A0A087XNF5_POEFO Loading...

CKLF-like MARVEL transmembrane domain containing 3

AlphaFold DB (A0A3B3U1L4), UniProt , Accession A0A087XNF5, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 172 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	44.2	Very low	52.1	Low	253 Å²	253	142.5 Å²	142.5	100%	1.246	82%	0.823	S	S	*	*				0	107.4	0	-150.8	77.4	177.5	0	0	106.5
2	G	48.8	Very low	52	Low	65 Å²	65	140.4 Å²	140.4	67%	0.67	80%	0.8	S	S	*	*			trans	102.8	64	165.6	0	0	0	0	0	116.8
3	D	57.3	Low	51.4	Low	164 Å²	164	137.5 Å²	137.5	88%	0.877	79%	0.79	S	S	*	*			trans	-58.1	126.1	146.1	-64.2	-75.7	0	0	0	108.3
4	I	61.9	Low	50.8	Low	153 Å²	153	144.1 Å²	144.1	79%	0.785	80%	0.795	S	S	*	*			trans	-125.9	92	171.3	-92.1	159.3	0	0	0	108.3
5	E	57	Low	50.5	Low	178 Å²	178	143.5 Å²	143.5	83%	0.832	78%	0.784	S	S	*	*			trans	30.3	113.3	140.7	-75	162.1	104.7	0	0	119.6
6	A	55.7	Low	50.4	Low	88 Å²	88	139.2 Å²	139.2	73%	0.727	77%	0.768	S	S	*	*			trans	-63.8	148.7	155	0	0	0	0	0	111.2	D8	A6-D8 PolarHBondContact O-N 3.22Å; A6-D8 VanDerWaalsContact O-N 3.17Å
7	P	51	Low	50.4	Low	125 Å²	125	136.6 Å²	136.6	81%	0.812	76%	0.757	S	S	*	*			trans	-79.3	105	172.9	30.9	-28.5	0	0	0	109.5	S9	P7-S9 PolarHBondContact O-N 3.25Å
8	D	49.3	Very low	50.2	Low	163 Å²	163	136.5 Å²	136.5	87%	0.872	75%	0.754	S	S	*	*			trans	-80.3	91.2	165	-149	-1.3	0	0	0	107.9	A6	A6-D8 PolarHBondContact O-N 3.22Å; A6-D8 VanDerWaalsContact O-N 3.17Å
9	S	49.6	Very low	50.2	Low	108 Å²	108	135.3 Å²	135.3	76%	0.755	74%	0.743	S	S	*	*			trans	-96.7	93.5	168.6	59.9	0	0	0	0	109.2	P7	P7-S9 PolarHBondContact O-N 3.25Å
10	S	51.5	Low	50	Low	92 Å²	92	133 Å²	133	64%	0.643	74%	0.738	S	S	*	*			trans	-45.7	154.8	161.8	58.4	0	0	0	0	113.6
11	Q	46.5	Very low	50	Low	178 Å²	178	132.2 Å²	132.2	83%	0.832	74%	0.736	S	S	*	*			trans	99.4	94.4	165.7	-59.2	175.2	-23.1	0	0	115.8
12	Q	51.8	Low	50.3	Low	118 Å²	118	124.9 Å²	124.9	55%	0.551	70%	0.702	S	S	*	*				145.2	85.6	105.3	-161.9	152.4	-62.2	0	0	113.4	Q15	Q12-Q15 HydrophobicContact CG-CB 4.48Å; Q12-Q15 HydrophobicContact CG-CG 4.29Å
13	P	43.9	Very low	50.5	Low	102 Å²	102	123.4 Å²	123.4	66%	0.662	68%	0.68	S	S	*	*	S	Bend	trans	-103.2	4.6	160.9	36.4	-29.1	0	0	0	112.7
14	R	43	Very low	50.5	Low	231 Å²	231	117.7 Å²	117.7	87%	0.872	65%	0.653	S	S	*	*	S	Bend	trans	-81.1	-17.4	-177.7	-94.2	-173.9	168.7	166.4	-2	115
15	Q	46.4	Very low	50.2	Low	134 Å²	134	118.7 Å²	118.7	63%	0.626	65%	0.652	S	S	*	*	S	Bend	trans	-79.7	-22.5	174.9	-80.6	-170.7	-28.5	0	0	113	Q12 V17 M19	Q12-Q15 HydrophobicContact CG-CB 4.48Å; Q12-Q15 HydrophobicContact CG-CG 4.29Å; Q15-V17 PolarHBondContact O-N 3.34Å; Q15-M19 PolarHBondContact O-N 3.46Å
16	S	48.7	Very low	50.4	Low	75 Å²	75	118.1 Å²	118.1	52%	0.524	65%	0.649	S	S	.	*	H	α-helix	trans	-76.8	-23.8	-171.8	-49.1	0	0	0	0	114	S20	S16-S20 WeakPolarHBondContact O-CB 3.48Å; S16-S20 PolarHBondContact O-N 2.87Å; S16-S20 PolarHBondContact O-OG 2.92Å
17	V	49.7	Very low	50.6	Low	95 Å²	95	118.6 Å²	118.6	58%	0.576	64%	0.635	S	S	*	*	H	α-helix	trans	-81.9	-30.2	-175.5	-172.5	0	0	0	0	112.3	Q15 S20	Q15-V17 PolarHBondContact O-N 3.34Å; V17-S20 WeakPolarHBondContact CA-OG 3.43Å; V17-S20 PolarHBondContact O-OG 3.14Å
18	L	47.3	Very low	50.9	Low	135 Å²	135	114.5 Å²	114.5	71%	0.707	61%	0.611	S	S	*	*	H	α-helix	trans	-78.3	-31.2	170.3	-60.7	-167.8	0	0	0	111.3	S20 V21 L22	L18-S20 VanDerWaalsContact C-N 3.32Å; L18-V21 PolarHBondContact O-N 3.43Å; L18-L22 WeakPolarHBondContact O-CG 3.3Å; L18-L22 PolarHBondContact O-N 3.08Å; L18-L22 VanDerWaalsContact O-N 3.12Å
19	M	50.2	Low	51.3	Low	113 Å²	113	112.2 Å²	112.2	56%	0.557	60%	0.604	S	S	*	*	H	α-helix	trans	-71.6	-20	171.1	-96.1	-77	-174.1	0	0	114.1	Q15 V21 L22	Q15-M19 PolarHBondContact O-N 3.46Å; M19-V21 VanDerWaalsContact C-N 3.27Å; M19-L22 HydrophobicContact SD-CD1 4.27Å
20	S	46.9	Very low	52.2	Low	90 Å²	90	109.4 Å²	109.4	63%	0.629	58%	0.584	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.8	-12.5	172.1	59.8	0	0	0	0	113.4	S16 V17 L18	S16-S20 WeakPolarHBondContact O-CB 3.48Å; S16-S20 PolarHBondContact O-N 2.87Å; S16-S20 PolarHBondContact O-OG 2.92Å; V17-S20 WeakPolarHBondContact CA-OG 3.43Å; V17-S20 PolarHBondContact O-OG 3.14Å; L18-S20 VanDerWaalsContact C-N 3.32Å
21	V	50.3	Low	52.9	Low	117 Å²	117	114.8 Å²	114.8	71%	0.709	59%	0.59	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-24.4	174.9	-177.2	0	0	0	0	111.3	L18 M19	L18-V21 PolarHBondContact O-N 3.43Å; M19-V21 VanDerWaalsContact C-N 3.27Å
22	L	49.1	Very low	54	Low	99 Å²	99	109.8 Å²	109.8	52%	0.518	57%	0.566	S	S	.	*	S	Bend	trans	-70.6	138.3	167.9	-70.3	169.3	0	0	0	109.5	L18 M19 S24	L18-L22 WeakPolarHBondContact O-CG 3.3Å; L18-L22 PolarHBondContact O-N 3.08Å; L18-L22 VanDerWaalsContact O-N 3.12Å; M19-L22 HydrophobicContact SD-CD1 4.27Å; L22-S24 PolarHBondContact O-N 3.47Å
23	P	53	Low	54.9	Low	33 Å²	33	104.7 Å²	104.7	21%	0.214	54%	0.544	C	S	.	.	P	Polyproline II helix	trans	-53.1	128.4	173.4	20.1	-29.2	0	0	0	108.3	F27 I37	P23-F27 HydrophobicContact CB-CB 3.97Å; P23-I37 HydrophobicContact CG-CD1 4.25Å
24	S	57.7	Low	56.4	Low	45 Å²	45	105 Å²	105	32%	0.315	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-50.5	150.9	-178	78.1	0	0	0	0	109.6	L22 E26 F27 A28	L22-S24 PolarHBondContact O-N 3.47Å; S24-E26 PolarHBondContact O-N 3.02Å; S24-F27 WeakPolarHBondContact O-CA 3.42Å; S24-F27 WeakPolarHBondContact O-CB 3.47Å; S24-F27 PolarHBondContact O-N 3.36Å; S24-F27 WeakPolarHBondContact OG-CD2 3.31Å; S24-F27 PolarHBondContact OG-N 3.41Å; S24-A28 PolarHBondContact O-N 3.3Å
25	K	54.8	Low	57.8	Low	173 Å²	173	95.8 Å²	95.8	75%	0.752	51%	0.506	S	S	*	.	H	α-helix	trans	-48.9	-34.7	176.3	-89.9	-176.2	159.2	-178.3	0	111.8	A28 T29	K25-A28 PolarHBondContact O-N 3.39Å; K25-T29 WeakPolarHBondContact O-CB 3.5Å; K25-T29 PolarHBondContact O-N 2.89Å; K25-T29 PolarHBondContact O-OG1 3Å
26	E	62.6	Low	59.2	Low	167 Å²	167	90.2 Å²	90.2	78%	0.78	48%	0.481	S	S	*	.	H	α-helix	trans	-65	-40	174.9	-60.5	-178.6	147.3	0	0	113	S24 T29 S30	S24-E26 PolarHBondContact O-N 3.02Å; E26-T29 PolarHBondContact O-N 3.36Å; E26-S30 PolarHBondContact O-N 3.14Å; E26-S30 VanDerWaalsContact O-N 3.14Å
27	F	58.8	Low	60.6	Low	98 Å²	98	89.9 Å²	89.9	43%	0.43	47%	0.472	S	S	.	.	H	α-helix	trans	-69.2	-41.1	172.9	-75.5	-67.4	0	0	0	112.9	P23 S24 T29 S30 Y76	P23-F27 HydrophobicContact CB-CB 3.97Å; S24-F27 WeakPolarHBondContact O-CA 3.42Å; S24-F27 WeakPolarHBondContact O-CB 3.47Å; S24-F27 PolarHBondContact O-N 3.36Å; S24-F27 WeakPolarHBondContact OG-CD2 3.31Å; S24-F27 PolarHBondContact OG-N 3.41Å; F27-T29 PolarHBondContact O-N 3.41Å; F27-S30 WeakPolarHBondContact O-CB 3.39Å; F27-S30 PolarHBondContact O-N 3.32Å; F27-Y76 AromaticContact CD1-CE1 3.89Å; F27-Y76 HydrophobicContact CD1-CE1 3.89Å; F27-Y76 HydrophobicContact CE1-CE1 4.04Å
28	A	57.8	Low	62	Low	38 Å²	38	86.8 Å²	86.8	31%	0.314	46%	0.457	S	S	.	.	H	α-helix	trans	-65.5	-26.2	176	0	0	0	0	0	112.6	S24 K25 I37	S24-A28 PolarHBondContact O-N 3.3Å; K25-A28 PolarHBondContact O-N 3.39Å; A28-I37 HydrophobicContact CB-CD1 3.93Å
29	T	56.6	Low	63.4	Low	116 Å²	116	80.6 Å²	80.6	71%	0.712	42%	0.424	S	S	*	.	H	α-helix	trans	-88.5	-14.9	177.2	-37.4	0	0	0	0	112.5	K25 E26 F27	K25-T29 WeakPolarHBondContact O-CB 3.5Å; K25-T29 PolarHBondContact O-N 2.89Å; K25-T29 PolarHBondContact O-OG1 3Å; E26-T29 PolarHBondContact O-N 3.36Å; F27-T29 PolarHBondContact O-N 3.41Å
30	S	69.4	Low	64.8	Low	48 Å²	48	75.8 Å²	75.8	34%	0.336	40%	0.404	S	S	.	.	S	Bend	trans	-66.9	136.8	172.3	-177.2	0	0	0	0	110.1	E26 F27 K32 G33 M34	E26-S30 PolarHBondContact O-N 3.14Å; E26-S30 VanDerWaalsContact O-N 3.14Å; F27-S30 WeakPolarHBondContact O-CB 3.39Å; F27-S30 PolarHBondContact O-N 3.32Å; S30-K32 PolarHBondContact O-N 3.47Å; S30-K32 VanDerWaalsContact O-N 3.12Å; S30-G33 PolarHBondContact O-N 3.24Å; S30-M34 PolarHBondContact O-N 3.47Å
31	R	66.6	Low	66.3	Low	206 Å²	206	73.6 Å²	73.6	78%	0.777	39%	0.391	S	S	*	.	H	α-helix	trans	-51.8	-40.7	-177.7	-71.2	-176.9	-159.2	173.6	6.4	112.1	L35	R31-L35 VanDerWaalsContact O-CG 3.25Å; R31-L35 WeakPolarHBondContact O-CG 3.19Å; R31-L35 PolarHBondContact O-N 3.15Å
32	K	68.6	Low	67.5	Low	73 Å²	73	69.6 Å²	69.6	32%	0.317	37%	0.365	S	S	.	.	H	α-helix	trans	-68.7	-40.2	178.5	-68.9	-172.9	173.1	-172.1	0	113.5	S30 L35 L36 E144	S30-K32 PolarHBondContact O-N 3.47Å; S30-K32 VanDerWaalsContact O-N 3.12Å; K32-L35 PolarHBondContact O-N 3.25Å; K32-L36 PolarHBondContact O-N 3.23Å; K32-E144 WeakPolarHBondContact CE-OE2 3.36Å; K32-E144 IonicContact NZ-OE1 2.8Å; K32-E144 PolarHBondContact NZ-OE1 2.66Å; K32-E144 IonicContact NZ-OE2 3.59Å; K32-E144 PolarHBondContact NZ-OE2 3.06Å
33	G	72.4	Confident	68.8	Low	10 Å²	10	64.9 Å²	64.9	10%	0.103	34%	0.341	C	S	.	.	H	α-helix	trans	-68.6	-39.7	178.5	0	0	0	0	0	111.9	S30 L35 L36 I37	S30-G33 PolarHBondContact O-N 3.24Å; G33-L35 VanDerWaalsContact C-N 3.33Å; G33-L35 PolarHBondContact O-N 3.45Å; G33-L36 PolarHBondContact O-N 3.33Å; G33-I37 WeakPolarHBondContact O-CB 3.43Å; G33-I37 WeakPolarHBondContact O-CD1 3.4Å; G33-I37 WeakPolarHBondContact O-CG1 3.25Å; G33-I37 PolarHBondContact O-N 3.41Å
34	M	73.5	Confident	70.1	Confident	109 Å²	109	68.1 Å²	68.1	54%	0.537	35%	0.352	S	S	.	.	H	α-helix	trans	-62.5	-40.1	175	-172.7	178	64.3	0	0	112.1	S30 I37 A38	S30-M34 PolarHBondContact O-N 3.47Å; M34-I37 PolarHBondContact O-N 3.47Å; M34-A38 VanDerWaalsContact O-CB 3.28Å; M34-A38 WeakPolarHBondContact O-CB 2.8Å; M34-A38 PolarHBondContact O-N 2.8Å
35	L	73.6	Confident	71.1	Confident	38 Å²	38	69.5 Å²	69.5	20%	0.199	36%	0.355	C	S	.	.	H	α-helix	trans	-65.7	-47	175.9	-71	171.6	0	0	0	111.6	R31 K32 G33 I37 A38 E39 D137 V140	R31-L35 VanDerWaalsContact O-CG 3.25Å; R31-L35 WeakPolarHBondContact O-CG 3.19Å; R31-L35 PolarHBondContact O-N 3.15Å; K32-L35 PolarHBondContact O-N 3.25Å; G33-L35 VanDerWaalsContact C-N 3.33Å; G33-L35 PolarHBondContact O-N 3.45Å; L35-I37 VanDerWaalsContact C-N 3.32Å; L35-I37 PolarHBondContact O-N 2.87Å; L35-A38 PolarHBondContact O-N 2.99Å; L35-E39 VanDerWaalsContact O-CB 3.3Å; L35-E39 WeakPolarHBondContact O-CB 3.45Å; L35-E39 PolarHBondContact O-N 2.87Å; L35-D137 WeakPolarHBondContact CB-OD1 3.42Å; L35-D137 WeakPolarHBondContact CD1-OD1 3.45Å; L35-D137 WeakPolarHBondContact CD2-OD1 3.42Å; L35-D137 WeakPolarHBondContact CG-OD1 3.45Å; L35-V140 HydrophobicContact CD1-CB 4.43Å; L35-V140 HydrophobicContact CD1-CG1 4.47Å; L35-V140 HydrophobicContact CD1-CG2 4.32Å
36	L	75.4	Confident	72.1	Confident	16 Å²	16	61.3 Å²	61.3	8%	0.084	32%	0.319	C	S	.	.	H	α-helix	trans	-58.4	-41.3	173.8	-93.7	160.2	0	0	0	113.1	K32 G33 E39 G40 S69 F72	K32-L36 PolarHBondContact O-N 3.23Å; G33-L36 PolarHBondContact O-N 3.33Å; L36-E39 WeakPolarHBondContact O-CB 3.2Å; L36-E39 PolarHBondContact O-N 3.49Å; L36-G40 PolarHBondContact O-N 2.92Å; L36-S69 PolarHBondContact O-OG 3.21Å; L36-F72 HydrophobicContact CD2-CB 3.9Å
