3.5Å; L114-L117 WeakPolarHBondContact O-CB 3.4Å; L114-L117 PolarHBondContact O-N 3.45Å; L114-V118 WeakPolarHBondContact O-CG2 3.33Å; L114-V118 PolarHBondContact O-N 3.48Å
115	N	90.6	Very high	90.9	Very high	48 Å²	48	66.2 Å²	66.2	26%	0.257	35%	0.35	S	S	.	.	H	α-helix	trans	-67.6	-34.1	178.4	-74.6	-98.9	0	0	0	111.9	D111 F112 A113 A119 L166 K169	D111-N115 PolarHBondContact O-N 3.38Å; D111-N115 PolarHBondContact O-ND2 3.41Å; D111-N115 PolarHBondContact OD1-ND2 2.79Å; F112-N115 PolarHBondContact O-N 3Å; A113-N115 PolarHBondContact O-N 3.19Å; N115-A119 VanDerWaalsContact O-CB 3.24Å; N115-A119 WeakPolarHBondContact O-CB 3.5Å; N115-A119 PolarHBondContact O-N 2.71Å; N115-L166 HydrophobicContact CB-CD2 4.15Å; N115-K169 HydrophobicContact CB-CD 4.32Å; N115-K169 PolarHBondContact ND2-NZ 3.3Å; N115-K169 PolarHBondContact OD1-NZ 3.44Å; N115-K169 VanDerWaalsContact OD1-NZ 3.08Å
116	T	93.5	Very high	90.1	Very high	40 Å²	40	66.6 Å²	66.6	25%	0.245	36%	0.356	C	S	.	.	H	α-helix	trans	-66.9	-39.8	172.7	-56.2	0	0	0	0	110.9	F112 A113 L114 A119 I120	F112-T116 WeakPolarHBondContact O-CB 3.28Å; F112-T116 PolarHBondContact O-N 2.76Å; F112-T116 PolarHBondContact O-OG1 3.41Å; A113-T116 PolarHBondContact O-N 2.89Å; L114-T116 VanDerWaalsContact C-N 3.3Å; L114-T116 PolarHBondContact O-N 3.5Å; T116-A119 WeakPolarHBondContact O-CB 3.34Å; T116-A119 PolarHBondContact O-N 3.17Å; T116-I120 HydrophobicContact CG2-CD1 4.09Å; T116-I120 VanDerWaalsContact O-CG1 3.28Å; T116-I120 WeakPolarHBondContact O-CG1 3.27Å; T116-I120 PolarHBondContact O-N 3.23Å
117	L	92.4	Very high	89.2	Confident	107 Å²	107	69 Å²	69	56%	0.56	36%	0.364	S	S	*	.	H	α-helix	trans	-63.2	-48	175.6	-176.6	67	0	0	0	111.3	A113 L114 A119 I120 T121	A113-L117 PolarHBondContact O-N 2.87Å; L114-L117 WeakPolarHBondContact O-CB 3.4Å; L114-L117 PolarHBondContact O-N 3.45Å; L117-A119 VanDerWaalsContact C-N 3.3Å; L117-A119 PolarHBondContact O-N 3.42Å; L117-I120 PolarHBondContact O-N 2.93Å; L117-T121 PolarHBondContact O-N 3.41Å; L117-T121 PolarHBondContact O-OG1 2.87Å; L117-T121 VanDerWaalsContact O-OG1 3.11Å
118	V	87.2	Confident	88.3	Confident	87 Å²	87	69.8 Å²	69.8	53%	0.527	38%	0.378	S	S	.	.	H	α-helix	trans	-58.7	-44.3	175.3	172.4	0	0	0	0	110.6	L114 I120 T121 V122	L114-V118 WeakPolarHBondContact O-CG2 3.33Å; L114-V118 PolarHBondContact O-N 3.48Å; V118-I120 PolarHBondContact O-N 3Å; V118-T121 WeakPolarHBondContact O-CB 3.3Å; V118-T121 PolarHBondContact O-N 2.88Å; V118-V122 HydrophobicContact CG1-CG2 4.48Å; V118-V122 VanDerWaalsContact O-CG2 3.3Å; V118-V122 WeakPolarHBondContact O-CG2 3.38Å; V118-V122 PolarHBondContact O-N 3.43Å
119	A	90.1	Very high	87.3	Confident	5 Å²	5	71.1 Å²	71.1	4%	0.041	39%	0.385	C	S	.	.	H	α-helix	trans	-56	-49.7	174	0	0	0	0	0	111.8	N115 T116 L117 T121 V122 L123 I162 L166	N115-A119 VanDerWaalsContact O-CB 3.24Å; N115-A119 WeakPolarHBondContact O-CB 3.5Å; N115-A119 PolarHBondContact O-N 2.71Å; T116-A119 WeakPolarHBondContact O-CB 3.34Å; T116-A119 PolarHBondContact O-N 3.17Å; L117-A119 VanDerWaalsContact C-N 3.3Å; L117-A119 PolarHBondContact O-N 3.42Å; A119-T121 VanDerWaalsContact C-N 3.33Å; A119-T121 PolarHBondContact O-N 2.78Å; A119-V122 WeakPolarHBondContact O-CB 3.11Å; A119-V122 PolarHBondContact O-N 3.42Å; A119-L123 VanDerWaalsContact O-CG 3.3Å; A119-L123 WeakPolarHBondContact O-CG 3.37Å; A119-L123 PolarHBondContact O-N 3.45Å; A119-I162 HydrophobicContact CB-CG2 3.34Å; A119-L166 HydrophobicContact CB-CD1 4.2Å
120	I	90.5	Very high	86.2	Confident	89 Å²	89	70.4 Å²	70.4	46%	0.456	38%	0.38	S	S	.	.	H	α-helix	trans	-60.6	-43.3	178.2	-67.7	163.7	0	0	0	110.9	T116 L117 V118 V122 L123 V124	T116-I120 HydrophobicContact CG2-CD1 4.09Å; T116-I120 VanDerWaalsContact O-CG1 3.28Å; T116-I120 WeakPolarHBondContact O-CG1 3.27Å; T116-I120 PolarHBondContact O-N 3.23Å; L117-I120 PolarHBondContact O-N 2.93Å; V118-I120 PolarHBondContact O-N 3Å; I120-V122 VanDerWaalsContact C-N 3.32Å; I120-V122 PolarHBondContact O-N 2.91Å; I120-L123 PolarHBondContact O-N 3.44Å; I120-V124 HydrophobicContact CG2-CG2 4.06Å; I120-V124 WeakPolarHBondContact O-CG2 3.34Å; I120-V124 PolarHBondContact O-N 3.23Å
121	T	87.2	Confident	85.2	Confident	73 Å²	73	68.9 Å²	68.9	45%	0.448	38%	0.375	S	S	.	.	H	α-helix	trans	-57.9	-45.1	176.6	-59.5	0	0	0	0	111.7	L117 V118 A119 L123 V124 Y125	L117-T121 PolarHBondContact O-N 3.41Å; L117-T121 PolarHBondContact O-OG1 2.87Å; L117-T121 VanDerWaalsContact O-OG1 3.11Å; V118-T121 WeakPolarHBondContact O-CB 3.3Å; V118-T121 PolarHBondContact O-N 2.88Å; A119-T121 VanDerWaalsContact C-N 3.33Å; A119-T121 PolarHBondContact O-N 2.78Å; T121-L123 VanDerWaalsContact C-N 3.25Å; T121-L123 PolarHBondContact O-N 2.98Å; T121-V124 PolarHBondContact O-N 2.95Å; T121-Y125 HydrophobicContact CG2-CD2 4.17Å; T121-Y125 PolarHBondContact O-N 3.49Å
122	V	84.8	Confident	84.3	Confident	35 Å²	35	75.1 Å²	75.1	21%	0.212	40%	0.398	C	S	.	.	H	α-helix	trans	-59.5	-36.4	175.6	165.3	0	0	0	0	111.4	V118 A119 I120 I129 I158	V118-V122 HydrophobicContact CG1-CG2 4.48Å; V118-V122 VanDerWaalsContact O-CG2 3.3Å; V118-V122 WeakPolarHBondContact O-CG2 3.38Å; V118-V122 PolarHBondContact O-N 3.43Å; A119-V122 WeakPolarHBondContact O-CB 3.11Å; A119-V122 PolarHBondContact O-N 3.42Å; I120-V122 VanDerWaalsContact C-N 3.32Å; I120-V122 PolarHBondContact O-N 2.91Å; V122-I129 HydrophobicContact CB-CD1 4.4Å; V122-I129 HydrophobicContact CG1-CD1 3.56Å; V122-I158 HydrophobicContact CG1-CG2 3.55Å
123	L	86	Confident	83.1	Confident	79 Å²	79	73.1 Å²	73.1	41%	0.414	39%	0.39	S	S	.	.	H	α-helix	trans	-78.4	-35.2	179.2	-62.6	-177.4	0	0	0	114.3	A119 I120 T121 L159	A119-L123 VanDerWaalsContact O-CG 3.3Å; A119-L123 WeakPolarHBondContact O-CG 3.37Å; A119-L123 PolarHBondContact O-N 3.45Å; I120-L123 PolarHBondContact O-N 3.44Å; T121-L123 VanDerWaalsContact C-N 3.25Å; T121-L123 PolarHBondContact O-N 2.98Å; L123-L159 HydrophobicContact CD1-CD2 3.62Å; L123-L159 HydrophobicContact CD2-CD1 4.25Å; L123-L159 HydrophobicContact CD2-CD2 3.17Å; L123-L159 HydrophobicContact CD2-CG 3.46Å; L123-L159 VanDerWaalsContact CD2-CG 3.46Å; L123-L159 HydrophobicContact CG-CD2 4Å
124	V	88.2	Confident	81.8	Confident	88 Å²	88	76.3 Å²	76.3	53%	0.533	39%	0.391	S	S	.	.	H	α-helix	trans	-78	-31.9	179	176	0	0	0	0	111	I120 T121 P126	I120-V124 HydrophobicContact CG2-CG2 4.06Å; I120-V124 WeakPolarHBondContact O-CG2 3.34Å; I120-V124 PolarHBondContact O-N 3.23Å; T121-V124 PolarHBondContact O-N 2.95Å; V124-P126 WeakPolarHBondContact O-CD 3.45Å
125	Y	84.7	Confident	81.1	Confident	149 Å²	149	79.3 Å²	79.3	58%	0.584	40%	0.403	S	S	*	.			trans	-121.8	60.1	-176.7	-58.4	-78.8	0	0	0	113.1	T121 N127 S128	T121-Y125 HydrophobicContact CG2-CD2 4.17Å; T121-Y125 PolarHBondContact O-N 3.49Å; Y125-N127 PolarHBondContact O-N 2.84Å; Y125-S128 VanDerWaalsContact O-CB 3.22Å; Y125-S128 WeakPolarHBondContact O-CB 3.22Å; Y125-S128 PolarHBondContact O-N 3.04Å
126	P	76.4	Confident	80.2	Confident	43 Å²	43	79 Å²	79	28%	0.279	40%	0.401	S	S	.	.	H	α-helix	trans	-61.8	-31.5	-179.7	26.3	-34.8	0	0	0	112.5	V124 S128 I129 Q130 V155	V124-P126 WeakPolarHBondContact O-CD 3.45Å; P126-S128 PolarHBondContact O-N 2.99Å; P126-I129 WeakPolarHBondContact O-CB 3.2Å; P126-I129 PolarHBondContact O-N 2.88Å; P126-I129 VanDerWaalsContact O-N 3.09Å; P126-Q130 PolarHBondContact O-N 2.88Å; P126-V155 HydrophobicContact CB-CG2 3.95Å
