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Succinate dehydrogenase assembly factor 2, mitochondrial

Plays an essential role in the assembly of succinate dehydrogenase (SDH), an enzyme complex (also referred to as respiratory complex II) that is a component of both the tricarboxylic acid (TCA) cycle and the mitochondrial electron transport chain, and which couples the oxidation of succinate to fumarate with the reduction of ubiquinone (coenzyme Q) to ubiquinol. Required for flavinylation (covalent attachment of FAD) of the flavoprotein subunit SDHA of the SDH catalytic dimer.

AlphaFold DB , UniProt , Accession A0A096NGZ1, Species PAPAN (Papio anubis, Olive baboon), Gene SDHAF2, Length 166 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	38.1	Very low	43.1	Very low	248 Å²	248	137.7 Å²	137.7	100%	1.222	82%	0.822	S	S	*	*				0	116.2	0	-59.4	-74.2	-141.3	0	0	106.4
2	A	36.8	Very low	43.2	Very low	85 Å²	85	145.7 Å²	145.7	70%	0.702	83%	0.826	S	S	*	*			cis	-159.2	125.4	4.8	0	0	0	0	0	104.8
3	V	36.5	Very low	43.7	Very low	130 Å²	130	149.1 Å²	149.1	79%	0.788	84%	0.835	S	S	*	*				91	106.6	109.8	-177.9	0	0	0	0	113
4	S	42.6	Very low	43.5	Very low	112 Å²	112	149.7 Å²	149.7	78%	0.783	83%	0.834	S	S	*	*			trans	-55.9	140.7	163.9	-29.4	0	0	0	0	111.9
5	T	45.2	Very low	44.2	Very low	120 Å²	120	146.5 Å²	146.5	74%	0.736	83%	0.834	S	S	*	*			trans	-130.1	105.2	159	45.5	0	0	0	0	109.7
6	V	48.1	Very low	44	Very low	138 Å²	138	147.6 Å²	147.6	84%	0.836	84%	0.836	S	S	*	*			trans	-67.9	134.1	163.4	-98.7	0	0	0	0	109.2
7	F	41	Very low	44.3	Very low	193 Å²	193	143.6 Å²	143.6	85%	0.846	82%	0.82	S	S	*	*			trans	-130.1	120.8	158.5	-90.1	-81	0	0	0	110.5
8	S	48.1	Very low	44.7	Very low	111 Å²	111	149.3 Å²	149.3	78%	0.776	83%	0.826	S	S	*	*			trans	-91	129.8	176.9	-178.2	0	0	0	0	108.6
9	I	45.3	Very low	44.7	Very low	159 Å²	159	149.4 Å²	149.4	82%	0.815	82%	0.819	S	S	*	*			trans	-141.9	91.5	163.7	-54.9	-177.7	0	0	0	110.6
10	S	43.3	Very low	45	Very low	99 Å²	99	147.2 Å²	147.2	69%	0.692	82%	0.815	S	S	*	*			trans	24.2	116.9	131.1	-146.8	0	0	0	0	119.5	R12	S10-R12 PolarHBondContact O-N 3.2Å
11	S	49.3	Very low	45.1	Very low	120 Å²	120	147.7 Å²	147.7	84%	0.839	82%	0.816	S	S	*	*			trans	-51.2	124.6	163.3	-52.7	0	0	0	0	112.2
12	R	44.2	Very low	45.6	Very low	233 Å²	233	143.9 Å²	143.9	88%	0.879	80%	0.799	S	S	*	*			trans	-114.7	104.9	159.4	-79.5	-172.6	175.4	-144.7	-0.4	109	S10 L14	S10-R12 PolarHBondContact O-N 3.2Å; R12-L14 PolarHBondContact O-N 2.97Å
13	M	49.5	Very low	46.4	Very low	190 Å²	190	144.2 Å²	144.2	94%	0.936	80%	0.797	S	S	*	*			trans	-61.2	119.8	160.5	-82.6	-162.7	169.2	0	0	108.4
14	L	41.2	Very low	47	Very low	158 Å²	158	143.3 Å²	143.3	83%	0.827	79%	0.793	S	S	*	*			trans	-105.6	105.4	159.3	-73.7	172.3	0	0	0	107.1	R12 L16	R12-L14 PolarHBondContact O-N 2.97Å; L14-L16 PolarHBondContact O-N 3.44Å
15	A	54.3	Low	47.5	Very low	101 Å²	101	146.1 Å²	146.1	84%	0.835	80%	0.799	S	S	*	*			trans	-65.4	118.2	169.7	0	0	0	0	0	108.6
16	L	40.9	Very low	47.5	Very low	165 Å²	165	147.4 Å²	147.4	86%	0.864	80%	0.8	S	S	*	*			trans	-108.5	116.7	165.9	-81	163.8	0	0	0	109	L14	L14-L16 PolarHBondContact O-N 3.44Å
17	S	48.1	Very low	47.8	Very low	80 Å²	80	145.7 Å²	145.7	56%	0.559	80%	0.795	S	S	*	*			trans	-30.8	124.6	172.2	177.9	0	0	0	0	114.3	H19	S17-H19 PolarHBondContact O-N 3.28Å; S17-H19 VanDerWaalsContact O-N 3.12Å; S17-H19 PolarHBondContact OG-CE1 3.23Å; S17-H19 PolarHBondContact OG-NE2 3.04Å
18	R	51.7	Low	48.4	Very low	245 Å²	245	141.9 Å²	141.9	93%	0.925	79%	0.787	S	S	*	*			trans	-74.7	94.6	167.4	-71.5	-178.2	170	-141.8	-1.7	108.7	S20	R18-S20 PolarHBondContact O-N 2.91Å
19	H	44.5	Very low	48.7	Very low	151 Å²	151	140.5 Å²	140.5	70%	0.699	77%	0.774	S	S	*	*			trans	-78.3	97.2	162.9	-63.5	-67	0	0	0	108.4	S17 L21	S17-H19 PolarHBondContact O-N 3.28Å; S17-H19 VanDerWaalsContact O-N 3.12Å; S17-H19 PolarHBondContact OG-CE1 3.23Å; S17-H19 PolarHBondContact OG-NE2 3.04Å; H19-L21 PolarHBondContact O-N 2.82Å
20	S	52	Low	49.3	Very low	106 Å²	106	137.6 Å²	137.6	74%	0.741	77%	0.768	S	S	*	*			trans	-68.2	92.6	165.7	46	0	0	0	0	109	R18 L22	R18-S20 PolarHBondContact O-N 2.91Å; S20-L22 PolarHBondContact O-N 3.06Å
21	L	46.3	Very low	49.8	Very low	158 Å²	158	141.6 Å²	141.6	83%	0.827	77%	0.773	S	S	*	*			trans	-79.5	98.3	161.2	-62.3	-178.3	0	0	0	107.1	H19 S23	H19-L21 PolarHBondContact O-N 2.82Å; L21-S23 VanDerWaalsContact C-N 3.3Å; L21-S23 PolarHBondContact O-N 3.29Å
22	L	49.6	Very low	50.2	Low	167 Å²	167	145 Å²	145	87%	0.874	77%	0.767	S	S	*	*			trans	-64.7	96.6	162.8	-73.9	166.9	0	0	0	107.1	S20	S20-L22 PolarHBondContact O-N 3.06Å
23	S	53.3	Low	51	Low	93 Å²	93	145.7 Å²	145.7	65%	0.65	77%	0.77	S	S	*	*			trans	-69.2	130.2	165.1	42.7	0	0	0	0	108.2	L21 L25	L21-S23 VanDerWaalsContact C-N 3.3Å; L21-S23 PolarHBondContact O-N 3.29Å; S23-L25 PolarHBondContact O-N 3.31Å; S23-L25 VanDerWaalsContact O-N 3.15Å
24	P	47.7	Very low	51.6	Low	111 Å²	111	144.2 Å²	144.2	72%	0.721	76%	0.758	S	S	*	*			trans	-65.3	120.5	169.4	26.8	-28.4	0	0	0	106.6	L26	P24-L26 PolarHBondContact O-N 3.27Å
25	L	52.9	Low	52.9	Low	171 Å²	171	145.8 Å²	145.8	90%	0.895	76%	0.755	S	S	*	*			trans	-64.7	84.2	165.6	-71.8	168.3	0	0	0	107.3	S23 S27	S23-L25 PolarHBondContact O-N 3.31Å; S23-L25 VanDerWaalsContact O-N 3.15Å; L25-S27 PolarHBondContact O-N 2.73Å
26	L	46.8	Very low	53.6	Low	147 Å²	147	151 Å²	151	77%	0.77	75%	0.753	S	S	*	*			trans	-64.7	100.5	152.1	-75.5	169.1	0	0	0	104.7	P24 V28	P24-L26 PolarHBondContact O-N 3.27Å; L26-V28 HydrophobicContact CB-CG2 4.45Å; L26-V28 PolarHBondContact O-N 3.06Å
27	S	54.4	Low	54.9	Low	102 Å²	102	145.2 Å²	145.2	71%	0.713	73%	0.733	S	S	*	*			trans	-55.9	82.7	158.9	162	0	0	0	0	107	L25 T29	L25-S27 PolarHBondContact O-N 2.73Å; S27-T29 PolarHBondContact O-N 3.26Å
28	V	52.6	Low	56	Low	113 Å²	113	146.7 Å²	146.7	69%	0.685	74%	0.735	S	S	*	*			trans	-68.2	92.8	162.1	179.5	0	0	0	0	103.5	L26 S30	L26-V28 HydrophobicContact CB-CG2 4.45Å; L26-V28 PolarHBondContact O-N 3.06Å; V28-S30 PolarHBondContact O-N 3.26Å
29	T	55	Low	57	Low	82 Å²	82	138.8 Å²	138.8	50%	0.503	72%	0.717	S	S	.	*			trans	-55.2	98.6	158.2	47	0	0	0	0	104.7	S27 F31	S27-T29 PolarHBondContact O-N 3.26Å; T29-F31 WeakPolarHBondContact O-CD2 3.4Å; T29-F31 PolarHBondContact O-N 3.05Å; T29-F31 VanDerWaalsContact OG1-CE2 3.31Å; T29-F31 WeakPolarHBondContact OG1-CE2 3.43Å
30	S	57.4	Low	58.4	Low	98 Å²	98	137.2 Å²	137.2	69%	0.685	72%	0.72	S	S	*	*			trans	-60.7	96.2	165.1	-71.9	0	0	0	0	104.5	V28 R32	V28-S30 PolarHBondContact O-N 3.26Å; S30-R32 PolarHBondContact O-N 3.41Å
31	F	54.4	Low	59.1	Low	183 Å²	183	138.6 Å²	138.6	80%	0.803	73%	0.725	S	S	*	*			trans	-63.7	84.1	163	-67.4	-79.1	0	0	0	104.9	T29 R33	T29-F31 WeakPolarHBondContact O-CD2 3.4Å; T29-F31 PolarHBondContact O-N 3.05Å; T29-F31 VanDerWaalsContact OG1-CE2 3.31Å; T29-F31 WeakPolarHBondContact OG1-CE2 3.43Å; F31-R33 PolarHBondContact O-N 3.01Å
32	R	58	Low	60.3	Low	190 Å²	190	137.2 Å²	137.2	72%	0.717	72%	0.718	S	S	*	*			trans	-58.9	99.2	157.5	-74.2	-174.4	-177	-115.4	2.4	103.5	S30 F34	S30-R32 PolarHBondContact O-N 3.41Å; R32-F34 HydrophobicContact CB-CD2 3.68Å; R32-F34 HydrophobicContact CB-CE1 4.43Å; R32-F34 HydrophobicContact CB-CE2 3.34Å; R32-F34 HydrophobicContact CB-CG 4.37Å; R32-F34 HydrophobicContact CB-CZ 3.77Å; R32-F34 HydrophobicContact CG-CE2 4.17Å; R32-F34 HydrophobicContact CG-CZ 4.22Å; R32-F34 VanDerWaalsContact O-CD2 3.28Å; R32-F34 WeakPolarHBondContact O-CD2 3.4Å; R32-F34 PolarHBondContact O-N 2.88Å
33	R	59.9	Low	61.2	Low	248 Å²	248	133.5 Å²	133.5	94%	0.936	71%	0.706	S	S	*	*			trans	-68.1	79.7	169.1	-162.9	168.9	-152.6	174.7	4.9	105.7	F31 Y35	F31-R33 PolarHBondContact O-N 3.01Å; R33-Y35 PolarHBondContact O-N 3.36Å; R33-Y35 VanDerWaalsContact O-N 3.1Å
34	F	62.1	Low	61.8	Low	159 Å²	159	135.2 Å²	135.2	70%	0.697	70%	0.704	S	S	*	*			trans	-64.9	109.4	168.7	-69.9	-75.6	0	0	0	105.7	R32 R36	R32-F34 HydrophobicContact CB-CD2 3.68Å; R32-F34 HydrophobicContact CB-CE1 4.43Å; R32-F34 HydrophobicContact CB-CE2 3.34Å; R32-F34 HydrophobicContact CB-CG 4.37Å; R32-F34 HydrophobicContact CB-CZ 3.77Å; R32-F34 HydrophobicContact CG-CE2 4.17Å; R32-F34 HydrophobicContact CG-CZ 4.22Å; R32-F34 VanDerWaalsContact O-CD2 3.28Å; R32-F34 WeakPolarHBondContact O-CD2 3.4Å; R32-F34 PolarHBondContact O-N 2.88Å; F34-R36 PolarHBondContact O-N 3.5Å
35	Y	69.8	Low	62.6	Low	192 Å²	192	138.5 Å²	138.5	75%	0.753	71%	0.706	S	S	*	*			trans	-62.5	106.2	165	-174.6	-95.8	0	0	0	106.3	R33 G37	R33-Y35 PolarHBondContact O-N 3.36Å; R33-Y35 VanDerWaalsContact O-N 3.1Å; Y35-G37 PolarHBondContact O-N 3.06Å
36	R	68.4	Low	63	Low	210 Å²	210	137.1 Å²	137.1	79%	0.792	70%	0.7	S	S	*	*			trans	-75.8	-6	-173.3	-159.2	173.6	-169.2	-128.1	11.2	112.8	F34 D38	F34-R36 PolarHBondContact O-N 3.5Å; R36-D38 VanDerWaalsContact CD-OD2 3.25Å; R36-D38 WeakPolarHBondContact CD-OD2 3.36Å; R36-D38 WeakPolarHBondContact CG-OD2 3.33Å; R36-D38 IonicContact CZ-OD2 3.54Å; R36-D38 IonicContact NE-OD2 3.66Å; R36-D38 IonicContact NH1-OD2 2.79Å; R36-D38 PolarHBondContact NH1-OD2 3.32Å; R36-D38 PolarHBondContact O-N 3.06Å; R36-D38 VanDerWaalsContact O-N 3.08Å
37	G	68.1	Low	64.1	Low	44 Å²	44	135.8 Å²	135.8	45%	0.454	69%	0.691	S	S	.	*			trans	69.3	-2.7	-176.5	0	0	0	0	0	114.4	Y35 S39	Y35-G37 PolarHBondContact O-N 3.06Å; G37-S39 PolarHBondContact O-N 3.42Å
38	D	70.6	Confident	65.1	Low	111 Å²	111	138 Å²	138	59%	0.594	69%	0.694	S	S	*	*			trans	-78.4	50	177.4	-65.8	-24.2	0	0	0	111.3	R36	R36-D38 VanDerWaalsContact CD-OD2 3.25Å; R36-D38 WeakPolarHBondContact CD-OD2 3.36Å; R36-D38 WeakPolarHBondContact CG-OD2 3.33Å; R36-D38 IonicContact CZ-OD2 3.54Å; R36-D38 IonicContact NE-OD2 3.66Å; R36-D38 IonicContact NH1-OD2 2.79Å; R36-D38 PolarHBondContact NH1-OD2 3.32Å; R36-D38 PolarHBondContact O-N 3.06Å; R36-D38 VanDerWaalsContact O-N 3.08Å
39	S	72.6	Confident	66	Low	79 Å²	79	140.7 Å²	140.7	55%	0.552	70%	0.699	S	S	*	*	P	Polyproline II helix	trans	-65.6	130.5	164.1	54.2	0	0	0	0	107.8	G37 T41	G37-S39 PolarHBondContact O-N 3.42Å; S39-T41 PolarHBondContact O-N 3.3Å
40	P	73.6	Confident	67.4	Low	118 Å²	118	143.4 Å²	143.4	77%	0.766	71%	0.709	S	S	*	*	P	Polyproline II helix	trans	-49.1	137.9	170.4	-22.5	31.5	0	0	0	109.2	D42	P40-D42 PolarHBondContact O-N 2.75Å
41	T	67.7	Low	68.8	Low	135 Å²	135	144.4 Å²	144.4	83%	0.828	71%	0.713	S	S	*	*	P	Polyproline II helix	trans	-50.2	118.6	169.4	38	0	0	0	0	107.7	S39 S43	S39-T41 PolarHBondContact O-N 3.3Å; T41-S43 PolarHBondContact O-N 3.19Å
42	D	71.1	Confident	70.4	Confident	129 Å²	129	140.9 Å²	140.9	69%	0.69	70%	0.702	S	S	*	*			trans	-53.6	107	177.6	-179.8	5.6	0	0	0	107.7	P40 Q44	P40-D42 PolarHBondContact O-N 2.75Å; D42-Q44 PolarHBondContact O-N 2.97Å; D42-Q44 PolarHBondContact OD1-N 2.91Å
43	S	68.8	Low	72	Confident	88 Å²	88	137.3 Å²	137.3	62%	0.615	70%	0.703	S	S	*	*			trans	-71	1.4	-173.1	62.6	0	0	0	0	112.6	T41 K45	T41-S43 PolarHBondContact O-N 3.19Å; S43-K45 PolarHBondContact O-N 3.04Å
