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Cholesterol side-chain cleavage enzyme, mitochondrial

A cytochrome P450 monooxygenase that catalyzes the side-chain hydroxylation and cleavage of cholesterol to pregnenolone, the precursor of most steroid hormones. Catalyzes three sequential oxidation reactions of cholesterol, namely the hydroxylation at C22 followed with the hydroxylation at C20 to yield 20R,22R-hydroxycholesterol that is further cleaved between C20 and C22 to yield the C21-steroid pregnenolone and 4-methylpentanal. Mechanistically, uses molecular oxygen inserting one oxygen atom into a substrate and reducing the second into a water molecule. Two electrons are provided by NADPH via a two-protein mitochondrial transfer system comprising flavoprotein FDXR (adrenodoxin/ferredoxin reductase) and nonheme iron-sulfur protein FDX1 or FDX2 (adrenodoxin/ferredoxin).

AlphaFold DB , UniProt , Accession A0A087WRU6, Species MOUSE (Mus musculus, Mouse), Gene Cyp11a1, Length 279 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	33.3	Very low	28.2	Very low	242 Å²	242	160.8 Å²	160.8	100%	1.192	85%	0.854	S	S	*	*				0	126	0	-137.8	179.2	166.1	0	0	107.4
2	K	32.4	Very low	27.9	Very low	206 Å²	206	164.9 Å²	164.9	90%	0.896	85%	0.851	S	S	*	*			trans	83.7	101.5	-179.5	-62.6	-166.6	173.5	-175.1	0	118.2
3	E	28.6	Very low	27.5	Very low	191 Å²	191	161.4 Å²	161.4	89%	0.893	84%	0.842	S	S	*	*			trans	-65.2	148.8	155.4	-63	165.4	134.2	0	0	111.9
4	D	27.9	Very low	27.3	Very low	165 Å²	165	158.5 Å²	158.5	88%	0.882	84%	0.84	S	S	*	*			trans	-174.2	130.3	131.7	-128.1	-12.5	0	0	0	105.7
5	G	28.3	Very low	27.1	Very low	74 Å²	74	158.4 Å²	158.4	76%	0.763	83%	0.833	S	S	*	*			cis	100.4	64.8	39.1	0	0	0	0	0	110.1
6	G	26.5	Very low	26.9	Very low	75 Å²	75	158.3 Å²	158.3	77%	0.773	83%	0.833	S	S	*	*			trans	-151.8	90.8	-175.8	0	0	0	0	0	114.7	E8	G6-E8 PolarHBondContact O-N 3.34Å
7	R	28.5	Very low	26.9	Very low	238 Å²	238	157.1 Å²	157.1	90%	0.898	83%	0.833	S	S	*	*			trans	-53.2	123	168.2	-79.1	170.8	-177	154.2	1.9	111.2	K9	R7-K9 PolarHBondContact O-N 3.48Å
8	E	27.3	Very low	26.8	Very low	194 Å²	194	158.5 Å²	158.5	91%	0.907	83%	0.834	S	S	*	*			trans	-69.1	98.2	162.6	-131.8	173.8	-176.6	0	0	108.6	G6 V10	G6-E8 PolarHBondContact O-N 3.34Å; E8-V10 PolarHBondContact O-N 2.99Å
9	K	26.9	Very low	27.2	Very low	189 Å²	189	157.6 Å²	157.6	82%	0.822	84%	0.836	S	S	*	*			trans	-74.7	109	169.3	-77.3	-180	176.3	177.8	0	107.8	R7 A11	R7-K9 PolarHBondContact O-N 3.48Å; K9-A11 PolarHBondContact O-N 2.9Å
10	V	25.9	Very low	27.1	Very low	111 Å²	111	158.2 Å²	158.2	67%	0.673	83%	0.833	S	S	*	*			trans	-64.7	100	162.8	-178.3	0	0	0	0	107.6	E8 Y12	E8-V10 PolarHBondContact O-N 2.99Å; V10-Y12 HydrophobicContact CB-CE2 4.31Å; V10-Y12 HydrophobicContact CG1-CD2 3.89Å; V10-Y12 HydrophobicContact CG1-CE2 3.45Å; V10-Y12 VanDerWaalsContact CG1-CE2 3.45Å; V10-Y12 PolarHBondContact O-N 3.03Å
11	A	24	Very low	27.2	Very low	84 Å²	84	157 Å²	157	69%	0.694	83%	0.833	S	S	*	*			trans	-75.9	101.7	172.8	0	0	0	0	0	108.9	K9 T13	K9-A11 PolarHBondContact O-N 2.9Å; A11-T13 PolarHBondContact O-N 3.44Å
12	Y	24.6	Very low	26.8	Very low	210 Å²	210	154 Å²	154	82%	0.824	82%	0.815	S	S	*	*			trans	-78.8	101.8	160.6	-71.9	-85.5	0	0	0	107.8	V10 C14	V10-Y12 HydrophobicContact CB-CE2 4.31Å; V10-Y12 HydrophobicContact CG1-CD2 3.89Å; V10-Y12 HydrophobicContact CG1-CE2 3.45Å; V10-Y12 VanDerWaalsContact CG1-CE2 3.45Å; V10-Y12 PolarHBondContact O-N 3.03Å; Y12-C14 PolarHBondContact O-N 3.18Å; Y12-C14 VanDerWaalsContact O-N 3.12Å
13	T	23.6	Very low	26.8	Very low	119 Å²	119	149.9 Å²	149.9	73%	0.73	81%	0.807	S	S	*	*			trans	-67.5	103.4	171.5	15.3	0	0	0	0	109.4	A11 H15	A11-T13 PolarHBondContact O-N 3.44Å; T13-H15 PolarHBondContact O-N 3.13Å
14	C	24.1	Very low	26.9	Very low	121 Å²	121	148.4 Å²	148.4	82%	0.818	80%	0.8	S	S	*	*			trans	-70.6	103.3	165.1	-160.5	0	0	0	0	108	Y12	Y12-C14 PolarHBondContact O-N 3.18Å; Y12-C14 VanDerWaalsContact O-N 3.12Å
15	H	24.3	Very low	27	Very low	157 Å²	157	147.2 Å²	147.2	73%	0.727	79%	0.794	S	S	*	*			trans	-85.3	113.1	166.5	-91.8	49.1	0	0	0	109	T13 V17	T13-H15 PolarHBondContact O-N 3.13Å; H15-V17 PolarHBondContact O-N 3.32Å; H15-V17 VanDerWaalsContact O-N 3.13Å
16	N	24.9	Very low	27.3	Very low	157 Å²	157	147 Å²	147	84%	0.84	78%	0.778	S	S	*	*			trans	-46.1	111.7	159.7	-79.4	-28.2	0	0	0	109.7
17	V	26.7	Very low	27.7	Very low	137 Å²	137	144.2 Å²	144.2	83%	0.83	75%	0.748	S	S	*	*			trans	-93.2	117.5	161	176.8	0	0	0	0	107	H15 V19	H15-V17 PolarHBondContact O-N 3.32Å; H15-V17 VanDerWaalsContact O-N 3.13Å; V17-V19 PolarHBondContact O-N 3.31Å
18	Q	23.8	Very low	28.2	Very low	183 Å²	183	136 Å²	136	86%	0.855	72%	0.724	S	S	*	*			trans	-49.4	127.7	178.8	-75.2	163.6	-59.3	0	0	111.8	Q20	Q18-Q20 PolarHBondContact O-N 2.9Å
19	V	35.9	Very low	28.6	Very low	142 Å²	142	134 Å²	134	86%	0.861	72%	0.718	S	S	*	*			trans	-67.6	104.8	161.8	175.4	0	0	0	0	107.5	V17	V17-V19 PolarHBondContact O-N 3.31Å
20	Q	25.1	Very low	29.3	Very low	168 Å²	168	130.3 Å²	130.3	79%	0.785	70%	0.703	S	S	*	*			trans	-164.6	113.2	151.6	-109	165.8	7.9	0	0	110.9	Q18	Q18-Q20 PolarHBondContact O-N 2.9Å
21	T	27.7	Very low	29.8	Very low	134 Å²	134	127.8 Å²	127.8	82%	0.822	69%	0.689	S	S	*	*	S	Bend	trans	58.7	71.4	153.4	47.1	0	0	0	0	118.9
22	Q	26.1	Very low	30.6	Very low	178 Å²	178	131 Å²	131	83%	0.832	69%	0.688	S	S	*	*			trans	-144.7	80.1	155.3	-79	-170.8	-15.5	0	0	110.2
23	V	33	Very low	31.7	Very low	120 Å²	120	122.1 Å²	122.1	73%	0.727	66%	0.655	S	S	*	*			trans	-107.7	7	-177.2	-174.9	0	0	0	0	112.8
24	H	29.8	Very low	32.4	Very low	161 Å²	161	117.3 Å²	117.3	75%	0.745	62%	0.624	S	S	*	*	S	Bend	trans	-129.7	4.3	-172.2	-73.6	-46.8	0	0	0	118.3
25	D	29.6	Very low	33.2	Very low	139 Å²	139	121 Å²	121	74%	0.743	62%	0.621	S	S	*	*	S	Bend	trans	-116.1	2.2	178.8	-80.4	-38	0	0	0	115
26	T	35.6	Very low	34.7	Very low	69 Å²	69	122 Å²	122	42%	0.423	62%	0.619	S	S	.	*			trans	-90	-13.5	-169.8	15.9	0	0	0	0	115.5	V28 K30	T26-V28 PolarHBondContact O-N 3.44Å; T26-K30 WeakPolarHBondContact O-CG 3.38Å
27	A	35.2	Very low	36.6	Very low	18 Å²	18	116.5 Å²	116.5	15%	0.149	59%	0.586	C	S	.	*	T	Hydrogen-bonded Turn	trans	-73.8	-22.4	-171.6	0	0	0	0	0	114.4	A162	A27-A162 HydrophobicContact CB-CB 4.01Å
28	V	38.1	Very low	38.8	Very low	64 Å²	64	114 Å²	114	39%	0.388	57%	0.574	S	S	.	*	T	Hydrogen-bonded Turn	trans	-114	-0.9	-173.1	-178.4	0	0	0	0	114.2	T26 W158	T26-V28 PolarHBondContact O-N 3.44Å; V28-W158 HydrophobicContact CB-CH2 4.44Å; V28-W158 HydrophobicContact CG2-CH2 3.43Å; V28-W158 VanDerWaalsContact CG2-CH2 3.43Å; V28-W158 HydrophobicContact CG2-CZ2 3.97Å; V28-W158 HydrophobicContact CG2-CZ3 4.37Å
29	L	35.8	Very low	41.6	Very low	153 Å²	153	109.6 Å²	109.6	80%	0.801	56%	0.564	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.6	-4	175.8	-85.3	157.5	0	0	0	113.7	C31	L29-C31 PolarHBondContact O-N 3.44Å; L29-C31 VanDerWaalsContact O-N 3.12Å
30	K	41.7	Very low	44	Very low	112 Å²	112	109.1 Å²	109.1	49%	0.487	56%	0.556	S	S	.	*	S	Bend	trans	-82.7	93.4	175.5	-75.5	179.7	-179.9	-179.1	0	109.8	T26	T26-K30 WeakPolarHBondContact O-CG 3.38Å
31	C	37	Very low	46.9	Very low	58 Å²	58	102.8 Å²	102.8	39%	0.392	53%	0.533	S	S	.	.			trans	79.7	118.8	171.9	-135.1	0	0	0	0	115.8	L29 T33 A212	L29-C31 PolarHBondContact O-N 3.44Å; L29-C31 VanDerWaalsContact O-N 3.12Å; C31-T33 PolarHBondContact O-N 2.98Å; C31-A212 HydrophobicContact CB-CB 4.44Å
32	K	39.9	Very low	49.8	Very low	152 Å²	152	101.3 Å²	101.3	66%	0.661	51%	0.513	S	S	*	.			trans	-66.6	100.9	160.5	-79.4	-178.4	175.9	179.1	0	107.2	R37	K32-R37 HydrophobicContact CB-CG 4.19Å; K32-R37 PolarHBondContact O-NE 3.46Å
33	T	47.1	Very low	52.9	Low	23 Å²	23	98.4 Å²	98.4	14%	0.141	50%	0.497	C	S	.	.			trans	-54	155	170.8	48.8	0	0	0	0	111.1	C31 W35 R36 R37 E216	C31-T33 PolarHBondContact O-N 2.98Å; T33-W35 PolarHBondContact O-N 3.02Å; T33-W35 VanDerWaalsContact O-N 3.17Å; T33-R36 CarbonylContact O-C 3.58Å; T33-R36 WeakPolarHBondContact O-CA 3.44Å; T33-R36 PolarHBondContact O-N 2.85Å; T33-R37 WeakPolarHBondContact O-CG 3.32Å; T33-R37 PolarHBondContact O-N 2.89Å; T33-E216 VanDerWaalsContact C-OE1 3.31Å; T33-E216 WeakPolarHBondContact CA-OE1 3.09Å; T33-E216 VanDerWaalsContact CB-CD 3.47Å; T33-E216 WeakPolarHBondContact CB-OE1 3.37Å; T33-E216 HydrophobicContact CG2-CG 4.08Å; T33-E216 VanDerWaalsContact CG2-OE1 3.23Å; T33-E216 WeakPolarHBondContact CG2-OE1 3.3Å
34	E	40.3	Very low	55.6	Low	18 Å²	18	98.8 Å²	98.8	8%	0.084	49%	0.489	C	S	.	.	G	3₁₀ helix	trans	-51.2	-41.4	179.3	-175.4	179.2	-179.8	0	0	110.9	R36 R37 R46 L49 N213 E216	E34-R36 PolarHBondContact O-N 2.87Å; E34-R36 VanDerWaalsContact O-N 3.12Å; E34-R37 PolarHBondContact O-N 3.16Å; E34-R46 WeakPolarHBondContact OE1-CB 3.37Å; E34-R46 WeakPolarHBondContact OE1-CD 3.49Å; E34-L49 WeakPolarHBondContact OE2-CD1 3.5Å; E34-N213 WeakPolarHBondContact CB-OD1 3.49Å; E34-N213 PolarHBondContact OE2-OD1 3.31Å; E34-E216 PolarHBondContact N-OE1 3.12Å; E34-E216 PolarHBondContact N-OE2 3.47Å
35	W	39.9	Very low	58.4	Low	198 Å²	198	91.2 Å²	91.2	75%	0.75	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	-61.8	-15.4	175.9	-57.9	105.9	0	0	0	115.7	T33 E216	T33-W35 PolarHBondContact O-N 3.02Å; T33-W35 VanDerWaalsContact O-N 3.17Å; W35-E216 PolarHBondContact NE1-OE2 2.81Å
36	R	55.1	Low	61.4	Low	179 Å²	179	88.4 Å²	88.4	68%	0.675	43%	0.433	S	S	*	.	G	3₁₀ helix	trans	-117.9	14.1	-178.5	-74.8	-173.9	176	-146.7	-0.2	113.4	T33 E34	T33-R36 CarbonylContact O-C 3.58Å; T33-R36 WeakPolarHBondContact O-CA 3.44Å; T33-R36 PolarHBondContact O-N 2.85Å; E34-R36 PolarHBondContact O-N 2.87Å; E34-R36 VanDerWaalsContact O-N 3.12Å
37	R	65.1	Low	64.2	Low	41 Å²	41	89.3 Å²	89.3	16%	0.155	43%	0.434	C	S	.	.			trans	-87.1	153.5	179.7	-75	-177.1	-171.2	-178.1	18.8	113.1	K32 T33 E34 A41 W42 D45 N209	K32-R37 HydrophobicContact CB-CG 4.19Å; K32-R37 PolarHBondContact O-NE 3.46Å; T33-R37 WeakPolarHBondContact O-CG 3.32Å; T33-R37 PolarHBondContact O-N 2.89Å; E34-R37 PolarHBondContact O-N 3.16Å; R37-A41 HydrophobicContact CB-CB 4.13Å; R37-A41 HydrophobicContact CG-CB 4.47Å; R37-W42 HydrophobicContact CB-CB 4.11Å; R37-D45 IonicContact CZ-OD2 3.16Å; R37-D45 VanDerWaalsContact CZ-OD2 3.26Å; R37-D45 IonicContact NH1-OD1 3.06Å; R37-D45 PolarHBondContact NH1-OD1 3.25Å; R37-D45 IonicContact NH1-OD2 3.4Å; R37-D45 PolarHBondContact NH1-OD2 2.97Å; R37-D45 IonicContact NH2-OD2 3.74Å; R37-D45 PolarHBondContact NH2-OD2 2.86Å; R37-N209 PolarHBondContact NH1-ND2 2.95Å
38	S	74.2	Confident	66.9	Low	83 Å²	83	89.3 Å²	89.3	58%	0.58	43%	0.432	S	S	*	.			trans	-65.8	157.8	169	54.9	0	0	0	0	110.6	D40 A41 W42	S38-D40 PolarHBondContact O-N 3.16Å; S38-A41 PolarHBondContact O-N 3.37Å; S38-W42 PolarHBondContact O-N 3.45Å
39	S	81.6	Confident	69.6	Low	91 Å²	91	86.6 Å²	86.6	64%	0.636	42%	0.415	S	S	*	.	H	α-helix	trans	-46.2	-52.4	-170.6	-173.9	0	0	0	0	114.5	K43	S39-K43 WeakPolarHBondContact O-CB 3.38Å; S39-K43 PolarHBondContact O-N 3.32Å
40	D	86.2	Confident	72.4	Confident	132 Å²	132	82 Å²	82	71%	0.706	39%	0.392	S	S	*	.	H	α-helix	trans	-70.4	-37.2	-177.9	-66.4	-35.5	0	0	0	113.2	S38 K43 K44	S38-D40 PolarHBondContact O-N 3.16Å; D40-K43 PolarHBondContact O-N 2.82Å; D40-K44 WeakPolarHBondContact O-CB 3.34Å; D40-K44 PolarHBondContact O-N 3.44Å
41	A	85.5	Confident	74.8	Confident	36 Å²	36	80.9 Å²	80.9	30%	0.298	39%	0.388	S	S	.	.	H	α-helix	trans	-70.3	-36.9	179.4	0	0	0	0	0	111.7	R37 S38 D45	R37-A41 HydrophobicContact CB-CB 4.13Å; R37-A41 HydrophobicContact CG-CB 4.47Å; S38-A41 PolarHBondContact O-N 3.37Å; A41-D45 PolarHBondContact O-N 3.43Å
42	W	89.9	Confident	77.6	Confident	103 Å²	103	80 Å²	80	39%	0.39	38%	0.378	S	S	.	.	H	α-helix	trans	-62.9	-51.6	170.3	168.5	81.6	0	0	0	110.8	R37 S38 K44 D45 R46	R37-W42 HydrophobicContact CB-CB 4.11Å; S38-W42 PolarHBondContact O-N 3.45Å; W42-K44 VanDerWaalsContact C-N 3.26Å; W42-K44 PolarHBondContact O-N 3.21Å; W42-D45 PolarHBondContact O-N 3.1Å; W42-R46 HydrophobicContact CH2-CG 4.43Å; W42-R46 HydrophobicContact CZ2-CB 4.22Å; W42-R46 HydrophobicContact CZ2-CG 3.9Å; W42-R46 WeakPolarHBondContact O-CB 3.4Å; W42-R46 PolarHBondContact O-N 2.84Å
43	K	90	Very high	80.1	Confident	117 Å²	117	74.2 Å²	74.2	51%	0.509	36%	0.356	S	S	.	.	H	α-helix	trans	-58.2	-40.1	-177.1	-177.8	175	178.7	-179.4	0	111.9	S39 D40 I47	S39-K43 WeakPolarHBondContact O-CB 3.38Å; S39-K43 PolarHBondContact O-N 3.32Å; D40-K43 PolarHBondContact O-N 2.82Å; K43-I47 HydrophobicContact CG-CD1 3.8Å; K43-I47 HydrophobicContact CG-CG1 4.42Å; K43-I47 WeakPolarHBondContact O-CB 3.15Å; K43-I47 WeakPolarHBondContact O-CD1 3.29Å; K43-I47 VanDerWaalsContact O-CG1 3.23Å; K43-I47 WeakPolarHBondContact O-CG1 3.49Å; K43-I47 PolarHBondContact O-N 2.98Å
44	K	89.5	Confident	82.4	Confident	128 Å²	128	78.5 Å²	78.5	56%	0.557	38%	0.376	S	S	*	.	H	α-helix	trans	-61.5	-50.2	178.1	-176.3	176.6	177.8	178.6	0	112	D40 W42	D40-K44 WeakPolarHBondContact O-CB 3.34Å; D40-K44 PolarHBondContact O-N 3.44Å; W42-K44 VanDerWaalsContact C-N 3.26Å; W42-K44 PolarHBondContact O-N 3.21Å
45	D	89.3	Confident	84.9	Confident	2 Å²	2	79.1 Å²	79.1	1%	0.011	38%	0.384	C	S	.	.	H	α-helix	trans	-63.5	-47.5	177.8	-85	44.1	0	0	0	110.8	R37 A41 W42 I47 V48 L49 L205 N209 N213	R37-D45 IonicContact CZ-OD2 3.16Å; R37-D45 VanDerWaalsContact CZ-OD2 3.26Å; R37-D45 IonicContact NH1-OD1 3.06Å; R37-D45 PolarHBondContact NH1-OD1 3.25Å; R37-D45 IonicContact NH1-OD2 3.4Å; R37-D45 PolarHBondContact NH1-OD2 2.97Å; R37-D45 IonicContact NH2-OD2 3.74Å; R37-D45 PolarHBondContact NH2-OD2 2.86Å; A41-D45 PolarHBondContact O-N 3.43Å; W42-D45 PolarHBondContact O-N 3.1Å; D45-I47 VanDerWaalsContact C-N 3.33Å; D45-I47 PolarHBondContact O-N 3.19Å; D45-V48 PolarHBondContact O-N 3.46Å; D45-V48 VanDerWaalsContact O-N 3.09Å; D45-L49 HydrophobicContact CB-CD1 4.45Å; D45-L49 WeakPolarHBondContact O-CG 3.43Å; D45-L49 PolarHBondContact O-N 2.91Å; D45-L205 WeakPolarHBondContact OD1-CD2 3.48Å; D45-N209 PolarHBondContact OD1-ND2 3.4Å; D45-N209 VanDerWaalsContact OD1-ND2 3.16Å; D45-N213 PolarHBondContact OD2-ND2 3.49Å
46	R	92.4	Very high	87.3	Confident	80 Å²	80	74.5 Å²	74.5	30%	0.302	38%	0.38	S	S	.	.	H	α-helix	trans	-60.2	-39.7	-176.4	-171.6	53.1	176.6	-99.8	1.2	113.4	E34 W42 V48 N50	E34-R46 WeakPolarHBondContact OE1-CB 3.37Å; E34-R46 WeakPolarHBondContact OE1-CD 3.49Å; W42-R46 HydrophobicContact CH2-CG 4.43Å; W42-R46 HydrophobicContact CZ2-CB 4.22Å; W42-R46 HydrophobicContact CZ2-CG 3.9Å; W42-R46 WeakPolarHBondContact O-CB 3.4Å; W42-R46 PolarHBondContact O-N 2.84Å; R46-V48 VanDerWaalsContact C-N 3.33Å; R46-V48 PolarHBondContact O-N 3.4Å; R46-N50 WeakPolarHBondContact CD-OD1 3.41Å; R46-N50 PolarHBondContact NE-OD1 3.37Å; R46-N50 VanDerWaalsContact O-CB 3.22Å; R46-N50 WeakPolarHBondContact O-CB 3.38Å; R46-N50 PolarHBondContact O-N 3.34Å; R46-N50 PolarHBondContact O-ND2 3.4Å
47	I	93.8	Very high	88.9	Confident	88 Å²	88	68.5 Å²	68.5	45%	0.451	37%	0.373	S	S	.	.	H	α-helix	trans	-62.1	-43.1	177.7	-73.6	168	0	0	0	110.8	K43 D45 Q51	K43-I47 HydrophobicContact CG-CD1 3.8Å; K43-I47 HydrophobicContact CG-CG1 4.42Å; K43-I47 WeakPolarHBondContact O-CB 3.15Å; K43-I47 WeakPolarHBondContact O-CD1 3.29Å; K43-I47 VanDerWaalsContact O-CG1 3.23Å; K43-I47 WeakPolarHBondContact O-CG1 3.49Å; K43-I47 PolarHBondContact O-N 2.98Å; D45-I47 VanDerWaalsContact C-N 3.33Å; D45-I47 PolarHBondContact O-N 3.19Å; I47-Q51 WeakPolarHBondContact O-CG 3.32Å
48	V	93.5	Very high	90.1	Very high	17 Å²	17	67 Å²	67	10%	0.103	37%	0.37	C	S	.	.	H	α-helix	trans	-70	-48.3	179.5	178.6	0	0	0	0	110.4	D45 R46 N50 Q51 L199 K204 L205	D45-V48 PolarHBondContact O-N 3.46Å; D45-V48 VanDerWaalsContact O-N 3.09Å; R46-V48 VanDerWaalsContact C-N 3.33Å; R46-V48 PolarHBondContact O-N 3.4Å; V48-N50 VanDerWaalsContact C-N 3.32Å; V48-N50 PolarHBondContact O-N 3.09Å; V48-Q51 WeakPolarHBondContact O-CB 3.47Å; V48-Q51 PolarHBondContact O-N 3.48Å; V48-Q51 VanDerWaalsContact O-N 3.11Å; V48-L199 HydrophobicContact CG1-CD2 4.02Å; V48-K204 HydrophobicContact CG1-CB 4.03Å; V48-K204 HydrophobicContact CG1-CD 4.45Å; V48-K204 HydrophobicContact CG2-CB 3.77Å; V48-K204 HydrophobicContact CG2-CD 4.25Å; V48-L205 HydrophobicContact CB-CD1 3.93Å; V48-L205 HydrophobicContact CB-CD2 4.36Å; V48-L205 HydrophobicContact CB-CG 4.01Å; V48-L205 HydrophobicContact CG1-CD1 3.8Å; V48-L205 HydrophobicContact CG1-CG 3.9Å; V48-L205 HydrophobicContact CG2-CD2 4.19Å; V48-L205 HydrophobicContact CG2-CG 4.15Å
49	L	93.6	Very high	90.8	Very high	7 Å²	7	66.6 Å²	66.6	4%	0.037	36%	0.36	C	S	.	.	H	α-helix	trans	-59.5	-42.6	179.5	-68.1	167.2	0	0	0	111.7	E34 D45 Q51 E52 V53 L199 N213	E34-L49 WeakPolarHBondContact OE2-CD1 3.5Å; D45-L49 HydrophobicContact CB-CD1 4.45Å; D45-L49 WeakPolarHBondContact O-CG 3.43Å; D45-L49 PolarHBondContact O-N 2.91Å; L49-Q51 PolarHBondContact O-N 2.84Å; L49-Q51 VanDerWaalsContact O-N 3.17Å; L49-E52 PolarHBondContact O-N 3.44Å; L49-V53 HydrophobicContact CB-CG2 4.39Å; L49-V53 WeakPolarHBondContact O-CG2 3.38Å; L49-V53 PolarHBondContact O-N 3.09Å; L49-L199 HydrophobicContact CD2-CD1 4.04Å; L49-L199 HydrophobicContact CD2-CD2 4.18Å; L49-N213 HydrophobicContact CD1-CB 4.09Å; L49-N213 WeakPolarHBondContact CD1-OD1 3.24Å; L49-N213 HydrophobicContact CD2-CB 3.97Å
50	N	94.6	Very high	91.2	Very high	57 Å²	57	69.3 Å²	69.3	31%	0.305	36%	0.361	S	S	.	.	H	α-helix	trans	-57.8	-32.1	178.4	-78.8	-11.8	0	0	0	112.9	R46 V48 E52 M54 A55	R46-N50 WeakPolarHBondContact CD-OD1 3.41Å; R46-N50 PolarHBondContact NE-OD1 3.37Å; R46-N50 VanDerWaalsContact O-CB 3.22Å; R46-N50 WeakPolarHBondContact O-CB 3.38Å; R46-N50 PolarHBondContact O-N 3.34Å; R46-N50 PolarHBondContact O-ND2 3.4Å; V48-N50 VanDerWaalsContact C-N 3.32Å; V48-N50 PolarHBondContact O-N 3.09Å; N50-E52 VanDerWaalsContact C-N 3.27Å; N50-E52 PolarHBondContact O-N 3.37Å; N50-M54 HydrophobicContact CB-CB 4.29Å; N50-M54 CarbonylContact O-C 3.57Å; N50-M54 WeakPolarHBondContact O-CA 3.49Å; N50-M54 WeakPolarHBondContact O-CB 3.49Å; N50-M54 PolarHBondContact O-N 3.46Å; N50-M54 VanDerWaalsContact O-N 3.08Å; N50-M54 WeakPolarHBondContact OD1-CG 3.48Å; N50-A55 PolarHBondContact O-N 3.27Å
51	Q	93.4	Very high	91.6	Very high	88 Å²	88	66.2 Å²	66.2	41%	0.411	34%	0.344	S	S	.	.	H	α-helix	trans	-65	-34.9	176.6	-68.1	179.3	-10.8	0	0	111.5	I47 V48 L49 A55	I47-Q51 WeakPolarHBondContact O-CG 3.32Å; V48-Q51 WeakPolarHBondContact O-CB 3.47Å; V48-Q51 PolarHBondContact O-N 3.48Å; V48-Q51 VanDerWaalsContact O-N 3.11Å; L49-Q51 PolarHBondContact O-N 2.84Å; L49-Q51 VanDerWaalsContact O-N 3.17Å; Q51-A55 VanDerWaalsContact O-CB 3.29Å; Q51-A55 WeakPolarHBondContact O-CB 3.48Å
52	E	93.9	Very high	92	Very high	39 Å²	39	65.5 Å²	65.5	18%	0.182	33%	0.334	C	S	.	.	H	α-helix	trans	-95.2	-27.9	-175.6	-53.4	-50.6	147	0	0	113.7	L49 N50 A58 F62 V195 S198 L199	L49-E52 PolarHBondContact O-N 3.44Å; N50-E52 VanDerWaalsContact C-N 3.27Å; N50-E52 PolarHBondContact O-N 3.37Å; E52-A58 WeakPolarHBondContact O-CB 3.44Å; E52-F62 WeakPolarHBondContact O-CZ 3.38Å; E52-V195 HydrophobicContact CB-CG1 4.15Å; E52-S198 WeakPolarHBondContact OE2-CB 3.45Å; E52-L199 HydrophobicContact CB-CD2 4.3Å; E52-L199 HydrophobicContact CG-CD2 3.67Å; E52-L199 HydrophobicContact CG-CG 4.14Å
53	V	94.4	Very high	92.2	Very high	32 Å²	32	62.2 Å²	62.2	19%	0.194	33%	0.325	C	S	.	.	H	α-helix	trans	-116.4	-20.1	-172.5	-58.6	0	0	0	0	115	L49 V195 M217	L49-V53 HydrophobicContact CB-CG2 4.39Å; L49-V53 WeakPolarHBondContact O-CG2 3.38Å; L49-V53 PolarHBondContact O-N 3.09Å; V53-V195 HydrophobicContact CG1-CG1 3.73Å; V53-V195 HydrophobicContact CG1-CG2 4.11Å; V53-M217 HydrophobicContact CG1-CE 3.62Å; V53-M217 HydrophobicContact CG1-SD 4.22Å
54	M	93.7	Very high	92.3	Very high	112 Å²	112	60.4 Å²	60.4	55%	0.552	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117.1	-21.8	-175.6	-62.4	-61.6	-69.7	0	0	113.4	N50 I59	N50-M54 HydrophobicContact CB-CB 4.29Å; N50-M54 CarbonylContact O-C 3.57Å; N50-M54 WeakPolarHBondContact O-CA 3.49Å; N50-M54 WeakPolarHBondContact O-CB 3.49Å; N50-M54 PolarHBondContact O-N 3.46Å; N50-M54 VanDerWaalsContact O-N 3.08Å; N50-M54 WeakPolarHBondContact OD1-CG 3.48Å; M54-I59 VanDerWaalsContact O-CD1 3.31Å; M54-I59 WeakPolarHBondContact O-CD1 3.28Å
55	A	93.8	Very high	92.5	Very high	31 Å²	31	55.4 Å²	55.4	26%	0.256	31%	0.305	S	S	.	.	S	Bend	trans	-66.1	135.2	-178.2	0	0	0	0	0	110.5	N50 Q51 G57 A58 I59	N50-A55 PolarHBondContact O-N 3.27Å; Q51-A55 VanDerWaalsContact O-CB 3.29Å; Q51-A55 WeakPolarHBondContact O-CB 3.48Å; A55-G57 PolarHBondContact O-N 2.89Å; A55-G57 VanDerWaalsContact O-N 3.09Å; A55-A58 HydrophobicContact CB-CB 4.41Å; A55-A58 PolarHBondContact O-N 3.35Å; A55-I59 WeakPolarHBondContact O-CG1 3.34Å; A55-I59 PolarHBondContact O-N 2.98Å
56	P	89.3	Confident	92.9	Very high	102 Å²	102	58.5 Å²	58.5	66%	0.662	32%	0.321	S	S	*	.	H	α-helix	trans	-56.7	-30.6	179	-27.3	34.6	0	0	0	113.8	K60	P56-K60 WeakPolarHBondContact O-CG 3.48Å; P56-K60 PolarHBondContact O-N 2.94Å
57	G	88.3	Confident	93	Very high	52 Å²	52	57.8 Å²	57.8	54%	0.536	32%	0.321	S	S	.	.	H	α-helix	trans	-65.2	-41.1	174.9	0	0	0	0	0	112.8	A55	A55-G57 PolarHBondContact O-N 2.89Å; A55-G57 VanDerWaalsContact O-N 3.09Å
58	A	90.3	Very high	93.1	Very high	10 Å²	10	54.9 Å²	54.9	8%	0.083	31%	0.312	C	S	.	.	H	α-helix	trans	-73.8	-44.3	178.5	0	0	0	0	0	111.9	E52 A55 K60 N61	E52-A58 WeakPolarHBondContact O-CB 3.44Å; A55-A58 HydrophobicContact CB-CB 4.41Å; A55-A58 PolarHBondContact O-N 3.35Å; A58-K60 PolarHBondContact O-N 2.99Å; A58-K60 VanDerWaalsContact O-N 3.16Å; A58-N61 VanDerWaalsContact O-CB 3.31Å; A58-N61 WeakPolarHBondContact O-CB 3.36Å; A58-N61 PolarHBondContact O-N 3.43Å
