A0A087YLG1_POEFO Loading...

Mitochondrial import inner membrane translocase subunit TIM22

Essential core component of the TIM22 complex, a complex that mediates the import and insertion of multi-pass transmembrane proteins into the mitochondrial inner membrane. In the TIM22 complex, it constitutes the voltage-activated and signal-gated channel. Forms a twin-pore translocase that uses the membrane potential as external driving force in 2 voltage-dependent steps.

AlphaFold DB (A0A3B3VYC4), UniProt , Accession A0A087YLG1, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 201 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	38.6	Very low	33.2	Very low	243 Å²	243	118.7 Å²	118.7	100%	1.197	84%	0.841	S	S	*	*				0	94.7	0	-59.2	-159.3	-164.7	0	0	106.2
2	A	33.5	Very low	33	Very low	96 Å²	96	115.9 Å²	115.9	79%	0.793	83%	0.83	S	S	*	*				70.5	103.5	103.7	0	0	0	0	0	111.2
3	A	37.5	Very low	32.8	Very low	100 Å²	100	115.7 Å²	115.7	83%	0.826	83%	0.827	S	S	*	*				74.1	139.5	84.1	0	0	0	0	0	111.1
4	S	38.1	Very low	32.8	Very low	95 Å²	95	118.4 Å²	118.4	66%	0.664	83%	0.827	S	S	*	*			cis	-172.9	176.7	5.6	60.4	0	0	0	0	110.3
5	T	35.2	Very low	32.8	Very low	138 Å²	138	117.1 Å²	117.1	85%	0.847	82%	0.817	S	S	*	*			trans	73.9	133.3	137.3	53.2	0	0	0	0	122
6	G	29.1	Very low	32.7	Very low	83 Å²	83	118.4 Å²	118.4	86%	0.856	82%	0.819	S	S	*	*			trans	150.9	100.3	138.4	0	0	0	0	0	114.7
7	A	31.5	Very low	32.5	Very low	102 Å²	102	115.7 Å²	115.7	84%	0.843	82%	0.815	S	S	*	*			trans	-99.5	165.6	169.5	0	0	0	0	0	111.6
8	A	31.3	Very low	33.6	Very low	90 Å²	90	116.5 Å²	116.5	74%	0.744	82%	0.816	S	S	*	*			trans	78.3	135.3	172.4	0	0	0	0	0	114.9
9	D	30.6	Very low	33.6	Very low	165 Å²	165	114.7 Å²	114.7	88%	0.882	81%	0.809	S	S	*	*			cis	-155.3	172.6	49.3	-104.2	-49.5	0	0	0	114.8
10	A	30.8	Very low	34.3	Very low	93 Å²	93	115 Å²	115	77%	0.769	81%	0.811	S	S	*	*			trans	-82.6	-177.9	-159.6	0	0	0	0	0	119.2
11	A	28.6	Very low	34.5	Very low	101 Å²	101	115.1 Å²	115.1	84%	0.835	81%	0.811	S	S	*	*			trans	110.9	143.4	155.9	0	0	0	0	0	114.6
12	A	31.9	Very low	34.7	Very low	85 Å²	85	110.3 Å²	110.3	70%	0.702	80%	0.795	S	S	*	*			cis	-177.3	159.8	-18.7	0	0	0	0	0	106.1
13	S	29.8	Very low	35.9	Very low	113 Å²	113	111.1 Å²	111.1	79%	0.79	79%	0.793	S	S	*	*			trans	76.7	104.8	158	-52.2	0	0	0	0	118.2
14	D	32.7	Very low	35.9	Very low	154 Å²	154	113 Å²	113	82%	0.824	79%	0.794	S	S	*	*				84.8	115.3	72.1	-162.2	22.2	0	0	0	112.6
15	S	33	Very low	36.4	Very low	98 Å²	98	118.2 Å²	118.2	69%	0.685	81%	0.81	S	S	*	*				160.2	127.7	122.2	60.6	0	0	0	0	114.2
16	T	31.5	Very low	36.7	Very low	139 Å²	139	114.3 Å²	114.3	85%	0.853	80%	0.797	S	S	*	*			trans	81.8	109.1	144.1	-27.3	0	0	0	0	120.2
17	G	29.2	Very low	37.5	Very low	72 Å²	72	115.4 Å²	115.4	74%	0.742	79%	0.792	S	S	*	*			trans	-79.4	-139.1	176.7	0	0	0	0	0	115.3
18	P	52.1	Low	38.8	Very low	130 Å²	130	116 Å²	116	84%	0.844	79%	0.787	S	S	*	*			cis	-135.7	-166.8	-6.5	39.9	-19.9	0	0	0	113.8
19	A	33.4	Very low	40.4	Very low	82 Å²	82	117.8 Å²	117.8	68%	0.678	79%	0.789	S	S	*	*			trans	93.6	92.2	152	0	0	0	0	0	118.9
20	S	48.6	Very low	42.6	Very low	121 Å²	121	114.5 Å²	114.5	85%	0.846	77%	0.771	S	S	*	*			trans	-24.6	127.1	135.5	47.9	0	0	0	0	115.1
21	S	36.7	Very low	45.1	Very low	117 Å²	117	115.9 Å²	115.9	82%	0.818	76%	0.761	S	S	*	*			trans	-161.8	118.4	141.4	52.6	0	0	0	0	111.6
22	V	44.2	Very low	47.8	Very low	142 Å²	142	119.6 Å²	119.6	86%	0.861	76%	0.755	S	S	*	*			trans	-127.4	133.8	152.6	-178.1	0	0	0	0	102.1
23	P	58.9	Low	50.3	Low	114 Å²	114	119.3 Å²	119.3	74%	0.74	75%	0.748	S	S	*	*			cis	-143.9	152.5	44	33	-10.9	0	0	0	116.2
24	T	37.7	Very low	52.9	Low	138 Å²	138	118.3 Å²	118.3	85%	0.847	73%	0.731	S	S	*	*			trans	-145.5	110.6	156.3	-50.3	0	0	0	0	109.7	G26	T24-G26 VanDerWaalsContact C-N 3.26Å; T24-G26 PolarHBondContact O-N 2.8Å
25	M	47.9	Very low	55.5	Low	206 Å²	206	113.9 Å²	113.9	100%	1.015	71%	0.71	S	S	*	*			trans	-70.5	84.9	163.5	-75.6	-168	-153.9	0	0	108.6
26	G	40.4	Very low	58.1	Low	55 Å²	55	114.3 Å²	114.3	57%	0.567	70%	0.704	S	S	*	*	S	Bend	trans	-135.5	129.8	167.7	0	0	0	0	0	107.3	T24	T24-G26 VanDerWaalsContact C-N 3.26Å; T24-G26 PolarHBondContact O-N 2.8Å
27	S	47.8	Very low	60.8	Low	107 Å²	107	111 Å²	111	75%	0.748	68%	0.679	S	S	*	*			trans	4.2	116.5	175.4	-57.6	0	0	0	0	116.1	T29	S27-T29 PolarHBondContact O-N 2.9Å
28	P	57.3	Low	63.6	Low	115 Å²	115	112.1 Å²	112.1	75%	0.747	67%	0.665	S	S	*	*			trans	-62.7	102.7	-171.9	27.4	-33.4	0	0	0	109.8	I30	P28-I30 HydrophobicContact CB-CD1 4.42Å; P28-I30 PolarHBondContact O-N 3.01Å
29	T	66.4	Low	65.3	Low	126 Å²	126	111.2 Å²	111.2	77%	0.773	65%	0.652	S	S	*	*			trans	-68.1	88.9	162.6	48.4	0	0	0	0	105.9	S27 Q31	S27-T29 PolarHBondContact O-N 2.9Å; T29-Q31 PolarHBondContact O-N 2.85Å
30	I	75.1	Confident	67.9	Low	97 Å²	97	113 Å²	113	50%	0.497	66%	0.655	S	S	.	*			trans	-57.4	104.6	174.4	-62.2	-73.1	0	0	0	106.6	P28 Y32 V35	P28-I30 HydrophobicContact CB-CD1 4.42Å; P28-I30 PolarHBondContact O-N 3.01Å; I30-Y32 VanDerWaalsContact C-N 3.35Å; I30-Y32 WeakPolarHBondContact O-CD2 3.36Å; I30-Y32 PolarHBondContact O-N 3.43Å; I30-V35 HydrophobicContact CG2-CG2 3.9Å
31	Q	83.8	Confident	69.7	Low	122 Å²	122	108.7 Å²	108.7	57%	0.57	63%	0.629	S	S	*	*			trans	-72.9	95.7	171.1	-71.2	-163.7	7.8	0	0	107.8	T29 S33 M34 V35	T29-Q31 PolarHBondContact O-N 2.85Å; Q31-S33 PolarHBondContact O-N 3.41Å; Q31-S33 VanDerWaalsContact O-N 3.1Å; Q31-M34 HydrophobicContact CB-CB 4.29Å; Q31-M34 HydrophobicContact CB-CG 4.11Å; Q31-M34 PolarHBondContact O-N 2.86Å; Q31-V35 PolarHBondContact O-N 3.47Å
32	Y	84.9	Confident	72.2	Confident	178 Å²	178	112.6 Å²	112.6	70%	0.698	63%	0.634	S	S	*	*	H	α-helix	trans	-53	-32	-178.8	-71.7	-83.7	0	0	0	113	I30 V35 L36	I30-Y32 VanDerWaalsContact C-N 3.35Å; I30-Y32 WeakPolarHBondContact O-CD2 3.36Å; I30-Y32 PolarHBondContact O-N 3.43Å; Y32-V35 PolarHBondContact O-N 3.1Å; Y32-L36 WeakPolarHBondContact O-CB 3.5Å; Y32-L36 WeakPolarHBondContact O-CD1 3.32Å; Y32-L36 VanDerWaalsContact O-CG 3.22Å; Y32-L36 WeakPolarHBondContact O-CG 3.22Å; Y32-L36 PolarHBondContact O-N 2.85Å
33	S	84.9	Confident	74.1	Confident	80 Å²	80	110.9 Å²	110.9	56%	0.559	62%	0.615	S	S	*	*	H	α-helix	trans	-59.7	-48.1	174.5	50	0	0	0	0	112.7	Q31 V35 L36 E37	Q31-S33 PolarHBondContact O-N 3.41Å; Q31-S33 VanDerWaalsContact O-N 3.1Å; S33-V35 VanDerWaalsContact C-N 3.33Å; S33-V35 PolarHBondContact O-N 2.98Å; S33-L36 PolarHBondContact O-N 2.85Å; S33-E37 WeakPolarHBondContact O-CB 3.49Å; S33-E37 PolarHBondContact O-N 3.24Å
34	M	85	Confident	75.5	Confident	91 Å²	91	112.6 Å²	112.6	45%	0.448	61%	0.607	S	S	.	*	H	α-helix	trans	-67.1	-35.1	179.3	-68.5	-67.5	-70.9	0	0	112.2	Q31 H38	Q31-M34 HydrophobicContact CB-CB 4.29Å; Q31-M34 HydrophobicContact CB-CG 4.11Å; Q31-M34 PolarHBondContact O-N 2.86Å; M34-H38 PolarHBondContact O-N 2.99Å; M34-H38 PolarHBondContact O-ND1 3.4Å
35	V	86.9	Confident	77.7	Confident	62 Å²	62	110.3 Å²	110.3	38%	0.376	59%	0.594	S	S	.	*	H	α-helix	trans	-72.1	-42.8	176.9	177.6	0	0	0	0	111.2	I30 Q31 Y32 S33 E37 H38 L39	I30-V35 HydrophobicContact CG2-CG2 3.9Å; Q31-V35 PolarHBondContact O-N 3.47Å; Y32-V35 PolarHBondContact O-N 3.1Å; S33-V35 VanDerWaalsContact C-N 3.33Å; S33-V35 PolarHBondContact O-N 2.98Å; V35-E37 VanDerWaalsContact C-N 3.27Å; V35-E37 PolarHBondContact O-N 3.02Å; V35-H38 PolarHBondContact O-N 3.02Å; V35-L39 HydrophobicContact CG1-CD1 3.7Å; V35-L39 HydrophobicContact CG1-CG 4.27Å; V35-L39 WeakPolarHBondContact O-CG 3.19Å; V35-L39 PolarHBondContact O-N 2.8Å
36	L	86.8	Confident	79.2	Confident	107 Å²	107	108.3 Å²	108.3	56%	0.56	59%	0.586	S	S	*	*	H	α-helix	trans	-60.8	-37.9	174.2	-77.1	166.5	0	0	0	111.5	Y32 S33 H38 L39 V40 G41	Y32-L36 WeakPolarHBondContact O-CB 3.5Å; Y32-L36 WeakPolarHBondContact O-CD1 3.32Å; Y32-L36 VanDerWaalsContact O-CG 3.22Å; Y32-L36 WeakPolarHBondContact O-CG 3.22Å; Y32-L36 PolarHBondContact O-N 2.85Å; S33-L36 PolarHBondContact O-N 2.85Å; L36-H38 VanDerWaalsContact C-N 3.28Å; L36-H38 PolarHBondContact O-N 3.13Å; L36-L39 PolarHBondContact O-N 3.28Å; L36-V40 PolarHBondContact O-N 3.07Å; L36-G41 PolarHBondContact O-N 3.38Å; L36-G41 VanDerWaalsContact O-N 3.13Å
37	E	88.4	Confident	81.1	Confident	68 Å²	68	113.5 Å²	113.5	32%	0.318	59%	0.593	S	S	.	*	H	α-helix	trans	-64.2	-32.7	177.4	-155.7	-176.8	-179.4	0	0	112.7	S33 V35 G41 K43	S33-E37 WeakPolarHBondContact O-CB 3.49Å; S33-E37 PolarHBondContact O-N 3.24Å; V35-E37 VanDerWaalsContact C-N 3.27Å; V35-E37 PolarHBondContact O-N 3.02Å; E37-G41 CarbonylContact O-C 3.31Å; E37-G41 VanDerWaalsContact O-C 3.31Å; E37-G41 WeakPolarHBondContact O-CA 3.15Å; E37-G41 PolarHBondContact O-N 3.2Å; E37-K43 HydrophobicContact CG-CD 4.1Å; E37-K43 HydrophobicContact CG-CG 4.37Å; E37-K43 WeakPolarHBondContact OE1-CE 3.13Å; E37-K43 IonicContact OE1-NZ 3.17Å; E37-K43 PolarHBondContact OE1-NZ 3.19Å; E37-K43 IonicContact OE2-NZ 2.8Å; E37-K43 PolarHBondContact OE2-NZ 3.34Å
38	H	88.1	Confident	82.5	Confident	97 Å²	97	116 Å²	116	45%	0.449	60%	0.598	S	S	.	*	H	α-helix	trans	-84.5	-23.8	175.6	-85.1	75.7	0	0	0	114.3	M34 V35 L36 R44	M34-H38 PolarHBondContact O-N 2.99Å; M34-H38 PolarHBondContact O-ND1 3.4Å; V35-H38 PolarHBondContact O-N 3.02Å; L36-H38 VanDerWaalsContact C-N 3.28Å; L36-H38 PolarHBondContact O-N 3.13Å; H38-R44 VanDerWaalsContact O-CA 3.31Å; H38-R44 WeakPolarHBondContact O-CA 3.31Å
39	L	87.3	Confident	83.3	Confident	110 Å²	110	115 Å²	115	58%	0.576	59%	0.586	S	S	*	*	H	α-helix	trans	-93.3	-38.1	-178.5	-68.9	176.9	0	0	0	113	V35 L36 R44	V35-L39 HydrophobicContact CG1-CD1 3.7Å; V35-L39 HydrophobicContact CG1-CG 4.27Å; V35-L39 WeakPolarHBondContact O-CG 3.19Å; V35-L39 PolarHBondContact O-N 2.8Å; L36-L39 PolarHBondContact O-N 3.28Å; L39-R44 VanDerWaalsContact O-CD 3.25Å; L39-R44 WeakPolarHBondContact O-CD 3.37Å
40	V	88.8	Confident	83.4	Confident	121 Å²	121	112.5 Å²	112.5	73%	0.733	57%	0.573	S	S	*	*	T	Hydrogen-bonded Turn	trans	-128.8	-15.3	-172.6	-172.1	0	0	0	0	112.2	L36	L36-V40 PolarHBondContact O-N 3.07Å
41	G	86.9	Confident	83.1	Confident	29 Å²	29	112.6 Å²	112.6	30%	0.299	58%	0.58	S	S	.	*	S	Bend	trans	-87.3	-175.8	-179.8	0	0	0	0	0	114.9	L36 E37 K43 R44	L36-G41 PolarHBondContact O-N 3.38Å; L36-G41 VanDerWaalsContact O-N 3.13Å; E37-G41 CarbonylContact O-C 3.31Å; E37-G41 VanDerWaalsContact O-C 3.31Å; E37-G41 WeakPolarHBondContact O-CA 3.15Å; E37-G41 PolarHBondContact O-N 3.2Å; G41-K43 PolarHBondContact O-N 3.21Å; G41-R44 WeakPolarHBondContact O-CB 3.25Å; G41-R44 PolarHBondContact O-N 3.26Å; G41-R44 VanDerWaalsContact O-N 3.07Å