44	Q	66.6	Low	73.5	Confident	130 Å²	130	130.3 Å²	130.3	61%	0.607	69%	0.69	S	S	*	*	S	Bend	trans	52.7	3.5	-174.7	-64.4	-164.7	-42	0	0	114.6	D42 D46 M47	D42-Q44 PolarHBondContact O-N 2.97Å; D42-Q44 PolarHBondContact OD1-N 2.91Å; Q44-D46 PolarHBondContact O-N 2.63Å; Q44-D46 VanDerWaalsContact O-N 3.16Å; Q44-M47 WeakPolarHBondContact O-CB 3.49Å; Q44-M47 PolarHBondContact O-N 3.35Å
45	K	63.3	Low	75	Confident	179 Å²	179	126 Å²	126	78%	0.778	67%	0.669	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.4	-18.6	-173.7	-159.1	174.9	-176.7	-179.6	0	113	S43	S43-K45 PolarHBondContact O-N 3.04Å
46	D	62.6	Low	76.1	Confident	143 Å²	143	123.9 Å²	123.9	77%	0.765	67%	0.666	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.7	7.4	178.4	-58.1	-32.8	0	0	0	112.8	Q44 I48	Q44-D46 PolarHBondContact O-N 2.63Å; Q44-D46 VanDerWaalsContact O-N 3.16Å; D46-I48 PolarHBondContact O-N 2.86Å
47	M	68.4	Low	77.2	Confident	119 Å²	119	118.6 Å²	118.6	59%	0.586	65%	0.65	S	S	*	*			trans	-69.9	94.8	172.5	-86.7	-163.5	71.2	0	0	110.4	Q44 E49	Q44-M47 WeakPolarHBondContact O-CB 3.49Å; Q44-M47 PolarHBondContact O-N 3.35Å; M47-E49 PolarHBondContact O-N 3.31Å
48	I	76.8	Confident	78.4	Confident	148 Å²	148	122 Å²	122	76%	0.759	65%	0.65	S	S	*	*			trans	-75.6	107	165.1	-61.6	166.4	0	0	0	107.1	D46 I50	D46-I48 PolarHBondContact O-N 2.86Å; I48-I50 HydrophobicContact CG2-CG1 4.29Å; I48-I50 PolarHBondContact O-N 3.44Å; I48-I50 VanDerWaalsContact O-N 3.12Å
49	E	71.1	Confident	79.4	Confident	170 Å²	170	122.3 Å²	122.3	79%	0.794	66%	0.655	S	S	*	*			trans	-71.6	102.1	171.7	-70.5	-178.3	-175.5	0	0	109.3	M47 P51	M47-E49 PolarHBondContact O-N 3.31Å; E49-P51 WeakPolarHBondContact O-CD 3.48Å
50	I	84.6	Confident	80.4	Confident	139 Å²	139	124.7 Å²	124.7	71%	0.713	66%	0.662	S	S	*	*	P	Polyproline II helix	trans	-80.4	116.4	173	-58.5	173.7	0	0	0	107.2	I48 L52	I48-I50 HydrophobicContact CG2-CG1 4.29Å; I48-I50 PolarHBondContact O-N 3.44Å; I48-I50 VanDerWaalsContact O-N 3.12Å; I50-L52 PolarHBondContact O-N 3.02Å
51	P	85.9	Confident	81.3	Confident	118 Å²	118	120.3 Å²	120.3	77%	0.766	63%	0.631	S	S	*	*	P	Polyproline II helix	trans	-68	122.8	-178.4	27.4	-33.3	0	0	0	109.9	E49	E49-P51 WeakPolarHBondContact O-CD 3.48Å
52	L	87.9	Confident	82.7	Confident	110 Å²	110	116.8 Å²	116.8	58%	0.576	61%	0.612	S	S	*	*	P	Polyproline II helix	trans	-74.4	153.5	170.3	-66.8	175.8	0	0	0	110.1	I50 S113	I50-L52 PolarHBondContact O-N 3.02Å; L52-S113 VanDerWaalsContact CD1-CB 3.44Å; L52-S113 WeakPolarHBondContact CD1-OG 3.34Å
53	P	91.5	Very high	83.9	Confident	114 Å²	114	113.7 Å²	113.7	74%	0.74	60%	0.595	S	S	*	*	P	Polyproline II helix	trans	-58.5	134.7	174.1	25.3	-33.9	0	0	0	109.7	W55	P53-W55 PolarHBondContact O-N 3Å
54	P	92.1	Very high	85.1	Confident	102 Å²	102	116.7 Å²	116.7	66%	0.662	60%	0.599	S	S	*	*	P	Polyproline II helix	trans	-63.3	140.1	177.5	26.8	-33.7	0	0	0	109.6	Q56	P54-Q56 PolarHBondContact O-N 2.87Å
55	W	93	Very high	86.5	Confident	67 Å²	67	114 Å²	114	25%	0.254	59%	0.592	S	S	.	*	P	Polyproline II helix	trans	-60.6	136.4	173.9	178.5	91.3	0	0	0	110.1	P53 E57 D106 R107 E111	P53-W55 PolarHBondContact O-N 3Å; W55-E57 HydrophobicContact CH2-CB 3.51Å; W55-E57 HydrophobicContact CH2-CG 3.83Å; W55-E57 HydrophobicContact CZ2-CB 4.4Å; W55-E57 HydrophobicContact CZ3-CB 3.67Å; W55-E57 HydrophobicContact CZ3-CG 4.41Å; W55-D106 HydrophobicContact CZ2-CB 4.34Å; W55-R107 HydrophobicContact CE3-CG 4.35Å; W55-R107 HydrophobicContact CH2-CB 3.96Å; W55-R107 HydrophobicContact CH2-CG 4.26Å; W55-R107 HydrophobicContact CZ2-CB 4Å; W55-R107 HydrophobicContact CZ2-CG 4.49Å; W55-R107 HydrophobicContact CZ3-CB 4.39Å; W55-R107 HydrophobicContact CZ3-CG 4.19Å; W55-E111 HydrophobicContact CB-CB 3.99Å; W55-E111 HydrophobicContact CB-CG 3.93Å; W55-E111 HydrophobicContact CG-CB 3.97Å; W55-E111 HydrophobicContact CG-CG 4.38Å
56	Q	93.4	Very high	88.1	Confident	149 Å²	149	105.7 Å²	105.7	70%	0.696	56%	0.556	S	S	*	*			trans	-120.6	127.9	-179.1	-65.8	178.6	13.6	0	0	109.6	P54	P54-Q56 PolarHBondContact O-N 2.87Å
57	E	92.6	Very high	89.7	Confident	99 Å²	99	101.9 Å²	101.9	46%	0.463	53%	0.531	S	S	.	.			trans	-70.8	133.6	176	-171.4	167.7	-173.6	0	0	110.9	W55 T59 N103	W55-E57 HydrophobicContact CH2-CB 3.51Å; W55-E57 HydrophobicContact CH2-CG 3.83Å; W55-E57 HydrophobicContact CZ2-CB 4.4Å; W55-E57 HydrophobicContact CZ3-CB 3.67Å; W55-E57 HydrophobicContact CZ3-CG 4.41Å; E57-T59 HydrophobicContact CG-CG2 4.4Å; E57-N103 WeakPolarHBondContact OE1-CB 3.31Å; E57-N103 VanDerWaalsContact OE1-CG 3.26Å; E57-N103 PolarHBondContact OE1-ND2 2.9Å
58	R	92.5	Very high	91.1	Very high	115 Å²	115	99.1 Å²	99.1	43%	0.434	53%	0.527	S	S	.	.			trans	-97.5	115.7	178.5	-58.2	-175	70.1	172.7	0.9	110.6	K66	R58-K66 PolarHBondContact O-NZ 2.92Å
59	T	91.9	Very high	92	Very high	117 Å²	117	93.7 Å²	93.7	72%	0.718	50%	0.497	S	S	*	.			trans	-112.1	-3.3	-177	61.1	0	0	0	0	113.6	E57	E57-T59 HydrophobicContact CG-CG2 4.4Å
60	D	92.8	Very high	93.3	Very high	129 Å²	129	85.6 Å²	85.6	69%	0.69	46%	0.459	S	S	*	.	S	Bend	trans	-93.5	-6	-172.2	61.2	-41.9	0	0	0	114.2
61	E	93.9	Very high	93.9	Very high	26 Å²	26	79.7 Å²	79.7	12%	0.121	43%	0.429	C	S	.	.	S	Bend	trans	-101.2	150.8	-176.4	64	-178.7	175.4	0	0	113.4	T65 K66 R69	E61-T65 HydrophobicContact CB-CG2 4.13Å; E61-K66 HydrophobicContact CG-CB 4.02Å; E61-K66 WeakPolarHBondContact OE1-CB 3.48Å; E61-K66 WeakPolarHBondContact OE1-CE 2.98Å; E61-K66 WeakPolarHBondContact OE1-CG 3.42Å; E61-R69 IonicContact OE1-CZ 3.52Å; E61-R69 IonicContact OE1-NE 2.9Å; E61-R69 PolarHBondContact OE1-NE 3.16Å; E61-R69 VanDerWaalsContact OE1-NE 3.09Å; E61-R69 IonicContact OE1-NH2 2.92Å; E61-R69 PolarHBondContact OE1-NH2 2.95Å; E61-R69 IonicContact OE2-NE 3.65Å; E61-R69 PolarHBondContact OE2-NE 3.26Å
62	S	96.3	Very high	94.5	Very high	61 Å²	61	81.2 Å²	81.2	43%	0.427	42%	0.421	S	S	.	.			trans	-68.4	158.8	173	80.8	0	0	0	0	111.7	E64 T65 K66	S62-E64 PolarHBondContact O-N 2.8Å; S62-T65 PolarHBondContact O-N 3.16Å; S62-T65 VanDerWaalsContact O-N 3.16Å; S62-T65 WeakPolarHBondContact OG-CB 3.42Å; S62-T65 PolarHBondContact OG-N 2.96Å; S62-T65 VanDerWaalsContact OG-N 3.16Å; S62-T65 PolarHBondContact OG-OG1 3.25Å; S62-K66 WeakPolarHBondContact O-CB 3.34Å; S62-K66 PolarHBondContact O-N 3.44Å
63	I	95.3	Very high	95	Very high	65 Å²	65	78 Å²	78	33%	0.333	40%	0.402	S	S	.	.	H	α-helix	trans	-58.3	-36.2	177.7	-165.7	171.5	0	0	0	112.7	R67 L102	I63-R67 VanDerWaalsContact O-CG 3.3Å; I63-R67 WeakPolarHBondContact O-CG 3.3Å; I63-R67 PolarHBondContact O-N 3.09Å; I63-L102 HydrophobicContact CD1-CD1 4.31Å; I63-L102 HydrophobicContact CG1-CD1 3.76Å
64	E	94.9	Very high	95.2	Very high	150 Å²	150	72.5 Å²	72.5	70%	0.701	37%	0.367	S	S	*	.	H	α-helix	trans	-70.3	-42.3	178.3	-64	-177.2	175.9	0	0	111.2	S62 R67 A68	S62-E64 PolarHBondContact O-N 2.8Å; E64-R67 PolarHBondContact O-N 3.08Å; E64-A68 PolarHBondContact O-N 2.94Å
65	T	96.3	Very high	95.5	Very high	75 Å²	75	70.6 Å²	70.6	46%	0.46	35%	0.347	S	S	.	.	H	α-helix	trans	-61.9	-44.8	174.8	-52.2	0	0	0	0	111.1	E61 S62 R67 A68 R69	E61-T65 HydrophobicContact CB-CG2 4.13Å; S62-T65 PolarHBondContact O-N 3.16Å; S62-T65 VanDerWaalsContact O-N 3.16Å; S62-T65 WeakPolarHBondContact OG-CB 3.42Å; S62-T65 PolarHBondContact OG-N 2.96Å; S62-T65 VanDerWaalsContact OG-N 3.16Å; S62-T65 PolarHBondContact OG-OG1 3.25Å; T65-R67 PolarHBondContact O-N 2.97Å; T65-A68 PolarHBondContact O-N 3.27Å; T65-R69 WeakPolarHBondContact O-CB 3.47Å; T65-R69 PolarHBondContact O-N 3.31Å
66	K	96.6	Very high	95.6	Very high	3 Å²	3	74 Å²	74	1%	0.013	36%	0.363	C	S	.	.	H	α-helix	trans	-59	-46.5	176	-175.8	166	-73.5	179	0	111.5	R58 E61 S62 A68 R69 L70 L102 N103	R58-K66 PolarHBondContact O-NZ 2.92Å; E61-K66 HydrophobicContact CG-CB 4.02Å; E61-K66 WeakPolarHBondContact OE1-CB 3.48Å; E61-K66 WeakPolarHBondContact OE1-CE 2.98Å; E61-K66 WeakPolarHBondContact OE1-CG 3.42Å; S62-K66 WeakPolarHBondContact O-CB 3.34Å; S62-K66 PolarHBondContact O-N 3.44Å; K66-A68 PolarHBondContact O-N 3.36Å; K66-R69 PolarHBondContact O-N 3.41Å; K66-L70 HydrophobicContact CG-CD1 3.8Å; K66-L70 HydrophobicContact CG-CG 4.39Å; K66-L70 WeakPolarHBondContact O-CB 3.34Å; K66-L70 VanDerWaalsContact O-CG 3.25Å; K66-L70 WeakPolarHBondContact O-CG 3.42Å; K66-L70 PolarHBondContact O-N 3.37Å; K66-L102 HydrophobicContact CD-CB 4Å; K66-L102 HydrophobicContact CD-CD1 4.47Å; K66-L102 HydrophobicContact CG-CB 4.36Å; K66-L102 HydrophobicContact CG-CD1 4.47Å; K66-N103 PolarHBondContact NZ-OD1 2.85Å
67	R	96.6	Very high	95.8	Very high	63 Å²	63	68.8 Å²	68.8	24%	0.238	34%	0.337	C	S	.	.	H	α-helix	trans	-61	-45.1	175.2	-73.3	175.8	177.7	139.5	1.3	112.1	I63 E64 T65 R69 L70 L71 L94 Q95 M97 L102	I63-R67 VanDerWaalsContact O-CG 3.3Å; I63-R67 WeakPolarHBondContact O-CG 3.3Å; I63-R67 PolarHBondContact O-N 3.09Å; E64-R67 PolarHBondContact O-N 3.08Å; T65-R67 PolarHBondContact O-N 2.97Å; R67-R69 VanDerWaalsContact C-N 3.34Å; R67-R69 PolarHBondContact O-N 3.14Å; R67-L70 PolarHBondContact O-N 3.19Å; R67-L71 VanDerWaalsContact O-CB 3.3Å; R67-L71 WeakPolarHBondContact O-CB 3.49Å; R67-L71 PolarHBondContact O-N 3.01Å; R67-L94 HydrophobicContact CB-CD2 4.32Å; R67-L94 HydrophobicContact CB-CG 4.37Å; R67-L94 WeakPolarHBondContact CD-O 3.33Å; R67-L94 HydrophobicContact CG-CG 4.27Å; R67-L94 PolarHBondContact NE-O 3.5Å; R67-L94 VanDerWaalsContact NE-O 3.08Å; R67-L94 WeakPolarHBondContact O-CD2 3.4Å; R67-Q95 PolarHBondContact NH2-O 2.68Å; R67-M97 PolarHBondContact NH2-O 3.45Å; R67-L102 HydrophobicContact CG-CD1 3.75Å; R67-L102 HydrophobicContact CG-CD2 4.06Å
68	A	96.4	Very high	95.8	Very high	62 Å²	62	67.6 Å²	67.6	51%	0.512	35%	0.352	S	S	.	.	H	α-helix	trans	-62.3	-42.2	178.6	0	0	0	0	0	112	E64 T65 K66 Y72	E64-A68 PolarHBondContact O-N 2.94Å; T65-A68 PolarHBondContact O-N 3.27Å; K66-A68 PolarHBondContact O-N 3.36Å; A68-Y72 PolarHBondContact O-N 3.38Å; A68-Y72 VanDerWaalsContact O-N 3.12Å
69	R	97.5	Very high	96	Very high	33 Å²	33	63 Å²	63	13%	0.125	34%	0.335	C	S	.	.	H	α-helix	trans	-62.6	-52.3	175.2	178.4	178.8	63.9	80.2	-4.6	111.8	E61 T65 K66 R67 L71 Y72 E73 D106	E61-R69 IonicContact OE1-CZ 3.52Å; E61-R69 IonicContact OE1-NE 2.9Å; E61-R69 PolarHBondContact OE1-NE 3.16Å; E61-R69 VanDerWaalsContact OE1-NE 3.09Å; E61-R69 IonicContact OE1-NH2 2.92Å; E61-R69 PolarHBondContact OE1-NH2 2.95Å; E61-R69 IonicContact OE2-NE 3.65Å; E61-R69 PolarHBondContact OE2-NE 3.26Å; T65-R69 WeakPolarHBondContact O-CB 3.47Å; T65-R69 PolarHBondContact O-N 3.31Å; K66-R69 PolarHBondContact O-N 3.41Å; R67-R69 VanDerWaalsContact C-N 3.34Å; R67-R69 PolarHBondContact O-N 3.14Å; R69-L71 VanDerWaalsContact C-N 3.27Å; R69-L71 PolarHBondContact O-N 3.26Å; R69-Y72 WeakPolarHBondContact O-CA 2.99Å; R69-Y72 WeakPolarHBondContact O-CB 3.47Å; R69-Y72 PolarHBondContact O-N 3.27Å; R69-E73 WeakPolarHBondContact CD-OE1 3.48Å; R69-E73 HydrophobicContact CG-CG 4.45Å; R69-E73 VanDerWaalsContact CG-OE1 3.22Å; R69-E73 WeakPolarHBondContact CG-OE1 3.38Å; R69-E73 IonicContact NH1-OE1 3.81Å; R69-E73 PolarHBondContact NH1-OE1 2.92Å; R69-E73 VanDerWaalsContact NH1-OE1 3.12Å; R69-E73 IonicContact NH1-OE2 3.12Å; R69-E73 PolarHBondContact NH1-OE2 3.07Å; R69-E73 WeakPolarHBondContact O-CG 3.5Å; R69-E73 PolarHBondContact O-N 3.3Å; R69-D106 IonicContact CZ-OD1 3Å; R69-D106 IonicContact CZ-OD2 3.09Å; R69-D106 IonicContact NH1-OD1 3.75Å; R69-D106 PolarHBondContact NH1-OD1 3.38Å; R69-D106 IonicContact NH1-OD2 3.46Å; R69-D106 PolarHBondContact NH1-OD2 2.97Å; R69-D106 IonicContact NH2-OD1 2.96Å; R69-D106 IonicContact NH2-OD2 3.53Å; R69-D106 PolarHBondContact NH2-OD2 3.37Å