37	I	78.7	Confident	72.8	Confident	69 Å²	69	56.1 Å²	56.1	35%	0.354	29%	0.294	S	S	.	.	H	α-helix	trans	-67.5	-43.9	177.2	-69.3	164.9	0	0	0	110.5	P23 A28 G33 M34 L35 E39 G40 A41 L73	P23-I37 HydrophobicContact CG-CD1 4.25Å; A28-I37 HydrophobicContact CB-CD1 3.93Å; G33-I37 WeakPolarHBondContact O-CB 3.43Å; G33-I37 WeakPolarHBondContact O-CD1 3.4Å; G33-I37 WeakPolarHBondContact O-CG1 3.25Å; G33-I37 PolarHBondContact O-N 3.41Å; M34-I37 PolarHBondContact O-N 3.47Å; L35-I37 VanDerWaalsContact C-N 3.32Å; L35-I37 PolarHBondContact O-N 2.87Å; I37-E39 VanDerWaalsContact C-N 3.31Å; I37-E39 PolarHBondContact O-N 2.99Å; I37-G40 PolarHBondContact O-N 3.17Å; I37-A41 VanDerWaalsContact O-CB 3.32Å; I37-A41 WeakPolarHBondContact O-CB 3.38Å; I37-A41 PolarHBondContact O-N 2.95Å; I37-L73 HydrophobicContact CG1-CD1 4.48Å
38	A	79.4	Confident	73.7	Confident	30 Å²	30	54.8 Å²	54.8	25%	0.248	29%	0.294	C	S	.	.	H	α-helix	trans	-60.3	-44.7	175.4	0	0	0	0	0	110.5	M34 L35 G40 A41 L42 V133	M34-A38 VanDerWaalsContact O-CB 3.28Å; M34-A38 WeakPolarHBondContact O-CB 2.8Å; M34-A38 PolarHBondContact O-N 2.8Å; L35-A38 PolarHBondContact O-N 2.99Å; A38-G40 PolarHBondContact O-N 3.12Å; A38-A41 PolarHBondContact O-N 3.2Å; A38-L42 WeakPolarHBondContact O-CB 3.39Å; A38-L42 WeakPolarHBondContact O-CD1 3.28Å; A38-L42 PolarHBondContact O-N 3.37Å; A38-V133 HydrophobicContact CB-CG1 4.4Å
39	E	76.4	Confident	74.4	Confident	5 Å²	5	54 Å²	54	2%	0.023	29%	0.285	C	S	.	.	H	α-helix	trans	-59.7	-47.5	177.5	-157.3	-158.5	138.5	0	0	112.3	L35 L36 I37 L42 S43 R96 F134	L35-E39 VanDerWaalsContact O-CB 3.3Å; L35-E39 WeakPolarHBondContact O-CB 3.45Å; L35-E39 PolarHBondContact O-N 2.87Å; L36-E39 WeakPolarHBondContact O-CB 3.2Å; L36-E39 PolarHBondContact O-N 3.49Å; I37-E39 VanDerWaalsContact C-N 3.31Å; I37-E39 PolarHBondContact O-N 2.99Å; E39-L42 PolarHBondContact O-N 3.41Å; E39-S43 VanDerWaalsContact O-CB 3.32Å; E39-S43 WeakPolarHBondContact O-CB 3.08Å; E39-S43 PolarHBondContact O-N 3.14Å; E39-S43 PolarHBondContact O-OG 3.02Å; E39-R96 IonicContact OE1-CZ 3.79Å; E39-R96 IonicContact OE1-NH1 3.5Å; E39-R96 PolarHBondContact OE1-NH1 2.76Å; E39-R96 IonicContact OE1-NH2 2.73Å; E39-R96 IonicContact OE2-CZ 2.67Å; E39-R96 IonicContact OE2-NH1 3.13Å; E39-R96 PolarHBondContact OE2-NH1 3.05Å; E39-R96 IonicContact OE2-NH2 3.33Å; E39-R96 PolarHBondContact OE2-NH2 2.84Å; E39-F134 HydrophobicContact CG-CD1 4.05Å; E39-F134 HydrophobicContact CG-CE1 3.18Å; E39-F134 HydrophobicContact CG-CE2 4.19Å; E39-F134 HydrophobicContact CG-CZ 3.21Å; E39-F134 WeakPolarHBondContact OE1-CE1 3.26Å; E39-F134 VanDerWaalsContact OE1-CZ 3.31Å; E39-F134 WeakPolarHBondContact OE1-CZ 3.35Å
40	G	79.4	Confident	75.1	Confident	12 Å²	12	48.6 Å²	48.6	12%	0.124	25%	0.252	C	S	.	.	H	α-helix	trans	-63	-41.7	176.3	0	0	0	0	0	112.2	L36 I37 A38 S43 F44 S69	L36-G40 PolarHBondContact O-N 2.92Å; I37-G40 PolarHBondContact O-N 3.17Å; A38-G40 PolarHBondContact O-N 3.12Å; G40-S43 PolarHBondContact O-N 3.4Å; G40-F44 WeakPolarHBondContact O-CB 2.85Å; G40-F44 PolarHBondContact O-N 3.14Å; G40-S69 WeakPolarHBondContact CA-OG 3.21Å; G40-S69 PolarHBondContact N-OG 2.87Å
41	A	78.7	Confident	75.3	Confident	44 Å²	44	49 Å²	49	36%	0.364	26%	0.258	S	S	.	.	H	α-helix	trans	-64.8	-46	176.9	0	0	0	0	0	111.9	I37 A38 S43 F44 I45	I37-A41 VanDerWaalsContact O-CB 3.32Å; I37-A41 WeakPolarHBondContact O-CB 3.38Å; I37-A41 PolarHBondContact O-N 2.95Å; A38-A41 PolarHBondContact O-N 3.2Å; A41-S43 VanDerWaalsContact C-N 3.35Å; A41-S43 PolarHBondContact O-N 2.99Å; A41-F44 PolarHBondContact O-N 3.08Å; A41-I45 WeakPolarHBondContact O-CD1 3.43Å; A41-I45 VanDerWaalsContact O-CG1 3.24Å; A41-I45 WeakPolarHBondContact O-CG1 2.96Å; A41-I45 PolarHBondContact O-N 2.94Å
42	L	75.2	Confident	75.5	Confident	33 Å²	33	42.9 Å²	42.9	17%	0.173	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-36.4	178.3	-87.8	85.9	0	0	0	112.1	A38 E39 S46 I129 A130 V133	A38-L42 WeakPolarHBondContact O-CB 3.39Å; A38-L42 WeakPolarHBondContact O-CD1 3.28Å; A38-L42 PolarHBondContact O-N 3.37Å; E39-L42 PolarHBondContact O-N 3.41Å; L42-S46 WeakPolarHBondContact O-CB 3.46Å; L42-S46 PolarHBondContact O-N 2.67Å; L42-S46 PolarHBondContact O-OG 2.56Å; L42-I129 HydrophobicContact CD2-CG2 4.18Å; L42-A130 HydrophobicContact CB-CB 4.2Å; L42-A130 HydrophobicContact CD2-CB 3.57Å; L42-A130 HydrophobicContact CG-CB 4.49Å; L42-V133 HydrophobicContact CD2-CB 4.46Å; L42-V133 HydrophobicContact CD2-CG2 4.11Å
43	S	76.8	Confident	75.7	Confident	0 Å²	0	39.9 Å²	39.9	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-64.2	-42.9	173.9	-59.8	0	0	0	0	111.5	E39 G40 A41 S46 F47	E39-S43 VanDerWaalsContact O-CB 3.32Å; E39-S43 WeakPolarHBondContact O-CB 3.08Å; E39-S43 PolarHBondContact O-N 3.14Å; E39-S43 PolarHBondContact O-OG 3.02Å; G40-S43 PolarHBondContact O-N 3.4Å; A41-S43 VanDerWaalsContact C-N 3.35Å; A41-S43 PolarHBondContact O-N 2.99Å; S43-S46 PolarHBondContact O-N 3.4Å; S43-F47 WeakPolarHBondContact O-CB 3.19Å; S43-F47 PolarHBondContact O-N 2.94Å
44	F	79.4	Confident	75.1	Confident	101 Å²	101	43.1 Å²	43.1	44%	0.443	27%	0.266	S	S	.	.	H	α-helix	trans	-65.1	-45.6	176.9	-176.7	-103.9	0	0	0	112.6	G40 A41 S46 F47 V48 F66	G40-F44 WeakPolarHBondContact O-CB 2.85Å; G40-F44 PolarHBondContact O-N 3.14Å; A41-F44 PolarHBondContact O-N 3.08Å; F44-S46 VanDerWaalsContact C-N 3.32Å; F44-S46 PolarHBondContact O-N 2.77Å; F44-F47 WeakPolarHBondContact O-CB 3.1Å; F44-F47 PolarHBondContact O-N 2.81Å; F44-V48 HydrophobicContact CD1-CG2 4.39Å; F44-V48 HydrophobicContact CE1-CG2 4Å; F44-V48 HydrophobicContact CE2-CG2 4.32Å; F44-V48 HydrophobicContact CZ-CG2 3.96Å; F44-V48 WeakPolarHBondContact O-CG2 3.01Å; F44-V48 PolarHBondContact O-N 2.99Å; F44-F66 HydrophobicContact CB-CD2 3.97Å; F44-F66 HydrophobicContact CB-CE2 3.85Å; F44-F66 HydrophobicContact CD2-CE2 4.04Å; F44-F66 HydrophobicContact CD2-CZ 4.05Å; F44-F66 HydrophobicContact CG-CE2 4.33Å
45	I	79.9	Confident	74.4	Confident	74 Å²	74	37.9 Å²	37.9	38%	0.379	24%	0.24	S	C	.	.	H	α-helix	trans	-60.2	-45.7	176.7	-68	164	0	0	0	110.2	A41 F47 V48 C49 F126	A41-I45 WeakPolarHBondContact O-CD1 3.43Å; A41-I45 VanDerWaalsContact O-CG1 3.24Å; A41-I45 WeakPolarHBondContact O-CG1 2.96Å; A41-I45 PolarHBondContact O-N 2.94Å; I45-F47 VanDerWaalsContact C-N 3.34Å; I45-F47 PolarHBondContact O-N 2.65Å; I45-V48 PolarHBondContact O-N 3.34Å; I45-C49 WeakPolarHBondContact O-CB 3.39Å; I45-C49 PolarHBondContact O-N 2.91Å; I45-F126 HydrophobicContact CG2-CD1 4.35Å; I45-F126 HydrophobicContact CG2-CD2 4.46Å; I45-F126 HydrophobicContact CG2-CG 4.21Å
46	S	74.7	Confident	73.9	Confident	1 Å²	1	38.3 Å²	38.3	1%	0.007	25%	0.249	C	C	.	.	H	α-helix	trans	-61.9	-42.1	177.1	-59.5	0	0	0	0	111.7	L42 S43 F44 C49 F50	L42-S46 WeakPolarHBondContact O-CB 3.46Å; L42-S46 PolarHBondContact O-N 2.67Å; L42-S46 PolarHBondContact O-OG 2.56Å; S43-S46 PolarHBondContact O-N 3.4Å; F44-S46 VanDerWaalsContact C-N 3.32Å; F44-S46 PolarHBondContact O-N 2.77Å; S46-C49 PolarHBondContact O-N 2.8Å; S46-F50 VanDerWaalsContact O-CD2 3.3Å; S46-F50 WeakPolarHBondContact O-CD2 3.28Å; S46-F50 PolarHBondContact O-N 2.99Å
47	F	78.1	Confident	73.7	Confident	57 Å²	57	41.2 Å²	41.2	25%	0.25	28%	0.276	C	S	.	.	H	α-helix	trans	-58.3	-51.1	175.3	170.1	-101.9	0	0	0	112	S43 F44 I45 C49 F50 A51 V59 P62 L63	S43-F47 WeakPolarHBondContact O-CB 3.19Å; S43-F47 PolarHBondContact O-N 2.94Å; F44-F47 WeakPolarHBondContact O-CB 3.1Å; F44-F47 PolarHBondContact O-N 2.81Å; I45-F47 VanDerWaalsContact C-N 3.34Å; I45-F47 PolarHBondContact O-N 2.65Å; F47-C49 VanDerWaalsContact C-N 3.27Å; F47-C49 PolarHBondContact O-N 3.27Å; F47-F50 PolarHBondContact O-N 3.44Å; F47-A51 VanDerWaalsContact O-CB 3.26Å; F47-A51 WeakPolarHBondContact O-CB 3.4Å; F47-A51 PolarHBondContact O-N 3.44Å; F47-V59 HydrophobicContact CD2-CG2 3.61Å; F47-V59 HydrophobicContact CE2-CG2 3.55Å; F47-P62 HydrophobicContact CB-CB 3.91Å; F47-L63 HydrophobicContact CD2-CB 3.9Å; F47-L63 HydrophobicContact CD2-CD1 4.2Å; F47-L63 HydrophobicContact CE2-CB 4.01Å; F47-L63 HydrophobicContact CE2-CD1 3.87Å; F47-L63 HydrophobicContact CE2-CD2 4.45Å; F47-L63 HydrophobicContact CE2-CG 4.33Å; F47-L63 HydrophobicContact CZ-CD1 4.29Å
48	V	77.8	Confident	73.5	Confident	71 Å²	71	40.7 Å²	40.7	43%	0.43	27%	0.271	S	S	.	.	H	α-helix	trans	-61.2	-39.5	178.9	175.1	0	0	0	0	110.9	F44 I45 A51 A52	F44-V48 HydrophobicContact CD1-CG2 4.39Å; F44-V48 HydrophobicContact CE1-CG2 4Å; F44-V48 HydrophobicContact CE2-CG2 4.32Å; F44-V48 HydrophobicContact CZ-CG2 3.96Å; F44-V48 WeakPolarHBondContact O-CG2 3.01Å; F44-V48 PolarHBondContact O-N 2.99Å; I45-V48 PolarHBondContact O-N 3.34Å; V48-A51 PolarHBondContact O-N 3.43Å; V48-A52 WeakPolarHBondContact O-CB 3.44Å; V48-A52 PolarHBondContact O-N 3.47Å; V48-A52 VanDerWaalsContact O-N 3.08Å
49	C	71.8	Confident	73.4	Confident	20 Å²	20	40.9 Å²	40.9	14%	0.135	27%	0.269	C	S	.	.	H	α-helix	trans	-68.1	-40.7	179.6	-146.8	0	0	0	0	112.3	I45 S46 F47 S53 S119 A123	I45-C49 WeakPolarHBondContact O-CB 3.39Å; I45-C49 PolarHBondContact O-N 2.91Å; S46-C49 PolarHBondContact O-N 2.8Å; F47-C49 VanDerWaalsContact C-N 3.27Å; F47-C49 PolarHBondContact O-N 3.27Å; C49-S53 WeakPolarHBondContact O-CB 3.47Å; C49-S53 PolarHBondContact O-N 3.14Å; C49-S119 PolarHBondContact SG-O 3.07Å; C49-S119 VanDerWaalsContact SG-O 3.4Å; C49-A123 HydrophobicContact CB-CB 3.81Å; C49-A123 VanDerWaalsContact SG-CA 3.56Å; C49-A123 VanDerWaalsContact SG-CB 3.5Å; C49-A123 PolarHBondContact SG-N 2.96Å
50	F	71.6	Confident	73.5	Confident	4 Å²	4	45 Å²	45	2%	0.018	29%	0.294	C	S	.	.	H	α-helix	trans	-71.8	-35.1	173.8	-86.7	-69.4	0	0	0	113.4	S46 F47 A52 S53 A55 F58 V59 P62 I107 A111 A123	S46-F50 VanDerWaalsContact O-CD2 3.3Å; S46-F50 WeakPolarHBondContact O-CD2 3.28Å; S46-F50 PolarHBondContact O-N 2.99Å; F47-F50 PolarHBondContact O-N 3.44Å; F50-A52 VanDerWaalsContact C-N 3.28Å; F50-A52 PolarHBondContact O-N 2.86Å; F50-S53 PolarHBondContact O-N 3.46Å; F50-A55 HydrophobicContact CD1-CB 3.85Å; F50-A55 HydrophobicContact CE1-CB 3.79Å; F50-F58 HydrophobicContact CD1-CB 4.25Å; F50-F58 HydrophobicContact CE1-CB 4.29Å; F50-V59 HydrophobicContact CB-CB 4.42Å; F50-V59 HydrophobicContact CB-CG2 4.33Å; F50-P62 HydrophobicContact CD2-CG 3.91Å; F50-I107 HydrophobicContact CD2-CG2 4.47Å; F50-I107 HydrophobicContact CE1-CG2 3.98Å; F50-I107 HydrophobicContact CE2-CG2 3.36Å; F50-I107 HydrophobicContact CZ-CG2 3.06Å; F50-A111 HydrophobicContact CE1-CB 4.4Å; F50-A111 HydrophobicContact CZ-CB 4.04Å; F50-A123 HydrophobicContact CE2-CB 4.16Å; F50-A123 HydrophobicContact CZ-CB 4.23Å
51	A	72.4	Confident	73.6	Confident	56 Å²	56	46.6 Å²	46.6	46%	0.463	30%	0.302	S	S	.	.	H	α-helix	trans	-65.3	-32.8	175.7	0	0	0	0	0	112.1	F47 V48 S53 V59	F47-A51 VanDerWaalsContact O-CB 3.26Å; F47-A51 WeakPolarHBondContact O-CB 3.4Å; F47-A51 PolarHBondContact O-N 3.44Å; V48-A51 PolarHBondContact O-N 3.43Å; A51-S53 VanDerWaalsContact C-N 3.33Å; A51-V59 HydrophobicContact CB-CG2 4Å