42	E	87.8	Confident	82.3	Confident	200 Å²	200	109.3 Å²	109.3	94%	0.935	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62.8	-23.5	-178.1	-72.3	-173	134.4	0	0	113.7	R44	E42-R44 PolarHBondContact O-N 3.31Å
43	K	85.9	Confident	81.7	Confident	105 Å²	105	106.9 Å²	106.9	46%	0.457	58%	0.582	S	S	.	*	T	Hydrogen-bonded Turn	trans	-79.9	3.3	177.6	-63.5	178.2	-175.1	153.8	0	112.8	E37 G41 P45	E37-K43 HydrophobicContact CG-CD 4.1Å; E37-K43 HydrophobicContact CG-CG 4.37Å; E37-K43 WeakPolarHBondContact OE1-CE 3.13Å; E37-K43 IonicContact OE1-NZ 3.17Å; E37-K43 PolarHBondContact OE1-NZ 3.19Å; E37-K43 IonicContact OE2-NZ 2.8Å; E37-K43 PolarHBondContact OE2-NZ 3.34Å; G41-K43 PolarHBondContact O-N 3.21Å; K43-P45 WeakPolarHBondContact O-CD 3.36Å
44	R	87.5	Confident	80.9	Confident	151 Å²	151	110.4 Å²	110.4	57%	0.57	59%	0.592	S	S	*	*	P	Polyproline II helix	trans	-66	120.9	178.9	-175.4	-168.6	178.6	-166.8	-2.1	110.7	H38 L39 G41 E42	H38-R44 VanDerWaalsContact O-CA 3.31Å; H38-R44 WeakPolarHBondContact O-CA 3.31Å; L39-R44 VanDerWaalsContact O-CD 3.25Å; L39-R44 WeakPolarHBondContact O-CD 3.37Å; G41-R44 WeakPolarHBondContact O-CB 3.25Å; G41-R44 PolarHBondContact O-N 3.26Å; G41-R44 VanDerWaalsContact O-N 3.07Å; E42-R44 PolarHBondContact O-N 3.31Å
45	P	83.9	Confident	80.3	Confident	89 Å²	89	108 Å²	108	58%	0.578	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-69	135.7	172.1	28.1	-32.6	0	0	0	110.4	K43 K47	K43-P45 WeakPolarHBondContact O-CD 3.36Å; P45-K47 PolarHBondContact O-N 3.09Å
46	I	80.3	Confident	79.8	Confident	165 Å²	165	109.2 Å²	109.2	85%	0.846	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-65	119.3	171.1	-58.1	-172.7	0	0	0	107.4
47	K	79.9	Confident	79.4	Confident	164 Å²	164	110.8 Å²	110.8	71%	0.713	62%	0.624	S	S	*	*			trans	-115.5	121.8	-179.8	-161.4	163.2	-175.3	166.4	0	107.8	P45 L49	P45-K47 PolarHBondContact O-N 3.09Å; K47-L49 VanDerWaalsContact C-N 3.35Å; K47-L49 HydrophobicContact CB-CD1 3.93Å; K47-L49 HydrophobicContact CG-CD1 4.15Å; K47-L49 VanDerWaalsContact O-CD1 3.29Å; K47-L49 WeakPolarHBondContact O-CD1 3.47Å; K47-L49 PolarHBondContact O-N 3.19Å
48	D	75.9	Confident	78.9	Confident	159 Å²	159	113.2 Å²	113.2	85%	0.85	65%	0.646	S	S	*	*			trans	-73.2	93.1	172.9	-67.6	-35.9	0	0	0	108.3	S50	D48-S50 PolarHBondContact O-N 3.45Å
49	L	73.8	Confident	78.5	Confident	95 Å²	95	113.6 Å²	113.6	50%	0.497	65%	0.654	S	S	.	*			trans	-73	118.3	173.6	-87.4	74.3	0	0	0	108.1	K47 P51 M54	K47-L49 VanDerWaalsContact C-N 3.35Å; K47-L49 HydrophobicContact CB-CD1 3.93Å; K47-L49 HydrophobicContact CG-CD1 4.15Å; K47-L49 VanDerWaalsContact O-CD1 3.29Å; K47-L49 WeakPolarHBondContact O-CD1 3.47Å; K47-L49 PolarHBondContact O-N 3.19Å; L49-P51 WeakPolarHBondContact O-CD 3.43Å; L49-M54 HydrophobicContact CD2-CG 4.37Å; L49-M54 HydrophobicContact CD2-SD 3.65Å
50	S	69.2	Low	78.2	Confident	72 Å²	72	112.9 Å²	112.9	50%	0.503	66%	0.656	S	S	.	*			trans	-62.5	121.6	166.7	178.4	0	0	0	0	108.5	D48 G52 V53	D48-S50 PolarHBondContact O-N 3.45Å; S50-G52 PolarHBondContact O-N 3.39Å; S50-V53 PolarHBondContact O-N 3.48Å
51	P	69.2	Low	77.7	Confident	99 Å²	99	113.4 Å²	113.4	64%	0.643	66%	0.662	S	S	*	*	H	α-helix	trans	-61	-18.5	-176	21.1	-30.9	0	0	0	113.2	L49 V53	L49-P51 WeakPolarHBondContact O-CD 3.43Å; P51-V53 VanDerWaalsContact C-N 3.29Å; P51-V53 PolarHBondContact O-N 3.48Å
52	G	67.9	Low	77.6	Confident	53 Å²	53	117 Å²	117	55%	0.546	67%	0.669	S	S	.	*	H	α-helix	trans	-73.9	-13.1	173.6	0	0	0	0	0	115.1	S50	S50-G52 PolarHBondContact O-N 3.39Å
53	V	70.4	Confident	77.7	Confident	127 Å²	127	109.8 Å²	109.8	77%	0.77	64%	0.641	S	S	*	*	H	α-helix	trans	-98.1	-20.1	-178.2	-177.8	0	0	0	0	112	S50 P51	S50-V53 PolarHBondContact O-N 3.48Å; P51-V53 VanDerWaalsContact C-N 3.29Å; P51-V53 PolarHBondContact O-N 3.48Å
54	M	69	Low	77.8	Confident	154 Å²	154	110 Å²	110	76%	0.759	65%	0.648	S	S	*	*	H	α-helix	trans	-94.7	-12.5	-171.8	-167.5	173.6	142.3	0	0	113.9	L49	L49-M54 HydrophobicContact CD2-CG 4.37Å; L49-M54 HydrophobicContact CD2-SD 3.65Å
55	G	71.8	Confident	78	Confident	42 Å²	42	109.5 Å²	109.5	43%	0.433	65%	0.651	S	S	.	*	S	Bend	trans	-117.5	142.9	-178	0	0	0	0	0	113.3	L57	G55-L57 PolarHBondContact O-N 2.99Å
56	G	76.6	Confident	78.3	Confident	86 Å²	86	109.8 Å²	109.8	89%	0.887	65%	0.645	S	S	*	*	S	Bend	trans	-70.4	-12.4	176.2	0	0	0	0	0	114.6
57	L	78.8	Confident	78.7	Confident	140 Å²	140	106.1 Å²	106.1	73%	0.733	62%	0.623	S	S	*	*	S	Bend	trans	-120.9	133.6	170.2	-84.8	83	0	0	0	109.6	G55 V59	G55-L57 PolarHBondContact O-N 2.99Å; L57-V59 PolarHBondContact O-N 2.85Å
58	P	77.8	Confident	79.3	Confident	120 Å²	120	104.5 Å²	104.5	78%	0.779	62%	0.619	S	S	*	*			trans	-67.5	102.8	172.5	27	-31.3	0	0	0	109.2
59	V	79.4	Confident	80.1	Confident	104 Å²	104	102 Å²	102	63%	0.63	61%	0.605	S	S	*	*			trans	-74.4	128.7	171.8	-69.3	0	0	0	0	109.1	L57	L57-V59 PolarHBondContact O-N 2.85Å
60	P	80.6	Confident	80.9	Confident	96 Å²	96	102 Å²	102	62%	0.623	60%	0.603	S	S	*	*			trans	-61.7	134.3	178.1	24.6	-32.5	0	0	0	109.6	K62	P60-K62 PolarHBondContact O-N 3.32Å
61	P	79.9	Confident	81.9	Confident	131 Å²	131	107.7 Å²	107.7	85%	0.851	61%	0.613	S	S	*	*			trans	-63.5	112.4	179.9	25.7	-33	0	0	0	109.6
62	K	83.4	Confident	82.9	Confident	104 Å²	104	104.5 Å²	104.5	45%	0.452	60%	0.598	S	S	.	*			trans	-82.2	131.4	171.8	-65.4	-74.2	-173.5	147	0	108.9	P60 Q66 K67	P60-K62 PolarHBondContact O-N 3.32Å; K62-Q66 VanDerWaalsContact CD-OE1 3.25Å; K62-K67 HydrophobicContact CB-CG 4.2Å; K62-K67 VanDerWaalsContact O-CE 3.32Å; K62-K67 WeakPolarHBondContact O-CE 3.45Å
63	S	90.4	Very high	84	Confident	49 Å²	49	107.1 Å²	107.1	34%	0.343	60%	0.597	S	S	.	*			trans	-62.3	152.4	172.5	69	0	0	0	0	110.2	E65 Q66 K67	S63-E65 PolarHBondContact O-N 2.04Å; S63-Q66 WeakPolarHBondContact O-CB 3.15Å; S63-Q66 PolarHBondContact O-N 2.81Å; S63-Q66 VanDerWaalsContact OG-CG 3.3Å; S63-Q66 WeakPolarHBondContact OG-CG 3.15Å; S63-Q66 PolarHBondContact OG-N 3.3Å; S63-K67 PolarHBondContact O-N 3.18Å; S63-K67 VanDerWaalsContact O-N 3.13Å
64	D	88.7	Confident	84.9	Confident	111 Å²	111	107 Å²	107	59%	0.594	59%	0.588	S	S	*	*	H	α-helix	trans	-63.1	-30	179.8	-65.2	-36.1	0	0	0	111.9	K67 M68	D64-K67 PolarHBondContact O-N 2.94Å; D64-K67 IonicContact OD1-NZ 2.85Å; D64-K67 PolarHBondContact OD1-NZ 3.34Å; D64-M68 WeakPolarHBondContact O-CG 3.5Å; D64-M68 PolarHBondContact O-N 2.9Å
65	E	90.9	Very high	86.1	Confident	139 Å²	139	101.7 Å²	101.7	65%	0.65	57%	0.567	S	S	*	*	H	α-helix	trans	-60.5	-45.1	170.7	-59.6	-178.3	147.6	0	0	112.2	S63 K67 M68 I69	S63-E65 PolarHBondContact O-N 2.04Å; E65-K67 VanDerWaalsContact C-N 3.33Å; E65-K67 PolarHBondContact O-N 3.5Å; E65-M68 PolarHBondContact O-N 3.29Å; E65-I69 WeakPolarHBondContact O-CG1 3.04Å; E65-I69 PolarHBondContact O-N 3.38Å
66	Q	90.7	Very high	87.2	Confident	95 Å²	95	101.2 Å²	101.2	44%	0.444	56%	0.556	S	S	.	*	H	α-helix	trans	-63.8	-39.6	177.3	-74	174.2	12.7	0	0	111.7	K62 S63 M68 I69 E70	K62-Q66 VanDerWaalsContact CD-OE1 3.25Å; S63-Q66 WeakPolarHBondContact O-CB 3.15Å; S63-Q66 PolarHBondContact O-N 2.81Å; S63-Q66 VanDerWaalsContact OG-CG 3.3Å; S63-Q66 WeakPolarHBondContact OG-CG 3.15Å; S63-Q66 PolarHBondContact OG-N 3.3Å; Q66-M68 VanDerWaalsContact C-N 3.34Å; Q66-M68 PolarHBondContact O-N 3.33Å; Q66-I69 PolarHBondContact O-N 2.95Å; Q66-E70 WeakPolarHBondContact O-CB 3.48Å; Q66-E70 PolarHBondContact O-N 2.79Å
67	K	89.1	Confident	88.1	Confident	89 Å²	89	100.4 Å²	100.4	39%	0.387	54%	0.542	S	S	.	.	H	α-helix	trans	-63.6	-39.9	176.5	-63.5	173.5	-164.7	154.3	0	111.8	K62 S63 D64 E65 R71	K62-K67 HydrophobicContact CB-CG 4.2Å; K62-K67 VanDerWaalsContact O-CE 3.32Å; K62-K67 WeakPolarHBondContact O-CE 3.45Å; S63-K67 PolarHBondContact O-N 3.18Å; S63-K67 VanDerWaalsContact O-N 3.13Å; D64-K67 PolarHBondContact O-N 2.94Å; D64-K67 IonicContact OD1-NZ 2.85Å; D64-K67 PolarHBondContact OD1-NZ 3.34Å; E65-K67 VanDerWaalsContact C-N 3.33Å; E65-K67 PolarHBondContact O-N 3.5Å; K67-R71 WeakPolarHBondContact O-CB 3.24Å; K67-R71 VanDerWaalsContact O-CG 3.26Å; K67-R71 WeakPolarHBondContact O-CG 3.39Å; K67-R71 PolarHBondContact O-N 2.87Å; K67-R71 VanDerWaalsContact O-N 3.07Å
68	M	91.4	Very high	88.9	Confident	129 Å²	129	98 Å²	98	64%	0.635	53%	0.525	S	S	*	.	H	α-helix	trans	-65.7	-40.8	176.5	-70.4	-168	-61.5	0	0	111.6	D64 E65 Q66 G72	D64-M68 WeakPolarHBondContact O-CG 3.5Å; D64-M68 PolarHBondContact O-N 2.9Å; E65-M68 PolarHBondContact O-N 3.29Å; Q66-M68 VanDerWaalsContact C-N 3.34Å; Q66-M68 PolarHBondContact O-N 3.33Å; M68-G72 PolarHBondContact O-N 3.36Å
69	I	92.8	Very high	89.7	Confident	107 Å²	107	95.9 Å²	95.9	55%	0.549	50%	0.504	S	S	.	.	H	α-helix	trans	-65.1	-46.8	177.3	-67.9	166.6	0	0	0	111	E65 Q66 R71 G72 M73	E65-I69 WeakPolarHBondContact O-CG1 3.04Å; E65-I69 PolarHBondContact O-N 3.38Å; Q66-I69 PolarHBondContact O-N 2.95Å; I69-R71 PolarHBondContact O-N 3.46Å; I69-G72 WeakPolarHBondContact O-CA 3.41Å; I69-G72 PolarHBondContact O-N 3.06Å; I69-G72 VanDerWaalsContact O-N 3.07Å; I69-M73 HydrophobicContact CG2-CG 4.41Å; I69-M73 HydrophobicContact CG2-SD 4.05Å; I69-M73 WeakPolarHBondContact O-CG 3.44Å; I69-M73 PolarHBondContact O-N 3Å
70	E	90.5	Very high	90.5	Very high	96 Å²	96	91.6 Å²	91.6	45%	0.449	48%	0.479	S	S	.	.	H	α-helix	trans	-59.9	-47.4	179.6	-171.1	167.5	-172.8	0	0	111.2	Q66 G72 M73 E74	Q66-E70 WeakPolarHBondContact O-CB 3.48Å; Q66-E70 PolarHBondContact O-N 2.79Å; E70-G72 VanDerWaalsContact C-N 3.27Å; E70-G72 PolarHBondContact O-N 3.28Å; E70-M73 PolarHBondContact O-N 3.2Å; E70-E74 WeakPolarHBondContact O-CG 3.37Å; E70-E74 PolarHBondContact O-N 3.5Å
71	R	89.9	Confident	91.3	Very high	190 Å²	190	91.3 Å²	91.3	72%	0.717	48%	0.475	S	S	*	.	H	α-helix	trans	-59.8	-37.3	172.9	-72.8	176.1	177.4	-176.9	-0.3	112.8	K67 I69 S75	K67-R71 WeakPolarHBondContact O-CB 3.24Å; K67-R71 VanDerWaalsContact O-CG 3.26Å; K67-R71 WeakPolarHBondContact O-CG 3.39Å; K67-R71 PolarHBondContact O-N 2.87Å; K67-R71 VanDerWaalsContact O-N 3.07Å; I69-R71 PolarHBondContact O-N 3.46Å; R71-S75 PolarHBondContact O-N 3.41Å
72	G	90.8	Very high	92.1	Very high	32 Å²	32	90.7 Å²	90.7	33%	0.33	46%	0.464	S	S	.	.	H	α-helix	trans	-63.5	-45.5	175.7	0	0	0	0	0	112.1	M68 I69 E70 S75 F78	M68-G72 PolarHBondContact O-N 3.36Å; I69-G72 WeakPolarHBondContact O-CA 3.41Å; I69-G72 PolarHBondContact O-N 3.06Å; I69-G72 VanDerWaalsContact O-N 3.07Å; E70-G72 VanDerWaalsContact C-N 3.27Å; E70-G72 PolarHBondContact O-N 3.28Å; G72-S75 VanDerWaalsContact O-CB 3.3Å; G72-S75 WeakPolarHBondContact O-CB 3.35Å; G72-S75 PolarHBondContact O-N 2.87Å; G72-S75 PolarHBondContact O-OG 3.5Å; G72-F78 WeakPolarHBondContact O-CB 3.07Å