59	I	90.1	Very high	93.3	Very high	75 Å²	75	54 Å²	54	39%	0.385	31%	0.308	S	S	.	.	H	α-helix	trans	-58.3	-33.7	-178.7	-66.8	170.4	0	0	0	112.4	M54 A55 N61 F62	M54-I59 VanDerWaalsContact O-CD1 3.31Å; M54-I59 WeakPolarHBondContact O-CD1 3.28Å; A55-I59 WeakPolarHBondContact O-CG1 3.34Å; A55-I59 PolarHBondContact O-N 2.98Å; I59-N61 PolarHBondContact O-N 3.14Å; I59-F62 HydrophobicContact CB-CD2 4.4Å; I59-F62 HydrophobicContact CG1-CD2 4.37Å; I59-F62 HydrophobicContact CG1-CE2 4.16Å; I59-F62 WeakPolarHBondContact O-CB 3.01Å; I59-F62 PolarHBondContact O-N 3.48Å
60	K	90.6	Very high	93.5	Very high	148 Å²	148	55.4 Å²	55.4	64%	0.643	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.1	-32.2	176.2	-77	174.6	-176	-174.4	0	112.7	P56 A58 F62	P56-K60 WeakPolarHBondContact O-CG 3.48Å; P56-K60 PolarHBondContact O-N 2.94Å; A58-K60 PolarHBondContact O-N 2.99Å; A58-K60 VanDerWaalsContact O-N 3.16Å; K60-F62 PolarHBondContact O-N 3.04Å
61	N	93	Very high	93.7	Very high	67 Å²	67	56.4 Å²	56.4	36%	0.358	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.2	-16.4	179.1	-58.8	-31.4	0	0	0	112.7	A58 I59 P64 Y192	A58-N61 VanDerWaalsContact O-CB 3.31Å; A58-N61 WeakPolarHBondContact O-CB 3.36Å; A58-N61 PolarHBondContact O-N 3.43Å; I59-N61 PolarHBondContact O-N 3.14Å; N61-P64 WeakPolarHBondContact O-CD 3.49Å; N61-Y192 HydrophobicContact CB-CD1 3.63Å; N61-Y192 HydrophobicContact CB-CD2 4.01Å; N61-Y192 HydrophobicContact CB-CE1 4.11Å; N61-Y192 HydrophobicContact CB-CE2 4.46Å; N61-Y192 HydrophobicContact CB-CG 3.57Å
62	F	94.9	Very high	93.9	Very high	21 Å²	21	53.4 Å²	53.4	9%	0.092	31%	0.309	C	S	.	.	H	α-helix	trans	-81.8	-22.2	-179.1	-54.2	-18.2	0	0	0	112.4	E52 I59 K60 L65 L66 V108 Y192 V195	E52-F62 WeakPolarHBondContact O-CZ 3.38Å; I59-F62 HydrophobicContact CB-CD2 4.4Å; I59-F62 HydrophobicContact CG1-CD2 4.37Å; I59-F62 HydrophobicContact CG1-CE2 4.16Å; I59-F62 WeakPolarHBondContact O-CB 3.01Å; I59-F62 PolarHBondContact O-N 3.48Å; K60-F62 PolarHBondContact O-N 3.04Å; F62-L65 PolarHBondContact O-N 2.76Å; F62-L66 HydrophobicContact CB-CD1 4.19Å; F62-L66 WeakPolarHBondContact O-CG 3.07Å; F62-L66 PolarHBondContact O-N 3.45Å; F62-V108 HydrophobicContact CB-CG2 4.16Å; F62-V108 HydrophobicContact CD1-CG1 3.78Å; F62-V108 HydrophobicContact CD2-CG1 4.04Å; F62-V108 HydrophobicContact CE1-CG1 3.78Å; F62-V108 HydrophobicContact CE2-CG1 4.02Å; F62-V108 HydrophobicContact CG-CG1 3.93Å; F62-V108 HydrophobicContact CG-CG2 4.25Å; F62-V108 HydrophobicContact CZ-CG1 3.89Å; F62-Y192 HydrophobicContact CD1-CE1 4.12Å; F62-Y192 AromaticContact CE1-CE1 3.82Å; F62-Y192 HydrophobicContact CE1-CE1 3.82Å; F62-V195 HydrophobicContact CE1-CG2 3.76Å; F62-V195 HydrophobicContact CZ-CG2 3.68Å
63	V	93.4	Very high	94.1	Very high	33 Å²	33	52.7 Å²	52.7	20%	0.2	31%	0.306	C	S	.	.	H	α-helix	trans	-55.8	-49.7	-175.6	176.5	0	0	0	0	112	L65 L66 E67 M261	V63-L65 VanDerWaalsContact C-N 3.34Å; V63-L65 PolarHBondContact O-N 2.91Å; V63-L66 PolarHBondContact O-N 3.44Å; V63-E67 WeakPolarHBondContact O-CB 3.45Å; V63-E67 PolarHBondContact O-N 3.32Å; V63-M261 HydrophobicContact CG1-CB 3.8Å; V63-M261 HydrophobicContact CG1-CG 3.47Å; V63-M261 VanDerWaalsContact CG1-CG 3.47Å
64	P	92.4	Very high	94.2	Very high	79 Å²	79	54.7 Å²	54.7	51%	0.513	31%	0.314	S	S	.	.	H	α-helix	trans	-65.4	-35.7	179	-21.1	34.8	0	0	0	113.4	N61 G68	N61-P64 WeakPolarHBondContact O-CD 3.49Å; P64-G68 PolarHBondContact O-N 3.03Å; P64-G68 VanDerWaalsContact O-N 3.16Å
65	L	94.9	Very high	94.4	Very high	23 Å²	23	55 Å²	55	12%	0.12	31%	0.312	C	S	.	.	H	α-helix	trans	-64.7	-50.3	179.1	-62.5	174	0	0	0	110.7	F62 V63 G68 V69 Y192	F62-L65 PolarHBondContact O-N 2.76Å; V63-L65 VanDerWaalsContact C-N 3.34Å; V63-L65 PolarHBondContact O-N 2.91Å; L65-G68 PolarHBondContact O-N 3.47Å; L65-V69 PolarHBondContact O-N 3.27Å; L65-Y192 HydrophobicContact CD1-CD1 4.15Å
66	L	96.8	Very high	94.6	Very high	68 Å²	68	54.2 Å²	54.2	36%	0.356	31%	0.305	S	S	.	.	H	α-helix	trans	-70.1	-35.8	180	-65.7	175.2	0	0	0	112.4	F62 V63 G68 V69 A70 V108	F62-L66 HydrophobicContact CB-CD1 4.19Å; F62-L66 WeakPolarHBondContact O-CG 3.07Å; F62-L66 PolarHBondContact O-N 3.45Å; V63-L66 PolarHBondContact O-N 3.44Å; L66-G68 VanDerWaalsContact C-N 3.32Å; L66-G68 PolarHBondContact O-N 3.47Å; L66-V69 PolarHBondContact O-N 2.93Å; L66-A70 WeakPolarHBondContact O-CB 2.93Å; L66-A70 PolarHBondContact O-N 3.11Å; L66-V108 HydrophobicContact CD1-CG2 4.37Å; L66-V108 HydrophobicContact CD2-CG2 3.69Å; L66-V108 HydrophobicContact CG-CG2 3.91Å
67	E	95.1	Very high	94.9	Very high	65 Å²	65	51.6 Å²	51.6	30%	0.304	29%	0.285	S	S	.	.	H	α-helix	trans	-59.8	-44	174.9	179	171.8	-157.8	0	0	111	V63 V69 A70 Q71 M261	V63-E67 WeakPolarHBondContact O-CB 3.45Å; V63-E67 PolarHBondContact O-N 3.32Å; E67-V69 VanDerWaalsContact C-N 3.34Å; E67-V69 PolarHBondContact O-N 2.85Å; E67-A70 PolarHBondContact O-N 2.98Å; E67-Q71 HydrophobicContact CG-CG 4.37Å; E67-Q71 WeakPolarHBondContact O-CG 3.31Å; E67-Q71 PolarHBondContact O-N 3.4Å; E67-M261 HydrophobicContact CG-CE 4.19Å; E67-M261 VanDerWaalsContact OE1-CE 3.22Å; E67-M261 WeakPolarHBondContact OE1-CE 3.27Å; E67-M261 WeakPolarHBondContact OE2-CB 3.36Å
68	G	95.4	Very high	95.2	Very high	26 Å²	26	54.3 Å²	54.3	27%	0.268	28%	0.284	S	S	.	.	H	α-helix	trans	-56.4	-46.6	176.5	0	0	0	0	0	112.6	P64 L65 L66 Q71 D72	P64-G68 PolarHBondContact O-N 3.03Å; P64-G68 VanDerWaalsContact O-N 3.16Å; L65-G68 PolarHBondContact O-N 3.47Å; L66-G68 VanDerWaalsContact C-N 3.32Å; L66-G68 PolarHBondContact O-N 3.47Å; G68-Q71 PolarHBondContact O-N 3.07Å; G68-D72 PolarHBondContact O-N 3.16Å; G68-D72 VanDerWaalsContact O-N 3.14Å
69	V	98.2	Very high	95.4	Very high	0 Å²	0	57.8 Å²	57.8	0%	0	30%	0.295	C	S	.	.	H	α-helix	trans	-64.8	-42.2	177.9	-177.7	0	0	0	0	111.6	L65 L66 E67 Q71 D72 F73 F100 E103 S104 L117	L65-V69 PolarHBondContact O-N 3.27Å; L66-V69 PolarHBondContact O-N 2.93Å; E67-V69 VanDerWaalsContact C-N 3.34Å; E67-V69 PolarHBondContact O-N 2.85Å; V69-Q71 PolarHBondContact O-N 3.03Å; V69-D72 PolarHBondContact O-N 3.21Å; V69-F73 PolarHBondContact O-N 2.81Å; V69-F100 HydrophobicContact CG1-CD2 3.78Å; V69-F100 HydrophobicContact CG1-CE2 3.83Å; V69-E103 HydrophobicContact CB-CG 4.43Å; V69-E103 HydrophobicContact CG1-CB 3.81Å; V69-E103 HydrophobicContact CG1-CG 3.7Å; V69-E103 HydrophobicContact CG2-CG 3.86Å; V69-S104 WeakPolarHBondContact CG1-OG 3.38Å; V69-L117 HydrophobicContact CG1-CD1 3.85Å
70	A	97.6	Very high	95.6	Very high	35 Å²	35	57.1 Å²	57.1	29%	0.289	29%	0.287	S	S	.	.	H	α-helix	trans	-62.5	-40.9	176.8	0	0	0	0	0	112.6	L66 E67 D72 F73 I74 F100	L66-A70 WeakPolarHBondContact O-CB 2.93Å; L66-A70 PolarHBondContact O-N 3.11Å; E67-A70 PolarHBondContact O-N 2.98Å; A70-D72 VanDerWaalsContact C-N 3.32Å; A70-D72 PolarHBondContact O-N 3.19Å; A70-F73 PolarHBondContact O-N 2.9Å; A70-I74 WeakPolarHBondContact O-CG1 3.42Å; A70-I74 PolarHBondContact O-N 3.33Å; A70-I74 VanDerWaalsContact O-N 3.08Å; A70-F100 HydrophobicContact CB-CE2 4.38Å
71	Q	97.4	Very high	95.8	Very high	78 Å²	78	52.7 Å²	52.7	36%	0.364	27%	0.27	S	S	.	.	H	α-helix	trans	-63.5	-38.8	175.7	-68.5	-56.7	-32.7	0	0	112	E67 G68 V69 I74 K75	E67-Q71 HydrophobicContact CG-CG 4.37Å; E67-Q71 WeakPolarHBondContact O-CG 3.31Å; E67-Q71 PolarHBondContact O-N 3.4Å; G68-Q71 PolarHBondContact O-N 3.07Å; V69-Q71 PolarHBondContact O-N 3.03Å; Q71-I74 WeakPolarHBondContact O-CB 3.35Å; Q71-I74 PolarHBondContact O-N 3.2Å; Q71-K75 WeakPolarHBondContact O-CG 3.47Å; Q71-K75 PolarHBondContact O-N 3.01Å
72	D	98.1	Very high	95.9	Very high	26 Å²	26	57.1 Å²	57.1	14%	0.139	29%	0.286	C	S	.	.	H	α-helix	trans	-69.7	-37.3	178.3	-68.4	-22.5	0	0	0	112.2	G68 V69 A70 I74 K75 V76 R113 L117	G68-D72 PolarHBondContact O-N 3.16Å; G68-D72 VanDerWaalsContact O-N 3.14Å; V69-D72 PolarHBondContact O-N 3.21Å; A70-D72 VanDerWaalsContact C-N 3.32Å; A70-D72 PolarHBondContact O-N 3.19Å; D72-I74 VanDerWaalsContact C-N 3.31Å; D72-I74 PolarHBondContact O-N 2.9Å; D72-K75 WeakPolarHBondContact O-CB 3.28Å; D72-K75 PolarHBondContact O-N 3.39Å; D72-K75 VanDerWaalsContact O-N 3.09Å; D72-K75 IonicContact OD1-NZ 2.62Å; D72-K75 PolarHBondContact OD1-NZ 3.14Å; D72-V76 WeakPolarHBondContact O-CG2 3.49Å; D72-V76 PolarHBondContact O-N 3.42Å; D72-R113 IonicContact OD2-CZ 3.21Å; D72-R113 IonicContact OD2-NH1 2.73Å; D72-R113 PolarHBondContact OD2-NH1 3.15Å; D72-R113 IonicContact OD2-NH2 3.09Å; D72-R113 PolarHBondContact OD2-NH2 3.18Å; D72-L117 HydrophobicContact CB-CB 4.44Å; D72-L117 HydrophobicContact CB-CD1 4.07Å
73	F	98.3	Very high	95.8	Very high	24 Å²	24	61.9 Å²	61.9	11%	0.105	31%	0.309	C	S	.	.	H	α-helix	trans	-61	-41.3	172.4	-170.9	-102.5	0	0	0	112.2	V69 A70 K75 V76 L77 D96 L97 F100 L117	V69-F73 PolarHBondContact O-N 2.81Å; A70-F73 PolarHBondContact O-N 2.9Å; F73-K75 VanDerWaalsContact C-N 3.32Å; F73-K75 PolarHBondContact O-N 2.95Å; F73-V76 WeakPolarHBondContact O-CB 3.29Å; F73-V76 PolarHBondContact O-N 3.29Å; F73-L77 HydrophobicContact CD1-CD1 4.12Å; F73-L77 HydrophobicContact CE1-CD1 3.75Å; F73-L77 HydrophobicContact CE1-CG 4.28Å; F73-L77 HydrophobicContact CZ-CD1 4.48Å; F73-L77 PolarHBondContact O-N 3.4Å; F73-L77 VanDerWaalsContact O-N 3.15Å; F73-D96 HydrophobicContact CE2-CB 3.8Å; F73-D96 HydrophobicContact CZ-CB 4.46Å; F73-L97 HydrophobicContact CE1-CD2 4.32Å; F73-L97 HydrophobicContact CE2-CD2 4.39Å; F73-L97 HydrophobicContact CZ-CD2 3.77Å; F73-L97 HydrophobicContact CZ-CG 4.39Å; F73-F100 HydrophobicContact CB-CD2 3.79Å; F73-F100 HydrophobicContact CB-CE2 4.31Å; F73-F100 HydrophobicContact CD2-CB 3.84Å; F73-F100 HydrophobicContact CD2-CD2 4.12Å; F73-F100 HydrophobicContact CD2-CG 4.23Å; F73-F100 HydrophobicContact CE2-CB 4.09Å; F73-F100 AromaticContact CG-CD2 3.98Å; F73-F100 HydrophobicContact CG-CD2 3.98Å; F73-F100 HydrophobicContact CG-CG 4.43Å; F73-L117 HydrophobicContact CB-CD1 4.11Å; F73-L117 HydrophobicContact CD2-CD2 4.09Å
74	I	97.6	Very high	95.6	Very high	73 Å²	73	64.4 Å²	64.4	37%	0.374	32%	0.318	S	S	.	.	H	α-helix	trans	-60.5	-41.5	173.4	-68.9	165.2	0	0	0	110.9	A70 Q71 D72 V76 L77 H78	A70-I74 WeakPolarHBondContact O-CG1 3.42Å; A70-I74 PolarHBondContact O-N 3.33Å; A70-I74 VanDerWaalsContact O-N 3.08Å; Q71-I74 WeakPolarHBondContact O-CB 3.35Å; Q71-I74 PolarHBondContact O-N 3.2Å; D72-I74 VanDerWaalsContact C-N 3.31Å; D72-I74 PolarHBondContact O-N 2.9Å; I74-V76 PolarHBondContact O-N 2.85Å; I74-L77 PolarHBondContact O-N 3.49Å; I74-H78 PolarHBondContact O-CD2 3.16Å; I74-H78 VanDerWaalsContact O-CD2 3.29Å; I74-H78 PolarHBondContact O-N 3.3Å
75	K	97.3	Very high	95	Very high	118 Å²	118	68 Å²	68	51%	0.513	33%	0.333	S	S	.	.	H	α-helix	trans	-62.9	-39.7	175.9	-67.9	170.5	-164.1	160.3	0	112.3	Q71 D72 F73 H78 R79	Q71-K75 WeakPolarHBondContact O-CG 3.47Å; Q71-K75 PolarHBondContact O-N 3.01Å; D72-K75 WeakPolarHBondContact O-CB 3.28Å; D72-K75 PolarHBondContact O-N 3.39Å; D72-K75 VanDerWaalsContact O-N 3.09Å; D72-K75 IonicContact OD1-NZ 2.62Å; D72-K75 PolarHBondContact OD1-NZ 3.14Å; F73-K75 VanDerWaalsContact C-N 3.32Å; F73-K75 PolarHBondContact O-N 2.95Å; K75-H78 PolarHBondContact O-N 3.01Å; K75-R79 WeakPolarHBondContact O-CB 3.42Å; K75-R79 PolarHBondContact O-N 2.94Å
76	V	96.9	Very high	94.5	Very high	16 Å²	16	69.9 Å²	69.9	10%	0.097	35%	0.348	C	S	.	.	H	α-helix	trans	-57.7	-49.6	175.1	172.6	0	0	0	0	110.5	D72 F73 I74 H78 R79 R80 L117	D72-V76 WeakPolarHBondContact O-CG2 3.49Å; D72-V76 PolarHBondContact O-N 3.42Å; F73-V76 WeakPolarHBondContact O-CB 3.29Å; F73-V76 PolarHBondContact O-N 3.29Å; I74-V76 PolarHBondContact O-N 2.85Å; V76-H78 PolarHBondContact O-N 3.01Å; V76-R79 PolarHBondContact O-N 3.2Å; V76-R80 WeakPolarHBondContact O-CG 3.42Å; V76-R80 PolarHBondContact O-N 3.42Å; V76-R80 VanDerWaalsContact O-N 3.08Å; V76-L117 HydrophobicContact CG2-CB 4.24Å; V76-L117 WeakPolarHBondContact CG2-O 3.33Å
77	L	96.2	Very high	94.1	Very high	47 Å²	47	69.8 Å²	69.8	25%	0.246	36%	0.364	C	S	.	.	H	α-helix	trans	-62.7	-44.5	178.9	-65.4	176.5	0	0	0	111.9	F73 I74 R79 R80 I81 F89 I93	F73-L77 HydrophobicContact CD1-CD1 4.12Å; F73-L77 HydrophobicContact CE1-CD1 3.75Å; F73-L77 HydrophobicContact CE1-CG 4.28Å; F73-L77 HydrophobicContact CZ-CD1 4.48Å; F73-L77 PolarHBondContact O-N 3.4Å; F73-L77 VanDerWaalsContact O-N 3.15Å; I74-L77 PolarHBondContact O-N 3.49Å; L77-R79 VanDerWaalsContact C-N 3.32Å; L77-R79 PolarHBondContact O-N 3.39Å; L77-R80 PolarHBondContact O-N 3.07Å; L77-I81 VanDerWaalsContact O-CG1 3.32Å; L77-I81 WeakPolarHBondContact O-CG1 3.45Å; L77-I81 PolarHBondContact O-N 3.33Å; L77-F89 HydrophobicContact CD2-CD1 4.5Å; L77-I93 HydrophobicContact CD2-CG2 4.46Å
78	H	95.8	Very high	94	Very high	109 Å²	109	70.8 Å²	70.8	51%	0.505	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-38.2	176	-81	-54	0	0	0	113.2	I74 K75 V76 I81 K82	I74-H78 PolarHBondContact O-CD2 3.16Å; I74-H78 VanDerWaalsContact O-CD2 3.29Å; I74-H78 PolarHBondContact O-N 3.3Å; K75-H78 PolarHBondContact O-N 3.01Å; V76-H78 PolarHBondContact O-N 3.01Å; H78-I81 PolarHBondContact O-N 3.43Å; H78-K82 WeakPolarHBondContact O-CG 3.48Å; H78-K82 PolarHBondContact O-N 3.02Å; H78-K82 VanDerWaalsContact O-N 3.09Å
79	R	94.6	Very high	93.9	Very high	83 Å²	83	72 Å²	72	31%	0.313	37%	0.369	S	S	.	.	H	α-helix	trans	-61.6	-45.2	175.2	-172.4	-175.1	-65.5	147.4	-4.4	110.7	K75 V76 L77 K82 Q83 E119	K75-R79 WeakPolarHBondContact O-CB 3.42Å; K75-R79 PolarHBondContact O-N 2.94Å; V76-R79 PolarHBondContact O-N 3.2Å; L77-R79 VanDerWaalsContact C-N 3.32Å; L77-R79 PolarHBondContact O-N 3.39Å; R79-K82 WeakPolarHBondContact O-CB 3.32Å; R79-K82 PolarHBondContact O-N 3.2Å; R79-Q83 WeakPolarHBondContact O-CG 3.42Å; R79-Q83 PolarHBondContact O-N 2.97Å; R79-E119 VanDerWaalsContact CD-OE1 3.22Å; R79-E119 WeakPolarHBondContact CD-OE1 3.38Å; R79-E119 IonicContact CZ-OE1 2.65Å; R79-E119 IonicContact NE-OE1 2.81Å; R79-E119 PolarHBondContact NE-OE1 2.98Å; R79-E119 VanDerWaalsContact NE-OE1 3.09Å; R79-E119 IonicContact NH1-OE1 2.66Å; R79-E119 PolarHBondContact NH1-OE1 3.47Å; R79-E119 VanDerWaalsContact NH1-OE1 3.16Å; R79-E119 IonicContact NH2-OE1 3.16Å
80	R	93.6	Very high	93.8	Very high	61 Å²	61	76.4 Å²	76.4	23%	0.23	40%	0.4	C	S	.	.	H	α-helix	trans	-66.4	-39.1	178.6	-68.7	-176.8	-178.7	178.8	7.2	113.2	V76 L77 K82 Q83 Q84 F89 D96	V76-R80 WeakPolarHBondContact O-CG 3.42Å; V76-R80 PolarHBondContact O-N 3.42Å; V76-R80 VanDerWaalsContact O-N 3.08Å; L77-R80 PolarHBondContact O-N 3.07Å; R80-K82 VanDerWaalsContact C-N 3.28Å; R80-K82 PolarHBondContact O-N 3.4Å; R80-Q83 PolarHBondContact O-N 2.91Å; R80-Q84 PolarHBondContact O-N 3.49Å; R80-F89 HydrophobicContact CB-CD2 3.6Å; R80-F89 HydrophobicContact CB-CE2 3.98Å; R80-F89 HydrophobicContact CB-CG 4.09Å; R80-F89 HydrophobicContact CG-CD2 4.47Å; R80-F89 HydrophobicContact CG-CE2 4.38Å; R80-D96 IonicContact CZ-OD1 3.14Å; R80-D96 IonicContact CZ-OD2 3.36Å; R80-D96 VanDerWaalsContact CZ-OD2 3.31Å; R80-D96 IonicContact NH1-OD1 2.68Å; R80-D96 IonicContact NH1-OD2 2.88Å; R80-D96 PolarHBondContact NH1-OD2 3.16Å; R80-D96 VanDerWaalsContact NH2-CG 3.28Å; R80-D96 IonicContact NH2-OD1 3.56Å; R80-D96 PolarHBondContact NH2-OD1 2.94Å; R80-D96 IonicContact NH2-OD2 3.26Å; R80-D96 PolarHBondContact NH2-OD2 2.94Å; R80-D96 VanDerWaalsContact NH2-OD2 3.16Å
81	I	95.3	Very high	93.6	Very high	54 Å²	54	77.1 Å²	77.1	28%	0.277	41%	0.411	S	S	.	.	H	α-helix	trans	-58	-44	172.8	-69.1	166	0	0	0	110.5	L77 H78 F89	L77-I81 VanDerWaalsContact O-CG1 3.32Å; L77-I81 WeakPolarHBondContact O-CG1 3.45Å; L77-I81 PolarHBondContact O-N 3.33Å; H78-I81 PolarHBondContact O-N 3.43Å; I81-F89 HydrophobicContact CB-CB 4.49Å; I81-F89 HydrophobicContact CG1-CB 3.54Å
82	K	93.6	Very high	93.4	Very high	161 Å²	161	79 Å²	79	70%	0.7	43%	0.428	S	S	*	.	H	α-helix	trans	-64.9	-39.9	176.6	-71.1	177.4	-178.6	-175.9	0	112.1	H78 R79 R80 Q84 N85	H78-K82 WeakPolarHBondContact O-CG 3.48Å; H78-K82 PolarHBondContact O-N 3.02Å; H78-K82 VanDerWaalsContact O-N 3.09Å; R79-K82 WeakPolarHBondContact O-CB 3.32Å; R79-K82 PolarHBondContact O-N 3.2Å; R80-K82 VanDerWaalsContact C-N 3.28Å; R80-K82 PolarHBondContact O-N 3.4Å; K82-Q84 PolarHBondContact O-N 2.99Å; K82-N85 PolarHBondContact O-N 3.49Å; K82-N85 PolarHBondContact O-OD1 3.19Å; K82-N85 VanDerWaalsContact O-OD1 3.12Å
83	Q	92.4	Very high	93.4	Very high	121 Å²	121	79.4 Å²	79.4	57%	0.565	43%	0.429	S	S	*	.	H	α-helix	trans	-67.5	-32.4	-179.6	-73.3	168.7	-16.3	0	0	113.5	R79 R80 N85	R79-Q83 WeakPolarHBondContact O-CG 3.42Å; R79-Q83 PolarHBondContact O-N 2.97Å; R80-Q83 PolarHBondContact O-N 2.91Å; Q83-N85 VanDerWaalsContact C-N 3.28Å; Q83-N85 PolarHBondContact O-N 3.03Å
84	Q	89.6	Confident	93.2	Very high	86 Å²	86	79.4 Å²	79.4	40%	0.402	43%	0.433	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.2	-7.5	179.9	-70.5	-167.4	0.6	0	0	114	R80 K82 S86 F89 S90	R80-Q84 PolarHBondContact O-N 3.49Å; K82-Q84 PolarHBondContact O-N 2.99Å; Q84-S86 PolarHBondContact O-N 3.27Å; Q84-F89 HydrophobicContact CG-CD2 4.47Å; Q84-S90 PolarHBondContact NE2-O 3.39Å
85	N	81.2	Confident	93.1	Very high	153 Å²	153	80.4 Å²	80.4	82%	0.818	44%	0.439	S	S	*	.	S	Bend	trans	53.3	7.2	177.3	-69.5	-29.3	0	0	0	116.6	K82 Q83	K82-N85 PolarHBondContact O-N 3.49Å; K82-N85 PolarHBondContact O-OD1 3.19Å; K82-N85 VanDerWaalsContact O-OD1 3.12Å; Q83-N85 VanDerWaalsContact C-N 3.28Å; Q83-N85 PolarHBondContact O-N 3.03Å
86	S	83.3	Confident	93	Very high	63 Å²	63	75.3 Å²	75.3	44%	0.441	42%	0.417	S	S	.	.	S	Bend	trans	-95.3	-5.5	179.3	60	0	0	0	0	113.2	Q84 N88	Q84-S86 PolarHBondContact O-N 3.27Å; S86-N88 PolarHBondContact O-N 3.36Å; S86-N88 PolarHBondContact OG-N 2.95Å; S86-N88 PolarHBondContact OG-O 2.84Å; S86-N88 PolarHBondContact OG-OD1 2.85Å
87	G	88.9	Confident	93.1	Very high	67 Å²	67	74.7 Å²	74.7	69%	0.691	41%	0.413	S	S	*	.	S	Bend	trans	74	4.1	-169.9	0	0	0	0	0	114
88	N	92.5	Very high	93.1	Very high	85 Å²	85	73.5 Å²	73.5	46%	0.455	41%	0.406	S	S	.	.	S	Bend	trans	-136.2	169.5	174.4	61.3	59.3	0	0	0	111.4	S86	S86-N88 PolarHBondContact O-N 3.36Å; S86-N88 PolarHBondContact OG-N 2.95Å; S86-N88 PolarHBondContact OG-O 2.84Å; S86-N88 PolarHBondContact OG-OD1 2.85Å
89	F	94.6	Very high	93.2	Very high	52 Å²	52	71 Å²	71	23%	0.228	39%	0.392	C	S	.	.			trans	-127.7	127.9	171	167.3	-101.9	0	0	0	108.8	L77 R80 I81 Q84 I93	L77-F89 HydrophobicContact CD2-CD1 4.5Å; R80-F89 HydrophobicContact CB-CD2 3.6Å; R80-F89 HydrophobicContact CB-CE2 3.98Å; R80-F89 HydrophobicContact CB-CG 4.09Å; R80-F89 HydrophobicContact CG-CD2 4.47Å; R80-F89 HydrophobicContact CG-CE2 4.38Å; I81-F89 HydrophobicContact CB-CB 4.49Å; I81-F89 HydrophobicContact CG1-CB 3.54Å; Q84-F89 HydrophobicContact CG-CD2 4.47Å; F89-I93 HydrophobicContact CE1-CG2 3.7Å; F89-I93 HydrophobicContact CZ-CG2 4.33Å
90	S	94.3	Very high	93.4	Very high	92 Å²	92	68.5 Å²	68.5	64%	0.643	38%	0.383	S	S	*	.			trans	-120.5	129	168.6	-62.9	0	0	0	0	109.7	Q84	Q84-S90 PolarHBondContact NE2-O 3.39Å
91	G	93.4	Very high	93.6	Very high	51 Å²	51	65.6 Å²	65.6	53%	0.526	37%	0.373	S	S	.	.	S	Bend	trans	173.3	162.8	179.2	0	0	0	0	0	112.6
92	V	95	Very high	93.7	Very high	118 Å²	118	63 Å²	63	72%	0.715	36%	0.359	S	S	*	.			trans	-76.1	129.8	172.6	-179.2	0	0	0	0	108.6	S94	V92-S94 WeakPolarHBondContact CG1-OG 3.42Å
93	I	96.5	Very high	93.9	Very high	33 Å²	33	55.4 Å²	55.4	17%	0.169	33%	0.326	C	S	.	.			trans	-115.7	13.6	-177.1	61.7	169	0	0	0	113.2	L77 F89 D95 D96 L97 L233	L77-I93 HydrophobicContact CD2-CG2 4.46Å; F89-I93 HydrophobicContact CE1-CG2 3.7Å; F89-I93 HydrophobicContact CZ-CG2 4.33Å; I93-D95 VanDerWaalsContact C-N 3.33Å; I93-D95 PolarHBondContact O-N 2.91Å; I93-D96 HydrophobicContact CB-CB 4.48Å; I93-D96 PolarHBondContact O-N 3.08Å; I93-L97 HydrophobicContact CD1-CD1 4.16Å; I93-L97 HydrophobicContact CD1-CG 4.33Å; I93-L97 HydrophobicContact CG1-CD1 4.08Å; I93-L97 HydrophobicContact CG1-CG 4.34Å; I93-L97 WeakPolarHBondContact O-CG 3.29Å; I93-L97 PolarHBondContact O-N 3.09Å; I93-L233 HydrophobicContact CD1-CD1 3.93Å
94	S	95.1	Very high	94.2	Very high	25 Å²	25	50.2 Å²	50.2	18%	0.175	30%	0.303	C	S	.	.	H	α-helix	trans	-55.9	-47.5	-179	51.9	0	0	0	0	111.8	V92 D96 L97 F98	V92-S94 WeakPolarHBondContact CG1-OG 3.42Å; S94-D96 VanDerWaalsContact C-N 3.28Å; S94-D96 PolarHBondContact O-N 3.46Å; S94-L97 WeakPolarHBondContact O-CB 3.48Å; S94-L97 PolarHBondContact O-N 3.39Å; S94-L97 VanDerWaalsContact O-N 3.1Å; S94-F98 WeakPolarHBondContact O-CD2 3.45Å; S94-F98 PolarHBondContact O-N 3Å
95	D	94.3	Very high	94.6	Very high	94 Å²	94	47.6 Å²	47.6	50%	0.503	29%	0.292	S	S	.	.	H	α-helix	trans	-63.9	-36.9	-179.7	-64.8	1.5	0	0	0	111.4	I93 F98 R99	I93-D95 VanDerWaalsContact C-N 3.33Å; I93-D95 PolarHBondContact O-N 2.91Å; D95-F98 PolarHBondContact O-N 3.38Å; D95-R99 VanDerWaalsContact O-CG 3.3Å; D95-R99 WeakPolarHBondContact O-CG 3.47Å; D95-R99 PolarHBondContact O-N 3.01Å