52	A	72.4	Confident	73.5	Confident	77 Å²	77	44.5 Å²	44.5	64%	0.636	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.5	-1.3	176	0	0	0	0	0	113.8	V48 F50	V48-A52 WeakPolarHBondContact O-CB 3.44Å; V48-A52 PolarHBondContact O-N 3.47Å; V48-A52 VanDerWaalsContact O-N 3.08Å; F50-A52 VanDerWaalsContact C-N 3.28Å; F50-A52 PolarHBondContact O-N 2.86Å
53	S	71.1	Confident	73.7	Confident	10 Å²	10	46 Å²	46	7%	0.07	29%	0.292	C	S	.	.	S	Bend	trans	-108.4	154.4	-175.3	171.7	0	0	0	0	112.4	C49 F50 A51 A55 A56 S120	C49-S53 WeakPolarHBondContact O-CB 3.47Å; C49-S53 PolarHBondContact O-N 3.14Å; F50-S53 PolarHBondContact O-N 3.46Å; A51-S53 VanDerWaalsContact C-N 3.33Å; S53-A55 PolarHBondContact O-N 2.9Å; S53-A55 VanDerWaalsContact O-N 3.12Å; S53-A55 PolarHBondContact OG-N 3.33Å; S53-A56 PolarHBondContact O-N 3.38Å; S53-A56 VanDerWaalsContact O-N 3.13Å; S53-S120 PolarHBondContact OG-OG 3.27Å
54	A	60	Low	73.9	Confident	78 Å²	78	52 Å²	52	65%	0.645	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-13.9	167.6	0	0	0	0	0	113.3	A56	A54-A56 PolarHBondContact O-N 3.41Å
55	A	59.9	Low	73.9	Confident	0 Å²	0	47.8 Å²	47.8	0%	0	31%	0.308	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	19.9	171.9	0	0	0	0	0	113.7	F50 S53 A57 F58 Y115	F50-A55 HydrophobicContact CD1-CB 3.85Å; F50-A55 HydrophobicContact CE1-CB 3.79Å; S53-A55 PolarHBondContact O-N 2.9Å; S53-A55 VanDerWaalsContact O-N 3.12Å; S53-A55 PolarHBondContact OG-N 3.33Å; A55-A57 PolarHBondContact O-N 3.18Å; A55-F58 HydrophobicContact CB-CD2 4.34Å; A55-F58 PolarHBondContact O-N 3.2Å; A55-Y115 HydrophobicContact CB-CD1 4.11Å; A55-Y115 HydrophobicContact CB-CD2 3.94Å; A55-Y115 HydrophobicContact CB-CE1 3.79Å; A55-Y115 HydrophobicContact CB-CE2 3.6Å; A55-Y115 HydrophobicContact CB-CG 4.18Å
56	A	63.7	Low	73.9	Confident	46 Å²	46	46.6 Å²	46.6	38%	0.38	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-52.7	-19.4	179.2	0	0	0	0	0	114.4	S53 A54 F58 V59	S53-A56 PolarHBondContact O-N 3.38Å; S53-A56 VanDerWaalsContact O-N 3.13Å; A54-A56 PolarHBondContact O-N 3.41Å; A56-F58 PolarHBondContact O-N 3.15Å; A56-F58 VanDerWaalsContact O-N 3.11Å; A56-V59 VanDerWaalsContact O-CB 3.24Å; A56-V59 WeakPolarHBondContact O-CB 3.42Å; A56-V59 WeakPolarHBondContact O-CG1 3.13Å; A56-V59 PolarHBondContact O-N 3.27Å
57	A	70.9	Confident	74.3	Confident	78 Å²	78	51 Å²	51	65%	0.645	32%	0.323	S	S	*	.	G	3₁₀ helix	trans	-55.4	-24.9	171.3	0	0	0	0	0	113.6	A55	A55-A57 PolarHBondContact O-N 3.18Å
58	F	73.6	Confident	74.4	Confident	58 Å²	58	49.7 Å²	49.7	25%	0.254	32%	0.322	S	S	.	.	G	3₁₀ helix	trans	-96.8	0.1	178.5	-58.8	-69.7	0	0	0	113.7	F50 A55 A56 T60 V61 P62 M110 Y115	F50-F58 HydrophobicContact CD1-CB 4.25Å; F50-F58 HydrophobicContact CE1-CB 4.29Å; A55-F58 HydrophobicContact CB-CD2 4.34Å; A55-F58 PolarHBondContact O-N 3.2Å; A56-F58 PolarHBondContact O-N 3.15Å; A56-F58 VanDerWaalsContact O-N 3.11Å; F58-T60 PolarHBondContact O-N 3.05Å; F58-V61 WeakPolarHBondContact O-CB 3.19Å; F58-V61 PolarHBondContact O-N 3.46Å; F58-P62 WeakPolarHBondContact O-CD 3.17Å; F58-M110 HydrophobicContact CD1-CE 4.13Å; F58-M110 HydrophobicContact CD2-CE 4.27Å; F58-M110 HydrophobicContact CE1-CE 3.42Å; F58-M110 VanDerWaalsContact CE1-CE 3.42Å; F58-M110 HydrophobicContact CE2-CE 3.57Å; F58-M110 HydrophobicContact CZ-CE 3.11Å; F58-Y115 HydrophobicContact CE2-CE2 4.41Å
59	V	78.3	Confident	74.5	Confident	34 Å²	34	46.5 Å²	46.5	21%	0.206	30%	0.303	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-28.7	-174.5	79.4	0	0	0	0	113.4	F47 F50 A51 A56 V61 P62 L63	F47-V59 HydrophobicContact CD2-CG2 3.61Å; F47-V59 HydrophobicContact CE2-CG2 3.55Å; F50-V59 HydrophobicContact CB-CB 4.42Å; F50-V59 HydrophobicContact CB-CG2 4.33Å; A51-V59 HydrophobicContact CB-CG2 4Å; A56-V59 VanDerWaalsContact O-CB 3.24Å; A56-V59 WeakPolarHBondContact O-CB 3.42Å; A56-V59 WeakPolarHBondContact O-CG1 3.13Å; A56-V59 PolarHBondContact O-N 3.27Å; V59-V61 PolarHBondContact O-N 2.96Å; V59-P62 WeakPolarHBondContact O-CD 3.3Å; V59-L63 WeakPolarHBondContact O-CB 3.39Å; V59-L63 PolarHBondContact O-N 3.16Å
60	T	78.7	Confident	74.9	Confident	90 Å²	90	49.6 Å²	49.6	55%	0.552	32%	0.317	S	S	*	.	H	α-helix	trans	-61.3	-28.4	176.5	8.4	0	0	0	0	112.2	F58 L64	F58-T60 PolarHBondContact O-N 3.05Å; T60-L64 WeakPolarHBondContact O-CB 3.43Å; T60-L64 PolarHBondContact O-N 3.31Å
61	V	80.7	Confident	75.4	Confident	47 Å²	47	56 Å²	56	29%	0.285	35%	0.345	S	S	.	.	H	α-helix	trans	-76.4	-53	-174.7	-179.4	0	0	0	0	111.9	F58 V59 L63 L64 A65 I103 I107	F58-V61 WeakPolarHBondContact O-CB 3.19Å; F58-V61 PolarHBondContact O-N 3.46Å; V59-V61 PolarHBondContact O-N 2.96Å; V61-L63 PolarHBondContact O-N 2.84Å; V61-L64 PolarHBondContact O-N 3.07Å; V61-A65 PolarHBondContact O-N 2.79Å; V61-I103 HydrophobicContact CG1-CG2 3.17Å; V61-I107 HydrophobicContact CB-CD1 3.91Å; V61-I107 HydrophobicContact CG1-CD1 3.62Å; V61-I107 HydrophobicContact CG2-CD1 4.38Å
62	P	75.9	Confident	75.5	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-58.3	-34.9	169.5	-23.6	32	0	0	0	113.2	F47 F50 F58 V59 A65 F66 F104	F47-P62 HydrophobicContact CB-CB 3.91Å; F50-P62 HydrophobicContact CD2-CG 3.91Å; F58-P62 WeakPolarHBondContact O-CD 3.17Å; V59-P62 WeakPolarHBondContact O-CD 3.3Å; P62-A65 PolarHBondContact O-N 3.48Å; P62-F66 WeakPolarHBondContact O-CB 3.41Å; P62-F66 PolarHBondContact O-N 3.18Å; P62-F104 HydrophobicContact CB-CZ 4.42Å; P62-F104 HydrophobicContact CG-CE1 4.44Å
63	L	80.4	Confident	75.8	Confident	65 Å²	65	52.9 Å²	52.9	34%	0.34	31%	0.309	S	S	.	.	H	α-helix	trans	-63.5	-44.6	177.1	-177.6	64.8	0	0	0	111.4	F47 V59 V61 F66 L67	F47-L63 HydrophobicContact CD2-CB 3.9Å; F47-L63 HydrophobicContact CD2-CD1 4.2Å; F47-L63 HydrophobicContact CE2-CB 4.01Å; F47-L63 HydrophobicContact CE2-CD1 3.87Å; F47-L63 HydrophobicContact CE2-CD2 4.45Å; F47-L63 HydrophobicContact CE2-CG 4.33Å; F47-L63 HydrophobicContact CZ-CD1 4.29Å; V59-L63 WeakPolarHBondContact O-CB 3.39Å; V59-L63 PolarHBondContact O-N 3.16Å; V61-L63 PolarHBondContact O-N 2.84Å; L63-F66 PolarHBondContact O-N 3.41Å; L63-L67 HydrophobicContact CG-CD1 4.46Å; L63-L67 WeakPolarHBondContact O-CG 3.44Å; L63-L67 PolarHBondContact O-N 3.13Å
64	L	81.2	Confident	76.1	Confident	124 Å²	124	58.6 Å²	58.6	65%	0.649	33%	0.333	S	S	*	.	H	α-helix	trans	-66.7	-39.1	178.1	-158.8	72.9	0	0	0	111.5	T60 V61 L67 A68	T60-L64 WeakPolarHBondContact O-CB 3.43Å; T60-L64 PolarHBondContact O-N 3.31Å; V61-L64 PolarHBondContact O-N 3.07Å; L64-L67 PolarHBondContact O-N 3.04Å; L64-A68 VanDerWaalsContact O-CB 3.29Å; L64-A68 WeakPolarHBondContact O-CB 3.4Å; L64-A68 PolarHBondContact O-N 3.45Å
65	A	78.6	Confident	76.8	Confident	14 Å²	14	55.7 Å²	55.7	12%	0.116	31%	0.309	C	S	.	.	H	α-helix	trans	-62.6	-41.9	173.7	0	0	0	0	0	112	V61 P62 A68 S69 F104	V61-A65 PolarHBondContact O-N 2.79Å; P62-A65 PolarHBondContact O-N 3.48Å; A65-A68 PolarHBondContact O-N 3.08Å; A65-S69 WeakPolarHBondContact O-CB 3.45Å; A65-S69 PolarHBondContact O-N 2.94Å; A65-F104 HydrophobicContact CB-CE2 3.9Å; A65-F104 HydrophobicContact CB-CZ 4.17Å
66	F	79.5	Confident	77.3	Confident	49 Å²	49	59.8 Å²	59.8	22%	0.215	33%	0.325	C	S	.	.	H	α-helix	trans	-63.5	-46.5	175.6	179.5	-107.8	0	0	0	112.2	F44 P62 L63 A68 S69 I70	F44-F66 HydrophobicContact CB-CD2 3.97Å; F44-F66 HydrophobicContact CB-CE2 3.85Å; F44-F66 HydrophobicContact CD2-CE2 4.04Å; F44-F66 HydrophobicContact CD2-CZ 4.05Å; F44-F66 HydrophobicContact CG-CE2 4.33Å; P62-F66 WeakPolarHBondContact O-CB 3.41Å; P62-F66 PolarHBondContact O-N 3.18Å; L63-F66 PolarHBondContact O-N 3.41Å; F66-A68 VanDerWaalsContact C-N 3.32Å; F66-A68 PolarHBondContact O-N 2.89Å; F66-S69 PolarHBondContact O-N 3.21Å; F66-I70 HydrophobicContact CD1-CD1 3.95Å; F66-I70 HydrophobicContact CE1-CD1 3.35Å; F66-I70 HydrophobicContact CE1-CG1 4.39Å; F66-I70 HydrophobicContact CE2-CD1 4.1Å; F66-I70 HydrophobicContact CE2-CG1 4.46Å; F66-I70 HydrophobicContact CZ-CD1 3.45Å; F66-I70 VanDerWaalsContact CZ-CD1 3.45Å; F66-I70 HydrophobicContact CZ-CG1 4.28Å; F66-I70 WeakPolarHBondContact O-CG1 3.47Å; F66-I70 PolarHBondContact O-N 2.73Å
67	L	83.3	Confident	77.5	Confident	94 Å²	94	60.4 Å²	60.4	49%	0.492	33%	0.327	S	S	.	.	H	α-helix	trans	-62.5	-39.9	175.7	-71.1	176.7	0	0	0	111.8	L63 L64 I70 F71	L63-L67 HydrophobicContact CG-CD1 4.46Å; L63-L67 WeakPolarHBondContact O-CG 3.44Å; L63-L67 PolarHBondContact O-N 3.13Å; L64-L67 PolarHBondContact O-N 3.04Å; L67-I70 PolarHBondContact O-N 3.11Å; L67-F71 WeakPolarHBondContact O-CB 3.37Å; L67-F71 PolarHBondContact O-N 2.9Å
68	A	80.4	Confident	77.2	Confident	29 Å²	29	60 Å²	60	24%	0.24	32%	0.316	C	S	.	.	H	α-helix	trans	-64.1	-43	175.6	0	0	0	0	0	111.6	L64 A65 F66 F71 F72	L64-A68 VanDerWaalsContact O-CB 3.29Å; L64-A68 WeakPolarHBondContact O-CB 3.4Å; L64-A68 PolarHBondContact O-N 3.45Å; A65-A68 PolarHBondContact O-N 3.08Å; F66-A68 VanDerWaalsContact C-N 3.32Å; F66-A68 PolarHBondContact O-N 2.89Å; A68-F71 PolarHBondContact O-N 3.38Å; A68-F72 WeakPolarHBondContact O-CB 3.35Å; A68-F72 WeakPolarHBondContact O-CD2 3.42Å; A68-F72 PolarHBondContact O-N 3.39Å
69	S	81.1	Confident	76.5	Confident	4 Å²	4	64.4 Å²	64.4	3%	0.028	34%	0.336	C	S	.	.	H	α-helix	trans	-63	-42.8	176.5	-173.6	0	0	0	0	111.8	L36 G40 A65 F66 F72 L73	L36-S69 PolarHBondContact O-OG 3.21Å; G40-S69 WeakPolarHBondContact CA-OG 3.21Å; G40-S69 PolarHBondContact N-OG 2.87Å; A65-S69 WeakPolarHBondContact O-CB 3.45Å; A65-S69 PolarHBondContact O-N 2.94Å; F66-S69 PolarHBondContact O-N 3.21Å; S69-F72 PolarHBondContact O-N 3.38Å; S69-L73 WeakPolarHBondContact O-CB 3.36Å; S69-L73 PolarHBondContact O-N 3.42Å
70	I	79.9	Confident	75.3	Confident	84 Å²	84	69.3 Å²	69.3	43%	0.431	35%	0.354	S	S	.	.	H	α-helix	trans	-61.6	-45.4	172.5	-71.8	179.7	0	0	0	111.3	F66 L67 F72 L73 F74	F66-I70 HydrophobicContact CD1-CD1 3.95Å; F66-I70 HydrophobicContact CE1-CD1 3.35Å; F66-I70 HydrophobicContact CE1-CG1 4.39Å; F66-I70 HydrophobicContact CE2-CD1 4.1Å; F66-I70 HydrophobicContact CE2-CG1 4.46Å; F66-I70 HydrophobicContact CZ-CD1 3.45Å; F66-I70 VanDerWaalsContact CZ-CD1 3.45Å; F66-I70 HydrophobicContact CZ-CG1 4.28Å; F66-I70 WeakPolarHBondContact O-CG1 3.47Å; F66-I70 PolarHBondContact O-N 2.73Å; L67-I70 PolarHBondContact O-N 3.11Å; I70-F72 VanDerWaalsContact C-N 3.32Å; I70-F72 PolarHBondContact O-N 3.37Å; I70-L73 PolarHBondContact O-N 3.37Å; I70-F74 WeakPolarHBondContact O-CB 3.45Å; I70-F74 PolarHBondContact O-N 3.42Å
71	F	80.6	Confident	74.1	Confident	138 Å²	138	69.9 Å²	69.9	61%	0.605	35%	0.354	S	S	*	.	H	α-helix	trans	-62.1	-41.1	179.2	-179.3	-96.2	0	0	0	111.6	L67 A68 F74 A75	L67-F71 WeakPolarHBondContact O-CB 3.37Å; L67-F71 PolarHBondContact O-N 2.9Å; A68-F71 PolarHBondContact O-N 3.38Å; F71-F74 PolarHBondContact O-N 3.47Å; F71-A75 VanDerWaalsContact O-CB 3.3Å; F71-A75 WeakPolarHBondContact O-CB 3.43Å; F71-A75 PolarHBondContact O-N 2.94Å