70	L	97.8	Very high	96.2	Very high	0 Å²	0	63.1 Å²	63.1	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-62.4	-35.5	-179.4	-70.7	172	0	0	0	112.1	K66 R67 E73 S74 L94 L102 Y105 D106 I109	K66-L70 HydrophobicContact CG-CD1 3.8Å; K66-L70 HydrophobicContact CG-CG 4.39Å; K66-L70 WeakPolarHBondContact O-CB 3.34Å; K66-L70 VanDerWaalsContact O-CG 3.25Å; K66-L70 WeakPolarHBondContact O-CG 3.42Å; K66-L70 PolarHBondContact O-N 3.37Å; R67-L70 PolarHBondContact O-N 3.19Å; L70-E73 PolarHBondContact O-N 2.9Å; L70-S74 VanDerWaalsContact O-CB 3.26Å; L70-S74 WeakPolarHBondContact O-CB 3.46Å; L70-S74 PolarHBondContact O-N 2.87Å; L70-S74 PolarHBondContact O-OG 3.26Å; L70-L94 HydrophobicContact CB-CD1 4.07Å; L70-L94 HydrophobicContact CB-CD2 4.4Å; L70-L94 HydrophobicContact CD1-CD1 4.41Å; L70-L102 HydrophobicContact CD1-CB 4.01Å; L70-L102 HydrophobicContact CD1-CD2 3.97Å; L70-Y105 HydrophobicContact CB-CD1 4.35Å; L70-Y105 HydrophobicContact CB-CE1 4.39Å; L70-Y105 HydrophobicContact CD1-CD1 4.26Å; L70-Y105 HydrophobicContact CD2-CD1 4.34Å; L70-D106 HydrophobicContact CD1-CB 4.39Å; L70-D106 VanDerWaalsContact CD2-CA 3.5Å; L70-D106 HydrophobicContact CD2-CB 3.58Å; L70-I109 HydrophobicContact CD2-CD1 4.07Å
71	L	97.8	Very high	96.4	Very high	16 Å²	16	61.1 Å²	61.1	8%	0.084	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-44.8	172.3	177	62.2	0	0	0	111.4	R67 R69 S74 R75 A90 L94 L158 Y160 L161	R67-L71 VanDerWaalsContact O-CB 3.3Å; R67-L71 WeakPolarHBondContact O-CB 3.49Å; R67-L71 PolarHBondContact O-N 3.01Å; R69-L71 VanDerWaalsContact C-N 3.27Å; R69-L71 PolarHBondContact O-N 3.26Å; L71-S74 PolarHBondContact O-N 3.49Å; L71-R75 HydrophobicContact CD1-CG 4.34Å; L71-R75 VanDerWaalsContact O-CG 3.27Å; L71-R75 WeakPolarHBondContact O-CG 3.45Å; L71-R75 PolarHBondContact O-N 3.05Å; L71-A90 HydrophobicContact CD1-CB 3.93Å; L71-L94 HydrophobicContact CB-CD2 3.73Å; L71-L158 HydrophobicContact CD2-CD2 4.38Å; L71-Y160 WeakPolarHBondContact CD1-OH 3.31Å; L71-L161 HydrophobicContact CD2-CD1 3.61Å; L71-L161 HydrophobicContact CD2-CD2 4.06Å; L71-L161 HydrophobicContact CD2-CG 4.41Å
72	Y	97.8	Very high	96.5	Very high	149 Å²	149	59.9 Å²	59.9	58%	0.584	31%	0.312	S	S	*	.	H	α-helix	trans	-61.7	-50.3	177.3	176.3	-93.6	0	0	0	111.4	A68 R69 S74 R75 K76	A68-Y72 PolarHBondContact O-N 3.38Å; A68-Y72 VanDerWaalsContact O-N 3.12Å; R69-Y72 WeakPolarHBondContact O-CA 2.99Å; R69-Y72 WeakPolarHBondContact O-CB 3.47Å; R69-Y72 PolarHBondContact O-N 3.27Å; Y72-S74 VanDerWaalsContact C-N 3.3Å; Y72-S74 PolarHBondContact O-N 2.91Å; Y72-R75 PolarHBondContact O-N 3.44Å; Y72-K76 HydrophobicContact CD1-CG 4.41Å; Y72-K76 HydrophobicContact CD2-CG 4.14Å; Y72-K76 HydrophobicContact CE1-CB 4.42Å; Y72-K76 HydrophobicContact CE1-CG 4.04Å; Y72-K76 HydrophobicContact CE2-CD 4.46Å; Y72-K76 HydrophobicContact CE2-CG 3.76Å; Y72-K76 HydrophobicContact CG-CG 4.45Å; Y72-K76 WeakPolarHBondContact O-CG 3.25Å; Y72-K76 PolarHBondContact O-N 3.13Å
73	E	97.2	Very high	96.5	Very high	42 Å²	42	58 Å²	58	20%	0.196	30%	0.298	C	S	.	.	H	α-helix	trans	-61.9	-35.9	179.7	-70.1	165.6	177.9	0	0	112.2	R69 L70 R75 K76 R77 I109 N110	R69-E73 WeakPolarHBondContact CD-OE1 3.48Å; R69-E73 HydrophobicContact CG-CG 4.45Å; R69-E73 VanDerWaalsContact CG-OE1 3.22Å; R69-E73 WeakPolarHBondContact CG-OE1 3.38Å; R69-E73 IonicContact NH1-OE1 3.81Å; R69-E73 PolarHBondContact NH1-OE1 2.92Å; R69-E73 VanDerWaalsContact NH1-OE1 3.12Å; R69-E73 IonicContact NH1-OE2 3.12Å; R69-E73 PolarHBondContact NH1-OE2 3.07Å; R69-E73 WeakPolarHBondContact O-CG 3.5Å; R69-E73 PolarHBondContact O-N 3.3Å; L70-E73 PolarHBondContact O-N 2.9Å; E73-R75 VanDerWaalsContact C-N 3.31Å; E73-R75 PolarHBondContact O-N 2.81Å; E73-K76 PolarHBondContact O-N 3.03Å; E73-R77 WeakPolarHBondContact O-CD 3.35Å; E73-I109 HydrophobicContact CB-CD1 4.07Å; E73-N110 PolarHBondContact OE2-ND2 2.63Å
74	S	97.4	Very high	96.6	Very high	0 Å²	0	56 Å²	56	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-65.3	-33.9	174.6	-59.1	0	0	0	0	112.7	L70 L71 Y72 R77 Y105	L70-S74 VanDerWaalsContact O-CB 3.26Å; L70-S74 WeakPolarHBondContact O-CB 3.46Å; L70-S74 PolarHBondContact O-N 2.87Å; L70-S74 PolarHBondContact O-OG 3.26Å; L71-S74 PolarHBondContact O-N 3.49Å; Y72-S74 VanDerWaalsContact C-N 3.3Å; Y72-S74 PolarHBondContact O-N 2.91Å; S74-R77 WeakPolarHBondContact O-CG 3.47Å; S74-Y105 WeakPolarHBondContact OG-CE1 3.26Å; S74-Y105 PolarHBondContact OG-OH 3.44Å
75	R	97.4	Very high	96.7	Very high	62 Å²	62	49.6 Å²	49.6	23%	0.234	26%	0.259	C	S	.	.	H	α-helix	trans	-85.9	-19.6	-178	-68.9	177.1	76.9	98.5	0.9	113.4	L71 Y72 E73 P156	L71-R75 HydrophobicContact CD1-CG 4.34Å; L71-R75 VanDerWaalsContact O-CG 3.27Å; L71-R75 WeakPolarHBondContact O-CG 3.45Å; L71-R75 PolarHBondContact O-N 3.05Å; Y72-R75 PolarHBondContact O-N 3.44Å; E73-R75 VanDerWaalsContact C-N 3.31Å; E73-R75 PolarHBondContact O-N 2.81Å; R75-P156 VanDerWaalsContact CZ-O 3.29Å; R75-P156 PolarHBondContact NH1-O 3.15Å; R75-P156 PolarHBondContact NH2-O 2.99Å
76	K	96.2	Very high	96.8	Very high	138 Å²	138	46 Å²	46	60%	0.6	24%	0.237	S	C	*	.	S	Bend	trans	-111	67.6	-173.4	-63.3	-61.3	-174.1	179.4	0	110.9	Y72 E73	Y72-K76 HydrophobicContact CD1-CG 4.41Å; Y72-K76 HydrophobicContact CD2-CG 4.14Å; Y72-K76 HydrophobicContact CE1-CB 4.42Å; Y72-K76 HydrophobicContact CE1-CG 4.04Å; Y72-K76 HydrophobicContact CE2-CD 4.46Å; Y72-K76 HydrophobicContact CE2-CG 3.76Å; Y72-K76 HydrophobicContact CG-CG 4.45Å; Y72-K76 WeakPolarHBondContact O-CG 3.25Å; Y72-K76 PolarHBondContact O-N 3.13Å; E73-K76 PolarHBondContact O-N 3.03Å
77	R	96.5	Very high	96.8	Very high	39 Å²	39	45.9 Å²	45.9	15%	0.147	24%	0.236	C	C	.	.			trans	-101.5	163.1	179.5	-50.2	-58	-61	-170.2	-4.2	111.9	E73 S74 M79 N82 C83 L86 I109 D115	E73-R77 WeakPolarHBondContact O-CD 3.35Å; S74-R77 WeakPolarHBondContact O-CG 3.47Å; R77-M79 VanDerWaalsContact C-N 3.29Å; R77-M79 PolarHBondContact O-N 3.44Å; R77-N82 HydrophobicContact CB-CB 4.03Å; R77-N82 HydrophobicContact CG-CB 4.01Å; R77-C83 PolarHBondContact N-SG 3.16Å; R77-L86 HydrophobicContact CG-CD1 4.17Å; R77-I109 VanDerWaalsContact CZ-O 3.29Å; R77-I109 PolarHBondContact NH1-O 3.44Å; R77-I109 PolarHBondContact NH2-O 3.07Å; R77-D115 IonicContact CZ-OD1 3.12Å; R77-D115 IonicContact NE-OD1 2.75Å; R77-D115 PolarHBondContact NE-OD1 3.12Å; R77-D115 IonicContact NH2-OD1 2.71Å; R77-D115 PolarHBondContact NH2-OD1 2.63Å
78	G	93.8	Very high	96.8	Very high	75 Å²	75	44 Å²	44	77%	0.773	23%	0.23	S	C	*	.	S	Bend	trans	-72.1	-18.5	178.2	0	0	0	0	0	114.7	D115	G78-D115 PolarHBondContact N-OD2 2.87Å
79	M	95.7	Very high	96.9	Very high	18 Å²	18	41.1 Å²	41.1	9%	0.089	21%	0.206	C	C	.	.	S	Bend	trans	-127.9	151.4	-178.8	68.4	176.5	55	0	0	112.5	R77 E81 N82 C83 D115 W116	R77-M79 VanDerWaalsContact C-N 3.29Å; R77-M79 PolarHBondContact O-N 3.44Å; M79-E81 VanDerWaalsContact C-N 3.35Å; M79-E81 HydrophobicContact CG-CB 4.47Å; M79-E81 PolarHBondContact O-N 3.49Å; M79-E81 HydrophobicContact SD-CB 4.19Å; M79-N82 HydrophobicContact CG-CB 3.71Å; M79-N82 HydrophobicContact SD-CB 4.13Å; M79-N82 VanDerWaalsContact SD-CG 3.56Å; M79-C83 PolarHBondContact O-N 3.22Å; M79-C83 VanDerWaalsContact O-N 3.1Å; M79-C83 PolarHBondContact O-SG 3.32Å; M79-D115 HydrophobicContact CE-CB 3.61Å; M79-D115 HydrophobicContact CG-CB 4.28Å; M79-D115 HydrophobicContact SD-CB 4.29Å; M79-W116 HydrophobicContact CE-CB 4.12Å; M79-W116 HydrophobicContact CE-CD2 3.23Å; M79-W116 HydrophobicContact CE-CE3 3.74Å; M79-W116 HydrophobicContact CE-CG 3.4Å; M79-W116 VanDerWaalsContact CE-CG 3.4Å; M79-W116 HydrophobicContact CE-CH2 4.29Å; M79-W116 HydrophobicContact CE-CZ2 3.87Å; M79-W116 HydrophobicContact CE-CZ3 4.23Å; M79-W116 HydrophobicContact SD-CD2 4.27Å; M79-W116 HydrophobicContact SD-CE3 4.19Å; M79-W116 HydrophobicContact SD-CZ3 4.33Å
80	L	96.3	Very high	96.9	Very high	120 Å²	120	39.6 Å²	39.6	63%	0.628	20%	0.201	S	C	*	.	H	α-helix	trans	-70	-34.1	-176.6	-176	61.1	0	0	0	112	C83 I84	L80-C83 WeakPolarHBondContact O-CB 3.31Å; L80-C83 PolarHBondContact O-N 3.31Å; L80-I84 HydrophobicContact CD1-CD1 3.96Å; L80-I84 HydrophobicContact CD1-CG1 4.09Å; L80-I84 HydrophobicContact CD2-CD1 4.4Å; L80-I84 HydrophobicContact CG-CD1 3.85Å; L80-I84 HydrophobicContact CG-CG1 4.35Å; L80-I84 WeakPolarHBondContact O-CG1 3.44Å; L80-I84 PolarHBondContact O-N 2.83Å
81	E	95.9	Very high	96.8	Very high	86 Å²	86	43.5 Å²	43.5	40%	0.402	22%	0.218	S	C	.	.	H	α-helix	trans	-57.9	-54.3	179.8	-65.7	81	175.6	0	0	110.6	M79 I84 L85 Y119	M79-E81 VanDerWaalsContact C-N 3.35Å; M79-E81 HydrophobicContact CG-CB 4.47Å; M79-E81 PolarHBondContact O-N 3.49Å; M79-E81 HydrophobicContact SD-CB 4.19Å; E81-I84 PolarHBondContact O-N 3Å; E81-L85 VanDerWaalsContact O-CB 3.27Å; E81-L85 WeakPolarHBondContact O-CB 3.49Å; E81-L85 PolarHBondContact O-N 3.4Å; E81-Y119 HydrophobicContact CB-CD2 4.02Å; E81-Y119 HydrophobicContact CB-CE2 3.86Å; E81-Y119 HydrophobicContact CG-CE2 4.45Å
82	N	96.9	Very high	96.6	Very high	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.8	-38	174.9	-74.9	-5.7	0	0	0	112.2	R77 M79 I84 L85 L86 D115 Y119	R77-N82 HydrophobicContact CB-CB 4.03Å; R77-N82 HydrophobicContact CG-CB 4.01Å; M79-N82 HydrophobicContact CG-CB 3.71Å; M79-N82 HydrophobicContact SD-CB 4.13Å; M79-N82 VanDerWaalsContact SD-CG 3.56Å; N82-I84 VanDerWaalsContact C-N 3.3Å; N82-I84 PolarHBondContact O-N 2.72Å; N82-L85 PolarHBondContact O-N 3.01Å; N82-L86 HydrophobicContact CB-CD1 4.26Å; N82-L86 VanDerWaalsContact O-CB 3.25Å; N82-L86 WeakPolarHBondContact O-CB 3.36Å; N82-L86 WeakPolarHBondContact O-CG 3.38Å; N82-L86 PolarHBondContact O-N 2.87Å; N82-D115 PolarHBondContact ND2-O 3.02Å; N82-D115 PolarHBondContact ND2-OD1 3.18Å; N82-D115 VanDerWaalsContact ND2-OD1 3.16Å; N82-Y119 WeakPolarHBondContact OD1-CB 3.4Å
83	C	97	Very high	96.5	Very high	22 Å²	22	41.7 Å²	41.7	15%	0.149	22%	0.215	C	C	.	.	H	α-helix	trans	-56.2	-46.7	176.4	-74.9	0	0	0	0	111.1	R77 M79 L80 S87	R77-C83 PolarHBondContact N-SG 3.16Å; M79-C83 PolarHBondContact O-N 3.22Å; M79-C83 VanDerWaalsContact O-N 3.1Å; M79-C83 PolarHBondContact O-SG 3.32Å; L80-C83 WeakPolarHBondContact O-CB 3.31Å; L80-C83 PolarHBondContact O-N 3.31Å; C83-S87 WeakPolarHBondContact O-CB 3.04Å; C83-S87 PolarHBondContact O-N 3.5Å; C83-S87 PolarHBondContact O-OG 2.88Å
84	I	97.1	Very high	96.3	Very high	23 Å²	23	40.2 Å²	40.2	12%	0.118	21%	0.208	C	C	.	.	H	α-helix	trans	-72.1	-48.5	-179.9	-64.5	171.1	0	0	0	110.3	L80 E81 N82 S87 L88 R152	L80-I84 HydrophobicContact CD1-CD1 3.96Å; L80-I84 HydrophobicContact CD1-CG1 4.09Å; L80-I84 HydrophobicContact CD2-CD1 4.4Å; L80-I84 HydrophobicContact CG-CD1 3.85Å; L80-I84 HydrophobicContact CG-CG1 4.35Å; L80-I84 WeakPolarHBondContact O-CG1 3.44Å; L80-I84 PolarHBondContact O-N 2.83Å; E81-I84 PolarHBondContact O-N 3Å; N82-I84 VanDerWaalsContact C-N 3.3Å; N82-I84 PolarHBondContact O-N 2.72Å; I84-S87 PolarHBondContact O-OG 3.19Å; I84-S87 VanDerWaalsContact O-OG 3.12Å; I84-L88 HydrophobicContact CG2-CD1 3.78Å; I84-L88 WeakPolarHBondContact O-CB 3.38Å; I84-L88 WeakPolarHBondContact O-CG 3.39Å; I84-L88 PolarHBondContact O-N 3.09Å; I84-L88 VanDerWaalsContact O-N 3.14Å; I84-R152 HydrophobicContact CG2-CB 4.16Å