73	M	91.2	Very high	92.7	Very high	108 Å²	108	87.1 Å²	87.1	53%	0.532	45%	0.453	S	S	.	.	H	α-helix	trans	-70.1	-31.9	-179.3	-69.8	-178.5	66.8	0	0	113.1	I69 E70 S75 F78	I69-M73 HydrophobicContact CG2-CG 4.41Å; I69-M73 HydrophobicContact CG2-SD 4.05Å; I69-M73 WeakPolarHBondContact O-CG 3.44Å; I69-M73 PolarHBondContact O-N 3Å; E70-M73 PolarHBondContact O-N 3.2Å; M73-S75 VanDerWaalsContact C-N 3.28Å; M73-F78 HydrophobicContact CB-CD1 4.32Å; M73-F78 HydrophobicContact CB-CE1 4.34Å; M73-F78 HydrophobicContact CG-CD1 4.45Å; M73-F78 HydrophobicContact CG-CE1 4.11Å; M73-F78 HydrophobicContact CG-CZ 4.46Å
74	E	89.5	Confident	93	Very high	124 Å²	124	86.9 Å²	86.9	58%	0.579	45%	0.452	S	S	*	.	H	α-helix	trans	-77.9	-13.7	175.2	-70	-171.8	145.3	0	0	113.4	E70	E70-E74 WeakPolarHBondContact O-CG 3.37Å; E70-E74 PolarHBondContact O-N 3.5Å
75	S	94.4	Very high	93.5	Very high	44 Å²	44	85.7 Å²	85.7	31%	0.308	45%	0.448	S	S	.	.	S	Bend	trans	-62.7	141.1	-179	76.5	0	0	0	0	112.2	R71 G72 M73 A77 F78 K79	R71-S75 PolarHBondContact O-N 3.41Å; G72-S75 VanDerWaalsContact O-CB 3.3Å; G72-S75 WeakPolarHBondContact O-CB 3.35Å; G72-S75 PolarHBondContact O-N 2.87Å; G72-S75 PolarHBondContact O-OG 3.5Å; M73-S75 VanDerWaalsContact C-N 3.28Å; S75-A77 PolarHBondContact O-N 2.97Å; S75-F78 PolarHBondContact O-N 2.94Å; S75-F78 VanDerWaalsContact O-N 3.15Å; S75-F78 WeakPolarHBondContact OG-CB 3.5Å; S75-F78 PolarHBondContact OG-N 3.29Å; S75-K79 PolarHBondContact O-N 3.33Å
76	C	94.6	Very high	93.8	Very high	31 Å²	31	81 Å²	81	21%	0.209	44%	0.437	C	S	.	.	H	α-helix	trans	-59.5	-33	176.7	-57.2	0	0	0	0	112.1	S80 C148	C76-S80 VanDerWaalsContact O-CB 3.25Å; C76-S80 WeakPolarHBondContact O-CB 3.37Å; C76-S80 PolarHBondContact O-N 3.28Å; C76-S80 PolarHBondContact O-OG 2.92Å; C76-C148 WeakPolarHBondContact CA-SG 3.45Å; C76-C148 HydrophobicContact CB-CB 3.63Å; C76-C148 WeakPolarHBondContact CB-SG 3.49Å; C76-C148 VanDerWaalsContact SG-C 3.58Å; C76-C148 WeakPolarHBondContact SG-CB 3.43Å; C76-C148 CovalentContact SG-SG 2.04Å; C76-C148 PolarHBondContact SG-SG 2.78Å
77	A	95.1	Very high	94	Very high	70 Å²	70	77.1 Å²	77.1	58%	0.579	42%	0.423	S	S	*	.	H	α-helix	trans	-62.2	-48.5	176.4	0	0	0	0	0	111.4	S75 S80 V81	S75-A77 PolarHBondContact O-N 2.97Å; A77-S80 PolarHBondContact O-N 3.46Å; A77-V81 WeakPolarHBondContact O-CG2 3.46Å; A77-V81 PolarHBondContact O-N 2.86Å
78	F	95.3	Very high	94.4	Very high	90 Å²	90	77 Å²	77	40%	0.395	42%	0.422	S	S	.	.	H	α-helix	trans	-65.1	-46.6	179.8	-175.4	-98	0	0	0	112	G72 M73 S75 S80 V81 L82	G72-F78 WeakPolarHBondContact O-CB 3.07Å; M73-F78 HydrophobicContact CB-CD1 4.32Å; M73-F78 HydrophobicContact CB-CE1 4.34Å; M73-F78 HydrophobicContact CG-CD1 4.45Å; M73-F78 HydrophobicContact CG-CE1 4.11Å; M73-F78 HydrophobicContact CG-CZ 4.46Å; S75-F78 PolarHBondContact O-N 2.94Å; S75-F78 VanDerWaalsContact O-N 3.15Å; S75-F78 WeakPolarHBondContact OG-CB 3.5Å; S75-F78 PolarHBondContact OG-N 3.29Å; F78-S80 VanDerWaalsContact C-N 3.29Å; F78-S80 PolarHBondContact O-N 2.78Å; F78-V81 PolarHBondContact O-N 3.33Å; F78-L82 PolarHBondContact O-N 3Å
79	K	95.6	Very high	94.7	Very high	74 Å²	74	75.4 Å²	75.4	32%	0.322	42%	0.419	S	S	.	.	H	α-helix	trans	-56.2	-44	175	-72.5	-178.8	175.3	174.2	0	111.8	S75 V81 L82 A83 S144	S75-K79 PolarHBondContact O-N 3.33Å; K79-V81 PolarHBondContact O-N 3.39Å; K79-L82 PolarHBondContact O-N 3.34Å; K79-A83 WeakPolarHBondContact O-CB 3.4Å; K79-A83 PolarHBondContact O-N 2.89Å; K79-S144 PolarHBondContact O-OG 2.95Å
80	S	96.2	Very high	94.8	Very high	15 Å²	15	75.5 Å²	75.5	11%	0.105	42%	0.42	C	S	.	.	H	α-helix	trans	-64.6	-40.7	178.4	-57	0	0	0	0	112.6	C76 A77 F78 A83 C84 C145	C76-S80 VanDerWaalsContact O-CB 3.25Å; C76-S80 WeakPolarHBondContact O-CB 3.37Å; C76-S80 PolarHBondContact O-N 3.28Å; C76-S80 PolarHBondContact O-OG 2.92Å; A77-S80 PolarHBondContact O-N 3.46Å; F78-S80 VanDerWaalsContact C-N 3.29Å; F78-S80 PolarHBondContact O-N 2.78Å; S80-A83 PolarHBondContact O-N 2.77Å; S80-C84 VanDerWaalsContact O-CB 3.23Å; S80-C84 WeakPolarHBondContact O-CB 3.33Å; S80-C84 PolarHBondContact O-N 3.34Å; S80-C145 WeakPolarHBondContact OG-CA 3.42Å; S80-C145 WeakPolarHBondContact OG-CB 3.47Å; S80-C145 PolarHBondContact OG-N 3.48Å
81	V	97.3	Very high	95	Very high	90 Å²	90	70.9 Å²	70.9	55%	0.545	40%	0.399	S	S	.	.	H	α-helix	trans	-65.4	-43.1	176.2	170	0	0	0	0	110.6	A77 F78 K79 A83 C84 V85	A77-V81 WeakPolarHBondContact O-CG2 3.46Å; A77-V81 PolarHBondContact O-N 2.86Å; F78-V81 PolarHBondContact O-N 3.33Å; K79-V81 PolarHBondContact O-N 3.39Å; V81-A83 VanDerWaalsContact C-N 3.35Å; V81-A83 PolarHBondContact O-N 3.48Å; V81-C84 VanDerWaalsContact O-CB 3.31Å; V81-C84 WeakPolarHBondContact O-CB 3.41Å; V81-C84 PolarHBondContact O-N 2.9Å; V81-V85 WeakPolarHBondContact O-CG2 3.44Å; V81-V85 PolarHBondContact O-N 3.04Å
82	L	96.4	Very high	95.2	Very high	117 Å²	117	62.7 Å²	62.7	61%	0.613	37%	0.373	S	S	*	.	H	α-helix	trans	-60.3	-46.3	176.7	-167.4	78.9	0	0	0	111.1	F78 K79 C84 V85 G86	F78-L82 PolarHBondContact O-N 3Å; K79-L82 PolarHBondContact O-N 3.34Å; L82-C84 VanDerWaalsContact C-N 3.33Å; L82-C84 PolarHBondContact O-N 3.02Å; L82-V85 PolarHBondContact O-N 2.87Å; L82-G86 PolarHBondContact O-N 2.93Å
83	A	96.6	Very high	95.3	Very high	29 Å²	29	64.2 Å²	64.2	24%	0.24	38%	0.383	C	S	.	.	H	α-helix	trans	-64.5	-36.6	175.9	0	0	0	0	0	112.5	K79 S80 V81 G86 G87 G140	K79-A83 WeakPolarHBondContact O-CB 3.4Å; K79-A83 PolarHBondContact O-N 2.89Å; S80-A83 PolarHBondContact O-N 2.77Å; V81-A83 VanDerWaalsContact C-N 3.35Å; V81-A83 PolarHBondContact O-N 3.48Å; A83-G86 PolarHBondContact O-N 3.49Å; A83-G87 PolarHBondContact O-N 2.91Å; A83-G140 WeakPolarHBondContact CB-O 3.25Å
84	C	96.9	Very high	95.3	Very high	45 Å²	45	64.1 Å²	64.1	30%	0.304	38%	0.38	S	S	.	.	H	α-helix	trans	-61	-49.9	174.8	-173.7	0	0	0	0	111.4	S80 V81 L82 G87 F88 A137 A141	S80-C84 VanDerWaalsContact O-CB 3.23Å; S80-C84 WeakPolarHBondContact O-CB 3.33Å; S80-C84 PolarHBondContact O-N 3.34Å; V81-C84 VanDerWaalsContact O-CB 3.31Å; V81-C84 WeakPolarHBondContact O-CB 3.41Å; V81-C84 PolarHBondContact O-N 2.9Å; L82-C84 VanDerWaalsContact C-N 3.33Å; L82-C84 PolarHBondContact O-N 3.02Å; C84-G87 PolarHBondContact O-N 3.49Å; C84-F88 WeakPolarHBondContact O-CB 3.37Å; C84-F88 PolarHBondContact O-N 2.95Å; C84-A137 WeakPolarHBondContact O-CB 3.34Å; C84-A141 HydrophobicContact CB-CB 3.88Å
85	V	97.8	Very high	95.4	Very high	86 Å²	86	58.2 Å²	58.2	52%	0.521	35%	0.352	S	S	.	.	H	α-helix	trans	-65.1	-44	178.7	174.5	0	0	0	0	110.6	V81 L82 G87 F88 V89	V81-V85 WeakPolarHBondContact O-CG2 3.44Å; V81-V85 PolarHBondContact O-N 3.04Å; L82-V85 PolarHBondContact O-N 2.87Å; V85-G87 PolarHBondContact O-N 2.72Å; V85-F88 WeakPolarHBondContact O-CB 3.09Å; V85-F88 PolarHBondContact O-N 2.95Å; V85-V89 WeakPolarHBondContact O-CG2 3.41Å; V85-V89 PolarHBondContact O-N 3.16Å
86	G	97.3	Very high	95.1	Very high	41 Å²	41	59.8 Å²	59.8	42%	0.423	36%	0.36	S	S	.	.	H	α-helix	trans	-58.9	-46.4	175.4	0	0	0	0	0	112.4	L82 A83 F88 V89 L90	L82-G86 PolarHBondContact O-N 2.93Å; A83-G86 PolarHBondContact O-N 3.49Å; G86-F88 PolarHBondContact O-N 3.4Å; G86-V89 PolarHBondContact O-N 3.4Å; G86-L90 WeakPolarHBondContact O-CB 3.47Å; G86-L90 PolarHBondContact O-N 3.39Å
87	G	96.1	Very high	94.8	Very high	13 Å²	13	65 Å²	65	13%	0.134	38%	0.379	C	S	.	.	H	α-helix	trans	-63.1	-38.6	175	0	0	0	0	0	112.9	A83 C84 V85 G91 F136	A83-G87 PolarHBondContact O-N 2.91Å; C84-G87 PolarHBondContact O-N 3.49Å; V85-G87 PolarHBondContact O-N 2.72Å; G87-G91 PolarHBondContact O-N 3.47Å; G87-F136 WeakPolarHBondContact O-CB 3.38Å
88	F	97.2	Very high	94.4	Very high	85 Å²	85	63.5 Å²	63.5	37%	0.373	36%	0.363	S	S	.	.	H	α-helix	trans	-62.2	-48.1	176.4	-174.7	-91.3	0	0	0	111.9	C84 V85 G86 G92 M130 A133 A137	C84-F88 WeakPolarHBondContact O-CB 3.37Å; C84-F88 PolarHBondContact O-N 2.95Å; V85-F88 WeakPolarHBondContact O-CB 3.09Å; V85-F88 PolarHBondContact O-N 2.95Å; G86-F88 PolarHBondContact O-N 3.4Å; F88-G92 PolarHBondContact O-N 3.3Å; F88-M130 HydrophobicContact CE2-SD 3.88Å; F88-M130 HydrophobicContact CZ-CE 4.29Å; F88-M130 HydrophobicContact CZ-SD 3.77Å; F88-A133 HydrophobicContact CD1-CB 4.4Å; F88-A133 HydrophobicContact CD2-CB 3.57Å; F88-A133 HydrophobicContact CE1-CB 4.36Å; F88-A133 HydrophobicContact CE2-CB 3.53Å; F88-A133 HydrophobicContact CG-CB 4.02Å; F88-A133 HydrophobicContact CZ-CB 3.95Å; F88-A133 WeakPolarHBondContact O-CB 3.33Å; F88-A137 HydrophobicContact CB-CB 3.92Å; F88-A137 HydrophobicContact CD2-CB 4.33Å
89	V	96.8	Very high	93.9	Very high	96 Å²	96	59.4 Å²	59.4	58%	0.582	35%	0.345	S	S	*	.	H	α-helix	trans	-64.5	-47.5	179.7	174.1	0	0	0	0	110.6	V85 G86 G92 A93	V85-V89 WeakPolarHBondContact O-CG2 3.41Å; V85-V89 PolarHBondContact O-N 3.16Å; G86-V89 PolarHBondContact O-N 3.4Å; V89-G92 PolarHBondContact O-N 3.44Å; V89-A93 WeakPolarHBondContact O-CB 3.14Å; V89-A93 PolarHBondContact O-N 2.83Å
90	L	95.3	Very high	93.3	Very high	109 Å²	109	58.3 Å²	58.3	57%	0.571	36%	0.356	S	S	*	.	H	α-helix	trans	-64.9	-43.9	-179.9	-173.3	139.4	0	0	0	111.9	G86 A93 F94 F136	G86-L90 WeakPolarHBondContact O-CB 3.47Å; G86-L90 PolarHBondContact O-N 3.39Å; L90-A93 PolarHBondContact O-N 2.88Å; L90-F94 WeakPolarHBondContact O-CB 3.28Å; L90-F94 PolarHBondContact O-N 2.86Å; L90-F136 HydrophobicContact CD2-CD1 4.23Å; L90-F136 HydrophobicContact CD2-CE1 4.31Å
91	G	94.2	Very high	92.7	Very high	0 Å²	0	63 Å²	63	0%	0	38%	0.378	C	S	.	.	H	α-helix	trans	-67.2	-34.7	176.5	0	0	0	0	0	113.2	G87 G95 Y132	G87-G91 PolarHBondContact O-N 3.47Å; G91-G95 PolarHBondContact O-N 2.9Å; G91-Y132 WeakPolarHBondContact O-CB 3.23Å
92	G	93.9	Very high	91.7	Very high	17 Å²	17	61.2 Å²	61.2	18%	0.175	37%	0.366	C	S	.	.	H	α-helix	trans	-66.4	-46.8	174.1	0	0	0	0	0	112	F88 V89 G95 V96	F88-G92 PolarHBondContact O-N 3.3Å; V89-G92 PolarHBondContact O-N 3.44Å; G92-G95 PolarHBondContact O-N 3.49Å; G92-V96 WeakPolarHBondContact O-CG2 3.37Å; G92-V96 PolarHBondContact O-N 2.74Å
93	A	93	Very high	90.1	Very high	64 Å²	64	61.3 Å²	61.3	53%	0.529	37%	0.371	S	S	.	.	H	α-helix	trans	-60.9	-47.5	175.7	0	0	0	0	0	111.5	V89 L90 G95 V96 F97	V89-A93 WeakPolarHBondContact O-CB 3.14Å; V89-A93 PolarHBondContact O-N 2.83Å; L90-A93 PolarHBondContact O-N 2.88Å; A93-G95 VanDerWaalsContact C-N 3.3Å; A93-G95 PolarHBondContact O-N 3.06Å; A93-V96 PolarHBondContact O-N 3.4Å; A93-F97 WeakPolarHBondContact O-CB 3.44Å; A93-F97 PolarHBondContact O-N 3.19Å
94	F	92.3	Very high	88.5	Confident	106 Å²	106	65.2 Å²	65.2	47%	0.465	39%	0.388	S	S	.	.	H	α-helix	trans	-61.3	-39.4	175.9	-178	-103.8	0	0	0	112.2	L90 T98 F136	L90-F94 WeakPolarHBondContact O-CB 3.28Å; L90-F94 PolarHBondContact O-N 2.86Å; F94-T98 WeakPolarHBondContact O-CB 3.35Å; F94-T98 PolarHBondContact O-N 3.46Å; F94-T98 PolarHBondContact O-OG1 3.37Å; F94-F136 HydrophobicContact CD1-CE2 4.12Å; F94-F136 HydrophobicContact CD1-CZ 4.36Å