72	F	75.9	Confident	73	Confident	17 Å²	17	74.8 Å²	74.8	8%	0.075	37%	0.374	C	S	.	.	H	α-helix	trans	-67.1	-41.8	175.7	-97.9	-94.2	0	0	0	112.5	L36 A68 S69 I70 F74 A75 Y76 F89 M92 D93	L36-F72 HydrophobicContact CD2-CB 3.9Å; A68-F72 WeakPolarHBondContact O-CB 3.35Å; A68-F72 WeakPolarHBondContact O-CD2 3.42Å; A68-F72 PolarHBondContact O-N 3.39Å; S69-F72 PolarHBondContact O-N 3.38Å; I70-F72 VanDerWaalsContact C-N 3.32Å; I70-F72 PolarHBondContact O-N 3.37Å; F72-F74 VanDerWaalsContact C-N 3.28Å; F72-F74 PolarHBondContact O-N 3.37Å; F72-A75 PolarHBondContact O-N 3.01Å; F72-Y76 VanDerWaalsContact O-CB 3.26Å; F72-Y76 WeakPolarHBondContact O-CB 3.26Å; F72-Y76 PolarHBondContact O-N 3.22Å; F72-F89 HydrophobicContact CD1-CE1 4.5Å; F72-F89 HydrophobicContact CD1-CE2 4.47Å; F72-F89 AromaticContact CD1-CZ 3.96Å; F72-F89 HydrophobicContact CD1-CZ 3.96Å; F72-F89 HydrophobicContact CE1-CE1 4.43Å; F72-F89 HydrophobicContact CE1-CE2 4.25Å; F72-F89 HydrophobicContact CE1-CZ 4.03Å; F72-M92 HydrophobicContact CZ-CG 4.25Å; F72-D93 HydrophobicContact CD1-CB 4.37Å; F72-D93 HydrophobicContact CE1-CB 3.65Å; F72-D93 WeakPolarHBondContact CE1-OD1 3.34Å; F72-D93 HydrophobicContact CZ-CB 4.26Å
73	L	77.6	Confident	72	Confident	51 Å²	51	85.4 Å²	85.4	27%	0.267	41%	0.414	S	S	.	.	H	α-helix	trans	-60.2	-41.7	174.2	-173.6	148.8	0	0	0	110.9	I37 S69 I70 S77	I37-L73 HydrophobicContact CG1-CD1 4.48Å; S69-L73 WeakPolarHBondContact O-CB 3.36Å; S69-L73 PolarHBondContact O-N 3.42Å; I70-L73 PolarHBondContact O-N 3.37Å; L73-S77 WeakPolarHBondContact O-CB 3.47Å; L73-S77 PolarHBondContact O-N 3.28Å; L73-S77 PolarHBondContact O-OG 3.16Å
74	F	77.2	Confident	70.7	Confident	130 Å²	130	89.2 Å²	89.2	57%	0.57	43%	0.428	S	S	*	.	H	α-helix	trans	-66	-51.5	174.9	-168.5	-97.7	0	0	0	111.3	I70 F71 F72 Y76 S77 T78	I70-F74 WeakPolarHBondContact O-CB 3.45Å; I70-F74 PolarHBondContact O-N 3.42Å; F71-F74 PolarHBondContact O-N 3.47Å; F72-F74 VanDerWaalsContact C-N 3.28Å; F72-F74 PolarHBondContact O-N 3.37Å; F74-Y76 VanDerWaalsContact C-N 3.25Å; F74-Y76 PolarHBondContact O-N 3.29Å; F74-S77 CarbonylContact O-C 3.55Å; F74-S77 WeakPolarHBondContact O-CA 3.44Å; F74-S77 WeakPolarHBondContact O-CB 3.46Å; F74-S77 PolarHBondContact O-N 3.18Å; F74-T78 WeakPolarHBondContact CD1-OG1 3.03Å; F74-T78 HydrophobicContact CE1-CG2 4.22Å; F74-T78 WeakPolarHBondContact CE1-OG1 3.48Å; F74-T78 HydrophobicContact CZ-CG2 4.29Å; F74-T78 WeakPolarHBondContact CZ-OG1 3.32Å; F74-T78 PolarHBondContact O-N 3.46Å; F74-T78 PolarHBondContact O-OG1 2.99Å
75	A	76.1	Confident	69.2	Low	17 Å²	17	92.1 Å²	92.1	14%	0.14	44%	0.435	C	S	.	.	H	α-helix	trans	-57.1	-38.4	179.1	0	0	0	0	0	112.8	F71 F72 F89	F71-A75 VanDerWaalsContact O-CB 3.3Å; F71-A75 WeakPolarHBondContact O-CB 3.43Å; F71-A75 PolarHBondContact O-N 2.94Å; F72-A75 PolarHBondContact O-N 3.01Å; A75-F89 HydrophobicContact CB-CE2 4.05Å; A75-F89 HydrophobicContact CB-CZ 4.36Å
76	Y	69.4	Low	68.2	Low	86 Å²	86	93.7 Å²	93.7	34%	0.337	45%	0.452	S	S	.	.	H	α-helix	trans	-67.5	-37.1	173.9	-169	-98.9	0	0	0	112.1	F27 F72 F74 F89	F27-Y76 AromaticContact CD1-CE1 3.89Å; F27-Y76 HydrophobicContact CD1-CE1 3.89Å; F27-Y76 HydrophobicContact CE1-CE1 4.04Å; F72-Y76 VanDerWaalsContact O-CB 3.26Å; F72-Y76 WeakPolarHBondContact O-CB 3.26Å; F72-Y76 PolarHBondContact O-N 3.22Å; F74-Y76 VanDerWaalsContact C-N 3.25Å; F74-Y76 PolarHBondContact O-N 3.29Å; Y76-F89 HydrophobicContact CD2-CE1 4.5Å
77	S	68.8	Low	67.2	Low	60 Å²	60	95.8 Å²	95.8	42%	0.42	46%	0.462	S	S	.	.	H	α-helix	trans	-76.2	-36.3	179.8	-59.7	0	0	0	0	113.5	L73 F74 K79	L73-S77 WeakPolarHBondContact O-CB 3.47Å; L73-S77 PolarHBondContact O-N 3.28Å; L73-S77 PolarHBondContact O-OG 3.16Å; F74-S77 CarbonylContact O-C 3.55Å; F74-S77 WeakPolarHBondContact O-CA 3.44Å; F74-S77 WeakPolarHBondContact O-CB 3.46Å; F74-S77 PolarHBondContact O-N 3.18Å; S77-K79 VanDerWaalsContact C-N 3.31Å; S77-K79 PolarHBondContact O-N 2.96Å
78	T	65.1	Low	66.3	Low	68 Å²	68	95.3 Å²	95.3	42%	0.417	47%	0.466	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.3	16.6	-168.4	-34.3	0	0	0	0	115	F74 F80	F74-T78 WeakPolarHBondContact CD1-OG1 3.03Å; F74-T78 HydrophobicContact CE1-CG2 4.22Å; F74-T78 WeakPolarHBondContact CE1-OG1 3.48Å; F74-T78 HydrophobicContact CZ-CG2 4.29Å; F74-T78 WeakPolarHBondContact CZ-OG1 3.32Å; F74-T78 PolarHBondContact O-N 3.46Å; F74-T78 PolarHBondContact O-OG1 2.99Å; T78-F80 PolarHBondContact O-N 3.44Å
79	K	58.4	Low	65.9	Low	152 Å²	152	96.6 Å²	96.6	66%	0.661	47%	0.466	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.1	17.1	-176.8	-75.5	-151.6	176.8	-169.3	0	115.3	S77 N81 E82	S77-K79 VanDerWaalsContact C-N 3.31Å; S77-K79 PolarHBondContact O-N 2.96Å; K79-N81 PolarHBondContact O-N 3.49Å; K79-E82 WeakPolarHBondContact CD-OE2 3.37Å; K79-E82 IonicContact NZ-OE2 2.65Å; K79-E82 PolarHBondContact O-N 2.85Å
80	F	53.3	Low	65.4	Low	137 Å²	137	97.1 Å²	97.1	60%	0.601	47%	0.469	S	S	*	.	G	3₁₀ helix	trans	-62	-13.8	173.7	-138.5	-95.8	0	0	0	111.8	T78 E82 R83 F84	T78-F80 PolarHBondContact O-N 3.44Å; F80-E82 PolarHBondContact O-N 2.89Å; F80-R83 PolarHBondContact O-N 3.27Å; F80-F84 HydrophobicContact CD1-CD2 4.21Å; F80-F84 HydrophobicContact CE1-CD2 4.06Å; F80-F84 AromaticContact CE1-CE2 3.91Å; F80-F84 HydrophobicContact CE1-CE2 3.91Å
81	N	52.8	Low	65.2	Low	102 Å²	102	96.4 Å²	96.4	55%	0.545	47%	0.466	S	S	.	.	G	3₁₀ helix	trans	-54	-25.8	167.8	-166.4	48.1	0	0	0	115	K79 R83	K79-N81 PolarHBondContact O-N 3.49Å; N81-R83 VanDerWaalsContact C-N 3.27Å; N81-R83 PolarHBondContact O-N 3.2Å
82	E	57.5	Low	64.9	Low	150 Å²	150	95.4 Å²	95.4	70%	0.701	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-73.9	-15	179.8	-90	178.2	87.4	0	0	113.6	K79 F80	K79-E82 WeakPolarHBondContact CD-OE2 3.37Å; K79-E82 IonicContact NZ-OE2 2.65Å; K79-E82 PolarHBondContact O-N 2.85Å; F80-E82 PolarHBondContact O-N 2.89Å
83	R	54.2	Low	65	Low	222 Å²	222	95.9 Å²	95.9	84%	0.838	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.1	-26.1	-173.9	-68.7	-67.2	-164.7	162.7	2.5	115	F80 N81	F80-R83 PolarHBondContact O-N 3.27Å; N81-R83 VanDerWaalsContact C-N 3.27Å; N81-R83 PolarHBondContact O-N 3.2Å
84	F	53.7	Low	65.2	Low	145 Å²	145	95.2 Å²	95.2	64%	0.636	46%	0.463	S	S	*	.	S	Bend	trans	-115.4	92.8	-179.6	-78.2	-87.7	0	0	0	110.2	F80 G86	F80-F84 HydrophobicContact CD1-CD2 4.21Å; F80-F84 HydrophobicContact CE1-CD2 4.06Å; F80-F84 AromaticContact CE1-CE2 3.91Å; F80-F84 HydrophobicContact CE1-CE2 3.91Å; F84-G86 PolarHBondContact O-N 3.4Å
85	K	49.7	Very low	65.5	Low	186 Å²	186	93.5 Å²	93.5	81%	0.809	46%	0.458	S	S	*	.			trans	-4.9	113.3	166.3	-86	169.7	167.1	166.5	0	114.7	F87 C88	K85-F87 PolarHBondContact O-N 3.49Å; K85-C88 PolarHBondContact O-N 3.35Å
86	G	56.9	Low	65.8	Low	46 Å²	46	94.5 Å²	94.5	47%	0.474	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	1.7	-171.7	0	0	0	0	0	118.9	F84 P90	F84-G86 PolarHBondContact O-N 3.4Å; G86-P90 WeakPolarHBondContact O-CD 3.38Å; G86-P90 WeakPolarHBondContact O-CG 3.46Å
87	F	59.3	Low	66.4	Low	93 Å²	93	90.5 Å²	90.5	41%	0.408	44%	0.443	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-38.2	173.4	-171.9	-99.6	0	0	0	113.3	K85 F89 P90 L91 L145 L149	K85-F87 PolarHBondContact O-N 3.49Å; F87-F89 VanDerWaalsContact C-N 3.35Å; F87-F89 PolarHBondContact O-N 2.91Å; F87-P90 WeakPolarHBondContact O-CD 3.5Å; F87-L91 HydrophobicContact CE1-CD1 4.05Å; F87-L91 HydrophobicContact CZ-CD1 4.3Å; F87-L91 WeakPolarHBondContact O-CB 3.35Å; F87-L91 PolarHBondContact O-N 3.27Å; F87-L145 HydrophobicContact CD2-CD1 4.06Å; F87-L145 HydrophobicContact CE2-CD1 3.46Å; F87-L145 VanDerWaalsContact CE2-CD1 3.46Å; F87-L145 HydrophobicContact CZ-CD1 3.91Å; F87-L149 HydrophobicContact CE2-CD2 3.9Å; F87-L149 HydrophobicContact CE2-CG 4.35Å; F87-L149 HydrophobicContact CZ-CD2 3.91Å
88	C	63.9	Low	67.1	Low	85 Å²	85	89.6 Å²	89.6	57%	0.574	44%	0.435	S	S	*	.	H	α-helix	trans	-72	-29.8	-178.6	-82.5	0	0	0	0	112.9	K85 M92	K85-C88 PolarHBondContact O-N 3.35Å; C88-M92 VanDerWaalsContact O-CB 3.26Å; C88-M92 WeakPolarHBondContact O-CB 3.32Å; C88-M92 PolarHBondContact O-N 2.61Å
89	F	71.7	Confident	68.1	Low	56 Å²	56	89.6 Å²	89.6	25%	0.246	44%	0.435	C	S	.	.	H	α-helix	trans	-66.9	-53.9	-179.6	-171.8	-91.9	0	0	0	113.1	F72 A75 Y76 F87 L91 M92 D93	F72-F89 HydrophobicContact CD1-CE1 4.5Å; F72-F89 HydrophobicContact CD1-CE2 4.47Å; F72-F89 AromaticContact CD1-CZ 3.96Å; F72-F89 HydrophobicContact CD1-CZ 3.96Å; F72-F89 HydrophobicContact CE1-CE1 4.43Å; F72-F89 HydrophobicContact CE1-CE2 4.25Å; F72-F89 HydrophobicContact CE1-CZ 4.03Å; A75-F89 HydrophobicContact CB-CE2 4.05Å; A75-F89 HydrophobicContact CB-CZ 4.36Å; Y76-F89 HydrophobicContact CD2-CE1 4.5Å; F87-F89 VanDerWaalsContact C-N 3.35Å; F87-F89 PolarHBondContact O-N 2.91Å; F89-L91 VanDerWaalsContact C-N 3.31Å; F89-L91 PolarHBondContact O-N 2.83Å; F89-M92 PolarHBondContact O-N 3.45Å; F89-D93 PolarHBondContact O-N 3.3Å
90	P	72	Confident	69.3	Low	15 Å²	15	82.9 Å²	82.9	10%	0.097	41%	0.407	C	S	.	.	H	α-helix	trans	-64.9	-32.5	175.4	22.1	-31.2	0	0	0	113	G86 F87 D93 F94	G86-P90 WeakPolarHBondContact O-CD 3.38Å; G86-P90 WeakPolarHBondContact O-CG 3.46Å; F87-P90 WeakPolarHBondContact O-CD 3.5Å; P90-D93 PolarHBondContact O-N 2.88Å; P90-F94 WeakPolarHBondContact O-CB 3.26Å; P90-F94 PolarHBondContact O-N 3.37Å
91	L	74.3	Confident	70.9	Confident	69 Å²	69	77.3 Å²	77.3	36%	0.361	39%	0.385	S	S	.	.	H	α-helix	trans	-68.6	-37.5	175.3	-170.1	133.6	0	0	0	112.3	F87 F89 F94 I95 L145	F87-L91 HydrophobicContact CE1-CD1 4.05Å; F87-L91 HydrophobicContact CZ-CD1 4.3Å; F87-L91 WeakPolarHBondContact O-CB 3.35Å; F87-L91 PolarHBondContact O-N 3.27Å; F89-L91 VanDerWaalsContact C-N 3.31Å; F89-L91 PolarHBondContact O-N 2.83Å; L91-F94 WeakPolarHBondContact O-CB 3.35Å; L91-F94 PolarHBondContact O-N 3.38Å; L91-I95 WeakPolarHBondContact O-CG1 3.48Å; L91-I95 PolarHBondContact O-N 3.45Å; L91-I95 VanDerWaalsContact O-N 3.11Å; L91-L145 HydrophobicContact CD1-CD2 4.44Å
92	M	75.6	Confident	72.6	Confident	117 Å²	117	76.9 Å²	76.9	58%	0.576	38%	0.382	S	S	*	.	H	α-helix	trans	-68.3	-37.1	173.9	-173.4	146.9	53.4	0	0	111.9	F72 C88 F89 R96	F72-M92 HydrophobicContact CZ-CG 4.25Å; C88-M92 VanDerWaalsContact O-CB 3.26Å; C88-M92 WeakPolarHBondContact O-CB 3.32Å; C88-M92 PolarHBondContact O-N 2.61Å; F89-M92 PolarHBondContact O-N 3.45Å; M92-R96 WeakPolarHBondContact O-CB 3.43Å; M92-R96 PolarHBondContact O-N 2.88Å; M92-R96 VanDerWaalsContact O-N 3.12Å
93	D	77.7	Confident	73.9	Confident	26 Å²	26	72.6 Å²	72.6	14%	0.139	36%	0.363	C	S	.	.	H	α-helix	trans	-64.3	-41.1	173.6	-160.6	30.1	0	0	0	111.9	F72 F89 P90 R96 C97 I141	F72-D93 HydrophobicContact CD1-CB 4.37Å; F72-D93 HydrophobicContact CE1-CB 3.65Å; F72-D93 WeakPolarHBondContact CE1-OD1 3.34Å; F72-D93 HydrophobicContact CZ-CB 4.26Å; F89-D93 PolarHBondContact O-N 3.3Å; P90-D93 PolarHBondContact O-N 2.88Å; D93-R96 PolarHBondContact O-N 3.14Å; D93-R96 IonicContact OD1-CZ 3.68Å; D93-R96 IonicContact OD1-NE 2.63Å; D93-R96 PolarHBondContact OD1-NE 2.78Å; D93-R96 VanDerWaalsContact OD1-NE 3.13Å; D93-R96 IonicContact OD1-NH2 3.28Å; D93-R96 PolarHBondContact OD1-NH2 2.91Å; D93-C97 WeakPolarHBondContact O-CB 3.44Å; D93-C97 PolarHBondContact O-N 3.2Å; D93-I141 HydrophobicContact CB-CD1 4.38Å; D93-I141 WeakPolarHBondContact OD2-CD1 3.32Å