127	N	76.6	Confident	79.2	Confident	120 Å²	120	81.2 Å²	81.2	64%	0.642	42%	0.416	S	S	*	.	H	α-helix	trans	-62.2	-30.2	175.2	-65.1	-40.4	0	0	0	112.4	Y125 I129 Q130 E131	Y125-N127 PolarHBondContact O-N 2.84Å; N127-I129 PolarHBondContact O-N 3.47Å; N127-Q130 WeakPolarHBondContact O-CB 3.26Å; N127-Q130 PolarHBondContact O-N 3.39Å; N127-E131 PolarHBondContact O-N 3.49Å
128	S	74.2	Confident	77.8	Confident	75 Å²	75	81.6 Å²	81.6	52%	0.524	43%	0.425	S	S	.	.	H	α-helix	trans	-65.1	-30.1	176.1	-169.3	0	0	0	0	111.9	Y125 P126 E131 Y132	Y125-S128 VanDerWaalsContact O-CB 3.22Å; Y125-S128 WeakPolarHBondContact O-CB 3.22Å; Y125-S128 PolarHBondContact O-N 3.04Å; P126-S128 PolarHBondContact O-N 2.99Å; S128-E131 PolarHBondContact O-N 3.01Å; S128-Y132 WeakPolarHBondContact O-CB 3.41Å; S128-Y132 PolarHBondContact O-N 3.14Å
129	I	71.9	Confident	77.1	Confident	34 Å²	34	84.7 Å²	84.7	17%	0.174	44%	0.438	C	S	.	.	H	α-helix	trans	-70.6	-41.5	176.9	-50.5	167.6	0	0	0	109.5	V122 P126 N127 E131 Y132 I133 I158	V122-I129 HydrophobicContact CB-CD1 4.4Å; V122-I129 HydrophobicContact CG1-CD1 3.56Å; P126-I129 WeakPolarHBondContact O-CB 3.2Å; P126-I129 PolarHBondContact O-N 2.88Å; P126-I129 VanDerWaalsContact O-N 3.09Å; N127-I129 PolarHBondContact O-N 3.47Å; I129-E131 VanDerWaalsContact C-N 3.25Å; I129-E131 PolarHBondContact O-N 3.21Å; I129-Y132 PolarHBondContact O-N 3.36Å; I129-I133 HydrophobicContact CG2-CD1 3.9Å; I129-I133 HydrophobicContact CG2-CG1 4.44Å; I129-I133 WeakPolarHBondContact O-CD1 3.46Å; I129-I133 VanDerWaalsContact O-CG1 3.23Å; I129-I133 WeakPolarHBondContact O-CG1 2.92Å; I129-I133 PolarHBondContact O-N 3.2Å; I129-I158 HydrophobicContact CD1-CD1 3.86Å; I129-I158 HydrophobicContact CG2-CD1 4.19Å
130	Q	71.3	Confident	76.2	Confident	61 Å²	61	88.8 Å²	88.8	29%	0.285	46%	0.456	S	S	.	.	H	α-helix	trans	-61.1	-39.4	174.2	-64.9	-169.9	-16.1	0	0	111.3	P126 N127 I133 R134	P126-Q130 PolarHBondContact O-N 2.88Å; N127-Q130 WeakPolarHBondContact O-CB 3.26Å; N127-Q130 PolarHBondContact O-N 3.39Å; Q130-I133 PolarHBondContact O-N 3.3Å; Q130-R134 WeakPolarHBondContact O-CG 3.45Å; Q130-R134 PolarHBondContact O-N 2.89Å
131	E	73.5	Confident	75.3	Confident	92 Å²	92	89.5 Å²	89.5	43%	0.43	47%	0.466	S	S	.	.	H	α-helix	trans	-66.5	-41.5	176	-164	56.7	-154.1	0	0	112.2	N127 S128 I129 I133 R134 Q135	N127-E131 PolarHBondContact O-N 3.49Å; S128-E131 PolarHBondContact O-N 3.01Å; I129-E131 VanDerWaalsContact C-N 3.25Å; I129-E131 PolarHBondContact O-N 3.21Å; E131-I133 PolarHBondContact O-N 2.9Å; E131-R134 WeakPolarHBondContact O-CA 3.39Å; E131-R134 WeakPolarHBondContact O-CB 3.28Å; E131-R134 PolarHBondContact O-N 2.88Å; E131-R134 VanDerWaalsContact O-N 3.1Å; E131-R134 IonicContact OE2-NH1 3.65Å; E131-Q135 WeakPolarHBondContact O-CG 3.45Å; E131-Q135 PolarHBondContact O-N 3.15Å
132	Y	70.8	Confident	74.4	Confident	155 Å²	155	93 Å²	93	61%	0.608	47%	0.472	S	S	*	.	H	α-helix	trans	-60.4	-45.4	172.8	-175	-102.1	0	0	0	111.9	S128 I129 R134 Q135 L136	S128-Y132 WeakPolarHBondContact O-CB 3.41Å; S128-Y132 PolarHBondContact O-N 3.14Å; I129-Y132 PolarHBondContact O-N 3.36Å; Y132-R134 PolarHBondContact O-N 3.29Å; Y132-Q135 PolarHBondContact O-N 3.45Å; Y132-L136 HydrophobicContact CD1-CD1 3.73Å; Y132-L136 HydrophobicContact CE1-CD1 3.56Å; Y132-L136 HydrophobicContact CG-CD1 4.41Å; Y132-L136 WeakPolarHBondContact O-CD1 3.41Å; Y132-L136 PolarHBondContact O-N 3.32Å; Y132-L136 VanDerWaalsContact O-N 3.13Å
133	I	69.5	Low	73.7	Confident	28 Å²	28	94 Å²	94	14%	0.144	47%	0.472	C	S	.	.	H	α-helix	trans	-61.7	-32.3	174.8	-64.5	162.6	0	0	0	111.2	I129 Q130 E131 R143 V146 M147	I129-I133 HydrophobicContact CG2-CD1 3.9Å; I129-I133 HydrophobicContact CG2-CG1 4.44Å; I129-I133 WeakPolarHBondContact O-CD1 3.46Å; I129-I133 VanDerWaalsContact O-CG1 3.23Å; I129-I133 WeakPolarHBondContact O-CG1 2.92Å; I129-I133 PolarHBondContact O-N 3.2Å; Q130-I133 PolarHBondContact O-N 3.3Å; E131-I133 PolarHBondContact O-N 2.9Å; I133-R143 HydrophobicContact CG2-CG 4.42Å; I133-R143 PolarHBondContact O-NE 3.48Å; I133-V146 HydrophobicContact CD1-CG1 3.86Å; I133-M147 HydrophobicContact CG2-CE 3.82Å; I133-M147 HydrophobicContact CG2-CG 4.43Å
134	R	67.7	Low	73	Confident	119 Å²	119	95.5 Å²	95.5	45%	0.449	48%	0.48	S	S	.	.	H	α-helix	trans	-68.7	-36.8	173.2	-76.5	-178.6	-178.1	106.8	8.1	112.8	Q130 E131 Y132 L136 R143 M147	Q130-R134 WeakPolarHBondContact O-CG 3.45Å; Q130-R134 PolarHBondContact O-N 2.89Å; E131-R134 WeakPolarHBondContact O-CA 3.39Å; E131-R134 WeakPolarHBondContact O-CB 3.28Å; E131-R134 PolarHBondContact O-N 2.88Å; E131-R134 VanDerWaalsContact O-N 3.1Å; E131-R134 IonicContact OE2-NH1 3.65Å; Y132-R134 PolarHBondContact O-N 3.29Å; R134-L136 VanDerWaalsContact C-N 3.3Å; R134-R143 PolarHBondContact O-NH2 3.43Å; R134-M147 HydrophobicContact CB-CE 4.39Å; R134-M147 HydrophobicContact CG-CE 3.7Å
135	Q	76	Confident	72.3	Confident	138 Å²	138	95.8 Å²	95.8	65%	0.645	48%	0.479	S	S	*	.	H	α-helix	trans	-73.8	-17.4	178	-69.9	175.2	-13.5	0	0	113.7	E131 Y132	E131-Q135 WeakPolarHBondContact O-CG 3.45Å; E131-Q135 PolarHBondContact O-N 3.15Å; Y132-Q135 PolarHBondContact O-N 3.45Å
136	L	71	Confident	71.7	Confident	42 Å²	42	91.1 Å²	91.1	22%	0.22	47%	0.466	C	S	.	.	S	Bend	trans	-57.2	143	175.9	-99.2	74.9	0	0	0	111.2	Y132 R134 F140	Y132-L136 HydrophobicContact CD1-CD1 3.73Å; Y132-L136 HydrophobicContact CE1-CD1 3.56Å; Y132-L136 HydrophobicContact CG-CD1 4.41Å; Y132-L136 WeakPolarHBondContact O-CD1 3.41Å; Y132-L136 PolarHBondContact O-N 3.32Å; Y132-L136 VanDerWaalsContact O-N 3.13Å; R134-L136 VanDerWaalsContact C-N 3.3Å; L136-F140 HydrophobicContact CD2-CD1 3.99Å; L136-F140 HydrophobicContact CD2-CD2 4.38Å; L136-F140 HydrophobicContact CD2-CE1 4.27Å; L136-F140 HydrophobicContact CD2-CG 4.05Å
137	P	72.9	Confident	71.4	Confident	86 Å²	86	92.8 Å²	92.8	56%	0.558	47%	0.471	S	S	*	.			trans	-51.6	139.5	179	-25.6	32.4	0	0	0	111.8	N139 F140	P137-N139 PolarHBondContact O-N 3.42Å; P137-F140 WeakPolarHBondContact O-CB 3.08Å; P137-F140 PolarHBondContact O-N 3.47Å
138	P	64.6	Low	71.3	Confident	115 Å²	115	91.7 Å²	91.7	75%	0.747	47%	0.473	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	-17.4	-177.1	23.7	-33.1	0	0	0	113.4	F140	P138-F140 PolarHBondContact O-N 3.12Å
139	N	72.2	Confident	71.5	Confident	152 Å²	152	91 Å²	91	81%	0.813	47%	0.465	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.2	-0.1	176.2	-65	-24	0	0	0	114	P137 P141	P137-N139 PolarHBondContact O-N 3.42Å; N139-P141 VanDerWaalsContact O-CD 3.3Å; N139-P141 WeakPolarHBondContact O-CD 3.37Å
140	F	71.3	Confident	72	Confident	92 Å²	92	94.1 Å²	94.1	40%	0.404	48%	0.482	S	S	.	.			trans	-76.2	113	-179.5	-170.6	-105.6	0	0	0	110.9	L136 P137 P138 Y142 R143	L136-F140 HydrophobicContact CD2-CD1 3.99Å; L136-F140 HydrophobicContact CD2-CD2 4.38Å; L136-F140 HydrophobicContact CD2-CE1 4.27Å; L136-F140 HydrophobicContact CD2-CG 4.05Å; P137-F140 WeakPolarHBondContact O-CB 3.08Å; P137-F140 PolarHBondContact O-N 3.47Å; P138-F140 PolarHBondContact O-N 3.12Å; F140-Y142 PolarHBondContact O-N 3.02Å; F140-R143 HydrophobicContact CB-CB 4.45Å; F140-R143 HydrophobicContact CD1-CB 4.25Å; F140-R143 WeakPolarHBondContact O-CB 3.25Å; F140-R143 PolarHBondContact O-N 3.22Å; F140-R143 VanDerWaalsContact O-N 3.15Å