95	G	90.2	Very high	86.8	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	38%	0.382	C	S	.	.	H	α-helix	trans	-69.6	-40.5	-179.9	0	0	0	0	0	113.9	G91 G92 A93 A99	G91-G95 PolarHBondContact O-N 2.9Å; G92-G95 PolarHBondContact O-N 3.49Å; A93-G95 VanDerWaalsContact C-N 3.3Å; A93-G95 PolarHBondContact O-N 3.06Å; G95-A99 WeakPolarHBondContact O-CB 3.48Å; G95-A99 PolarHBondContact O-N 2.82Å
96	V	88.1	Confident	84.7	Confident	78 Å²	78	62.2 Å²	62.2	47%	0.473	38%	0.376	S	S	.	.	H	α-helix	trans	-67	-42.8	174.3	172.5	0	0	0	0	110.6	G92 A93 T98 A99 G100	G92-V96 WeakPolarHBondContact O-CG2 3.37Å; G92-V96 PolarHBondContact O-N 2.74Å; A93-V96 PolarHBondContact O-N 3.4Å; V96-T98 PolarHBondContact O-N 2.98Å; V96-A99 PolarHBondContact O-N 3.5Å; V96-G100 PolarHBondContact O-N 3.37Å
97	F	89.1	Confident	82.6	Confident	141 Å²	141	68.3 Å²	68.3	62%	0.618	39%	0.391	S	S	*	.	H	α-helix	trans	-59.7	-46.8	175.9	179.8	-99.3	0	0	0	111.7	A93 A99 G100 I101	A93-F97 WeakPolarHBondContact O-CB 3.44Å; A93-F97 PolarHBondContact O-N 3.19Å; F97-A99 VanDerWaalsContact C-N 3.33Å; F97-A99 PolarHBondContact O-N 2.95Å; F97-G100 PolarHBondContact O-N 2.88Å; F97-G100 VanDerWaalsContact O-N 3.11Å; F97-I101 PolarHBondContact O-N 2.68Å
98	T	87.7	Confident	80.7	Confident	37 Å²	37	73.3 Å²	73.3	23%	0.227	42%	0.415	C	S	.	.	H	α-helix	trans	-65.1	-36.6	178.4	-56	0	0	0	0	112	F94 V96 G100 I101 D102	F94-T98 WeakPolarHBondContact O-CB 3.35Å; F94-T98 PolarHBondContact O-N 3.46Å; F94-T98 PolarHBondContact O-OG1 3.37Å; V96-T98 PolarHBondContact O-N 2.98Å; T98-G100 VanDerWaalsContact C-N 3.28Å; T98-G100 PolarHBondContact O-N 3.44Å; T98-I101 WeakPolarHBondContact O-CG1 3.4Å; T98-I101 PolarHBondContact O-N 2.99Å; T98-D102 PolarHBondContact O-N 2.98Å
99	A	84.7	Confident	78.9	Confident	4 Å²	4	75.5 Å²	75.5	3%	0.033	44%	0.437	C	S	.	.	H	α-helix	trans	-68.6	-28.5	174.8	0	0	0	0	0	112.4	G95 V96 F97 I101 D102 M125	G95-A99 WeakPolarHBondContact O-CB 3.48Å; G95-A99 PolarHBondContact O-N 2.82Å; V96-A99 PolarHBondContact O-N 3.5Å; F97-A99 VanDerWaalsContact C-N 3.33Å; F97-A99 PolarHBondContact O-N 2.95Å; A99-I101 VanDerWaalsContact C-N 3.35Å; A99-D102 PolarHBondContact O-N 3.33Å; A99-M125 VanDerWaalsContact C-CE 3.44Å; A99-M125 HydrophobicContact CB-CB 3.94Å; A99-M125 HydrophobicContact CB-CE 4Å; A99-M125 HydrophobicContact CB-CG 3.87Å
100	G	81.9	Confident	77	Confident	52 Å²	52	79.6 Å²	79.6	54%	0.536	45%	0.447	S	S	.	.	H	α-helix	trans	-72.1	-25.2	177.9	0	0	0	0	0	114.6	V96 F97 T98 M125	V96-G100 PolarHBondContact O-N 3.37Å; F97-G100 PolarHBondContact O-N 2.88Å; F97-G100 VanDerWaalsContact O-N 3.11Å; T98-G100 VanDerWaalsContact C-N 3.28Å; T98-G100 PolarHBondContact O-N 3.44Å; G100-M125 VanDerWaalsContact N-CE 3.26Å
101	I	83.4	Confident	75	Confident	112 Å²	112	79.7 Å²	79.7	57%	0.574	45%	0.449	S	S	*	.	H	α-helix	trans	-91.8	-12.3	176.4	61.5	170.9	0	0	0	113	F97 T98 A99 T103	F97-I101 PolarHBondContact O-N 2.68Å; T98-I101 WeakPolarHBondContact O-CG1 3.4Å; T98-I101 PolarHBondContact O-N 2.99Å; A99-I101 VanDerWaalsContact C-N 3.35Å; I101-T103 PolarHBondContact O-N 2.71Å
102	D	76.3	Confident	73.2	Confident	54 Å²	54	85.8 Å²	85.8	29%	0.289	49%	0.488	S	S	.	.			trans	-78.7	109.6	-179.4	-170.8	-5.4	0	0	0	110.3	T98 A99 N104 V105 R128	T98-D102 PolarHBondContact O-N 2.98Å; A99-D102 PolarHBondContact O-N 3.33Å; D102-N104 PolarHBondContact O-N 2.94Å; D102-N104 WeakPolarHBondContact OD1-CB 3.3Å; D102-N104 PolarHBondContact OD1-N 3.45Å; D102-V105 HydrophobicContact CB-CG1 4.37Å; D102-V105 VanDerWaalsContact O-CG2 3.27Å; D102-V105 WeakPolarHBondContact O-CG2 3.23Å; D102-R128 IonicContact OD2-NH1 3.63Å; D102-R128 PolarHBondContact OD2-NH1 3.36Å
103	T	63.6	Low	71.2	Confident	119 Å²	119	93 Å²	93	73%	0.73	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.7	-3.3	179.9	57.9	0	0	0	0	113.6	I101	I101-T103 PolarHBondContact O-N 2.71Å
104	N	63	Low	69.3	Low	110 Å²	110	99.7 Å²	99.7	59%	0.588	53%	0.533	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.9	-2.9	176.9	-78.6	-84.8	0	0	0	114.2	D102 G106	D102-N104 PolarHBondContact O-N 2.94Å; D102-N104 WeakPolarHBondContact OD1-CB 3.3Å; D102-N104 PolarHBondContact OD1-N 3.45Å; N104-G106 VanDerWaalsContact C-N 3.29Å; N104-G106 PolarHBondContact O-N 2.96Å
105	V	60.3	Low	67.6	Low	31 Å²	31	100.6 Å²	100.6	19%	0.188	55%	0.548	C	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	78	179.6	-61.2	0	0	0	0	111.3	D102 V121	D102-V105 HydrophobicContact CB-CG1 4.37Å; D102-V105 VanDerWaalsContact O-CG2 3.27Å; D102-V105 WeakPolarHBondContact O-CG2 3.23Å; V105-V121 HydrophobicContact CB-CG1 4.34Å; V105-V121 HydrophobicContact CG2-CG1 4.05Å
106	G	53.9	Low	66.2	Low	37 Å²	37	103.3 Å²	103.3	38%	0.381	57%	0.565	S	S	.	*	T	Hydrogen-bonded Turn	trans	145.2	-0.2	172.4	0	0	0	0	0	118.2	N104 D108	N104-G106 VanDerWaalsContact C-N 3.29Å; N104-G106 PolarHBondContact O-N 2.96Å; G106-D108 PolarHBondContact O-N 3.47Å
107	F	54.7	Low	65.3	Low	170 Å²	170	103.1 Å²	103.1	75%	0.746	57%	0.565	S	S	*	*			trans	-91.4	88.7	174.7	-70.7	-75.2	0	0	0	110.5	P109	F107-P109 WeakPolarHBondContact O-CD 3.19Å
108	D	55.8	Low	64.3	Low	118 Å²	118	100.3 Å²	100.3	63%	0.631	57%	0.567	S	S	*	*			trans	-74.9	121.7	166	-123.6	-63.4	0	0	0	109	G106 K110 D111	G106-D108 PolarHBondContact O-N 3.47Å; D108-K110 PolarHBondContact O-N 3.19Å; D108-D111 PolarHBondContact O-N 3.49Å
109	P	57.9	Low	63.7	Low	131 Å²	131	108.5 Å²	108.5	85%	0.851	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	-12.5	-177.1	-21.7	31.6	0	0	0	114.7	F107	F107-P109 WeakPolarHBondContact O-CD 3.19Å
110	K	57.8	Low	63.4	Low	181 Å²	181	114 Å²	114	79%	0.787	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.7	-22.8	-175.9	-99.5	177.2	174.7	177.2	0	114.6	D108	D108-K110 PolarHBondContact O-N 3.19Å
111	D	52.6	Low	63.1	Low	112 Å²	112	113 Å²	113	60%	0.599	60%	0.602	S	S	*	*			trans	-150.8	92.2	-177.1	-76.7	-58.5	0	0	0	112.2	D108 L113	D108-D111 PolarHBondContact O-N 3.49Å; D111-L113 PolarHBondContact O-N 2.92Å; D111-L113 VanDerWaalsContact O-N 3.08Å
112	P	56.2	Low	62.9	Low	127 Å²	127	113.8 Å²	113.8	83%	0.825	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.5	2.1	-173.4	27.9	-33.7	0	0	0	115.3
113	L	51.7	Low	63.2	Low	169 Å²	169	118.8 Å²	118.8	89%	0.885	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.8	-0.5	-172.6	-145.1	77.4	0	0	0	114.4	D111 T115	D111-L113 PolarHBondContact O-N 2.92Å; D111-L113 VanDerWaalsContact O-N 3.08Å; L113-T115 PolarHBondContact O-N 3.4Å
114	R	54.7	Low	64.1	Low	204 Å²	204	115.8 Å²	115.8	77%	0.77	61%	0.605	S	S	*	*			trans	-83.4	99.9	171	-94.9	-100.4	145.6	87.4	-4.6	107.5	P116	R114-P116 VanDerWaalsContact O-CD 3.3Å; R114-P116 WeakPolarHBondContact O-CD 3.24Å
115	T	55.7	Low	65	Low	126 Å²	126	112.2 Å²	112.2	77%	0.773	59%	0.586	S	S	*	*			trans	-51.5	114.9	163.8	35.4	0	0	0	0	107.2	L113 T117	L113-T115 PolarHBondContact O-N 3.4Å; T115-T117 PolarHBondContact O-N 3.28Å; T115-T117 VanDerWaalsContact O-N 3.16Å
116	P	60.8	Low	66.2	Low	57 Å²	57	112.5 Å²	112.5	37%	0.37	60%	0.595	S	S	.	*			trans	-60.6	127.4	-177.4	26.6	-35.3	0	0	0	107	R114 A118 V121	R114-P116 VanDerWaalsContact O-CD 3.3Å; R114-P116 WeakPolarHBondContact O-CD 3.24Å; P116-A118 PolarHBondContact O-N 3.35Å; P116-V121 HydrophobicContact CB-CG2 3.66Å; P116-V121 HydrophobicContact CG-CG2 3.83Å
117	T	68.9	Low	67.9	Low	74 Å²	74	117.2 Å²	117.2	45%	0.454	61%	0.607	S	S	.	*			trans	-58.2	136.1	-178.7	-49.5	0	0	0	0	107.1	T115 R119 E120 V121	T115-T117 PolarHBondContact O-N 3.28Å; T115-T117 VanDerWaalsContact O-N 3.16Å; T117-R119 HydrophobicContact CG2-CB 4.13Å; T117-R119 HydrophobicContact CG2-CG 4.5Å; T117-R119 PolarHBondContact O-N 3.05Å; T117-E120 WeakPolarHBondContact CB-OE2 3.32Å; T117-E120 PolarHBondContact N-OE2 3.38Å; T117-E120 VanDerWaalsContact N-OE2 3.09Å; T117-E120 WeakPolarHBondContact O-CA 3.26Å; T117-E120 WeakPolarHBondContact O-CB 3.49Å; T117-E120 PolarHBondContact O-N 2.92Å; T117-E120 PolarHBondContact OG1-OE2 3.45Å; T117-V121 PolarHBondContact O-N 2.98Å; T117-V121 VanDerWaalsContact O-N 3.16Å
118	A	69.6	Low	69.3	Low	81 Å²	81	112.7 Å²	112.7	67%	0.669	59%	0.585	S	S	*	*	H	α-helix	trans	-51.4	-27	178.5	0	0	0	0	0	112.7	P116 L122	P116-A118 PolarHBondContact O-N 3.35Å; A118-L122 WeakPolarHBondContact O-CB 3.28Å; A118-L122 PolarHBondContact O-N 3.07Å
119	R	74.2	Confident	71	Confident	210 Å²	210	107.2 Å²	107.2	79%	0.792	56%	0.557	S	S	*	*	H	α-helix	trans	-70.3	-36.3	173.2	-68.4	-174.2	171.1	-166.1	-2.3	114.6	T117 K123	T117-R119 HydrophobicContact CG2-CB 4.13Å; T117-R119 HydrophobicContact CG2-CG 4.5Å; T117-R119 PolarHBondContact O-N 3.05Å; R119-K123 VanDerWaalsContact O-CB 3.26Å; R119-K123 WeakPolarHBondContact O-CB 3.23Å; R119-K123 PolarHBondContact O-N 3.46Å
120	E	78.4	Confident	72.6	Confident	119 Å²	119	105.2 Å²	105.2	56%	0.556	54%	0.537	S	S	*	.	H	α-helix	trans	-72.7	-43.6	177.7	-75.5	160	156	0	0	110.5	T117 L122 K123 D124	T117-E120 WeakPolarHBondContact CB-OE2 3.32Å; T117-E120 PolarHBondContact N-OE2 3.38Å; T117-E120 VanDerWaalsContact N-OE2 3.09Å; T117-E120 WeakPolarHBondContact O-CA 3.26Å; T117-E120 WeakPolarHBondContact O-CB 3.49Å; T117-E120 PolarHBondContact O-N 2.92Å; T117-E120 PolarHBondContact OG1-OE2 3.45Å; E120-L122 PolarHBondContact O-N 3.35Å; E120-K123 PolarHBondContact O-N 2.86Å; E120-D124 PolarHBondContact O-N 3.5Å
121	V	75.6	Confident	74.3	Confident	32 Å²	32	99.2 Å²	99.2	19%	0.194	52%	0.517	C	S	.	.	H	α-helix	trans	-59.2	-49.2	172.9	-177.5	0	0	0	0	110.2	V105 P116 T117 K123 D124 M125	V105-V121 HydrophobicContact CB-CG1 4.34Å; V105-V121 HydrophobicContact CG2-CG1 4.05Å; P116-V121 HydrophobicContact CB-CG2 3.66Å; P116-V121 HydrophobicContact CG-CG2 3.83Å; T117-V121 PolarHBondContact O-N 2.98Å; T117-V121 VanDerWaalsContact O-N 3.16Å; V121-K123 PolarHBondContact O-N 3.32Å; V121-D124 PolarHBondContact O-N 2.94Å; V121-M125 HydrophobicContact CG1-CG 4.17Å; V121-M125 HydrophobicContact CG1-SD 3.85Å; V121-M125 WeakPolarHBondContact O-CB 3.29Å; V121-M125 WeakPolarHBondContact O-CG 3.43Å; V121-M125 PolarHBondContact O-N 3Å
122	L	79	Confident	76.3	Confident	128 Å²	128	98.1 Å²	98.1	67%	0.67	51%	0.506	S	S	*	.	H	α-helix	trans	-63.5	-31.9	179.7	-159	118.2	0	0	0	112.5	A118 E120 G126	A118-L122 WeakPolarHBondContact O-CB 3.28Å; A118-L122 PolarHBondContact O-N 3.07Å; E120-L122 PolarHBondContact O-N 3.35Å; L122-G126 PolarHBondContact O-N 3Å