96	D	96.5	Very high	95.3	Very high	10 Å²	10	40.3 Å²	40.3	5%	0.053	25%	0.253	C	S	.	.	H	α-helix	trans	-69.6	-34.9	175.4	-54.3	-59.5	0	0	0	111.7	F73 R80 I93 S94 R99 F100	F73-D96 HydrophobicContact CE2-CB 3.8Å; F73-D96 HydrophobicContact CZ-CB 4.46Å; R80-D96 IonicContact CZ-OD1 3.14Å; R80-D96 IonicContact CZ-OD2 3.36Å; R80-D96 VanDerWaalsContact CZ-OD2 3.31Å; R80-D96 IonicContact NH1-OD1 2.68Å; R80-D96 IonicContact NH1-OD2 2.88Å; R80-D96 PolarHBondContact NH1-OD2 3.16Å; R80-D96 VanDerWaalsContact NH2-CG 3.28Å; R80-D96 IonicContact NH2-OD1 3.56Å; R80-D96 PolarHBondContact NH2-OD1 2.94Å; R80-D96 IonicContact NH2-OD2 3.26Å; R80-D96 PolarHBondContact NH2-OD2 2.94Å; R80-D96 VanDerWaalsContact NH2-OD2 3.16Å; I93-D96 HydrophobicContact CB-CB 4.48Å; I93-D96 PolarHBondContact O-N 3.08Å; S94-D96 VanDerWaalsContact C-N 3.28Å; S94-D96 PolarHBondContact O-N 3.46Å; D96-R99 PolarHBondContact O-N 3.22Å; D96-R99 IonicContact OD1-NH1 2.84Å; D96-F100 VanDerWaalsContact O-CB 3.27Å; D96-F100 WeakPolarHBondContact O-CB 3.29Å; D96-F100 PolarHBondContact O-N 3.17Å
97	L	98.1	Very high	95.9	Very high	3 Å²	3	37.4 Å²	37.4	2%	0.016	23%	0.232	C	C	.	.	H	α-helix	trans	-70.1	-35.5	175.3	-70.5	172.5	0	0	0	112.1	F73 I93 S94 F100 S101 S226 L229 Q230	F73-L97 HydrophobicContact CE1-CD2 4.32Å; F73-L97 HydrophobicContact CE2-CD2 4.39Å; F73-L97 HydrophobicContact CZ-CD2 3.77Å; F73-L97 HydrophobicContact CZ-CG 4.39Å; I93-L97 HydrophobicContact CD1-CD1 4.16Å; I93-L97 HydrophobicContact CD1-CG 4.33Å; I93-L97 HydrophobicContact CG1-CD1 4.08Å; I93-L97 HydrophobicContact CG1-CG 4.34Å; I93-L97 WeakPolarHBondContact O-CG 3.29Å; I93-L97 PolarHBondContact O-N 3.09Å; S94-L97 WeakPolarHBondContact O-CB 3.48Å; S94-L97 PolarHBondContact O-N 3.39Å; S94-L97 VanDerWaalsContact O-N 3.1Å; L97-F100 PolarHBondContact O-N 3.42Å; L97-S101 WeakPolarHBondContact O-CB 3.31Å; L97-S101 PolarHBondContact O-N 3.49Å; L97-S101 PolarHBondContact O-OG 2.95Å; L97-S226 WeakPolarHBondContact O-CB 3.45Å; L97-L229 HydrophobicContact CD2-CB 4.31Å; L97-Q230 HydrophobicContact CD1-CB 3.69Å; L97-Q230 HydrophobicContact CD1-CG 4.14Å
98	F	97.3	Very high	96.3	Very high	22 Å²	22	34.7 Å²	34.7	10%	0.096	20%	0.203	C	C	.	.	H	α-helix	trans	-64.5	-44.5	170.9	-71.2	-64.4	0	0	0	111.3	S94 D95 S101 F102 I129 Y133 V222 D223 S226 M227	S94-F98 WeakPolarHBondContact O-CD2 3.45Å; S94-F98 PolarHBondContact O-N 3Å; D95-F98 PolarHBondContact O-N 3.38Å; F98-S101 PolarHBondContact O-N 2.69Å; F98-F102 WeakPolarHBondContact O-CB 3.32Å; F98-F102 PolarHBondContact O-N 3.23Å; F98-I129 HydrophobicContact CB-CG2 3.75Å; F98-I129 HydrophobicContact CG-CG2 4.43Å; F98-Y133 HydrophobicContact CZ-CD2 4.45Å; F98-V222 HydrophobicContact CB-CG1 4.43Å; F98-V222 HydrophobicContact CD1-CG1 4.09Å; F98-D223 HydrophobicContact CE1-CB 4.2Å; F98-D223 WeakPolarHBondContact CE1-OD1 3.41Å; F98-S226 WeakPolarHBondContact CD1-OG 3.36Å; F98-S226 WeakPolarHBondContact CE1-OG 3.3Å; F98-M227 HydrophobicContact CE1-CE 3.82Å; F98-M227 HydrophobicContact CE2-CE 3.84Å; F98-M227 HydrophobicContact CZ-CE 3.35Å; F98-M227 HydrophobicContact CZ-SD 4.16Å
99	R	97.9	Very high	96.4	Very high	58 Å²	58	30.7 Å²	30.7	22%	0.219	18%	0.181	C	C	.	.	H	α-helix	trans	-61.3	-45	174	-71.4	168.1	-176.6	163.1	1	112.1	D95 D96 S101 F102 E103 M116 L117 Q126 I129	D95-R99 VanDerWaalsContact O-CG 3.3Å; D95-R99 WeakPolarHBondContact O-CG 3.47Å; D95-R99 PolarHBondContact O-N 3.01Å; D96-R99 PolarHBondContact O-N 3.22Å; D96-R99 IonicContact OD1-NH1 2.84Å; R99-S101 VanDerWaalsContact C-N 3.32Å; R99-S101 PolarHBondContact O-N 3.42Å; R99-F102 PolarHBondContact O-N 3.31Å; R99-E103 VanDerWaalsContact O-CB 3.31Å; R99-E103 WeakPolarHBondContact O-CB 3.4Å; R99-E103 PolarHBondContact O-N 2.94Å; R99-M116 HydrophobicContact CB-CB 4.14Å; R99-M116 WeakPolarHBondContact CD-O 3.22Å; R99-M116 HydrophobicContact CG-CB 4.43Å; R99-M116 HydrophobicContact CG-CE 4.37Å; R99-L117 HydrophobicContact CB-CD2 4.18Å; R99-Q126 VanDerWaalsContact NH2-OE1 3.1Å; R99-I129 HydrophobicContact CG-CD1 4.09Å
100	F	98.4	Very high	96.4	Very high	29 Å²	29	28.5 Å²	28.5	13%	0.127	17%	0.172	C	C	.	.	H	α-helix	trans	-57.5	-45	175.3	168.3	-96.9	0	0	0	111.8	V69 A70 F73 D96 L97 E103 S104 L117 L229	V69-F100 HydrophobicContact CG1-CD2 3.78Å; V69-F100 HydrophobicContact CG1-CE2 3.83Å; A70-F100 HydrophobicContact CB-CE2 4.38Å; F73-F100 HydrophobicContact CB-CD2 3.79Å; F73-F100 HydrophobicContact CB-CE2 4.31Å; F73-F100 HydrophobicContact CD2-CB 3.84Å; F73-F100 HydrophobicContact CD2-CD2 4.12Å; F73-F100 HydrophobicContact CD2-CG 4.23Å; F73-F100 HydrophobicContact CE2-CB 4.09Å; F73-F100 AromaticContact CG-CD2 3.98Å; F73-F100 HydrophobicContact CG-CD2 3.98Å; F73-F100 HydrophobicContact CG-CG 4.43Å; D96-F100 VanDerWaalsContact O-CB 3.27Å; D96-F100 WeakPolarHBondContact O-CB 3.29Å; D96-F100 PolarHBondContact O-N 3.17Å; L97-F100 PolarHBondContact O-N 3.42Å; F100-E103 PolarHBondContact O-N 2.89Å; F100-S104 VanDerWaalsContact O-CB 3.31Å; F100-S104 WeakPolarHBondContact O-CB 3.5Å; F100-S104 PolarHBondContact O-N 3.24Å; F100-S104 PolarHBondContact O-OG 2.81Å; F100-L117 HydrophobicContact CB-CD2 4.38Å; F100-L117 HydrophobicContact CD2-CD1 4.46Å; F100-L229 HydrophobicContact CD1-CD1 3.85Å; F100-L229 HydrophobicContact CE1-CD1 3.47Å; F100-L229 VanDerWaalsContact CE1-CD1 3.47Å
101	S	98.1	Very high	96.3	Very high	1 Å²	1	25.3 Å²	25.3	1%	0.007	15%	0.153	C	C	.	.	H	α-helix	trans	-69.6	-41.3	-178.6	-57.6	0	0	0	0	111.5	L97 F98 R99 S104 I105 V222 S226	L97-S101 WeakPolarHBondContact O-CB 3.31Å; L97-S101 PolarHBondContact O-N 3.49Å; L97-S101 PolarHBondContact O-OG 2.95Å; F98-S101 PolarHBondContact O-N 2.69Å; R99-S101 VanDerWaalsContact C-N 3.32Å; R99-S101 PolarHBondContact O-N 3.42Å; S101-S104 PolarHBondContact O-N 3.07Å; S101-I105 WeakPolarHBondContact O-CG2 3.47Å; S101-I105 PolarHBondContact O-N 3.02Å; S101-V222 WeakPolarHBondContact CB-O 3.33Å; S101-S226 WeakPolarHBondContact OG-CA 3.38Å; S101-S226 WeakPolarHBondContact OG-CB 3.49Å; S101-S226 PolarHBondContact OG-N 2.89Å; S101-S226 VanDerWaalsContact OG-N 3.13Å
102	F	97.6	Very high	96	Very high	0 Å²	0	26.4 Å²	26.4	0%	0	15%	0.145	C	C	.	.	H	α-helix	trans	-61.2	-47.9	172.3	178	-93.9	0	0	0	112.4	F98 R99 S104 I105 S106 M114 M116 A125 F128 I129 Y175 V222	F98-F102 WeakPolarHBondContact O-CB 3.32Å; F98-F102 PolarHBondContact O-N 3.23Å; R99-F102 PolarHBondContact O-N 3.31Å; F102-S104 VanDerWaalsContact C-N 3.26Å; F102-S104 PolarHBondContact O-N 3.13Å; F102-I105 WeakPolarHBondContact O-CG2 3.41Å; F102-I105 PolarHBondContact O-N 3.34Å; F102-S106 VanDerWaalsContact O-CB 3.26Å; F102-S106 WeakPolarHBondContact O-CB 3.21Å; F102-S106 PolarHBondContact O-N 3.48Å; F102-S106 PolarHBondContact O-OG 3.37Å; F102-M114 HydrophobicContact CE1-CB 3.97Å; F102-M114 HydrophobicContact CE1-CE 4.44Å; F102-M114 HydrophobicContact CE1-CG 3.92Å; F102-M114 HydrophobicContact CZ-CE 4.15Å; F102-M116 HydrophobicContact CD1-CG 3.57Å; F102-M116 HydrophobicContact CE1-CG 3.82Å; F102-M116 HydrophobicContact CE1-SD 4.5Å; F102-A125 HydrophobicContact CE1-CB 4.12Å; F102-A125 HydrophobicContact CZ-CB 4.32Å; F102-F128 AromaticContact CD2-CD1 3.73Å; F102-F128 HydrophobicContact CD2-CD1 3.73Å; F102-F128 AromaticContact CD2-CE1 3.94Å; F102-F128 HydrophobicContact CD2-CE1 3.94Å; F102-F128 AromaticContact CE2-CD1 3.41Å; F102-F128 HydrophobicContact CE2-CD1 3.41Å; F102-F128 VanDerWaalsContact CE2-CD1 3.41Å; F102-F128 AromaticContact CE2-CE1 3.74Å; F102-F128 HydrophobicContact CE2-CE1 3.74Å; F102-F128 HydrophobicContact CE2-CG 4.23Å; F102-F128 HydrophobicContact CZ-CD1 4.46Å; F102-I129 HydrophobicContact CB-CD1 3.73Å; F102-I129 HydrophobicContact CB-CG1 3.87Å; F102-I129 HydrophobicContact CD1-CD1 4.32Å; F102-I129 HydrophobicContact CD2-CG1 4.09Å; F102-I129 HydrophobicContact CG-CD1 3.97Å; F102-I129 HydrophobicContact CG-CG1 3.93Å; F102-Y175 HydrophobicContact CZ-CE2 4.11Å; F102-V222 HydrophobicContact CB-CG2 3.96Å; F102-V222 HydrophobicContact CD2-CG2 3.92Å; F102-V222 HydrophobicContact CG-CG2 4.45Å
103	E	97.9	Very high	96	Very high	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.129	C	C	.	.	H	α-helix	trans	-60.6	-38.3	177.4	-168.9	75.1	-166.9	0	0	110.8	V69 R99 F100 S106 S107 R113 M114 G115 M116 L117	V69-E103 HydrophobicContact CB-CG 4.43Å; V69-E103 HydrophobicContact CG1-CB 3.81Å; V69-E103 HydrophobicContact CG1-CG 3.7Å; V69-E103 HydrophobicContact CG2-CG 3.86Å; R99-E103 VanDerWaalsContact O-CB 3.31Å; R99-E103 WeakPolarHBondContact O-CB 3.4Å; R99-E103 PolarHBondContact O-N 2.94Å; F100-E103 PolarHBondContact O-N 2.89Å; E103-S106 WeakPolarHBondContact CA-OG 3.47Å; E103-S106 PolarHBondContact O-OG 3.47Å; E103-S106 VanDerWaalsContact O-OG 3.12Å; E103-S107 WeakPolarHBondContact O-CB 3.5Å; E103-S107 PolarHBondContact O-N 3.08Å; E103-R113 IonicContact OE1-CZ 2.71Å; E103-R113 IonicContact OE1-NE 3.31Å; E103-R113 PolarHBondContact OE1-NE 3.23Å; E103-R113 IonicContact OE1-NH2 3.36Å; E103-R113 PolarHBondContact OE1-NH2 3.47Å; E103-M114 PolarHBondContact OE1-N 3.17Å; E103-M114 WeakPolarHBondContact OE2-CB 3.31Å; E103-G115 PolarHBondContact OE1-N 3.4Å; E103-G115 VanDerWaalsContact OE1-N 3.08Å; E103-G115 PolarHBondContact OE2-N 2.91Å; E103-M116 HydrophobicContact CB-CB 4.49Å; E103-M116 WeakPolarHBondContact OE2-CB 3.14Å; E103-M116 PolarHBondContact OE2-N 3.22Å; E103-L117 HydrophobicContact CG-CD1 4.45Å; E103-L117 HydrophobicContact CG-CG 4.48Å
104	S	98.1	Very high	95.8	Very high	12 Å²	12	26.4 Å²	26.4	8%	0.084	13%	0.132	C	C	.	.	H	α-helix	trans	-65.5	-51.6	177.9	-63.4	0	0	0	0	112.4	V69 F100 S101 F102 S107 V108	V69-S104 WeakPolarHBondContact CG1-OG 3.38Å; F100-S104 VanDerWaalsContact O-CB 3.31Å; F100-S104 WeakPolarHBondContact O-CB 3.5Å; F100-S104 PolarHBondContact O-N 3.24Å; F100-S104 PolarHBondContact O-OG 2.81Å; S101-S104 PolarHBondContact O-N 3.07Å; F102-S104 VanDerWaalsContact C-N 3.26Å; F102-S104 PolarHBondContact O-N 3.13Å; S104-S107 PolarHBondContact O-N 3.5Å; S104-V108 WeakPolarHBondContact O-CG2 3.42Å; S104-V108 PolarHBondContact O-N 2.9Å; S104-V108 VanDerWaalsContact O-N 3.13Å
105	I	97.5	Very high	95.8	Very high	31 Å²	31	26.1 Å²	26.1	16%	0.159	13%	0.133	C	C	.	.	H	α-helix	trans	-69.7	-39.4	-178.3	-170.9	58.3	0	0	0	111.8	S101 F102 V108 I109 L218	S101-I105 WeakPolarHBondContact O-CG2 3.47Å; S101-I105 PolarHBondContact O-N 3.02Å; F102-I105 WeakPolarHBondContact O-CG2 3.41Å; F102-I105 PolarHBondContact O-N 3.34Å; I105-V108 PolarHBondContact O-N 3.1Å; I105-I109 HydrophobicContact CD1-CD1 4.04Å; I105-I109 HydrophobicContact CD1-CG1 4.3Å; I105-I109 HydrophobicContact CG1-CD1 3.8Å; I105-I109 HydrophobicContact CG1-CG1 4.44Å; I105-I109 WeakPolarHBondContact O-CB 3.36Å; I105-I109 VanDerWaalsContact O-CG1 3.3Å; I105-I109 WeakPolarHBondContact O-CG1 3.33Å; I105-I109 PolarHBondContact O-N 3.09Å; I105-L218 HydrophobicContact CG2-CD2 4.19Å
106	S	95.9	Very high	95.9	Very high	0 Å²	0	21.7 Å²	21.7	0%	0	11%	0.11	C	C	.	.	H	α-helix	trans	-64.9	-39.5	175.6	57.7	0	0	0	0	111.5	F102 E103 V108 I109 F110 M114	F102-S106 VanDerWaalsContact O-CB 3.26Å; F102-S106 WeakPolarHBondContact O-CB 3.21Å; F102-S106 PolarHBondContact O-N 3.48Å; F102-S106 PolarHBondContact O-OG 3.37Å; E103-S106 WeakPolarHBondContact CA-OG 3.47Å; E103-S106 PolarHBondContact O-OG 3.47Å; E103-S106 VanDerWaalsContact O-OG 3.12Å; S106-V108 PolarHBondContact O-N 3.43Å; S106-I109 PolarHBondContact O-N 3.49Å; S106-F110 WeakPolarHBondContact O-CB 3.22Å; S106-F110 VanDerWaalsContact O-CD2 3.31Å; S106-F110 WeakPolarHBondContact O-CD2 3.31Å; S106-F110 PolarHBondContact O-N 2.98Å; S106-M114 VanDerWaalsContact OG-CG 3.27Å; S106-M114 WeakPolarHBondContact OG-CG 3.34Å
107	S	96.1	Very high	95.9	Very high	2 Å²	2	21.9 Å²	21.9	1%	0.014	11%	0.111	C	C	.	.	H	α-helix	trans	-63.4	-40.7	175.7	-172.4	0	0	0	0	112.7	E103 S104 G111 E112	E103-S107 WeakPolarHBondContact O-CB 3.5Å; E103-S107 PolarHBondContact O-N 3.08Å; S104-S107 PolarHBondContact O-N 3.5Å; S107-G111 WeakPolarHBondContact O-CA 3.49Å; S107-G111 PolarHBondContact O-N 3.34Å; S107-E112 VanDerWaalsContact CA-O 3.31Å; S107-E112 WeakPolarHBondContact CA-O 3.21Å
108	V	96.8	Very high	95.7	Very high	11 Å²	11	26.9 Å²	26.9	7%	0.067	13%	0.134	C	C	.	.	H	α-helix	trans	-67.3	-40.2	175.3	170.7	0	0	0	0	112	F62 L66 S104 I105 S106 G194 V195	F62-V108 HydrophobicContact CB-CG2 4.16Å; F62-V108 HydrophobicContact CD1-CG1 3.78Å; F62-V108 HydrophobicContact CD2-CG1 4.04Å; F62-V108 HydrophobicContact CE1-CG1 3.78Å; F62-V108 HydrophobicContact CE2-CG1 4.02Å; F62-V108 HydrophobicContact CG-CG1 3.93Å; F62-V108 HydrophobicContact CG-CG2 4.25Å; F62-V108 HydrophobicContact CZ-CG1 3.89Å; L66-V108 HydrophobicContact CD1-CG2 4.37Å; L66-V108 HydrophobicContact CD2-CG2 3.69Å; L66-V108 HydrophobicContact CG-CG2 3.91Å; S104-V108 WeakPolarHBondContact O-CG2 3.42Å; S104-V108 PolarHBondContact O-N 2.9Å; S104-V108 VanDerWaalsContact O-N 3.13Å; I105-V108 PolarHBondContact O-N 3.1Å; S106-V108 PolarHBondContact O-N 3.43Å; V108-G194 WeakPolarHBondContact O-CA 3.23Å; V108-V195 HydrophobicContact CG1-CG2 3.9Å; V108-V195 PolarHBondContact O-N 3.4Å
109	I	95.8	Very high	95.4	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-71.8	-51.2	-177.7	-72.2	172.3	0	0	0	111.6	I105 S106 G194 V195 L196 I214 M217 L218	I105-I109 HydrophobicContact CD1-CD1 4.04Å; I105-I109 HydrophobicContact CD1-CG1 4.3Å; I105-I109 HydrophobicContact CG1-CD1 3.8Å; I105-I109 HydrophobicContact CG1-CG1 4.44Å; I105-I109 WeakPolarHBondContact O-CB 3.36Å; I105-I109 VanDerWaalsContact O-CG1 3.3Å; I105-I109 WeakPolarHBondContact O-CG1 3.33Å; I105-I109 PolarHBondContact O-N 3.09Å; S106-I109 PolarHBondContact O-N 3.49Å; I109-G194 CarbonylContact O-C 3.58Å; I109-V195 PolarHBondContact O-N 2.83Å; I109-V195 VanDerWaalsContact O-N 3.14Å; I109-L196 HydrophobicContact CG2-CB 4.17Å; I109-L196 WeakPolarHBondContact O-CB 3.39Å; I109-L196 PolarHBondContact O-N 2.98Å; I109-I214 HydrophobicContact CG2-CD1 3.74Å; I109-I214 HydrophobicContact CG2-CG1 4.43Å; I109-I214 HydrophobicContact CG2-CG2 3.99Å; I109-M217 HydrophobicContact CD1-CB 3.77Å; I109-M217 HydrophobicContact CD1-CE 4.19Å; I109-M217 HydrophobicContact CG1-CE 3.97Å; I109-L218 HydrophobicContact CD1-CD2 3.71Å; I109-L218 HydrophobicContact CD1-CG 3.78Å
110	F	93.6	Very high	95.1	Very high	7 Å²	7	37 Å²	37	3%	0.031	19%	0.187	C	C	.	.	H	α-helix	trans	-99.7	-11.5	-170.2	-57.1	-65.2	0	0	0	113.2	S106 E112 M114 Y175 F179 P193 L196 I214 L218	S106-F110 WeakPolarHBondContact O-CB 3.22Å; S106-F110 VanDerWaalsContact O-CD2 3.31Å; S106-F110 WeakPolarHBondContact O-CD2 3.31Å; S106-F110 PolarHBondContact O-N 2.98Å; F110-E112 PolarHBondContact O-N 3.29Å; F110-M114 HydrophobicContact CD2-CE 4.34Å; F110-M114 HydrophobicContact CE2-CE 4.3Å; F110-Y175 HydrophobicContact CZ-CG 4.47Å; F110-F179 HydrophobicContact CB-CD2 4.18Å; F110-F179 HydrophobicContact CB-CE2 4.43Å; F110-F179 HydrophobicContact CD1-CB 4.1Å; F110-F179 HydrophobicContact CD1-CD2 4.14Å; F110-F179 HydrophobicContact CD1-CG 4.1Å; F110-F179 WeakPolarHBondContact O-CE2 3.43Å; F110-P193 CarbonylContact C-O 3.34Å; F110-L196 HydrophobicContact CD1-CD2 3.77Å; F110-L196 HydrophobicContact CE1-CD2 3.63Å; F110-I214 HydrophobicContact CE1-CG2 4.41Å; F110-I214 HydrophobicContact CZ-CG2 4.11Å; F110-L218 HydrophobicContact CE2-CD1 4.11Å; F110-L218 HydrophobicContact CE2-CD2 4.01Å; F110-L218 HydrophobicContact CZ-CD1 4Å
111	G	91.9	Very high	94.9	Very high	25 Å²	25	37.3 Å²	37.3	26%	0.258	19%	0.191	S	C	.	.	S	Bend	trans	65.8	14.2	-175.2	0	0	0	0	0	113.8	S107	S107-G111 WeakPolarHBondContact O-CA 3.49Å; S107-G111 PolarHBondContact O-N 3.34Å
112	E	88.7	Confident	94.6	Very high	74 Å²	74	40.5 Å²	40.5	35%	0.346	21%	0.208	S	C	.	.	S	Bend	trans	-126.9	165.7	-174.6	-67.9	-173.8	159.9	0	0	111.1	S107 F110 K186	S107-E112 VanDerWaalsContact CA-O 3.31Å; S107-E112 WeakPolarHBondContact CA-O 3.21Å; F110-E112 PolarHBondContact O-N 3.29Å; E112-K186 IonicContact OE1-NZ 3.9Å; E112-K186 PolarHBondContact OE1-NZ 3.41Å
113	R	93.1	Very high	94.4	Very high	103 Å²	103	45.1 Å²	45.1	39%	0.389	24%	0.238	S	C	.	.			trans	-103.6	125.6	179.5	-63.7	-59.6	-57.4	-81.5	-7.8	109.5	D72 E103	D72-R113 IonicContact OD2-CZ 3.21Å; D72-R113 IonicContact OD2-NH1 2.73Å; D72-R113 PolarHBondContact OD2-NH1 3.15Å; D72-R113 IonicContact OD2-NH2 3.09Å; D72-R113 PolarHBondContact OD2-NH2 3.18Å; E103-R113 IonicContact OE1-CZ 2.71Å; E103-R113 IonicContact OE1-NE 3.31Å; E103-R113 PolarHBondContact OE1-NE 3.23Å; E103-R113 IonicContact OE1-NH2 3.36Å; E103-R113 PolarHBondContact OE1-NH2 3.47Å
114	M	92.8	Very high	94.2	Very high	48 Å²	48	48.3 Å²	48.3	24%	0.236	25%	0.253	C	S	.	.			trans	-84.9	-16.1	179.4	-58.5	-62.9	-119.7	0	0	112	F102 E103 S106 F110 M116 Y175	F102-M114 HydrophobicContact CE1-CB 3.97Å; F102-M114 HydrophobicContact CE1-CE 4.44Å; F102-M114 HydrophobicContact CE1-CG 3.92Å; F102-M114 HydrophobicContact CZ-CE 4.15Å; E103-M114 PolarHBondContact OE1-N 3.17Å; E103-M114 WeakPolarHBondContact OE2-CB 3.31Å; S106-M114 VanDerWaalsContact OG-CG 3.27Å; S106-M114 WeakPolarHBondContact OG-CG 3.34Å; F110-M114 HydrophobicContact CD2-CE 4.34Å; F110-M114 HydrophobicContact CE2-CE 4.3Å; M114-M116 HydrophobicContact CB-CG 4.19Å; M114-Y175 HydrophobicContact CE-CD1 3.72Å; M114-Y175 HydrophobicContact CE-CD2 3.99Å; M114-Y175 HydrophobicContact CE-CE1 3.64Å; M114-Y175 HydrophobicContact CE-CE2 3.91Å; M114-Y175 HydrophobicContact CE-CG 3.91Å
115	G	95.6	Very high	93.9	Very high	19 Å²	19	47.8 Å²	47.8	20%	0.196	25%	0.25	C	C	.	.			trans	79.8	19.8	175.5	0	0	0	0	0	114.1	E103 L117 E118	E103-G115 PolarHBondContact OE1-N 3.4Å; E103-G115 VanDerWaalsContact OE1-N 3.08Å; E103-G115 PolarHBondContact OE2-N 2.91Å; G115-L117 PolarHBondContact O-N 3.08Å; G115-L117 VanDerWaalsContact O-N 3.13Å; G115-E118 WeakPolarHBondContact O-CB 3.38Å; G115-E118 PolarHBondContact O-N 3.38Å; G115-E118 VanDerWaalsContact O-N 3.13Å
116	M	96.5	Very high	93.8	Very high	1 Å²	1	47.8 Å²	47.8	1%	0.005	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-71.4	-6.7	-177.5	-62.4	-56.5	-73.1	0	0	114.4	R99 F102 E103 M114 V121 A125 Q126 I129	R99-M116 HydrophobicContact CB-CB 4.14Å; R99-M116 WeakPolarHBondContact CD-O 3.22Å; R99-M116 HydrophobicContact CG-CB 4.43Å; R99-M116 HydrophobicContact CG-CE 4.37Å; F102-M116 HydrophobicContact CD1-CG 3.57Å; F102-M116 HydrophobicContact CE1-CG 3.82Å; F102-M116 HydrophobicContact CE1-SD 4.5Å; E103-M116 HydrophobicContact CB-CB 4.49Å; E103-M116 WeakPolarHBondContact OE2-CB 3.14Å; E103-M116 PolarHBondContact OE2-N 3.22Å; M114-M116 HydrophobicContact CB-CG 4.19Å; M116-V121 HydrophobicContact CE-CG1 3.22Å; M116-V121 HydrophobicContact SD-CG1 3.43Å; M116-V121 WeakPolarHBondContact SD-CG1 3.35Å; M116-A125 HydrophobicContact CE-CB 3.8Å; M116-A125 HydrophobicContact CG-CB 4.47Å; M116-A125 HydrophobicContact SD-CB 3.33Å; M116-A125 WeakPolarHBondContact SD-CB 3.48Å; M116-Q126 HydrophobicContact CE-CB 4.17Å; M116-I129 HydrophobicContact CE-CD1 3.65Å
117	L	97	Very high	93.8	Very high	14 Å²	14	54.1 Å²	54.1	7%	0.073	27%	0.273	C	S	.	.	T	Hydrogen-bonded Turn	trans	-105.1	4.5	175.9	-59.4	-179.5	0	0	0	112.8	V69 D72 F73 V76 R99 F100 E103 G115	V69-L117 HydrophobicContact CG1-CD1 3.85Å; D72-L117 HydrophobicContact CB-CB 4.44Å; D72-L117 HydrophobicContact CB-CD1 4.07Å; F73-L117 HydrophobicContact CB-CD1 4.11Å; F73-L117 HydrophobicContact CD2-CD2 4.09Å; V76-L117 HydrophobicContact CG2-CB 4.24Å; V76-L117 WeakPolarHBondContact CG2-O 3.33Å; R99-L117 HydrophobicContact CB-CD2 4.18Å; F100-L117 HydrophobicContact CB-CD2 4.38Å; F100-L117 HydrophobicContact CD2-CD1 4.46Å; E103-L117 HydrophobicContact CG-CD1 4.45Å; E103-L117 HydrophobicContact CG-CG 4.48Å; G115-L117 PolarHBondContact O-N 3.08Å; G115-L117 VanDerWaalsContact O-N 3.13Å
118	E	94.2	Very high	93.8	Very high	108 Å²	108	54 Å²	54	51%	0.505	27%	0.272	S	S	.	.	S	Bend	trans	-77.8	169.6	172	-61.3	-63.2	168.9	0	0	111.5	G115 I120 V121	G115-E118 WeakPolarHBondContact O-CB 3.38Å; G115-E118 PolarHBondContact O-N 3.38Å; G115-E118 VanDerWaalsContact O-N 3.13Å; E118-I120 VanDerWaalsContact C-N 3.33Å; E118-V121 WeakPolarHBondContact O-CG2 3.36Å
119	E	89.9	Confident	93.7	Very high	135 Å²	135	53.7 Å²	53.7	63%	0.631	27%	0.27	S	S	*	.	S	Bend	trans	-69.4	-33.9	177.5	-62	-171.1	-157.3	0	0	112.5	R79	R79-E119 VanDerWaalsContact CD-OE1 3.22Å; R79-E119 WeakPolarHBondContact CD-OE1 3.38Å; R79-E119 IonicContact CZ-OE1 2.65Å; R79-E119 IonicContact NE-OE1 2.81Å; R79-E119 PolarHBondContact NE-OE1 2.98Å; R79-E119 VanDerWaalsContact NE-OE1 3.09Å; R79-E119 IonicContact NH1-OE1 2.66Å; R79-E119 PolarHBondContact NH1-OE1 3.47Å; R79-E119 VanDerWaalsContact NH1-OE1 3.16Å; R79-E119 IonicContact NH2-OE1 3.16Å
120	I	92	Very high	93.7	Very high	158 Å²	158	57.8 Å²	57.8	81%	0.81	29%	0.292	S	S	*	.	S	Bend	trans	-108.6	111.4	177.1	-58.5	173.4	0	0	0	106.8	E118	E118-I120 VanDerWaalsContact C-N 3.33Å
121	V	93.4	Very high	93.8	Very high	34 Å²	34	57.9 Å²	57.9	21%	0.206	29%	0.294	C	S	.	.			trans	-101.4	142.8	-174.9	177.4	0	0	0	0	109.6	M116 E118 P123	M116-V121 HydrophobicContact CE-CG1 3.22Å; M116-V121 HydrophobicContact SD-CG1 3.43Å; M116-V121 WeakPolarHBondContact SD-CG1 3.35Å; E118-V121 WeakPolarHBondContact O-CG2 3.36Å; V121-P123 WeakPolarHBondContact O-CD 3.11Å
122	D	92.5	Very high	93.8	Very high	69 Å²	69	56.7 Å²	56.7	37%	0.369	28%	0.282	S	S	.	.			trans	-62.5	117.9	173.2	172.1	23.8	0	0	0	110.6	E124 A125 Q126	D122-E124 PolarHBondContact O-N 3.49Å; D122-E124 PolarHBondContact OD1-N 3.26Å; D122-A125 HydrophobicContact CB-CB 4.06Å; D122-A125 PolarHBondContact O-N 3.09Å; D122-A125 WeakPolarHBondContact OD2-CB 3.45Å; D122-A125 PolarHBondContact OD2-N 2.95Å; D122-A125 VanDerWaalsContact OD2-N 3.09Å; D122-Q126 PolarHBondContact O-N 3.48Å