141	P	70.8	Confident	72.4	Confident	103 Å²	103	94.3 Å²	94.3	67%	0.669	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.8	-14.3	-165.9	24	-33.6	0	0	0	115	N139	N139-P141 VanDerWaalsContact O-CD 3.3Å; N139-P141 WeakPolarHBondContact O-CD 3.37Å
142	Y	69.1	Low	72.9	Confident	147 Å²	147	94.3 Å²	94.3	58%	0.576	50%	0.495	S	S	*	.	T	Hydrogen-bonded Turn	trans	-109.4	5.5	-178.1	-66.2	-78.7	0	0	0	113.8	F140 V146	F140-Y142 PolarHBondContact O-N 3.02Å; Y142-V146 WeakPolarHBondContact O-CG2 3.41Å; Y142-V146 PolarHBondContact O-N 2.99Å; Y142-V146 VanDerWaalsContact O-N 3.16Å
143	R	69.2	Low	73.5	Confident	57 Å²	57	89.8 Å²	89.8	22%	0.215	49%	0.485	C	S	.	.	H	α-helix	trans	-61.4	-49.5	-174.7	-178.6	178.2	-176.8	-90.3	11	111.9	I133 R134 F140 V146 M147	I133-R143 HydrophobicContact CG2-CG 4.42Å; I133-R143 PolarHBondContact O-NE 3.48Å; R134-R143 PolarHBondContact O-NH2 3.43Å; F140-R143 HydrophobicContact CB-CB 4.45Å; F140-R143 HydrophobicContact CD1-CB 4.25Å; F140-R143 WeakPolarHBondContact O-CB 3.25Å; F140-R143 PolarHBondContact O-N 3.22Å; F140-R143 VanDerWaalsContact O-N 3.15Å; R143-V146 PolarHBondContact O-N 3.1Å; R143-M147 HydrophobicContact CG-CE 3.7Å; R143-M147 WeakPolarHBondContact O-CG 3.17Å; R143-M147 PolarHBondContact O-N 3.25Å
144	D	70.3	Confident	74.2	Confident	109 Å²	109	89.6 Å²	89.6	58%	0.583	48%	0.484	S	S	*	.	H	α-helix	trans	-73	-36.5	-174.8	-58.2	-45.4	0	0	0	111.7	V146 M147 S148	D144-V146 VanDerWaalsContact C-N 3.34Å; D144-V146 PolarHBondContact O-N 3.22Å; D144-M147 PolarHBondContact O-N 2.95Å; D144-S148 PolarHBondContact O-N 3.48Å
145	D	74.2	Confident	75	Confident	95 Å²	95	86.1 Å²	86.1	51%	0.508	48%	0.476	S	S	.	.	H	α-helix	trans	-58.8	-46.3	174.2	-70.8	-23	0	0	0	110.9	M147 S148 V149	D145-M147 VanDerWaalsContact C-N 3.34Å; D145-M147 PolarHBondContact O-N 3.47Å; D145-S148 PolarHBondContact O-N 3.4Å; D145-S148 VanDerWaalsContact O-N 3.17Å; D145-S148 PolarHBondContact O-OG 2.89Å; D145-V149 WeakPolarHBondContact O-CG2 3.44Å; D145-V149 PolarHBondContact O-N 2.98Å
146	V	71.8	Confident	75.5	Confident	51 Å²	51	84.7 Å²	84.7	31%	0.309	47%	0.472	S	S	.	.	H	α-helix	trans	-66.2	-36.2	179.5	176.2	0	0	0	0	111.8	I133 Y142 R143 D144 S148 V149 L154	I133-V146 HydrophobicContact CD1-CG1 3.86Å; Y142-V146 WeakPolarHBondContact O-CG2 3.41Å; Y142-V146 PolarHBondContact O-N 2.99Å; Y142-V146 VanDerWaalsContact O-N 3.16Å; R143-V146 PolarHBondContact O-N 3.1Å; D144-V146 VanDerWaalsContact C-N 3.34Å; D144-V146 PolarHBondContact O-N 3.22Å; V146-S148 VanDerWaalsContact C-N 3.3Å; V146-V149 PolarHBondContact O-N 3.31Å; V146-L154 HydrophobicContact CG1-CD1 3.61Å
147	M	70.7	Confident	76.3	Confident	77 Å²	77	87.6 Å²	87.6	38%	0.379	49%	0.487	S	S	.	.	H	α-helix	trans	-69.8	-27	174.9	-70.3	-173.6	-165.4	0	0	113.1	I133 R134 R143 D144 D145 V149	I133-M147 HydrophobicContact CG2-CE 3.82Å; I133-M147 HydrophobicContact CG2-CG 4.43Å; R134-M147 HydrophobicContact CB-CE 4.39Å; R134-M147 HydrophobicContact CG-CE 3.7Å; R143-M147 HydrophobicContact CG-CE 3.7Å; R143-M147 WeakPolarHBondContact O-CG 3.17Å; R143-M147 PolarHBondContact O-N 3.25Å; D144-M147 PolarHBondContact O-N 2.95Å; D145-M147 VanDerWaalsContact C-N 3.34Å; D145-M147 PolarHBondContact O-N 3.47Å; M147-V149 VanDerWaalsContact C-N 3.31Å
148	S	75.3	Confident	77	Confident	98 Å²	98	85.4 Å²	85.4	69%	0.685	47%	0.47	S	S	*	.	H	α-helix	trans	-74.6	-21.3	177.3	80.3	0	0	0	0	113.3	D144 D145 V146	D144-S148 PolarHBondContact O-N 3.48Å; D145-S148 PolarHBondContact O-N 3.4Å; D145-S148 VanDerWaalsContact O-N 3.17Å; D145-S148 PolarHBondContact O-OG 2.89Å; V146-S148 VanDerWaalsContact C-N 3.3Å
149	V	78.2	Confident	78.2	Confident	59 Å²	59	83 Å²	83	36%	0.358	45%	0.451	S	S	.	.	S	Bend	trans	-70.6	139.1	178.8	179.7	0	0	0	0	110.3	D145 V146 M147 C153 L154	D145-V149 WeakPolarHBondContact O-CG2 3.44Å; D145-V149 PolarHBondContact O-N 2.98Å; V146-V149 PolarHBondContact O-N 3.31Å; M147-V149 VanDerWaalsContact C-N 3.31Å; V149-C153 HydrophobicContact CG1-CB 4.18Å; V149-L154 HydrophobicContact CG1-CB 4.34Å
150	N	82.1	Confident	79.1	Confident	101 Å²	101	80.8 Å²	80.8	54%	0.54	44%	0.439	S	S	.	.			trans	-54.1	124.7	174.5	-179.1	3.3	0	0	0	110.3	T152 C153 L154	N150-T152 PolarHBondContact O-N 3.09Å; N150-T152 VanDerWaalsContact O-N 3.09Å; N150-T152 PolarHBondContact OD1-N 2.98Å; N150-C153 HydrophobicContact CB-CB 4.32Å; N150-C153 WeakPolarHBondContact O-CB 3.26Å; N150-C153 PolarHBondContact O-N 3.31Å; N150-L154 PolarHBondContact O-N 3.39Å; N150-L154 VanDerWaalsContact O-N 3.08Å
151	P	79.2	Confident	80	Confident	65 Å²	65	82.5 Å²	82.5	42%	0.422	45%	0.446	S	S	.	.	H	α-helix	trans	-52.7	-36.1	-177.3	19.2	-35.1	0	0	0	113.6	L154 V155	P151-L154 PolarHBondContact O-N 3.34Å; P151-V155 WeakPolarHBondContact O-CG2 3.08Å; P151-V155 PolarHBondContact O-N 3.39Å
152	T	83.1	Confident	80.9	Confident	92 Å²	92	79.3 Å²	79.3	56%	0.564	42%	0.423	S	S	*	.	H	α-helix	trans	-64.4	-42.6	177.6	-50	0	0	0	0	112	N150 V155 L156	N150-T152 PolarHBondContact O-N 3.09Å; N150-T152 VanDerWaalsContact O-N 3.09Å; N150-T152 PolarHBondContact OD1-N 2.98Å; T152-V155 PolarHBondContact O-N 2.95Å; T152-L156 WeakPolarHBondContact O-CG 3.41Å; T152-L156 PolarHBondContact O-N 3.37Å; T152-L156 VanDerWaalsContact O-N 3.14Å
153	C	85.4	Confident	82	Confident	59 Å²	59	75.5 Å²	75.5	40%	0.399	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-43.1	177.7	-172.6	0	0	0	0	110.8	V149 N150 V155 L156 I157	V149-C153 HydrophobicContact CG1-CB 4.18Å; N150-C153 HydrophobicContact CB-CB 4.32Å; N150-C153 WeakPolarHBondContact O-CB 3.26Å; N150-C153 PolarHBondContact O-N 3.31Å; C153-V155 PolarHBondContact O-N 3.38Å; C153-L156 WeakPolarHBondContact O-CB 3.38Å; C153-L156 PolarHBondContact O-N 3.47Å; C153-I157 WeakPolarHBondContact O-CG1 3.5Å; C153-I157 PolarHBondContact O-N 2.86Å
154	L	83.4	Confident	83.2	Confident	25 Å²	25	77.6 Å²	77.6	13%	0.131	43%	0.432	C	S	.	.	H	α-helix	trans	-58.2	-46.3	176.5	-176	157	0	0	0	111.5	V146 V149 N150 P151 L156 I157 I158	V146-L154 HydrophobicContact CG1-CD1 3.61Å; V149-L154 HydrophobicContact CG1-CB 4.34Å; N150-L154 PolarHBondContact O-N 3.39Å; N150-L154 VanDerWaalsContact O-N 3.08Å; P151-L154 PolarHBondContact O-N 3.34Å; L154-L156 VanDerWaalsContact C-N 3.32Å; L154-L156 PolarHBondContact O-N 3.42Å; L154-I157 PolarHBondContact O-N 3.46Å; L154-I158 HydrophobicContact CD2-CD1 3.41Å; L154-I158 VanDerWaalsContact CD2-CD1 3.41Å; L154-I158 HydrophobicContact CD2-CG1 4.19Å; L154-I158 HydrophobicContact CG-CD1 4.43Å; L154-I158 WeakPolarHBondContact O-CG1 3.47Å; L154-I158 PolarHBondContact O-N 2.93Å
155	V	84.3	Confident	84.3	Confident	45 Å²	45	74.7 Å²	74.7	27%	0.273	42%	0.416	S	S	.	.	H	α-helix	trans	-60.9	-40.6	176.6	170.9	0	0	0	0	111.7	P126 P151 T152 C153 I158 L159	P126-V155 HydrophobicContact CB-CG2 3.95Å; P151-V155 WeakPolarHBondContact O-CG2 3.08Å; P151-V155 PolarHBondContact O-N 3.39Å; T152-V155 PolarHBondContact O-N 2.95Å; C153-V155 PolarHBondContact O-N 3.38Å; V155-I158 PolarHBondContact O-N 3.25Å; V155-L159 HydrophobicContact CG1-CD1 3.99Å; V155-L159 WeakPolarHBondContact O-CB 3.48Å; V155-L159 WeakPolarHBondContact O-CG 3.4Å; V155-L159 PolarHBondContact O-N 2.94Å