85	L	97.1	Very high	96.1	Very high	15 Å²	15	44.3 Å²	44.3	8%	0.079	23%	0.227	C	C	.	.	H	α-helix	trans	-60.4	-53.3	-176.6	-177.7	65.1	0	0	0	111.9	E81 N82 F89 Y119 A122 L140 F143 A144	E81-L85 VanDerWaalsContact O-CB 3.27Å; E81-L85 WeakPolarHBondContact O-CB 3.49Å; E81-L85 PolarHBondContact O-N 3.4Å; N82-L85 PolarHBondContact O-N 3.01Å; L85-F89 WeakPolarHBondContact O-CB 3.33Å; L85-F89 PolarHBondContact O-N 3.41Å; L85-Y119 HydrophobicContact CD2-CD2 4.42Å; L85-A122 HydrophobicContact CD2-CB 4.1Å; L85-L140 HydrophobicContact CD2-CD1 4.45Å; L85-L140 HydrophobicContact CG-CD1 4.42Å; L85-F143 HydrophobicContact CD1-CD1 3.83Å; L85-F143 HydrophobicContact CD1-CE1 4.07Å; L85-A144 HydrophobicContact CD1-CB 4.41Å
86	L	97.9	Very high	95.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-73.3	-31.7	-176.3	-61.3	179	0	0	0	112.3	R77 N82 F89 A90 I109 L140	R77-L86 HydrophobicContact CG-CD1 4.17Å; N82-L86 HydrophobicContact CB-CD1 4.26Å; N82-L86 VanDerWaalsContact O-CB 3.25Å; N82-L86 WeakPolarHBondContact O-CB 3.36Å; N82-L86 WeakPolarHBondContact O-CG 3.38Å; N82-L86 PolarHBondContact O-N 2.87Å; L86-F89 PolarHBondContact O-N 2.7Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 3.36Å; L86-I109 HydrophobicContact CD1-CG2 4.13Å; L86-I109 HydrophobicContact CD2-CG2 4.41Å; L86-L140 HydrophobicContact CD2-CD1 3.98Å; L86-L140 HydrophobicContact CD2-CD2 4.33Å
87	S	97.3	Very high	95.9	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.221	C	C	.	.	H	α-helix	trans	-69.4	-36.3	176.8	65.5	0	0	0	0	113	C83 I84 K91 A155 P156	C83-S87 WeakPolarHBondContact O-CB 3.04Å; C83-S87 PolarHBondContact O-N 3.5Å; C83-S87 PolarHBondContact O-OG 2.88Å; I84-S87 PolarHBondContact O-OG 3.19Å; I84-S87 VanDerWaalsContact O-OG 3.12Å; S87-K91 PolarHBondContact O-N 3.27Å; S87-K91 VanDerWaalsContact O-N 3.16Å; S87-A155 WeakPolarHBondContact OG-CB 3.37Å; S87-P156 WeakPolarHBondContact OG-CD 3.25Å
88	L	97	Very high	95.9	Very high	23 Å²	23	43.8 Å²	43.8	12%	0.12	24%	0.236	C	C	.	.	H	α-helix	trans	-72.5	-42.8	173.5	-67.8	169.3	0	0	0	111	I84 A90 K91 E92 F143 R152 P156	I84-L88 HydrophobicContact CG2-CD1 3.78Å; I84-L88 WeakPolarHBondContact O-CB 3.38Å; I84-L88 WeakPolarHBondContact O-CG 3.39Å; I84-L88 PolarHBondContact O-N 3.09Å; I84-L88 VanDerWaalsContact O-N 3.14Å; L88-A90 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 3.26Å; L88-K91 WeakPolarHBondContact O-CB 3.36Å; L88-K91 PolarHBondContact O-N 3.28Å; L88-K91 VanDerWaalsContact O-N 3.16Å; L88-E92 PolarHBondContact O-N 2.74Å; L88-F143 HydrophobicContact CB-CE1 3.99Å; L88-F143 HydrophobicContact CB-CZ 3.72Å; L88-R152 HydrophobicContact CD1-CB 3.94Å; L88-R152 HydrophobicContact CD1-CG 3.72Å; L88-P156 HydrophobicContact CD2-CB 4.19Å; L88-P156 HydrophobicContact CD2-CG 3.99Å
89	F	97.2	Very high	95.9	Very high	2 Å²	2	45.2 Å²	45.2	1%	0.009	22%	0.223	C	C	.	.	H	α-helix	trans	-57.2	-46.4	174.4	179.8	-97.4	0	0	0	111.8	L85 L86 K91 E92 H93 M97 Y105 V136 L139 L140 F143	L85-F89 WeakPolarHBondContact O-CB 3.33Å; L85-F89 PolarHBondContact O-N 3.41Å; L86-F89 PolarHBondContact O-N 2.7Å; F89-K91 VanDerWaalsContact C-N 3.32Å; F89-K91 PolarHBondContact O-N 3.2Å; F89-E92 PolarHBondContact O-N 3.13Å; F89-H93 AromaticContact CD2-CD2 3.42Å; F89-H93 VanDerWaalsContact CD2-CD2 3.42Å; F89-H93 WeakPolarHBondContact CD2-CD2 3.3Å; F89-H93 HydrophobicContact CE1-CB 4.44Å; F89-H93 AromaticContact CE2-CD2 3.38Å; F89-H93 WeakPolarHBondContact CE2-CD2 3.2Å; F89-H93 AromaticContact CE2-NE2 3.88Å; F89-H93 HydrophobicContact CZ-CB 4.3Å; F89-H93 PolarHBondContact O-CD2 3.26Å; F89-H93 PolarHBondContact O-N 3.45Å; F89-M97 HydrophobicContact CE1-CE 3.76Å; F89-M97 HydrophobicContact CZ-CE 3.7Å; F89-Y105 HydrophobicContact CD1-CD2 4.44Å; F89-Y105 AromaticContact CD1-CE2 3.68Å; F89-Y105 HydrophobicContact CD1-CE2 3.68Å; F89-Y105 AromaticContact CE1-CD2 3.82Å; F89-Y105 HydrophobicContact CE1-CD2 3.82Å; F89-Y105 AromaticContact CE1-CE2 3.51Å; F89-Y105 HydrophobicContact CE1-CE2 3.51Å; F89-V136 HydrophobicContact CZ-CG1 4.43Å; F89-L139 HydrophobicContact CE2-CB 4.05Å; F89-L139 HydrophobicContact CZ-CB 4.2Å; F89-L140 HydrophobicContact CD2-CD1 4.04Å; F89-L140 HydrophobicContact CE2-CB 4.36Å; F89-L140 HydrophobicContact CE2-CD1 4.42Å; F89-L140 HydrophobicContact CG-CD1 4.12Å; F89-F143 HydrophobicContact CB-CD1 3.94Å; F89-F143 HydrophobicContact CB-CE1 3.95Å; F89-F143 HydrophobicContact CB-CG 4.46Å; F89-F143 HydrophobicContact CB-CZ 4.49Å; F89-F143 HydrophobicContact CD2-CB 3.86Å; F89-F143 HydrophobicContact CD2-CD1 4.04Å; F89-F143 HydrophobicContact CD2-CD2 4.32Å; F89-F143 AromaticContact CD2-CG 3.81Å; F89-F143 HydrophobicContact CD2-CG 3.81Å; F89-F143 HydrophobicContact CE2-CB 4.34Å
90	A	97.1	Very high	95.9	Very high	2 Å²	2	51.4 Å²	51.4	2%	0.017	25%	0.249	C	C	.	.	H	α-helix	trans	-62.8	-37.7	177.5	0	0	0	0	0	112.3	L71 L86 L88 E92 L94	L71-A90 HydrophobicContact CD1-CB 3.93Å; L86-A90 WeakPolarHBondContact O-CB 3.44Å; L86-A90 PolarHBondContact O-N 3.36Å; L88-A90 VanDerWaalsContact C-N 3.33Å; L88-A90 PolarHBondContact O-N 3.26Å; A90-E92 VanDerWaalsContact C-N 3.29Å; A90-E92 PolarHBondContact O-N 2.75Å; A90-L94 HydrophobicContact CB-CB 4.4Å; A90-L94 HydrophobicContact CB-CD2 4.35Å; A90-L94 WeakPolarHBondContact O-CB 3.44Å; A90-L94 PolarHBondContact O-N 3.42Å; A90-L94 VanDerWaalsContact O-N 3.09Å
91	K	95.4	Very high	96	Very high	82 Å²	82	47.4 Å²	47.4	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-58	-42.6	176.4	171	178.7	178.5	-172	0	111.9	S87 L88 F89 P156 Y160	S87-K91 PolarHBondContact O-N 3.27Å; S87-K91 VanDerWaalsContact O-N 3.16Å; L88-K91 WeakPolarHBondContact O-CB 3.36Å; L88-K91 PolarHBondContact O-N 3.28Å; L88-K91 VanDerWaalsContact O-N 3.16Å; F89-K91 VanDerWaalsContact C-N 3.32Å; F89-K91 PolarHBondContact O-N 3.2Å; K91-P156 HydrophobicContact CB-CG 4.06Å; K91-P156 HydrophobicContact CD-CB 3.6Å; K91-P156 HydrophobicContact CD-CG 3.89Å; K91-Y160 HydrophobicContact CB-CE1 4.13Å; K91-Y160 HydrophobicContact CB-CE2 3.97Å; K91-Y160 HydrophobicContact CD-CD1 3.97Å; K91-Y160 HydrophobicContact CD-CE1 4.14Å; K91-Y160 HydrophobicContact CD-CG 4.22Å; K91-Y160 HydrophobicContact CG-CD1 3.99Å; K91-Y160 HydrophobicContact CG-CD2 3.81Å; K91-Y160 HydrophobicContact CG-CE1 3.94Å; K91-Y160 HydrophobicContact CG-CE2 3.75Å; K91-Y160 HydrophobicContact CG-CG 3.94Å
92	E	93.8	Very high	96	Very high	77 Å²	77	43.3 Å²	43.3	36%	0.36	21%	0.208	S	C	.	.	H	α-helix	trans	-85.7	-38.4	-174.2	-70	178.5	-153.7	0	0	113.2	L88 F89 A90 H96 F143	L88-E92 PolarHBondContact O-N 2.74Å; F89-E92 PolarHBondContact O-N 3.13Å; A90-E92 VanDerWaalsContact C-N 3.29Å; A90-E92 PolarHBondContact O-N 2.75Å; E92-H96 PolarHBondContact O-CE1 3.33Å; E92-H96 VanDerWaalsContact O-CE1 3.31Å; E92-H96 PolarHBondContact O-ND1 2.91Å; E92-F143 WeakPolarHBondContact OE2-CE2 3.21Å
93	H	95.4	Very high	96	Very high	50 Å²	50	44.7 Å²	44.7	23%	0.231	22%	0.215	C	C	.	.	H	α-helix	trans	-103	-30.4	-169.3	-65.2	-73.8	0	0	0	114.4	F89 Q95 H96 M97	F89-H93 AromaticContact CD2-CD2 3.42Å; F89-H93 VanDerWaalsContact CD2-CD2 3.42Å; F89-H93 WeakPolarHBondContact CD2-CD2 3.3Å; F89-H93 HydrophobicContact CE1-CB 4.44Å; F89-H93 AromaticContact CE2-CD2 3.38Å; F89-H93 WeakPolarHBondContact CE2-CD2 3.2Å; F89-H93 AromaticContact CE2-NE2 3.88Å; F89-H93 HydrophobicContact CZ-CB 4.3Å; F89-H93 PolarHBondContact O-CD2 3.26Å; F89-H93 PolarHBondContact O-N 3.45Å; H93-Q95 VanDerWaalsContact C-N 3.35Å; H93-Q95 PolarHBondContact O-N 2.85Å; H93-H96 PolarHBondContact O-N 3.4Å; H93-M97 HydrophobicContact CB-CE 3.7Å; H93-M97 HydrophobicContact CB-SD 4.35Å; H93-M97 WeakPolarHBondContact O-CG 3.49Å; H93-M97 PolarHBondContact O-N 3.44Å
94	L	94.9	Very high	96	Very high	11 Å²	11	45.6 Å²	45.6	6%	0.058	22%	0.219	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66	-33.5	-164.8	-160.5	73.2	0	0	0	114	R67 L70 L71 A90 H96 M97 L102 Y105	R67-L94 HydrophobicContact CB-CD2 4.32Å; R67-L94 HydrophobicContact CB-CG 4.37Å; R67-L94 WeakPolarHBondContact CD-O 3.33Å; R67-L94 HydrophobicContact CG-CG 4.27Å; R67-L94 PolarHBondContact NE-O 3.5Å; R67-L94 VanDerWaalsContact NE-O 3.08Å; R67-L94 WeakPolarHBondContact O-CD2 3.4Å; L70-L94 HydrophobicContact CB-CD1 4.07Å; L70-L94 HydrophobicContact CB-CD2 4.4Å; L70-L94 HydrophobicContact CD1-CD1 4.41Å; L71-L94 HydrophobicContact CB-CD2 3.73Å; A90-L94 HydrophobicContact CB-CB 4.4Å; A90-L94 HydrophobicContact CB-CD2 4.35Å; A90-L94 WeakPolarHBondContact O-CB 3.44Å; A90-L94 PolarHBondContact O-N 3.42Å; A90-L94 VanDerWaalsContact O-N 3.09Å; L94-H96 VanDerWaalsContact C-N 3.33Å; L94-M97 HydrophobicContact CD1-SD 4.46Å; L94-L102 HydrophobicContact CD1-CD2 3.54Å; L94-L102 HydrophobicContact CG-CD2 4.17Å; L94-Y105 HydrophobicContact CD1-CD1 3.98Å; L94-Y105 HydrophobicContact CD1-CE1 4.07Å
95	Q	93.1	Very high	96	Very high	86 Å²	86	44.5 Å²	44.5	40%	0.402	21%	0.213	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.7	-31.2	177	-68.9	-177.9	-7.3	0	0	112.5	R67 H93	R67-Q95 PolarHBondContact NH2-O 2.68Å; H93-Q95 VanDerWaalsContact C-N 3.35Å; H93-Q95 PolarHBondContact O-N 2.85Å
96	H	92.8	Very high	96	Very high	145 Å²	145	44 Å²	44	67%	0.671	21%	0.21	S	C	*	.	T	Hydrogen-bonded Turn	trans	-94.1	-14.6	-174.5	-47.9	101.7	0	0	0	113.1	E92 H93 L94	E92-H96 PolarHBondContact O-CE1 3.33Å; E92-H96 VanDerWaalsContact O-CE1 3.31Å; E92-H96 PolarHBondContact O-ND1 2.91Å; H93-H96 PolarHBondContact O-N 3.4Å; L94-H96 VanDerWaalsContact C-N 3.33Å
97	M	95.4	Very high	95.9	Very high	6 Å²	6	48.1 Å²	48.1	3%	0.03	23%	0.226	C	C	.	.			trans	-67.1	140.3	179.7	-82.5	172	172.2	0	0	112.3	R67 F89 H93 L94 Q101 L102 V136 L139	R67-M97 PolarHBondContact NH2-O 3.45Å; F89-M97 HydrophobicContact CE1-CE 3.76Å; F89-M97 HydrophobicContact CZ-CE 3.7Å; H93-M97 HydrophobicContact CB-CE 3.7Å; H93-M97 HydrophobicContact CB-SD 4.35Å; H93-M97 WeakPolarHBondContact O-CG 3.49Å; H93-M97 PolarHBondContact O-N 3.44Å; L94-M97 HydrophobicContact CD1-SD 4.46Å; M97-Q101 HydrophobicContact CB-CB 4.01Å; M97-Q101 HydrophobicContact CG-CB 3.95Å; M97-L102 HydrophobicContact CB-CD2 3.83Å; M97-L102 HydrophobicContact CB-CG 4.06Å; M97-L102 HydrophobicContact SD-CD2 4.27Å; M97-V136 HydrophobicContact CE-CG1 4.36Å; M97-L139 HydrophobicContact CE-CD1 4.47Å
98	T	96.7	Very high	95.9	Very high	76 Å²	76	48.1 Å²	48.1	47%	0.466	23%	0.226	S	C	.	.			trans	-72.6	162.3	168.7	63.3	0	0	0	0	111	K100 Q101 L102	T98-K100 VanDerWaalsContact C-N 3.27Å; T98-K100 PolarHBondContact O-N 3.24Å; T98-Q101 WeakPolarHBondContact O-CB 3.21Å; T98-Q101 PolarHBondContact O-N 2.91Å; T98-Q101 WeakPolarHBondContact OG1-CG 3.5Å; T98-Q101 PolarHBondContact OG1-N 2.91Å; T98-Q101 PolarHBondContact OG1-OE1 3.12Å; T98-L102 WeakPolarHBondContact O-CG 3.21Å; T98-L102 PolarHBondContact O-N 3.35Å