123	P	94.2	Very high	94	Very high	96 Å²	96	58.6 Å²	58.6	62%	0.623	29%	0.286	S	S	*	.	H	α-helix	trans	-62	-28.2	179.2	26	-35.4	0	0	0	112.8	V121 Q126 R127	V121-P123 WeakPolarHBondContact O-CD 3.11Å; P123-Q126 PolarHBondContact O-N 3.4Å; P123-R127 WeakPolarHBondContact O-CB 3.46Å; P123-R127 PolarHBondContact O-N 3.18Å
124	E	92.3	Very high	94	Very high	67 Å²	67	57.8 Å²	57.8	31%	0.313	29%	0.287	S	S	.	.	H	α-helix	trans	-75.3	-40.7	-179.4	-71.1	-62.8	114.9	0	0	112	D122 R127 F128 K171	D122-E124 PolarHBondContact O-N 3.49Å; D122-E124 PolarHBondContact OD1-N 3.26Å; E124-R127 WeakPolarHBondContact O-CB 3.38Å; E124-R127 PolarHBondContact O-N 3.41Å; E124-F128 PolarHBondContact O-N 3.41Å; E124-F128 VanDerWaalsContact O-N 3.1Å; E124-K171 WeakPolarHBondContact OE2-CE 3.3Å; E124-K171 IonicContact OE2-NZ 2.73Å; E124-K171 PolarHBondContact OE2-NZ 2.62Å
125	A	92.8	Very high	94	Very high	2 Å²	2	56 Å²	56	2%	0.017	28%	0.279	C	S	.	.	H	α-helix	trans	-64.3	-38.6	169.8	0	0	0	0	0	112.2	F102 M116 D122 R127 F128 I129 Y175	F102-A125 HydrophobicContact CE1-CB 4.12Å; F102-A125 HydrophobicContact CZ-CB 4.32Å; M116-A125 HydrophobicContact CE-CB 3.8Å; M116-A125 HydrophobicContact CG-CB 4.47Å; M116-A125 HydrophobicContact SD-CB 3.33Å; M116-A125 WeakPolarHBondContact SD-CB 3.48Å; D122-A125 HydrophobicContact CB-CB 4.06Å; D122-A125 PolarHBondContact O-N 3.09Å; D122-A125 WeakPolarHBondContact OD2-CB 3.45Å; D122-A125 PolarHBondContact OD2-N 2.95Å; D122-A125 VanDerWaalsContact OD2-N 3.09Å; A125-R127 VanDerWaalsContact C-N 3.29Å; A125-R127 PolarHBondContact O-N 2.98Å; A125-F128 WeakPolarHBondContact O-CB 3.48Å; A125-F128 PolarHBondContact O-N 3.5Å; A125-I129 PolarHBondContact O-N 3.38Å; A125-I129 VanDerWaalsContact O-N 3.17Å; A125-Y175 WeakPolarHBondContact CA-OH 3.34Å
126	Q	95	Very high	93.7	Very high	30 Å²	30	59.4 Å²	59.4	14%	0.14	29%	0.288	C	S	.	.	H	α-helix	trans	-63.5	-36.8	173.1	-175.2	64.7	66.8	0	0	111.7	R99 M116 D122 P123 F128 I129 N130	R99-Q126 VanDerWaalsContact NH2-OE1 3.1Å; M116-Q126 HydrophobicContact CE-CB 4.17Å; D122-Q126 PolarHBondContact O-N 3.48Å; P123-Q126 PolarHBondContact O-N 3.4Å; Q126-F128 VanDerWaalsContact C-N 3.3Å; Q126-F128 PolarHBondContact O-N 3.12Å; Q126-I129 PolarHBondContact O-N 3.43Å; Q126-N130 PolarHBondContact NE2-OD1 3.02Å; Q126-N130 PolarHBondContact O-N 3.2Å; Q126-N130 PolarHBondContact O-OD1 3.06Å
127	R	95.8	Very high	93.4	Very high	133 Å²	133	64.7 Å²	64.7	50%	0.502	31%	0.313	S	S	.	.	H	α-helix	trans	-62.9	-36.7	175	-173.1	-176.6	175.5	-179.5	-0.5	111.9	P123 E124 A125 N130 A131 V167	P123-R127 WeakPolarHBondContact O-CB 3.46Å; P123-R127 PolarHBondContact O-N 3.18Å; E124-R127 WeakPolarHBondContact O-CB 3.38Å; E124-R127 PolarHBondContact O-N 3.41Å; A125-R127 VanDerWaalsContact C-N 3.29Å; A125-R127 PolarHBondContact O-N 2.98Å; R127-N130 PolarHBondContact O-N 3.24Å; R127-A131 WeakPolarHBondContact O-CB 3.23Å; R127-A131 PolarHBondContact O-N 3.04Å; R127-V167 HydrophobicContact CG-CG1 4.13Å
128	F	94.9	Very high	93.1	Very high	0 Å²	0	64.4 Å²	64.4	0%	0	31%	0.311	C	S	.	.	H	α-helix	trans	-61.4	-50.1	172.5	178.6	-89.3	0	0	0	111.7	F102 E124 A125 Q126 N130 A131 V132 I168 K171 L218 V222	F102-F128 AromaticContact CD2-CD1 3.73Å; F102-F128 HydrophobicContact CD2-CD1 3.73Å; F102-F128 AromaticContact CD2-CE1 3.94Å; F102-F128 HydrophobicContact CD2-CE1 3.94Å; F102-F128 AromaticContact CE2-CD1 3.41Å; F102-F128 HydrophobicContact CE2-CD1 3.41Å; F102-F128 VanDerWaalsContact CE2-CD1 3.41Å; F102-F128 AromaticContact CE2-CE1 3.74Å; F102-F128 HydrophobicContact CE2-CE1 3.74Å; F102-F128 HydrophobicContact CE2-CG 4.23Å; F102-F128 HydrophobicContact CZ-CD1 4.46Å; E124-F128 PolarHBondContact O-N 3.41Å; E124-F128 VanDerWaalsContact O-N 3.1Å; A125-F128 WeakPolarHBondContact O-CB 3.48Å; A125-F128 PolarHBondContact O-N 3.5Å; Q126-F128 VanDerWaalsContact C-N 3.3Å; Q126-F128 PolarHBondContact O-N 3.12Å; F128-N130 VanDerWaalsContact C-N 3.3Å; F128-N130 PolarHBondContact O-N 3.23Å; F128-A131 WeakPolarHBondContact O-CB 3.39Å; F128-A131 PolarHBondContact O-N 3.49Å; F128-V132 HydrophobicContact CD1-CG2 4.21Å; F128-V132 HydrophobicContact CE1-CG2 3.76Å; F128-V132 HydrophobicContact CZ-CG2 4.06Å; F128-V132 PolarHBondContact O-N 2.89Å; F128-I168 HydrophobicContact CE2-CB 4.18Å; F128-I168 HydrophobicContact CE2-CG1 4.34Å; F128-I168 HydrophobicContact CE2-CG2 3.88Å; F128-I168 HydrophobicContact CZ-CG2 4.31Å; F128-K171 HydrophobicContact CB-CB 4.5Å; F128-K171 HydrophobicContact CD2-CB 3.75Å; F128-L218 HydrophobicContact CE1-CB 4.25Å; F128-L218 HydrophobicContact CZ-CB 3.79Å; F128-V222 HydrophobicContact CE1-CG2 4.36Å
129	I	95.1	Very high	92.8	Very high	4 Å²	4	61 Å²	61	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-55.2	-48.4	177.4	-66.3	173.1	0	0	0	110.6	F98 R99 F102 M116 A125 Q126 A131 V132 Y133 V222	F98-I129 HydrophobicContact CB-CG2 3.75Å; F98-I129 HydrophobicContact CG-CG2 4.43Å; R99-I129 HydrophobicContact CG-CD1 4.09Å; F102-I129 HydrophobicContact CB-CD1 3.73Å; F102-I129 HydrophobicContact CB-CG1 3.87Å; F102-I129 HydrophobicContact CD1-CD1 4.32Å; F102-I129 HydrophobicContact CD2-CG1 4.09Å; F102-I129 HydrophobicContact CG-CD1 3.97Å; F102-I129 HydrophobicContact CG-CG1 3.93Å; M116-I129 HydrophobicContact CE-CD1 3.65Å; A125-I129 PolarHBondContact O-N 3.38Å; A125-I129 VanDerWaalsContact O-N 3.17Å; Q126-I129 PolarHBondContact O-N 3.43Å; I129-A131 VanDerWaalsContact C-N 3.28Å; I129-A131 PolarHBondContact O-N 3.09Å; I129-V132 PolarHBondContact O-N 3.06Å; I129-Y133 PolarHBondContact O-N 2.97Å; I129-V222 HydrophobicContact CG1-CG1 4.44Å; I129-V222 HydrophobicContact CG2-CG1 4.09Å
130	N	96.1	Very high	92.6	Very high	87 Å²	87	59.8 Å²	59.8	47%	0.465	30%	0.301	S	S	.	.	H	α-helix	trans	-62.7	-35.9	179.3	-65	-8	0	0	0	112	Q126 R127 F128 Q134	Q126-N130 PolarHBondContact NE2-OD1 3.02Å; Q126-N130 PolarHBondContact O-N 3.2Å; Q126-N130 PolarHBondContact O-OD1 3.06Å; R127-N130 PolarHBondContact O-N 3.24Å; F128-N130 VanDerWaalsContact C-N 3.3Å; F128-N130 PolarHBondContact O-N 3.23Å; N130-Q134 WeakPolarHBondContact O-CB 3.49Å; N130-Q134 VanDerWaalsContact O-CG 3.26Å; N130-Q134 WeakPolarHBondContact O-CG 3.49Å; N130-Q134 PolarHBondContact O-N 2.87Å
131	A	95.5	Very high	92.2	Very high	8 Å²	8	55.9 Å²	55.9	7%	0.066	29%	0.286	C	S	.	.	H	α-helix	trans	-67.7	-36.8	177.4	0	0	0	0	0	112.5	R127 F128 I129 Q134 M135 V167 I168	R127-A131 WeakPolarHBondContact O-CB 3.23Å; R127-A131 PolarHBondContact O-N 3.04Å; F128-A131 WeakPolarHBondContact O-CB 3.39Å; F128-A131 PolarHBondContact O-N 3.49Å; I129-A131 VanDerWaalsContact C-N 3.28Å; I129-A131 PolarHBondContact O-N 3.09Å; A131-Q134 PolarHBondContact O-N 3.2Å; A131-M135 WeakPolarHBondContact O-CB 3.33Å; A131-M135 PolarHBondContact O-N 2.89Å; A131-V167 HydrophobicContact CB-CB 3.81Å; A131-V167 HydrophobicContact CB-CG1 3.62Å; A131-I168 HydrophobicContact CB-CG1 4.01Å
132	V	93.4	Very high	91.8	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-60.9	-48.9	174.6	175	0	0	0	0	110.8	F128 I129 Q134 M135 F136 I168 A219 V222	F128-V132 HydrophobicContact CD1-CG2 4.21Å; F128-V132 HydrophobicContact CE1-CG2 3.76Å; F128-V132 HydrophobicContact CZ-CG2 4.06Å; F128-V132 PolarHBondContact O-N 2.89Å; I129-V132 PolarHBondContact O-N 3.06Å; V132-Q134 PolarHBondContact O-N 3.36Å; V132-M135 WeakPolarHBondContact O-CB 3.36Å; V132-M135 PolarHBondContact O-N 2.9Å; V132-F136 HydrophobicContact CG1-CD2 4.07Å; V132-F136 HydrophobicContact CG1-CE2 3.89Å; V132-F136 WeakPolarHBondContact O-CD2 3.34Å; V132-F136 PolarHBondContact O-N 3.11Å; V132-F136 VanDerWaalsContact O-N 3.14Å; V132-I168 HydrophobicContact CG2-CD1 4.14Å; V132-I168 HydrophobicContact CG2-CG1 4.14Å; V132-A219 WeakPolarHBondContact CG1-O 3.39Å; V132-A219 HydrophobicContact CG2-CB 4.28Å; V132-V222 HydrophobicContact CG1-CB 4.33Å
133	Y	92.6	Very high	91.4	Very high	114 Å²	114	58.7 Å²	58.7	45%	0.447	30%	0.299	S	S	.	.	H	α-helix	trans	-59	-46.2	176	175.6	-97.4	0	0	0	112.1	F98 I129 M135 F136 H137 D223	F98-Y133 HydrophobicContact CZ-CD2 4.45Å; I129-Y133 PolarHBondContact O-N 2.97Å; Y133-M135 VanDerWaalsContact C-N 3.3Å; Y133-M135 PolarHBondContact O-N 3.29Å; Y133-F136 PolarHBondContact O-N 2.84Å; Y133-H137 WeakPolarHBondContact O-CB 3.49Å; Y133-H137 PolarHBondContact O-N 2.95Å; Y133-D223 WeakPolarHBondContact CA-OD2 3.3Å
134	Q	93.2	Very high	90.8	Very high	86 Å²	86	61.3 Å²	61.3	40%	0.402	31%	0.307	S	S	.	.	H	α-helix	trans	-61.9	-37.6	177.4	-72.6	-64.5	-30.7	0	0	112.2	N130 A131 V132 H137 T138 A164	N130-Q134 WeakPolarHBondContact O-CB 3.49Å; N130-Q134 VanDerWaalsContact O-CG 3.26Å; N130-Q134 WeakPolarHBondContact O-CG 3.49Å; N130-Q134 PolarHBondContact O-N 2.87Å; A131-Q134 PolarHBondContact O-N 3.2Å; V132-Q134 PolarHBondContact O-N 3.36Å; Q134-H137 PolarHBondContact O-N 3.17Å; Q134-T138 WeakPolarHBondContact O-CB 3.2Å; Q134-T138 VanDerWaalsContact O-CG2 3.3Å; Q134-T138 WeakPolarHBondContact O-CG2 3.4Å; Q134-T138 PolarHBondContact O-N 3.25Å; Q134-T138 PolarHBondContact O-OG1 3.35Å; Q134-A164 HydrophobicContact CB-CB 4.13Å
135	M	92.8	Very high	90.2	Very high	12 Å²	12	61.8 Å²	61.8	6%	0.059	31%	0.311	C	S	.	.	H	α-helix	trans	-60.7	-47.4	176.5	178.8	-76.9	-66.2	0	0	111.1	A131 V132 Y133 T138 S139 H161 A164 W165 I168	A131-M135 WeakPolarHBondContact O-CB 3.33Å; A131-M135 PolarHBondContact O-N 2.89Å; V132-M135 WeakPolarHBondContact O-CB 3.36Å; V132-M135 PolarHBondContact O-N 2.9Å; Y133-M135 VanDerWaalsContact C-N 3.3Å; Y133-M135 PolarHBondContact O-N 3.29Å; M135-T138 PolarHBondContact O-OG1 3.23Å; M135-S139 WeakPolarHBondContact O-CB 3.43Å; M135-S139 PolarHBondContact O-N 3.16Å; M135-S139 VanDerWaalsContact O-N 3.17Å; M135-S139 PolarHBondContact O-OG 2.85Å; M135-H161 PolarHBondContact O-ND1 2.97Å; M135-A164 HydrophobicContact CB-CB 4.12Å; M135-W165 HydrophobicContact CE-CH2 4.16Å; M135-W165 HydrophobicContact CE-CZ2 4.02Å; M135-W165 HydrophobicContact CG-CD2 3.95Å; M135-W165 HydrophobicContact CG-CG 4.33Å; M135-W165 HydrophobicContact CG-CH2 4.29Å; M135-W165 HydrophobicContact CG-CZ2 3.54Å; M135-W165 HydrophobicContact SD-CH2 4.23Å; M135-W165 HydrophobicContact SD-CZ2 3.49Å; M135-W165 WeakPolarHBondContact SD-CZ2 3.39Å; M135-I168 HydrophobicContact CB-CD1 3.85Å; M135-I168 HydrophobicContact CG-CD1 4.14Å
136	F	89.5	Confident	89.7	Confident	89 Å²	89	65.4 Å²	65.4	39%	0.39	34%	0.335	S	S	.	.	H	α-helix	trans	-65	-46.2	175.9	-79	-66.2	0	0	0	112.1	V132 Y133 T138 S139 D223	V132-F136 HydrophobicContact CG1-CD2 4.07Å; V132-F136 HydrophobicContact CG1-CE2 3.89Å; V132-F136 WeakPolarHBondContact O-CD2 3.34Å; V132-F136 PolarHBondContact O-N 3.11Å; V132-F136 VanDerWaalsContact O-N 3.14Å; Y133-F136 PolarHBondContact O-N 2.84Å; F136-T138 PolarHBondContact O-N 3.12Å; F136-S139 WeakPolarHBondContact O-CB 3.25Å; F136-S139 PolarHBondContact O-N 2.96Å; F136-S139 VanDerWaalsContact O-N 3.14Å; F136-D223 HydrophobicContact CD2-CB 4.19Å; F136-D223 WeakPolarHBondContact CD2-OD2 3.38Å; F136-D223 HydrophobicContact CE2-CB 4.08Å
137	H	89.8	Confident	88.8	Confident	113 Å²	113	68 Å²	68	52%	0.523	35%	0.354	S	S	.	.	H	α-helix	trans	-60.3	-44.4	-178.4	-173	75.3	0	0	0	112.5	Y133 Q134 S139 P141	Y133-H137 WeakPolarHBondContact O-CB 3.49Å; Y133-H137 PolarHBondContact O-N 2.95Å; Q134-H137 PolarHBondContact O-N 3.17Å; H137-S139 VanDerWaalsContact C-N 3.29Å; H137-S139 PolarHBondContact O-N 3.38Å; H137-P141 WeakPolarHBondContact O-CD 3.05Å
138	T	89.6	Confident	88	Confident	7 Å²	7	66.3 Å²	66.3	4%	0.043	36%	0.355	C	S	.	.	H	α-helix	trans	-74.7	-16.9	179	55.3	0	0	0	0	113.5	Q134 M135 F136 P141 M142 T157 D160 H161	Q134-T138 WeakPolarHBondContact O-CB 3.2Å; Q134-T138 VanDerWaalsContact O-CG2 3.3Å; Q134-T138 WeakPolarHBondContact O-CG2 3.4Å; Q134-T138 PolarHBondContact O-N 3.25Å; Q134-T138 PolarHBondContact O-OG1 3.35Å; M135-T138 PolarHBondContact O-OG1 3.23Å; F136-T138 PolarHBondContact O-N 3.12Å; T138-P141 WeakPolarHBondContact O-CD 3.13Å; T138-M142 VanDerWaalsContact O-CE 3.26Å; T138-M142 WeakPolarHBondContact O-CE 3.37Å; T138-T157 WeakPolarHBondContact O-CG2 3.32Å; T138-D160 HydrophobicContact CG2-CB 3.94Å; T138-H161 WeakPolarHBondContact OG1-CA 3.12Å; T138-H161 WeakPolarHBondContact OG1-CB 3.39Å; T138-H161 PolarHBondContact OG1-ND1 3.43Å
139	S	87.7	Confident	87.1	Confident	37 Å²	37	71.3 Å²	71.3	26%	0.259	38%	0.377	S	S	.	.	H	α-helix	trans	-70.8	-35.5	176.5	-64.1	0	0	0	0	112.8	M135 F136 H137 M142 L143 H161	M135-S139 WeakPolarHBondContact O-CB 3.43Å; M135-S139 PolarHBondContact O-N 3.16Å; M135-S139 VanDerWaalsContact O-N 3.17Å; M135-S139 PolarHBondContact O-OG 2.85Å; F136-S139 WeakPolarHBondContact O-CB 3.25Å; F136-S139 PolarHBondContact O-N 2.96Å; F136-S139 VanDerWaalsContact O-N 3.14Å; H137-S139 VanDerWaalsContact C-N 3.29Å; H137-S139 PolarHBondContact O-N 3.38Å; S139-M142 WeakPolarHBondContact O-CA 3.48Å; S139-M142 PolarHBondContact O-N 2.99Å; S139-L143 PolarHBondContact O-N 3.33Å; S139-H161 PolarHBondContact OG-CE1 3.46Å
140	V	86.5	Confident	86	Confident	109 Å²	109	71.9 Å²	71.9	66%	0.661	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-59.2	-49.3	-173.4	175.9	0	0	0	0	112.7	M142 L143	V140-M142 PolarHBondContact O-N 3.43Å; V140-M142 VanDerWaalsContact O-N 3.11Å; V140-L143 PolarHBondContact O-N 3.37Å
141	P	84.5	Confident	84.7	Confident	77 Å²	77	73.5 Å²	73.5	50%	0.5	38%	0.379	S	S	.	.	G	3₁₀ helix	trans	-65.4	-14.7	176.8	-19	32.4	0	0	0	113.6	H137 T138 T157	H137-P141 WeakPolarHBondContact O-CD 3.05Å; T138-P141 WeakPolarHBondContact O-CD 3.13Å; P141-T157 HydrophobicContact CB-CG2 4.26Å; P141-T157 HydrophobicContact CG-CG2 4.26Å
142	M	83.1	Confident	83.5	Confident	22 Å²	22	80 Å²	80	11%	0.108	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-97.7	-12.6	-175.8	-60.6	-165.4	-64	0	0	115.1	T138 S139 V140 N144 L145 F150 T157 W158 H161	T138-M142 VanDerWaalsContact O-CE 3.26Å; T138-M142 WeakPolarHBondContact O-CE 3.37Å; S139-M142 WeakPolarHBondContact O-CA 3.48Å; S139-M142 PolarHBondContact O-N 2.99Å; V140-M142 PolarHBondContact O-N 3.43Å; V140-M142 VanDerWaalsContact O-N 3.11Å; M142-N144 VanDerWaalsContact C-N 3.34Å; M142-N144 PolarHBondContact O-N 2.75Å; M142-L145 PolarHBondContact O-N 3.43Å; M142-F150 HydrophobicContact CB-CD2 4.34Å; M142-F150 HydrophobicContact CB-CE1 4.35Å; M142-F150 HydrophobicContact CB-CE2 3.69Å; M142-F150 HydrophobicContact CB-CZ 3.71Å; M142-F150 HydrophobicContact CG-CD1 4.18Å; M142-F150 HydrophobicContact CG-CD2 4.36Å; M142-F150 HydrophobicContact CG-CE1 3.81Å; M142-F150 HydrophobicContact CG-CE2 3.98Å; M142-F150 HydrophobicContact CG-CG 4.43Å; M142-F150 HydrophobicContact CG-CZ 3.7Å; M142-F150 WeakPolarHBondContact O-CE2 3.39Å; M142-F150 HydrophobicContact SD-CD1 4.32Å; M142-F150 HydrophobicContact SD-CD2 4.42Å; M142-F150 HydrophobicContact SD-CG 4.26Å; M142-T157 HydrophobicContact CG-CG2 3.91Å; M142-T157 HydrophobicContact SD-CG2 4.15Å; M142-W158 HydrophobicContact CE-CE3 4.46Å; M142-W158 HydrophobicContact SD-CB 4.44Å; M142-W158 HydrophobicContact SD-CE3 3.99Å; M142-H161 HydrophobicContact CE-CB 3.43Å; M142-H161 VanDerWaalsContact CE-CB 3.43Å; M142-H161 VanDerWaalsContact CE-CD2 3.48Å; M142-H161 WeakPolarHBondContact CE-CD2 3.31Å
143	L	84.7	Confident	82.2	Confident	140 Å²	140	84.8 Å²	84.8	73%	0.733	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64	-35.5	-167.1	-170.2	64.9	0	0	0	114.2	S139 V140	S139-L143 PolarHBondContact O-N 3.33Å; V140-L143 PolarHBondContact O-N 3.37Å
144	N	81.1	Confident	80.9	Confident	151 Å²	151	87.9 Å²	87.9	81%	0.807	45%	0.448	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101.8	5.7	-171.3	-66.1	-49.8	0	0	0	114.4	M142	M142-N144 VanDerWaalsContact C-N 3.34Å; M142-N144 PolarHBondContact O-N 2.75Å
145	L	80.1	Confident	80.2	Confident	76 Å²	76	85.5 Å²	85.5	40%	0.398	44%	0.44	S	S	.	.	S	Bend	trans	-116.4	142.1	-176.3	-65.6	175.2	0	0	0	110.3	M142 F149 F150	M142-L145 PolarHBondContact O-N 3.43Å; L145-F149 HydrophobicContact CD1-CD1 4.08Å; L145-F149 HydrophobicContact CD1-CE1 4.42Å; L145-F150 HydrophobicContact CB-CD2 4.47Å; L145-F150 HydrophobicContact CB-CE1 4.31Å; L145-F150 HydrophobicContact CB-CE2 3.4Å; L145-F150 VanDerWaalsContact CB-CE2 3.4Å; L145-F150 HydrophobicContact CB-CZ 3.29Å; L145-F150 HydrophobicContact CD1-CE1 3.66Å; L145-F150 HydrophobicContact CD1-CE2 4.32Å; L145-F150 HydrophobicContact CD1-CZ 3.33Å; L145-F150 HydrophobicContact CG-CE2 4.41Å; L145-F150 HydrophobicContact CG-CZ 3.82Å
146	P	82	Confident	79.9	Confident	79 Å²	79	92.2 Å²	92.2	51%	0.513	47%	0.468	S	S	.	.			trans	-59.5	144.8	177.2	-23.5	33.4	0	0	0	112	D148 F149	P146-D148 PolarHBondContact O-N 3.38Å; P146-D148 VanDerWaalsContact O-N 3.12Å; P146-F149 WeakPolarHBondContact O-CB 3.49Å; P146-F149 PolarHBondContact O-N 2.91Å
147	P	76.5	Confident	79.8	Confident	84 Å²	84	90 Å²	90	55%	0.545	46%	0.463	S	S	.	.	H	α-helix	trans	-55.1	-33.9	-179.9	-27.3	34.7	0	0	0	114.2	F149 F150 R151	P147-F149 PolarHBondContact O-N 3.42Å; P147-F150 PolarHBondContact O-N 3.4Å; P147-R151 PolarHBondContact O-N 3.14Å; P147-R151 VanDerWaalsContact O-N 3.13Å
148	D	79	Confident	79.6	Confident	97 Å²	97	87.5 Å²	87.5	52%	0.519	45%	0.448	S	S	.	.	H	α-helix	trans	-63.2	-31.1	179.6	-62.6	-29.2	0	0	0	111.7	P146 F150 R151 L152	P146-D148 PolarHBondContact O-N 3.38Å; P146-D148 VanDerWaalsContact O-N 3.12Å; D148-F150 PolarHBondContact O-N 3.29Å; D148-R151 PolarHBondContact O-N 3.49Å; D148-L152 HydrophobicContact CB-CD1 4.27Å; D148-L152 WeakPolarHBondContact O-CB 3.37Å; D148-L152 VanDerWaalsContact O-CD1 3.27Å; D148-L152 WeakPolarHBondContact O-CD1 3.4Å; D148-L152 WeakPolarHBondContact O-CG 3.44Å; D148-L152 PolarHBondContact O-N 2.69Å
149	F	76.6	Confident	79.6	Confident	106 Å²	106	93.1 Å²	93.1	47%	0.465	47%	0.472	S	S	.	.	H	α-helix	trans	-62.5	-42.9	178.6	-152.5	-103.6	0	0	0	111.6	L145 P146 P147 L153	L145-F149 HydrophobicContact CD1-CD1 4.08Å; L145-F149 HydrophobicContact CD1-CE1 4.42Å; P146-F149 WeakPolarHBondContact O-CB 3.49Å; P146-F149 PolarHBondContact O-N 2.91Å; P147-F149 PolarHBondContact O-N 3.42Å; F149-L153 HydrophobicContact CD1-CD1 3.63Å; F149-L153 HydrophobicContact CE1-CD1 3.34Å; F149-L153 HydrophobicContact CE2-CD1 4.36Å; F149-L153 HydrophobicContact CG-CD1 4.26Å; F149-L153 HydrophobicContact CZ-CD1 3.75Å; F149-L153 VanDerWaalsContact O-CB 3.31Å; F149-L153 WeakPolarHBondContact O-CB 3.31Å; F149-L153 VanDerWaalsContact O-CG 3.31Å; F149-L153 WeakPolarHBondContact O-CG 3.39Å; F149-L153 PolarHBondContact O-N 3.39Å
150	F	72	Confident	79.8	Confident	15 Å²	15	94 Å²	94	7%	0.066	47%	0.474	C	S	.	.	H	α-helix	trans	-75.3	-35.7	178.5	-61.1	-61.6	0	0	0	113.4	M142 L145 P147 D148 R154 T155 W158	M142-F150 HydrophobicContact CB-CD2 4.34Å; M142-F150 HydrophobicContact CB-CE1 4.35Å; M142-F150 HydrophobicContact CB-CE2 3.69Å; M142-F150 HydrophobicContact CB-CZ 3.71Å; M142-F150 HydrophobicContact CG-CD1 4.18Å; M142-F150 HydrophobicContact CG-CD2 4.36Å; M142-F150 HydrophobicContact CG-CE1 3.81Å; M142-F150 HydrophobicContact CG-CE2 3.98Å; M142-F150 HydrophobicContact CG-CG 4.43Å; M142-F150 HydrophobicContact CG-CZ 3.7Å; M142-F150 WeakPolarHBondContact O-CE2 3.39Å; M142-F150 HydrophobicContact SD-CD1 4.32Å; M142-F150 HydrophobicContact SD-CD2 4.42Å; M142-F150 HydrophobicContact SD-CG 4.26Å; L145-F150 HydrophobicContact CB-CD2 4.47Å; L145-F150 HydrophobicContact CB-CE1 4.31Å; L145-F150 HydrophobicContact CB-CE2 3.4Å; L145-F150 VanDerWaalsContact CB-CE2 3.4Å; L145-F150 HydrophobicContact CB-CZ 3.29Å; L145-F150 HydrophobicContact CD1-CE1 3.66Å; L145-F150 HydrophobicContact CD1-CE2 4.32Å; L145-F150 HydrophobicContact CD1-CZ 3.33Å; L145-F150 HydrophobicContact CG-CE2 4.41Å; L145-F150 HydrophobicContact CG-CZ 3.82Å; P147-F150 PolarHBondContact O-N 3.4Å; D148-F150 PolarHBondContact O-N 3.29Å; F150-R154 WeakPolarHBondContact O-CA 3.5Å; F150-R154 PolarHBondContact O-N 3.11Å; F150-T155 HydrophobicContact CD1-CG2 4.38Å; F150-W158 HydrophobicContact CB-CB 4.23Å; F150-W158 HydrophobicContact CB-CE3 4.46Å; F150-W158 HydrophobicContact CB-CG 4.44Å
151	R	69.5	Low	79.9	Confident	122 Å²	122	89.9 Å²	89.9	46%	0.46	45%	0.447	S	S	.	.	H	α-helix	trans	-66.6	-42.1	175.3	-73.9	-179.4	177.6	155	-4	111.7	P147 D148	P147-R151 PolarHBondContact O-N 3.14Å; P147-R151 VanDerWaalsContact O-N 3.13Å; D148-R151 PolarHBondContact O-N 3.49Å
152	L	68.7	Low	80.2	Confident	144 Å²	144	86.9 Å²	86.9	75%	0.754	43%	0.43	S	S	*	.	H	α-helix	trans	-70.3	-44.7	179.5	-75.7	159.9	0	0	0	112	D148 R154	D148-L152 HydrophobicContact CB-CD1 4.27Å; D148-L152 WeakPolarHBondContact O-CB 3.37Å; D148-L152 VanDerWaalsContact O-CD1 3.27Å; D148-L152 WeakPolarHBondContact O-CD1 3.4Å; D148-L152 WeakPolarHBondContact O-CG 3.44Å; D148-L152 PolarHBondContact O-N 2.69Å; L152-R154 VanDerWaalsContact C-N 3.32Å; L152-R154 PolarHBondContact O-N 3.06Å
153	L	67.8	Low	80.7	Confident	101 Å²	101	88.3 Å²	88.3	53%	0.529	44%	0.444	S	S	.	.	H	α-helix	trans	-83.9	-6.6	-176.8	-63.3	177	0	0	0	113.7	F149 T155	F149-L153 HydrophobicContact CD1-CD1 3.63Å; F149-L153 HydrophobicContact CE1-CD1 3.34Å; F149-L153 HydrophobicContact CE2-CD1 4.36Å; F149-L153 HydrophobicContact CG-CD1 4.26Å; F149-L153 HydrophobicContact CZ-CD1 3.75Å; F149-L153 VanDerWaalsContact O-CB 3.31Å; F149-L153 WeakPolarHBondContact O-CB 3.31Å; F149-L153 VanDerWaalsContact O-CG 3.31Å; F149-L153 WeakPolarHBondContact O-CG 3.39Å; F149-L153 PolarHBondContact O-N 3.39Å; L153-T155 HydrophobicContact CB-CG2 3.67Å; L153-T155 PolarHBondContact O-N 2.93Å