156	L	87.2	Confident	85.2	Confident	108 Å²	108	71.9 Å²	71.9	57%	0.565	40%	0.401	S	S	*	.	H	α-helix	trans	-63.7	-41.4	176.3	-69.8	175.4	0	0	0	112.4	T152 C153 L154 L159 L160	T152-L156 WeakPolarHBondContact O-CG 3.41Å; T152-L156 PolarHBondContact O-N 3.37Å; T152-L156 VanDerWaalsContact O-N 3.14Å; C153-L156 WeakPolarHBondContact O-CB 3.38Å; C153-L156 PolarHBondContact O-N 3.47Å; L154-L156 VanDerWaalsContact C-N 3.32Å; L154-L156 PolarHBondContact O-N 3.42Å; L156-L159 HydrophobicContact CD2-CD1 4.46Å; L156-L159 WeakPolarHBondContact O-CB 3.39Å; L156-L159 PolarHBondContact O-N 3.21Å; L156-L160 WeakPolarHBondContact O-CB 3.17Å; L156-L160 PolarHBondContact O-N 2.83Å
157	I	87.9	Confident	86.2	Confident	103 Å²	103	74 Å²	74	53%	0.528	41%	0.414	S	S	.	.	H	α-helix	trans	-63.1	-44.9	176.3	-67.5	167.1	0	0	0	110.4	C153 L154 L160 F161	C153-I157 WeakPolarHBondContact O-CG1 3.5Å; C153-I157 PolarHBondContact O-N 2.86Å; L154-I157 PolarHBondContact O-N 3.46Å; I157-L160 PolarHBondContact O-N 3.43Å; I157-F161 PolarHBondContact O-N 3.24Å
158	I	87.4	Confident	87.2	Confident	41 Å²	41	76.2 Å²	76.2	21%	0.21	42%	0.422	C	S	.	.	H	α-helix	trans	-62	-47.3	176.7	-68.1	179.9	0	0	0	110.6	V122 I129 L154 V155 L160 F161 I162	V122-I158 HydrophobicContact CG1-CG2 3.55Å; I129-I158 HydrophobicContact CD1-CD1 3.86Å; I129-I158 HydrophobicContact CG2-CD1 4.19Å; L154-I158 HydrophobicContact CD2-CD1 3.41Å; L154-I158 VanDerWaalsContact CD2-CD1 3.41Å; L154-I158 HydrophobicContact CD2-CG1 4.19Å; L154-I158 HydrophobicContact CG-CD1 4.43Å; L154-I158 WeakPolarHBondContact O-CG1 3.47Å; L154-I158 PolarHBondContact O-N 2.93Å; V155-I158 PolarHBondContact O-N 3.25Å; I158-L160 VanDerWaalsContact C-N 3.31Å; I158-L160 PolarHBondContact O-N 3.42Å; I158-F161 PolarHBondContact O-N 3.29Å; I158-I162 HydrophobicContact CG2-CG1 4.1Å; I158-I162 WeakPolarHBondContact O-CB 3.32Å; I158-I162 VanDerWaalsContact O-CG1 3.26Å; I158-I162 WeakPolarHBondContact O-CG1 3.35Å; I158-I162 PolarHBondContact O-N 2.72Å
159	L	88.5	Confident	87.9	Confident	64 Å²	64	73.1 Å²	73.1	34%	0.335	40%	0.396	S	S	.	.	H	α-helix	trans	-54.5	-46.7	176.6	-91.6	167	0	0	0	112.5	L123 V155 L156 I162 S163	L123-L159 HydrophobicContact CD1-CD2 3.62Å; L123-L159 HydrophobicContact CD2-CD1 4.25Å; L123-L159 HydrophobicContact CD2-CD2 3.17Å; L123-L159 HydrophobicContact CD2-CG 3.46Å; L123-L159 VanDerWaalsContact CD2-CG 3.46Å; L123-L159 HydrophobicContact CG-CD2 4Å; V155-L159 HydrophobicContact CG1-CD1 3.99Å; V155-L159 WeakPolarHBondContact O-CB 3.48Å; V155-L159 WeakPolarHBondContact O-CG 3.4Å; V155-L159 PolarHBondContact O-N 2.94Å; L156-L159 HydrophobicContact CD2-CD1 4.46Å; L156-L159 WeakPolarHBondContact O-CB 3.39Å; L156-L159 PolarHBondContact O-N 3.21Å; L159-I162 PolarHBondContact O-N 3.27Å; L159-S163 WeakPolarHBondContact O-CB 3.27Å; L159-S163 PolarHBondContact O-N 3.49Å
160	L	91.3	Very high	88.6	Confident	106 Å²	106	71.4 Å²	71.4	56%	0.555	39%	0.39	S	S	*	.	H	α-helix	trans	-59.2	-51.2	177.3	-169	178.7	0	0	0	109.9	L156 I157 I158 I162 S163 I164	L156-L160 WeakPolarHBondContact O-CB 3.17Å; L156-L160 PolarHBondContact O-N 2.83Å; I157-L160 PolarHBondContact O-N 3.43Å; I158-L160 VanDerWaalsContact C-N 3.31Å; I158-L160 PolarHBondContact O-N 3.42Å; L160-I162 PolarHBondContact O-N 2.85Å; L160-S163 PolarHBondContact O-N 2.87Å; L160-I164 HydrophobicContact CD2-CD1 3.22Å; L160-I164 HydrophobicContact CD2-CG1 3.86Å; L160-I164 WeakPolarHBondContact O-CG1 3.32Å; L160-I164 PolarHBondContact O-N 3.3Å
161	F	91.1	Very high	89	Confident	127 Å²	127	70.1 Å²	70.1	56%	0.557	38%	0.378	S	S	*	.	H	α-helix	trans	-60.6	-45.3	-179.2	-175	-112.4	0	0	0	112.3	I157 I158 S163 I164 I165	I157-F161 PolarHBondContact O-N 3.24Å; I158-F161 PolarHBondContact O-N 3.29Å; F161-S163 PolarHBondContact O-N 2.95Å; F161-I164 PolarHBondContact O-N 2.84Å; F161-I165 HydrophobicContact CD1-CD1 3.53Å; F161-I165 HydrophobicContact CD2-CD1 4.5Å; F161-I165 HydrophobicContact CE1-CD1 3.2Å; F161-I165 HydrophobicContact CE1-CG1 4.33Å; F161-I165 HydrophobicContact CE2-CD1 4.22Å; F161-I165 HydrophobicContact CG-CD1 4.2Å; F161-I165 HydrophobicContact CZ-CD1 3.58Å; F161-I165 HydrophobicContact CZ-CG1 4.34Å; F161-I165 WeakPolarHBondContact O-CG1 3.29Å; F161-I165 PolarHBondContact O-N 2.91Å
162	I	90.2	Very high	89.6	Confident	36 Å²	36	68.1 Å²	68.1	19%	0.185	36%	0.364	C	S	.	.	H	α-helix	trans	-61.2	-43.9	176.1	-69.7	-57.5	0	0	0	111.4	A119 I158 L159 L160 I164 I165 L166	A119-I162 HydrophobicContact CB-CG2 3.34Å; I158-I162 HydrophobicContact CG2-CG1 4.1Å; I158-I162 WeakPolarHBondContact O-CB 3.32Å; I158-I162 VanDerWaalsContact O-CG1 3.26Å; I158-I162 WeakPolarHBondContact O-CG1 3.35Å; I158-I162 PolarHBondContact O-N 2.72Å; L159-I162 PolarHBondContact O-N 3.27Å; L160-I162 PolarHBondContact O-N 2.85Å; I162-I164 PolarHBondContact O-N 2.86Å; I162-I165 PolarHBondContact O-N 2.92Å; I162-L166 HydrophobicContact CG2-CD1 3.98Å; I162-L166 HydrophobicContact CG2-CG 4.37Å; I162-L166 WeakPolarHBondContact O-CG 3.37Å; I162-L166 PolarHBondContact O-N 3.26Å
163	S	92.1	Very high	90	Very high	67 Å²	67	65 Å²	65	47%	0.469	34%	0.344	S	S	.	.	H	α-helix	trans	-61.8	-42	177	-176.4	0	0	0	0	112.2	L159 L160 F161 L166 T167	L159-S163 WeakPolarHBondContact O-CB 3.27Å; L159-S163 PolarHBondContact O-N 3.49Å; L160-S163 PolarHBondContact O-N 2.87Å; F161-S163 PolarHBondContact O-N 2.95Å; S163-L166 PolarHBondContact O-N 2.89Å; S163-T167 WeakPolarHBondContact O-CB 2.8Å; S163-T167 PolarHBondContact O-N 2.85Å; S163-T167 PolarHBondContact O-OG1 3.29Å
164	I	94.4	Very high	90.2	Very high	101 Å²	101	65 Å²	65	52%	0.518	35%	0.345	S	S	.	.	H	α-helix	trans	-60.5	-47.7	174.3	-71	177.4	0	0	0	110.5	L160 F161 I162 L166 T167 F168	L160-I164 HydrophobicContact CD2-CD1 3.22Å; L160-I164 HydrophobicContact CD2-CG1 3.86Å; L160-I164 WeakPolarHBondContact O-CG1 3.32Å; L160-I164 PolarHBondContact O-N 3.3Å; F161-I164 PolarHBondContact O-N 2.84Å; I162-I164 PolarHBondContact O-N 2.86Å; I164-L166 PolarHBondContact O-N 3.46Å; I164-T167 PolarHBondContact O-N 2.78Å; I164-F168 WeakPolarHBondContact O-CB 3.41Å; I164-F168 PolarHBondContact O-N 3.35Å
165	I	91.8	Very high	90.5	Very high	49 Å²	49	64.3 Å²	64.3	25%	0.251	34%	0.341	S	S	.	.	H	α-helix	trans	-60.3	-47.7	179.5	-70.5	167	0	0	0	111.1	F161 I162 T167 F168 K169	F161-I165 HydrophobicContact CD1-CD1 3.53Å; F161-I165 HydrophobicContact CD2-CD1 4.5Å; F161-I165 HydrophobicContact CE1-CD1 3.2Å; F161-I165 HydrophobicContact CE1-CG1 4.33Å; F161-I165 HydrophobicContact CE2-CD1 4.22Å; F161-I165 HydrophobicContact CG-CD1 4.2Å; F161-I165 HydrophobicContact CZ-CD1 3.58Å; F161-I165 HydrophobicContact CZ-CG1 4.34Å; F161-I165 WeakPolarHBondContact O-CG1 3.29Å; F161-I165 PolarHBondContact O-N 2.91Å; I162-I165 PolarHBondContact O-N 2.92Å; I165-T167 VanDerWaalsContact C-N 3.34Å; I165-T167 PolarHBondContact O-N 2.83Å; I165-F168 PolarHBondContact O-N 3.49Å; I165-K169 WeakPolarHBondContact O-CG 3.14Å; I165-K169 PolarHBondContact O-N 2.9Å