94	F	81.8	Confident	75.3	Confident	38 Å²	38	62.1 Å²	62.1	17%	0.167	32%	0.324	C	S	.	.	H	α-helix	trans	-57.7	-53.2	174.7	174.4	-95.3	0	0	0	112.6	P90 L91 R96 C97 V98 F138 I141 F142	P90-F94 WeakPolarHBondContact O-CB 3.26Å; P90-F94 PolarHBondContact O-N 3.37Å; L91-F94 WeakPolarHBondContact O-CB 3.35Å; L91-F94 PolarHBondContact O-N 3.38Å; F94-R96 VanDerWaalsContact C-N 3.28Å; F94-R96 PolarHBondContact O-N 2.93Å; F94-C97 PolarHBondContact O-N 2.92Å; F94-V98 HydrophobicContact CD1-CG2 4.48Å; F94-V98 HydrophobicContact CE1-CG2 4.27Å; F94-V98 HydrophobicContact CE2-CG2 4.46Å; F94-V98 HydrophobicContact CZ-CG2 4.29Å; F94-V98 WeakPolarHBondContact O-CG2 3.44Å; F94-V98 PolarHBondContact O-N 3.26Å; F94-F138 AromaticContact CD2-CD2 3.66Å; F94-F138 HydrophobicContact CD2-CD2 3.66Å; F94-F138 AromaticContact CD2-CE2 3.95Å; F94-F138 HydrophobicContact CD2-CE2 3.95Å; F94-F138 HydrophobicContact CE1-CE2 4.36Å; F94-F138 AromaticContact CE2-CD2 3.17Å; F94-F138 HydrophobicContact CE2-CD2 3.17Å; F94-F138 AromaticContact CE2-CE2 2.98Å; F94-F138 HydrophobicContact CE2-CE2 2.98Å; F94-F138 HydrophobicContact CE2-CG 4.36Å; F94-F138 AromaticContact CE2-CZ 3.99Å; F94-F138 HydrophobicContact CE2-CZ 3.99Å; F94-F138 AromaticContact CZ-CD2 3.82Å; F94-F138 HydrophobicContact CZ-CD2 3.82Å; F94-F138 AromaticContact CZ-CE2 3.25Å; F94-F138 HydrophobicContact CZ-CE2 3.25Å; F94-F138 HydrophobicContact CZ-CZ 4.24Å; F94-I141 HydrophobicContact CB-CG2 3.79Å; F94-I141 HydrophobicContact CD2-CG2 4.23Å; F94-F142 HydrophobicContact CE2-CB 4.21Å; F94-F142 HydrophobicContact CE2-CD2 4.09Å
95	I	82.6	Confident	77	Confident	93 Å²	93	59.3 Å²	59.3	48%	0.477	31%	0.311	S	S	.	.	H	α-helix	trans	-62.5	-39.4	-178.9	-65.3	-64.3	0	0	0	110.9	L91 T99	L91-I95 WeakPolarHBondContact O-CG1 3.48Å; L91-I95 PolarHBondContact O-N 3.45Å; L91-I95 VanDerWaalsContact O-N 3.11Å; I95-T99 VanDerWaalsContact O-CB 3.28Å; I95-T99 WeakPolarHBondContact O-CB 3.47Å; I95-T99 PolarHBondContact O-N 3.49Å; I95-T99 PolarHBondContact O-OG1 3.32Å
96	R	82.6	Confident	78.8	Confident	39 Å²	39	54.6 Å²	54.6	15%	0.147	29%	0.294	C	S	.	.	H	α-helix	trans	-62.2	-46.3	175.6	-177.2	-171.8	71.8	76.7	2.7	111.5	E39 M92 D93 F94 T99 S100	E39-R96 IonicContact OE1-CZ 3.79Å; E39-R96 IonicContact OE1-NH1 3.5Å; E39-R96 PolarHBondContact OE1-NH1 2.76Å; E39-R96 IonicContact OE1-NH2 2.73Å; E39-R96 IonicContact OE2-CZ 2.67Å; E39-R96 IonicContact OE2-NH1 3.13Å; E39-R96 PolarHBondContact OE2-NH1 3.05Å; E39-R96 IonicContact OE2-NH2 3.33Å; E39-R96 PolarHBondContact OE2-NH2 2.84Å; M92-R96 WeakPolarHBondContact O-CB 3.43Å; M92-R96 PolarHBondContact O-N 2.88Å; M92-R96 VanDerWaalsContact O-N 3.12Å; D93-R96 PolarHBondContact O-N 3.14Å; D93-R96 IonicContact OD1-CZ 3.68Å; D93-R96 IonicContact OD1-NE 2.63Å; D93-R96 PolarHBondContact OD1-NE 2.78Å; D93-R96 VanDerWaalsContact OD1-NE 3.13Å; D93-R96 IonicContact OD1-NH2 3.28Å; D93-R96 PolarHBondContact OD1-NH2 2.91Å; F94-R96 VanDerWaalsContact C-N 3.28Å; F94-R96 PolarHBondContact O-N 2.93Å; R96-T99 PolarHBondContact O-N 3.37Å; R96-S100 VanDerWaalsContact O-CB 3.3Å; R96-S100 WeakPolarHBondContact O-CB 3.28Å; R96-S100 PolarHBondContact O-N 3.34Å
97	C	82.2	Confident	80.1	Confident	1 Å²	1	53 Å²	53	1%	0.007	27%	0.274	C	S	.	.	H	α-helix	trans	-63.1	-46.6	179.9	-168.9	0	0	0	0	111.8	D93 F94 S100 S101 F134 D137 I141	D93-C97 WeakPolarHBondContact O-CB 3.44Å; D93-C97 PolarHBondContact O-N 3.2Å; F94-C97 PolarHBondContact O-N 2.92Å; C97-S100 PolarHBondContact O-N 2.72Å; C97-S101 WeakPolarHBondContact O-CB 3.33Å; C97-S101 PolarHBondContact O-N 2.84Å; C97-F134 PolarHBondContact SG-O 3.33Å; C97-D137 WeakPolarHBondContact SG-CB 3.41Å; C97-I141 HydrophobicContact CB-CD1 4.42Å
98	V	84.8	Confident	81.3	Confident	42 Å²	42	48.8 Å²	48.8	26%	0.255	26%	0.257	S	S	.	.	H	α-helix	trans	-61.2	-47.4	175.7	174.2	0	0	0	0	111.4	F94 S100 S101 I102 F138	F94-V98 HydrophobicContact CD1-CG2 4.48Å; F94-V98 HydrophobicContact CE1-CG2 4.27Å; F94-V98 HydrophobicContact CE2-CG2 4.46Å; F94-V98 HydrophobicContact CZ-CG2 4.29Å; F94-V98 WeakPolarHBondContact O-CG2 3.44Å; F94-V98 PolarHBondContact O-N 3.26Å; V98-S100 VanDerWaalsContact C-N 3.33Å; V98-S100 PolarHBondContact O-N 3.04Å; V98-S101 WeakPolarHBondContact O-CB 3.48Å; V98-S101 PolarHBondContact O-N 3.21Å; V98-I102 HydrophobicContact CG1-CD1 3.89Å; V98-I102 WeakPolarHBondContact O-CG1 2.94Å; V98-I102 PolarHBondContact O-N 3.31Å; V98-I102 VanDerWaalsContact O-N 3.08Å; V98-F138 HydrophobicContact CG2-CD2 3.28Å; V98-F138 HydrophobicContact CG2-CE2 3.63Å; V98-F138 HydrophobicContact CG2-CG 4.26Å
99	T	85.3	Confident	82.4	Confident	68 Å²	68	48.6 Å²	48.6	42%	0.417	25%	0.249	S	C	.	.	H	α-helix	trans	-60.5	-46.2	179.8	-58.4	0	0	0	0	110.6	I95 R96 I102 I103	I95-T99 VanDerWaalsContact O-CB 3.28Å; I95-T99 WeakPolarHBondContact O-CB 3.47Å; I95-T99 PolarHBondContact O-N 3.49Å; I95-T99 PolarHBondContact O-OG1 3.32Å; R96-T99 PolarHBondContact O-N 3.37Å; T99-I102 PolarHBondContact O-N 3.37Å; T99-I103 HydrophobicContact CG2-CD1 3.67Å; T99-I103 HydrophobicContact CG2-CG1 4.45Å; T99-I103 WeakPolarHBondContact O-CB 3.13Å; T99-I103 WeakPolarHBondContact O-CG1 3.46Å; T99-I103 PolarHBondContact O-N 3.27Å
100	S	83.5	Confident	83	Confident	10 Å²	10	48.7 Å²	48.7	7%	0.07	25%	0.251	C	S	.	.	H	α-helix	trans	-60.6	-46.4	176.6	-164.6	0	0	0	0	111.7	R96 C97 V98 I102 I103 F104 F134	R96-S100 VanDerWaalsContact O-CB 3.3Å; R96-S100 WeakPolarHBondContact O-CB 3.28Å; R96-S100 PolarHBondContact O-N 3.34Å; C97-S100 PolarHBondContact O-N 2.72Å; V98-S100 VanDerWaalsContact C-N 3.33Å; V98-S100 PolarHBondContact O-N 3.04Å; S100-I102 PolarHBondContact O-N 2.97Å; S100-I103 PolarHBondContact O-N 2.83Å; S100-F104 WeakPolarHBondContact O-CB 3.31Å; S100-F104 VanDerWaalsContact O-CD2 3.29Å; S100-F104 WeakPolarHBondContact O-CD2 3.35Å; S100-F104 PolarHBondContact O-N 2.89Å; S100-F104 WeakPolarHBondContact OG-CD2 3.34Å; S100-F104 VanDerWaalsContact OG-CE2 3.32Å; S100-F104 WeakPolarHBondContact OG-CE2 3.29Å; S100-F134 WeakPolarHBondContact OG-CE1 3.36Å; S100-F134 WeakPolarHBondContact OG-CE2 3.29Å; S100-F134 WeakPolarHBondContact OG-CZ 3.32Å
101	S	87.3	Confident	83.5	Confident	20 Å²	20	48 Å²	48	14%	0.14	25%	0.247	C	C	.	.	H	α-helix	trans	-54.7	-49.4	178	-168.4	0	0	0	0	112.4	C97 V98 F105 T131	C97-S101 WeakPolarHBondContact O-CB 3.33Å; C97-S101 PolarHBondContact O-N 2.84Å; V98-S101 WeakPolarHBondContact O-CB 3.48Å; V98-S101 PolarHBondContact O-N 3.21Å; S101-F105 VanDerWaalsContact O-CB 3.28Å; S101-F105 WeakPolarHBondContact O-CB 3.05Å; S101-F105 PolarHBondContact O-N 3.28Å; S101-T131 PolarHBondContact O-OG1 2.8Å; S101-T131 PolarHBondContact OG-O 2.84Å
102	I	88	Confident	83.9	Confident	93 Å²	93	47.6 Å²	47.6	48%	0.477	25%	0.247	S	C	.	.	H	α-helix	trans	-63.7	-44.8	179.5	-65.4	167.4	0	0	0	110.7	V98 T99 S100 F105 I106	V98-I102 HydrophobicContact CG1-CD1 3.89Å; V98-I102 WeakPolarHBondContact O-CG1 2.94Å; V98-I102 PolarHBondContact O-N 3.31Å; V98-I102 VanDerWaalsContact O-N 3.08Å; T99-I102 PolarHBondContact O-N 3.37Å; S100-I102 PolarHBondContact O-N 2.97Å; I102-F105 WeakPolarHBondContact O-CB 3.32Å; I102-F105 PolarHBondContact O-N 2.63Å; I102-I106 HydrophobicContact CG2-CD1 3.86Å; I102-I106 VanDerWaalsContact O-CG1 3.31Å; I102-I106 WeakPolarHBondContact O-CG1 3.3Å; I102-I106 PolarHBondContact O-N 2.86Å
103	I	85.4	Confident	84.2	Confident	61 Å²	61	46.4 Å²	46.4	31%	0.313	25%	0.25	S	C	.	.	H	α-helix	trans	-63.9	-49.1	-179.3	-74.5	174.9	0	0	0	111.2	V61 T99 S100 F105 I106 I107	V61-I103 HydrophobicContact CG1-CG2 3.17Å; T99-I103 HydrophobicContact CG2-CD1 3.67Å; T99-I103 HydrophobicContact CG2-CG1 4.45Å; T99-I103 WeakPolarHBondContact O-CB 3.13Å; T99-I103 WeakPolarHBondContact O-CG1 3.46Å; T99-I103 PolarHBondContact O-N 3.27Å; S100-I103 PolarHBondContact O-N 2.83Å; I103-F105 VanDerWaalsContact C-N 3.25Å; I103-F105 PolarHBondContact O-N 2.86Å; I103-I106 PolarHBondContact O-N 3.06Å; I103-I107 HydrophobicContact CG2-CD1 3.66Å; I103-I107 HydrophobicContact CG2-CG1 4.45Å; I103-I107 WeakPolarHBondContact O-CB 3.42Å; I103-I107 VanDerWaalsContact O-CG1 3.26Å; I103-I107 WeakPolarHBondContact O-CG1 3.48Å; I103-I107 PolarHBondContact O-N 3.29Å
104	F	83.4	Confident	84.3	Confident	2 Å²	2	52.8 Å²	52.8	1%	0.009	28%	0.277	C	S	.	.	H	α-helix	trans	-62.8	-34	177.2	-85.6	-73.9	0	0	0	112	P62 A65 S100 S108 A130 F134	P62-F104 HydrophobicContact CB-CZ 4.42Å; P62-F104 HydrophobicContact CG-CE1 4.44Å; A65-F104 HydrophobicContact CB-CE2 3.9Å; A65-F104 HydrophobicContact CB-CZ 4.17Å; S100-F104 WeakPolarHBondContact O-CB 3.31Å; S100-F104 VanDerWaalsContact O-CD2 3.29Å; S100-F104 WeakPolarHBondContact O-CD2 3.35Å; S100-F104 PolarHBondContact O-N 2.89Å; S100-F104 WeakPolarHBondContact OG-CD2 3.34Å; S100-F104 VanDerWaalsContact OG-CE2 3.32Å; S100-F104 WeakPolarHBondContact OG-CE2 3.29Å; F104-S108 WeakPolarHBondContact O-CB 3.3Å; F104-S108 PolarHBondContact O-N 2.8Å; F104-A130 HydrophobicContact CD1-CB 4.4Å; F104-A130 HydrophobicContact CG-CB 4.4Å; F104-F134 HydrophobicContact CD2-CD2 4.12Å; F104-F134 AromaticContact CD2-CE2 3.52Å; F104-F134 HydrophobicContact CD2-CE2 3.52Å; F104-F134 HydrophobicContact CD2-CZ 4.27Å; F104-F134 AromaticContact CE2-CE2 3.68Å; F104-F134 HydrophobicContact CE2-CE2 3.68Å; F104-F134 HydrophobicContact CE2-CZ 4.11Å; F104-F134 HydrophobicContact CG-CE2 4.4Å
105	F	88.4	Confident	84.2	Confident	85 Å²	85	53.6 Å²	53.6	37%	0.373	28%	0.279	S	S	.	.	H	α-helix	trans	-64.6	-49	174.9	-178.5	-113.7	0	0	0	112	S101 I102 I103 I107 S108 I109 F128 T131	S101-F105 VanDerWaalsContact O-CB 3.28Å; S101-F105 WeakPolarHBondContact O-CB 3.05Å; S101-F105 PolarHBondContact O-N 3.28Å; I102-F105 WeakPolarHBondContact O-CB 3.32Å; I102-F105 PolarHBondContact O-N 2.63Å; I103-F105 VanDerWaalsContact C-N 3.25Å; I103-F105 PolarHBondContact O-N 2.86Å; F105-I107 PolarHBondContact O-N 3.34Å; F105-S108 WeakPolarHBondContact O-CB 3.31Å; F105-S108 PolarHBondContact O-N 2.98Å; F105-I109 HydrophobicContact CD1-CD1 4.08Å; F105-I109 HydrophobicContact CD2-CD1 4.43Å; F105-I109 HydrophobicContact CE1-CD1 3.6Å; F105-I109 HydrophobicContact CE2-CD1 4Å; F105-I109 HydrophobicContact CG-CD1 4.47Å; F105-I109 HydrophobicContact CZ-CD1 3.56Å; F105-I109 WeakPolarHBondContact O-CG1 3.2Å; F105-I109 PolarHBondContact O-N 3.03Å; F105-F128 HydrophobicContact CD2-CD2 4.35Å; F105-F128 HydrophobicContact CD2-CE2 4.26Å; F105-F128 HydrophobicContact CE2-CD2 4.42Å; F105-F128 AromaticContact CE2-CE2 3.94Å; F105-F128 HydrophobicContact CE2-CE2 3.94Å; F105-T131 WeakPolarHBondContact CA-OG1 3.19Å; F105-T131 HydrophobicContact CB-CG2 3.87Å; F105-T131 HydrophobicContact CD2-CG2 4.1Å; F105-T131 HydrophobicContact CG-CG2 4.34Å; F105-T131 PolarHBondContact N-OG1 3.41Å