154	R	64.8	Low	81.1	Confident	178 Å²	178	81.9 Å²	81.9	67%	0.672	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	40.2	45.3	-177	-68.9	-171.6	171.3	-178.5	-2	112.2	F150 L152	F150-R154 WeakPolarHBondContact O-CA 3.5Å; F150-R154 PolarHBondContact O-N 3.11Å; L152-R154 VanDerWaalsContact C-N 3.32Å; L152-R154 PolarHBondContact O-N 3.06Å
155	T	77.5	Confident	81.7	Confident	37 Å²	37	77.6 Å²	77.6	23%	0.227	38%	0.384	C	S	.	.			trans	-59.7	149.8	-171.1	62.3	0	0	0	0	110.3	F150 L153 T157 W158 K159	F150-T155 HydrophobicContact CD1-CG2 4.38Å; L153-T155 HydrophobicContact CB-CG2 3.67Å; L153-T155 PolarHBondContact O-N 2.93Å; T155-T157 PolarHBondContact O-N 3.31Å; T155-W158 PolarHBondContact O-N 3.5Å; T155-W158 VanDerWaalsContact O-N 3.09Å; T155-W158 PolarHBondContact OG1-N 2.81Å; T155-K159 PolarHBondContact O-N 2.71Å
156	K	87	Confident	82.3	Confident	152 Å²	152	76.8 Å²	76.8	66%	0.661	38%	0.381	S	S	*	.	H	α-helix	trans	-51.5	-43.1	174.6	-177	-175.8	177.8	-64.5	0	111	W158 K159 D160	K156-W158 VanDerWaalsContact C-N 3.34Å; K156-W158 PolarHBondContact O-N 2.86Å; K156-K159 PolarHBondContact O-N 2.73Å; K156-K159 VanDerWaalsContact O-N 3.14Å; K156-D160 IonicContact NZ-OD1 3.92Å; K156-D160 IonicContact NZ-OD2 2.8Å; K156-D160 PolarHBondContact NZ-OD2 3.17Å; K156-D160 VanDerWaalsContact O-CG 3.27Å; K156-D160 PolarHBondContact O-N 3.44Å
157	T	86.8	Confident	82.9	Confident	44 Å²	44	74.2 Å²	74.2	27%	0.27	36%	0.363	S	S	.	.	H	α-helix	trans	-56.6	-42.8	177.9	-48.2	0	0	0	0	113.1	T138 P141 M142 T155 D160 H161	T138-T157 WeakPolarHBondContact O-CG2 3.32Å; P141-T157 HydrophobicContact CB-CG2 4.26Å; P141-T157 HydrophobicContact CG-CG2 4.26Å; M142-T157 HydrophobicContact CG-CG2 3.91Å; M142-T157 HydrophobicContact SD-CG2 4.15Å; T155-T157 PolarHBondContact O-N 3.31Å; T157-D160 PolarHBondContact O-N 2.94Å; T157-H161 VanDerWaalsContact O-CB 3.3Å; T157-H161 WeakPolarHBondContact O-CB 3.27Å; T157-H161 PolarHBondContact O-N 3.47Å
158	W	86.9	Confident	83.7	Confident	59 Å²	59	70.2 Å²	70.2	22%	0.223	34%	0.337	C	S	.	.	H	α-helix	trans	-64.9	-42.1	176.8	173	-108.5	0	0	0	112.4	V28 M142 F150 T155 K156 H161 A162	V28-W158 HydrophobicContact CB-CH2 4.44Å; V28-W158 HydrophobicContact CG2-CH2 3.43Å; V28-W158 VanDerWaalsContact CG2-CH2 3.43Å; V28-W158 HydrophobicContact CG2-CZ2 3.97Å; V28-W158 HydrophobicContact CG2-CZ3 4.37Å; M142-W158 HydrophobicContact CE-CE3 4.46Å; M142-W158 HydrophobicContact SD-CB 4.44Å; M142-W158 HydrophobicContact SD-CE3 3.99Å; F150-W158 HydrophobicContact CB-CB 4.23Å; F150-W158 HydrophobicContact CB-CE3 4.46Å; F150-W158 HydrophobicContact CB-CG 4.44Å; T155-W158 PolarHBondContact O-N 3.5Å; T155-W158 VanDerWaalsContact O-N 3.09Å; T155-W158 PolarHBondContact OG1-N 2.81Å; K156-W158 VanDerWaalsContact C-N 3.34Å; K156-W158 PolarHBondContact O-N 2.86Å; W158-H161 PolarHBondContact O-N 3.02Å; W158-A162 WeakPolarHBondContact O-CB 3.33Å; W158-A162 PolarHBondContact O-N 3.25Å
159	K	88.9	Confident	84.2	Confident	125 Å²	125	67.5 Å²	67.5	54%	0.543	32%	0.321	S	S	.	.	H	α-helix	trans	-63.4	-44.8	178.2	-66.6	-179.7	-178.5	177.5	0	111.5	T155 K156 H161 A162 A163	T155-K159 PolarHBondContact O-N 2.71Å; K156-K159 PolarHBondContact O-N 2.73Å; K156-K159 VanDerWaalsContact O-N 3.14Å; K159-H161 VanDerWaalsContact C-N 3.35Å; K159-A162 PolarHBondContact O-N 3.14Å; K159-A163 WeakPolarHBondContact O-CB 3.2Å; K159-A163 PolarHBondContact O-N 2.94Å
160	D	91.1	Very high	85	Confident	57 Å²	57	67.1 Å²	67.1	31%	0.305	32%	0.323	S	S	.	.	H	α-helix	trans	-64.4	-41.6	178.3	-63.6	-17	0	0	0	110.8	T138 K156 T157 A163 A164	T138-D160 HydrophobicContact CG2-CB 3.94Å; K156-D160 IonicContact NZ-OD1 3.92Å; K156-D160 IonicContact NZ-OD2 2.8Å; K156-D160 PolarHBondContact NZ-OD2 3.17Å; K156-D160 VanDerWaalsContact O-CG 3.27Å; K156-D160 PolarHBondContact O-N 3.44Å; T157-D160 PolarHBondContact O-N 2.94Å; D160-A163 PolarHBondContact O-N 3.42Å; D160-A164 WeakPolarHBondContact O-CB 3.4Å; D160-A164 PolarHBondContact O-N 3.4Å
161	H	90.4	Very high	86	Confident	21 Å²	21	67.5 Å²	67.5	10%	0.097	33%	0.325	C	S	.	.	H	α-helix	trans	-64	-45.6	176.8	-171.8	77.3	0	0	0	112.8	M135 T138 S139 M142 T157 W158 K159 A164 W165	M135-H161 PolarHBondContact O-ND1 2.97Å; T138-H161 WeakPolarHBondContact OG1-CA 3.12Å; T138-H161 WeakPolarHBondContact OG1-CB 3.39Å; T138-H161 PolarHBondContact OG1-ND1 3.43Å; S139-H161 PolarHBondContact OG-CE1 3.46Å; M142-H161 HydrophobicContact CE-CB 3.43Å; M142-H161 VanDerWaalsContact CE-CB 3.43Å; M142-H161 VanDerWaalsContact CE-CD2 3.48Å; M142-H161 WeakPolarHBondContact CE-CD2 3.31Å; T157-H161 VanDerWaalsContact O-CB 3.3Å; T157-H161 WeakPolarHBondContact O-CB 3.27Å; T157-H161 PolarHBondContact O-N 3.47Å; W158-H161 PolarHBondContact O-N 3.02Å; K159-H161 VanDerWaalsContact C-N 3.35Å; H161-A164 PolarHBondContact O-N 3.11Å; H161-W165 AromaticContact CD2-CD1 3.55Å; H161-W165 AromaticContact CD2-NE1 3.75Å; H161-W165 AromaticContact CE1-CD1 3.72Å; H161-W165 AromaticContact CE1-NE1 3.24Å; H161-W165 PolarHBondContact CE1-NE1 3.03Å; H161-W165 AromaticContact NE2-CD1 3.28Å; H161-W165 VanDerWaalsContact NE2-CD1 3.28Å; H161-W165 AromaticContact NE2-NE1 2.95Å; H161-W165 PolarHBondContact NE2-NE1 3.45Å; H161-W165 PolarHBondContact O-N 3.37Å
162	A	90.2	Very high	87	Confident	15 Å²	15	61.7 Å²	61.7	12%	0.124	30%	0.303	C	S	.	.	H	α-helix	trans	-62.3	-43.7	176.9	0	0	0	0	0	111.3	A27 W158 K159 A164 W165 D166	A27-A162 HydrophobicContact CB-CB 4.01Å; W158-A162 WeakPolarHBondContact O-CB 3.33Å; W158-A162 PolarHBondContact O-N 3.25Å; K159-A162 PolarHBondContact O-N 3.14Å; A162-A164 VanDerWaalsContact C-N 3.34Å; A162-A164 PolarHBondContact O-N 3.17Å; A162-W165 PolarHBondContact O-N 3.4Å; A162-D166 PolarHBondContact O-N 2.92Å
163	A	93.2	Very high	88	Confident	51 Å²	51	58.2 Å²	58.2	42%	0.421	29%	0.286	S	S	.	.	H	α-helix	trans	-63.8	-37.8	177.2	0	0	0	0	0	112.7	K159 D160 D166 V167	K159-A163 WeakPolarHBondContact O-CB 3.2Å; K159-A163 PolarHBondContact O-N 2.94Å; D160-A163 PolarHBondContact O-N 3.42Å; A163-D166 PolarHBondContact O-N 2.96Å; A163-V167 WeakPolarHBondContact O-CG2 3.49Å; A163-V167 PolarHBondContact O-N 2.89Å; A163-V167 VanDerWaalsContact O-N 3.14Å
164	A	93.8	Very high	89.2	Confident	6 Å²	6	57.4 Å²	57.4	5%	0.05	28%	0.279	C	S	.	.	H	α-helix	trans	-62.5	-46.6	174.4	0	0	0	0	0	111.4	Q134 M135 D160 H161 A162 D166 V167 I168	Q134-A164 HydrophobicContact CB-CB 4.13Å; M135-A164 HydrophobicContact CB-CB 4.12Å; D160-A164 WeakPolarHBondContact O-CB 3.4Å; D160-A164 PolarHBondContact O-N 3.4Å; H161-A164 PolarHBondContact O-N 3.11Å; A162-A164 VanDerWaalsContact C-N 3.34Å; A162-A164 PolarHBondContact O-N 3.17Å; A164-D166 PolarHBondContact O-N 3.29Å; A164-V167 PolarHBondContact O-N 3.14Å; A164-I168 WeakPolarHBondContact O-CG1 3.46Å; A164-I168 PolarHBondContact O-N 3.39Å; A164-I168 VanDerWaalsContact O-N 3.08Å
165	W	92.8	Very high	90.5	Very high	61 Å²	61	50.3 Å²	50.3	23%	0.231	25%	0.252	C	S	.	.	H	α-helix	trans	-62.3	-40.6	174.6	-83.8	113.3	0	0	0	113.1	M135 H161 A162 V167 I168 F169	M135-W165 HydrophobicContact CE-CH2 4.16Å; M135-W165 HydrophobicContact CE-CZ2 4.02Å; M135-W165 HydrophobicContact CG-CD2 3.95Å; M135-W165 HydrophobicContact CG-CG 4.33Å; M135-W165 HydrophobicContact CG-CH2 4.29Å; M135-W165 HydrophobicContact CG-CZ2 3.54Å; M135-W165 HydrophobicContact SD-CH2 4.23Å; M135-W165 HydrophobicContact SD-CZ2 3.49Å; M135-W165 WeakPolarHBondContact SD-CZ2 3.39Å; H161-W165 AromaticContact CD2-CD1 3.55Å; H161-W165 AromaticContact CD2-NE1 3.75Å; H161-W165 AromaticContact CE1-CD1 3.72Å; H161-W165 AromaticContact CE1-NE1 3.24Å; H161-W165 PolarHBondContact CE1-NE1 3.03Å; H161-W165 AromaticContact NE2-CD1 3.28Å; H161-W165 VanDerWaalsContact NE2-CD1 3.28Å; H161-W165 AromaticContact NE2-NE1 2.95Å; H161-W165 PolarHBondContact NE2-NE1 3.45Å; H161-W165 PolarHBondContact O-N 3.37Å; A162-W165 PolarHBondContact O-N 3.4Å; W165-V167 VanDerWaalsContact C-N 3.28Å; W165-V167 PolarHBondContact O-N 2.93Å; W165-I168 HydrophobicContact CD2-CD1 4.5Å; W165-I168 HydrophobicContact CE3-CB 4.29Å; W165-I168 HydrophobicContact CE3-CD1 4.1Å; W165-I168 HydrophobicContact CE3-CG2 4.15Å; W165-I168 HydrophobicContact CZ3-CD1 4.37Å; W165-I168 HydrophobicContact CZ3-CG2 4.13Å; W165-I168 PolarHBondContact O-N 3.41Å; W165-I168 VanDerWaalsContact O-N 3.15Å; W165-F169 HydrophobicContact CB-CD2 4.34Å; W165-F169 HydrophobicContact CB-CE2 4.48Å; W165-F169 HydrophobicContact CD2-CE2 4.25Å; W165-F169 HydrophobicContact CE3-CD2 4.01Å; W165-F169 AromaticContact CE3-CE2 3.56Å; W165-F169 HydrophobicContact CE3-CE2 3.56Å; W165-F169 HydrophobicContact CE3-CZ 4.33Å; W165-F169 HydrophobicContact CZ3-CE2 4.19Å; W165-F169 VanDerWaalsContact O-CD2 3.27Å; W165-F169 WeakPolarHBondContact O-CD2 3.35Å; W165-F169 PolarHBondContact O-N 3.36Å
166	D	92.9	Very high	91.1	Very high	59 Å²	59	48.5 Å²	48.5	32%	0.316	24%	0.242	S	C	.	.	H	α-helix	trans	-58.9	-41.8	177.1	-76.1	-27.5	0	0	0	111.3	A162 A163 A164 N170	A162-D166 PolarHBondContact O-N 2.92Å; A163-D166 PolarHBondContact O-N 2.96Å; A164-D166 PolarHBondContact O-N 3.29Å; D166-N170 VanDerWaalsContact O-CB 3.23Å; D166-N170 WeakPolarHBondContact O-CB 3.41Å; D166-N170 PolarHBondContact O-N 2.66Å; D166-N170 PolarHBondContact O-ND2 3.42Å
167	V	94.9	Very high	91.2	Very high	24 Å²	24	43.8 Å²	43.8	15%	0.145	22%	0.222	C	C	.	.	H	α-helix	trans	-62.8	-47.1	174.4	173.2	0	0	0	0	111.2	R127 A131 A163 A164 W165 N170 K171	R127-V167 HydrophobicContact CG-CG1 4.13Å; A131-V167 HydrophobicContact CB-CB 3.81Å; A131-V167 HydrophobicContact CB-CG1 3.62Å; A163-V167 WeakPolarHBondContact O-CG2 3.49Å; A163-V167 PolarHBondContact O-N 2.89Å; A163-V167 VanDerWaalsContact O-N 3.14Å; A164-V167 PolarHBondContact O-N 3.14Å; W165-V167 VanDerWaalsContact C-N 3.28Å; W165-V167 PolarHBondContact O-N 2.93Å; V167-N170 PolarHBondContact O-N 2.73Å; V167-K171 WeakPolarHBondContact O-CB 3.48Å; V167-K171 PolarHBondContact O-N 3.41Å
168	I	92.6	Very high	91.3	Very high	0 Å²	0	45.5 Å²	45.5	0%	0	23%	0.229	C	C	.	.	H	α-helix	trans	-58.5	-51.3	-179.8	-68.3	165.3	0	0	0	110.6	F128 A131 V132 M135 A164 W165 A172 T215 A219	F128-I168 HydrophobicContact CE2-CB 4.18Å; F128-I168 HydrophobicContact CE2-CG1 4.34Å; F128-I168 HydrophobicContact CE2-CG2 3.88Å; F128-I168 HydrophobicContact CZ-CG2 4.31Å; A131-I168 HydrophobicContact CB-CG1 4.01Å; V132-I168 HydrophobicContact CG2-CD1 4.14Å; V132-I168 HydrophobicContact CG2-CG1 4.14Å; M135-I168 HydrophobicContact CB-CD1 3.85Å; M135-I168 HydrophobicContact CG-CD1 4.14Å; A164-I168 WeakPolarHBondContact O-CG1 3.46Å; A164-I168 PolarHBondContact O-N 3.39Å; A164-I168 VanDerWaalsContact O-N 3.08Å; W165-I168 HydrophobicContact CD2-CD1 4.5Å; W165-I168 HydrophobicContact CE3-CB 4.29Å; W165-I168 HydrophobicContact CE3-CD1 4.1Å; W165-I168 HydrophobicContact CE3-CG2 4.15Å; W165-I168 HydrophobicContact CZ3-CD1 4.37Å; W165-I168 HydrophobicContact CZ3-CG2 4.13Å; W165-I168 PolarHBondContact O-N 3.41Å; W165-I168 VanDerWaalsContact O-N 3.15Å; I168-A172 VanDerWaalsContact O-CB 3.28Å; I168-A172 WeakPolarHBondContact O-CB 3.45Å; I168-A172 PolarHBondContact O-N 3.36Å; I168-T215 HydrophobicContact CG2-CG2 3.81Å; I168-A219 HydrophobicContact CG2-CB 4.15Å
169	F	90.6	Very high	91.3	Very high	41 Å²	41	43.3 Å²	43.3	18%	0.18	22%	0.221	C	C	.	.	H	α-helix	trans	-64.9	-46.2	-178.8	-84.1	-71.2	0	0	0	112.3	W165 K171 A172 D173 T215	W165-F169 HydrophobicContact CB-CD2 4.34Å; W165-F169 HydrophobicContact CB-CE2 4.48Å; W165-F169 HydrophobicContact CD2-CE2 4.25Å; W165-F169 HydrophobicContact CE3-CD2 4.01Å; W165-F169 AromaticContact CE3-CE2 3.56Å; W165-F169 HydrophobicContact CE3-CE2 3.56Å; W165-F169 HydrophobicContact CE3-CZ 4.33Å; W165-F169 HydrophobicContact CZ3-CE2 4.19Å; W165-F169 VanDerWaalsContact O-CD2 3.27Å; W165-F169 WeakPolarHBondContact O-CD2 3.35Å; W165-F169 PolarHBondContact O-N 3.36Å; F169-K171 VanDerWaalsContact C-N 3.34Å; F169-K171 PolarHBondContact O-N 3.16Å; F169-A172 PolarHBondContact O-N 2.93Å; F169-D173 VanDerWaalsContact O-CB 3.28Å; F169-D173 WeakPolarHBondContact O-CB 3.18Å; F169-D173 PolarHBondContact O-N 2.88Å; F169-T215 HydrophobicContact CD1-CG2 3.89Å; F169-T215 HydrophobicContact CE1-CG2 4Å; F169-T215 HydrophobicContact CG-CG2 4.47Å
170	N	92.6	Very high	91.1	Very high	97 Å²	97	40.4 Å²	40.4	52%	0.519	21%	0.207	S	C	.	.	H	α-helix	trans	-62.7	-42.5	-177.7	-70	-25	0	0	0	111.4	D166 V167 E174	D166-N170 VanDerWaalsContact O-CB 3.23Å; D166-N170 WeakPolarHBondContact O-CB 3.41Å; D166-N170 PolarHBondContact O-N 2.66Å; D166-N170 PolarHBondContact O-ND2 3.42Å; V167-N170 PolarHBondContact O-N 2.73Å; N170-E174 WeakPolarHBondContact O-CB 3.05Å; N170-E174 PolarHBondContact O-N 3.09Å
171	K	92.5	Very high	90.8	Very high	24 Å²	24	44 Å²	44	10%	0.104	22%	0.217	C	C	.	.	H	α-helix	trans	-72.5	-41.1	179.6	-75.5	-71	165.3	-162.3	0	113	E124 F128 V167 F169 D173 E174 Y175	E124-K171 WeakPolarHBondContact OE2-CE 3.3Å; E124-K171 IonicContact OE2-NZ 2.73Å; E124-K171 PolarHBondContact OE2-NZ 2.62Å; F128-K171 HydrophobicContact CB-CB 4.5Å; F128-K171 HydrophobicContact CD2-CB 3.75Å; V167-K171 WeakPolarHBondContact O-CB 3.48Å; V167-K171 PolarHBondContact O-N 3.41Å; F169-K171 VanDerWaalsContact C-N 3.34Å; F169-K171 PolarHBondContact O-N 3.16Å; K171-D173 VanDerWaalsContact C-N 3.31Å; K171-D173 PolarHBondContact O-N 3.16Å; K171-E174 IonicContact NZ-OE1 3.63Å; K171-E174 IonicContact NZ-OE2 2.89Å; K171-E174 PolarHBondContact NZ-OE2 2.96Å; K171-E174 WeakPolarHBondContact O-CB 3.5Å; K171-E174 PolarHBondContact O-N 3.45Å; K171-Y175 HydrophobicContact CB-CE2 4.27Å; K171-Y175 WeakPolarHBondContact O-CD2 3.22Å; K171-Y175 VanDerWaalsContact O-CG 3.29Å; K171-Y175 PolarHBondContact O-N 3.1Å
172	A	91.1	Very high	90.5	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-65.2	-36.6	176	0	0	0	0	0	112.2	I168 F169 T176 T215 L218	I168-A172 VanDerWaalsContact O-CB 3.28Å; I168-A172 WeakPolarHBondContact O-CB 3.45Å; I168-A172 PolarHBondContact O-N 3.36Å; F169-A172 PolarHBondContact O-N 2.93Å; A172-T176 WeakPolarHBondContact O-CB 3.48Å; A172-T176 PolarHBondContact O-N 3.14Å; A172-T176 PolarHBondContact O-OG1 3.13Å; A172-T215 HydrophobicContact CB-CG2 3.8Å; A172-T215 WeakPolarHBondContact CB-OG1 3.27Å; A172-L218 HydrophobicContact CB-CD1 4.09Å
173	D	90.6	Very high	89.9	Confident	71 Å²	71	46.7 Å²	46.7	38%	0.38	23%	0.23	S	C	.	.	H	α-helix	trans	-63.8	-48.4	172.3	-170.5	31.2	0	0	0	110.7	F169 K171 Y175 T176 Q177 Q211	F169-D173 VanDerWaalsContact O-CB 3.28Å; F169-D173 WeakPolarHBondContact O-CB 3.18Å; F169-D173 PolarHBondContact O-N 2.88Å; K171-D173 VanDerWaalsContact C-N 3.31Å; K171-D173 PolarHBondContact O-N 3.16Å; D173-Y175 PolarHBondContact O-N 3.01Å; D173-T176 PolarHBondContact O-N 3.48Å; D173-Q177 WeakPolarHBondContact O-CB 3.39Å; D173-Q177 WeakPolarHBondContact O-CG 3.43Å; D173-Q177 PolarHBondContact O-N 3.42Å; D173-Q211 PolarHBondContact OD1-NE2 2.7Å
174	E	92	Very high	89.1	Confident	84 Å²	84	51.2 Å²	51.2	39%	0.393	24%	0.236	S	C	.	.	H	α-helix	trans	-53.7	-51.8	175.4	-174.2	-176.9	169.6	0	0	111.9	N170 K171 T176 Q177 N178	N170-E174 WeakPolarHBondContact O-CB 3.05Å; N170-E174 PolarHBondContact O-N 3.09Å; K171-E174 IonicContact NZ-OE1 3.63Å; K171-E174 IonicContact NZ-OE2 2.89Å; K171-E174 PolarHBondContact NZ-OE2 2.96Å; K171-E174 WeakPolarHBondContact O-CB 3.5Å; K171-E174 PolarHBondContact O-N 3.45Å; E174-T176 PolarHBondContact O-N 3.44Å; E174-Q177 PolarHBondContact O-N 3.5Å; E174-N178 WeakPolarHBondContact O-CB 3.37Å; E174-N178 PolarHBondContact O-N 2.91Å; E174-N178 PolarHBondContact O-ND2 3.4Å
175	Y	91.2	Very high	88.3	Confident	28 Å²	28	58.3 Å²	58.3	11%	0.11	27%	0.268	C	S	.	.	H	α-helix	trans	-61	-43.7	177.9	-63.3	-38.3	0	0	0	112.6	F102 F110 M114 A125 K171 D173 Q177 F179 L218	F102-Y175 HydrophobicContact CZ-CE2 4.11Å; F110-Y175 HydrophobicContact CZ-CG 4.47Å; M114-Y175 HydrophobicContact CE-CD1 3.72Å; M114-Y175 HydrophobicContact CE-CD2 3.99Å; M114-Y175 HydrophobicContact CE-CE1 3.64Å; M114-Y175 HydrophobicContact CE-CE2 3.91Å; M114-Y175 HydrophobicContact CE-CG 3.91Å; A125-Y175 WeakPolarHBondContact CA-OH 3.34Å; K171-Y175 HydrophobicContact CB-CE2 4.27Å; K171-Y175 WeakPolarHBondContact O-CD2 3.22Å; K171-Y175 VanDerWaalsContact O-CG 3.29Å; K171-Y175 PolarHBondContact O-N 3.1Å; D173-Y175 PolarHBondContact O-N 3.01Å; Y175-Q177 PolarHBondContact O-N 3.29Å; Y175-F179 WeakPolarHBondContact O-CB 3.37Å; Y175-F179 PolarHBondContact O-N 3.35Å; Y175-L218 HydrophobicContact CD2-CD1 4.48Å
176	T	90.4	Very high	87.3	Confident	0 Å²	0	60.3 Å²	60.3	0%	0	28%	0.278	C	S	.	.	H	α-helix	trans	-66.5	-39.8	-179.3	-55.3	0	0	0	0	111.8	A172 D173 E174 Y180 L196 F207 Q211	A172-T176 WeakPolarHBondContact O-CB 3.48Å; A172-T176 PolarHBondContact O-N 3.14Å; A172-T176 PolarHBondContact O-OG1 3.13Å; D173-T176 PolarHBondContact O-N 3.48Å; E174-T176 PolarHBondContact O-N 3.44Å; T176-Y180 WeakPolarHBondContact O-CB 3.36Å; T176-Y180 PolarHBondContact O-N 2.86Å; T176-L196 HydrophobicContact CG2-CD1 4.19Å; T176-L196 HydrophobicContact CG2-CD2 3.96Å; T176-F207 HydrophobicContact CG2-CE2 4.36Å; T176-F207 HydrophobicContact CG2-CZ 4.3Å; T176-Q211 HydrophobicContact CG2-CG 3.79Å
177	Q	89.4	Confident	85.9	Confident	53 Å²	53	68.2 Å²	68.2	25%	0.248	30%	0.304	C	S	.	.	H	α-helix	trans	-68.1	-48.6	177.6	-69.4	-71.9	-10.1	0	0	111.3	D173 E174 Y175 F179 Y180 W181 Q211	D173-Q177 WeakPolarHBondContact O-CB 3.39Å; D173-Q177 WeakPolarHBondContact O-CG 3.43Å; D173-Q177 PolarHBondContact O-N 3.42Å; E174-Q177 PolarHBondContact O-N 3.5Å; Y175-Q177 PolarHBondContact O-N 3.29Å; Q177-F179 VanDerWaalsContact C-N 3.32Å; Q177-F179 PolarHBondContact O-N 2.84Å; Q177-Y180 WeakPolarHBondContact O-CB 3.35Å; Q177-Y180 PolarHBondContact O-N 3.18Å; Q177-Y180 VanDerWaalsContact O-N 3.11Å; Q177-W181 PolarHBondContact O-N 2.91Å; Q177-Q211 VanDerWaalsContact NE2-NE2 3.18Å
178	N	88.5	Confident	84.9	Confident	80 Å²	80	74.3 Å²	74.3	43%	0.428	34%	0.336	S	S	.	.	H	α-helix	trans	-57.9	-47.4	179.3	-70.1	-11	0	0	0	110.5	E174 Y180 W181 D182	E174-N178 WeakPolarHBondContact O-CB 3.37Å; E174-N178 PolarHBondContact O-N 2.91Å; E174-N178 PolarHBondContact O-ND2 3.4Å; N178-Y180 VanDerWaalsContact C-N 3.34Å; N178-Y180 PolarHBondContact O-N 3.03Å; N178-W181 PolarHBondContact O-N 3.39Å; N178-D182 PolarHBondContact O-N 3.14Å
179	F	86.8	Confident	84.2	Confident	13 Å²	13	77.6 Å²	77.6	6%	0.057	35%	0.35	C	S	.	.	H	α-helix	trans	-58.7	-44.5	175	-175.4	-91.9	0	0	0	112.4	F110 Y175 Q177 W181 D182 L183 L196 L200	F110-F179 HydrophobicContact CB-CD2 4.18Å; F110-F179 HydrophobicContact CB-CE2 4.43Å; F110-F179 HydrophobicContact CD1-CB 4.1Å; F110-F179 HydrophobicContact CD1-CD2 4.14Å; F110-F179 HydrophobicContact CD1-CG 4.1Å; F110-F179 WeakPolarHBondContact O-CE2 3.43Å; Y175-F179 WeakPolarHBondContact O-CB 3.37Å; Y175-F179 PolarHBondContact O-N 3.35Å; Q177-F179 VanDerWaalsContact C-N 3.32Å; Q177-F179 PolarHBondContact O-N 2.84Å; F179-W181 VanDerWaalsContact C-N 3.31Å; F179-W181 PolarHBondContact O-N 3.17Å; F179-D182 PolarHBondContact O-N 2.78Å; F179-L183 HydrophobicContact CE1-CD1 4.33Å; F179-L183 HydrophobicContact CZ-CD1 4.34Å; F179-L183 VanDerWaalsContact O-CB 3.32Å; F179-L183 WeakPolarHBondContact O-CB 3.49Å; F179-L183 PolarHBondContact O-N 3.29Å; F179-L196 HydrophobicContact CB-CD2 3.92Å; F179-L196 HydrophobicContact CD1-CB 4.25Å; F179-L196 HydrophobicContact CD1-CD2 3.33Å; F179-L196 HydrophobicContact CD1-CG 3.62Å; F179-L196 HydrophobicContact CE1-CB 4.11Å; F179-L196 HydrophobicContact CE1-CD2 4.05Å; F179-L196 HydrophobicContact CE1-CG 3.85Å; F179-L196 HydrophobicContact CG-CD2 3.77Å; F179-L196 HydrophobicContact CG-CG 4.47Å; F179-L200 HydrophobicContact CD1-CD1 4.34Å; F179-L200 HydrophobicContact CE1-CD1 4.39Å
180	Y	85	Confident	83.5	Confident	64 Å²	64	81.5 Å²	81.5	25%	0.251	38%	0.382	S	S	.	.	H	α-helix	trans	-61.6	-38	178.2	178.9	-104.1	0	0	0	112.8	T176 Q177 N178 R184 L200 F207	T176-Y180 WeakPolarHBondContact O-CB 3.36Å; T176-Y180 PolarHBondContact O-N 2.86Å; Q177-Y180 WeakPolarHBondContact O-CB 3.35Å; Q177-Y180 PolarHBondContact O-N 3.18Å; Q177-Y180 VanDerWaalsContact O-N 3.11Å; N178-Y180 VanDerWaalsContact C-N 3.34Å; N178-Y180 PolarHBondContact O-N 3.03Å; Y180-R184 PolarHBondContact O-N 3.49Å; Y180-R184 PolarHBondContact OH-NH2 3.5Å; Y180-L200 HydrophobicContact CD2-CD1 3.9Å; Y180-L200 HydrophobicContact CD2-CD2 3.97Å; Y180-L200 HydrophobicContact CE2-CD2 4.27Å; Y180-F207 HydrophobicContact CD2-CE2 4.14Å; Y180-F207 HydrophobicContact CG-CE2 4.17Å
181	W	85.4	Confident	83	Confident	131 Å²	131	83.7 Å²	83.7	50%	0.496	39%	0.389	S	S	.	.	H	α-helix	trans	-70.2	-43.9	176.2	-70.9	118.8	0	0	0	112.4	Q177 N178 F179 L183 R184	Q177-W181 PolarHBondContact O-N 2.91Å; N178-W181 PolarHBondContact O-N 3.39Å; F179-W181 VanDerWaalsContact C-N 3.31Å; F179-W181 PolarHBondContact O-N 3.17Å; W181-L183 PolarHBondContact O-N 3.32Å; W181-R184 WeakPolarHBondContact O-CB 3.42Å; W181-R184 PolarHBondContact O-N 3.31Å; W181-R184 VanDerWaalsContact O-N 3.17Å
182	D	83.6	Confident	82.9	Confident	61 Å²	61	84.9 Å²	84.9	33%	0.326	39%	0.394	S	S	.	.	H	α-helix	trans	-63.3	-35.1	177.5	-74.2	-8.7	0	0	0	111.5	N178 F179 R184 Q185 K186	N178-D182 PolarHBondContact O-N 3.14Å; F179-D182 PolarHBondContact O-N 2.78Å; D182-R184 VanDerWaalsContact C-N 3.26Å; D182-R184 PolarHBondContact O-N 3.03Å; D182-Q185 WeakPolarHBondContact O-CA 3.49Å; D182-Q185 WeakPolarHBondContact O-CB 3.46Å; D182-Q185 PolarHBondContact O-N 3.27Å; D182-K186 PolarHBondContact O-N 3.01Å