123	K	83.3	Confident	78.2	Confident	159 Å²	159	92.1 Å²	92.1	69%	0.691	47%	0.467	S	S	*	.	H	α-helix	trans	-70.4	-42.8	175.3	-173.2	173.8	179.4	172.8	0	111.9	R119 E120 V121 G126 Q127	R119-K123 VanDerWaalsContact O-CB 3.26Å; R119-K123 WeakPolarHBondContact O-CB 3.23Å; R119-K123 PolarHBondContact O-N 3.46Å; E120-K123 PolarHBondContact O-N 2.86Å; V121-K123 PolarHBondContact O-N 3.32Å; K123-G126 PolarHBondContact O-N 2.96Å; K123-Q127 WeakPolarHBondContact O-CB 3.11Å; K123-Q127 PolarHBondContact O-N 2.96Å
124	D	82.1	Confident	80.3	Confident	55 Å²	55	89.9 Å²	89.9	29%	0.294	45%	0.45	S	S	.	.	H	α-helix	trans	-67.7	-44	176.6	-168.4	35.8	0	0	0	111.3	E120 V121 G126 Q127 R128	E120-D124 PolarHBondContact O-N 3.5Å; V121-D124 PolarHBondContact O-N 2.94Å; D124-G126 VanDerWaalsContact C-N 3.31Å; D124-G126 PolarHBondContact O-N 3.03Å; D124-Q127 PolarHBondContact O-N 3.34Å; D124-R128 WeakPolarHBondContact O-CG 3.39Å; D124-R128 PolarHBondContact O-N 2.62Å; D124-R128 IonicContact OD1-NE 3.3Å; D124-R128 IonicContact OD2-CZ 2.8Å; D124-R128 VanDerWaalsContact OD2-CZ 3.3Å; D124-R128 IonicContact OD2-NE 2.76Å; D124-R128 PolarHBondContact OD2-NE 3.46Å; D124-R128 VanDerWaalsContact OD2-NE 3.17Å; D124-R128 IonicContact OD2-NH2 2.78Å; D124-R128 PolarHBondContact OD2-NH2 2.93Å
125	M	82.7	Confident	82.2	Confident	36 Å²	36	84.9 Å²	84.9	18%	0.177	44%	0.438	C	S	.	.	H	α-helix	trans	-58.2	-43.3	172.5	-66.2	177.3	93.7	0	0	111.8	A99 G100 V121 R128 G129	A99-M125 VanDerWaalsContact C-CE 3.44Å; A99-M125 HydrophobicContact CB-CB 3.94Å; A99-M125 HydrophobicContact CB-CE 4Å; A99-M125 HydrophobicContact CB-CG 3.87Å; G100-M125 VanDerWaalsContact N-CE 3.26Å; V121-M125 HydrophobicContact CG1-CG 4.17Å; V121-M125 HydrophobicContact CG1-SD 3.85Å; V121-M125 WeakPolarHBondContact O-CB 3.29Å; V121-M125 WeakPolarHBondContact O-CG 3.43Å; V121-M125 PolarHBondContact O-N 3Å; M125-R128 PolarHBondContact O-N 2.93Å; M125-G129 PolarHBondContact O-N 3.03Å
126	G	85.6	Confident	84.1	Confident	36 Å²	36	82.6 Å²	82.6	37%	0.371	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-39.1	177	0	0	0	0	0	112.8	L122 K123 D124 G129 M130	L122-G126 PolarHBondContact O-N 3Å; K123-G126 PolarHBondContact O-N 2.96Å; D124-G126 VanDerWaalsContact C-N 3.31Å; D124-G126 PolarHBondContact O-N 3.03Å; G126-G129 PolarHBondContact O-N 2.95Å; G126-M130 VanDerWaalsContact O-CB 3.23Å; G126-M130 WeakPolarHBondContact O-CB 3.36Å; G126-M130 PolarHBondContact O-N 2.89Å
127	Q	87.9	Confident	85.8	Confident	136 Å²	136	80.2 Å²	80.2	64%	0.636	40%	0.403	S	S	*	.	H	α-helix	trans	-65.4	-44	176.1	-176.2	178	-35.1	0	0	111.5	K123 D124 M130 S131	K123-Q127 WeakPolarHBondContact O-CB 3.11Å; K123-Q127 PolarHBondContact O-N 2.96Å; D124-Q127 PolarHBondContact O-N 3.34Å; Q127-M130 PolarHBondContact O-N 3.34Å; Q127-S131 PolarHBondContact O-N 3.09Å; Q127-S131 VanDerWaalsContact O-N 3.11Å
128	R	85.1	Confident	87.1	Confident	75 Å²	75	81 Å²	81	28%	0.283	40%	0.404	S	S	.	.	H	α-helix	trans	-64	-47	174.7	-65.8	177	-166.7	-160	6.5	111.1	D102 D124 M125 M130 S131 Y132	D102-R128 IonicContact OD2-NH1 3.63Å; D102-R128 PolarHBondContact OD2-NH1 3.36Å; D124-R128 WeakPolarHBondContact O-CG 3.39Å; D124-R128 PolarHBondContact O-N 2.62Å; D124-R128 IonicContact OD1-NE 3.3Å; D124-R128 IonicContact OD2-CZ 2.8Å; D124-R128 VanDerWaalsContact OD2-CZ 3.3Å; D124-R128 IonicContact OD2-NE 2.76Å; D124-R128 PolarHBondContact OD2-NE 3.46Å; D124-R128 VanDerWaalsContact OD2-NE 3.17Å; D124-R128 IonicContact OD2-NH2 2.78Å; D124-R128 PolarHBondContact OD2-NH2 2.93Å; M125-R128 PolarHBondContact O-N 2.93Å; R128-M130 VanDerWaalsContact C-N 3.32Å; R128-M130 PolarHBondContact O-N 2.04Å; R128-S131 WeakPolarHBondContact O-CB 3.36Å; R128-S131 PolarHBondContact O-N 2.9Å; R128-S131 VanDerWaalsContact O-N 3.08Å; R128-S131 PolarHBondContact O-OG 3.37Å; R128-Y132 VanDerWaalsContact O-CD2 3.25Å; R128-Y132 WeakPolarHBondContact O-CD2 3.41Å; R128-Y132 PolarHBondContact O-N 3.45Å; R128-Y132 VanDerWaalsContact O-N 3.14Å
129	G	91	Very high	88.3	Confident	4 Å²	4	79.1 Å²	79.1	4%	0.041	38%	0.384	C	S	.	.	H	α-helix	trans	-57.1	-42.9	175.4	0	0	0	0	0	112.9	M125 G126 S131 Y132 A133	M125-G129 PolarHBondContact O-N 3.03Å; G126-G129 PolarHBondContact O-N 2.95Å; G129-S131 VanDerWaalsContact C-N 3.31Å; G129-S131 PolarHBondContact O-N 3.47Å; G129-Y132 PolarHBondContact O-N 3.43Å; G129-A133 WeakPolarHBondContact O-CB 3.47Å; G129-A133 PolarHBondContact O-N 3.32Å
130	M	92.7	Very high	89.3	Confident	89 Å²	89	70.1 Å²	70.1	44%	0.438	36%	0.356	S	S	.	.	H	α-helix	trans	-62.5	-37.1	175.8	-176.1	64	67.9	0	0	112.3	F88 G126 Q127 R128 K134	F88-M130 HydrophobicContact CE2-SD 3.88Å; F88-M130 HydrophobicContact CZ-CE 4.29Å; F88-M130 HydrophobicContact CZ-SD 3.77Å; G126-M130 VanDerWaalsContact O-CB 3.23Å; G126-M130 WeakPolarHBondContact O-CB 3.36Å; G126-M130 PolarHBondContact O-N 2.89Å; Q127-M130 PolarHBondContact O-N 3.34Å; R128-M130 VanDerWaalsContact C-N 3.32Å; R128-M130 PolarHBondContact O-N 2.04Å; M130-K134 HydrophobicContact CG-CD 4.48Å; M130-K134 VanDerWaalsContact O-CG 3.31Å; M130-K134 WeakPolarHBondContact O-CG 3.36Å; M130-K134 PolarHBondContact O-N 3.05Å; M130-K134 VanDerWaalsContact O-N 3.08Å
131	S	93	Very high	90.2	Very high	54 Å²	54	65.4 Å²	65.4	38%	0.378	34%	0.337	S	S	.	.	H	α-helix	trans	-66.1	-42	176.2	78.5	0	0	0	0	111.8	Q127 R128 G129 K134 N135	Q127-S131 PolarHBondContact O-N 3.09Å; Q127-S131 VanDerWaalsContact O-N 3.11Å; R128-S131 WeakPolarHBondContact O-CB 3.36Å; R128-S131 PolarHBondContact O-N 2.9Å; R128-S131 VanDerWaalsContact O-N 3.08Å; R128-S131 PolarHBondContact O-OG 3.37Å; G129-S131 VanDerWaalsContact C-N 3.31Å; G129-S131 PolarHBondContact O-N 3.47Å; S131-K134 PolarHBondContact O-N 2.92Å; S131-N135 PolarHBondContact O-N 3.47Å; S131-N135 PolarHBondContact O-ND2 3.19Å
132	Y	94.1	Very high	91.1	Very high	90 Å²	90	68.8 Å²	68.8	35%	0.353	35%	0.352	S	S	.	.	H	α-helix	trans	-65.5	-47.1	175	-69.1	-57.4	0	0	0	111.6	G91 R128 G129 K134 N135 F136	G91-Y132 WeakPolarHBondContact O-CB 3.23Å; R128-Y132 VanDerWaalsContact O-CD2 3.25Å; R128-Y132 WeakPolarHBondContact O-CD2 3.41Å; R128-Y132 PolarHBondContact O-N 3.45Å; R128-Y132 VanDerWaalsContact O-N 3.14Å; G129-Y132 PolarHBondContact O-N 3.43Å; Y132-K134 VanDerWaalsContact C-N 3.29Å; Y132-K134 PolarHBondContact O-N 3.03Å; Y132-N135 PolarHBondContact O-N 3.46Å; Y132-N135 VanDerWaalsContact O-N 3.08Å; Y132-F136 WeakPolarHBondContact O-CD2 3.37Å; Y132-F136 PolarHBondContact O-N 3.46Å
133	A	95.9	Very high	91.9	Very high	1 Å²	1	65.5 Å²	65.5	1%	0.008	33%	0.333	C	S	.	.	H	α-helix	trans	-52.2	-46.8	176.6	0	0	0	0	0	112	F88 G129 N135 A137	F88-A133 HydrophobicContact CD1-CB 4.4Å; F88-A133 HydrophobicContact CD2-CB 3.57Å; F88-A133 HydrophobicContact CE1-CB 4.36Å; F88-A133 HydrophobicContact CE2-CB 3.53Å; F88-A133 HydrophobicContact CG-CB 4.02Å; F88-A133 HydrophobicContact CZ-CB 3.95Å; F88-A133 WeakPolarHBondContact O-CB 3.33Å; G129-A133 WeakPolarHBondContact O-CB 3.47Å; G129-A133 PolarHBondContact O-N 3.32Å; A133-N135 PolarHBondContact O-N 3.49Å; A133-A137 WeakPolarHBondContact O-CB 3.26Å; A133-A137 PolarHBondContact O-N 3.35Å
134	K	96.1	Very high	92.5	Very high	122 Å²	122	58.8 Å²	58.8	53%	0.53	31%	0.306	S	S	.	.	H	α-helix	trans	-62.3	-43.1	177.3	-73.3	174.6	-179.6	-179.1	0	112.8	M130 S131 Y132 A137 I138	M130-K134 HydrophobicContact CG-CD 4.48Å; M130-K134 VanDerWaalsContact O-CG 3.31Å; M130-K134 WeakPolarHBondContact O-CG 3.36Å; M130-K134 PolarHBondContact O-N 3.05Å; M130-K134 VanDerWaalsContact O-N 3.08Å; S131-K134 PolarHBondContact O-N 2.92Å; Y132-K134 VanDerWaalsContact C-N 3.29Å; Y132-K134 PolarHBondContact O-N 3.03Å; K134-A137 PolarHBondContact O-N 3.35Å; K134-I138 WeakPolarHBondContact O-CD1 3.14Å; K134-I138 VanDerWaalsContact O-CG1 3.27Å; K134-I138 WeakPolarHBondContact O-CG1 3.16Å; K134-I138 PolarHBondContact O-N 3.31Å
135	N	94.8	Very high	93.2	Very high	98 Å²	98	58.1 Å²	58.1	52%	0.524	31%	0.305	S	S	.	.	H	α-helix	trans	-64.9	-47.3	179.4	-75.5	-60.4	0	0	0	111.7	S131 Y132 A133 A137 I138 V139	S131-N135 PolarHBondContact O-N 3.47Å; S131-N135 PolarHBondContact O-ND2 3.19Å; Y132-N135 PolarHBondContact O-N 3.46Å; Y132-N135 VanDerWaalsContact O-N 3.08Å; A133-N135 PolarHBondContact O-N 3.49Å; N135-A137 VanDerWaalsContact C-N 3.34Å; N135-A137 PolarHBondContact O-N 2.97Å; N135-I138 PolarHBondContact O-N 3.06Å; N135-V139 VanDerWaalsContact O-CG2 3.3Å; N135-V139 WeakPolarHBondContact O-CG2 3.19Å; N135-V139 PolarHBondContact O-N 3.15Å
136	F	95.4	Very high	93.8	Very high	79 Å²	79	57.7 Å²	57.7	35%	0.346	30%	0.304	S	S	.	.	H	α-helix	trans	-65.6	-36.7	177.3	-83.2	-87.2	0	0	0	112.6	G87 L90 F94 Y132 V139 G140	G87-F136 WeakPolarHBondContact O-CB 3.38Å; L90-F136 HydrophobicContact CD2-CD1 4.23Å; L90-F136 HydrophobicContact CD2-CE1 4.31Å; F94-F136 HydrophobicContact CD1-CE2 4.12Å; F94-F136 HydrophobicContact CD1-CZ 4.36Å; Y132-F136 WeakPolarHBondContact O-CD2 3.37Å; Y132-F136 PolarHBondContact O-N 3.46Å; F136-V139 PolarHBondContact O-N 2.83Å; F136-G140 PolarHBondContact O-N 3.25Å
137	A	96.6	Very high	94.2	Very high	6 Å²	6	58.8 Å²	58.8	5%	0.05	30%	0.3	C	S	.	.	H	α-helix	trans	-60	-47	174.1	0	0	0	0	0	111.8	C84 F88 A133 K134 N135 G140 A141	C84-A137 WeakPolarHBondContact O-CB 3.34Å; F88-A137 HydrophobicContact CB-CB 3.92Å; F88-A137 HydrophobicContact CD2-CB 4.33Å; A133-A137 WeakPolarHBondContact O-CB 3.26Å; A133-A137 PolarHBondContact O-N 3.35Å; K134-A137 PolarHBondContact O-N 3.35Å; N135-A137 VanDerWaalsContact C-N 3.34Å; N135-A137 PolarHBondContact O-N 2.97Å; A137-G140 PolarHBondContact O-N 3.24Å; A137-A141 VanDerWaalsContact O-CB 3.26Å; A137-A141 WeakPolarHBondContact O-CB 3.39Å; A137-A141 PolarHBondContact O-N 2.93Å
138	I	95.5	Very high	94.5	Very high	92 Å²	92	52.6 Å²	52.6	47%	0.472	27%	0.271	S	S	.	.	H	α-helix	trans	-63.6	-45.6	178.6	-68.4	164.9	0	0	0	110.9	K134 N135 A141 M142	K134-I138 WeakPolarHBondContact O-CD1 3.14Å; K134-I138 VanDerWaalsContact O-CG1 3.27Å; K134-I138 WeakPolarHBondContact O-CG1 3.16Å; K134-I138 PolarHBondContact O-N 3.31Å; N135-I138 PolarHBondContact O-N 3.06Å; I138-A141 PolarHBondContact O-N 2.93Å; I138-M142 HydrophobicContact CG2-CG 4.37Å; I138-M142 WeakPolarHBondContact O-CB 3.05Å; I138-M142 VanDerWaalsContact O-CG 3.26Å; I138-M142 WeakPolarHBondContact O-CG 3.3Å; I138-M142 PolarHBondContact O-N 3.18Å
139	V	94.9	Very high	95	Very high	41 Å²	41	53.7 Å²	53.7	25%	0.248	28%	0.282	C	S	.	.	H	α-helix	trans	-61.6	-48.1	178.8	173.7	0	0	0	0	110.8	N135 F136 M142 F143 I173 F189	N135-V139 VanDerWaalsContact O-CG2 3.3Å; N135-V139 WeakPolarHBondContact O-CG2 3.19Å; N135-V139 PolarHBondContact O-N 3.15Å; F136-V139 PolarHBondContact O-N 2.83Å; V139-M142 PolarHBondContact O-N 3.22Å; V139-F143 WeakPolarHBondContact O-CB 3.26Å; V139-F143 PolarHBondContact O-N 3.03Å; V139-I173 HydrophobicContact CG2-CD1 3.68Å; V139-F189 HydrophobicContact CG1-CE1 3.74Å; V139-F189 HydrophobicContact CG1-CZ 4.27Å