166	L	93.3	Very high	90.8	Very high	35 Å²	35	62.1 Å²	62.1	18%	0.183	33%	0.328	C	S	.	.	H	α-helix	trans	-63.9	-41.1	-179.8	-69.4	177.3	0	0	0	111.5	F112 N115 A119 I162 S163 I164 F168 K169 G170	F112-L166 HydrophobicContact CD2-CD2 4.37Å; F112-L166 HydrophobicContact CE2-CB 4.25Å; F112-L166 HydrophobicContact CE2-CD2 4.11Å; N115-L166 HydrophobicContact CB-CD2 4.15Å; A119-L166 HydrophobicContact CB-CD1 4.2Å; I162-L166 HydrophobicContact CG2-CD1 3.98Å; I162-L166 HydrophobicContact CG2-CG 4.37Å; I162-L166 WeakPolarHBondContact O-CG 3.37Å; I162-L166 PolarHBondContact O-N 3.26Å; S163-L166 PolarHBondContact O-N 2.89Å; I164-L166 PolarHBondContact O-N 3.46Å; L166-F168 VanDerWaalsContact C-N 3.35Å; L166-K169 PolarHBondContact O-N 3.41Å; L166-G170 PolarHBondContact O-N 2.96Å
167	T	93.4	Very high	91	Very high	95 Å²	95	61.4 Å²	61.4	58%	0.583	32%	0.318	S	S	*	.	H	α-helix	trans	-62.8	-43.5	175.8	-56.9	0	0	0	0	110.9	S163 I164 I165 G170 Y171	S163-T167 WeakPolarHBondContact O-CB 2.8Å; S163-T167 PolarHBondContact O-N 2.85Å; S163-T167 PolarHBondContact O-OG1 3.29Å; I164-T167 PolarHBondContact O-N 2.78Å; I165-T167 VanDerWaalsContact C-N 3.34Å; I165-T167 PolarHBondContact O-N 2.83Å; T167-G170 PolarHBondContact O-N 3Å; T167-Y171 PolarHBondContact O-N 3.18Å
168	F	91.3	Very high	90.9	Very high	124 Å²	124	58.2 Å²	58.2	54%	0.544	30%	0.302	S	S	.	.	H	α-helix	trans	-61.2	-45.5	175.7	179.6	-105.3	0	0	0	111.7	I164 I165 L166 G170 Y171 L172	I164-F168 WeakPolarHBondContact O-CB 3.41Å; I164-F168 PolarHBondContact O-N 3.35Å; I165-F168 PolarHBondContact O-N 3.49Å; L166-F168 VanDerWaalsContact C-N 3.35Å; F168-G170 PolarHBondContact O-N 3.24Å; F168-Y171 WeakPolarHBondContact O-CB 3.38Å; F168-Y171 PolarHBondContact O-N 3.33Å; F168-L172 HydrophobicContact CD1-CD1 4.01Å; F168-L172 HydrophobicContact CE1-CD1 3.54Å; F168-L172 HydrophobicContact CE1-CG 4.2Å; F168-L172 HydrophobicContact CZ-CD1 3.99Å; F168-L172 HydrophobicContact CZ-CD2 4.21Å; F168-L172 HydrophobicContact CZ-CG 4.28Å; F168-L172 WeakPolarHBondContact O-CG 3.5Å; F168-L172 PolarHBondContact O-N 3.48Å
169	K	90.8	Very high	91	Very high	34 Å²	34	56.3 Å²	56.3	15%	0.148	29%	0.292	C	S	.	.	H	α-helix	trans	-61.9	-42.7	175.1	-72.5	-163.5	174.4	-159.4	0	112.6	D111 F112 N115 I165 L166 Y171 L172 I173	D111-K169 VanDerWaalsContact CG-NZ 3.33Å; D111-K169 IonicContact OD1-NZ 3.22Å; D111-K169 PolarHBondContact OD1-NZ 2.96Å; D111-K169 WeakPolarHBondContact OD2-CE 3.42Å; D111-K169 IonicContact OD2-NZ 2.69Å; D111-K169 PolarHBondContact OD2-NZ 3.4Å; F112-K169 HydrophobicContact CD2-CB 3.98Å; N115-K169 HydrophobicContact CB-CD 4.32Å; N115-K169 PolarHBondContact ND2-NZ 3.3Å; N115-K169 PolarHBondContact OD1-NZ 3.44Å; N115-K169 VanDerWaalsContact OD1-NZ 3.08Å; I165-K169 WeakPolarHBondContact O-CG 3.14Å; I165-K169 PolarHBondContact O-N 2.9Å; L166-K169 PolarHBondContact O-N 3.41Å; K169-Y171 VanDerWaalsContact C-N 3.29Å; K169-Y171 PolarHBondContact O-N 3.22Å; K169-L172 WeakPolarHBondContact O-CB 3.34Å; K169-L172 PolarHBondContact O-N 3.46Å; K169-L172 VanDerWaalsContact O-N 3.16Å; K169-I173 WeakPolarHBondContact O-CG1 3.49Å; K169-I173 PolarHBondContact O-N 3.43Å
170	G	93.5	Very high	91	Very high	23 Å²	23	55.6 Å²	55.6	24%	0.237	29%	0.285	C	S	.	.	H	α-helix	trans	-60.6	-37.4	174.7	0	0	0	0	0	113	L166 T167 F168 I173 S174	L166-G170 PolarHBondContact O-N 2.96Å; T167-G170 PolarHBondContact O-N 3Å; F168-G170 PolarHBondContact O-N 3.24Å; G170-I173 PolarHBondContact O-N 3.1Å; G170-S174 WeakPolarHBondContact O-CB 3.45Å; G170-S174 PolarHBondContact O-N 3.43Å; G170-S174 PolarHBondContact O-OG 2.98Å
171	Y	90.2	Very high	90.8	Very high	73 Å²	73	54.9 Å²	54.9	29%	0.286	28%	0.275	S	S	.	.	H	α-helix	trans	-64	-43.5	173.1	173.7	-103	0	0	0	111.9	C15 C16 T167 F168 K169 S174 C175	C15-Y171 VanDerWaalsContact SG-CE2 3.56Å; C15-Y171 VanDerWaalsContact SG-CZ 3.59Å; C15-Y171 PolarHBondContact SG-OH 2.97Å; C16-Y171 HydrophobicContact CB-CE2 4.17Å; C16-Y171 PolarHBondContact O-OH 3.44Å; T167-Y171 PolarHBondContact O-N 3.18Å; F168-Y171 WeakPolarHBondContact O-CB 3.38Å; F168-Y171 PolarHBondContact O-N 3.33Å; K169-Y171 VanDerWaalsContact C-N 3.29Å; K169-Y171 PolarHBondContact O-N 3.22Å; Y171-S174 WeakPolarHBondContact O-CB 3.33Å; Y171-S174 PolarHBondContact O-N 3.5Å; Y171-C175 VanDerWaalsContact CE1-SG 3.59Å; Y171-C175 VanDerWaalsContact CZ-SG 3.58Å; Y171-C175 PolarHBondContact O-N 2.87Å; Y171-C175 PolarHBondContact O-SG 3.29Å
172	L	90.6	Very high	90.5	Very high	24 Å²	24	51.6 Å²	51.6	13%	0.126	26%	0.26	C	S	.	.	H	α-helix	trans	-61.6	-44.5	176.3	-65.4	177.7	0	0	0	112.2	L28 F168 K169 S174 C175 V176	L28-L172 HydrophobicContact CD1-CD1 3.89Å; L28-L172 HydrophobicContact CD1-CD2 3.72Å; L28-L172 HydrophobicContact CD1-CG 4.29Å; L28-L172 HydrophobicContact CD2-CB 4.09Å; L28-L172 HydrophobicContact CD2-CD2 4.14Å; F168-L172 HydrophobicContact CD1-CD1 4.01Å; F168-L172 HydrophobicContact CE1-CD1 3.54Å; F168-L172 HydrophobicContact CE1-CG 4.2Å; F168-L172 HydrophobicContact CZ-CD1 3.99Å; F168-L172 HydrophobicContact CZ-CD2 4.21Å; F168-L172 HydrophobicContact CZ-CG 4.28Å; F168-L172 WeakPolarHBondContact O-CG 3.5Å; F168-L172 PolarHBondContact O-N 3.48Å; K169-L172 WeakPolarHBondContact O-CB 3.34Å; K169-L172 PolarHBondContact O-N 3.46Å; K169-L172 VanDerWaalsContact O-N 3.16Å; L172-S174 VanDerWaalsContact C-N 3.27Å; L172-S174 PolarHBondContact O-N 2.93Å; L172-C175 WeakPolarHBondContact O-CB 3.41Å; L172-C175 PolarHBondContact O-N 3.24Å; L172-C175 VanDerWaalsContact O-N 3.12Å; L172-V176 PolarHBondContact O-N 3.09Å
173	I	92.3	Very high	90.3	Very high	27 Å²	27	49.9 Å²	49.9	14%	0.138	25%	0.251	C	S	.	.	H	α-helix	trans	-56.7	-44.9	173.9	-68.9	166.2	0	0	0	110.6	F105 Q108 I109 F112 K169 G170 C175 V176 W177	F105-I173 HydrophobicContact CD2-CG2 4.39Å; F105-I173 HydrophobicContact CE2-CG2 3.66Å; F105-I173 HydrophobicContact CZ-CG2 4.43Å; Q108-I173 HydrophobicContact CB-CD1 4.49Å; Q108-I173 HydrophobicContact CB-CG1 3.74Å; I109-I173 HydrophobicContact CG1-CG2 4.45Å; F112-I173 HydrophobicContact CB-CD1 3.6Å; F112-I173 HydrophobicContact CD2-CD1 4.29Å; F112-I173 HydrophobicContact CG-CD1 3.95Å; K169-I173 WeakPolarHBondContact O-CG1 3.49Å; K169-I173 PolarHBondContact O-N 3.43Å; G170-I173 PolarHBondContact O-N 3.1Å; I173-C175 VanDerWaalsContact C-N 3.33Å; I173-C175 PolarHBondContact O-N 2.97Å; I173-V176 PolarHBondContact O-N 3.46Å; I173-W177 WeakPolarHBondContact O-CB 3.39Å; I173-W177 PolarHBondContact O-N 3.46Å
174	S	90	Very high	90	Very high	59 Å²	59	50 Å²	50	41%	0.413	25%	0.246	S	C	.	.	H	α-helix	trans	-63.3	-38.9	178.2	-58.7	0	0	0	0	112	G170 Y171 L172 W177 N178	G170-S174 WeakPolarHBondContact O-CB 3.45Å; G170-S174 PolarHBondContact O-N 3.43Å; G170-S174 PolarHBondContact O-OG 2.98Å; Y171-S174 WeakPolarHBondContact O-CB 3.33Å; Y171-S174 PolarHBondContact O-N 3.5Å; L172-S174 VanDerWaalsContact C-N 3.27Å; L172-S174 PolarHBondContact O-N 2.93Å; S174-W177 PolarHBondContact O-N 3.3Å; S174-N178 VanDerWaalsContact O-CB 3.28Å; S174-N178 WeakPolarHBondContact O-CB 3.5Å; S174-N178 PolarHBondContact O-N 3.11Å; S174-N178 PolarHBondContact O-ND2 2.87Å