183	L	79	Confident	82.8	Confident	33 Å²	33	85.7 Å²	85.7	17%	0.173	40%	0.399	C	S	.	.	H	α-helix	trans	-63.4	-31.7	176.6	-163.9	72.3	0	0	0	113.8	F179 W181 Q185 F189 Y197 L200	F179-L183 HydrophobicContact CE1-CD1 4.33Å; F179-L183 HydrophobicContact CZ-CD1 4.34Å; F179-L183 VanDerWaalsContact O-CB 3.32Å; F179-L183 WeakPolarHBondContact O-CB 3.49Å; F179-L183 PolarHBondContact O-N 3.29Å; W181-L183 PolarHBondContact O-N 3.32Å; L183-Q185 PolarHBondContact O-N 2.98Å; L183-F189 HydrophobicContact CD1-CE2 3.73Å; L183-F189 HydrophobicContact CD1-CZ 3.55Å; L183-Y197 HydrophobicContact CD1-CD2 3.2Å; L183-Y197 HydrophobicContact CD1-CE2 3.46Å; L183-Y197 VanDerWaalsContact CD1-CE2 3.46Å; L183-Y197 HydrophobicContact CD1-CG 4.4Å; L183-Y197 HydrophobicContact CD2-CD2 3.55Å; L183-Y197 HydrophobicContact CD2-CE2 3.88Å; L183-Y197 HydrophobicContact CG-CD2 3.89Å; L183-Y197 HydrophobicContact CG-CE2 4.01Å; L183-L200 HydrophobicContact CD2-CD1 4.15Å
184	R	75.4	Confident	82.9	Confident	145 Å²	145	82.3 Å²	82.3	55%	0.547	38%	0.381	S	S	.	.	H	α-helix	trans	-67.9	-21.8	174.6	-69.8	178.4	167.3	-149	-5.7	112.1	Y180 W181 D182	Y180-R184 PolarHBondContact O-N 3.49Å; Y180-R184 PolarHBondContact OH-NH2 3.5Å; W181-R184 WeakPolarHBondContact O-CB 3.42Å; W181-R184 PolarHBondContact O-N 3.31Å; W181-R184 VanDerWaalsContact O-N 3.17Å; D182-R184 VanDerWaalsContact C-N 3.26Å; D182-R184 PolarHBondContact O-N 3.03Å
185	Q	76.9	Confident	83.1	Confident	156 Å²	156	78.3 Å²	78.3	73%	0.729	36%	0.362	S	S	*	.	H	α-helix	trans	-95.4	-35.9	-178.1	-56.7	-176.5	37.4	0	0	112.3	D182 L183	D182-Q185 WeakPolarHBondContact O-CA 3.49Å; D182-Q185 WeakPolarHBondContact O-CB 3.46Å; D182-Q185 PolarHBondContact O-N 3.27Å; L183-Q185 PolarHBondContact O-N 2.98Å
186	K	70.8	Confident	83.2	Confident	102 Å²	102	77 Å²	77	44%	0.443	36%	0.357	S	S	.	.			trans	-98.3	114.2	179.1	-64.3	174.2	-174.6	165.6	0	110.5	E112 D182 F189	E112-K186 IonicContact OE1-NZ 3.9Å; E112-K186 PolarHBondContact OE1-NZ 3.41Å; D182-K186 PolarHBondContact O-N 3.01Å; K186-F189 HydrophobicContact CB-CZ 4.2Å
187	R	64.7	Low	83.3	Confident	226 Å²	226	81.1 Å²	81.1	85%	0.853	37%	0.373	S	S	*	.			trans	-105.9	-9.1	-179.3	-70.6	-165.8	179.9	-165.4	1	115.5
188	D	74.3	Confident	83.4	Confident	152 Å²	152	79.7 Å²	79.7	81%	0.813	37%	0.369	S	S	*	.			trans	-125.8	124.7	-175.4	-157.4	-1.3	0	0	0	110.6
189	F	77.2	Confident	83.6	Confident	69 Å²	69	76.1 Å²	76.1	30%	0.303	35%	0.35	S	S	.	.			trans	-125.1	118.2	-179.2	-64.8	-78.4	0	0	0	108.9	L183 K186 Q191 P193 Y197	L183-F189 HydrophobicContact CD1-CE2 3.73Å; L183-F189 HydrophobicContact CD1-CZ 3.55Å; K186-F189 HydrophobicContact CB-CZ 4.2Å; F189-Q191 VanDerWaalsContact C-N 3.26Å; F189-Q191 WeakPolarHBondContact CB-O 3.32Å; F189-Q191 PolarHBondContact O-N 2.87Å; F189-P193 HydrophobicContact CB-CB 4.35Å; F189-P193 HydrophobicContact CD1-CB 3.7Å; F189-P193 HydrophobicContact CD2-CB 4.06Å; F189-P193 HydrophobicContact CD2-CG 4.27Å; F189-P193 HydrophobicContact CE1-CB 3.93Å; F189-P193 HydrophobicContact CE2-CB 4.28Å; F189-P193 HydrophobicContact CG-CB 3.77Å; F189-P193 HydrophobicContact CG-CG 4.26Å; F189-P193 HydrophobicContact CZ-CB 4.23Å; F189-Y197 HydrophobicContact CD2-CE2 4.32Å; F189-Y197 HydrophobicContact CE2-CD2 4.21Å; F189-Y197 AromaticContact CE2-CE2 3.78Å; F189-Y197 HydrophobicContact CE2-CE2 3.78Å
190	S	75.9	Confident	83.7	Confident	123 Å²	123	77 Å²	77	86%	0.86	36%	0.355	S	S	*	.	S	Bend	trans	-76.4	-15	175.9	57.6	0	0	0	0	113.3
191	Q	82.7	Confident	83.8	Confident	142 Å²	142	76.9 Å²	76.9	66%	0.664	37%	0.374	S	S	*	.	S	Bend	trans	-136.3	168.3	-179.4	-62.8	-175.7	9.2	0	0	110.4	F189 P193	F189-Q191 VanDerWaalsContact C-N 3.26Å; F189-Q191 WeakPolarHBondContact CB-O 3.32Å; F189-Q191 PolarHBondContact O-N 2.87Å; Q191-P193 WeakPolarHBondContact O-CD 3.36Å
192	Y	89.5	Confident	83.6	Confident	49 Å²	49	72.6 Å²	72.6	19%	0.192	37%	0.37	C	S	.	.			trans	-59.1	120.7	177.9	178.1	-107.2	0	0	0	111	N61 F62 L65 G194 V195 S198	N61-Y192 HydrophobicContact CB-CD1 3.63Å; N61-Y192 HydrophobicContact CB-CD2 4.01Å; N61-Y192 HydrophobicContact CB-CE1 4.11Å; N61-Y192 HydrophobicContact CB-CE2 4.46Å; N61-Y192 HydrophobicContact CB-CG 3.57Å; F62-Y192 HydrophobicContact CD1-CE1 4.12Å; F62-Y192 AromaticContact CE1-CE1 3.82Å; F62-Y192 HydrophobicContact CE1-CE1 3.82Å; L65-Y192 HydrophobicContact CD1-CD1 4.15Å; Y192-G194 VanDerWaalsContact C-N 3.29Å; Y192-G194 PolarHBondContact O-N 2.9Å; Y192-G194 PolarHBondContact OH-O 3.38Å; Y192-V195 PolarHBondContact OH-N 3.32Å; Y192-S198 WeakPolarHBondContact CE2-OG 2.87Å; Y192-S198 PolarHBondContact OH-OG 2.84Å; Y192-S198 VanDerWaalsContact OH-OG 3.1Å
193	P	89.9	Confident	83.6	Confident	18 Å²	18	76.5 Å²	76.5	12%	0.117	39%	0.391	C	S	.	.			trans	-86.8	10.6	-170.6	34.9	-38.4	0	0	0	114.5	F110 F189 Q191 Y197	F110-P193 CarbonylContact C-O 3.34Å; F189-P193 HydrophobicContact CB-CB 4.35Å; F189-P193 HydrophobicContact CD1-CB 3.7Å; F189-P193 HydrophobicContact CD2-CB 4.06Å; F189-P193 HydrophobicContact CD2-CG 4.27Å; F189-P193 HydrophobicContact CE1-CB 3.93Å; F189-P193 HydrophobicContact CE2-CB 4.28Å; F189-P193 HydrophobicContact CG-CB 3.77Å; F189-P193 HydrophobicContact CG-CG 4.26Å; F189-P193 HydrophobicContact CZ-CB 4.23Å; Q191-P193 WeakPolarHBondContact O-CD 3.36Å; P193-Y197 HydrophobicContact CB-CD1 4.24Å; P193-Y197 HydrophobicContact CB-CG 4.01Å; P193-Y197 HydrophobicContact CG-CD1 3.13Å; P193-Y197 HydrophobicContact CG-CD2 4.17Å; P193-Y197 HydrophobicContact CG-CE1 3.7Å; P193-Y197 HydrophobicContact CG-CG 3.36Å
194	G	93.2	Very high	84	Confident	0 Å²	0	80.1 Å²	80.1	0%	0	41%	0.405	C	S	.	.			trans	98.8	169.6	177.6	0	0	0	0	0	115.3	V108 I109 Y192 S198	V108-G194 WeakPolarHBondContact O-CA 3.23Å; I109-G194 CarbonylContact O-C 3.58Å; Y192-G194 VanDerWaalsContact C-N 3.29Å; Y192-G194 PolarHBondContact O-N 2.9Å; Y192-G194 PolarHBondContact OH-O 3.38Å; G194-S198 PolarHBondContact O-N 3.47Å; G194-S198 PolarHBondContact O-OG 2.97Å
195	V	94.9	Very high	84.7	Confident	0 Å²	0	73.6 Å²	73.6	0%	0	38%	0.381	C	S	.	.	H	α-helix	trans	-65.5	-40.8	-176.3	172.4	0	0	0	0	111.8	E52 V53 F62 V108 I109 Y192 Y197 S198 L199 M217	E52-V195 HydrophobicContact CB-CG1 4.15Å; V53-V195 HydrophobicContact CG1-CG1 3.73Å; V53-V195 HydrophobicContact CG1-CG2 4.11Å; F62-V195 HydrophobicContact CE1-CG2 3.76Å; F62-V195 HydrophobicContact CZ-CG2 3.68Å; V108-V195 HydrophobicContact CG1-CG2 3.9Å; V108-V195 PolarHBondContact O-N 3.4Å; I109-V195 PolarHBondContact O-N 2.83Å; I109-V195 VanDerWaalsContact O-N 3.14Å; Y192-V195 PolarHBondContact OH-N 3.32Å; V195-Y197 VanDerWaalsContact C-N 3.32Å; V195-Y197 PolarHBondContact O-N 3.29Å; V195-S198 PolarHBondContact O-N 3.37Å; V195-S198 VanDerWaalsContact O-N 3.13Å; V195-L199 HydrophobicContact CG1-CD1 3.8Å; V195-L199 HydrophobicContact CG1-CG 4.18Å; V195-L199 WeakPolarHBondContact O-CG 2.91Å; V195-L199 PolarHBondContact O-N 2.95Å; V195-M217 HydrophobicContact CG1-CE 4.47Å
196	L	93.8	Very high	85.3	Confident	0 Å²	0	69.5 Å²	69.5	0%	0	37%	0.368	C	S	.	.	H	α-helix	trans	-62.1	-40.8	-178.2	177.4	54.6	0	0	0	111.4	I109 F110 T176 F179 S198 L199 L200 I210 I214	I109-L196 HydrophobicContact CG2-CB 4.17Å; I109-L196 WeakPolarHBondContact O-CB 3.39Å; I109-L196 PolarHBondContact O-N 2.98Å; F110-L196 HydrophobicContact CD1-CD2 3.77Å; F110-L196 HydrophobicContact CE1-CD2 3.63Å; T176-L196 HydrophobicContact CG2-CD1 4.19Å; T176-L196 HydrophobicContact CG2-CD2 3.96Å; F179-L196 HydrophobicContact CB-CD2 3.92Å; F179-L196 HydrophobicContact CD1-CB 4.25Å; F179-L196 HydrophobicContact CD1-CD2 3.33Å; F179-L196 HydrophobicContact CD1-CG 3.62Å; F179-L196 HydrophobicContact CE1-CB 4.11Å; F179-L196 HydrophobicContact CE1-CD2 4.05Å; F179-L196 HydrophobicContact CE1-CG 3.85Å; F179-L196 HydrophobicContact CG-CD2 3.77Å; F179-L196 HydrophobicContact CG-CG 4.47Å; L196-S198 VanDerWaalsContact C-N 3.33Å; L196-S198 PolarHBondContact O-N 3.13Å; L196-L199 PolarHBondContact O-N 3.12Å; L196-L200 HydrophobicContact CD1-CD1 3.83Å; L196-L200 HydrophobicContact CD1-CD2 4.47Å; L196-L200 HydrophobicContact CD1-CG 3.89Å; L196-L200 HydrophobicContact CG-CD1 3.86Å; L196-L200 HydrophobicContact CG-CG 4.39Å; L196-L200 WeakPolarHBondContact O-CB 3.39Å; L196-L200 VanDerWaalsContact O-CG 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.46Å; L196-L200 PolarHBondContact O-N 2.92Å; L196-I210 HydrophobicContact CD1-CG2 3.48Å; L196-I210 VanDerWaalsContact CD1-CG2 3.48Å; L196-I214 HydrophobicContact CB-CD1 4.48Å; L196-I214 HydrophobicContact CD1-CD1 4.49Å; L196-I214 HydrophobicContact CD1-CG1 4.04Å
197	Y	92.2	Very high	86.2	Confident	86 Å²	86	67.5 Å²	67.5	34%	0.337	36%	0.359	S	S	.	.	H	α-helix	trans	-57.1	-48	173.6	178.9	-102.1	0	0	0	112	L183 F189 P193 V195 L199 L200 G201	L183-Y197 HydrophobicContact CD1-CD2 3.2Å; L183-Y197 HydrophobicContact CD1-CE2 3.46Å; L183-Y197 VanDerWaalsContact CD1-CE2 3.46Å; L183-Y197 HydrophobicContact CD1-CG 4.4Å; L183-Y197 HydrophobicContact CD2-CD2 3.55Å; L183-Y197 HydrophobicContact CD2-CE2 3.88Å; L183-Y197 HydrophobicContact CG-CD2 3.89Å; L183-Y197 HydrophobicContact CG-CE2 4.01Å; F189-Y197 HydrophobicContact CD2-CE2 4.32Å; F189-Y197 HydrophobicContact CE2-CD2 4.21Å; F189-Y197 AromaticContact CE2-CE2 3.78Å; F189-Y197 HydrophobicContact CE2-CE2 3.78Å; P193-Y197 HydrophobicContact CB-CD1 4.24Å; P193-Y197 HydrophobicContact CB-CG 4.01Å; P193-Y197 HydrophobicContact CG-CD1 3.13Å; P193-Y197 HydrophobicContact CG-CD2 4.17Å; P193-Y197 HydrophobicContact CG-CE1 3.7Å; P193-Y197 HydrophobicContact CG-CG 3.36Å; V195-Y197 VanDerWaalsContact C-N 3.32Å; V195-Y197 PolarHBondContact O-N 3.29Å; Y197-L199 VanDerWaalsContact C-N 3.34Å; Y197-L199 PolarHBondContact O-N 2.68Å; Y197-L200 PolarHBondContact O-N 2.68Å; Y197-G201 PolarHBondContact O-N 2.84Å
198	S	91.5	Very high	87.3	Confident	23 Å²	23	64 Å²	64	16%	0.161	35%	0.351	C	S	.	.	H	α-helix	trans	-63.9	-41.4	-176.7	-51.2	0	0	0	0	111.2	E52 Y192 G194 V195 L196 G201 G202	E52-S198 WeakPolarHBondContact OE2-CB 3.45Å; Y192-S198 WeakPolarHBondContact CE2-OG 2.87Å; Y192-S198 PolarHBondContact OH-OG 2.84Å; Y192-S198 VanDerWaalsContact OH-OG 3.1Å; G194-S198 PolarHBondContact O-N 3.47Å; G194-S198 PolarHBondContact O-OG 2.97Å; V195-S198 PolarHBondContact O-N 3.37Å; V195-S198 VanDerWaalsContact O-N 3.13Å; L196-S198 VanDerWaalsContact C-N 3.33Å; L196-S198 PolarHBondContact O-N 3.13Å; S198-G201 PolarHBondContact O-N 3.18Å; S198-G202 PolarHBondContact O-N 3.12Å
199	L	92.1	Very high	88.1	Confident	6 Å²	6	58.5 Å²	58.5	3%	0.031	32%	0.321	C	S	.	.	H	α-helix	trans	-65	-42.4	175.5	-70.4	173.2	0	0	0	112.9	V48 L49 E52 V195 L196 Y197 I210 I214	V48-L199 HydrophobicContact CG1-CD2 4.02Å; L49-L199 HydrophobicContact CD2-CD1 4.04Å; L49-L199 HydrophobicContact CD2-CD2 4.18Å; E52-L199 HydrophobicContact CB-CD2 4.3Å; E52-L199 HydrophobicContact CG-CD2 3.67Å; E52-L199 HydrophobicContact CG-CG 4.14Å; V195-L199 HydrophobicContact CG1-CD1 3.8Å; V195-L199 HydrophobicContact CG1-CG 4.18Å; V195-L199 WeakPolarHBondContact O-CG 2.91Å; V195-L199 PolarHBondContact O-N 2.95Å; L196-L199 PolarHBondContact O-N 3.12Å; Y197-L199 VanDerWaalsContact C-N 3.34Å; Y197-L199 PolarHBondContact O-N 2.68Å; L199-I210 HydrophobicContact CB-CD1 4.19Å; L199-I210 HydrophobicContact CB-CG1 4.36Å; L199-I210 HydrophobicContact CB-CG2 4.22Å; L199-I210 HydrophobicContact CD1-CG2 4.3Å; L199-I214 HydrophobicContact CD1-CD1 4.3Å
200	L	90.7	Very high	88.8	Confident	30 Å²	30	55.4 Å²	55.4	16%	0.157	31%	0.307	C	S	.	.	H	α-helix	trans	-67.1	-41.2	177.6	-70.7	168.5	0	0	0	111.7	F179 Y180 L183 L196 Y197 F207 I210	F179-L200 HydrophobicContact CD1-CD1 4.34Å; F179-L200 HydrophobicContact CE1-CD1 4.39Å; Y180-L200 HydrophobicContact CD2-CD1 3.9Å; Y180-L200 HydrophobicContact CD2-CD2 3.97Å; Y180-L200 HydrophobicContact CE2-CD2 4.27Å; L183-L200 HydrophobicContact CD2-CD1 4.15Å; L196-L200 HydrophobicContact CD1-CD1 3.83Å; L196-L200 HydrophobicContact CD1-CD2 4.47Å; L196-L200 HydrophobicContact CD1-CG 3.89Å; L196-L200 HydrophobicContact CG-CD1 3.86Å; L196-L200 HydrophobicContact CG-CG 4.39Å; L196-L200 WeakPolarHBondContact O-CB 3.39Å; L196-L200 VanDerWaalsContact O-CG 3.24Å; L196-L200 WeakPolarHBondContact O-CG 3.46Å; L196-L200 PolarHBondContact O-N 2.92Å; Y197-L200 PolarHBondContact O-N 2.68Å; L200-F207 HydrophobicContact CD2-CD2 3.77Å; L200-F207 HydrophobicContact CD2-CE2 4.01Å; L200-I210 HydrophobicContact CD2-CD1 4.09Å
201	G	86.4	Confident	89.4	Confident	63 Å²	63	51 Å²	51	65%	0.649	27%	0.273	S	S	*	.	H	α-helix	trans	-68.5	-32.4	178.7	0	0	0	0	0	113.6	Y197 S198 N203	Y197-G201 PolarHBondContact O-N 2.84Å; S198-G201 PolarHBondContact O-N 3.18Å; G201-N203 VanDerWaalsContact C-N 3.35Å; G201-N203 PolarHBondContact O-N 2.96Å
202	G	81.7	Confident	89.8	Confident	40 Å²	40	44.4 Å²	44.4	41%	0.412	24%	0.243	S	C	.	.	H	α-helix	trans	-71.2	-24	-179.4	0	0	0	0	0	114.8	S198 K204	S198-G202 PolarHBondContact O-N 3.12Å; G202-K204 WeakPolarHBondContact O-CG 3.38Å; G202-K204 PolarHBondContact O-N 2.95Å
203	N	82.3	Confident	89.9	Confident	144 Å²	144	42.1 Å²	42.1	77%	0.77	23%	0.234	S	C	*	.			trans	49.2	27.4	-177.8	-162.4	31	0	0	0	114.9	G201	G201-N203 VanDerWaalsContact C-N 3.35Å; G201-N203 PolarHBondContact O-N 2.96Å
204	K	87.8	Confident	90.1	Very high	109 Å²	109	41.3 Å²	41.3	47%	0.474	23%	0.229	S	C	.	.			trans	-88.9	-15.1	-179.9	-61	-177.7	-172.1	165.7	0	113	V48 G202	V48-K204 HydrophobicContact CG1-CB 4.03Å; V48-K204 HydrophobicContact CG1-CD 4.45Å; V48-K204 HydrophobicContact CG2-CB 3.77Å; V48-K204 HydrophobicContact CG2-CD 4.25Å; G202-K204 WeakPolarHBondContact O-CG 3.38Å; G202-K204 PolarHBondContact O-N 2.95Å
205	L	89.3	Confident	90.1	Very high	8 Å²	8	41.6 Å²	41.6	4%	0.042	23%	0.231	C	C	.	.	S	Bend	trans	-126.9	141.2	179.9	-67.9	177.4	0	0	0	110.8	D45 V48 N209 I210	D45-L205 WeakPolarHBondContact OD1-CD2 3.48Å; V48-L205 HydrophobicContact CB-CD1 3.93Å; V48-L205 HydrophobicContact CB-CD2 4.36Å; V48-L205 HydrophobicContact CB-CG 4.01Å; V48-L205 HydrophobicContact CG1-CD1 3.8Å; V48-L205 HydrophobicContact CG1-CG 3.9Å; V48-L205 HydrophobicContact CG2-CD2 4.19Å; V48-L205 HydrophobicContact CG2-CG 4.15Å; L205-N209 HydrophobicContact CB-CB 4.43Å; L205-I210 HydrophobicContact CB-CD1 4.32Å; L205-I210 HydrophobicContact CB-CG1 3.82Å
206	P	90.8	Very high	89.9	Confident	69 Å²	69	42.9 Å²	42.9	45%	0.448	24%	0.237	S	C	.	.			trans	-57.4	144.2	168.3	-20.8	31.5	0	0	0	110.8	K208 N209 I210	P206-K208 PolarHBondContact O-N 3.24Å; P206-K208 VanDerWaalsContact O-N 3.16Å; P206-N209 WeakPolarHBondContact O-CA 3.3Å; P206-N209 WeakPolarHBondContact O-CB 3.45Å; P206-N209 PolarHBondContact O-N 2.83Å; P206-I210 PolarHBondContact O-N 3.06Å; P206-I210 VanDerWaalsContact O-N 3.09Å
207	F	89.2	Confident	89.9	Confident	60 Å²	60	45 Å²	45	26%	0.263	25%	0.247	S	C	.	.	H	α-helix	trans	-51.6	-42.2	179.4	-179.3	-104.3	0	0	0	112.9	T176 Y180 L200 N209 I210 Q211	T176-F207 HydrophobicContact CG2-CE2 4.36Å; T176-F207 HydrophobicContact CG2-CZ 4.3Å; Y180-F207 HydrophobicContact CD2-CE2 4.14Å; Y180-F207 HydrophobicContact CG-CE2 4.17Å; L200-F207 HydrophobicContact CD2-CD2 3.77Å; L200-F207 HydrophobicContact CD2-CE2 4.01Å; F207-N209 VanDerWaalsContact C-N 3.27Å; F207-N209 PolarHBondContact O-N 3.4Å; F207-I210 WeakPolarHBondContact O-CB 3.31Å; F207-I210 PolarHBondContact O-N 3.44Å; F207-I210 VanDerWaalsContact O-N 3.09Å; F207-Q211 HydrophobicContact CD1-CG 4.01Å; F207-Q211 HydrophobicContact CE1-CG 3.68Å; F207-Q211 VanDerWaalsContact CE1-OE1 3.31Å; F207-Q211 HydrophobicContact CE2-CG 4.33Å; F207-Q211 HydrophobicContact CG-CG 4.49Å; F207-Q211 HydrophobicContact CZ-CG 3.85Å; F207-Q211 WeakPolarHBondContact O-CG 3.14Å; F207-Q211 PolarHBondContact O-N 3.38Å
208	K	88.6	Confident	90	Very high	154 Å²	154	41 Å²	41	67%	0.67	23%	0.231	S	C	*	.	H	α-helix	trans	-59.5	-34.1	175.5	-69.2	-171.9	176.9	-176.8	0	113.7	P206 A212	P206-K208 PolarHBondContact O-N 3.24Å; P206-K208 VanDerWaalsContact O-N 3.16Å; K208-A212 WeakPolarHBondContact O-CB 3.31Å; K208-A212 PolarHBondContact O-N 3.08Å; K208-A212 VanDerWaalsContact O-N 3.07Å
209	N	89.9	Confident	90.1	Very high	35 Å²	35	40.1 Å²	40.1	19%	0.187	23%	0.226	C	C	.	.	H	α-helix	trans	-72.2	-41.7	175.7	-69.6	17.4	0	0	0	110.1	R37 D45 L205 P206 F207 Q211 A212 N213	R37-N209 PolarHBondContact NH1-ND2 2.95Å; D45-N209 PolarHBondContact OD1-ND2 3.4Å; D45-N209 VanDerWaalsContact OD1-ND2 3.16Å; L205-N209 HydrophobicContact CB-CB 4.43Å; P206-N209 WeakPolarHBondContact O-CA 3.3Å; P206-N209 WeakPolarHBondContact O-CB 3.45Å; P206-N209 PolarHBondContact O-N 2.83Å; F207-N209 VanDerWaalsContact C-N 3.27Å; F207-N209 PolarHBondContact O-N 3.4Å; N209-Q211 VanDerWaalsContact C-N 3.34Å; N209-Q211 PolarHBondContact O-N 3.21Å; N209-A212 PolarHBondContact O-N 3.18Å; N209-N213 PolarHBondContact O-N 3.26Å; N209-N213 PolarHBondContact O-ND2 3.34Å
210	I	91.4	Very high	90.1	Very high	4 Å²	4	41.3 Å²	41.3	2%	0.021	24%	0.24	C	C	.	.	H	α-helix	trans	-57.4	-50.8	174.6	-63	172.7	0	0	0	109.6	L196 L199 L200 L205 P206 F207 A212 N213 I214	L196-I210 HydrophobicContact CD1-CG2 3.48Å; L196-I210 VanDerWaalsContact CD1-CG2 3.48Å; L199-I210 HydrophobicContact CB-CD1 4.19Å; L199-I210 HydrophobicContact CB-CG1 4.36Å; L199-I210 HydrophobicContact CB-CG2 4.22Å; L199-I210 HydrophobicContact CD1-CG2 4.3Å; L200-I210 HydrophobicContact CD2-CD1 4.09Å; L205-I210 HydrophobicContact CB-CD1 4.32Å; L205-I210 HydrophobicContact CB-CG1 3.82Å; P206-I210 PolarHBondContact O-N 3.06Å; P206-I210 VanDerWaalsContact O-N 3.09Å; F207-I210 WeakPolarHBondContact O-CB 3.31Å; F207-I210 PolarHBondContact O-N 3.44Å; F207-I210 VanDerWaalsContact O-N 3.09Å; I210-A212 VanDerWaalsContact C-N 3.33Å; I210-A212 PolarHBondContact O-N 2.86Å; I210-N213 PolarHBondContact O-N 3.21Å; I210-I214 HydrophobicContact CG2-CG1 4.24Å; I210-I214 WeakPolarHBondContact O-CG1 3.42Å; I210-I214 PolarHBondContact O-N 2.92Å
211	Q	90.3	Very high	90.2	Very high	30 Å²	30	40.4 Å²	40.4	14%	0.14	24%	0.237	C	C	.	.	H	α-helix	trans	-55.5	-45.5	177.4	-69.2	-175.9	-61.5	0	0	112.8	D173 T176 Q177 F207 N209 N213 I214 T215	D173-Q211 PolarHBondContact OD1-NE2 2.7Å; T176-Q211 HydrophobicContact CG2-CG 3.79Å; Q177-Q211 VanDerWaalsContact NE2-NE2 3.18Å; F207-Q211 HydrophobicContact CD1-CG 4.01Å; F207-Q211 HydrophobicContact CE1-CG 3.68Å; F207-Q211 VanDerWaalsContact CE1-OE1 3.31Å; F207-Q211 HydrophobicContact CE2-CG 4.33Å; F207-Q211 HydrophobicContact CG-CG 4.49Å; F207-Q211 HydrophobicContact CZ-CG 3.85Å; F207-Q211 WeakPolarHBondContact O-CG 3.14Å; F207-Q211 PolarHBondContact O-N 3.38Å; N209-Q211 VanDerWaalsContact C-N 3.34Å; N209-Q211 PolarHBondContact O-N 3.21Å; Q211-N213 PolarHBondContact O-N 3.04Å; Q211-I214 PolarHBondContact O-N 3.06Å; Q211-T215 PolarHBondContact O-N 3.36Å; Q211-T215 PolarHBondContact O-OG1 2.98Å
212	A	89.8	Confident	90.6	Very high	4 Å²	4	37.4 Å²	37.4	3%	0.033	21%	0.206	C	C	.	.	H	α-helix	trans	-59.7	-48.1	177.9	0	0	0	0	0	111.9	C31 K208 N209 I210 I214 T215 E216	C31-A212 HydrophobicContact CB-CB 4.44Å; K208-A212 WeakPolarHBondContact O-CB 3.31Å; K208-A212 PolarHBondContact O-N 3.08Å; K208-A212 VanDerWaalsContact O-N 3.07Å; N209-A212 PolarHBondContact O-N 3.18Å; I210-A212 VanDerWaalsContact C-N 3.33Å; I210-A212 PolarHBondContact O-N 2.86Å; A212-I214 PolarHBondContact O-N 3.43Å; A212-T215 PolarHBondContact O-N 3.36Å; A212-E216 WeakPolarHBondContact O-CG 3.39Å; A212-E216 PolarHBondContact O-N 3.02Å
213	N	92	Very high	91.1	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.011	19%	0.192	C	C	.	.	H	α-helix	trans	-66.6	-37.7	-179.8	-69.2	-57	0	0	0	112.1	E34 D45 L49 N209 I210 Q211 E216 M217	E34-N213 WeakPolarHBondContact CB-OD1 3.49Å; E34-N213 PolarHBondContact OE2-OD1 3.31Å; D45-N213 PolarHBondContact OD2-ND2 3.49Å; L49-N213 HydrophobicContact CD1-CB 4.09Å; L49-N213 WeakPolarHBondContact CD1-OD1 3.24Å; L49-N213 HydrophobicContact CD2-CB 3.97Å; N209-N213 PolarHBondContact O-N 3.26Å; N209-N213 PolarHBondContact O-ND2 3.34Å; I210-N213 PolarHBondContact O-N 3.21Å; Q211-N213 PolarHBondContact O-N 3.04Å; N213-E216 PolarHBondContact O-N 3.49Å; N213-M217 WeakPolarHBondContact O-CB 3.26Å; N213-M217 VanDerWaalsContact O-CG 3.25Å; N213-M217 WeakPolarHBondContact O-CG 3.13Å; N213-M217 PolarHBondContact O-N 3.17Å
214	I	93.7	Very high	91.6	Very high	0 Å²	0	33.1 Å²	33.1	0%	0	18%	0.177	C	C	.	.	H	α-helix	trans	-62.6	-45.5	174.1	-68.5	-45.9	0	0	0	111.3	I109 F110 L196 L199 I210 Q211 A212 E216 M217 L218	I109-I214 HydrophobicContact CG2-CD1 3.74Å; I109-I214 HydrophobicContact CG2-CG1 4.43Å; I109-I214 HydrophobicContact CG2-CG2 3.99Å; F110-I214 HydrophobicContact CE1-CG2 4.41Å; F110-I214 HydrophobicContact CZ-CG2 4.11Å; L196-I214 HydrophobicContact CB-CD1 4.48Å; L196-I214 HydrophobicContact CD1-CD1 4.49Å; L196-I214 HydrophobicContact CD1-CG1 4.04Å; L199-I214 HydrophobicContact CD1-CD1 4.3Å; I210-I214 HydrophobicContact CG2-CG1 4.24Å; I210-I214 WeakPolarHBondContact O-CG1 3.42Å; I210-I214 PolarHBondContact O-N 2.92Å; Q211-I214 PolarHBondContact O-N 3.06Å; A212-I214 PolarHBondContact O-N 3.43Å; I214-E216 VanDerWaalsContact C-N 3.29Å; I214-E216 PolarHBondContact O-N 3.3Å; I214-M217 HydrophobicContact CD1-SD 4.33Å; I214-M217 PolarHBondContact O-N 3.13Å; I214-L218 HydrophobicContact CG2-CD1 3.93Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.39Å; I214-L218 WeakPolarHBondContact O-CG 3.38Å; I214-L218 PolarHBondContact O-N 2.98Å