99	E	95	Very high	95.9	Very high	106 Å²	106	47 Å²	47	50%	0.495	22%	0.22	S	C	.	.	H	α-helix	trans	-56.1	-40.9	177.8	-176.7	173.2	-166	0	0	112.8	Q101 L102 N103	E99-Q101 VanDerWaalsContact C-N 3.34Å; E99-Q101 PolarHBondContact O-N 3.45Å; E99-L102 WeakPolarHBondContact O-CB 3.34Å; E99-L102 PolarHBondContact O-N 3.44Å; E99-N103 PolarHBondContact O-N 3.46Å; E99-N103 PolarHBondContact O-OD1 2.68Å
100	K	95.6	Very high	95.8	Very high	147 Å²	147	49.4 Å²	49.4	64%	0.639	23%	0.233	S	C	*	.	H	α-helix	trans	-59.5	-44.6	175.6	-174.4	-176.4	177	-170.8	0	111.7	T98 L102 N103 L104	T98-K100 VanDerWaalsContact C-N 3.27Å; T98-K100 PolarHBondContact O-N 3.24Å; K100-L102 VanDerWaalsContact C-N 3.35Å; K100-N103 PolarHBondContact O-N 3.48Å; K100-L104 WeakPolarHBondContact O-CG 3.4Å; K100-L104 PolarHBondContact O-N 2.93Å
101	Q	96.8	Very high	95.7	Very high	36 Å²	36	52.3 Å²	52.3	17%	0.168	25%	0.246	C	C	.	.	H	α-helix	trans	-66.9	-36.6	177.3	-73	168.4	-28.6	0	0	111.9	M97 T98 E99 N103 L104 Y105 E135 V136	M97-Q101 HydrophobicContact CB-CB 4.01Å; M97-Q101 HydrophobicContact CG-CB 3.95Å; T98-Q101 WeakPolarHBondContact O-CB 3.21Å; T98-Q101 PolarHBondContact O-N 2.91Å; T98-Q101 WeakPolarHBondContact OG1-CG 3.5Å; T98-Q101 PolarHBondContact OG1-N 2.91Å; T98-Q101 PolarHBondContact OG1-OE1 3.12Å; E99-Q101 VanDerWaalsContact C-N 3.34Å; E99-Q101 PolarHBondContact O-N 3.45Å; Q101-N103 VanDerWaalsContact C-N 3.34Å; Q101-N103 PolarHBondContact O-N 3.16Å; Q101-L104 PolarHBondContact O-N 3.14Å; Q101-Y105 WeakPolarHBondContact O-CB 3.06Å; Q101-Y105 PolarHBondContact O-N 3.16Å; Q101-E135 HydrophobicContact CG-CG 4.38Å; Q101-E135 WeakPolarHBondContact CG-OE1 3.4Å; Q101-E135 PolarHBondContact NE2-OE2 3.32Å; Q101-V136 HydrophobicContact CB-CG2 4.32Å
102	L	97	Very high	95.5	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-62.6	-40.4	173.9	-66.9	174.2	0	0	0	111.5	I63 K66 R67 L70 L94 M97 T98 E99 K100 Y105 D106	I63-L102 HydrophobicContact CD1-CD1 4.31Å; I63-L102 HydrophobicContact CG1-CD1 3.76Å; K66-L102 HydrophobicContact CD-CB 4Å; K66-L102 HydrophobicContact CD-CD1 4.47Å; K66-L102 HydrophobicContact CG-CB 4.36Å; K66-L102 HydrophobicContact CG-CD1 4.47Å; R67-L102 HydrophobicContact CG-CD1 3.75Å; R67-L102 HydrophobicContact CG-CD2 4.06Å; L70-L102 HydrophobicContact CD1-CB 4.01Å; L70-L102 HydrophobicContact CD1-CD2 3.97Å; L94-L102 HydrophobicContact CD1-CD2 3.54Å; L94-L102 HydrophobicContact CG-CD2 4.17Å; M97-L102 HydrophobicContact CB-CD2 3.83Å; M97-L102 HydrophobicContact CB-CG 4.06Å; M97-L102 HydrophobicContact SD-CD2 4.27Å; T98-L102 WeakPolarHBondContact O-CG 3.21Å; T98-L102 PolarHBondContact O-N 3.35Å; E99-L102 WeakPolarHBondContact O-CB 3.34Å; E99-L102 PolarHBondContact O-N 3.44Å; K100-L102 VanDerWaalsContact C-N 3.35Å; L102-Y105 PolarHBondContact O-N 3.47Å; L102-D106 VanDerWaalsContact O-CB 3.31Å; L102-D106 WeakPolarHBondContact O-CB 3.37Å; L102-D106 PolarHBondContact O-N 2.97Å
103	N	96.3	Very high	95.3	Very high	29 Å²	29	50.5 Å²	50.5	16%	0.155	25%	0.252	C	S	.	.	H	α-helix	trans	-68.2	-39.4	177.1	-64	-1.7	0	0	0	111.9	E57 K66 E99 K100 Q101 Y105 D106 R107	E57-N103 WeakPolarHBondContact OE1-CB 3.31Å; E57-N103 VanDerWaalsContact OE1-CG 3.26Å; E57-N103 PolarHBondContact OE1-ND2 2.9Å; K66-N103 PolarHBondContact NZ-OD1 2.85Å; E99-N103 PolarHBondContact O-N 3.46Å; E99-N103 PolarHBondContact O-OD1 2.68Å; K100-N103 PolarHBondContact O-N 3.48Å; Q101-N103 VanDerWaalsContact C-N 3.34Å; Q101-N103 PolarHBondContact O-N 3.16Å; N103-Y105 VanDerWaalsContact C-N 3.32Å; N103-Y105 PolarHBondContact O-N 3.37Å; N103-D106 PolarHBondContact O-N 2.74Å; N103-R107 WeakPolarHBondContact O-CB 3.42Å; N103-R107 PolarHBondContact O-N 3.04Å
104	L	96.8	Very high	95.2	Very high	42 Å²	42	51.3 Å²	51.3	22%	0.22	26%	0.258	C	S	.	.	H	α-helix	trans	-62.9	-39.8	173.1	-68.6	177.6	0	0	0	111.7	K100 Q101 L108 N134 E135 V136	K100-L104 WeakPolarHBondContact O-CG 3.4Å; K100-L104 PolarHBondContact O-N 2.93Å; Q101-L104 PolarHBondContact O-N 3.14Å; L104-L108 WeakPolarHBondContact O-CB 3.22Å; L104-L108 PolarHBondContact O-N 3.47Å; L104-N134 HydrophobicContact CD1-CB 4.3Å; L104-E135 HydrophobicContact CD1-CG 3.96Å; L104-V136 HydrophobicContact CB-CB 4.38Å; L104-V136 HydrophobicContact CB-CG2 3.71Å; L104-V136 HydrophobicContact CD1-CG2 4.31Å
105	Y	97.6	Very high	95.1	Very high	0 Å²	0	52.3 Å²	52.3	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-68.4	-43.8	176.5	-175.5	-116.3	0	0	0	112.3	L70 S74 F89 L94 Q101 L102 N103 R107 L108 I109 V136	L70-Y105 HydrophobicContact CB-CD1 4.35Å; L70-Y105 HydrophobicContact CB-CE1 4.39Å; L70-Y105 HydrophobicContact CD1-CD1 4.26Å; L70-Y105 HydrophobicContact CD2-CD1 4.34Å; S74-Y105 WeakPolarHBondContact OG-CE1 3.26Å; S74-Y105 PolarHBondContact OG-OH 3.44Å; F89-Y105 HydrophobicContact CD1-CD2 4.44Å; F89-Y105 AromaticContact CD1-CE2 3.68Å; F89-Y105 HydrophobicContact CD1-CE2 3.68Å; F89-Y105 AromaticContact CE1-CD2 3.82Å; F89-Y105 HydrophobicContact CE1-CD2 3.82Å; F89-Y105 AromaticContact CE1-CE2 3.51Å; F89-Y105 HydrophobicContact CE1-CE2 3.51Å; L94-Y105 HydrophobicContact CD1-CD1 3.98Å; L94-Y105 HydrophobicContact CD1-CE1 4.07Å; Q101-Y105 WeakPolarHBondContact O-CB 3.06Å; Q101-Y105 PolarHBondContact O-N 3.16Å; L102-Y105 PolarHBondContact O-N 3.47Å; N103-Y105 VanDerWaalsContact C-N 3.32Å; N103-Y105 PolarHBondContact O-N 3.37Å; Y105-R107 VanDerWaalsContact C-N 3.32Å; Y105-R107 PolarHBondContact O-N 3.04Å; Y105-L108 WeakPolarHBondContact O-CB 2.95Å; Y105-L108 PolarHBondContact O-N 3.38Å; Y105-L108 VanDerWaalsContact O-N 3.16Å; Y105-I109 HydrophobicContact CD1-CD1 4.33Å; Y105-I109 HydrophobicContact CD2-CG2 4.1Å; Y105-I109 HydrophobicContact CE1-CD1 3.82Å; Y105-I109 HydrophobicContact CE1-CG2 4.38Å; Y105-I109 HydrophobicContact CE2-CG2 3.59Å; Y105-I109 WeakPolarHBondContact O-CG1 3.35Å; Y105-I109 PolarHBondContact O-N 3.39Å; Y105-V136 HydrophobicContact CD2-CG1 3.71Å; Y105-V136 HydrophobicContact CG-CG1 4.29Å
106	D	97	Very high	95.2	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.016	26%	0.264	C	S	.	.	H	α-helix	trans	-54.2	-51.3	174.9	-169.6	8	0	0	0	110.8	W55 R69 L70 L102 N103 L108 I109 N110	W55-D106 HydrophobicContact CZ2-CB 4.34Å; R69-D106 IonicContact CZ-OD1 3Å; R69-D106 IonicContact CZ-OD2 3.09Å; R69-D106 IonicContact NH1-OD1 3.75Å; R69-D106 PolarHBondContact NH1-OD1 3.38Å; R69-D106 IonicContact NH1-OD2 3.46Å; R69-D106 PolarHBondContact NH1-OD2 2.97Å; R69-D106 IonicContact NH2-OD1 2.96Å; R69-D106 IonicContact NH2-OD2 3.53Å; R69-D106 PolarHBondContact NH2-OD2 3.37Å; L70-D106 HydrophobicContact CD1-CB 4.39Å; L70-D106 VanDerWaalsContact CD2-CA 3.5Å; L70-D106 HydrophobicContact CD2-CB 3.58Å; L102-D106 VanDerWaalsContact O-CB 3.31Å; L102-D106 WeakPolarHBondContact O-CB 3.37Å; L102-D106 PolarHBondContact O-N 2.97Å; N103-D106 PolarHBondContact O-N 2.74Å; D106-L108 PolarHBondContact O-N 3.12Å; D106-I109 PolarHBondContact O-N 2.86Å; D106-N110 VanDerWaalsContact O-CB 3.3Å; D106-N110 WeakPolarHBondContact O-CB 3.3Å; D106-N110 PolarHBondContact O-N 3.19Å; D106-N110 PolarHBondContact O-ND2 3Å; D106-N110 PolarHBondContact OD1-ND2 2.96Å
107	R	96.2	Very high	95.3	Very high	87 Å²	87	48.6 Å²	48.6	33%	0.328	24%	0.243	S	C	.	.	H	α-helix	trans	-58.7	-47.1	176.4	-170.4	172.4	-175.2	176.5	7.3	111.4	W55 N103 Y105 I109 E111 I131 F132	W55-R107 HydrophobicContact CE3-CG 4.35Å; W55-R107 HydrophobicContact CH2-CB 3.96Å; W55-R107 HydrophobicContact CH2-CG 4.26Å; W55-R107 HydrophobicContact CZ2-CB 4Å; W55-R107 HydrophobicContact CZ2-CG 4.49Å; W55-R107 HydrophobicContact CZ3-CB 4.39Å; W55-R107 HydrophobicContact CZ3-CG 4.19Å; N103-R107 WeakPolarHBondContact O-CB 3.42Å; N103-R107 PolarHBondContact O-N 3.04Å; Y105-R107 VanDerWaalsContact C-N 3.32Å; Y105-R107 PolarHBondContact O-N 3.04Å; R107-I109 PolarHBondContact O-N 2.99Å; R107-E111 WeakPolarHBondContact CD-OE2 3.48Å; R107-E111 HydrophobicContact CG-CB 4.21Å; R107-E111 WeakPolarHBondContact CG-OE2 3.5Å; R107-E111 IonicContact CZ-OE1 3.51Å; R107-E111 IonicContact CZ-OE2 2.87Å; R107-E111 IonicContact NE-OE1 3.86Å; R107-E111 PolarHBondContact NE-OE1 3.48Å; R107-E111 IonicContact NE-OE2 3.47Å; R107-E111 PolarHBondContact NE-OE2 2.89Å; R107-E111 IonicContact NH2-OE1 2.72Å; R107-E111 PolarHBondContact NH2-OE1 2.96Å; R107-E111 IonicContact NH2-OE2 3.4Å; R107-E111 WeakPolarHBondContact O-CB 3.35Å; R107-E111 PolarHBondContact O-N 2.73Å; R107-I131 VanDerWaalsContact NH2-CG2 3.3Å; R107-F132 HydrophobicContact CG-CE1 4.19Å
108	L	96.6	Very high	95.4	Very high	0 Å²	0	48.4 Å²	48.4	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-58.7	-42.5	-179.5	175.4	60.3	0	0	0	113.6	L104 Y105 D106 P112 W121 F132 V136 M137 L140	L104-L108 WeakPolarHBondContact O-CB 3.22Å; L104-L108 PolarHBondContact O-N 3.47Å; Y105-L108 WeakPolarHBondContact O-CB 2.95Å; Y105-L108 PolarHBondContact O-N 3.38Å; Y105-L108 VanDerWaalsContact O-N 3.16Å; D106-L108 PolarHBondContact O-N 3.12Å; L108-P112 VanDerWaalsContact O-CD 3.26Å; L108-P112 WeakPolarHBondContact O-CD 3.39Å; L108-P112 WeakPolarHBondContact O-CG 3.46Å; L108-W121 HydrophobicContact CD1-CE3 4.31Å; L108-W121 HydrophobicContact CD1-CZ3 4.47Å; L108-F132 HydrophobicContact CB-CD1 4.43Å; L108-F132 HydrophobicContact CD1-CB 4.21Å; L108-F132 HydrophobicContact CD1-CD1 3.92Å; L108-F132 HydrophobicContact CD1-CG 4.2Å; L108-V136 HydrophobicContact CD2-CG1 4.1Å; L108-M137 HydrophobicContact CD1-CE 3.36Å; L108-M137 HydrophobicContact CD2-CE 4.32Å; L108-M137 HydrophobicContact CG-CE 4.48Å; L108-L140 HydrophobicContact CD2-CD2 3.94Å
109	I	96.4	Very high	95.4	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.005	23%	0.234	C	C	.	.	H	α-helix	trans	-89.6	-22.2	-174.1	69.1	173.8	0	0	0	113.5	L70 E73 R77 L86 Y105 D106 R107	L70-I109 HydrophobicContact CD2-CD1 4.07Å; E73-I109 HydrophobicContact CB-CD1 4.07Å; R77-I109 VanDerWaalsContact CZ-O 3.29Å; R77-I109 PolarHBondContact NH1-O 3.44Å; R77-I109 PolarHBondContact NH2-O 3.07Å; L86-I109 HydrophobicContact CD1-CG2 4.13Å; L86-I109 HydrophobicContact CD2-CG2 4.41Å; Y105-I109 HydrophobicContact CD1-CD1 4.33Å; Y105-I109 HydrophobicContact CD2-CG2 4.1Å; Y105-I109 HydrophobicContact CE1-CD1 3.82Å; Y105-I109 HydrophobicContact CE1-CG2 4.38Å; Y105-I109 HydrophobicContact CE2-CG2 3.59Å; Y105-I109 WeakPolarHBondContact O-CG1 3.35Å; Y105-I109 PolarHBondContact O-N 3.39Å; D106-I109 PolarHBondContact O-N 2.86Å; R107-I109 PolarHBondContact O-N 2.99Å
110	N	95.8	Very high	95.5	Very high	52 Å²	52	46.7 Å²	46.7	28%	0.278	22%	0.224	S	C	.	.	H	α-helix	trans	-114.4	-21.6	-171.4	-64.7	-41.5	0	0	0	114.9	E73 D106	E73-N110 PolarHBondContact OE2-ND2 2.63Å; D106-N110 VanDerWaalsContact O-CB 3.3Å; D106-N110 WeakPolarHBondContact O-CB 3.3Å; D106-N110 PolarHBondContact O-N 3.19Å; D106-N110 PolarHBondContact O-ND2 3Å; D106-N110 PolarHBondContact OD1-ND2 2.96Å