175	C	89.2	Confident	89.4	Confident	9 Å²	9	47 Å²	47	6%	0.061	24%	0.239	C	C	.	.	H	α-helix	trans	-60.6	-47.9	174.9	-65.3	0	0	0	0	111.5	C15 Y171 L172 I173 N178 C179	C15-C175 PolarHBondContact SG-SG 2.98Å; Y171-C175 VanDerWaalsContact CE1-SG 3.59Å; Y171-C175 VanDerWaalsContact CZ-SG 3.58Å; Y171-C175 PolarHBondContact O-N 2.87Å; Y171-C175 PolarHBondContact O-SG 3.29Å; L172-C175 WeakPolarHBondContact O-CB 3.41Å; L172-C175 PolarHBondContact O-N 3.24Å; L172-C175 VanDerWaalsContact O-N 3.12Å; I173-C175 VanDerWaalsContact C-N 3.33Å; I173-C175 PolarHBondContact O-N 2.97Å; C175-N178 PolarHBondContact O-N 2.89Å; C175-C179 WeakPolarHBondContact O-CB 3.32Å; C175-C179 PolarHBondContact O-N 3.3Å
176	V	91.4	Very high	88.8	Confident	0 Å²	0	50.5 Å²	50.5	0%	0	25%	0.25	C	C	.	.	H	α-helix	trans	-66.2	-42.3	179.7	178.3	0	0	0	0	111.4	T25 L28 I101 F104 F105 Q108 L172 I173 N178 C179 Y180	T25-V176 HydrophobicContact CG2-CG1 4.44Å; T25-V176 HydrophobicContact CG2-CG2 4.1Å; L28-V176 HydrophobicContact CD2-CG2 3.81Å; I101-V176 HydrophobicContact CG2-CG1 3.6Å; F104-V176 HydrophobicContact CD1-CG1 4.2Å; F104-V176 HydrophobicContact CD1-CG2 4.26Å; F104-V176 HydrophobicContact CE1-CG2 3.95Å; F105-V176 HydrophobicContact CB-CG1 4.11Å; F105-V176 HydrophobicContact CD2-CG1 4.21Å; Q108-V176 VanDerWaalsContact NE2-CG2 3.33Å; Q108-V176 VanDerWaalsContact OE1-CG2 3.32Å; L172-V176 PolarHBondContact O-N 3.09Å; I173-V176 PolarHBondContact O-N 3.46Å; V176-N178 PolarHBondContact O-N 3.05Å; V176-C179 WeakPolarHBondContact O-CB 3.43Å; V176-C179 PolarHBondContact O-N 2.8Å; V176-Y180 PolarHBondContact O-N 3.04Å
177	W	90.2	Very high	88.1	Confident	92 Å²	92	51.3 Å²	51.3	35%	0.348	25%	0.254	S	S	.	.	H	α-helix	trans	-61	-44.4	175.4	-177.1	-111.9	0	0	0	112.4	F105 I173 S174 C179 Y180 R181	F105-W177 HydrophobicContact CD1-CE3 4.2Å; F105-W177 HydrophobicContact CD1-CZ3 4.35Å; F105-W177 HydrophobicContact CD2-CB 4.44Å; F105-W177 HydrophobicContact CD2-CE3 4.32Å; F105-W177 AromaticContact CE1-CE3 3.6Å; F105-W177 HydrophobicContact CE1-CE3 3.6Å; F105-W177 AromaticContact CE1-CZ3 3.73Å; F105-W177 HydrophobicContact CE1-CZ3 3.73Å; F105-W177 HydrophobicContact CE2-CB 3.79Å; F105-W177 HydrophobicContact CE2-CD2 4.29Å; F105-W177 AromaticContact CE2-CE3 3.75Å; F105-W177 HydrophobicContact CE2-CE3 3.75Å; F105-W177 HydrophobicContact CE2-CG 4.36Å; F105-W177 HydrophobicContact CZ-CB 4.38Å; F105-W177 HydrophobicContact CZ-CD2 4.03Å; F105-W177 AromaticContact CZ-CE3 3.33Å; F105-W177 HydrophobicContact CZ-CE3 3.33Å; F105-W177 HydrophobicContact CZ-CG 4.48Å; F105-W177 AromaticContact CZ-CZ3 3.9Å; F105-W177 HydrophobicContact CZ-CZ3 3.9Å; I173-W177 WeakPolarHBondContact O-CB 3.39Å; I173-W177 PolarHBondContact O-N 3.46Å; S174-W177 PolarHBondContact O-N 3.3Å; W177-C179 VanDerWaalsContact C-N 3.32Å; W177-C179 PolarHBondContact O-N 2.88Å; W177-Y180 HydrophobicContact CE3-CD1 4.19Å; W177-Y180 HydrophobicContact CH2-CD1 4.5Å; W177-Y180 HydrophobicContact CZ3-CD1 4.02Å; W177-Y180 HydrophobicContact CZ3-CE1 4.27Å; W177-Y180 WeakPolarHBondContact O-CB 3.45Å; W177-Y180 PolarHBondContact O-N 3.38Å; W177-R181 HydrophobicContact CD2-CG 4.34Å; W177-R181 HydrophobicContact CZ2-CG 4.3Å; W177-R181 WeakPolarHBondContact O-CB 3.41Å; W177-R181 WeakPolarHBondContact O-CG 3.21Å; W177-R181 PolarHBondContact O-N 2.87Å
178	N	86.9	Confident	87.3	Confident	37 Å²	37	50 Å²	50	20%	0.198	25%	0.249	C	C	.	.	H	α-helix	trans	-64.3	-38.4	176.8	-73.6	-17.6	0	0	0	111.5	V21 S174 C175 V176 R181 Y182	V21-N178 HydrophobicContact CG1-CB 4.14Å; S174-N178 VanDerWaalsContact O-CB 3.28Å; S174-N178 WeakPolarHBondContact O-CB 3.5Å; S174-N178 PolarHBondContact O-N 3.11Å; S174-N178 PolarHBondContact O-ND2 2.87Å; C175-N178 PolarHBondContact O-N 2.89Å; V176-N178 PolarHBondContact O-N 3.05Å; N178-R181 PolarHBondContact O-N 3.42Å; N178-Y182 WeakPolarHBondContact O-CB 3.25Å; N178-Y182 PolarHBondContact O-N 3.23Å
179	C	88.2	Confident	86.5	Confident	0 Å²	0	47.3 Å²	47.3	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-62.8	-46.9	173.1	-176.2	0	0	0	0	112	T25 C175 V176 W177 R181 Y182 I183	T25-C179 HydrophobicContact CG2-CB 4.4Å; T25-C179 WeakPolarHBondContact OG1-CB 3.22Å; C175-C179 WeakPolarHBondContact O-CB 3.32Å; C175-C179 PolarHBondContact O-N 3.3Å; V176-C179 WeakPolarHBondContact O-CB 3.43Å; V176-C179 PolarHBondContact O-N 2.8Å; W177-C179 VanDerWaalsContact C-N 3.32Å; W177-C179 PolarHBondContact O-N 2.88Å; C179-R181 PolarHBondContact O-N 3.02Å; C179-Y182 PolarHBondContact O-N 2.96Å; C179-I183 WeakPolarHBondContact O-CG1 3.15Å; C179-I183 PolarHBondContact O-N 3.47Å
180	Y	89	Confident	85.7	Confident	50 Å²	50	49.9 Å²	49.9	20%	0.196	26%	0.261	C	S	.	.	H	α-helix	trans	-56.5	-49.9	175	171.9	-99.1	0	0	0	111.7	A98 I102 V176 W177 Y182 I183 N184	A98-Y180 HydrophobicContact CB-CD2 3.84Å; A98-Y180 HydrophobicContact CB-CE2 3.69Å; A98-Y180 VanDerWaalsContact O-CD2 3.3Å; A98-Y180 WeakPolarHBondContact O-CD2 3.39Å; A98-Y180 WeakPolarHBondContact O-CE2 3.3Å; I102-Y180 HydrophobicContact CD1-CE2 3.91Å; I102-Y180 HydrophobicContact CG1-CD2 4.15Å; I102-Y180 HydrophobicContact CG1-CE2 3.6Å; V176-Y180 PolarHBondContact O-N 3.04Å; W177-Y180 HydrophobicContact CE3-CD1 4.19Å; W177-Y180 HydrophobicContact CH2-CD1 4.5Å; W177-Y180 HydrophobicContact CZ3-CD1 4.02Å; W177-Y180 HydrophobicContact CZ3-CE1 4.27Å; W177-Y180 WeakPolarHBondContact O-CB 3.45Å; W177-Y180 PolarHBondContact O-N 3.38Å; Y180-Y182 PolarHBondContact O-N 3.28Å; Y180-I183 PolarHBondContact O-N 2.92Å; Y180-N184 WeakPolarHBondContact O-CB 3.11Å; Y180-N184 PolarHBondContact O-N 2.96Å
181	R	86	Confident	84.9	Confident	91 Å²	91	53.3 Å²	53.3	34%	0.343	28%	0.277	S	S	.	.	H	α-helix	trans	-63	-41.2	178.2	-74.1	-73.3	-64.8	-84.8	-5.3	112.4	W177 N178 C179 N184 G185	W177-R181 HydrophobicContact CD2-CG 4.34Å; W177-R181 HydrophobicContact CZ2-CG 4.3Å; W177-R181 WeakPolarHBondContact O-CB 3.41Å; W177-R181 WeakPolarHBondContact O-CG 3.21Å; W177-R181 PolarHBondContact O-N 2.87Å; N178-R181 PolarHBondContact O-N 3.42Å; C179-R181 PolarHBondContact O-N 3.02Å; R181-N184 PolarHBondContact O-N 3.06Å; R181-G185 PolarHBondContact O-N 3.34Å
182	Y	84.9	Confident	84.3	Confident	58 Å²	58	55.1 Å²	55.1	23%	0.227	29%	0.291	C	S	.	.	H	α-helix	trans	-61.4	-46.9	177.6	174.2	-89.7	0	0	0	111.4	H20 V21 N178 C179 Y180 G185 R186	H20-Y182 AromaticContact CE1-CE1 3.61Å; H20-Y182 AromaticContact CE1-CZ 3.58Å; H20-Y182 AromaticContact NE2-CZ 3.59Å; H20-Y182 PolarHBondContact NE2-OH 3.49Å; V21-Y182 HydrophobicContact CG2-CD1 4.43Å; V21-Y182 HydrophobicContact CG2-CD2 4.32Å; V21-Y182 HydrophobicContact CG2-CG 4Å; N178-Y182 WeakPolarHBondContact O-CB 3.25Å; N178-Y182 PolarHBondContact O-N 3.23Å; C179-Y182 PolarHBondContact O-N 2.96Å; Y180-Y182 PolarHBondContact O-N 3.28Å; Y182-G185 PolarHBondContact O-N 3.43Å; Y182-R186 PolarHBondContact O-N 2.86Å; Y182-R186 VanDerWaalsContact O-N 3.09Å
183	I	86.6	Confident	83.5	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-64.7	-44.2	177.6	-67	166.1	0	0	0	110.7	Q96 A98 I101 C179 Y180 G185 R186 N187	Q96-I183 HydrophobicContact CB-CG2 4.05Å; Q96-I183 WeakPolarHBondContact O-CG2 3.34Å; A98-I183 HydrophobicContact CB-CB 4.33Å; A98-I183 HydrophobicContact CB-CG2 3.88Å; I101-I183 HydrophobicContact CD1-CD1 3.38Å; C179-I183 WeakPolarHBondContact O-CG1 3.15Å; C179-I183 PolarHBondContact O-N 3.47Å; Y180-I183 PolarHBondContact O-N 2.92Å; I183-G185 PolarHBondContact O-N 3.13Å; I183-R186 PolarHBondContact O-N 3.34Å; I183-N187 PolarHBondContact O-N 2.81Å; I183-N187 PolarHBondContact O-OD1 2.91Å