215	T	93.1	Very high	92.1	Very high	7 Å²	7	31 Å²	31	4%	0.043	17%	0.173	C	C	.	.	H	α-helix	trans	-57.2	-44.3	175.5	-58.6	0	0	0	0	111.4	I168 F169 A172 Q211 A212 A219	I168-T215 HydrophobicContact CG2-CG2 3.81Å; F169-T215 HydrophobicContact CD1-CG2 3.89Å; F169-T215 HydrophobicContact CE1-CG2 4Å; F169-T215 HydrophobicContact CG-CG2 4.47Å; A172-T215 HydrophobicContact CB-CG2 3.8Å; A172-T215 WeakPolarHBondContact CB-OG1 3.27Å; Q211-T215 PolarHBondContact O-N 3.36Å; Q211-T215 PolarHBondContact O-OG1 2.98Å; A212-T215 PolarHBondContact O-N 3.36Å; T215-A219 WeakPolarHBondContact O-CB 3.48Å; T215-A219 PolarHBondContact O-N 3.13Å
216	E	91.4	Very high	92.5	Very high	27 Å²	27	30.6 Å²	30.6	13%	0.126	17%	0.171	C	C	.	.	H	α-helix	trans	-65.6	-42.6	178	-72.1	171.7	-134.3	0	0	112.6	T33 E34 W35 A212 N213 I214 G220	T33-E216 VanDerWaalsContact C-OE1 3.31Å; T33-E216 WeakPolarHBondContact CA-OE1 3.09Å; T33-E216 VanDerWaalsContact CB-CD 3.47Å; T33-E216 WeakPolarHBondContact CB-OE1 3.37Å; T33-E216 HydrophobicContact CG2-CG 4.08Å; T33-E216 VanDerWaalsContact CG2-OE1 3.23Å; T33-E216 WeakPolarHBondContact CG2-OE1 3.3Å; E34-E216 PolarHBondContact N-OE1 3.12Å; E34-E216 PolarHBondContact N-OE2 3.47Å; W35-E216 PolarHBondContact NE1-OE2 2.81Å; A212-E216 WeakPolarHBondContact O-CG 3.39Å; A212-E216 PolarHBondContact O-N 3.02Å; N213-E216 PolarHBondContact O-N 3.49Å; I214-E216 VanDerWaalsContact C-N 3.29Å; I214-E216 PolarHBondContact O-N 3.3Å; E216-G220 PolarHBondContact O-N 3.02Å
217	M	94.6	Very high	92.7	Very high	45 Å²	45	30.1 Å²	30.1	22%	0.222	16%	0.164	C	C	.	.	H	α-helix	trans	-64	-44.2	177	-72.2	175.3	64.6	0	0	111.6	V53 I109 V195 N213 I214 G221	V53-M217 HydrophobicContact CG1-CE 3.62Å; V53-M217 HydrophobicContact CG1-SD 4.22Å; I109-M217 HydrophobicContact CD1-CB 3.77Å; I109-M217 HydrophobicContact CD1-CE 4.19Å; I109-M217 HydrophobicContact CG1-CE 3.97Å; V195-M217 HydrophobicContact CG1-CE 4.47Å; N213-M217 WeakPolarHBondContact O-CB 3.26Å; N213-M217 VanDerWaalsContact O-CG 3.25Å; N213-M217 WeakPolarHBondContact O-CG 3.13Å; N213-M217 PolarHBondContact O-N 3.17Å; I214-M217 HydrophobicContact CD1-SD 4.33Å; I214-M217 PolarHBondContact O-N 3.13Å; M217-G221 PolarHBondContact O-N 3.01Å
218	L	94.4	Very high	93.1	Very high	0 Å²	0	29.1 Å²	29.1	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-61.5	-51.5	176.4	-73.7	171.7	0	0	0	111.2	I105 I109 F110 F128 A172 Y175 I214 G220 G221 V222	I105-L218 HydrophobicContact CG2-CD2 4.19Å; I109-L218 HydrophobicContact CD1-CD2 3.71Å; I109-L218 HydrophobicContact CD1-CG 3.78Å; F110-L218 HydrophobicContact CE2-CD1 4.11Å; F110-L218 HydrophobicContact CE2-CD2 4.01Å; F110-L218 HydrophobicContact CZ-CD1 4Å; F128-L218 HydrophobicContact CE1-CB 4.25Å; F128-L218 HydrophobicContact CZ-CB 3.79Å; A172-L218 HydrophobicContact CB-CD1 4.09Å; Y175-L218 HydrophobicContact CD2-CD1 4.48Å; I214-L218 HydrophobicContact CG2-CD1 3.93Å; I214-L218 HydrophobicContact CG2-CG 4.32Å; I214-L218 WeakPolarHBondContact O-CB 3.39Å; I214-L218 WeakPolarHBondContact O-CG 3.38Å; I214-L218 PolarHBondContact O-N 2.98Å; L218-G220 PolarHBondContact O-N 3.16Å; L218-G221 PolarHBondContact O-N 3.46Å; L218-V222 WeakPolarHBondContact O-CG2 3.2Å
219	A	91.9	Very high	93.6	Very high	5 Å²	5	24.6 Å²	24.6	4%	0.041	15%	0.145	C	C	.	.	H	α-helix	trans	-64.1	-40.5	-179.6	0	0	0	0	0	112.3	V132 I168 T215	V132-A219 WeakPolarHBondContact CG1-O 3.39Å; V132-A219 HydrophobicContact CG2-CB 4.28Å; I168-A219 HydrophobicContact CG2-CB 4.15Å; T215-A219 WeakPolarHBondContact O-CB 3.48Å; T215-A219 PolarHBondContact O-N 3.13Å
220	G	92.6	Very high	94	Very high	32 Å²	32	26 Å²	26	33%	0.33	15%	0.151	S	C	.	.	H	α-helix	trans	-72.1	-25.9	179.8	0	0	0	0	0	114.3	E216 L218 T224	E216-G220 PolarHBondContact O-N 3.02Å; L218-G220 PolarHBondContact O-N 3.16Å; G220-T224 VanDerWaalsContact O-CG2 3.31Å; G220-T224 WeakPolarHBondContact O-CG2 3.48Å; G220-T224 PolarHBondContact O-OG1 2.85Å
221	G	94.1	Very high	94.3	Very high	10 Å²	10	32.6 Å²	32.6	10%	0.103	18%	0.176	C	C	.	.	H	α-helix	trans	-82.9	-16.9	-175	0	0	0	0	0	115.6	M217 L218 T225	M217-G221 PolarHBondContact O-N 3.01Å; L218-G221 PolarHBondContact O-N 3.46Å; G221-T225 PolarHBondContact O-OG1 3.29Å
222	V	93.8	Very high	94.7	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.174	C	C	.	.	H	α-helix	trans	-79.2	-62.5	-173.9	178.3	0	0	0	0	111.8	F98 S101 F102 F128 I129 V132 L218 S226	F98-V222 HydrophobicContact CB-CG1 4.43Å; F98-V222 HydrophobicContact CD1-CG1 4.09Å; S101-V222 WeakPolarHBondContact CB-O 3.33Å; F102-V222 HydrophobicContact CB-CG2 3.96Å; F102-V222 HydrophobicContact CD2-CG2 3.92Å; F102-V222 HydrophobicContact CG-CG2 4.45Å; F128-V222 HydrophobicContact CE1-CG2 4.36Å; I129-V222 HydrophobicContact CG1-CG1 4.44Å; I129-V222 HydrophobicContact CG2-CG1 4.09Å; V132-V222 HydrophobicContact CG1-CB 4.33Å; L218-V222 WeakPolarHBondContact O-CG2 3.2Å; V222-S226 WeakPolarHBondContact O-CB 3.35Å; V222-S226 PolarHBondContact O-OG 3.03Å; V222-S226 VanDerWaalsContact O-OG 3.06Å
223	D	91.7	Very high	95.1	Very high	19 Å²	19	35.6 Å²	35.6	10%	0.102	19%	0.191	C	C	.	.	H	α-helix	trans	-77.9	-32.3	-170.9	-75.5	21.8	0	0	0	113.3	F98 Y133 F136 S226 M227	F98-D223 HydrophobicContact CE1-CB 4.2Å; F98-D223 WeakPolarHBondContact CE1-OD1 3.41Å; Y133-D223 WeakPolarHBondContact CA-OD2 3.3Å; F136-D223 HydrophobicContact CD2-CB 4.19Å; F136-D223 WeakPolarHBondContact CD2-OD2 3.38Å; F136-D223 HydrophobicContact CE2-CB 4.08Å; D223-S226 PolarHBondContact O-OG 3.16Å; D223-S226 VanDerWaalsContact O-OG 3.07Å; D223-M227 WeakPolarHBondContact O-CB 3.43Å; D223-M227 WeakPolarHBondContact O-CG 3.26Å; D223-M227 PolarHBondContact O-N 3.09Å
224	T	94.3	Very high	95.4	Very high	76 Å²	76	40.7 Å²	40.7	47%	0.466	21%	0.211	S	C	.	.	H	α-helix	trans	-65.7	-53.9	-175.3	54.6	0	0	0	0	111.4	G220 T228	G220-T224 VanDerWaalsContact O-CG2 3.31Å; G220-T224 WeakPolarHBondContact O-CG2 3.48Å; G220-T224 PolarHBondContact O-OG1 2.85Å; T224-T228 PolarHBondContact O-N 3.49Å; T224-T228 PolarHBondContact O-OG1 3.3Å; T224-T228 VanDerWaalsContact O-OG1 3.07Å
225	T	97.1	Very high	95.6	Very high	63 Å²	63	44.6 Å²	44.6	39%	0.387	23%	0.229	S	C	.	.	H	α-helix	trans	-67.8	-40.7	-177.8	-49.1	0	0	0	0	111.7	G221 M227 T228 L229	G221-T225 PolarHBondContact O-OG1 3.29Å; T225-M227 PolarHBondContact O-N 2.98Å; T225-T228 PolarHBondContact O-N 3.27Å; T225-L229 HydrophobicContact CG2-CD1 3.98Å; T225-L229 HydrophobicContact CG2-CG 4.39Å; T225-L229 WeakPolarHBondContact O-CB 3.5Å; T225-L229 WeakPolarHBondContact O-CG 3.26Å; T225-L229 PolarHBondContact O-N 3.49Å
226	S	97.1	Very high	95.9	Very high	0 Å²	0	45.7 Å²	45.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-63.1	-45.5	-177.2	63.9	0	0	0	0	111.7	L97 F98 S101 V222 D223 L229 Q230	L97-S226 WeakPolarHBondContact O-CB 3.45Å; F98-S226 WeakPolarHBondContact CD1-OG 3.36Å; F98-S226 WeakPolarHBondContact CE1-OG 3.3Å; S101-S226 WeakPolarHBondContact OG-CA 3.38Å; S101-S226 WeakPolarHBondContact OG-CB 3.49Å; S101-S226 PolarHBondContact OG-N 2.89Å; S101-S226 VanDerWaalsContact OG-N 3.13Å; V222-S226 WeakPolarHBondContact O-CB 3.35Å; V222-S226 PolarHBondContact O-OG 3.03Å; V222-S226 VanDerWaalsContact O-OG 3.06Å; D223-S226 PolarHBondContact O-OG 3.16Å; D223-S226 VanDerWaalsContact O-OG 3.07Å; S226-L229 PolarHBondContact O-N 2.88Å; S226-Q230 WeakPolarHBondContact O-CB 3.43Å; S226-Q230 PolarHBondContact O-N 3.09Å
227	M	96.2	Very high	96.1	Very high	60 Å²	60	47.3 Å²	47.3	30%	0.296	25%	0.252	S	S	.	.	H	α-helix	trans	-69.5	-43	-179.9	-65.2	-61.9	92.7	0	0	111.8	F98 D223 T225 L229 Q230 W231	F98-M227 HydrophobicContact CE1-CE 3.82Å; F98-M227 HydrophobicContact CE2-CE 3.84Å; F98-M227 HydrophobicContact CZ-CE 3.35Å; F98-M227 HydrophobicContact CZ-SD 4.16Å; D223-M227 WeakPolarHBondContact O-CB 3.43Å; D223-M227 WeakPolarHBondContact O-CG 3.26Å; D223-M227 PolarHBondContact O-N 3.09Å; T225-M227 PolarHBondContact O-N 2.98Å; M227-L229 VanDerWaalsContact C-N 3.32Å; M227-L229 PolarHBondContact O-N 2.88Å; M227-Q230 VanDerWaalsContact CE-OE1 3.26Å; M227-Q230 WeakPolarHBondContact O-CB 3.46Å; M227-Q230 PolarHBondContact O-N 3Å; M227-W231 VanDerWaalsContact O-CD1 3.26Å; M227-W231 PolarHBondContact O-N 3.01Å
228	T	98	Very high	96.3	Very high	38 Å²	38	50.7 Å²	50.7	23%	0.233	27%	0.267	C	S	.	.	H	α-helix	trans	-61.3	-41.6	175.8	-58.7	0	0	0	0	111.5	T224 T225 W231 N232 T278 L279	T224-T228 PolarHBondContact O-N 3.49Å; T224-T228 PolarHBondContact O-OG1 3.3Å; T224-T228 VanDerWaalsContact O-OG1 3.07Å; T225-T228 PolarHBondContact O-N 3.27Å; T228-W231 PolarHBondContact O-N 3.07Å; T228-N232 WeakPolarHBondContact O-CB 3.36Å; T228-N232 PolarHBondContact O-N 3.34Å; T228-T278 HydrophobicContact CG2-CG2 4.06Å; T228-L279 HydrophobicContact CG2-CD2 3.73Å; T228-L279 HydrophobicContact CG2-CG 3.98Å
229	L	98.2	Very high	96.4	Very high	60 Å²	60	54.4 Å²	54.4	31%	0.314	29%	0.287	S	S	.	.	H	α-helix	trans	-64.8	-39.7	175.2	-74.8	173.9	0	0	0	112.2	L97 F100 T225 S226 M227 W231 N232 L233	L97-L229 HydrophobicContact CD2-CB 4.31Å; F100-L229 HydrophobicContact CD1-CD1 3.85Å; F100-L229 HydrophobicContact CE1-CD1 3.47Å; F100-L229 VanDerWaalsContact CE1-CD1 3.47Å; T225-L229 HydrophobicContact CG2-CD1 3.98Å; T225-L229 HydrophobicContact CG2-CG 4.39Å; T225-L229 WeakPolarHBondContact O-CB 3.5Å; T225-L229 WeakPolarHBondContact O-CG 3.26Å; T225-L229 PolarHBondContact O-N 3.49Å; S226-L229 PolarHBondContact O-N 2.88Å; M227-L229 VanDerWaalsContact C-N 3.32Å; M227-L229 PolarHBondContact O-N 2.88Å; L229-W231 VanDerWaalsContact C-N 3.35Å; L229-W231 PolarHBondContact O-N 2.73Å; L229-N232 PolarHBondContact O-N 3.48Å; L229-L233 WeakPolarHBondContact O-CB 3.24Å; L229-L233 VanDerWaalsContact O-CG 3.29Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 2.86Å
230	Q	98.3	Very high	96.8	Very high	65 Å²	65	58.8 Å²	58.8	30%	0.304	31%	0.31	S	S	.	.	H	α-helix	trans	-60.2	-45.5	176.4	-169.6	171	19.3	0	0	111.6	L97 S226 M227 L233 Y234	L97-Q230 HydrophobicContact CD1-CB 3.69Å; L97-Q230 HydrophobicContact CD1-CG 4.14Å; S226-Q230 WeakPolarHBondContact O-CB 3.43Å; S226-Q230 PolarHBondContact O-N 3.09Å; M227-Q230 VanDerWaalsContact CE-OE1 3.26Å; M227-Q230 WeakPolarHBondContact O-CB 3.46Å; M227-Q230 PolarHBondContact O-N 3Å; Q230-L233 PolarHBondContact O-N 2.98Å; Q230-Y234 WeakPolarHBondContact O-CB 3.49Å; Q230-Y234 PolarHBondContact O-N 3.28Å
231	W	98.4	Very high	97	Very high	142 Å²	142	65.4 Å²	65.4	54%	0.538	33%	0.329	S	S	.	.	H	α-helix	trans	-65.3	-41.1	175.4	-79.7	110.6	0	0	0	112.4	M227 T228 L229 L233 Y234 E235 T278	M227-W231 VanDerWaalsContact O-CD1 3.26Å; M227-W231 PolarHBondContact O-N 3.01Å; T228-W231 PolarHBondContact O-N 3.07Å; L229-W231 VanDerWaalsContact C-N 3.35Å; L229-W231 PolarHBondContact O-N 2.73Å; W231-L233 VanDerWaalsContact C-N 3.32Å; W231-L233 PolarHBondContact O-N 3.36Å; W231-Y234 AromaticContact CE3-CD1 3.78Å; W231-Y234 HydrophobicContact CE3-CD1 3.78Å; W231-Y234 HydrophobicContact CE3-CE1 4.36Å; W231-Y234 HydrophobicContact CE3-CG 4.28Å; W231-Y234 AromaticContact CZ3-CD1 3.78Å; W231-Y234 HydrophobicContact CZ3-CD1 3.78Å; W231-Y234 AromaticContact CZ3-CE1 3.92Å; W231-Y234 HydrophobicContact CZ3-CE1 3.92Å; W231-Y234 HydrophobicContact CZ3-CG 4.37Å; W231-Y234 WeakPolarHBondContact O-CB 3.4Å; W231-Y234 PolarHBondContact O-N 3Å; W231-Y234 VanDerWaalsContact O-N 3.16Å; W231-E235 WeakPolarHBondContact O-CG 3.42Å; W231-E235 PolarHBondContact O-N 2.9Å; W231-T278 HydrophobicContact CB-CG2 3.8Å
232	N	98.4	Very high	97.2	Very high	18 Å²	18	67.9 Å²	67.9	10%	0.096	34%	0.343	C	S	.	.	H	α-helix	trans	-60.5	-43.2	176.4	-169.8	-102.9	0	0	0	111.8	T228 L229 E235 M236 T278	T228-N232 WeakPolarHBondContact O-CB 3.36Å; T228-N232 PolarHBondContact O-N 3.34Å; L229-N232 PolarHBondContact O-N 3.48Å; N232-E235 PolarHBondContact O-N 3.45Å; N232-M236 WeakPolarHBondContact O-CB 3.05Å; N232-M236 WeakPolarHBondContact O-CG 3.16Å; N232-M236 PolarHBondContact O-N 3.07Å; N232-M236 VanDerWaalsContact OD1-CE 3.29Å; N232-M236 WeakPolarHBondContact OD1-CE 3.44Å; N232-T278 HydrophobicContact CB-CG2 4.03Å; N232-T278 PolarHBondContact ND2-OG1 3.35Å
233	L	98.1	Very high	97.5	Very high	78 Å²	78	70.4 Å²	70.4	41%	0.408	35%	0.354	S	S	.	.	H	α-helix	trans	-63.7	-41.7	174.7	-70.2	170.3	0	0	0	111.9	I93 L229 Q230 W231 M236 A237	I93-L233 HydrophobicContact CD1-CD1 3.93Å; L229-L233 WeakPolarHBondContact O-CB 3.24Å; L229-L233 VanDerWaalsContact O-CG 3.29Å; L229-L233 WeakPolarHBondContact O-CG 3.49Å; L229-L233 PolarHBondContact O-N 2.86Å; Q230-L233 PolarHBondContact O-N 2.98Å; W231-L233 VanDerWaalsContact C-N 3.32Å; W231-L233 PolarHBondContact O-N 3.36Å; L233-M236 HydrophobicContact CD2-CE 3.84Å; L233-A237 WeakPolarHBondContact O-CB 3.44Å; L233-A237 PolarHBondContact O-N 3.13Å
234	Y	98.2	Very high	97.8	Very high	109 Å²	109	73.7 Å²	73.7	43%	0.427	37%	0.369	S	S	.	.	H	α-helix	trans	-60.5	-49.4	175.9	172.9	-90.9	0	0	0	111.8	Q230 W231 M236 A237 H238	Q230-Y234 WeakPolarHBondContact O-CB 3.49Å; Q230-Y234 PolarHBondContact O-N 3.28Å; W231-Y234 AromaticContact CE3-CD1 3.78Å; W231-Y234 HydrophobicContact CE3-CD1 3.78Å; W231-Y234 HydrophobicContact CE3-CE1 4.36Å; W231-Y234 HydrophobicContact CE3-CG 4.28Å; W231-Y234 AromaticContact CZ3-CD1 3.78Å; W231-Y234 HydrophobicContact CZ3-CD1 3.78Å; W231-Y234 AromaticContact CZ3-CE1 3.92Å; W231-Y234 HydrophobicContact CZ3-CE1 3.92Å; W231-Y234 HydrophobicContact CZ3-CG 4.37Å; W231-Y234 WeakPolarHBondContact O-CB 3.4Å; W231-Y234 PolarHBondContact O-N 3Å; W231-Y234 VanDerWaalsContact O-N 3.16Å; Y234-M236 PolarHBondContact O-N 3.3Å; Y234-A237 WeakPolarHBondContact O-CB 3.38Å; Y234-A237 PolarHBondContact O-N 3.05Å; Y234-A237 VanDerWaalsContact O-N 3.16Å; Y234-H238 AromaticContact CD2-CE1 3.52Å; Y234-H238 AromaticContact CD2-ND1 3.81Å; Y234-H238 AromaticContact CE1-CE1 3.96Å; Y234-H238 AromaticContact CE1-ND1 3.82Å; Y234-H238 AromaticContact CE2-CE1 3.01Å; Y234-H238 WeakPolarHBondContact CE2-CE1 3.27Å; Y234-H238 AromaticContact CE2-ND1 3.61Å; Y234-H238 AromaticContact CE2-NE2 3.71Å; Y234-H238 AromaticContact CZ-CE1 3.25Å; Y234-H238 AromaticContact CZ-ND1 3.59Å; Y234-H238 AromaticContact CZ-NE2 3.63Å; Y234-H238 PolarHBondContact O-N 2.85Å; Y234-H238 VanDerWaalsContact O-N 3.07Å; Y234-H238 PolarHBondContact O-ND1 3.38Å; Y234-H238 PolarHBondContact OH-NE2 3.31Å
235	E	98.3	Very high	98	Very high	82 Å²	82	74.6 Å²	74.6	38%	0.383	37%	0.369	S	S	.	.	H	α-helix	trans	-64.3	-40.3	-179.8	-72.5	-56.1	149	0	0	112.1	W231 N232 A237 H238 N239	W231-E235 WeakPolarHBondContact O-CG 3.42Å; W231-E235 PolarHBondContact O-N 2.9Å; N232-E235 PolarHBondContact O-N 3.45Å; E235-A237 VanDerWaalsContact C-N 3.33Å; E235-A237 PolarHBondContact O-N 3.28Å; E235-H238 PolarHBondContact O-N 3.37Å; E235-N239 WeakPolarHBondContact O-CB 3.28Å; E235-N239 PolarHBondContact O-N 3.15Å; E235-N239 PolarHBondContact O-ND2 2.91Å; E235-N239 PolarHBondContact OE2-ND2 3.39Å
236	M	98.3	Very high	98.1	Very high	30 Å²	30	71.9 Å²	71.9	15%	0.148	35%	0.352	C	S	.	.	H	α-helix	trans	-62.6	-39.8	173.5	-75.9	-169.3	-65.9	0	0	112.1	N232 L233 Y234 H238 N239 Q243 L246	N232-M236 WeakPolarHBondContact O-CB 3.05Å; N232-M236 WeakPolarHBondContact O-CG 3.16Å; N232-M236 PolarHBondContact O-N 3.07Å; N232-M236 VanDerWaalsContact OD1-CE 3.29Å; N232-M236 WeakPolarHBondContact OD1-CE 3.44Å; L233-M236 HydrophobicContact CD2-CE 3.84Å; Y234-M236 PolarHBondContact O-N 3.3Å; M236-H238 VanDerWaalsContact C-N 3.29Å; M236-H238 PolarHBondContact O-N 3.48Å; M236-N239 CarbonylContact O-C 3.56Å; M236-N239 PolarHBondContact O-N 3.08Å; M236-Q243 HydrophobicContact CB-CB 4.16Å; M236-Q243 HydrophobicContact CB-CG 4.13Å; M236-Q243 HydrophobicContact SD-CG 4.45Å; M236-L246 HydrophobicContact CG-CD1 3.96Å; M236-L246 HydrophobicContact SD-CD1 3.68Å
237	A	97.5	Very high	98.2	Very high	61 Å²	61	77.5 Å²	77.5	50%	0.504	37%	0.373	S	S	.	.	H	α-helix	trans	-66.9	-29.9	177.8	0	0	0	0	0	112.8	L233 Y234 E235	L233-A237 WeakPolarHBondContact O-CB 3.44Å; L233-A237 PolarHBondContact O-N 3.13Å; Y234-A237 WeakPolarHBondContact O-CB 3.38Å; Y234-A237 PolarHBondContact O-N 3.05Å; Y234-A237 VanDerWaalsContact O-N 3.16Å; E235-A237 VanDerWaalsContact C-N 3.33Å; E235-A237 PolarHBondContact O-N 3.28Å
238	H	97.3	Very high	98.3	Very high	116 Å²	116	77.4 Å²	77.4	54%	0.537	38%	0.382	S	S	.	.	H	α-helix	trans	-83.2	-25	175.8	-72.9	72	0	0	0	112.8	Y234 E235 M236	Y234-H238 AromaticContact CD2-CE1 3.52Å; Y234-H238 AromaticContact CD2-ND1 3.81Å; Y234-H238 AromaticContact CE1-CE1 3.96Å; Y234-H238 AromaticContact CE1-ND1 3.82Å; Y234-H238 AromaticContact CE2-CE1 3.01Å; Y234-H238 WeakPolarHBondContact CE2-CE1 3.27Å; Y234-H238 AromaticContact CE2-ND1 3.61Å; Y234-H238 AromaticContact CE2-NE2 3.71Å; Y234-H238 AromaticContact CZ-CE1 3.25Å; Y234-H238 AromaticContact CZ-ND1 3.59Å; Y234-H238 AromaticContact CZ-NE2 3.63Å; Y234-H238 PolarHBondContact O-N 2.85Å; Y234-H238 VanDerWaalsContact O-N 3.07Å; Y234-H238 PolarHBondContact O-ND1 3.38Å; Y234-H238 PolarHBondContact OH-NE2 3.31Å; E235-H238 PolarHBondContact O-N 3.37Å; M236-H238 VanDerWaalsContact C-N 3.29Å; M236-H238 PolarHBondContact O-N 3.48Å
239	N	98	Very high	98.3	Very high	78 Å²	78	77.3 Å²	77.3	42%	0.417	38%	0.379	S	S	.	.			trans	-118.5	67.3	-177.3	-63.3	-79.3	0	0	0	111.4	E235 M236 K241 V242 Q243	E235-N239 WeakPolarHBondContact O-CB 3.28Å; E235-N239 PolarHBondContact O-N 3.15Å; E235-N239 PolarHBondContact O-ND2 2.91Å; E235-N239 PolarHBondContact OE2-ND2 3.39Å; M236-N239 CarbonylContact O-C 3.56Å; M236-N239 PolarHBondContact O-N 3.08Å; N239-K241 PolarHBondContact O-N 3.05Å; N239-K241 VanDerWaalsContact O-N 3.12Å; N239-V242 HydrophobicContact CB-CB 4.06Å; N239-V242 HydrophobicContact CB-CG2 4.03Å; N239-V242 WeakPolarHBondContact O-CA 3.18Å; N239-V242 WeakPolarHBondContact O-CB 3.38Å; N239-V242 PolarHBondContact O-N 3.14Å; N239-Q243 PolarHBondContact O-N 3.25Å
240	L	98.3	Very high	98.3	Very high	97 Å²	97	76.6 Å²	76.6	51%	0.508	38%	0.377	S	S	.	.	H	α-helix	trans	-53.6	-37.4	-175.5	-59.8	-179.4	0	0	0	113.4	V242 Q243 E244	L240-V242 VanDerWaalsContact C-N 3.29Å; L240-V242 PolarHBondContact O-N 3.35Å; L240-Q243 WeakPolarHBondContact O-CB 3.33Å; L240-Q243 PolarHBondContact O-N 3.36Å; L240-Q243 VanDerWaalsContact O-N 3.16Å; L240-E244 PolarHBondContact O-N 3.49Å; L240-E244 VanDerWaalsContact O-OE2 3.07Å
241	K	98.4	Very high	98.3	Very high	171 Å²	171	77.6 Å²	77.6	74%	0.743	38%	0.384	S	S	*	.	H	α-helix	trans	-58.3	-41.7	174.7	-175.9	179.3	177	-176.2	0	112.3	N239 E244 M245	N239-K241 PolarHBondContact O-N 3.05Å; N239-K241 VanDerWaalsContact O-N 3.12Å; K241-E244 PolarHBondContact O-N 2.94Å; K241-M245 HydrophobicContact CG-SD 4.49Å; K241-M245 VanDerWaalsContact O-CG 3.3Å; K241-M245 WeakPolarHBondContact O-CG 3.33Å; K241-M245 PolarHBondContact O-N 3.34Å; K241-M245 VanDerWaalsContact O-N 3.13Å
242	V	98.2	Very high	98.3	Very high	63 Å²	63	72.8 Å²	72.8	38%	0.382	37%	0.374	S	S	.	.	H	α-helix	trans	-70	-41.9	177.3	178.4	0	0	0	0	110	N239 L240 E244 M245 L246	N239-V242 HydrophobicContact CB-CB 4.06Å; N239-V242 HydrophobicContact CB-CG2 4.03Å; N239-V242 WeakPolarHBondContact O-CA 3.18Å; N239-V242 WeakPolarHBondContact O-CB 3.38Å; N239-V242 PolarHBondContact O-N 3.14Å; L240-V242 VanDerWaalsContact C-N 3.29Å; L240-V242 PolarHBondContact O-N 3.35Å; V242-E244 VanDerWaalsContact C-N 3.26Å; V242-E244 PolarHBondContact O-N 3.09Å; V242-M245 WeakPolarHBondContact O-CB 3.46Å; V242-M245 PolarHBondContact O-N 2.95Å; V242-L246 HydrophobicContact CG1-CD1 4.02Å; V242-L246 HydrophobicContact CG1-CG 4.3Å; V242-L246 WeakPolarHBondContact O-CG 3.48Å; V242-L246 PolarHBondContact O-N 3.19Å
243	Q	98.7	Very high	98.3	Very high	53 Å²	53	72 Å²	72	25%	0.248	37%	0.371	C	S	.	.	H	α-helix	trans	-56.2	-41.7	174.4	-170.3	-177.6	21.1	0	0	111.9	M236 N239 L240 L246 R247	M236-Q243 HydrophobicContact CB-CB 4.16Å; M236-Q243 HydrophobicContact CB-CG 4.13Å; M236-Q243 HydrophobicContact SD-CG 4.45Å; N239-Q243 PolarHBondContact O-N 3.25Å; L240-Q243 WeakPolarHBondContact O-CB 3.33Å; L240-Q243 PolarHBondContact O-N 3.36Å; L240-Q243 VanDerWaalsContact O-N 3.16Å; Q243-L246 PolarHBondContact O-N 3.1Å; Q243-R247 WeakPolarHBondContact O-CB 3.27Å; Q243-R247 PolarHBondContact O-N 3.41Å
244	E	98.7	Very high	98.3	Very high	88 Å²	88	75.6 Å²	75.6	41%	0.411	38%	0.379	S	S	.	.	H	α-helix	trans	-66.6	-41.7	178.7	-89.7	63.8	125.4	0	0	111.4	L240 K241 V242 R247 A248	L240-E244 PolarHBondContact O-N 3.49Å; L240-E244 VanDerWaalsContact O-OE2 3.07Å; K241-E244 PolarHBondContact O-N 2.94Å; V242-E244 VanDerWaalsContact C-N 3.26Å; V242-E244 PolarHBondContact O-N 3.09Å; E244-R247 PolarHBondContact O-N 3.43Å; E244-R247 IonicContact OE2-CZ 3.77Å; E244-R247 IonicContact OE2-NH1 3.61Å; E244-R247 PolarHBondContact OE2-NH1 3.45Å; E244-A248 WeakPolarHBondContact O-CB 3.31Å; E244-A248 PolarHBondContact O-N 2.98Å
245	M	98.6	Very high	98.2	Very high	95 Å²	95	78.6 Å²	78.6	47%	0.468	39%	0.389	S	S	.	.	H	α-helix	trans	-62.9	-46.1	175.5	-70.7	171.7	60.1	0	0	111.8	K241 V242 A248 E249 L270	K241-M245 HydrophobicContact CG-SD 4.49Å; K241-M245 VanDerWaalsContact O-CG 3.3Å; K241-M245 WeakPolarHBondContact O-CG 3.33Å; K241-M245 PolarHBondContact O-N 3.34Å; K241-M245 VanDerWaalsContact O-N 3.13Å; V242-M245 WeakPolarHBondContact O-CB 3.46Å; V242-M245 PolarHBondContact O-N 2.95Å; M245-A248 PolarHBondContact O-N 3.46Å; M245-E249 PolarHBondContact O-N 3.5Å; M245-L270 HydrophobicContact CB-CD2 3.86Å; M245-L270 HydrophobicContact CE-CD2 4.1Å