111	E	94.4	Very high	95.6	Very high	62 Å²	62	40.6 Å²	40.6	29%	0.29	20%	0.197	S	C	.	.	S	Bend	trans	-73.4	-42.6	176.3	-175.6	-179.8	-161.7	0	0	113	W55 R107 S113 F132	W55-E111 HydrophobicContact CB-CB 3.99Å; W55-E111 HydrophobicContact CB-CG 3.93Å; W55-E111 HydrophobicContact CG-CB 3.97Å; W55-E111 HydrophobicContact CG-CG 4.38Å; R107-E111 WeakPolarHBondContact CD-OE2 3.48Å; R107-E111 HydrophobicContact CG-CB 4.21Å; R107-E111 WeakPolarHBondContact CG-OE2 3.5Å; R107-E111 IonicContact CZ-OE1 3.51Å; R107-E111 IonicContact CZ-OE2 2.87Å; R107-E111 IonicContact NE-OE1 3.86Å; R107-E111 PolarHBondContact NE-OE1 3.48Å; R107-E111 IonicContact NE-OE2 3.47Å; R107-E111 PolarHBondContact NE-OE2 2.89Å; R107-E111 IonicContact NH2-OE1 2.72Å; R107-E111 PolarHBondContact NH2-OE1 2.96Å; R107-E111 IonicContact NH2-OE2 3.4Å; R107-E111 WeakPolarHBondContact O-CB 3.35Å; R107-E111 PolarHBondContact O-N 2.73Å; E111-S113 PolarHBondContact O-N 3.36Å; E111-F132 HydrophobicContact CB-CE1 4.26Å; E111-F132 HydrophobicContact CB-CZ 4.05Å; E111-F132 HydrophobicContact CG-CZ 4.08Å; E111-F132 WeakPolarHBondContact OE2-CE1 3.02Å; E111-F132 WeakPolarHBondContact OE2-CZ 3.11Å
112	P	92.8	Very high	95.6	Very high	20 Å²	20	39 Å²	39	13%	0.13	19%	0.19	C	C	.	.			trans	-69.5	128.8	177.4	-16	30.6	0	0	0	111.3	L108 N114 I118 W121 F132	L108-P112 VanDerWaalsContact O-CD 3.26Å; L108-P112 WeakPolarHBondContact O-CD 3.39Å; L108-P112 WeakPolarHBondContact O-CG 3.46Å; P112-N114 VanDerWaalsContact C-N 3.28Å; P112-N114 PolarHBondContact O-N 3.5Å; P112-I118 HydrophobicContact CB-CD1 4.41Å; P112-I118 HydrophobicContact CB-CG1 4.24Å; P112-I118 HydrophobicContact CG-CD1 4.28Å; P112-I118 HydrophobicContact CG-CG1 4.05Å; P112-W121 HydrophobicContact CB-CH2 3.85Å; P112-W121 HydrophobicContact CB-CZ3 4.04Å; P112-W121 HydrophobicContact CG-CH2 3.68Å; P112-W121 HydrophobicContact CG-CZ3 3.47Å; P112-W121 VanDerWaalsContact CG-CZ3 3.47Å; P112-F132 HydrophobicContact CG-CE1 4.31Å; P112-F132 HydrophobicContact CG-CE2 4.17Å; P112-F132 HydrophobicContact CG-CZ 3.78Å
113	S	89.7	Confident	95.5	Very high	101 Å²	101	41.7 Å²	41.7	71%	0.706	21%	0.206	S	C	*	.	S	Bend	trans	-69.7	-24.8	177.4	-178.4	0	0	0	0	113.6	L52 E111	L52-S113 VanDerWaalsContact CD1-CB 3.44Å; L52-S113 WeakPolarHBondContact CD1-OG 3.34Å; E111-S113 PolarHBondContact O-N 3.36Å
114	N	92.2	Very high	95.6	Very high	68 Å²	68	44.8 Å²	44.8	36%	0.364	22%	0.22	S	C	.	.			trans	-112.9	117	-171.6	178	16.3	0	0	0	110.8	P112 W116 D117	P112-N114 VanDerWaalsContact C-N 3.28Å; P112-N114 PolarHBondContact O-N 3.5Å; N114-W116 PolarHBondContact O-N 2.93Å; N114-W116 WeakPolarHBondContact OD1-CB 3.22Å; N114-W116 PolarHBondContact OD1-N 3.07Å; N114-W116 VanDerWaalsContact OD1-N 3.09Å; N114-D117 WeakPolarHBondContact CB-OD2 3.27Å; N114-D117 PolarHBondContact ND2-OD2 3.5Å; N114-D117 PolarHBondContact O-N 2.77Å; N114-D117 VanDerWaalsContact O-N 3.13Å
115	D	93.1	Very high	95.5	Very high	31 Å²	31	45.9 Å²	45.9	17%	0.166	24%	0.235	C	C	.	.	H	α-helix	trans	-56.8	-33.7	177.5	-93.2	-57.8	0	0	0	113.1	R77 G78 M79 N82 D117 I118 Y119	R77-D115 IonicContact CZ-OD1 3.12Å; R77-D115 IonicContact NE-OD1 2.75Å; R77-D115 PolarHBondContact NE-OD1 3.12Å; R77-D115 IonicContact NH2-OD1 2.71Å; R77-D115 PolarHBondContact NH2-OD1 2.63Å; G78-D115 PolarHBondContact N-OD2 2.87Å; M79-D115 HydrophobicContact CE-CB 3.61Å; M79-D115 HydrophobicContact CG-CB 4.28Å; M79-D115 HydrophobicContact SD-CB 4.29Å; N82-D115 PolarHBondContact ND2-O 3.02Å; N82-D115 PolarHBondContact ND2-OD1 3.18Å; N82-D115 VanDerWaalsContact ND2-OD1 3.16Å; D115-D117 PolarHBondContact O-N 2.76Å; D115-I118 PolarHBondContact O-N 3.31Å; D115-Y119 PolarHBondContact O-N 2.94Å
116	W	94.9	Very high	95.5	Very high	108 Å²	108	50.8 Å²	50.8	41%	0.409	26%	0.256	S	S	.	.	H	α-helix	trans	-63.6	-32.5	-179.8	-77.5	106	0	0	0	112.6	M79 N114 Y119 Y120	M79-W116 HydrophobicContact CE-CB 4.12Å; M79-W116 HydrophobicContact CE-CD2 3.23Å; M79-W116 HydrophobicContact CE-CE3 3.74Å; M79-W116 HydrophobicContact CE-CG 3.4Å; M79-W116 VanDerWaalsContact CE-CG 3.4Å; M79-W116 HydrophobicContact CE-CH2 4.29Å; M79-W116 HydrophobicContact CE-CZ2 3.87Å; M79-W116 HydrophobicContact CE-CZ3 4.23Å; M79-W116 HydrophobicContact SD-CD2 4.27Å; M79-W116 HydrophobicContact SD-CE3 4.19Å; M79-W116 HydrophobicContact SD-CZ3 4.33Å; N114-W116 PolarHBondContact O-N 2.93Å; N114-W116 WeakPolarHBondContact OD1-CB 3.22Å; N114-W116 PolarHBondContact OD1-N 3.07Å; N114-W116 VanDerWaalsContact OD1-N 3.09Å; W116-Y119 HydrophobicContact CE3-CD1 4.38Å; W116-Y119 HydrophobicContact CZ3-CD1 4.29Å; W116-Y119 PolarHBondContact O-N 3.11Å; W116-Y120 HydrophobicContact CB-CD2 4.26Å; W116-Y120 HydrophobicContact CB-CE2 3.76Å; W116-Y120 HydrophobicContact CE3-CE1 4.36Å; W116-Y120 AromaticContact CE3-CZ 3.98Å; W116-Y120 WeakPolarHBondContact O-CD2 3.25Å; W116-Y120 VanDerWaalsContact O-CG 3.27Å; W116-Y120 PolarHBondContact O-N 3.35Å
117	D	95.6	Very high	95.4	Very high	46 Å²	46	56 Å²	56	25%	0.246	29%	0.29	C	S	.	.	H	α-helix	trans	-66.4	-41.7	-178.8	-66.6	-34.9	0	0	0	110.6	N114 D115 Y119 Y120 W121	N114-D117 WeakPolarHBondContact CB-OD2 3.27Å; N114-D117 PolarHBondContact ND2-OD2 3.5Å; N114-D117 PolarHBondContact O-N 2.77Å; N114-D117 VanDerWaalsContact O-N 3.13Å; D115-D117 PolarHBondContact O-N 2.76Å; D117-Y119 VanDerWaalsContact C-N 3.31Å; D117-Y119 PolarHBondContact O-N 3.43Å; D117-Y120 PolarHBondContact O-N 3.41Å; D117-W121 HydrophobicContact CB-CD2 4.48Å; D117-W121 HydrophobicContact CB-CH2 4.04Å; D117-W121 HydrophobicContact CB-CZ2 3.61Å; D117-W121 VanDerWaalsContact O-CD1 3.32Å; D117-W121 PolarHBondContact O-N 3.48Å
118	I	96.1	Very high	95.3	Very high	1 Å²	1	52.2 Å²	52.2	1%	0.005	28%	0.278	C	S	.	.	H	α-helix	trans	-57.9	-45.2	173.6	-62.6	165.2	0	0	0	110.7	P112 D115 W121 A122	P112-I118 HydrophobicContact CB-CD1 4.41Å; P112-I118 HydrophobicContact CB-CG1 4.24Å; P112-I118 HydrophobicContact CG-CD1 4.28Å; P112-I118 HydrophobicContact CG-CG1 4.05Å; D115-I118 PolarHBondContact O-N 3.31Å; I118-W121 HydrophobicContact CG1-CE3 4.36Å; I118-W121 HydrophobicContact CG1-CZ3 4.2Å; I118-W121 PolarHBondContact O-N 3.39Å; I118-A122 WeakPolarHBondContact O-CB 3.44Å; I118-A122 PolarHBondContact O-N 3.33Å
119	Y	96.8	Very high	95.3	Very high	73 Å²	73	54.9 Å²	54.9	29%	0.286	30%	0.295	S	S	.	.	H	α-helix	trans	-62.7	-44.5	178.5	-172.5	-103.4	0	0	0	112.1	E81 N82 L85 D115 W116 D117 W121 A122 T123	E81-Y119 HydrophobicContact CB-CD2 4.02Å; E81-Y119 HydrophobicContact CB-CE2 3.86Å; E81-Y119 HydrophobicContact CG-CE2 4.45Å; N82-Y119 WeakPolarHBondContact OD1-CB 3.4Å; L85-Y119 HydrophobicContact CD2-CD2 4.42Å; D115-Y119 PolarHBondContact O-N 2.94Å; W116-Y119 HydrophobicContact CE3-CD1 4.38Å; W116-Y119 HydrophobicContact CZ3-CD1 4.29Å; W116-Y119 PolarHBondContact O-N 3.11Å; D117-Y119 VanDerWaalsContact C-N 3.31Å; D117-Y119 PolarHBondContact O-N 3.43Å; Y119-W121 VanDerWaalsContact C-N 3.34Å; Y119-W121 PolarHBondContact O-N 3.21Å; Y119-A122 PolarHBondContact O-N 3.39Å; Y119-T123 HydrophobicContact CD1-CG2 4.33Å; Y119-T123 HydrophobicContact CD2-CG2 4.46Å; Y119-T123 HydrophobicContact CE1-CG2 3.9Å; Y119-T123 HydrophobicContact CE2-CG2 4.05Å; Y119-T123 WeakPolarHBondContact O-CB 3.41Å; Y119-T123 WeakPolarHBondContact O-CG2 3.35Å; Y119-T123 PolarHBondContact O-N 2.76Å; Y119-T123 PolarHBondContact O-OG1 2.92Å
120	Y	97.4	Very high	95.3	Very high	73 Å²	73	63.1 Å²	63.1	29%	0.286	33%	0.334	S	S	.	.	H	α-helix	trans	-65.5	-37	178.6	-65.7	-43.2	0	0	0	112.7	W116 D117 T123 E124 A125 K126	W116-Y120 HydrophobicContact CB-CD2 4.26Å; W116-Y120 HydrophobicContact CB-CE2 3.76Å; W116-Y120 HydrophobicContact CE3-CE1 4.36Å; W116-Y120 AromaticContact CE3-CZ 3.98Å; W116-Y120 WeakPolarHBondContact O-CD2 3.25Å; W116-Y120 VanDerWaalsContact O-CG 3.27Å; W116-Y120 PolarHBondContact O-N 3.35Å; D117-Y120 PolarHBondContact O-N 3.41Å; Y120-T123 WeakPolarHBondContact CA-OG1 3.47Å; Y120-T123 PolarHBondContact O-OG1 3.13Å; Y120-E124 PolarHBondContact O-N 2.92Å; Y120-E124 VanDerWaalsContact O-N 3.13Å; Y120-A125 HydrophobicContact CD1-CB 3.98Å; Y120-A125 PolarHBondContact O-N 3.16Å; Y120-K126 HydrophobicContact CD2-CD 3.91Å; Y120-K126 HydrophobicContact CG-CD 4.17Å; Y120-K126 HydrophobicContact CG-CG 4.34Å; Y120-K126 PolarHBondContact O-N 2.75Å
121	W	97.3	Very high	95.2	Very high	20 Å²	20	65.1 Å²	65.1	8%	0.076	34%	0.343	C	S	.	.	H	α-helix	trans	-69.3	-40.2	176.3	-57.5	-24.5	0	0	0	112.1	L108 P112 D117 I118 Y119 T123 E124 P127 A128 P129 F132 M137 R141	L108-W121 HydrophobicContact CD1-CE3 4.31Å; L108-W121 HydrophobicContact CD1-CZ3 4.47Å; P112-W121 HydrophobicContact CB-CH2 3.85Å; P112-W121 HydrophobicContact CB-CZ3 4.04Å; P112-W121 HydrophobicContact CG-CH2 3.68Å; P112-W121 HydrophobicContact CG-CZ3 3.47Å; P112-W121 VanDerWaalsContact CG-CZ3 3.47Å; D117-W121 HydrophobicContact CB-CD2 4.48Å; D117-W121 HydrophobicContact CB-CH2 4.04Å; D117-W121 HydrophobicContact CB-CZ2 3.61Å; D117-W121 VanDerWaalsContact O-CD1 3.32Å; D117-W121 PolarHBondContact O-N 3.48Å; I118-W121 HydrophobicContact CG1-CE3 4.36Å; I118-W121 HydrophobicContact CG1-CZ3 4.2Å; I118-W121 PolarHBondContact O-N 3.39Å; Y119-W121 VanDerWaalsContact C-N 3.34Å; Y119-W121 PolarHBondContact O-N 3.21Å; W121-T123 VanDerWaalsContact C-N 3.35Å; W121-E124 PolarHBondContact O-N 3.37Å; W121-P127 PolarHBondContact NE1-O 2.77Å; W121-A128 HydrophobicContact CB-CB 4Å; W121-A128 HydrophobicContact CD2-CB 4.27Å; W121-A128 HydrophobicContact CG-CB 3.85Å; W121-P129 VanDerWaalsContact CE2-CD 3.47Å; W121-P129 HydrophobicContact CH2-CG 4.3Å; W121-P129 VanDerWaalsContact CZ2-CD 3.45Å; W121-P129 HydrophobicContact CZ2-CG 3.82Å; W121-F132 HydrophobicContact CE3-CD2 4.45Å; W121-F132 AromaticContact CH2-CD2 3.82Å; W121-F132 HydrophobicContact CH2-CD2 3.82Å; W121-F132 AromaticContact CH2-CE2 3.72Å; W121-F132 HydrophobicContact CH2-CE2 3.72Å; W121-F132 AromaticContact CZ3-CD2 3.75Å; W121-F132 HydrophobicContact CZ3-CD2 3.75Å; W121-F132 AromaticContact CZ3-CE2 3.9Å; W121-F132 HydrophobicContact CZ3-CE2 3.9Å; W121-F132 HydrophobicContact CZ3-CG 4.25Å; W121-M137 HydrophobicContact CB-CE 3.64Å; W121-M137 HydrophobicContact CB-SD 4.05Å; W121-M137 HydrophobicContact CD2-CE 4.43Å; W121-M137 HydrophobicContact CE3-CE 3.98Å; W121-M137 HydrophobicContact CG-CE 4.35Å; W121-R141 PolarHBondContact O-NE 3.06Å; W121-R141 VanDerWaalsContact O-NE 3.07Å
122	A	96.8	Very high	95.2	Very high	2 Å²	2	62.7 Å²	62.7	2%	0.017	33%	0.332	C	S	.	.	H	α-helix	trans	-66.5	-37.1	177.2	0	0	0	0	0	112.1	L85 I118 Y119 E124 L140 R141 A144	L85-A122 HydrophobicContact CD2-CB 4.1Å; I118-A122 WeakPolarHBondContact O-CB 3.44Å; I118-A122 PolarHBondContact O-N 3.33Å; Y119-A122 PolarHBondContact O-N 3.39Å; A122-E124 VanDerWaalsContact C-N 3.31Å; A122-L140 HydrophobicContact CB-CD2 3.86Å; A122-L140 HydrophobicContact CB-CG 3.83Å; A122-R141 WeakPolarHBondContact O-CA 3.02Å; A122-A144 HydrophobicContact CB-CB 4.48Å; A122-A144 WeakPolarHBondContact O-CB 3.26Å