184	N	85.8	Confident	82.3	Confident	70 Å²	70	65 Å²	65	37%	0.374	34%	0.336	S	S	.	.	H	α-helix	trans	-66.9	-37.6	-179.5	-163.3	54.1	0	0	0	112.8	A98 Y180 R181 S188	A98-N184 HydrophobicContact CB-CB 4.26Å; Y180-N184 WeakPolarHBondContact O-CB 3.11Å; Y180-N184 PolarHBondContact O-N 2.96Å; R181-N184 PolarHBondContact O-N 3.06Å; N184-S188 PolarHBondContact O-N 3.42Å; N184-S188 PolarHBondContact O-OG 3.03Å
185	G	81.2	Confident	81.7	Confident	36 Å²	36	65.5 Å²	65.5	37%	0.371	34%	0.336	S	S	.	.	H	α-helix	trans	-62.5	-44	174.6	0	0	0	0	0	111.7	R181 Y182 I183 S188 S189	R181-G185 PolarHBondContact O-N 3.34Å; Y182-G185 PolarHBondContact O-N 3.43Å; I183-G185 PolarHBondContact O-N 3.13Å; G185-S188 PolarHBondContact O-N 3.22Å; G185-S189 PolarHBondContact O-N 3.26Å; G185-S189 PolarHBondContact O-OG 3.13Å
186	R	80	Confident	81.1	Confident	123 Å²	123	68.5 Å²	68.5	46%	0.464	36%	0.355	S	S	.	.	H	α-helix	trans	-63.3	-46.8	176.6	-167.7	179.4	-177.4	105.3	0.3	112.3	Y182 I183 S188 S189 D190	Y182-R186 PolarHBondContact O-N 2.86Å; Y182-R186 VanDerWaalsContact O-N 3.09Å; I183-R186 PolarHBondContact O-N 3.34Å; R186-S188 PolarHBondContact O-N 3.02Å; R186-S189 WeakPolarHBondContact O-CB 3.5Å; R186-S189 PolarHBondContact O-N 2.86Å; R186-S189 VanDerWaalsContact O-N 3.1Å; R186-D190 PolarHBondContact O-N 3.41Å
187	N	77.8	Confident	80.2	Confident	52 Å²	52	71.2 Å²	71.2	28%	0.278	37%	0.374	S	S	.	.	H	α-helix	trans	-59.7	-35.9	177.2	-69.8	1.2	0	0	0	111.8	Q96 I183 V191	Q96-N187 PolarHBondContact O-ND2 3.1Å; I183-N187 PolarHBondContact O-N 2.81Å; I183-N187 PolarHBondContact O-OD1 2.91Å; N187-V191 VanDerWaalsContact O-CG2 3.24Å; N187-V191 WeakPolarHBondContact O-CG2 3.47Å; N187-V191 PolarHBondContact O-N 3.34Å; N187-V191 VanDerWaalsContact O-N 3.13Å
188	S	77.3	Confident	79.3	Confident	68 Å²	68	70.4 Å²	70.4	48%	0.476	38%	0.376	S	S	.	.	H	α-helix	trans	-69.5	-40	175.5	-58.5	0	0	0	0	112.3	N184 G185 R186 L192	N184-S188 PolarHBondContact O-N 3.42Å; N184-S188 PolarHBondContact O-OG 3.03Å; G185-S188 PolarHBondContact O-N 3.22Å; R186-S188 PolarHBondContact O-N 3.02Å; S188-L192 WeakPolarHBondContact O-CB 3.37Å; S188-L192 PolarHBondContact O-N 3.27Å
189	S	74.7	Confident	78.4	Confident	67 Å²	67	73.1 Å²	73.1	47%	0.469	39%	0.39	S	S	.	.	H	α-helix	trans	-64.8	-42.9	174.3	-65.1	0	0	0	0	112.3	G185 R186 V191 L192 V193	G185-S189 PolarHBondContact O-N 3.26Å; G185-S189 PolarHBondContact O-OG 3.13Å; R186-S189 WeakPolarHBondContact O-CB 3.5Å; R186-S189 PolarHBondContact O-N 2.86Å; R186-S189 VanDerWaalsContact O-N 3.1Å; S189-V191 VanDerWaalsContact C-N 3.34Å; S189-V191 PolarHBondContact O-N 3.2Å; S189-L192 PolarHBondContact O-N 3.47Å; S189-V193 WeakPolarHBondContact O-CG2 3.26Å; S189-V193 PolarHBondContact O-N 2.95Å
190	D	73.4	Confident	77.2	Confident	88 Å²	88	76.6 Å²	76.6	47%	0.471	41%	0.412	S	S	.	.	H	α-helix	trans	-62.5	-41.5	178.2	-68.7	-19.8	0	0	0	111	R186 Y194	R186-D190 PolarHBondContact O-N 3.41Å; D190-Y194 PolarHBondContact O-N 2.92Å; D190-Y194 VanDerWaalsContact O-N 3.11Å
191	V	76.2	Confident	75.8	Confident	96 Å²	96	78.2 Å²	78.2	58%	0.582	43%	0.427	S	S	*	.	H	α-helix	trans	-63.4	-42.7	173.6	171.6	0	0	0	0	111.6	N187 S189 Y194 V195	N187-V191 VanDerWaalsContact O-CG2 3.24Å; N187-V191 WeakPolarHBondContact O-CG2 3.47Å; N187-V191 PolarHBondContact O-N 3.34Å; N187-V191 VanDerWaalsContact O-N 3.13Å; S189-V191 VanDerWaalsContact C-N 3.34Å; S189-V191 PolarHBondContact O-N 3.2Å; V191-Y194 PolarHBondContact O-N 3.42Å; V191-V195 WeakPolarHBondContact O-CG2 3.24Å; V191-V195 PolarHBondContact O-N 2.8Å
192	L	78.7	Confident	74.4	Confident	110 Å²	110	79.1 Å²	79.1	58%	0.576	44%	0.442	S	S	*	.	H	α-helix	trans	-64.2	-42.2	179	179.2	64.4	0	0	0	112.6	S188 S189 Y194 V195 T196	S188-L192 WeakPolarHBondContact O-CB 3.37Å; S188-L192 PolarHBondContact O-N 3.27Å; S189-L192 PolarHBondContact O-N 3.47Å; L192-Y194 VanDerWaalsContact C-N 3.32Å; L192-V195 PolarHBondContact O-N 3.36Å; L192-T196 WeakPolarHBondContact O-CB 3.4Å; L192-T196 PolarHBondContact O-N 3.11Å; L192-T196 PolarHBondContact O-OG1 3.01Å
193	V	72.7	Confident	72.9	Confident	90 Å²	90	83.2 Å²	83.2	55%	0.545	47%	0.467	S	S	.	.	H	α-helix	trans	-64.9	-39.4	177.7	172.5	0	0	0	0	110.6	S189 S197	S189-V193 WeakPolarHBondContact O-CG2 3.26Å; S189-V193 PolarHBondContact O-N 2.95Å; V193-S197 VanDerWaalsContact O-CB 3.26Å; V193-S197 WeakPolarHBondContact O-CB 3.42Å; V193-S197 PolarHBondContact O-N 2.88Å; V193-S197 PolarHBondContact O-OG 2.78Å
194	Y	68.6	Low	71	Confident	169 Å²	169	89.3 Å²	89.3	66%	0.663	50%	0.499	S	S	*	.	H	α-helix	trans	-63.2	-46.6	176	-175.7	-97.1	0	0	0	112.1	D190 V191 L192 S197 N198	D190-Y194 PolarHBondContact O-N 2.92Å; D190-Y194 VanDerWaalsContact O-N 3.11Å; V191-Y194 PolarHBondContact O-N 3.42Å; L192-Y194 VanDerWaalsContact C-N 3.32Å; Y194-S197 PolarHBondContact O-N 3.26Å; Y194-N198 VanDerWaalsContact O-CB 3.28Å; Y194-N198 WeakPolarHBondContact O-CB 3.37Å; Y194-N198 PolarHBondContact O-N 3.04Å
195	V	76.7	Confident	69.1	Low	69 Å²	69	91.1 Å²	91.1	42%	0.418	52%	0.515	S	S	.	.	H	α-helix	trans	-62.4	-47.8	176.7	173.6	0	0	0	0	111.1	V191 L192 S197 N198 D199	V191-V195 WeakPolarHBondContact O-CG2 3.24Å; V191-V195 PolarHBondContact O-N 2.8Å; L192-V195 PolarHBondContact O-N 3.36Å; V195-S197 PolarHBondContact O-N 3.45Å; V195-N198 PolarHBondContact O-N 3.02Å; V195-D199 WeakPolarHBondContact O-CB 3.42Å; V195-D199 PolarHBondContact O-N 2.78Å
196	T	76.2	Confident	67.7	Low	73 Å²	73	94.2 Å²	94.2	45%	0.448	53%	0.528	S	S	.	.	H	α-helix	trans	-62.3	-44.1	-179.9	-52.3	0	0	0	0	111.4	L192 T200	L192-T196 WeakPolarHBondContact O-CB 3.4Å; L192-T196 PolarHBondContact O-N 3.11Å; L192-T196 PolarHBondContact O-OG1 3.01Å; T196-T200 WeakPolarHBondContact O-CG2 3.28Å; T196-T200 PolarHBondContact O-N 3.12Å; T196-T200 PolarHBondContact O-OG1 3.37Å
197	S	73	Confident	66.6	Low	57 Å²	57	97.5 Å²	97.5	40%	0.399	54%	0.542	S	S	.	.	H	α-helix	trans	-61.6	-47	176.1	-59.4	0	0	0	0	110.5	V193 Y194 V195 D199 T200 T201	V193-S197 VanDerWaalsContact O-CB 3.26Å; V193-S197 WeakPolarHBondContact O-CB 3.42Å; V193-S197 PolarHBondContact O-N 2.88Å; V193-S197 PolarHBondContact O-OG 2.78Å; Y194-S197 PolarHBondContact O-N 3.26Å; V195-S197 PolarHBondContact O-N 3.45Å; S197-D199 PolarHBondContact O-N 2.84Å; S197-T200 WeakPolarHBondContact CA-OG1 3.35Å; S197-T200 PolarHBondContact O-N 3.32Å; S197-T200 PolarHBondContact O-OG1 3.49Å; S197-T201 WeakPolarHBondContact O-CG2 3.27Å; S197-T201 PolarHBondContact O-N 3.43Å; S197-T201 PolarHBondContact O-OG1 3.48Å; S197-T201 VanDerWaalsContact O-OG1 3.12Å
198	N	71.9	Confident	65.3	Low	74 Å²	74	101.5 Å²	101.5	40%	0.396	56%	0.564	S	S	.	*	H	α-helix	trans	-63.6	-43.7	-179.1	-166.4	58.2	0	0	0	112.2	Y194 V195 T200 T201 V202	Y194-N198 VanDerWaalsContact O-CB 3.28Å; Y194-N198 WeakPolarHBondContact O-CB 3.37Å; Y194-N198 PolarHBondContact O-N 3.04Å; V195-N198 PolarHBondContact O-N 3.02Å; N198-T200 VanDerWaalsContact C-N 3.33Å; N198-T200 PolarHBondContact O-N 3.48Å; N198-T201 VanDerWaalsContact CA-OG1 3.27Å; N198-T201 WeakPolarHBondContact CA-OG1 3.49Å; N198-T201 PolarHBondContact O-N 2.87Å; N198-T201 PolarHBondContact O-OG1 3.22Å; N198-V202 WeakPolarHBondContact O-CB 3.22Å; N198-V202 VanDerWaalsContact O-CG2 3.22Å; N198-V202 WeakPolarHBondContact O-CG2 3.48Å; N198-V202 PolarHBondContact O-N 2.89Å