140	G	95.4	Very high	95.2	Very high	20 Å²	20	55 Å²	55	21%	0.206	29%	0.288	C	S	.	.	H	α-helix	trans	-62.7	-42.7	179.1	0	0	0	0	0	112.8	A83 F136 A137 F143 S144	A83-G140 WeakPolarHBondContact CB-O 3.25Å; F136-G140 PolarHBondContact O-N 3.25Å; A137-G140 PolarHBondContact O-N 3.24Å; G140-F143 PolarHBondContact O-N 3.21Å; G140-S144 WeakPolarHBondContact O-CB 3.03Å; G140-S144 PolarHBondContact O-N 3.07Å
141	A	96.5	Very high	95.3	Very high	21 Å²	21	53.5 Å²	53.5	17%	0.174	28%	0.279	C	S	.	.	H	α-helix	trans	-62.2	-46.6	176.2	0	0	0	0	0	112	C84 A137 I138 C145	C84-A141 HydrophobicContact CB-CB 3.88Å; A137-A141 VanDerWaalsContact O-CB 3.26Å; A137-A141 WeakPolarHBondContact O-CB 3.39Å; A137-A141 PolarHBondContact O-N 2.93Å; I138-A141 PolarHBondContact O-N 2.93Å; A141-C145 WeakPolarHBondContact O-CB 3.24Å; A141-C145 PolarHBondContact O-N 2.99Å
142	M	95.6	Very high	95.2	Very high	103 Å²	103	55 Å²	55	51%	0.507	29%	0.29	S	S	.	.	H	α-helix	trans	-66	-40.5	-179.8	-73.4	-69.9	166.8	0	0	112.1	I138 V139 T146 T169	I138-M142 HydrophobicContact CG2-CG 4.37Å; I138-M142 WeakPolarHBondContact O-CB 3.05Å; I138-M142 VanDerWaalsContact O-CG 3.26Å; I138-M142 WeakPolarHBondContact O-CG 3.3Å; I138-M142 PolarHBondContact O-N 3.18Å; V139-M142 PolarHBondContact O-N 3.22Å; M142-T146 VanDerWaalsContact O-CB 3.26Å; M142-T146 WeakPolarHBondContact O-CB 3.3Å; M142-T146 PolarHBondContact O-N 3.32Å; M142-T146 PolarHBondContact O-OG1 2.91Å; M142-T169 HydrophobicContact CB-CG2 3.65Å
143	F	96.1	Very high	95.2	Very high	58 Å²	58	58.6 Å²	58.6	25%	0.254	31%	0.31	S	S	.	.	H	α-helix	trans	-61.6	-54	177.3	179.2	-97.5	0	0	0	111.3	V139 G140 C145 T146 E147 A162 S165 T169 S193	V139-F143 WeakPolarHBondContact O-CB 3.26Å; V139-F143 PolarHBondContact O-N 3.03Å; G140-F143 PolarHBondContact O-N 3.21Å; F143-C145 PolarHBondContact O-N 2.66Å; F143-T146 PolarHBondContact O-N 2.88Å; F143-E147 WeakPolarHBondContact O-CB 3.4Å; F143-E147 PolarHBondContact O-N 3.47Å; F143-A162 HydrophobicContact CZ-CB 4.39Å; F143-S165 WeakPolarHBondContact CE2-OG 3.38Å; F143-T169 WeakPolarHBondContact CA-OG1 3.47Å; F143-S193 WeakPolarHBondContact CE2-OG 3.17Å
144	S	96.1	Very high	95.2	Very high	18 Å²	18	63.1 Å²	63.1	13%	0.126	33%	0.327	C	S	.	.	H	α-helix	trans	-65.3	-38.7	-178.6	-176	0	0	0	0	112.8	K79 G140 C148	K79-S144 PolarHBondContact O-OG 2.95Å; G140-S144 WeakPolarHBondContact O-CB 3.03Å; G140-S144 PolarHBondContact O-N 3.07Å; S144-C148 WeakPolarHBondContact O-CB 3.45Å; S144-C148 PolarHBondContact O-N 3.33Å
145	C	95.3	Very high	95	Very high	42 Å²	42	60.5 Å²	60.5	28%	0.284	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-49.8	175.8	-170.5	0	0	0	0	111.3	S80 A141 F143 E147 C148 I149	S80-C145 WeakPolarHBondContact OG-CA 3.42Å; S80-C145 WeakPolarHBondContact OG-CB 3.47Å; S80-C145 PolarHBondContact OG-N 3.48Å; A141-C145 WeakPolarHBondContact O-CB 3.24Å; A141-C145 PolarHBondContact O-N 2.99Å; F143-C145 PolarHBondContact O-N 2.66Å; C145-E147 PolarHBondContact O-N 3.27Å; C145-C148 PolarHBondContact O-N 3.45Å; C145-I149 VanDerWaalsContact O-CG1 3.28Å; C145-I149 WeakPolarHBondContact O-CG1 3.27Å; C145-I149 PolarHBondContact O-N 2.96Å
146	T	96	Very high	95	Very high	26 Å²	26	62.1 Å²	62.1	16%	0.16	34%	0.337	C	S	.	.	H	α-helix	trans	-66.1	-41.9	-176.8	-53.9	0	0	0	0	111.2	M142 F143 I149 I150 V168	M142-T146 VanDerWaalsContact O-CB 3.26Å; M142-T146 WeakPolarHBondContact O-CB 3.3Å; M142-T146 PolarHBondContact O-N 3.32Å; M142-T146 PolarHBondContact O-OG1 2.91Å; F143-T146 PolarHBondContact O-N 2.88Å; T146-I149 PolarHBondContact O-N 3.07Å; T146-I150 HydrophobicContact CG2-CD1 3.82Å; T146-I150 HydrophobicContact CG2-CG1 4.45Å; T146-I150 WeakPolarHBondContact O-CB 3.26Å; T146-I150 VanDerWaalsContact O-CG1 3.24Å; T146-I150 WeakPolarHBondContact O-CG1 3.23Å; T146-I150 PolarHBondContact O-N 3.08Å; T146-V168 HydrophobicContact CG2-CB 3.96Å; T146-V168 HydrophobicContact CG2-CG1 3.81Å
147	E	94.8	Very high	94.7	Very high	60 Å²	60	62.8 Å²	62.8	28%	0.28	35%	0.351	S	S	.	.	H	α-helix	trans	-59.2	-49.3	175.3	-171.7	-171	172.5	0	0	111.3	F143 C145 I149 I150 E151 N161	F143-E147 WeakPolarHBondContact O-CB 3.4Å; F143-E147 PolarHBondContact O-N 3.47Å; C145-E147 PolarHBondContact O-N 3.27Å; E147-I149 VanDerWaalsContact C-N 3.32Å; E147-I149 PolarHBondContact O-N 3.03Å; E147-I150 PolarHBondContact O-N 3.28Å; E147-E151 WeakPolarHBondContact O-CB 3.49Å; E147-E151 PolarHBondContact O-N 3.13Å; E147-N161 HydrophobicContact CG-CB 4.47Å
148	C	94.4	Very high	94.5	Very high	5 Å²	5	65.6 Å²	65.6	3%	0.034	37%	0.365	C	S	.	.	H	α-helix	trans	-62.3	-38	179.6	-177.1	0	0	0	0	112.6	C76 S144 C145 S152	C76-C148 WeakPolarHBondContact CA-SG 3.45Å; C76-C148 HydrophobicContact CB-CB 3.63Å; C76-C148 WeakPolarHBondContact CB-SG 3.49Å; C76-C148 VanDerWaalsContact SG-C 3.58Å; C76-C148 WeakPolarHBondContact SG-CB 3.43Å; C76-C148 CovalentContact SG-SG 2.04Å; C76-C148 PolarHBondContact SG-SG 2.78Å; S144-C148 WeakPolarHBondContact O-CB 3.45Å; S144-C148 PolarHBondContact O-N 3.33Å; C145-C148 PolarHBondContact O-N 3.45Å; C148-S152 VanDerWaalsContact O-CB 3.23Å; C148-S152 WeakPolarHBondContact O-CB 3.48Å; C148-S152 PolarHBondContact O-N 2.83Å; C148-S152 PolarHBondContact O-OG 3.48Å
149	I	95	Very high	94.4	Very high	99 Å²	99	67.9 Å²	67.9	51%	0.508	37%	0.368	S	S	.	.	H	α-helix	trans	-65.3	-44.8	175.5	-68.7	166	0	0	0	110.7	C145 T146 E147 S152 H153	C145-I149 VanDerWaalsContact O-CG1 3.28Å; C145-I149 WeakPolarHBondContact O-CG1 3.27Å; C145-I149 PolarHBondContact O-N 2.96Å; T146-I149 PolarHBondContact O-N 3.07Å; E147-I149 VanDerWaalsContact C-N 3.32Å; E147-I149 PolarHBondContact O-N 3.03Å; I149-S152 PolarHBondContact O-N 2.83Å; I149-H153 WeakPolarHBondContact O-CB 3.39Å; I149-H153 PolarHBondContact O-N 3.39Å
150	I	94.8	Very high	94.3	Very high	32 Å²	32	70 Å²	70	16%	0.164	37%	0.374	C	S	.	.	H	α-helix	trans	-65.1	-44	178.9	-68.7	169	0	0	0	110.6	T146 E147 H153 R154 N161	T146-I150 HydrophobicContact CG2-CD1 3.82Å; T146-I150 HydrophobicContact CG2-CG1 4.45Å; T146-I150 WeakPolarHBondContact O-CB 3.26Å; T146-I150 VanDerWaalsContact O-CG1 3.24Å; T146-I150 WeakPolarHBondContact O-CG1 3.23Å; T146-I150 PolarHBondContact O-N 3.08Å; E147-I150 PolarHBondContact O-N 3.28Å; I150-H153 PolarHBondContact O-N 3.5Å; I150-R154 HydrophobicContact CG2-CG 4.41Å; I150-R154 WeakPolarHBondContact O-CB 3.34Å; I150-R154 WeakPolarHBondContact O-CG 3.33Å; I150-R154 PolarHBondContact O-N 2.66Å; I150-N161 HydrophobicContact CG2-CB 4.32Å
151	E	94.5	Very high	94.2	Very high	56 Å²	56	69.1 Å²	69.1	26%	0.262	37%	0.365	S	S	.	.	H	α-helix	trans	-61.5	-46.7	177	-173.4	-178.2	-172.2	0	0	110.9	E147 H153 R154 G155 S157	E147-E151 WeakPolarHBondContact O-CB 3.49Å; E147-E151 PolarHBondContact O-N 3.13Å; E151-H153 VanDerWaalsContact C-N 3.3Å; E151-H153 PolarHBondContact O-N 2.81Å; E151-R154 PolarHBondContact O-N 3.19Å; E151-G155 WeakPolarHBondContact O-CA 3.18Å; E151-G155 PolarHBondContact O-N 3.48Å; E151-S157 WeakPolarHBondContact OE1-CB 3.43Å
152	S	92.6	Very high	94.1	Very high	86 Å²	86	68.3 Å²	68.3	60%	0.601	36%	0.358	S	S	*	.	H	α-helix	trans	-61.7	-38	177.4	-60.3	0	0	0	0	112.1	C148 I149	C148-S152 VanDerWaalsContact O-CB 3.23Å; C148-S152 WeakPolarHBondContact O-CB 3.48Å; C148-S152 PolarHBondContact O-N 2.83Å; C148-S152 PolarHBondContact O-OG 3.48Å; I149-S152 PolarHBondContact O-N 2.83Å
153	H	94.1	Very high	94.1	Very high	165 Å²	165	64.9 Å²	64.9	76%	0.764	34%	0.342	S	S	*	.	H	α-helix	trans	-73.9	-36.8	178.1	-177.7	-85.4	0	0	0	112.7	I149 I150 E151	I149-H153 WeakPolarHBondContact O-CB 3.39Å; I149-H153 PolarHBondContact O-N 3.39Å; I150-H153 PolarHBondContact O-N 3.5Å; E151-H153 VanDerWaalsContact C-N 3.3Å; E151-H153 PolarHBondContact O-N 2.81Å
154	R	93.9	Very high	94.1	Very high	96 Å²	96	68 Å²	68	36%	0.362	35%	0.353	S	S	.	.	H	α-helix	trans	-88	-21.7	-177.7	-67.2	-175.8	72.3	-142	-7.1	113.6	I150 E151 K156 N161	I150-R154 HydrophobicContact CG2-CG 4.41Å; I150-R154 WeakPolarHBondContact O-CB 3.34Å; I150-R154 WeakPolarHBondContact O-CG 3.33Å; I150-R154 PolarHBondContact O-N 2.66Å; E151-R154 PolarHBondContact O-N 3.19Å; R154-K156 PolarHBondContact O-N 3.08Å; R154-N161 PolarHBondContact NH1-OD1 3.49Å
155	G	93.3	Very high	94.1	Very high	67 Å²	67	67.1 Å²	67.1	69%	0.691	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	63.4	23	-175.6	0	0	0	0	0	113.9	E151	E151-G155 WeakPolarHBondContact O-CA 3.18Å; E151-G155 PolarHBondContact O-N 3.48Å
156	K	93.3	Very high	94.1	Very high	133 Å²	133	65.1 Å²	65.1	58%	0.578	33%	0.334	S	S	*	.			trans	-142	135.8	-179.3	-65.5	-170.9	179.5	-173.9	0	110.1	R154 N161	R154-K156 PolarHBondContact O-N 3.08Å; K156-N161 PolarHBondContact O-ND2 2.84Å
157	S	90.8	Very high	94.2	Very high	92 Å²	92	65.5 Å²	65.5	64%	0.643	34%	0.337	S	S	*	.			trans	-97	100	171.5	53.9	0	0	0	0	110.2	E151	E151-S157 WeakPolarHBondContact OE1-CB 3.43Å
158	D	92.6	Very high	94.3	Very high	66 Å²	66	66.3 Å²	66.3	35%	0.353	35%	0.346	S	S	.	.			trans	-128.4	158.3	178.6	-65.3	-56.7	0	0	0	110.2	K160 N161	D158-K160 PolarHBondContact O-N 3.22Å; D158-N161 PolarHBondContact N-ND2 3.26Å; D158-N161 WeakPolarHBondContact O-CB 3.42Å; D158-N161 PolarHBondContact O-N 3.14Å
159	W	91.7	Very high	94.3	Very high	139 Å²	139	66.3 Å²	66.3	53%	0.527	35%	0.346	S	S	.	.	H	α-helix	trans	-52.8	-27.2	173.3	63.3	-89.3	0	0	0	114	N161 A162 V163 E197	W159-N161 PolarHBondContact O-N 3.47Å; W159-A162 PolarHBondContact O-N 2.91Å; W159-V163 HydrophobicContact CE3-CG2 4.05Å; W159-V163 HydrophobicContact CZ3-CG2 4.34Å; W159-V163 WeakPolarHBondContact O-CG2 3.39Å; W159-V163 PolarHBondContact O-N 3.38Å; W159-E197 HydrophobicContact CB-CG 3.58Å
160	K	93.8	Very high	94.3	Very high	86 Å²	86	61.6 Å²	61.6	37%	0.374	32%	0.322	S	S	.	.	H	α-helix	trans	-62.8	-31.7	176.5	-62.2	179.8	-176.3	175.6	0	112.3	D158 A162 V163 Y164	D158-K160 PolarHBondContact O-N 3.22Å; K160-A162 VanDerWaalsContact C-N 3.34Å; K160-V163 PolarHBondContact O-N 2.93Å; K160-Y164 HydrophobicContact CB-CD2 4.25Å; K160-Y164 HydrophobicContact CB-CE2 3.83Å; K160-Y164 WeakPolarHBondContact O-CB 3.35Å; K160-Y164 WeakPolarHBondContact O-CD2 3.18Å; K160-Y164 VanDerWaalsContact O-CG 3.27Å; K160-Y164 PolarHBondContact O-N 3.21Å