123	T	96.4	Very high	95.3	Very high	57 Å²	57	67.3 Å²	67.3	35%	0.35	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.8	1.3	179	54.1	0	0	0	0	113.8	Y119 Y120 W121 A125	Y119-T123 HydrophobicContact CD1-CG2 4.33Å; Y119-T123 HydrophobicContact CD2-CG2 4.46Å; Y119-T123 HydrophobicContact CE1-CG2 3.9Å; Y119-T123 HydrophobicContact CE2-CG2 4.05Å; Y119-T123 WeakPolarHBondContact O-CB 3.41Å; Y119-T123 WeakPolarHBondContact O-CG2 3.35Å; Y119-T123 PolarHBondContact O-N 2.76Å; Y119-T123 PolarHBondContact O-OG1 2.92Å; Y120-T123 WeakPolarHBondContact CA-OG1 3.47Å; Y120-T123 PolarHBondContact O-OG1 3.13Å; W121-T123 VanDerWaalsContact C-N 3.35Å; T123-A125 PolarHBondContact O-N 2.71Å; T123-A125 VanDerWaalsContact O-N 3.11Å
124	E	96.6	Very high	95.6	Very high	93 Å²	93	64 Å²	64	44%	0.435	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	58.9	17.2	-175.7	-57.8	173.4	164	0	0	113.2	Y120 W121 A122 K126 R141 K145	Y120-E124 PolarHBondContact O-N 2.92Å; Y120-E124 VanDerWaalsContact O-N 3.13Å; W121-E124 PolarHBondContact O-N 3.37Å; A122-E124 VanDerWaalsContact C-N 3.31Å; E124-K126 VanDerWaalsContact C-N 3.3Å; E124-R141 HydrophobicContact CG-CG 4.07Å; E124-R141 WeakPolarHBondContact OE1-CD 3.49Å; E124-K145 VanDerWaalsContact CD-NZ 3.27Å; E124-K145 IonicContact OE1-NZ 3.34Å; E124-K145 PolarHBondContact OE1-NZ 3.24Å; E124-K145 VanDerWaalsContact OE2-CE 3.25Å; E124-K145 WeakPolarHBondContact OE2-CE 3.27Å; E124-K145 IonicContact OE2-NZ 3.19Å; E124-K145 PolarHBondContact OE2-NZ 3.3Å
125	A	96.6	Very high	95.8	Very high	66 Å²	66	64.7 Å²	64.7	55%	0.545	33%	0.327	S	S	.	.	S	Bend	trans	-70.3	-29.3	176.7	0	0	0	0	0	112.1	Y120 T123	Y120-A125 HydrophobicContact CD1-CB 3.98Å; Y120-A125 PolarHBondContact O-N 3.16Å; T123-A125 PolarHBondContact O-N 2.71Å; T123-A125 VanDerWaalsContact O-N 3.11Å
126	K	95.9	Very high	96	Very high	102 Å²	102	63.2 Å²	63.2	44%	0.443	32%	0.319	S	S	.	.	S	Bend	trans	-134.1	147.8	170.8	-65.7	-177.3	-177.4	176.8	0	109.7	Y120 E124	Y120-K126 HydrophobicContact CD2-CD 3.91Å; Y120-K126 HydrophobicContact CG-CD 4.17Å; Y120-K126 HydrophobicContact CG-CG 4.34Å; Y120-K126 PolarHBondContact O-N 2.75Å; E124-K126 VanDerWaalsContact C-N 3.3Å
127	P	95.3	Very high	96.1	Very high	112 Å²	112	58.3 Å²	58.3	73%	0.727	30%	0.301	S	S	*	.	P	Polyproline II helix	trans	-63.5	141.4	173	28.3	-34.2	0	0	0	110.1	W121	W121-P127 PolarHBondContact NE1-O 2.77Å
128	A	95.4	Very high	96.2	Very high	9 Å²	9	59 Å²	59	7%	0.074	31%	0.313	C	S	.	.	P	Polyproline II helix	trans	-78.5	147.8	172.2	0	0	0	0	0	109.3	W121 F132 E133 M137	W121-A128 HydrophobicContact CB-CB 4Å; W121-A128 HydrophobicContact CD2-CB 4.27Å; W121-A128 HydrophobicContact CG-CB 3.85Å; A128-F132 HydrophobicContact CB-CB 4.48Å; A128-E133 HydrophobicContact CB-CG 4.22Å; A128-M137 HydrophobicContact CB-CE 4.01Å
129	P	96.3	Very high	96.2	Very high	55 Å²	55	61.8 Å²	61.8	36%	0.357	33%	0.328	S	S	.	.	P	Polyproline II helix	trans	-56.6	146.7	166.6	-22.8	31.1	0	0	0	111.4	W121 I131 F132 E133	W121-P129 VanDerWaalsContact CE2-CD 3.47Å; W121-P129 HydrophobicContact CH2-CG 4.3Å; W121-P129 VanDerWaalsContact CZ2-CD 3.45Å; W121-P129 HydrophobicContact CZ2-CG 3.82Å; P129-I131 PolarHBondContact O-N 2.93Å; P129-F132 HydrophobicContact CB-CD2 3.95Å; P129-F132 HydrophobicContact CB-CE2 4.47Å; P129-F132 HydrophobicContact CG-CD2 3.87Å; P129-F132 HydrophobicContact CG-CE2 4.25Å; P129-F132 WeakPolarHBondContact O-CA 3.34Å; P129-F132 PolarHBondContact O-N 2.95Å; P129-E133 PolarHBondContact O-N 3.1Å
130	E	94.9	Very high	96.2	Very high	174 Å²	174	58.3 Å²	58.3	81%	0.813	31%	0.314	S	S	*	.	G	3₁₀ helix	trans	-53.3	-32.5	-177.9	-64.2	179.5	179.9	0	0	113.1	F132 E133	E130-F132 PolarHBondContact O-N 2.78Å; E130-E133 PolarHBondContact O-N 3.42Å; E130-E133 VanDerWaalsContact O-N 3.13Å
131	I	93.6	Very high	96.2	Very high	94 Å²	94	57.1 Å²	57.1	48%	0.482	31%	0.309	S	S	.	.	G	3₁₀ helix	trans	-59.5	-34	177.4	-56.2	173.6	0	0	0	111.6	R107 P129	R107-I131 VanDerWaalsContact NH2-CG2 3.3Å; P129-I131 PolarHBondContact O-N 2.93Å
132	F	95.6	Very high	96.2	Very high	12 Å²	12	60 Å²	60	5%	0.053	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-96.9	-3.8	180	-58.6	-63.8	0	0	0	112.9	R107 L108 E111 P112 W121 A128 P129 E130 N134 M137	R107-F132 HydrophobicContact CG-CE1 4.19Å; L108-F132 HydrophobicContact CB-CD1 4.43Å; L108-F132 HydrophobicContact CD1-CB 4.21Å; L108-F132 HydrophobicContact CD1-CD1 3.92Å; L108-F132 HydrophobicContact CD1-CG 4.2Å; E111-F132 HydrophobicContact CB-CE1 4.26Å; E111-F132 HydrophobicContact CB-CZ 4.05Å; E111-F132 HydrophobicContact CG-CZ 4.08Å; E111-F132 WeakPolarHBondContact OE2-CE1 3.02Å; E111-F132 WeakPolarHBondContact OE2-CZ 3.11Å; P112-F132 HydrophobicContact CG-CE1 4.31Å; P112-F132 HydrophobicContact CG-CE2 4.17Å; P112-F132 HydrophobicContact CG-CZ 3.78Å; W121-F132 HydrophobicContact CE3-CD2 4.45Å; W121-F132 AromaticContact CH2-CD2 3.82Å; W121-F132 HydrophobicContact CH2-CD2 3.82Å; W121-F132 AromaticContact CH2-CE2 3.72Å; W121-F132 HydrophobicContact CH2-CE2 3.72Å; W121-F132 AromaticContact CZ3-CD2 3.75Å; W121-F132 HydrophobicContact CZ3-CD2 3.75Å; W121-F132 AromaticContact CZ3-CE2 3.9Å; W121-F132 HydrophobicContact CZ3-CE2 3.9Å; W121-F132 HydrophobicContact CZ3-CG 4.25Å; A128-F132 HydrophobicContact CB-CB 4.48Å; P129-F132 HydrophobicContact CB-CD2 3.95Å; P129-F132 HydrophobicContact CB-CE2 4.47Å; P129-F132 HydrophobicContact CG-CD2 3.87Å; P129-F132 HydrophobicContact CG-CE2 4.25Å; P129-F132 WeakPolarHBondContact O-CA 3.34Å; P129-F132 PolarHBondContact O-N 2.95Å; E130-F132 PolarHBondContact O-N 2.78Å; F132-N134 PolarHBondContact O-N 3.24Å; F132-M137 HydrophobicContact CB-CE 4.12Å; F132-M137 WeakPolarHBondContact O-CB 3.37Å
133	E	95	Very high	96.2	Very high	116 Å²	116	60.5 Å²	60.5	54%	0.542	33%	0.327	S	S	.	.			trans	-78	75.4	175.5	-66.2	-156.9	145.6	0	0	111	A128 P129 E130	A128-E133 HydrophobicContact CB-CG 4.22Å; P129-E133 PolarHBondContact O-N 3.1Å; E130-E133 PolarHBondContact O-N 3.42Å; E130-E133 VanDerWaalsContact O-N 3.13Å
134	N	95.7	Very high	96.2	Very high	32 Å²	32	59 Å²	59	17%	0.171	32%	0.321	C	S	.	.	S	Bend	trans	-132.5	-179.3	-176.7	62.2	42.8	0	0	0	112.3	L104 F132 V136 M137 A138	L104-N134 HydrophobicContact CD1-CB 4.3Å; F132-N134 PolarHBondContact O-N 3.24Å; N134-V136 PolarHBondContact O-N 3.37Å; N134-V136 WeakPolarHBondContact OD1-CB 3.09Å; N134-V136 PolarHBondContact OD1-N 3.13Å; N134-M137 PolarHBondContact O-N 3.42Å; N134-M137 PolarHBondContact OD1-N 3.19Å; N134-A138 PolarHBondContact O-N 3.48Å
135	E	96.4	Very high	96.1	Very high	83 Å²	83	59.9 Å²	59.9	39%	0.388	32%	0.324	S	S	.	.	H	α-helix	trans	-58	-34.1	-178.9	62.9	-178.8	147.8	0	0	113.2	Q101 L104 A138 L139	Q101-E135 HydrophobicContact CG-CG 4.38Å; Q101-E135 WeakPolarHBondContact CG-OE1 3.4Å; Q101-E135 PolarHBondContact NE2-OE2 3.32Å; L104-E135 HydrophobicContact CD1-CG 3.96Å; E135-A138 PolarHBondContact O-N 3.48Å; E135-L139 WeakPolarHBondContact O-CG 3.49Å; E135-L139 PolarHBondContact O-N 2.91Å
136	V	97.2	Very high	96	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-73.8	-39.9	-179	179.4	0	0	0	0	110.9	F89 M97 Q101 L104 Y105 L108 N134 A138 L139 L140	F89-V136 HydrophobicContact CZ-CG1 4.43Å; M97-V136 HydrophobicContact CE-CG1 4.36Å; Q101-V136 HydrophobicContact CB-CG2 4.32Å; L104-V136 HydrophobicContact CB-CB 4.38Å; L104-V136 HydrophobicContact CB-CG2 3.71Å; L104-V136 HydrophobicContact CD1-CG2 4.31Å; Y105-V136 HydrophobicContact CD2-CG1 3.71Å; Y105-V136 HydrophobicContact CG-CG1 4.29Å; L108-V136 HydrophobicContact CD2-CG1 4.1Å; N134-V136 PolarHBondContact O-N 3.37Å; N134-V136 WeakPolarHBondContact OD1-CB 3.09Å; N134-V136 PolarHBondContact OD1-N 3.13Å; V136-A138 VanDerWaalsContact C-N 3.32Å; V136-A138 PolarHBondContact O-N 2.96Å; V136-L139 PolarHBondContact O-N 3.44Å; V136-L140 WeakPolarHBondContact O-CB 3.44Å; V136-L140 PolarHBondContact O-N 3.12Å
137	M	97.3	Very high	95.9	Very high	4 Å²	4	60.6 Å²	60.6	2%	0.02	32%	0.316	C	S	.	.	H	α-helix	trans	-63.1	-39.6	172.4	177.2	60.4	75.2	0	0	111.6	L108 W121 A128 F132 N134 L140 R141	L108-M137 HydrophobicContact CD1-CE 3.36Å; L108-M137 HydrophobicContact CD2-CE 4.32Å; L108-M137 HydrophobicContact CG-CE 4.48Å; W121-M137 HydrophobicContact CB-CE 3.64Å; W121-M137 HydrophobicContact CB-SD 4.05Å; W121-M137 HydrophobicContact CD2-CE 4.43Å; W121-M137 HydrophobicContact CE3-CE 3.98Å; W121-M137 HydrophobicContact CG-CE 4.35Å; A128-M137 HydrophobicContact CB-CE 4.01Å; F132-M137 HydrophobicContact CB-CE 4.12Å; F132-M137 WeakPolarHBondContact O-CB 3.37Å; N134-M137 PolarHBondContact O-N 3.42Å; N134-M137 PolarHBondContact OD1-N 3.19Å; M137-L140 PolarHBondContact O-N 3.09Å; M137-R141 WeakPolarHBondContact O-CG 3.33Å; M137-R141 PolarHBondContact O-N 3.22Å; M137-R141 HydrophobicContact SD-CG 4.19Å
138	A	97.1	Very high	95.8	Very high	60 Å²	60	61.4 Å²	61.4	50%	0.496	31%	0.314	S	S	.	.	H	α-helix	trans	-61.6	-43.9	174.9	0	0	0	0	0	111.8	N134 E135 V136 R141 D142	N134-A138 PolarHBondContact O-N 3.48Å; E135-A138 PolarHBondContact O-N 3.48Å; V136-A138 VanDerWaalsContact C-N 3.32Å; V136-A138 PolarHBondContact O-N 2.96Å; A138-R141 PolarHBondContact O-N 3.5Å; A138-D142 PolarHBondContact O-N 3.13Å
139	L	96.6	Very high	95.6	Very high	61 Å²	61	69.9 Å²	69.9	32%	0.319	35%	0.349	S	S	.	.	H	α-helix	trans	-61.4	-43.3	173.4	-71.5	171.5	0	0	0	111.8	F89 M97 E135 V136 D142 F143	F89-L139 HydrophobicContact CE2-CB 4.05Å; F89-L139 HydrophobicContact CZ-CB 4.2Å; M97-L139 HydrophobicContact CE-CD1 4.47Å; E135-L139 WeakPolarHBondContact O-CG 3.49Å; E135-L139 PolarHBondContact O-N 2.91Å; V136-L139 PolarHBondContact O-N 3.44Å; L139-D142 PolarHBondContact O-N 3.24Å; L139-F143 VanDerWaalsContact O-CB 3.31Å; L139-F143 WeakPolarHBondContact O-CB 3.41Å; L139-F143 PolarHBondContact O-N 3.3Å
140	L	97.3	Very high	95.5	Very high	0 Å²	0	70.6 Å²	70.6	0%	0	35%	0.348	C	S	.	.	H	α-helix	trans	-64.7	-40.9	179.7	-177.2	61.6	0	0	0	112	L85 L86 F89 L108 A122 V136 M137 F143 A144	L85-L140 HydrophobicContact CD2-CD1 4.45Å; L85-L140 HydrophobicContact CG-CD1 4.42Å; L86-L140 HydrophobicContact CD2-CD1 3.98Å; L86-L140 HydrophobicContact CD2-CD2 4.33Å; F89-L140 HydrophobicContact CD2-CD1 4.04Å; F89-L140 HydrophobicContact CE2-CB 4.36Å; F89-L140 HydrophobicContact CE2-CD1 4.42Å; F89-L140 HydrophobicContact CG-CD1 4.12Å; L108-L140 HydrophobicContact CD2-CD2 3.94Å; A122-L140 HydrophobicContact CB-CD2 3.86Å; A122-L140 HydrophobicContact CB-CG 3.83Å; V136-L140 WeakPolarHBondContact O-CB 3.44Å; V136-L140 PolarHBondContact O-N 3.12Å; M137-L140 PolarHBondContact O-N 3.09Å; L140-F143 PolarHBondContact O-N 3.04Å; L140-A144 WeakPolarHBondContact O-CB 3.19Å; L140-A144 PolarHBondContact O-N 2.8Å
141	R	97.4	Very high	95.3	Very high	48 Å²	48	70.5 Å²	70.5	18%	0.181	35%	0.348	C	S	.	.	H	α-helix	trans	-65	-42.7	175	-72.6	177.5	-179	-170.5	15.3	112.1	W121 A122 E124 M137 A138 F143 A144 K145	W121-R141 PolarHBondContact O-NE 3.06Å; W121-R141 VanDerWaalsContact O-NE 3.07Å; A122-R141 WeakPolarHBondContact O-CA 3.02Å; E124-R141 HydrophobicContact CG-CG 4.07Å; E124-R141 WeakPolarHBondContact OE1-CD 3.49Å; M137-R141 WeakPolarHBondContact O-CG 3.33Å; M137-R141 PolarHBondContact O-N 3.22Å; M137-R141 HydrophobicContact SD-CG 4.19Å; A138-R141 PolarHBondContact O-N 3.5Å; R141-F143 VanDerWaalsContact C-N 3.33Å; R141-A144 PolarHBondContact O-N 3.19Å; R141-K145 WeakPolarHBondContact O-CG 3.4Å; R141-K145 PolarHBondContact O-N 2.87Å