199	D	66.9	Low	64.1	Low	94 Å²	94	104.8 Å²	104.8	50%	0.503	58%	0.576	S	S	.	*	H	α-helix	trans	-64	-38.3	176.6	-69.5	-23.6	0	0	0	111.6	V195 S197 L203	V195-D199 WeakPolarHBondContact O-CB 3.42Å; V195-D199 PolarHBondContact O-N 2.78Å; S197-D199 PolarHBondContact O-N 2.84Å; D199-L203 PolarHBondContact O-N 2.88Å
200	T	64.5	Low	62.8	Low	73 Å²	73	104.8 Å²	104.8	45%	0.448	58%	0.58	S	S	.	*	H	α-helix	trans	-69.2	-34.6	173.1	54.3	0	0	0	0	113	T196 S197 N198 L203 L204	T196-T200 WeakPolarHBondContact O-CG2 3.28Å; T196-T200 PolarHBondContact O-N 3.12Å; T196-T200 PolarHBondContact O-OG1 3.37Å; S197-T200 WeakPolarHBondContact CA-OG1 3.35Å; S197-T200 PolarHBondContact O-N 3.32Å; S197-T200 PolarHBondContact O-OG1 3.49Å; N198-T200 VanDerWaalsContact C-N 3.33Å; N198-T200 PolarHBondContact O-N 3.48Å; T200-L203 PolarHBondContact O-N 2.82Å; T200-L204 WeakPolarHBondContact O-CD1 3.38Å; T200-L204 PolarHBondContact O-N 3.42Å
201	T	59.1	Low	61.6	Low	84 Å²	84	106.1 Å²	106.1	52%	0.515	59%	0.592	S	S	.	*	H	α-helix	trans	-76.8	-26.5	176.4	54.4	0	0	0	0	113.1	S197 N198 L203 L204	S197-T201 WeakPolarHBondContact O-CG2 3.27Å; S197-T201 PolarHBondContact O-N 3.43Å; S197-T201 PolarHBondContact O-OG1 3.48Å; S197-T201 VanDerWaalsContact O-OG1 3.12Å; N198-T201 VanDerWaalsContact CA-OG1 3.27Å; N198-T201 WeakPolarHBondContact CA-OG1 3.49Å; N198-T201 PolarHBondContact O-N 2.87Å; N198-T201 PolarHBondContact O-OG1 3.22Å; T201-L203 PolarHBondContact O-N 3.18Å; T201-L204 PolarHBondContact O-N 3.37Å
202	V	57.1	Low	60.4	Low	110 Å²	110	107.5 Å²	107.5	67%	0.667	60%	0.6	S	S	*	*	H	α-helix	trans	-70	-25	171.7	170.8	0	0	0	0	110.9	N198	N198-V202 WeakPolarHBondContact O-CB 3.22Å; N198-V202 VanDerWaalsContact O-CG2 3.22Å; N198-V202 WeakPolarHBondContact O-CG2 3.48Å; N198-V202 PolarHBondContact O-N 2.89Å
203	L	53.5	Low	58.6	Low	144 Å²	144	109 Å²	109	75%	0.754	61%	0.608	S	S	*	*	H	α-helix	trans	-83.1	-19.1	174.4	-81.9	168.9	0	0	0	114.8	D199 T200 T201 P205	D199-L203 PolarHBondContact O-N 2.88Å; T200-L203 PolarHBondContact O-N 2.82Å; T201-L203 PolarHBondContact O-N 3.18Å; L203-P205 WeakPolarHBondContact O-CD 3.34Å
204	L	46.2	Very low	57.3	Low	128 Å²	128	108.9 Å²	108.9	67%	0.67	63%	0.625	S	S	*	*	S	Bend	trans	-98.8	108.2	171.6	-82.8	99	0	0	0	109.3	T200 T201	T200-L204 WeakPolarHBondContact O-CD1 3.38Å; T200-L204 PolarHBondContact O-N 3.42Å; T201-L204 PolarHBondContact O-N 3.37Å
205	P	44.9	Very low	56	Low	109 Å²	109	105 Å²	105	71%	0.708	63%	0.628	S	S	*	*			trans	-53.5	142.1	165.4	-8.2	16.6	0	0	0	109	L203 Y207	L203-P205 WeakPolarHBondContact O-CD 3.34Å; P205-Y207 PolarHBondContact O-N 3.21Å
206	P	53.2	Low	54.5	Low	100 Å²	100	106.2 Å²	106.2	65%	0.649	65%	0.646	S	S	*	*			trans	-53.9	125.2	174.3	-20.1	30.2	0	0	0	109.5	D208	P206-D208 PolarHBondContact O-N 3.43Å
207	Y	55.3	Low	52.8	Low	193 Å²	193	112.3 Å²	112.3	76%	0.757	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-69.5	-0.6	-179.3	-164.7	-98.9	0	0	0	113.1	P205	P205-Y207 PolarHBondContact O-N 3.21Å
208	D	50.7	Low	51.3	Low	136 Å²	136	118.1 Å²	118.1	73%	0.727	69%	0.687	S	S	*	*	G	3₁₀ helix	trans	-84.3	-9.9	-178.4	-71.1	-38.5	0	0	0	114.8	P206	P206-D208 PolarHBondContact O-N 3.43Å
209	D	52.6	Low	50.3	Low	137 Å²	137	120 Å²	120	73%	0.733	70%	0.703	S	S	*	*	G	3₁₀ helix	trans	-92.1	1.6	173.2	-70.6	-25.3	0	0	0	113.7	T211	D209-T211 VanDerWaalsContact C-N 3.27Å; D209-T211 PolarHBondContact O-N 3.18Å
210	A	47.1	Very low	49.6	Very low	67 Å²	67	121.1 Å²	121.1	55%	0.554	72%	0.715	S	S	*	*	G	3₁₀ helix	trans	-80.7	-1.6	175.2	0	0	0	0	0	114.1
211	T	48.2	Very low	49	Very low	116 Å²	116	123.1 Å²	123.1	71%	0.712	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-109.4	-0.1	-174.3	-17.3	0	0	0	0	115.7	D209	D209-T211 VanDerWaalsContact C-N 3.27Å; D209-T211 PolarHBondContact O-N 3.18Å
212	V	51.3	Low	49	Very low	124 Å²	124	125 Å²	125	75%	0.752	74%	0.744	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112.3	-22.6	179.7	-171.4	0	0	0	0	114.1	G214	V212-G214 PolarHBondContact O-N 3.06Å
213	N	41.3	Very low	48.8	Very low	141 Å²	141	130.2 Å²	130.2	75%	0.754	75%	0.753	S	S	*	*			trans	-105.6	83	173.6	-68.4	-12.6	0	0	0	110.1	A215	N213-A215 PolarHBondContact O-N 3.49Å
214	G	45.2	Very low	49	Very low	88 Å²	88	130.2 Å²	130.2	91%	0.907	76%	0.758	S	S	*	*			trans	-59.8	80.4	163.3	0	0	0	0	0	110.6	V212	V212-G214 PolarHBondContact O-N 3.06Å
215	A	41.8	Very low	49.6	Very low	87 Å²	87	129 Å²	129	72%	0.719	76%	0.76	S	S	*	*			trans	-102.1	104.4	162.9	0	0	0	0	0	106.7	N213 K217	N213-A215 PolarHBondContact O-N 3.49Å; A215-K217 PolarHBondContact O-N 3.42Å; A215-K217 VanDerWaalsContact O-N 3.15Å
216	A	44.1	Very low	49.9	Very low	96 Å²	96	132.4 Å²	132.4	79%	0.793	80%	0.798	S	S	*	*			trans	-18.3	106.9	172.6	0	0	0	0	0	114	E218	A216-E218 PolarHBondContact O-N 3.15Å; A216-E218 VanDerWaalsContact O-N 3.15Å
217	K	40.5	Very low	49.7	Very low	201 Å²	201	134.1 Å²	134.1	87%	0.874	81%	0.806	S	S	*	*			trans	-60.7	115.6	157.3	-79	-178.5	176.1	176.8	0	106.6	A215	A215-K217 PolarHBondContact O-N 3.42Å; A215-K217 VanDerWaalsContact O-N 3.15Å
218	E	43.1	Very low	49.5	Very low	179 Å²	179	130.9 Å²	130.9	84%	0.836	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-51.4	138.2	167.2	-74.8	-176.3	139.7	0	0	109.4	A216	A216-E218 PolarHBondContact O-N 3.15Å; A216-E218 VanDerWaalsContact O-N 3.15Å
219	P	49.7	Very low	49.4	Very low	114 Å²	114	130.7 Å²	130.7	74%	0.74	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-64.1	145.7	-176.7	25.6	-32.2	0	0	0	110.5
220	P	51.7	Low	49.2	Very low	116 Å²	116	130.3 Å²	130.3	75%	0.753	82%	0.817	S	S	*	*	P	Polyproline II helix	trans	-62.5	150.3	-178.2	26.2	-33.5	0	0	0	111.3
221	P	53.3	Low	49.3	Very low	116 Å²	116	134.3 Å²	134.3	75%	0.753	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-61.9	149.2	-177.9	23.5	-32.2	0	0	0	112	Y223	P221-Y223 PolarHBondContact O-N 3.15Å
222	P	57.7	Low	49.4	Very low	124 Å²	124	135.5 Å²	135.5	81%	0.805	84%	0.842	S	S	*	*	P	Polyproline II helix	trans	-64.6	134.5	-173.7	-16.9	29.5	0	0	0	112.3	V224	P222-V224 PolarHBondContact O-N 2.78Å
223	Y	52.9	Low	49.3	Very low	219 Å²	219	136.3 Å²	136.3	86%	0.859	85%	0.848	S	S	*	*			trans	-69.8	108.2	172.4	-120.6	-98.4	0	0	0	109.6	P221 S225	P221-Y223 PolarHBondContact O-N 3.15Å; Y223-S225 PolarHBondContact O-N 3.5Å
224	V	58.5	Low	49.9	Very low	144 Å²	144	135.9 Å²	135.9	87%	0.873	86%	0.856	S	S	*	*			trans	-75.6	118.1	164.5	-74	0	0	0	0	108.3	P222	P222-V224 PolarHBondContact O-N 2.78Å
225	S	57.8	Low	50.3	Low	101 Å²	101	139.9 Å²	139.9	71%	0.706	85%	0.851	S	S	*	*			trans	-108.5	120.5	176.8	-50.5	0	0	0	0	108.6	Y223	Y223-S225 PolarHBondContact O-N 3.5Å
226	A	52.3	Low	51	Low	182 Å²	182	144.7 Å²	144.7	100%	1.504	86%	0.863	S	S	*	*			trans	64	0	175.6	0	0	0	0	0	117.6

Retrieved 226 of 226 residues in 913.7 ms (Link to these results)

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