246	L	98.7	Very high	98.2	Very high	5 Å²	5	81.3 Å²	81.3	3%	0.026	40%	0.402	C	S	.	.	H	α-helix	trans	-61.1	-46	176.5	-70.2	172.2	0	0	0	111.2	M236 V242 Q243 A248 E249 V250 L270 L271	M236-L246 HydrophobicContact CG-CD1 3.96Å; M236-L246 HydrophobicContact SD-CD1 3.68Å; V242-L246 HydrophobicContact CG1-CD1 4.02Å; V242-L246 HydrophobicContact CG1-CG 4.3Å; V242-L246 WeakPolarHBondContact O-CG 3.48Å; V242-L246 PolarHBondContact O-N 3.19Å; Q243-L246 PolarHBondContact O-N 3.1Å; L246-A248 VanDerWaalsContact C-N 3.34Å; L246-A248 PolarHBondContact O-N 3.25Å; L246-E249 PolarHBondContact O-N 3.03Å; L246-V250 WeakPolarHBondContact O-CB 3.47Å; L246-V250 VanDerWaalsContact O-CG2 3.28Å; L246-V250 WeakPolarHBondContact O-CG2 3.36Å; L246-V250 PolarHBondContact O-N 3.25Å; L246-L270 HydrophobicContact CD2-CB 4.26Å; L246-L270 HydrophobicContact CD2-CD2 4.02Å; L246-L270 HydrophobicContact CD2-CG 3.74Å; L246-L270 HydrophobicContact CG-CD2 4.48Å; L246-L271 HydrophobicContact CD2-CB 4.26Å; L246-L271 HydrophobicContact CD2-CD1 4.22Å
247	R	98.7	Very high	98.1	Very high	118 Å²	118	80.1 Å²	80.1	45%	0.445	40%	0.397	S	S	.	.	H	α-helix	trans	-60.8	-43.4	176.6	-172.7	-177.7	-64.7	112.9	-0.9	111.5	Q243 E244 V250 L251	Q243-R247 WeakPolarHBondContact O-CB 3.27Å; Q243-R247 PolarHBondContact O-N 3.41Å; E244-R247 PolarHBondContact O-N 3.43Å; E244-R247 IonicContact OE2-CZ 3.77Å; E244-R247 IonicContact OE2-NH1 3.61Å; E244-R247 PolarHBondContact OE2-NH1 3.45Å; R247-V250 PolarHBondContact O-N 3.02Å; R247-L251 HydrophobicContact CG-CD1 4.16Å; R247-L251 WeakPolarHBondContact O-CB 3.19Å; R247-L251 VanDerWaalsContact O-CG 3.28Å; R247-L251 WeakPolarHBondContact O-CG 3.19Å; R247-L251 PolarHBondContact O-N 3.24Å
248	A	98.7	Very high	98.1	Very high	58 Å²	58	86 Å²	86	48%	0.479	41%	0.414	S	S	.	.	H	α-helix	trans	-62.6	-43.8	178.5	0	0	0	0	0	112	E244 M245 L246 L251 A252	E244-A248 WeakPolarHBondContact O-CB 3.31Å; E244-A248 PolarHBondContact O-N 2.98Å; M245-A248 PolarHBondContact O-N 3.46Å; L246-A248 VanDerWaalsContact C-N 3.34Å; L246-A248 PolarHBondContact O-N 3.25Å; A248-L251 PolarHBondContact O-N 2.92Å; A248-A252 WeakPolarHBondContact O-CB 3.31Å; A248-A252 PolarHBondContact O-N 3.35Å
249	E	98.7	Very high	97.8	Very high	37 Å²	37	82.3 Å²	82.3	17%	0.173	41%	0.408	C	S	.	.	H	α-helix	trans	-59.5	-51.6	174.8	-176.5	-176.1	-110.9	0	0	111.1	M245 L246 L251 A252 A253 V268 P269 L270 L271	M245-E249 PolarHBondContact O-N 3.5Å; L246-E249 PolarHBondContact O-N 3.03Å; E249-L251 VanDerWaalsContact C-N 3.32Å; E249-L251 PolarHBondContact O-N 2.95Å; E249-A252 PolarHBondContact O-N 3.37Å; E249-A252 VanDerWaalsContact O-N 3.14Å; E249-A253 WeakPolarHBondContact O-CB 3.37Å; E249-A253 PolarHBondContact O-N 3.31Å; E249-V268 HydrophobicContact CG-CG1 4.41Å; E249-V268 VanDerWaalsContact OE2-C 3.24Å; E249-V268 VanDerWaalsContact OE2-CA 3.29Å; E249-V268 WeakPolarHBondContact OE2-CA 3.34Å; E249-P269 WeakPolarHBondContact OE1-CD 3.28Å; E249-P269 WeakPolarHBondContact OE1-CG 3.4Å; E249-L270 VanDerWaalsContact CD-CB 3.43Å; E249-L270 WeakPolarHBondContact OE1-CB 3.49Å; E249-L270 PolarHBondContact OE1-N 3.09Å; E249-L270 WeakPolarHBondContact OE2-CB 3.23Å; E249-L270 PolarHBondContact OE2-N 3.48Å; E249-L270 VanDerWaalsContact OE2-N 3.16Å; E249-L271 PolarHBondContact OE2-N 2.81Å
250	V	98.4	Very high	97.6	Very high	44 Å²	44	81.4 Å²	81.4	27%	0.267	40%	0.403	S	S	.	.	H	α-helix	trans	-58.6	-43.1	-179.3	168.9	0	0	0	0	111.5	L246 R247 A253 R254 M264 V268 L271	L246-V250 WeakPolarHBondContact O-CB 3.47Å; L246-V250 VanDerWaalsContact O-CG2 3.28Å; L246-V250 WeakPolarHBondContact O-CG2 3.36Å; L246-V250 PolarHBondContact O-N 3.25Å; R247-V250 PolarHBondContact O-N 3.02Å; V250-A253 PolarHBondContact O-N 3.39Å; V250-R254 WeakPolarHBondContact O-CB 3.39Å; V250-R254 PolarHBondContact O-N 3.04Å; V250-M264 HydrophobicContact CB-CE 4.36Å; V250-M264 HydrophobicContact CG1-CE 3.49Å; V250-M264 VanDerWaalsContact CG1-CE 3.49Å; V250-M264 WeakPolarHBondContact O-CE 3.44Å; V250-V268 HydrophobicContact CG2-CG1 4.35Å; V250-L271 HydrophobicContact CG2-CD2 4Å
251	L	98.4	Very high	97.4	Very high	86 Å²	86	79.3 Å²	79.3	45%	0.45	39%	0.391	S	S	.	.	H	α-helix	trans	-66.7	-38.8	177.4	-70.5	174.7	0	0	0	112.5	R247 A248 E249 R255	R247-L251 HydrophobicContact CG-CD1 4.16Å; R247-L251 WeakPolarHBondContact O-CB 3.19Å; R247-L251 VanDerWaalsContact O-CG 3.28Å; R247-L251 WeakPolarHBondContact O-CG 3.19Å; R247-L251 PolarHBondContact O-N 3.24Å; A248-L251 PolarHBondContact O-N 2.92Å; E249-L251 VanDerWaalsContact C-N 3.32Å; E249-L251 PolarHBondContact O-N 2.95Å; L251-R255 WeakPolarHBondContact O-CG 3.39Å; L251-R255 PolarHBondContact O-N 2.92Å; L251-R255 PolarHBondContact O-NH1 2.65Å
252	A	98.3	Very high	96.9	Very high	41 Å²	41	73.5 Å²	73.5	34%	0.339	38%	0.375	S	S	.	.	H	α-helix	trans	-66.1	-46.5	175.7	0	0	0	0	0	111.5	A248 E249 R254 R255 Q256	A248-A252 WeakPolarHBondContact O-CB 3.31Å; A248-A252 PolarHBondContact O-N 3.35Å; E249-A252 PolarHBondContact O-N 3.37Å; E249-A252 VanDerWaalsContact O-N 3.14Å; A252-R254 VanDerWaalsContact C-N 3.33Å; A252-R254 PolarHBondContact O-N 3.39Å; A252-R255 PolarHBondContact O-N 3.38Å; A252-Q256 PolarHBondContact O-N 3.37Å
253	A	98.3	Very high	96.7	Very high	3 Å²	3	76.4 Å²	76.4	3%	0.025	38%	0.383	C	S	.	.	H	α-helix	trans	-58.3	-43.5	176.8	0	0	0	0	0	111.7	E249 V250 R255 Q256 A257 M264 L267 V268	E249-A253 WeakPolarHBondContact O-CB 3.37Å; E249-A253 PolarHBondContact O-N 3.31Å; V250-A253 PolarHBondContact O-N 3.39Å; A253-R255 PolarHBondContact O-N 3.12Å; A253-Q256 PolarHBondContact O-N 3.5Å; A253-A257 VanDerWaalsContact O-CB 3.24Å; A253-A257 WeakPolarHBondContact O-CB 3.38Å; A253-A257 PolarHBondContact O-N 3.11Å; A253-M264 HydrophobicContact CB-CG 3.91Å; A253-L267 HydrophobicContact CB-CB 3.77Å; A253-V268 HydrophobicContact CB-CG1 3.57Å
254	R	97.3	Very high	96.5	Very high	152 Å²	152	75 Å²	75	57%	0.574	38%	0.376	S	S	*	.	H	α-helix	trans	-61.3	-42	177.5	-170.6	172.8	-176	173.7	3	112.7	V250 A252 Q258 G259 M264	V250-R254 WeakPolarHBondContact O-CB 3.39Å; V250-R254 PolarHBondContact O-N 3.04Å; A252-R254 VanDerWaalsContact C-N 3.33Å; A252-R254 PolarHBondContact O-N 3.39Å; R254-Q258 PolarHBondContact O-N 3.36Å; R254-G259 PolarHBondContact O-N 3.43Å; R254-G259 VanDerWaalsContact O-N 3.14Å; R254-M264 HydrophobicContact CB-CE 4.03Å; R254-M264 HydrophobicContact CB-SD 3.73Å; R254-M264 HydrophobicContact CG-SD 4.1Å
255	R	97.6	Very high	96.2	Very high	172 Å²	172	73.5 Å²	73.5	65%	0.649	37%	0.373	S	S	*	.	H	α-helix	trans	-64.4	-47.1	175.9	-72.7	-172.6	-64.3	-91.8	1.6	111.3	L251 A252 A253 A257 Q258	L251-R255 WeakPolarHBondContact O-CG 3.39Å; L251-R255 PolarHBondContact O-N 2.92Å; L251-R255 PolarHBondContact O-NH1 2.65Å; A252-R255 PolarHBondContact O-N 3.38Å; A253-R255 PolarHBondContact O-N 3.12Å; R255-A257 VanDerWaalsContact C-N 3.33Å; R255-A257 PolarHBondContact O-N 2.64Å; R255-Q258 PolarHBondContact O-N 2.84Å
256	Q	97.6	Very high	95.9	Very high	139 Å²	139	75.4 Å²	75.4	65%	0.65	38%	0.381	S	S	*	.	H	α-helix	trans	-64.7	-37.5	-179.8	-176.6	176.9	-7.6	0	0	112.4	A252 A253 Q258 L267	A252-Q256 PolarHBondContact O-N 3.37Å; A253-Q256 PolarHBondContact O-N 3.5Å; Q256-Q258 VanDerWaalsContact C-N 3.27Å; Q256-Q258 PolarHBondContact O-N 3.21Å; Q256-L267 HydrophobicContact CB-CD1 4.06Å; Q256-L267 HydrophobicContact CG-CD1 3.86Å
257	A	97.1	Very high	95.8	Very high	6 Å²	6	77.9 Å²	77.9	5%	0.05	39%	0.394	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.9	177.7	0	0	0	0	0	113.9	A253 R255 G259 D260 K263 M264 L267	A253-A257 VanDerWaalsContact O-CB 3.24Å; A253-A257 WeakPolarHBondContact O-CB 3.38Å; A253-A257 PolarHBondContact O-N 3.11Å; R255-A257 VanDerWaalsContact C-N 3.33Å; R255-A257 PolarHBondContact O-N 2.64Å; A257-G259 PolarHBondContact O-N 2.99Å; A257-D260 WeakPolarHBondContact CB-O 3.43Å; A257-D260 VanDerWaalsContact O-CB 3.27Å; A257-D260 WeakPolarHBondContact O-CB 3.37Å; A257-D260 PolarHBondContact O-N 3.44Å; A257-K263 HydrophobicContact CB-CB 3.93Å; A257-M264 HydrophobicContact CB-CB 3.96Å; A257-L267 HydrophobicContact CB-CD1 4.31Å
258	Q	96.5	Very high	95.8	Very high	183 Å²	183	72.7 Å²	72.7	86%	0.855	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	34.6	-173.8	-55.9	178.8	9.6	0	0	112.7	R254 R255 Q256	R254-Q258 PolarHBondContact O-N 3.36Å; R255-Q258 PolarHBondContact O-N 2.84Å; Q256-Q258 VanDerWaalsContact C-N 3.27Å; Q256-Q258 PolarHBondContact O-N 3.21Å
259	G	91	Very high	95.8	Very high	40 Å²	40	74.1 Å²	74.1	41%	0.412	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.9	-2.5	-178	0	0	0	0	0	116.2	R254 A257 M261	R254-G259 PolarHBondContact O-N 3.43Å; R254-G259 VanDerWaalsContact O-N 3.14Å; A257-G259 PolarHBondContact O-N 2.99Å; G259-M261 PolarHBondContact O-N 3.02Å
260	D	93.9	Very high	95.8	Very high	59 Å²	59	75.2 Å²	75.2	32%	0.316	39%	0.387	S	S	.	.			trans	-70	108.8	174.5	-179.5	-33.2	0	0	0	110.8	A257 A262 K263 M264	A257-D260 WeakPolarHBondContact CB-O 3.43Å; A257-D260 VanDerWaalsContact O-CB 3.27Å; A257-D260 WeakPolarHBondContact O-CB 3.37Å; A257-D260 PolarHBondContact O-N 3.44Å; D260-A262 PolarHBondContact O-N 3.41Å; D260-A262 WeakPolarHBondContact OD1-CB 3.34Å; D260-A262 PolarHBondContact OD1-N 3.41Å; D260-K263 HydrophobicContact CB-CB 4.15Å; D260-K263 HydrophobicContact CB-CD 3.95Å; D260-K263 HydrophobicContact CB-CG 4.21Å; D260-K263 PolarHBondContact O-N 2.93Å; D260-K263 PolarHBondContact OD1-N 3.47Å; D260-K263 VanDerWaalsContact OD2-CD 3.31Å; D260-K263 WeakPolarHBondContact OD2-CD 3.45Å; D260-K263 WeakPolarHBondContact OD2-CE 3.32Å; D260-K263 IonicContact OD2-NZ 3.9Å; D260-K263 PolarHBondContact OD2-NZ 2.98Å; D260-M264 WeakPolarHBondContact O-CB 3.34Å; D260-M264 PolarHBondContact O-N 3.43Å
261	M	93.1	Very high	95.8	Very high	52 Å²	52	75.7 Å²	75.7	26%	0.256	39%	0.387	S	S	.	.	H	α-helix	trans	-63.6	-38.2	-176.4	-170.9	58.2	68.8	0	0	112.8	V63 E67 G259 K263 M264 V265	V63-M261 HydrophobicContact CG1-CB 3.8Å; V63-M261 HydrophobicContact CG1-CG 3.47Å; V63-M261 VanDerWaalsContact CG1-CG 3.47Å; E67-M261 HydrophobicContact CG-CE 4.19Å; E67-M261 VanDerWaalsContact OE1-CE 3.22Å; E67-M261 WeakPolarHBondContact OE1-CE 3.27Å; E67-M261 WeakPolarHBondContact OE2-CB 3.36Å; G259-M261 PolarHBondContact O-N 3.02Å; M261-K263 VanDerWaalsContact C-N 3.3Å; M261-K263 PolarHBondContact O-N 2.97Å; M261-M264 PolarHBondContact O-N 2.91Å; M261-M264 HydrophobicContact SD-SD 4.41Å; M261-V265 HydrophobicContact CG-CG2 4.49Å; M261-V265 WeakPolarHBondContact O-CG2 3.17Å; M261-V265 PolarHBondContact O-N 3.41Å; M261-V265 HydrophobicContact SD-CG2 4.35Å
262	A	89.6	Confident	95.8	Very high	49 Å²	49	75.5 Å²	75.5	41%	0.405	38%	0.383	S	S	.	.	H	α-helix	trans	-65.2	-36	-179.3	0	0	0	0	0	111.7	D260	D260-A262 PolarHBondContact O-N 3.41Å; D260-A262 WeakPolarHBondContact OD1-CB 3.34Å; D260-A262 PolarHBondContact OD1-N 3.41Å
263	K	92.8	Very high	95.8	Very high	125 Å²	125	75.8 Å²	75.8	54%	0.543	39%	0.385	S	S	.	.	H	α-helix	trans	-71.9	-44.4	170.8	-69	176.8	-168.8	154.7	0	111.8	A257 D260 M261 V265 Q266	A257-K263 HydrophobicContact CB-CB 3.93Å; D260-K263 HydrophobicContact CB-CB 4.15Å; D260-K263 HydrophobicContact CB-CD 3.95Å; D260-K263 HydrophobicContact CB-CG 4.21Å; D260-K263 PolarHBondContact O-N 2.93Å; D260-K263 PolarHBondContact OD1-N 3.47Å; D260-K263 VanDerWaalsContact OD2-CD 3.31Å; D260-K263 WeakPolarHBondContact OD2-CD 3.45Å; D260-K263 WeakPolarHBondContact OD2-CE 3.32Å; D260-K263 IonicContact OD2-NZ 3.9Å; D260-K263 PolarHBondContact OD2-NZ 2.98Å; M261-K263 VanDerWaalsContact C-N 3.3Å; M261-K263 PolarHBondContact O-N 2.97Å; K263-V265 VanDerWaalsContact C-N 3.31Å; K263-V265 PolarHBondContact O-N 3.49Å; K263-Q266 WeakPolarHBondContact O-CB 3.37Å; K263-Q266 PolarHBondContact O-N 3.31Å
264	M	95.3	Very high	95.8	Very high	22 Å²	22	76.4 Å²	76.4	11%	0.108	39%	0.389	C	S	.	.	H	α-helix	trans	-58.4	-41.1	-176.6	-172.1	175.2	159.2	0	0	112.3	V250 A253 R254 A257 D260 M261 Q266 L267	V250-M264 HydrophobicContact CB-CE 4.36Å; V250-M264 HydrophobicContact CG1-CE 3.49Å; V250-M264 VanDerWaalsContact CG1-CE 3.49Å; V250-M264 WeakPolarHBondContact O-CE 3.44Å; A253-M264 HydrophobicContact CB-CG 3.91Å; R254-M264 HydrophobicContact CB-CE 4.03Å; R254-M264 HydrophobicContact CB-SD 3.73Å; R254-M264 HydrophobicContact CG-SD 4.1Å; A257-M264 HydrophobicContact CB-CB 3.96Å; D260-M264 WeakPolarHBondContact O-CB 3.34Å; D260-M264 PolarHBondContact O-N 3.43Å; M261-M264 PolarHBondContact O-N 2.91Å; M261-M264 HydrophobicContact SD-SD 4.41Å; M264-Q266 PolarHBondContact O-N 2.99Å; M264-Q266 VanDerWaalsContact O-N 3.11Å; M264-L267 PolarHBondContact O-N 3.14Å
265	V	91.6	Very high	95.8	Very high	57 Å²	57	73 Å²	73	35%	0.345	38%	0.382	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-21.7	176.6	172	0	0	0	0	112.7	M261 K263 K272	M261-V265 HydrophobicContact CG-CG2 4.49Å; M261-V265 WeakPolarHBondContact O-CG2 3.17Å; M261-V265 PolarHBondContact O-N 3.41Å; M261-V265 HydrophobicContact SD-CG2 4.35Å; K263-V265 VanDerWaalsContact C-N 3.31Å; K263-V265 PolarHBondContact O-N 3.49Å; V265-K272 WeakPolarHBondContact O-CE 2.93Å; V265-K272 PolarHBondContact O-NZ 2.96Å
266	Q	92.6	Very high	95.8	Very high	136 Å²	136	72.5 Å²	72.5	64%	0.636	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85	-14.6	174.3	-55.7	-53.1	-34.4	0	0	113.5	K263 M264	K263-Q266 WeakPolarHBondContact O-CB 3.37Å; K263-Q266 PolarHBondContact O-N 3.31Å; M264-Q266 PolarHBondContact O-N 2.99Å; M264-Q266 VanDerWaalsContact O-N 3.11Å
267	L	97.3	Very high	95.8	Very high	57 Å²	57	74 Å²	74	30%	0.298	39%	0.391	S	S	.	.	S	Bend	trans	-104.5	11.7	-173	-62.3	174.4	0	0	0	113.6	A253 Q256 A257 M264 P269	A253-L267 HydrophobicContact CB-CB 3.77Å; Q256-L267 HydrophobicContact CB-CD1 4.06Å; Q256-L267 HydrophobicContact CG-CD1 3.86Å; A257-L267 HydrophobicContact CB-CD1 4.31Å; M264-L267 PolarHBondContact O-N 3.14Å; L267-P269 WeakPolarHBondContact O-CD 3.37Å
268	V	97.8	Very high	95.9	Very high	9 Å²	9	75.2 Å²	75.2	6%	0.055	40%	0.398	C	S	.	.			trans	-120.6	59.4	-177	-66.4	0	0	0	0	112.8	E249 V250 A253 L270 L271 K272	E249-V268 HydrophobicContact CG-CG1 4.41Å; E249-V268 VanDerWaalsContact OE2-C 3.24Å; E249-V268 VanDerWaalsContact OE2-CA 3.29Å; E249-V268 WeakPolarHBondContact OE2-CA 3.34Å; V250-V268 HydrophobicContact CG2-CG1 4.35Å; A253-V268 HydrophobicContact CB-CG1 3.57Å; V268-L270 PolarHBondContact O-N 2.96Å; V268-L271 HydrophobicContact CB-CB 3.95Å; V268-L271 HydrophobicContact CB-CD2 4.41Å; V268-L271 HydrophobicContact CG2-CB 4.34Å; V268-L271 HydrophobicContact CG2-CD2 4.29Å; V268-L271 PolarHBondContact O-N 3.4Å; V268-K272 WeakPolarHBondContact O-CG 3.35Å; V268-K272 PolarHBondContact O-N 3.05Å; V268-K272 VanDerWaalsContact O-N 3.1Å
269	P	98.3	Very high	95.7	Very high	88 Å²	88	74.3 Å²	74.3	57%	0.571	40%	0.398	S	S	*	.	H	α-helix	trans	-62.7	-36	-177.7	26.4	-35.1	0	0	0	113.7	E249 L267 K272 A273	E249-P269 WeakPolarHBondContact OE1-CD 3.28Å; E249-P269 WeakPolarHBondContact OE1-CG 3.4Å; L267-P269 WeakPolarHBondContact O-CD 3.37Å; P269-K272 PolarHBondContact O-N 2.8Å; P269-A273 PolarHBondContact O-N 2.89Å
270	L	98.4	Very high	96	Very high	60 Å²	60	76.1 Å²	76.1	31%	0.314	40%	0.397	S	S	.	.	H	α-helix	trans	-69.6	-40.1	178.5	-172.3	67.9	0	0	0	111.2	M245 L246 E249 V268 K272 A273 S274	M245-L270 HydrophobicContact CB-CD2 3.86Å; M245-L270 HydrophobicContact CE-CD2 4.1Å; L246-L270 HydrophobicContact CD2-CB 4.26Å; L246-L270 HydrophobicContact CD2-CD2 4.02Å; L246-L270 HydrophobicContact CD2-CG 3.74Å; L246-L270 HydrophobicContact CG-CD2 4.48Å; E249-L270 VanDerWaalsContact CD-CB 3.43Å; E249-L270 WeakPolarHBondContact OE1-CB 3.49Å; E249-L270 PolarHBondContact OE1-N 3.09Å; E249-L270 WeakPolarHBondContact OE2-CB 3.23Å; E249-L270 PolarHBondContact OE2-N 3.48Å; E249-L270 VanDerWaalsContact OE2-N 3.16Å; V268-L270 PolarHBondContact O-N 2.96Å; L270-K272 VanDerWaalsContact C-N 3.32Å; L270-K272 PolarHBondContact O-N 3.49Å; L270-A273 CarbonylContact O-C 3.54Å; L270-A273 WeakPolarHBondContact O-CA 3.46Å; L270-A273 WeakPolarHBondContact O-CB 3.47Å; L270-A273 PolarHBondContact O-N 3.33Å; L270-A273 VanDerWaalsContact O-N 3.09Å; L270-S274 PolarHBondContact O-N 2.95Å
271	L	98.4	Very high	96.1	Very high	53 Å²	53	76.9 Å²	76.9	28%	0.277	40%	0.402	S	S	.	.	H	α-helix	trans	-62	-39.7	172.8	-174.2	64.1	0	0	0	112.1	L246 E249 V250 V268 A273 S274 I275	L246-L271 HydrophobicContact CD2-CB 4.26Å; L246-L271 HydrophobicContact CD2-CD1 4.22Å; E249-L271 PolarHBondContact OE2-N 2.81Å; V250-L271 HydrophobicContact CG2-CD2 4Å; V268-L271 HydrophobicContact CB-CB 3.95Å; V268-L271 HydrophobicContact CB-CD2 4.41Å; V268-L271 HydrophobicContact CG2-CB 4.34Å; V268-L271 HydrophobicContact CG2-CD2 4.29Å; V268-L271 PolarHBondContact O-N 3.4Å; L271-A273 VanDerWaalsContact C-N 3.28Å; L271-A273 PolarHBondContact O-N 3.17Å; L271-S274 PolarHBondContact O-N 2.91Å; L271-S274 PolarHBondContact O-OG 3.19Å; L271-I275 WeakPolarHBondContact O-CG1 3.43Å; L271-I275 PolarHBondContact O-N 2.94Å
272	K	98.2	Very high	96.3	Very high	83 Å²	83	78.3 Å²	78.3	36%	0.361	41%	0.41	S	S	.	.	H	α-helix	trans	-63.9	-35.8	172.4	-70.7	179.2	-176.9	172.7	0	111.9	V265 V268 P269 L270 K276	V265-K272 WeakPolarHBondContact O-CE 2.93Å; V265-K272 PolarHBondContact O-NZ 2.96Å; V268-K272 WeakPolarHBondContact O-CG 3.35Å; V268-K272 PolarHBondContact O-N 3.05Å; V268-K272 VanDerWaalsContact O-N 3.1Å; P269-K272 PolarHBondContact O-N 2.8Å; L270-K272 VanDerWaalsContact C-N 3.32Å; L270-K272 PolarHBondContact O-N 3.49Å; K272-K276 WeakPolarHBondContact O-CG 3.46Å; K272-K276 PolarHBondContact O-N 2.99Å
273	A	98.4	Very high	96.6	Very high	46 Å²	46	80.1 Å²	80.1	38%	0.38	41%	0.41	S	S	.	.	H	α-helix	trans	-69.6	-38.1	176.6	0	0	0	0	0	112.1	P269 L270 L271 I275 K276 E277	P269-A273 PolarHBondContact O-N 2.89Å; L270-A273 CarbonylContact O-C 3.54Å; L270-A273 WeakPolarHBondContact O-CA 3.46Å; L270-A273 WeakPolarHBondContact O-CB 3.47Å; L270-A273 PolarHBondContact O-N 3.33Å; L270-A273 VanDerWaalsContact O-N 3.09Å; L271-A273 VanDerWaalsContact C-N 3.28Å; L271-A273 PolarHBondContact O-N 3.17Å; A273-I275 VanDerWaalsContact C-N 3.31Å; A273-I275 PolarHBondContact O-N 2.92Å; A273-K276 WeakPolarHBondContact O-CB 3.43Å; A273-K276 PolarHBondContact O-N 3.25Å; A273-K276 VanDerWaalsContact O-N 3.09Å; A273-E277 PolarHBondContact O-N 3.13Å
274	S	98.3	Very high	96.9	Very high	16 Å²	16	77.3 Å²	77.3	11%	0.112	40%	0.402	C	S	.	.	H	α-helix	trans	-66.6	-32.7	178.4	69.9	0	0	0	0	112.7	L270 L271 K276 E277 T278	L270-S274 PolarHBondContact O-N 2.95Å; L271-S274 PolarHBondContact O-N 2.91Å; L271-S274 PolarHBondContact O-OG 3.19Å; S274-K276 VanDerWaalsContact C-N 3.34Å; S274-E277 PolarHBondContact O-N 3.38Å; S274-T278 PolarHBondContact O-N 3.04Å; S274-T278 PolarHBondContact O-OG1 3.22Å
275	I	98	Very high	97	Very high	82 Å²	82	80.9 Å²	80.9	42%	0.421	42%	0.421	S	S	.	.	H	α-helix	trans	-64.1	-41.1	171.3	-63.7	168.5	0	0	0	110.6	L271 A273 E277 T278 L279	L271-I275 WeakPolarHBondContact O-CG1 3.43Å; L271-I275 PolarHBondContact O-N 2.94Å; A273-I275 VanDerWaalsContact C-N 3.31Å; A273-I275 PolarHBondContact O-N 2.92Å; I275-E277 VanDerWaalsContact C-N 3.34Å; I275-T278 PolarHBondContact O-N 3.42Å; I275-L279 HydrophobicContact CG2-CD1 4.31Å; I275-L279 PolarHBondContact O-N 3.32Å
276	K	98.1	Very high	97.4	Very high	161 Å²	161	82.6 Å²	82.6	70%	0.7	43%	0.427	S	S	*	.	H	α-helix	trans	-65.2	-37.1	175.1	-66.5	175.5	-178.5	-178.4	0	112.4	K272 A273 S274 T278 L279	K272-K276 WeakPolarHBondContact O-CG 3.46Å; K272-K276 PolarHBondContact O-N 2.99Å; A273-K276 WeakPolarHBondContact O-CB 3.43Å; A273-K276 PolarHBondContact O-N 3.25Å; A273-K276 VanDerWaalsContact O-N 3.09Å; S274-K276 VanDerWaalsContact C-N 3.34Å; K276-T278 VanDerWaalsContact C-N 3.26Å; K276-T278 PolarHBondContact O-N 3.22Å; K276-L279 PolarHBondContact O-N 3.12Å
277	E	98	Very high	97.7	Very high	170 Å²	170	78.5 Å²	78.5	79%	0.794	41%	0.411	S	S	*	.	H	α-helix	trans	-69.6	-26.3	177.1	-168.4	70.5	177.1	0	0	112.2	A273 S274 I275	A273-E277 PolarHBondContact O-N 3.13Å; S274-E277 PolarHBondContact O-N 3.38Å; I275-E277 VanDerWaalsContact C-N 3.34Å
278	T	97.6	Very high	97.8	Very high	32 Å²	32	80.3 Å²	80.3	20%	0.196	42%	0.42	C	S	.	.	H	α-helix	trans	-76.7	-23.3	177.7	-53.7	0	0	0	0	112.5	T228 W231 N232 S274 I275 K276	T228-T278 HydrophobicContact CG2-CG2 4.06Å; W231-T278 HydrophobicContact CB-CG2 3.8Å; N232-T278 HydrophobicContact CB-CG2 4.03Å; N232-T278 PolarHBondContact ND2-OG1 3.35Å; S274-T278 PolarHBondContact O-N 3.04Å; S274-T278 PolarHBondContact O-OG1 3.22Å; I275-T278 PolarHBondContact O-N 3.42Å; K276-T278 VanDerWaalsContact C-N 3.26Å; K276-T278 PolarHBondContact O-N 3.22Å
279	L	93.9	Very high	97.8	Very high	164 Å²	164	86.8 Å²	86.8	86%	0.859	45%	0.453	S	S	*	.			trans	-101.5	0	-174.4	-74.1	171.9	0	0	0	111.8	T228 I275 K276	T228-L279 HydrophobicContact CG2-CD2 3.73Å; T228-L279 HydrophobicContact CG2-CG 3.98Å; I275-L279 HydrophobicContact CG2-CD1 4.31Å; I275-L279 PolarHBondContact O-N 3.32Å; K276-L279 PolarHBondContact O-N 3.12Å

Retrieved 279 of 279 residues in 136.8 ms (Link to these results)

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