142	D	96.9	Very high	95.3	Very high	79 Å²	79	68.6 Å²	68.6	42%	0.422	33%	0.334	S	S	.	.	H	α-helix	trans	-63.3	-43.5	175.7	-167.3	61.9	0	0	0	111.2	A138 L139 A144 K145 K147	A138-D142 PolarHBondContact O-N 3.13Å; L139-D142 PolarHBondContact O-N 3.24Å; D142-A144 PolarHBondContact O-N 2.95Å; D142-K145 PolarHBondContact O-N 3.37Å; D142-K147 WeakPolarHBondContact OD1-CE 3.41Å; D142-K147 IonicContact OD1-NZ 2.63Å; D142-K147 PolarHBondContact OD1-NZ 2.84Å
143	F	96.5	Very high	95.3	Very high	13 Å²	13	74.6 Å²	74.6	6%	0.057	37%	0.366	C	S	.	.	H	α-helix	trans	-60.2	-44.5	174.4	-169.7	-100.3	0	0	0	111.2	L85 L88 F89 E92 L139 L140 R141 K145 N146 R152	L85-F143 HydrophobicContact CD1-CD1 3.83Å; L85-F143 HydrophobicContact CD1-CE1 4.07Å; L88-F143 HydrophobicContact CB-CE1 3.99Å; L88-F143 HydrophobicContact CB-CZ 3.72Å; F89-F143 HydrophobicContact CB-CD1 3.94Å; F89-F143 HydrophobicContact CB-CE1 3.95Å; F89-F143 HydrophobicContact CB-CG 4.46Å; F89-F143 HydrophobicContact CB-CZ 4.49Å; F89-F143 HydrophobicContact CD2-CB 3.86Å; F89-F143 HydrophobicContact CD2-CD1 4.04Å; F89-F143 HydrophobicContact CD2-CD2 4.32Å; F89-F143 AromaticContact CD2-CG 3.81Å; F89-F143 HydrophobicContact CD2-CG 3.81Å; F89-F143 HydrophobicContact CE2-CB 4.34Å; E92-F143 WeakPolarHBondContact OE2-CE2 3.21Å; L139-F143 VanDerWaalsContact O-CB 3.31Å; L139-F143 WeakPolarHBondContact O-CB 3.41Å; L139-F143 PolarHBondContact O-N 3.3Å; L140-F143 PolarHBondContact O-N 3.04Å; R141-F143 VanDerWaalsContact C-N 3.33Å; F143-K145 VanDerWaalsContact C-N 3.26Å; F143-K145 PolarHBondContact O-N 2.91Å; F143-N146 PolarHBondContact O-N 3.08Å; F143-N146 VanDerWaalsContact O-N 3.13Å; F143-R152 PolarHBondContact O-NH1 3.16Å; F143-R152 PolarHBondContact O-NH2 3.01Å
144	A	95.8	Very high	95.3	Very high	26 Å²	26	77 Å²	77	22%	0.215	37%	0.37	C	S	.	.	H	α-helix	trans	-59.7	-33.6	179.6	0	0	0	0	0	113.1	L85 A122 L140 R141 D142 N146	L85-A144 HydrophobicContact CD1-CB 4.41Å; A122-A144 HydrophobicContact CB-CB 4.48Å; A122-A144 WeakPolarHBondContact O-CB 3.26Å; L140-A144 WeakPolarHBondContact O-CB 3.19Å; L140-A144 PolarHBondContact O-N 2.8Å; R141-A144 PolarHBondContact O-N 3.19Å; D142-A144 PolarHBondContact O-N 2.95Å; A144-N146 PolarHBondContact O-N 3.32Å
145	K	95.4	Very high	95.2	Very high	112 Å²	112	77 Å²	77	49%	0.487	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-18.9	178.4	-72.2	170.7	-176.6	172.3	0	113.9	E124 R141 D142 F143 K147	E124-K145 VanDerWaalsContact CD-NZ 3.27Å; E124-K145 IonicContact OE1-NZ 3.34Å; E124-K145 PolarHBondContact OE1-NZ 3.24Å; E124-K145 VanDerWaalsContact OE2-CE 3.25Å; E124-K145 WeakPolarHBondContact OE2-CE 3.27Å; E124-K145 IonicContact OE2-NZ 3.19Å; E124-K145 PolarHBondContact OE2-NZ 3.3Å; R141-K145 WeakPolarHBondContact O-CG 3.4Å; R141-K145 PolarHBondContact O-N 2.87Å; D142-K145 PolarHBondContact O-N 3.37Å; F143-K145 VanDerWaalsContact C-N 3.26Å; F143-K145 PolarHBondContact O-N 2.91Å; K145-K147 PolarHBondContact O-N 2.79Å
146	N	94.5	Very high	95.2	Very high	40 Å²	40	73.7 Å²	73.7	21%	0.214	36%	0.361	C	S	.	.			trans	46.9	52.6	175.5	-167.8	15.1	0	0	0	113.3	F143 A144 N148 K149 E150	F143-N146 PolarHBondContact O-N 3.08Å; F143-N146 VanDerWaalsContact O-N 3.13Å; A144-N146 PolarHBondContact O-N 3.32Å; N146-N148 PolarHBondContact O-N 2.77Å; N146-N148 VanDerWaalsContact O-N 3.14Å; N146-K149 PolarHBondContact O-N 2.71Å; N146-K149 PolarHBondContact OD1-N 2.97Å; N146-E150 PolarHBondContact ND2-N 3.02Å; N146-E150 PolarHBondContact ND2-O 3.1Å; N146-E150 PolarHBondContact OD1-N 2.75Å
147	K	93.4	Very high	95.1	Very high	143 Å²	143	77.8 Å²	77.8	62%	0.622	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.5	-32.4	-176.4	-67.7	171.6	177.8	164.4	0	112.8	D142 K145 K149	D142-K147 WeakPolarHBondContact OD1-CE 3.41Å; D142-K147 IonicContact OD1-NZ 2.63Å; D142-K147 PolarHBondContact OD1-NZ 2.84Å; K145-K147 PolarHBondContact O-N 2.79Å; K147-K149 VanDerWaalsContact C-N 3.26Å; K147-K149 PolarHBondContact O-N 2.72Å
148	N	93	Very high	95	Very high	129 Å²	129	81.4 Å²	81.4	69%	0.69	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.8	-5.3	179.3	-58.6	-23.3	0	0	0	113.6	N146 E150	N146-N148 PolarHBondContact O-N 2.77Å; N146-N148 VanDerWaalsContact O-N 3.14Å; N148-E150 HydrophobicContact CB-CG 3.94Å; N148-E150 WeakPolarHBondContact CB-OE1 3.48Å; N148-E150 PolarHBondContact ND2-OE1 2.89Å; N148-E150 PolarHBondContact O-N 2.77Å
149	K	92.3	Very high	94.8	Very high	186 Å²	186	84.9 Å²	84.9	81%	0.809	41%	0.408	S	S	*	.			trans	54.1	39.5	-177.3	-57.2	-180	-179	178.5	0	113.1	N146 K147	N146-K149 PolarHBondContact O-N 2.71Å; N146-K149 PolarHBondContact OD1-N 2.97Å; K147-K149 VanDerWaalsContact C-N 3.26Å; K147-K149 PolarHBondContact O-N 2.72Å
150	E	92.8	Very high	94.5	Very high	71 Å²	71	83.4 Å²	83.4	33%	0.332	40%	0.398	S	S	.	.			trans	-65.3	149.3	176.4	-69	157.8	-160.3	0	0	110.8	N146 N148 R152	N146-E150 PolarHBondContact ND2-N 3.02Å; N146-E150 PolarHBondContact ND2-O 3.1Å; N146-E150 PolarHBondContact OD1-N 2.75Å; N148-E150 HydrophobicContact CB-CG 3.94Å; N148-E150 WeakPolarHBondContact CB-OE1 3.48Å; N148-E150 PolarHBondContact ND2-OE1 2.89Å; N148-E150 PolarHBondContact O-N 2.77Å; E150-R152 PolarHBondContact O-N 2.78Å
151	Q	91.9	Very high	94.2	Very high	172 Å²	172	86.5 Å²	86.5	80%	0.804	41%	0.414	S	S	*	.			trans	-76.1	116	176.6	-68.1	-172	-7.2	0	0	110.5
152	R	93.8	Very high	93.8	Very high	53 Å²	53	92.6 Å²	92.6	20%	0.2	44%	0.443	C	S	.	.			trans	-112.1	63.2	179.1	-58.8	-169.2	174.9	167.8	-2.4	111.3	I84 L88 F143 E150	I84-R152 HydrophobicContact CG2-CB 4.16Å; L88-R152 HydrophobicContact CD1-CB 3.94Å; L88-R152 HydrophobicContact CD1-CG 3.72Å; F143-R152 PolarHBondContact O-NH1 3.16Å; F143-R152 PolarHBondContact O-NH2 3.01Å; E150-R152 PolarHBondContact O-N 2.78Å
153	L	94.1	Very high	93.3	Very high	138 Å²	138	94 Å²	94	72%	0.723	45%	0.446	S	S	*	.	S	Bend	trans	-95.7	-30.7	-174.9	-60.2	176.9	0	0	0	113.3
154	R	95	Very high	92.1	Very high	166 Å²	166	102.3 Å²	102.3	63%	0.626	48%	0.482	S	S	*	.	S	Bend	trans	-146.1	156.6	-175.7	60.5	-177.3	-80.9	173.1	-9.9	110.6	D157	R154-D157 IonicContact CZ-OD1 2.7Å; R154-D157 IonicContact NH2-OD1 2.76Å; R154-D157 PolarHBondContact NH2-OD1 3.04Å; R154-D157 IonicContact NH2-OD2 2.68Å; R154-D157 PolarHBondContact NH2-OD2 3.18Å
155	A	95.1	Very high	90.6	Very high	33 Å²	33	107.2 Å²	107.2	27%	0.273	51%	0.512	S	S	.	.	P	Polyproline II helix	trans	-60.7	145.6	167.3	0	0	0	0	0	110	S87	S87-A155 WeakPolarHBondContact OG-CB 3.37Å
156	P	95.3	Very high	88.8	Confident	13 Å²	13	115.9 Å²	115.9	8%	0.084	54%	0.542	C	S	.	.	P	Polyproline II helix	trans	-69.5	149.5	-179.8	28.3	-31.9	0	0	0	111	R75 S87 L88 K91 Y160	R75-P156 VanDerWaalsContact CZ-O 3.29Å; R75-P156 PolarHBondContact NH1-O 3.15Å; R75-P156 PolarHBondContact NH2-O 2.99Å; S87-P156 WeakPolarHBondContact OG-CD 3.25Å; L88-P156 HydrophobicContact CD2-CB 4.19Å; L88-P156 HydrophobicContact CD2-CG 3.99Å; K91-P156 HydrophobicContact CB-CG 4.06Å; K91-P156 HydrophobicContact CD-CB 3.6Å; K91-P156 HydrophobicContact CD-CG 3.89Å; P156-Y160 HydrophobicContact CB-CE1 4.49Å; P156-Y160 HydrophobicContact CG-CE1 4.44Å
157	D	95.4	Very high	88.5	Confident	86 Å²	86	119.7 Å²	119.7	46%	0.46	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-66.8	160	170.1	-58.2	-31	0	0	0	109.8	R154 E159 Y160	R154-D157 IonicContact CZ-OD1 2.7Å; R154-D157 IonicContact NH2-OD1 2.76Å; R154-D157 PolarHBondContact NH2-OD1 3.04Å; R154-D157 IonicContact NH2-OD2 2.68Å; R154-D157 PolarHBondContact NH2-OD2 3.18Å; D157-E159 VanDerWaalsContact C-N 3.3Å; D157-E159 PolarHBondContact O-N 3.28Å; D157-Y160 WeakPolarHBondContact O-CD1 3.25Å; D157-Y160 WeakPolarHBondContact O-CE1 3.28Å
158	L	94.8	Very high	88.3	Confident	80 Å²	80	118.5 Å²	118.5	42%	0.419	56%	0.555	S	S	.	*	G	3₁₀ helix	trans	-85.6	1.1	-172.6	-66.1	174.4	0	0	0	114	L71 Y160 L161	L71-L158 HydrophobicContact CD2-CD2 4.38Å; L158-Y160 VanDerWaalsContact C-N 3.27Å; L158-Y160 PolarHBondContact O-N 3.12Å; L158-L161 HydrophobicContact CB-CD1 4.38Å; L158-L161 HydrophobicContact CD2-CD1 4.06Å; L158-L161 WeakPolarHBondContact O-CB 3.36Å; L158-L161 PolarHBondContact O-N 3.05Å
159	E	93.7	Very high	88	Confident	134 Å²	134	117.9 Å²	117.9	63%	0.626	55%	0.547	S	S	*	.	G	3₁₀ helix	trans	-60.4	-33.8	-174	-63	-179	173.6	0	0	113.1	D157 L161 F162 E163	D157-E159 VanDerWaalsContact C-N 3.3Å; D157-E159 PolarHBondContact O-N 3.28Å; E159-L161 PolarHBondContact O-N 3.36Å; E159-F162 PolarHBondContact O-N 3.33Å; E159-E163 PolarHBondContact O-N 3.43Å
160	Y	90.9	Very high	87.8	Confident	29 Å²	29	113.9 Å²	113.9	11%	0.114	53%	0.532	C	S	.	.	G	3₁₀ helix	trans	-60.7	-16.3	179.2	74.2	-88.4	0	0	0	114.4	L71 K91 P156 D157 L158 F162	L71-Y160 WeakPolarHBondContact CD1-OH 3.31Å; K91-Y160 HydrophobicContact CB-CE1 4.13Å; K91-Y160 HydrophobicContact CB-CE2 3.97Å; K91-Y160 HydrophobicContact CD-CD1 3.97Å; K91-Y160 HydrophobicContact CD-CE1 4.14Å; K91-Y160 HydrophobicContact CD-CG 4.22Å; K91-Y160 HydrophobicContact CG-CD1 3.99Å; K91-Y160 HydrophobicContact CG-CD2 3.81Å; K91-Y160 HydrophobicContact CG-CE1 3.94Å; K91-Y160 HydrophobicContact CG-CE2 3.75Å; K91-Y160 HydrophobicContact CG-CG 3.94Å; P156-Y160 HydrophobicContact CB-CE1 4.49Å; P156-Y160 HydrophobicContact CG-CE1 4.44Å; D157-Y160 WeakPolarHBondContact O-CD1 3.25Å; D157-Y160 WeakPolarHBondContact O-CE1 3.28Å; L158-Y160 VanDerWaalsContact C-N 3.27Å; L158-Y160 PolarHBondContact O-N 3.12Å; Y160-F162 VanDerWaalsContact C-N 3.3Å
161	L	89.8	Confident	87.5	Confident	66 Å²	66	116.6 Å²	116.6	35%	0.346	55%	0.545	S	S	.	.	G	3₁₀ helix	trans	-76.3	-21.6	175.9	-61.7	174	0	0	0	112.6	L71 L158 E159	L71-L161 HydrophobicContact CD2-CD1 3.61Å; L71-L161 HydrophobicContact CD2-CD2 4.06Å; L71-L161 HydrophobicContact CD2-CG 4.41Å; L158-L161 HydrophobicContact CB-CD1 4.38Å; L158-L161 HydrophobicContact CD2-CD1 4.06Å; L158-L161 WeakPolarHBondContact O-CB 3.36Å; L158-L161 PolarHBondContact O-N 3.05Å; E159-L161 PolarHBondContact O-N 3.36Å
162	F	90.4	Very high	87.2	Confident	176 Å²	176	112.9 Å²	112.9	77%	0.772	53%	0.527	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.8	-15.5	-176.7	-49	-70.1	0	0	0	112.3	E159 Y160	E159-F162 PolarHBondContact O-N 3.33Å; Y160-F162 VanDerWaalsContact C-N 3.3Å
163	E	85.8	Confident	86.7	Confident	107 Å²	107	117.1 Å²	117.1	50%	0.5	55%	0.551	S	S	.	*	S	Bend	trans	-67.2	140.9	173.6	-70.9	-179.3	-148.3	0	0	110.9	E159	E159-E163 PolarHBondContact O-N 3.43Å
164	K	71.2	Confident	86.1	Confident	188 Å²	188	115.5 Å²	115.5	82%	0.817	54%	0.538	S	S	*	.	P	Polyproline II helix	trans	-68.2	140	172.7	-72.8	-178.4	178	179	0	109.3	R166	K164-R166 PolarHBondContact O-N 3.19Å
165	P	64.9	Low	85.4	Confident	129 Å²	129	111.3 Å²	111.3	84%	0.838	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-56.2	126.9	171.9	23.6	-31.2	0	0	0	108.5
166	R	57.4	Low	84.5	Confident	295 Å²	295	118.5 Å²	118.5	100%	1.113	55%	0.554	S	S	*	*			trans	-75.8	0	178	-70	-172.6	-168.3	-176.6	4.6	111.4	K164	K164-R166 PolarHBondContact O-N 3.19Å

Retrieved 166 of 166 residues in 432.1 ms (Link to these results)

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