106	I	88.2	Confident	83.8	Confident	88 Å²	88	54.5 Å²	54.5	45%	0.451	29%	0.291	S	S	.	.	H	α-helix	trans	-61.2	-47.8	177.3	-67	166.6	0	0	0	110.2	I102 I103 S108 I109 M110	I102-I106 HydrophobicContact CG2-CD1 3.86Å; I102-I106 VanDerWaalsContact O-CG1 3.31Å; I102-I106 WeakPolarHBondContact O-CG1 3.3Å; I102-I106 PolarHBondContact O-N 2.86Å; I103-I106 PolarHBondContact O-N 3.06Å; I106-S108 VanDerWaalsContact C-N 3.29Å; I106-S108 PolarHBondContact O-N 2.99Å; I106-I109 PolarHBondContact O-N 3.44Å; I106-M110 HydrophobicContact CG2-CG 4.4Å; I106-M110 WeakPolarHBondContact O-CG 3.28Å; I106-M110 PolarHBondContact O-N 2.9Å
107	I	83.6	Confident	83.7	Confident	11 Å²	11	55.9 Å²	55.9	6%	0.056	30%	0.301	C	S	.	.	H	α-helix	trans	-62.6	-38.9	-179.8	-71.6	174.5	0	0	0	110.9	F50 V61 I103 F105 M110 A111	F50-I107 HydrophobicContact CD2-CG2 4.47Å; F50-I107 HydrophobicContact CE1-CG2 3.98Å; F50-I107 HydrophobicContact CE2-CG2 3.36Å; F50-I107 HydrophobicContact CZ-CG2 3.06Å; V61-I107 HydrophobicContact CB-CD1 3.91Å; V61-I107 HydrophobicContact CG1-CD1 3.62Å; V61-I107 HydrophobicContact CG2-CD1 4.38Å; I103-I107 HydrophobicContact CG2-CD1 3.66Å; I103-I107 HydrophobicContact CG2-CG1 4.45Å; I103-I107 WeakPolarHBondContact O-CB 3.42Å; I103-I107 VanDerWaalsContact O-CG1 3.26Å; I103-I107 WeakPolarHBondContact O-CG1 3.48Å; I103-I107 PolarHBondContact O-N 3.29Å; F105-I107 PolarHBondContact O-N 3.34Å; I107-M110 PolarHBondContact O-N 3.43Å; I107-A111 VanDerWaalsContact O-CB 3.23Å; I107-A111 WeakPolarHBondContact O-CB 3.34Å; I107-A111 PolarHBondContact O-N 3.12Å
108	S	85.2	Confident	83.5	Confident	6 Å²	6	58.7 Å²	58.7	4%	0.042	33%	0.33	C	S	.	.	H	α-helix	trans	-60.4	-49.7	174.8	173.6	0	0	0	0	111.7	F104 F105 I106 M110 A111 V112 G124	F104-S108 WeakPolarHBondContact O-CB 3.3Å; F104-S108 PolarHBondContact O-N 2.8Å; F105-S108 WeakPolarHBondContact O-CB 3.31Å; F105-S108 PolarHBondContact O-N 2.98Å; I106-S108 VanDerWaalsContact C-N 3.29Å; I106-S108 PolarHBondContact O-N 2.99Å; S108-M110 VanDerWaalsContact C-N 3.33Å; S108-M110 PolarHBondContact O-N 2.97Å; S108-A111 PolarHBondContact O-N 2.71Å; S108-V112 WeakPolarHBondContact O-CG2 3.5Å; S108-V112 PolarHBondContact O-N 3.3Å; S108-G124 WeakPolarHBondContact CB-O 3.33Å; S108-G124 PolarHBondContact OG-O 2.89Å
109	I	87.4	Confident	83.2	Confident	80 Å²	80	58.7 Å²	58.7	41%	0.41	33%	0.332	S	S	.	.	H	α-helix	trans	-60.7	-43.5	177	-67	171.3	0	0	0	110.9	F105 I106 V112 S113	F105-I109 HydrophobicContact CD1-CD1 4.08Å; F105-I109 HydrophobicContact CD2-CD1 4.43Å; F105-I109 HydrophobicContact CE1-CD1 3.6Å; F105-I109 HydrophobicContact CE2-CD1 4Å; F105-I109 HydrophobicContact CG-CD1 4.47Å; F105-I109 HydrophobicContact CZ-CD1 3.56Å; F105-I109 WeakPolarHBondContact O-CG1 3.2Å; F105-I109 PolarHBondContact O-N 3.03Å; I106-I109 PolarHBondContact O-N 3.44Å; I109-V112 PolarHBondContact O-N 3.41Å; I109-S113 WeakPolarHBondContact O-CB 3.48Å; I109-S113 PolarHBondContact O-N 2.92Å; I109-S113 PolarHBondContact O-OG 3.29Å
110	M	84.2	Confident	82.9	Confident	59 Å²	59	55.4 Å²	55.4	29%	0.291	31%	0.312	S	S	.	.	H	α-helix	trans	-65.7	-43.7	177.9	-66.7	-149.8	-45.9	0	0	112.2	F58 I106 I107 S108 V112 S113 K114	F58-M110 HydrophobicContact CD1-CE 4.13Å; F58-M110 HydrophobicContact CD2-CE 4.27Å; F58-M110 HydrophobicContact CE1-CE 3.42Å; F58-M110 VanDerWaalsContact CE1-CE 3.42Å; F58-M110 HydrophobicContact CE2-CE 3.57Å; F58-M110 HydrophobicContact CZ-CE 3.11Å; I106-M110 HydrophobicContact CG2-CG 4.4Å; I106-M110 WeakPolarHBondContact O-CG 3.28Å; I106-M110 PolarHBondContact O-N 2.9Å; I107-M110 PolarHBondContact O-N 3.43Å; S108-M110 VanDerWaalsContact C-N 3.33Å; S108-M110 PolarHBondContact O-N 2.97Å; M110-V112 VanDerWaalsContact C-N 3.28Å; M110-V112 PolarHBondContact O-N 3.46Å; M110-S113 PolarHBondContact O-N 3.12Å; M110-S113 VanDerWaalsContact O-N 3.16Å; M110-K114 WeakPolarHBondContact O-CB 3.35Å; M110-K114 PolarHBondContact O-N 2.79Å
111	A	82.1	Confident	82.9	Confident	1 Å²	1	58.9 Å²	58.9	1%	0.008	33%	0.326	C	S	.	.	H	α-helix	trans	-60.9	-39.6	178.7	0	0	0	0	0	111.5	F50 I107 S108 S120	F50-A111 HydrophobicContact CE1-CB 4.4Å; F50-A111 HydrophobicContact CZ-CB 4.04Å; I107-A111 VanDerWaalsContact O-CB 3.23Å; I107-A111 WeakPolarHBondContact O-CB 3.34Å; I107-A111 PolarHBondContact O-N 3.12Å; S108-A111 PolarHBondContact O-N 2.71Å; A111-S120 WeakPolarHBondContact CB-O 3.49Å
112	V	81.9	Confident	82.6	Confident	59 Å²	59	59.5 Å²	59.5	36%	0.358	33%	0.332	S	S	.	.	H	α-helix	trans	-75	-31.7	174.9	-179.7	0	0	0	0	112.4	S108 I109 M110 K121	S108-V112 WeakPolarHBondContact O-CG2 3.5Å; S108-V112 PolarHBondContact O-N 3.3Å; I109-V112 PolarHBondContact O-N 3.41Å; M110-V112 VanDerWaalsContact C-N 3.28Å; M110-V112 PolarHBondContact O-N 3.46Å; V112-K121 HydrophobicContact CG1-CD 4.37Å; V112-K121 PolarHBondContact O-NZ 3.45Å
113	S	83.3	Confident	82.2	Confident	92 Å²	92	55.1 Å²	55.1	64%	0.643	31%	0.31	S	S	*	.	H	α-helix	trans	-94.3	-36	-172	-54.4	0	0	0	0	114.2	I109 M110	I109-S113 WeakPolarHBondContact O-CB 3.48Å; I109-S113 PolarHBondContact O-N 2.92Å; I109-S113 PolarHBondContact O-OG 3.29Å; M110-S113 PolarHBondContact O-N 3.12Å; M110-S113 VanDerWaalsContact O-N 3.16Å
114	K	79.8	Confident	82.1	Confident	161 Å²	161	52.2 Å²	52.2	70%	0.7	30%	0.295	S	S	*	.	H	α-helix	trans	-95.1	-28.9	-171.4	-93.4	-87.9	176.3	74.5	0	114.2	M110	M110-K114 WeakPolarHBondContact O-CB 3.35Å; M110-K114 PolarHBondContact O-N 2.79Å
115	Y	78.3	Confident	82.3	Confident	54 Å²	54	57.1 Å²	57.1	21%	0.212	32%	0.32	C	S	.	.			trans	-113	126.9	-169.8	-62.2	-86.1	0	0	0	111.3	A55 F58 D117 S120 K121	A55-Y115 HydrophobicContact CB-CD1 4.11Å; A55-Y115 HydrophobicContact CB-CD2 3.94Å; A55-Y115 HydrophobicContact CB-CE1 3.79Å; A55-Y115 HydrophobicContact CB-CE2 3.6Å; A55-Y115 HydrophobicContact CB-CG 4.18Å; F58-Y115 HydrophobicContact CE2-CE2 4.41Å; Y115-D117 VanDerWaalsContact C-N 3.31Å; Y115-S120 VanDerWaalsContact CB-CB 3.42Å; Y115-S120 WeakPolarHBondContact CB-OG 3.24Å; Y115-K121 WeakPolarHBondContact O-CE 3.38Å
116	P	74.4	Confident	82	Confident	113 Å²	113	57.6 Å²	57.6	73%	0.734	32%	0.322	S	S	*	.			trans	-80.7	-12.1	179	32.3	-33.9	0	0	0	113.1
117	D	81.2	Confident	81.7	Confident	68 Å²	68	53.5 Å²	53.5	36%	0.364	30%	0.302	S	S	.	.			trans	-66.7	135.1	-175.3	-47.6	-61.3	0	0	0	111.8	Y115 S119 S120 K121	Y115-D117 VanDerWaalsContact C-N 3.31Å; D117-S119 PolarHBondContact O-N 3.23Å; D117-S120 WeakPolarHBondContact O-CB 3.42Å; D117-S120 PolarHBondContact O-N 2.84Å; D117-K121 PolarHBondContact O-N 3.32Å; D117-K121 VanDerWaalsContact O-N 3.1Å
118	G	77.6	Confident	81.9	Confident	59 Å²	59	57.8 Å²	57.8	61%	0.608	32%	0.32	S	S	*	.	H	α-helix	trans	-57.6	-34.2	178.1	0	0	0	0	0	113	K121 A122	G118-K121 PolarHBondContact O-N 2.99Å; G118-A122 PolarHBondContact O-N 2.97Å
119	S	78.4	Confident	82	Confident	42 Å²	42	61.2 Å²	61.2	29%	0.294	34%	0.338	S	S	.	.	H	α-helix	trans	-62.6	-43.3	173.9	-169.8	0	0	0	0	112	C49 D117 K121 A122 A123	C49-S119 PolarHBondContact SG-O 3.07Å; C49-S119 VanDerWaalsContact SG-O 3.4Å; D117-S119 PolarHBondContact O-N 3.23Å; S119-K121 PolarHBondContact O-N 3.46Å; S119-A122 PolarHBondContact O-N 2.93Å; S119-A123 WeakPolarHBondContact O-CB 3.12Å; S119-A123 PolarHBondContact O-N 3.47Å
120	S	78.6	Confident	81.7	Confident	0 Å²	0	57.4 Å²	57.4	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-66.1	-38.1	176.8	-58.4	0	0	0	0	112.5	S53 A111 Y115 D117 A123 G124	S53-S120 PolarHBondContact OG-OG 3.27Å; A111-S120 WeakPolarHBondContact CB-O 3.49Å; Y115-S120 VanDerWaalsContact CB-CB 3.42Å; Y115-S120 WeakPolarHBondContact CB-OG 3.24Å; D117-S120 WeakPolarHBondContact O-CB 3.42Å; D117-S120 PolarHBondContact O-N 2.84Å; S120-A123 PolarHBondContact O-N 2.61Å; S120-G124 PolarHBondContact O-N 3.43Å
121	K	83.1	Confident	81.8	Confident	82 Å²	82	55.5 Å²	55.5	36%	0.357	31%	0.309	S	S	.	.	H	α-helix	trans	-64.1	-44.2	175.1	-60.8	-64.1	-173.1	168.3	0	111.3	V112 Y115 D117 G118 S119 G124 I125	V112-K121 HydrophobicContact CG1-CD 4.37Å; V112-K121 PolarHBondContact O-NZ 3.45Å; Y115-K121 WeakPolarHBondContact O-CE 3.38Å; D117-K121 PolarHBondContact O-N 3.32Å; D117-K121 VanDerWaalsContact O-N 3.1Å; G118-K121 PolarHBondContact O-N 2.99Å; S119-K121 PolarHBondContact O-N 3.46Å; K121-G124 PolarHBondContact O-N 3.11Å; K121-I125 WeakPolarHBondContact O-CG1 3.23Å; K121-I125 PolarHBondContact O-N 3.45Å
122	A	82.8	Confident	82.1	Confident	34 Å²	34	59.6 Å²	59.6	28%	0.281	33%	0.33	S	S	.	.	H	α-helix	trans	-62	-47.2	175.2	0	0	0	0	0	111.2	G118 S119 G124 I125 F126	G118-A122 PolarHBondContact O-N 2.97Å; S119-A122 PolarHBondContact O-N 2.93Å; A122-G124 PolarHBondContact O-N 3.31Å; A122-I125 PolarHBondContact O-N 3.5Å; A122-I125 VanDerWaalsContact O-N 3.11Å; A122-F126 HydrophobicContact CB-CE2 4.49Å; A122-F126 WeakPolarHBondContact O-CD2 3.32Å; A122-F126 PolarHBondContact O-N 2.79Å
123	A	79	Confident	82.1	Confident	0 Å²	0	58.2 Å²	58.2	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-54.3	-41.1	173.9	0	0	0	0	0	111.6	C49 F50 S119 S120 G127	C49-A123 HydrophobicContact CB-CB 3.81Å; C49-A123 VanDerWaalsContact SG-CA 3.56Å; C49-A123 VanDerWaalsContact SG-CB 3.5Å; C49-A123 PolarHBondContact SG-N 2.96Å; F50-A123 HydrophobicContact CE2-CB 4.16Å; F50-A123 HydrophobicContact CZ-CB 4.23Å; S119-A123 WeakPolarHBondContact O-CB 3.12Å; S119-A123 PolarHBondContact O-N 3.47Å; S120-A123 PolarHBondContact O-N 2.61Å; A123-G127 PolarHBondContact O-N 2.89Å
124	G	83	Confident	82.1	Confident	0 Å²	0	54 Å²	54	0%	0	29%	0.292	C	S	.	.	H	α-helix	trans	-60.2	-49.4	175.3	0	0	0	0	0	113	S108 S120 K121 A122 G127 F128	S108-G124 WeakPolarHBondContact CB-O 3.33Å; S108-G124 PolarHBondContact OG-O 2.89Å; S120-G124 PolarHBondContact O-N 3.43Å; K121-G124 PolarHBondContact O-N 3.11Å; A122-G124 PolarHBondContact O-N 3.31Å; G124-G127 PolarHBondContact O-N 3.28Å; G124-F128 PolarHBondContact O-N 2.94Å
125	I	86.8	Confident	82.4	Confident	105 Å²	105	48.5 Å²	48.5	54%	0.538	28%	0.277	S	S	.	.	H	α-helix	trans	-62.7	-45.9	179	-62.6	162.9	0	0	0	110.7	K121 A122 G127 F128 I129	K121-I125 WeakPolarHBondContact O-CG1 3.23Å; K121-I125 PolarHBondContact O-N 3.45Å; A122-I125 PolarHBondContact O-N 3.5Å; A122-I125 VanDerWaalsContact O-N 3.11Å; I125-G127 VanDerWaalsContact C-N 3.33Å; I125-G127 PolarHBondContact O-N 3.37Å; I125-F128 WeakPolarHBondContact O-CB 3.39Å; I125-F128 PolarHBondContact O-N 3.45Å; I125-F128 VanDerWaalsContact O-N 3.16Å; I125-I129 HydrophobicContact CG2-CD1 4.21Å; I125-I129 WeakPolarHBondContact O-CG1 3.4Å; I125-I129 PolarHBondContact O-N 2.99Å