161	N	93.8	Very high	94.3	Very high	2 Å²	2	60.8 Å²	60.8	1%	0.011	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-43.1	179.6	-62.6	-11.8	0	0	0	110.6	E147 I150 R154 K156 D158 W159 V163 Y164 S165	E147-N161 HydrophobicContact CG-CB 4.47Å; I150-N161 HydrophobicContact CG2-CB 4.32Å; R154-N161 PolarHBondContact NH1-OD1 3.49Å; K156-N161 PolarHBondContact O-ND2 2.84Å; D158-N161 PolarHBondContact N-ND2 3.26Å; D158-N161 WeakPolarHBondContact O-CB 3.42Å; D158-N161 PolarHBondContact O-N 3.14Å; W159-N161 PolarHBondContact O-N 3.47Å; N161-V163 PolarHBondContact O-N 3.47Å; N161-Y164 PolarHBondContact O-N 3.47Å; N161-S165 WeakPolarHBondContact O-CB 3.32Å; N161-S165 PolarHBondContact O-N 3.02Å; N161-S165 PolarHBondContact O-OG 3.05Å
162	A	93.7	Very high	94.4	Very high	4 Å²	4	61 Å²	61	3%	0.033	33%	0.333	C	S	.	.	H	α-helix	trans	-62.6	-40.1	174.9	0	0	0	0	0	112.2	F143 W159 K160 S165 G166 S193	F143-A162 HydrophobicContact CZ-CB 4.39Å; W159-A162 PolarHBondContact O-N 2.91Å; K160-A162 VanDerWaalsContact C-N 3.34Å; A162-S165 WeakPolarHBondContact CA-OG 3.31Å; A162-S165 PolarHBondContact O-OG 3.27Å; A162-G166 PolarHBondContact O-N 2.8Å; A162-S193 VanDerWaalsContact O-CB 3.23Å; A162-S193 WeakPolarHBondContact O-CB 3.23Å; A162-S193 PolarHBondContact O-OG 2.91Å
163	V	96.1	Very high	94.4	Very high	30 Å²	30	60 Å²	60	18%	0.182	32%	0.32	C	S	.	.	H	α-helix	trans	-67.6	-43.5	177.6	-179.9	0	0	0	0	111.6	W159 K160 N161 G166 C167 A190 A194	W159-V163 HydrophobicContact CE3-CG2 4.05Å; W159-V163 HydrophobicContact CZ3-CG2 4.34Å; W159-V163 WeakPolarHBondContact O-CG2 3.39Å; W159-V163 PolarHBondContact O-N 3.38Å; K160-V163 PolarHBondContact O-N 2.93Å; N161-V163 PolarHBondContact O-N 3.47Å; V163-G166 PolarHBondContact O-N 2.79Å; V163-C167 PolarHBondContact O-N 3.35Å; V163-A190 HydrophobicContact CG1-CB 3.89Å; V163-A194 HydrophobicContact CG2-CB 3.76Å
164	Y	96.1	Very high	94.3	Very high	123 Å²	123	52.8 Å²	52.8	48%	0.482	29%	0.29	S	S	.	.	H	α-helix	trans	-66.8	-44.8	177.4	-65.7	-43.2	0	0	0	111.9	K160 N161 G166 C167 V168	K160-Y164 HydrophobicContact CB-CD2 4.25Å; K160-Y164 HydrophobicContact CB-CE2 3.83Å; K160-Y164 WeakPolarHBondContact O-CB 3.35Å; K160-Y164 WeakPolarHBondContact O-CD2 3.18Å; K160-Y164 VanDerWaalsContact O-CG 3.27Å; K160-Y164 PolarHBondContact O-N 3.21Å; N161-Y164 PolarHBondContact O-N 3.47Å; Y164-G166 VanDerWaalsContact C-N 3.32Å; Y164-G166 PolarHBondContact O-N 2.92Å; Y164-C167 PolarHBondContact O-N 2.86Å; Y164-V168 WeakPolarHBondContact O-CB 3.18Å; Y164-V168 VanDerWaalsContact O-CG2 3.28Å; Y164-V168 WeakPolarHBondContact O-CG2 3.47Å; Y164-V168 PolarHBondContact O-N 3.29Å
165	S	95.9	Very high	94.3	Very high	0 Å²	0	54.2 Å²	54.2	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-64.3	-38.5	176.9	63	0	0	0	0	111.7	F143 N161 A162 V168 T169	F143-S165 WeakPolarHBondContact CE2-OG 3.38Å; N161-S165 WeakPolarHBondContact O-CB 3.32Å; N161-S165 PolarHBondContact O-N 3.02Å; N161-S165 PolarHBondContact O-OG 3.05Å; A162-S165 WeakPolarHBondContact CA-OG 3.31Å; A162-S165 PolarHBondContact O-OG 3.27Å; S165-V168 PolarHBondContact O-N 3Å; S165-T169 VanDerWaalsContact O-CB 3.24Å; S165-T169 WeakPolarHBondContact O-CB 3.41Å; S165-T169 PolarHBondContact O-N 2.95Å; S165-T169 PolarHBondContact O-OG1 3.28Å
166	G	95.8	Very high	94.1	Very high	0 Å²	0	61.9 Å²	61.9	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-58.1	-54.7	171.4	0	0	0	0	0	111.8	A162 V163 Y164 V168 T169 G170 F189	A162-G166 PolarHBondContact O-N 2.8Å; V163-G166 PolarHBondContact O-N 2.79Å; Y164-G166 VanDerWaalsContact C-N 3.32Å; Y164-G166 PolarHBondContact O-N 2.92Å; G166-V168 PolarHBondContact O-N 2.93Å; G166-T169 PolarHBondContact O-N 2.84Å; G166-G170 PolarHBondContact O-N 3.26Å; G166-F189 WeakPolarHBondContact O-CB 3.4Å
167	C	97.1	Very high	94.1	Very high	35 Å²	35	59.7 Å²	59.7	24%	0.236	31%	0.314	C	S	.	.	H	α-helix	trans	-57.3	-46.7	177.8	169.6	0	0	0	0	112.5	V163 Y164 G171 C186 A190	V163-C167 PolarHBondContact O-N 3.35Å; Y164-C167 PolarHBondContact O-N 2.86Å; C167-G171 WeakPolarHBondContact O-CA 3.42Å; C167-G171 PolarHBondContact O-N 3.45Å; C167-C186 HydrophobicContact CB-CB 4.07Å; C167-C186 WeakPolarHBondContact CB-SG 3.37Å; C167-C186 WeakPolarHBondContact O-CA 3.47Å; C167-C186 WeakPolarHBondContact O-CB 3.43Å; C167-C186 WeakPolarHBondContact SG-CB 3.08Å; C167-C186 CovalentContact SG-SG 2.04Å; C167-C186 PolarHBondContact SG-SG 3.45Å; C167-A190 HydrophobicContact CB-CB 4.08Å
168	V	96.4	Very high	94.2	Very high	77 Å²	77	56.8 Å²	56.8	47%	0.467	30%	0.299	S	S	.	.	H	α-helix	trans	-64.6	-44.3	-178.6	170.7	0	0	0	0	110.7	T146 Y164 S165 G166 A172	T146-V168 HydrophobicContact CG2-CB 3.96Å; T146-V168 HydrophobicContact CG2-CG1 3.81Å; Y164-V168 WeakPolarHBondContact O-CB 3.18Å; Y164-V168 VanDerWaalsContact O-CG2 3.28Å; Y164-V168 WeakPolarHBondContact O-CG2 3.47Å; Y164-V168 PolarHBondContact O-N 3.29Å; S165-V168 PolarHBondContact O-N 3Å; G166-V168 PolarHBondContact O-N 2.93Å; V168-A172 WeakPolarHBondContact O-CB 3.33Å; V168-A172 PolarHBondContact O-N 3.42Å
169	T	95.5	Very high	94.4	Very high	4 Å²	4	59.4 Å²	59.4	3%	0.025	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-51	179.5	-56.7	0	0	0	0	111.2	M142 F143 S165 G166 G171 A172 I173	M142-T169 HydrophobicContact CB-CG2 3.65Å; F143-T169 WeakPolarHBondContact CA-OG1 3.47Å; S165-T169 VanDerWaalsContact O-CB 3.24Å; S165-T169 WeakPolarHBondContact O-CB 3.41Å; S165-T169 PolarHBondContact O-N 2.95Å; S165-T169 PolarHBondContact O-OG1 3.28Å; G166-T169 PolarHBondContact O-N 2.84Å; T169-G171 VanDerWaalsContact C-N 3.33Å; T169-G171 PolarHBondContact O-N 3Å; T169-A172 PolarHBondContact O-N 3.49Å; T169-I173 HydrophobicContact CG2-CD1 3.98Å; T169-I173 VanDerWaalsContact O-CG1 3.3Å; T169-I173 WeakPolarHBondContact O-CG1 3.3Å; T169-I173 PolarHBondContact O-N 3.08Å
170	G	94.3	Very high	94.5	Very high	1 Å²	1	61.9 Å²	61.9	1%	0.01	33%	0.327	C	S	.	.	H	α-helix	trans	-64.9	-37.3	178.7	0	0	0	0	0	112.8	G166 G174 F189	G166-G170 PolarHBondContact O-N 3.26Å; G170-G174 PolarHBondContact O-N 3.47Å; G170-F189 VanDerWaalsContact CA-CD2 3.5Å
171	G	95.5	Very high	94.6	Very high	14 Å²	14	59.5 Å²	59.5	14%	0.144	32%	0.323	C	S	.	.	H	α-helix	trans	-65.5	-48.2	175	0	0	0	0	0	112.2	C167 T169 I173 G174 F175 G182	C167-G171 WeakPolarHBondContact O-CA 3.42Å; C167-G171 PolarHBondContact O-N 3.45Å; T169-G171 VanDerWaalsContact C-N 3.33Å; T169-G171 PolarHBondContact O-N 3Å; G171-I173 VanDerWaalsContact C-N 3.35Å; G171-I173 PolarHBondContact O-N 3.11Å; G171-G174 PolarHBondContact O-N 2.83Å; G171-F175 VanDerWaalsContact O-CB 3.23Å; G171-F175 WeakPolarHBondContact O-CB 3.36Å; G171-F175 PolarHBondContact O-N 2.96Å; G171-G182 WeakPolarHBondContact CA-O 3.4Å
172	A	95.1	Very high	94.6	Very high	62 Å²	62	59.7 Å²	59.7	51%	0.512	33%	0.325	S	S	.	.	H	α-helix	trans	-63.3	-39.7	179.7	0	0	0	0	0	112.5	V168 T169	V168-A172 WeakPolarHBondContact O-CB 3.33Å; V168-A172 PolarHBondContact O-N 3.42Å; T169-A172 PolarHBondContact O-N 3.49Å
173	I	92.9	Very high	94.8	Very high	63 Å²	63	64.2 Å²	64.2	32%	0.323	35%	0.353	S	S	.	.	H	α-helix	trans	-71.7	-46.9	177	-64.9	172.5	0	0	0	110.4	V139 T169 G171 F175 R176	V139-I173 HydrophobicContact CG2-CD1 3.68Å; T169-I173 HydrophobicContact CG2-CD1 3.98Å; T169-I173 VanDerWaalsContact O-CG1 3.3Å; T169-I173 WeakPolarHBondContact O-CG1 3.3Å; T169-I173 PolarHBondContact O-N 3.08Å; G171-I173 VanDerWaalsContact C-N 3.35Å; G171-I173 PolarHBondContact O-N 3.11Å; I173-F175 VanDerWaalsContact C-N 3.31Å; I173-F175 PolarHBondContact O-N 3.43Å; I173-R176 WeakPolarHBondContact O-CB 3.32Å; I173-R176 WeakPolarHBondContact O-CG 3.25Å; I173-R176 PolarHBondContact O-N 3.41Å
174	G	92.1	Very high	94.8	Very high	14 Å²	14	69.5 Å²	69.5	14%	0.144	38%	0.379	C	S	.	.	H	α-helix	trans	-65.2	-31.9	-179.8	0	0	0	0	0	113.4	G170 G171 R176 A177 G178 A181 G182	G170-G174 PolarHBondContact O-N 3.47Å; G171-G174 PolarHBondContact O-N 2.83Å; G174-R176 PolarHBondContact O-N 3.37Å; G174-R176 VanDerWaalsContact O-N 3.16Å; G174-A177 PolarHBondContact O-N 3.45Å; G174-G178 PolarHBondContact O-N 2.85Å; G174-A181 WeakPolarHBondContact O-CB 3.48Å; G174-G182 PolarHBondContact O-N 3.35Å
175	F	94.3	Very high	94.8	Very high	127 Å²	127	64.3 Å²	64.3	56%	0.557	36%	0.363	S	S	*	.	H	α-helix	trans	-61.9	-25.3	179.5	-163.1	-96.4	0	0	0	112.8	G171 I173 A177 G178 L179	G171-F175 VanDerWaalsContact O-CB 3.23Å; G171-F175 WeakPolarHBondContact O-CB 3.36Å; G171-F175 PolarHBondContact O-N 2.96Å; I173-F175 VanDerWaalsContact C-N 3.31Å; I173-F175 PolarHBondContact O-N 3.43Å; F175-A177 PolarHBondContact O-N 2.89Å; F175-G178 WeakPolarHBondContact O-CA 3.43Å; F175-G178 PolarHBondContact O-N 3.3Å; F175-L179 HydrophobicContact CD2-CD1 4.24Å; F175-L179 HydrophobicContact CE2-CB 4.21Å; F175-L179 HydrophobicContact CE2-CD1 3.68Å
176	R	90.4	Very high	94.9	Very high	228 Å²	228	66 Å²	66	86%	0.86	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.2	-26.7	174.2	-55.6	173.7	93.5	95.3	-3.2	112.2	I173 G174	I173-R176 WeakPolarHBondContact O-CB 3.32Å; I173-R176 WeakPolarHBondContact O-CG 3.25Å; I173-R176 PolarHBondContact O-N 3.41Å; G174-R176 PolarHBondContact O-N 3.37Å; G174-R176 VanDerWaalsContact O-N 3.16Å
177	A	91.4	Very high	95	Very high	86 Å²	86	68 Å²	68	71%	0.711	40%	0.395	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.1	2.1	173.8	0	0	0	0	0	113	G174 F175 A181	G174-A177 PolarHBondContact O-N 3.45Å; F175-A177 PolarHBondContact O-N 2.89Å; A177-A181 HydrophobicContact CB-CB 3.9Å
178	G	94.8	Very high	94.9	Very high	32 Å²	32	68.3 Å²	68.3	33%	0.33	41%	0.405	S	S	.	.			trans	118.3	165.4	177.7	0	0	0	0	0	114.1	G174 F175 K180 A181 G182	G174-G178 PolarHBondContact O-N 2.85Å; F175-G178 WeakPolarHBondContact O-CA 3.43Å; F175-G178 PolarHBondContact O-N 3.3Å; G178-K180 PolarHBondContact O-N 3.02Å; G178-A181 PolarHBondContact O-N 3.48Å; G178-G182 PolarHBondContact O-N 3.45Å
179	L	95.2	Very high	94.9	Very high	120 Å²	120	67.9 Å²	67.9	63%	0.628	40%	0.396	S	S	*	.	H	α-helix	trans	-59.2	-42.1	-175.6	177.7	65.2	0	0	0	113	F175 A181 G182 V183	F175-L179 HydrophobicContact CD2-CD1 4.24Å; F175-L179 HydrophobicContact CE2-CB 4.21Å; F175-L179 HydrophobicContact CE2-CD1 3.68Å; L179-A181 VanDerWaalsContact C-N 3.34Å; L179-A181 PolarHBondContact O-N 3.41Å; L179-G182 PolarHBondContact O-N 3.11Å; L179-V183 HydrophobicContact CD1-CG2 4.44Å; L179-V183 PolarHBondContact O-N 3.3Å
180	K	94.9	Very high	95	Very high	191 Å²	191	68.4 Å²	68.4	83%	0.83	40%	0.402	S	S	*	.	H	α-helix	trans	-61.8	-42.2	178.2	-67.7	-175	179.2	-177.8	0	111.8	G178 G182 V183 L184	G178-K180 PolarHBondContact O-N 3.02Å; K180-G182 VanDerWaalsContact C-N 3.34Å; K180-V183 PolarHBondContact O-N 3.23Å; K180-L184 WeakPolarHBondContact O-CB 3.37Å; K180-L184 PolarHBondContact O-N 3Å; K180-L184 VanDerWaalsContact O-N 3.09Å