126	F	83.2	Confident	82.7	Confident	95 Å²	95	50.7 Å²	50.7	42%	0.417	29%	0.292	S	S	.	.	H	α-helix	trans	-63.4	-38.9	176.4	-74.2	-65.9	0	0	0	112.3	I45 A122 F128 I129 A130	I45-F126 HydrophobicContact CG2-CD1 4.35Å; I45-F126 HydrophobicContact CG2-CD2 4.46Å; I45-F126 HydrophobicContact CG2-CG 4.21Å; A122-F126 HydrophobicContact CB-CE2 4.49Å; A122-F126 WeakPolarHBondContact O-CD2 3.32Å; A122-F126 PolarHBondContact O-N 2.79Å; F126-F128 VanDerWaalsContact C-N 3.31Å; F126-F128 PolarHBondContact O-N 3.45Å; F126-I129 PolarHBondContact O-N 3.37Å; F126-A130 PolarHBondContact O-N 3.43Å
127	G	82.5	Confident	83.1	Confident	3 Å²	3	45.6 Å²	45.6	3%	0.031	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-35.6	173.2	0	0	0	0	0	112.8	A123 G124 I125 A130 T131	A123-G127 PolarHBondContact O-N 2.89Å; G124-G127 PolarHBondContact O-N 3.28Å; I125-G127 VanDerWaalsContact C-N 3.33Å; I125-G127 PolarHBondContact O-N 3.37Å; G127-A130 WeakPolarHBondContact O-CB 3.48Å; G127-A130 PolarHBondContact O-N 2.8Å; G127-T131 PolarHBondContact O-N 2.81Å; G127-T131 PolarHBondContact O-OG1 3.45Å
128	F	86.3	Confident	83.2	Confident	101 Å²	101	45.8 Å²	45.8	44%	0.443	26%	0.256	S	S	.	.	H	α-helix	trans	-69.5	-42.2	175.6	-167	-97.6	0	0	0	111.9	F105 G124 I125 F126 A130 T131 I132	F105-F128 HydrophobicContact CD2-CD2 4.35Å; F105-F128 HydrophobicContact CD2-CE2 4.26Å; F105-F128 HydrophobicContact CE2-CD2 4.42Å; F105-F128 AromaticContact CE2-CE2 3.94Å; F105-F128 HydrophobicContact CE2-CE2 3.94Å; G124-F128 PolarHBondContact O-N 2.94Å; I125-F128 WeakPolarHBondContact O-CB 3.39Å; I125-F128 PolarHBondContact O-N 3.45Å; I125-F128 VanDerWaalsContact O-N 3.16Å; F126-F128 VanDerWaalsContact C-N 3.31Å; F126-F128 PolarHBondContact O-N 3.45Å; F128-A130 PolarHBondContact O-N 2.87Å; F128-T131 WeakPolarHBondContact O-CB 3.36Å; F128-T131 PolarHBondContact O-N 3.45Å; F128-I132 HydrophobicContact CD1-CD1 4.07Å; F128-I132 HydrophobicContact CE1-CD1 3.91Å; F128-I132 HydrophobicContact CE1-CG1 4.47Å; F128-I132 PolarHBondContact O-N 3.36Å
129	I	87.3	Confident	83.5	Confident	78 Å²	78	49.9 Å²	49.9	40%	0.4	25%	0.254	S	S	.	.	H	α-helix	trans	-59.9	-41	172.3	-63.5	167.6	0	0	0	109.5	L42 I125 F126 T131 I132 V133	L42-I129 HydrophobicContact CD2-CG2 4.18Å; I125-I129 HydrophobicContact CG2-CD1 4.21Å; I125-I129 WeakPolarHBondContact O-CG1 3.4Å; I125-I129 PolarHBondContact O-N 2.99Å; F126-I129 PolarHBondContact O-N 3.37Å; I129-T131 PolarHBondContact O-N 3.16Å; I129-I132 PolarHBondContact O-N 2.92Å; I129-I132 VanDerWaalsContact O-N 3.16Å; I129-V133 WeakPolarHBondContact O-CG2 3.33Å; I129-V133 PolarHBondContact O-N 3.04Å
130	A	81.6	Confident	83.7	Confident	0 Å²	0	50.6 Å²	50.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-58.3	-46.4	174.7	0	0	0	0	0	112.1	L42 F104 F126 G127 F128 I132 V133 F134	L42-A130 HydrophobicContact CB-CB 4.2Å; L42-A130 HydrophobicContact CD2-CB 3.57Å; L42-A130 HydrophobicContact CG-CB 4.49Å; F104-A130 HydrophobicContact CD1-CB 4.4Å; F104-A130 HydrophobicContact CG-CB 4.4Å; F126-A130 PolarHBondContact O-N 3.43Å; G127-A130 WeakPolarHBondContact O-CB 3.48Å; G127-A130 PolarHBondContact O-N 2.8Å; F128-A130 PolarHBondContact O-N 2.87Å; A130-I132 VanDerWaalsContact C-N 3.26Å; A130-I132 PolarHBondContact O-N 3.37Å; A130-V133 PolarHBondContact O-N 2.87Å; A130-V133 VanDerWaalsContact O-N 3.15Å; A130-F134 HydrophobicContact CB-CD2 4.26Å; A130-F134 HydrophobicContact CB-CE2 4.32Å; A130-F134 WeakPolarHBondContact O-CB 3.41Å; A130-F134 WeakPolarHBondContact O-CD2 3.47Å; A130-F134 PolarHBondContact O-N 3.24Å
131	T	86.9	Confident	84	Confident	18 Å²	18	51.3 Å²	51.3	11%	0.11	26%	0.26	C	S	.	.	H	α-helix	trans	-54.4	-42	175.5	-60	0	0	0	0	112.3	S101 F105 G127 F128 I129 A135	S101-T131 PolarHBondContact O-OG1 2.8Å; S101-T131 PolarHBondContact OG-O 2.84Å; F105-T131 WeakPolarHBondContact CA-OG1 3.19Å; F105-T131 HydrophobicContact CB-CG2 3.87Å; F105-T131 HydrophobicContact CD2-CG2 4.1Å; F105-T131 HydrophobicContact CG-CG2 4.34Å; F105-T131 PolarHBondContact N-OG1 3.41Å; G127-T131 PolarHBondContact O-N 2.81Å; G127-T131 PolarHBondContact O-OG1 3.45Å; F128-T131 WeakPolarHBondContact O-CB 3.36Å; F128-T131 PolarHBondContact O-N 3.45Å; I129-T131 PolarHBondContact O-N 3.16Å; T131-A135 WeakPolarHBondContact O-CB 3.38Å; T131-A135 PolarHBondContact O-N 3.29Å
132	I	87.3	Confident	84	Confident	88 Å²	88	52.5 Å²	52.5	45%	0.451	27%	0.266	S	S	.	.	H	α-helix	trans	-65.5	-46.5	178.1	-62.6	169.9	0	0	0	110.8	F128 I129 A130 F134 A135 L136	F128-I132 HydrophobicContact CD1-CD1 4.07Å; F128-I132 HydrophobicContact CE1-CD1 3.91Å; F128-I132 HydrophobicContact CE1-CG1 4.47Å; F128-I132 PolarHBondContact O-N 3.36Å; I129-I132 PolarHBondContact O-N 2.92Å; I129-I132 VanDerWaalsContact O-N 3.16Å; A130-I132 VanDerWaalsContact C-N 3.26Å; A130-I132 PolarHBondContact O-N 3.37Å; I132-F134 PolarHBondContact O-N 3.4Å; I132-A135 WeakPolarHBondContact O-CB 3.33Å; I132-A135 PolarHBondContact O-N 2.91Å; I132-A135 VanDerWaalsContact O-N 3.14Å; I132-L136 WeakPolarHBondContact O-CG 3.17Å; I132-L136 PolarHBondContact O-N 3.41Å
133	V	83.4	Confident	84.1	Confident	30 Å²	30	55.8 Å²	55.8	18%	0.182	28%	0.278	C	S	.	.	H	α-helix	trans	-59.9	-47.5	177.5	176	0	0	0	0	110.4	A38 L42 I129 A130 A135 L136 D137	A38-V133 HydrophobicContact CB-CG1 4.4Å; L42-V133 HydrophobicContact CD2-CB 4.46Å; L42-V133 HydrophobicContact CD2-CG2 4.11Å; I129-V133 WeakPolarHBondContact O-CG2 3.33Å; I129-V133 PolarHBondContact O-N 3.04Å; A130-V133 PolarHBondContact O-N 2.87Å; A130-V133 VanDerWaalsContact O-N 3.15Å; V133-A135 VanDerWaalsContact C-N 3.28Å; V133-A135 PolarHBondContact O-N 3.35Å; V133-L136 WeakPolarHBondContact O-CB 3.45Å; V133-L136 PolarHBondContact O-N 2.88Å; V133-D137 PolarHBondContact O-N 2.87Å
134	F	82.5	Confident	84.3	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.009	29%	0.291	C	S	.	.	H	α-helix	trans	-59	-36.2	174.3	-82.6	-66	0	0	0	113.2	E39 C97 S100 F104 A130 I132 L136 D137 F138	E39-F134 HydrophobicContact CG-CD1 4.05Å; E39-F134 HydrophobicContact CG-CE1 3.18Å; E39-F134 HydrophobicContact CG-CE2 4.19Å; E39-F134 HydrophobicContact CG-CZ 3.21Å; E39-F134 WeakPolarHBondContact OE1-CE1 3.26Å; E39-F134 VanDerWaalsContact OE1-CZ 3.31Å; E39-F134 WeakPolarHBondContact OE1-CZ 3.35Å; C97-F134 PolarHBondContact SG-O 3.33Å; S100-F134 WeakPolarHBondContact OG-CE1 3.36Å; S100-F134 WeakPolarHBondContact OG-CE2 3.29Å; S100-F134 WeakPolarHBondContact OG-CZ 3.32Å; F104-F134 HydrophobicContact CD2-CD2 4.12Å; F104-F134 AromaticContact CD2-CE2 3.52Å; F104-F134 HydrophobicContact CD2-CE2 3.52Å; F104-F134 HydrophobicContact CD2-CZ 4.27Å; F104-F134 AromaticContact CE2-CE2 3.68Å; F104-F134 HydrophobicContact CE2-CE2 3.68Å; F104-F134 HydrophobicContact CE2-CZ 4.11Å; F104-F134 HydrophobicContact CG-CE2 4.4Å; A130-F134 HydrophobicContact CB-CD2 4.26Å; A130-F134 HydrophobicContact CB-CE2 4.32Å; A130-F134 WeakPolarHBondContact O-CB 3.41Å; A130-F134 WeakPolarHBondContact O-CD2 3.47Å; A130-F134 PolarHBondContact O-N 3.24Å; I132-F134 PolarHBondContact O-N 3.4Å; F134-L136 VanDerWaalsContact C-N 3.34Å; F134-D137 PolarHBondContact O-N 3.26Å; F134-F138 WeakPolarHBondContact O-CB 3.36Å; F134-F138 PolarHBondContact O-N 2.88Å
135	A	85.8	Confident	84.2	Confident	46 Å²	46	59 Å²	59	38%	0.38	29%	0.294	S	S	.	.	H	α-helix	trans	-68.1	-35	176.1	0	0	0	0	0	112.1	T131 I132 V133 Y139	T131-A135 WeakPolarHBondContact O-CB 3.38Å; T131-A135 PolarHBondContact O-N 3.29Å; I132-A135 WeakPolarHBondContact O-CB 3.33Å; I132-A135 PolarHBondContact O-N 2.91Å; I132-A135 VanDerWaalsContact O-N 3.14Å; V133-A135 VanDerWaalsContact C-N 3.28Å; V133-A135 PolarHBondContact O-N 3.35Å; A135-Y139 PolarHBondContact O-N 3.17Å; A135-Y139 VanDerWaalsContact O-N 3.08Å
136	L	85	Confident	84.1	Confident	101 Å²	101	55.9 Å²	55.9	53%	0.529	28%	0.284	S	S	.	.	H	α-helix	trans	-69.1	-41.2	172.8	-64.7	174.4	0	0	0	111.4	I132 V133 F134 Y139 V140	I132-L136 WeakPolarHBondContact O-CG 3.17Å; I132-L136 PolarHBondContact O-N 3.41Å; V133-L136 WeakPolarHBondContact O-CB 3.45Å; V133-L136 PolarHBondContact O-N 2.88Å; F134-L136 VanDerWaalsContact C-N 3.34Å; L136-Y139 WeakPolarHBondContact O-CB 3.35Å; L136-Y139 PolarHBondContact O-N 2.87Å; L136-Y139 VanDerWaalsContact O-N 3.14Å; L136-V140 WeakPolarHBondContact O-CG2 3.35Å; L136-V140 PolarHBondContact O-N 3.43Å
137	D	81.8	Confident	84.1	Confident	6 Å²	6	53 Å²	53	3%	0.032	28%	0.281	C	S	.	.	H	α-helix	trans	-59.1	-48.4	175.4	-69.7	-13.9	0	0	0	111.2	L35 C97 V133 F134 Y139 V140 I141	L35-D137 WeakPolarHBondContact CB-OD1 3.42Å; L35-D137 WeakPolarHBondContact CD1-OD1 3.45Å; L35-D137 WeakPolarHBondContact CD2-OD1 3.42Å; L35-D137 WeakPolarHBondContact CG-OD1 3.45Å; C97-D137 WeakPolarHBondContact SG-CB 3.41Å; V133-D137 PolarHBondContact O-N 2.87Å; F134-D137 PolarHBondContact O-N 3.26Å; D137-Y139 VanDerWaalsContact C-N 3.31Å; D137-Y139 PolarHBondContact O-N 3.3Å; D137-V140 PolarHBondContact O-N 2.99Å; D137-I141 VanDerWaalsContact O-CG1 3.28Å; D137-I141 WeakPolarHBondContact O-CG1 3.26Å; D137-I141 PolarHBondContact O-N 3.2Å
138	F	83.5	Confident	84	Confident	71 Å²	71	57.1 Å²	57.1	31%	0.311	30%	0.298	S	S	.	.	H	α-helix	trans	-53.4	-46.3	171.8	159.7	-95	0	0	0	112.1	F94 V98 F134 V140 I141 F142	F94-F138 AromaticContact CD2-CD2 3.66Å; F94-F138 HydrophobicContact CD2-CD2 3.66Å; F94-F138 AromaticContact CD2-CE2 3.95Å; F94-F138 HydrophobicContact CD2-CE2 3.95Å; F94-F138 HydrophobicContact CE1-CE2 4.36Å; F94-F138 AromaticContact CE2-CD2 3.17Å; F94-F138 HydrophobicContact CE2-CD2 3.17Å; F94-F138 AromaticContact CE2-CE2 2.98Å; F94-F138 HydrophobicContact CE2-CE2 2.98Å; F94-F138 HydrophobicContact CE2-CG 4.36Å; F94-F138 AromaticContact CE2-CZ 3.99Å; F94-F138 HydrophobicContact CE2-CZ 3.99Å; F94-F138 AromaticContact CZ-CD2 3.82Å; F94-F138 HydrophobicContact CZ-CD2 3.82Å; F94-F138 AromaticContact CZ-CE2 3.25Å; F94-F138 HydrophobicContact CZ-CE2 3.25Å; F94-F138 HydrophobicContact CZ-CZ 4.24Å; V98-F138 HydrophobicContact CG2-CD2 3.28Å; V98-F138 HydrophobicContact CG2-CE2 3.63Å; V98-F138 HydrophobicContact CG2-CG 4.26Å; F134-F138 WeakPolarHBondContact O-CB 3.36Å; F134-F138 PolarHBondContact O-N 2.88Å; F138-V140 PolarHBondContact O-N 3.48Å; F138-I141 PolarHBondContact O-N 3.37Å; F138-F142 WeakPolarHBondContact O-CB 3.3Å; F138-F142 PolarHBondContact O-N 2.8Å
139	Y	85.5	Confident	83.7	Confident	145 Å²	145	57.2 Å²	57.2	57%	0.569	30%	0.303	S	S	*	.	H	α-helix	trans	-62.9	-42.3	-179.3	176.5	-99.4	0	0	0	111.9	A135 L136 D137 F142 N143	A135-Y139 PolarHBondContact O-N 3.17Å; A135-Y139 VanDerWaalsContact O-N 3.08Å; L136-Y139 WeakPolarHBondContact O-CB 3.35Å; L136-Y139 PolarHBondContact O-N 2.87Å; L136-Y139 VanDerWaalsContact O-N 3.14Å; D137-Y139 VanDerWaalsContact C-N 3.31Å; D137-Y139 PolarHBondContact O-N 3.3Å; Y139-F142 PolarHBondContact O-N 3.5Å; Y139-N143 WeakPolarHBondContact O-CB 3.41Å; Y139-N143 PolarHBondContact O-N 3.36Å
140	V	82.8	Confident	83.4	Confident	57 Å²	57	61 Å²	61	35%	0.345	32%	0.316	S	S	.	.	H	α-helix	trans	-65.4	-47.3	177.9	174	0	0	0	0	110.9	L35 L136 D137 F138 F142 N143 E144	L35-V140 HydrophobicContact CD1-CB 4.43Å; L35-V140 HydrophobicContact CD1-CG1 4.47Å; L35-V140 HydrophobicContact CD1-CG2 4.32Å; L136-V140 WeakPolarHBondContact O-CG2 3.35Å; L136-V140 PolarHBondContact O-N 3.43Å; D137-V140 PolarHBondContact O-N 2.99Å; F138-V140 PolarHBondContact O-N 3.48Å; V140-F142 VanDerWaalsContact C-N 3.32Å; V140-F142 PolarHBondContact O-N 3.4Å; V140-N143 PolarHBondContact O-N 3.32Å; V140-E144 PolarHBondContact O-N 3.36Å; V140-E144 VanDerWaalsContact O-N 3.15Å
141	I	83.1	Confident	83	Confident	16 Å²	16	67.4 Å²	67.4	8%	0.082	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-40.4	178.4	-64.2	163.5	0	0	0	110.6	D93 F94 C97 D137 F138 E144 L145	D93-I141 HydrophobicContact CB-CD1 4.38Å; D93-I141 WeakPolarHBondContact OD2-CD1 3.32Å; F94-I141 HydrophobicContact CB-CG2 3.79Å; F94-I141 HydrophobicContact CD2-CG2 4.23Å; C97-I141 HydrophobicContact CB-CD1 4.42Å; D137-I141 VanDerWaalsContact O-CG1 3.28Å; D137-I141 WeakPolarHBondContact O-CG1 3.26Å; D137-I141 PolarHBondContact O-N 3.2Å; F138-I141 PolarHBondContact O-N 3.37Å; I141-E144 PolarHBondContact O-N 2.97Å; I141-L145 WeakPolarHBondContact O-CB 3.45Å; I141-L145 PolarHBondContact O-N 3.3Å
142	F	84.6	Confident	81.9	Confident	106 Å²	106	68.8 Å²	68.8	47%	0.465	36%	0.364	S	S	.	.	H	α-helix	trans	-62.3	-43.8	177.1	-179.8	-97.7	0	0	0	111.9	F94 F138 Y139 V140 E144 L145 A146	F94-F142 HydrophobicContact CE2-CB 4.21Å; F94-F142 HydrophobicContact CE2-CD2 4.09Å; F138-F142 WeakPolarHBondContact O-CB 3.3Å; F138-F142 PolarHBondContact O-N 2.8Å; Y139-F142 PolarHBondContact O-N 3.5Å; V140-F142 VanDerWaalsContact C-N 3.32Å; V140-F142 PolarHBondContact O-N 3.4Å; F142-E144 VanDerWaalsContact C-N 3.28Å; F142-E144 PolarHBondContact O-N 3.46Å; F142-L145 PolarHBondContact O-N 3.1Å; F142-A146 VanDerWaalsContact O-CB 3.3Å; F142-A146 WeakPolarHBondContact O-CB 3.42Å; F142-A146 PolarHBondContact O-N 2.98Å
143	N	84.8	Confident	80.4	Confident	103 Å²	103	66.8 Å²	66.8	55%	0.551	37%	0.365	S	S	*	.	H	α-helix	trans	-63.9	-37.1	179.1	-167	38.1	0	0	0	111.8	Y139 V140 G147	Y139-N143 WeakPolarHBondContact O-CB 3.41Å; Y139-N143 PolarHBondContact O-N 3.36Å; V140-N143 PolarHBondContact O-N 3.32Å; N143-G147 PolarHBondContact O-N 3.2Å; N143-G147 VanDerWaalsContact O-N 3.08Å
144	E	82	Confident	79	Confident	55 Å²	55	71.9 Å²	71.9	26%	0.257	39%	0.387	S	S	.	.	H	α-helix	trans	-67.8	-44.9	173.4	-177.7	179	179.3	0	0	112.2	K32 V140 I141 F142 A146 G147 F148	K32-E144 WeakPolarHBondContact CE-OE2 3.36Å; K32-E144 IonicContact NZ-OE1 2.8Å; K32-E144 PolarHBondContact NZ-OE1 2.66Å; K32-E144 IonicContact NZ-OE2 3.59Å; K32-E144 PolarHBondContact NZ-OE2 3.06Å; V140-E144 PolarHBondContact O-N 3.36Å; V140-E144 VanDerWaalsContact O-N 3.15Å; I141-E144 PolarHBondContact O-N 2.97Å; F142-E144 VanDerWaalsContact C-N 3.28Å; F142-E144 PolarHBondContact O-N 3.46Å; E144-A146 VanDerWaalsContact C-N 3.33Å; E144-A146 PolarHBondContact O-N 2.82Å; E144-G147 PolarHBondContact O-N 3.2Å; E144-G147 VanDerWaalsContact O-N 3.14Å; E144-F148 HydrophobicContact CG-CD2 3.92Å; E144-F148 HydrophobicContact CG-CE2 3.45Å; E144-F148 VanDerWaalsContact CG-CE2 3.45Å; E144-F148 HydrophobicContact CG-CZ 4.34Å; E144-F148 WeakPolarHBondContact O-CD2 2.93Å; E144-F148 PolarHBondContact O-N 3.24Å
145	L	81.9	Confident	77.4	Confident	14 Å²	14	76.6 Å²	76.6	7%	0.073	42%	0.42	C	S	.	.	H	α-helix	trans	-61.5	-41.6	176.4	-172.7	66.3	0	0	0	111.7	F87 L91 I141 F142 G147 F148 L149	F87-L145 HydrophobicContact CD2-CD1 4.06Å; F87-L145 HydrophobicContact CE2-CD1 3.46Å; F87-L145 VanDerWaalsContact CE2-CD1 3.46Å; F87-L145 HydrophobicContact CZ-CD1 3.91Å; L91-L145 HydrophobicContact CD1-CD2 4.44Å; I141-L145 WeakPolarHBondContact O-CB 3.45Å; I141-L145 PolarHBondContact O-N 3.3Å; F142-L145 PolarHBondContact O-N 3.1Å; L145-G147 VanDerWaalsContact C-N 3.3Å; L145-G147 PolarHBondContact O-N 3.22Å; L145-F148 PolarHBondContact O-N 2.9Å; L145-L149 HydrophobicContact CG-CD1 4.32Å; L145-L149 WeakPolarHBondContact O-CB 3.38Å; L145-L149 VanDerWaalsContact O-CG 3.31Å; L145-L149 WeakPolarHBondContact O-CG 3.37Å; L145-L149 PolarHBondContact O-N 3.35Å
146	A	85.3	Confident	75.6	Confident	39 Å²	39	81.5 Å²	81.5	32%	0.322	44%	0.44	S	S	.	.	H	α-helix	trans	-61.9	-39	174.7	0	0	0	0	0	111.7	F142 E144 L149 K150	F142-A146 VanDerWaalsContact O-CB 3.3Å; F142-A146 WeakPolarHBondContact O-CB 3.42Å; F142-A146 PolarHBondContact O-N 2.98Å; E144-A146 VanDerWaalsContact C-N 3.33Å; E144-A146 PolarHBondContact O-N 2.82Å; A146-L149 PolarHBondContact O-N 3.26Å; A146-K150 WeakPolarHBondContact O-CB 3.11Å; A146-K150 PolarHBondContact O-N 3.04Å
147	G	81.9	Confident	73.8	Confident	35 Å²	35	84.5 Å²	84.5	36%	0.361	45%	0.452	S	S	.	.	H	α-helix	trans	-60.7	-45.1	172.2	0	0	0	0	0	112.8	N143 E144 L145 K150 Q151	N143-G147 PolarHBondContact O-N 3.2Å; N143-G147 VanDerWaalsContact O-N 3.08Å; E144-G147 PolarHBondContact O-N 3.2Å; E144-G147 VanDerWaalsContact O-N 3.14Å; L145-G147 VanDerWaalsContact C-N 3.3Å; L145-G147 PolarHBondContact O-N 3.22Å; G147-K150 PolarHBondContact O-N 2.99Å; G147-Q151 PolarHBondContact O-N 3.33Å; G147-Q151 VanDerWaalsContact O-N 3.14Å
148	F	80.2	Confident	72	Confident	89 Å²	89	93 Å²	93	39%	0.39	49%	0.491	S	S	.	.	H	α-helix	trans	-65.9	-41.7	176.3	-73.5	-58.6	0	0	0	113.2	E144 L145 K150 Q151 G152	E144-F148 HydrophobicContact CG-CD2 3.92Å; E144-F148 HydrophobicContact CG-CE2 3.45Å; E144-F148 VanDerWaalsContact CG-CE2 3.45Å; E144-F148 HydrophobicContact CG-CZ 4.34Å; E144-F148 WeakPolarHBondContact O-CD2 2.93Å; E144-F148 PolarHBondContact O-N 3.24Å; L145-F148 PolarHBondContact O-N 2.9Å; F148-K150 VanDerWaalsContact C-N 3.26Å; F148-K150 PolarHBondContact O-N 2.93Å; F148-Q151 PolarHBondContact O-N 3.45Å; F148-G152 PolarHBondContact O-N 3.08Å
149	L	80.1	Confident	70.1	Confident	102 Å²	102	95.6 Å²	95.6	53%	0.534	52%	0.515	S	S	.	.	H	α-helix	trans	-62.3	-36.7	176.4	-73.1	172.5	0	0	0	111.5	F87 L145 A146 G153	F87-L149 HydrophobicContact CE2-CD2 3.9Å; F87-L149 HydrophobicContact CE2-CG 4.35Å; F87-L149 HydrophobicContact CZ-CD2 3.91Å; L145-L149 HydrophobicContact CG-CD1 4.32Å; L145-L149 WeakPolarHBondContact O-CB 3.38Å; L145-L149 VanDerWaalsContact O-CG 3.31Å; L145-L149 WeakPolarHBondContact O-CG 3.37Å; L145-L149 PolarHBondContact O-N 3.35Å; A146-L149 PolarHBondContact O-N 3.26Å; L149-G153 PolarHBondContact O-N 3.45Å
150	K	81.5	Confident	68.2	Low	158 Å²	158	93.9 Å²	93.9	69%	0.687	53%	0.531	S	S	*	.	H	α-helix	trans	-66.3	-46	176.6	-166.2	174	179.1	-176.9	0	112	A146 G147 F148 G153	A146-K150 WeakPolarHBondContact O-CB 3.11Å; A146-K150 PolarHBondContact O-N 3.04Å; G147-K150 PolarHBondContact O-N 2.99Å; F148-K150 VanDerWaalsContact C-N 3.26Å; F148-K150 PolarHBondContact O-N 2.93Å; K150-G153 PolarHBondContact O-N 3.13Å
151	Q	72.6	Confident	66.9	Low	134 Å²	134	94.1 Å²	94.1	63%	0.626	55%	0.545	S	S	*	.	H	α-helix	trans	-68.8	-34.7	176.8	-82.4	178.8	-5.8	0	0	113.6	G147 F148 G153 E154	G147-Q151 PolarHBondContact O-N 3.33Å; G147-Q151 VanDerWaalsContact O-N 3.14Å; F148-Q151 PolarHBondContact O-N 3.45Å; Q151-G153 PolarHBondContact O-N 3.12Å; Q151-E154 PolarHBondContact O-N 3.19Å
152	G	63.4	Low	65	Low	48 Å²	48	100.5 Å²	100.5	50%	0.495	57%	0.574	S	S	.	*	H	α-helix	trans	-71.6	-16.2	177.8	0	0	0	0	0	114.3	F148	F148-G152 PolarHBondContact O-N 3.08Å
153	G	56.4	Low	63	Low	45 Å²	45	104.1 Å²	104.1	46%	0.464	59%	0.585	S	S	.	*	H	α-helix	trans	-79.8	-27	172.7	0	0	0	0	0	113.6	L149 K150 Q151	L149-G153 PolarHBondContact O-N 3.45Å; K150-G153 PolarHBondContact O-N 3.13Å; Q151-G153 PolarHBondContact O-N 3.12Å
154	E	54.5	Low	61.3	Low	137 Å²	137	106.6 Å²	106.6	64%	0.64	60%	0.598	S	S	*	*	H	α-helix	trans	-84.2	-16.8	-175.5	-65.7	175.5	113.2	0	0	113.1	Q151 N156	Q151-E154 PolarHBondContact O-N 3.19Å; E154-N156 VanDerWaalsContact C-N 3.33Å; E154-N156 PolarHBondContact O-N 3.31Å
155	S	47.9	Very low	59.5	Low	102 Å²	102	110.2 Å²	110.2	71%	0.713	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.8	9	-178.8	61.1	0	0	0	0	114.9
156	N	48.4	Very low	58.1	Low	149 Å²	149	118.7 Å²	118.7	80%	0.797	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.1	13.5	178.7	-154.4	40.7	0	0	0	114.3	E154	E154-N156 VanDerWaalsContact C-N 3.33Å; E154-N156 PolarHBondContact O-N 3.31Å
157	E	47.8	Very low	56.5	Low	164 Å²	164	122.2 Å²	122.2	77%	0.766	68%	0.678	S	S	*	*			trans	-104.4	68	168.2	-72.7	177.4	94.5	0	0	109.2	P159	E157-P159 WeakPolarHBondContact O-CD 3.24Å
158	E	43.7	Very low	55.7	Low	183 Å²	183	127.2 Å²	127.2	86%	0.855	70%	0.697	S	S	*	*			trans	-67.5	122.9	149.5	-92.3	-176.5	77.7	0	0	107.1	A160	E158-A160 PolarHBondContact O-N 3.11Å
159	P	43.4	Very low	54.6	Low	126 Å²	126	128.6 Å²	128.6	82%	0.818	72%	0.717	S	S	*	*			trans	-77.3	79.9	176.9	31.6	-31.2	0	0	0	108.9	E157 G161	E157-P159 WeakPolarHBondContact O-CD 3.24Å; P159-G161 PolarHBondContact O-N 2.96Å
160	A	46.3	Very low	53.8	Low	110 Å²	110	131 Å²	131	91%	0.909	73%	0.731	S	S	*	*			trans	-75.3	69.8	163.4	0	0	0	0	0	108.6	E158	E158-A160 PolarHBondContact O-N 3.11Å
161	G	54.6	Low	52.6	Low	61 Å²	61	129 Å²	129	63%	0.629	74%	0.736	S	S	*	*			trans	-163.1	61.4	-173.9	0	0	0	0	0	112	P159	P159-G161 PolarHBondContact O-N 2.96Å
162	Q	43.1	Very low	51.5	Low	151 Å²	151	134.3 Å²	134.3	71%	0.706	77%	0.769	S	S	*	*			trans	-152.8	106.2	152.3	-144.1	156.8	-78.5	0	0	114.8
163	R	43.3	Very low	50.9	Low	182 Å²	182	138.7 Å²	138.7	69%	0.687	78%	0.783	S	S	*	*			trans	78.7	93.6	144.3	-69.2	172.8	-146.8	167.5	6	118.1	D165	R163-D165 PolarHBondContact O-N 2.93Å
164	D	48.5	Very low	50.6	Low	154 Å²	154	143.6 Å²	143.6	82%	0.824	80%	0.8	S	S	*	*				-45.6	107.5	127.2	-44.2	-60.7	0	0	0	109.3
165	D	45.7	Very low	50.4	Low	132 Å²	132	143.9 Å²	143.9	71%	0.706	81%	0.809	S	S	*	*			trans	-124.8	91.8	154	-88.9	-50.5	0	0	0	106	R163 S167	R163-D165 PolarHBondContact O-N 2.93Å; D165-S167 PolarHBondContact O-N 3.01Å
166	F	52.2	Low	50.6	Low	191 Å²	191	146.4 Å²	146.4	84%	0.838	81%	0.814	S	S	*	*			trans	-55.6	115.8	154.8	-93.2	-99.1	0	0	0	107.3
167	S	51.1	Low	50.7	Low	114 Å²	114	146.3 Å²	146.3	80%	0.797	82%	0.815	S	S	*	*			trans	-139.7	98.3	155.5	-156.7	0	0	0	0	108.2	D165	D165-S167 PolarHBondContact O-N 3.01Å
168	D	64.3	Low	50.9	Low	140 Å²	140	145.1 Å²	145.1	75%	0.749	82%	0.819	S	S	*	*			trans	-46.7	133.7	163.4	-60.8	-53.3	0	0	0	110.1
169	S	57.2	Low	51.4	Low	118 Å²	118	142.4 Å²	142.4	83%	0.825	82%	0.816	S	S	*	*			trans	-161	94.7	152	-133.4	0	0	0	0	110.3
170	D	63.8	Low	52	Low	153 Å²	153	143.6 Å²	143.6	82%	0.818	82%	0.816	S	S	*	*			trans	-53	142	154.6	-71.2	-48.8	0	0	0	110.2
171	S	57.5	Low	52.5	Low	115 Å²	115	146.4 Å²	146.4	80%	0.804	81%	0.808	S	S	*	*			trans	-175.7	111.2	142.8	-74.8	0	0	0	0	110.5
172	D	48.9	Very low	52.3	Low	246 Å²	246	154.2 Å²	154.2	100%	1.316	82%	0.824	S	S	*	*			trans	45.7	0	150.3	-59.2	-28.1	0	0	0	122.2

Retrieved 172 of 172 residues in 134.3 ms (Link to these results)

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