181	A	94.8	Very high	95.1	Very high	36 Å²	36	71.4 Å²	71.4	30%	0.298	43%	0.426	S	S	.	.	H	α-helix	trans	-68	-35	176	0	0	0	0	0	111.7	G174 A177 G178 L179 G185	G174-A181 WeakPolarHBondContact O-CB 3.48Å; A177-A181 HydrophobicContact CB-CB 3.9Å; G178-A181 PolarHBondContact O-N 3.48Å; L179-A181 VanDerWaalsContact C-N 3.34Å; L179-A181 PolarHBondContact O-N 3.41Å; A181-G185 WeakPolarHBondContact O-CA 3.35Å; A181-G185 PolarHBondContact O-N 3.46Å
182	G	95.4	Very high	95.1	Very high	6 Å²	6	76.8 Å²	76.8	6%	0.062	45%	0.446	C	S	.	.	H	α-helix	trans	-62.8	-46.3	173.1	0	0	0	0	0	113.3	G171 G174 G178 L179 K180 G185 C186	G171-G182 WeakPolarHBondContact CA-O 3.4Å; G174-G182 PolarHBondContact O-N 3.35Å; G178-G182 PolarHBondContact O-N 3.45Å; L179-G182 PolarHBondContact O-N 3.11Å; K180-G182 VanDerWaalsContact C-N 3.34Å; G182-G185 PolarHBondContact O-N 2.99Å; G182-C186 PolarHBondContact O-N 3.44Å
183	V	97.1	Very high	95.1	Very high	100 Å²	100	74.2 Å²	74.2	61%	0.606	42%	0.424	S	S	*	.	H	α-helix	trans	-65.1	-44.9	178.1	176.2	0	0	0	0	111.1	L179 K180 G185 C186 G187	L179-V183 HydrophobicContact CD1-CG2 4.44Å; L179-V183 PolarHBondContact O-N 3.3Å; K180-V183 PolarHBondContact O-N 3.23Å; V183-G185 VanDerWaalsContact C-N 3.32Å; V183-G185 PolarHBondContact O-N 2.96Å; V183-C186 PolarHBondContact O-N 3.49Å; V183-G187 PolarHBondContact O-N 3.41Å
184	L	96.6	Very high	95.2	Very high	140 Å²	140	72.9 Å²	72.9	73%	0.733	42%	0.423	S	S	*	.	H	α-helix	trans	-63.6	-40.2	176	-170.9	69.8	0	0	0	111.5	K180 G187 G188	K180-L184 WeakPolarHBondContact O-CB 3.37Å; K180-L184 PolarHBondContact O-N 3Å; K180-L184 VanDerWaalsContact O-N 3.09Å; L184-G187 PolarHBondContact O-N 2.76Å; L184-G188 PolarHBondContact O-N 2.85Å
185	G	95.9	Very high	95.5	Very high	15 Å²	15	74.9 Å²	74.9	16%	0.155	44%	0.437	C	S	.	.	H	α-helix	trans	-62.7	-44.1	176.5	0	0	0	0	0	112.4	A181 G182 V183 F189	A181-G185 WeakPolarHBondContact O-CA 3.35Å; A181-G185 PolarHBondContact O-N 3.46Å; G182-G185 PolarHBondContact O-N 2.99Å; V183-G185 VanDerWaalsContact C-N 3.32Å; V183-G185 PolarHBondContact O-N 2.96Å; G185-F189 WeakPolarHBondContact O-CB 3.34Å; G185-F189 WeakPolarHBondContact O-CD2 3.31Å; G185-F189 PolarHBondContact O-N 2.92Å
186	C	97	Very high	95.5	Very high	35 Å²	35	72.1 Å²	72.1	24%	0.236	43%	0.428	C	S	.	.	H	α-helix	trans	-59.5	-50.6	173.4	158.4	0	0	0	0	111	C167 G182 V183 G188 A190	C167-C186 HydrophobicContact CB-CB 4.07Å; C167-C186 WeakPolarHBondContact CB-SG 3.37Å; C167-C186 WeakPolarHBondContact O-CA 3.47Å; C167-C186 WeakPolarHBondContact O-CB 3.43Å; C167-C186 WeakPolarHBondContact SG-CB 3.08Å; C167-C186 CovalentContact SG-SG 2.04Å; C167-C186 PolarHBondContact SG-SG 3.45Å; G182-C186 PolarHBondContact O-N 3.44Å; V183-C186 PolarHBondContact O-N 3.49Å; C186-G188 PolarHBondContact O-N 3.17Å; C186-A190 WeakPolarHBondContact O-CB 3.37Å; C186-A190 PolarHBondContact O-N 3.2Å
187	G	97.6	Very high	95.6	Very high	41 Å²	41	63.9 Å²	63.9	42%	0.423	40%	0.399	S	S	.	.	H	α-helix	trans	-61	-44.8	-179.6	0	0	0	0	0	113	V183 L184 A191	V183-G187 PolarHBondContact O-N 3.41Å; L184-G187 PolarHBondContact O-N 2.76Å; G187-A191 WeakPolarHBondContact O-CB 3.47Å; G187-A191 PolarHBondContact O-N 3.19Å
188	G	96.7	Very high	95.7	Very high	43 Å²	43	69.3 Å²	69.3	44%	0.443	40%	0.403	S	S	.	.	H	α-helix	trans	-64.8	-48.9	179.6	0	0	0	0	0	113	L184 C186 A191 F192	L184-G188 PolarHBondContact O-N 2.85Å; C186-G188 PolarHBondContact O-N 3.17Å; G188-A191 PolarHBondContact O-N 2.93Å; G188-F192 WeakPolarHBondContact O-CB 3.37Å; G188-F192 PolarHBondContact O-N 3.35Å
189	F	95.8	Very high	95.7	Very high	67 Å²	67	76.7 Å²	76.7	29%	0.294	42%	0.422	S	S	.	.	H	α-helix	trans	-68.9	-36.8	178.2	-86.4	-104.8	0	0	0	112.3	V139 G166 G170 G185 A191 F192 S193	V139-F189 HydrophobicContact CG1-CE1 3.74Å; V139-F189 HydrophobicContact CG1-CZ 4.27Å; G166-F189 WeakPolarHBondContact O-CB 3.4Å; G170-F189 VanDerWaalsContact CA-CD2 3.5Å; G185-F189 WeakPolarHBondContact O-CB 3.34Å; G185-F189 WeakPolarHBondContact O-CD2 3.31Å; G185-F189 PolarHBondContact O-N 2.92Å; F189-A191 PolarHBondContact O-N 2.91Å; F189-F192 PolarHBondContact O-N 3.08Å; F189-S193 WeakPolarHBondContact O-CB 3.27Å; F189-S193 PolarHBondContact O-N 3.02Å; F189-S193 PolarHBondContact O-OG 2.86Å; F189-S193 VanDerWaalsContact O-OG 3.05Å
190	A	97	Very high	95.6	Very high	16 Å²	16	77 Å²	77	13%	0.132	42%	0.424	C	S	.	.	H	α-helix	trans	-59.7	-46.4	173.9	0	0	0	0	0	111.7	V163 C167 C186 A194	V163-A190 HydrophobicContact CG1-CB 3.89Å; C167-A190 HydrophobicContact CB-CB 4.08Å; C186-A190 WeakPolarHBondContact O-CB 3.37Å; C186-A190 PolarHBondContact O-N 3.2Å; A190-A194 WeakPolarHBondContact O-CB 3.21Å; A190-A194 PolarHBondContact O-N 3.38Å
191	A	97.1	Very high	95	Very high	63 Å²	63	79 Å²	79	52%	0.521	43%	0.426	S	S	.	.	H	α-helix	trans	-65.4	-43.1	177.6	0	0	0	0	0	111.8	G187 G188 F189 A194 A195	G187-A191 WeakPolarHBondContact O-CB 3.47Å; G187-A191 PolarHBondContact O-N 3.19Å; G188-A191 PolarHBondContact O-N 2.93Å; F189-A191 PolarHBondContact O-N 2.91Å; A191-A194 PolarHBondContact O-N 2.9Å; A191-A195 WeakPolarHBondContact O-CB 3.42Å; A191-A195 PolarHBondContact O-N 3.39Å
192	F	95.3	Very high	95	Very high	127 Å²	127	81.2 Å²	81.2	56%	0.557	43%	0.432	S	S	*	.	H	α-helix	trans	-60.9	-48	176.1	175.7	-108.8	0	0	0	111.7	G188 F189 A194 A195 I196	G188-F192 WeakPolarHBondContact O-CB 3.37Å; G188-F192 PolarHBondContact O-N 3.35Å; F189-F192 PolarHBondContact O-N 3.08Å; F192-A194 VanDerWaalsContact C-N 3.35Å; F192-A194 PolarHBondContact O-N 3.5Å; F192-A195 PolarHBondContact O-N 3.16Å; F192-I196 HydrophobicContact CD2-CG1 4.28Å; F192-I196 HydrophobicContact CE1-CG1 4.08Å; F192-I196 HydrophobicContact CE2-CD1 3.95Å; F192-I196 HydrophobicContact CE2-CG1 3.82Å; F192-I196 HydrophobicContact CZ-CD1 3.96Å; F192-I196 HydrophobicContact CZ-CG1 3.71Å; F192-I196 WeakPolarHBondContact O-CG1 3.37Å; F192-I196 PolarHBondContact O-N 3.3Å
193	S	95.2	Very high	95	Very high	8 Å²	8	85.1 Å²	85.1	6%	0.056	45%	0.452	C	S	.	.	H	α-helix	trans	-62.5	-40.4	177	-64.2	0	0	0	0	112.1	F143 A162 F189 A195 I196 E197	F143-S193 WeakPolarHBondContact CE2-OG 3.17Å; A162-S193 VanDerWaalsContact O-CB 3.23Å; A162-S193 WeakPolarHBondContact O-CB 3.23Å; A162-S193 PolarHBondContact O-OG 2.91Å; F189-S193 WeakPolarHBondContact O-CB 3.27Å; F189-S193 PolarHBondContact O-N 3.02Å; F189-S193 PolarHBondContact O-OG 2.86Å; F189-S193 VanDerWaalsContact O-OG 3.05Å; S193-A195 VanDerWaalsContact C-N 3.33Å; S193-A195 PolarHBondContact O-N 3.21Å; S193-I196 PolarHBondContact O-N 3.16Å; S193-E197 WeakPolarHBondContact O-CB 3.46Å; S193-E197 PolarHBondContact O-N 3.4Å
194	A	95.8	Very high	94.9	Very high	36 Å²	36	84.3 Å²	84.3	30%	0.298	44%	0.443	S	S	.	.	H	α-helix	trans	-61.4	-41.6	174.2	0	0	0	0	0	112.2	V163 A190 A191 F192 E197 Y198	V163-A194 HydrophobicContact CG2-CB 3.76Å; A190-A194 WeakPolarHBondContact O-CB 3.21Å; A190-A194 PolarHBondContact O-N 3.38Å; A191-A194 PolarHBondContact O-N 2.9Å; F192-A194 VanDerWaalsContact C-N 3.35Å; F192-A194 PolarHBondContact O-N 3.5Å; A194-E197 PolarHBondContact O-N 3.02Å; A194-Y198 WeakPolarHBondContact O-CB 3.26Å; A194-Y198 PolarHBondContact O-N 3.27Å
195	A	96.7	Very high	94.8	Very high	55 Å²	55	81 Å²	81	46%	0.455	43%	0.426	S	S	.	.	H	α-helix	trans	-67.7	-41.6	179.7	0	0	0	0	0	112.2	A191 F192 S193 Y198 Y199	A191-A195 WeakPolarHBondContact O-CB 3.42Å; A191-A195 PolarHBondContact O-N 3.39Å; F192-A195 PolarHBondContact O-N 3.16Å; S193-A195 VanDerWaalsContact C-N 3.33Å; S193-A195 PolarHBondContact O-N 3.21Å; A195-Y198 PolarHBondContact O-N 3.31Å; A195-Y199 WeakPolarHBondContact O-CB 3.18Å; A195-Y199 PolarHBondContact O-N 3.01Å
196	I	94.5	Very high	94.7	Very high	70 Å²	70	85.1 Å²	85.1	36%	0.359	44%	0.443	S	S	.	.	H	α-helix	trans	-63.8	-45.1	175.3	-67.2	-64.7	0	0	0	110.7	F192 S193 Y198 Y199 L200	F192-I196 HydrophobicContact CD2-CG1 4.28Å; F192-I196 HydrophobicContact CE1-CG1 4.08Å; F192-I196 HydrophobicContact CE2-CD1 3.95Å; F192-I196 HydrophobicContact CE2-CG1 3.82Å; F192-I196 HydrophobicContact CZ-CD1 3.96Å; F192-I196 HydrophobicContact CZ-CG1 3.71Å; F192-I196 WeakPolarHBondContact O-CG1 3.37Å; F192-I196 PolarHBondContact O-N 3.3Å; S193-I196 PolarHBondContact O-N 3.16Å; I196-Y198 VanDerWaalsContact C-N 3.28Å; I196-Y198 PolarHBondContact O-N 2.88Å; I196-Y199 PolarHBondContact O-N 2.77Å; I196-Y199 VanDerWaalsContact O-N 3.09Å; I196-L200 HydrophobicContact CG2-CD1 3.6Å; I196-L200 HydrophobicContact CG2-CG 4.17Å; I196-L200 WeakPolarHBondContact O-CB 3.3Å; I196-L200 WeakPolarHBondContact O-CG 3.49Å; I196-L200 PolarHBondContact O-N 2.87Å
197	E	92.1	Very high	94.6	Very high	55 Å²	55	88.5 Å²	88.5	26%	0.257	46%	0.457	S	S	.	.	H	α-helix	trans	-63	-36.7	177.3	-169.5	65.7	-166	0	0	111.8	W159 S193 A194 Y199 R201	W159-E197 HydrophobicContact CB-CG 3.58Å; S193-E197 WeakPolarHBondContact O-CB 3.46Å; S193-E197 PolarHBondContact O-N 3.4Å; A194-E197 PolarHBondContact O-N 3.02Å; E197-Y199 VanDerWaalsContact C-N 3.35Å; E197-R201 WeakPolarHBondContact O-CB 3.49Å; E197-R201 PolarHBondContact O-N 3.09Å
198	Y	94.7	Very high	94.3	Very high	200 Å²	200	91.9 Å²	91.9	78%	0.784	46%	0.459	S	S	*	.	H	α-helix	trans	-66.8	-35.2	173	179.7	-96.1	0	0	0	112.6	A194 A195 I196	A194-Y198 WeakPolarHBondContact O-CB 3.26Å; A194-Y198 PolarHBondContact O-N 3.27Å; A195-Y198 PolarHBondContact O-N 3.31Å; I196-Y198 VanDerWaalsContact C-N 3.28Å; I196-Y198 PolarHBondContact O-N 2.88Å
199	Y	95.4	Very high	94.2	Very high	187 Å²	187	95.6 Å²	95.6	73%	0.733	46%	0.46	S	S	*	.	H	α-helix	trans	-76.5	-35.9	179.6	177.6	-98.2	0	0	0	113.2	A195 I196 E197	A195-Y199 WeakPolarHBondContact O-CB 3.18Å; A195-Y199 PolarHBondContact O-N 3.01Å; I196-Y199 PolarHBondContact O-N 2.77Å; I196-Y199 VanDerWaalsContact O-N 3.09Å; E197-Y199 VanDerWaalsContact C-N 3.35Å
200	L	92.3	Very high	94	Very high	127 Å²	127	98 Å²	98	67%	0.665	47%	0.474	S	S	*	.	H	α-helix	trans	-86.9	-7.5	-176.6	-67.5	178.6	0	0	0	114	I196	I196-L200 HydrophobicContact CG2-CD1 3.6Å; I196-L200 HydrophobicContact CG2-CG 4.17Å; I196-L200 WeakPolarHBondContact O-CB 3.3Å; I196-L200 WeakPolarHBondContact O-CG 3.49Å; I196-L200 PolarHBondContact O-N 2.87Å
201	R	82.4	Confident	93.8	Very high	232 Å²	232	105.5 Å²	105.5	88%	0.875	51%	0.505	S	S	*	.			trans	-97.9	0	-178.3	-172.2	172.1	-169.7	88.2	6.1	112.3	E197	E197-R201 WeakPolarHBondContact O-CB 3.49Å; E197-R201 PolarHBondContact O-N 3.09Å

Retrieved 201 of 201 residues in 179 ms (Link to these results)

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