A0A096MFR9_POEFO Loading...

Cytoplasmic tRNA 2-thiolation protein 2

Plays a central role in 2-thiolation of mcm(5)S(2)U at tRNA wobble positions of tRNA(Lys), tRNA(Glu) and tRNA(Gln). May act by forming a heterodimer with CTU1/ATPBD3 that ligates sulfur from thiocarboxylated URM1 onto the uridine of tRNAs at wobble position.

AlphaFold DB , UniProt , Accession A0A096MFR9, Species POEFO (Poecilia formosa, Amazon molly), Gene CTU2, Length 498 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	40.7	Very low	35.3	Very low	241 Å²	241	166.5 Å²	166.5	100%	1.187	81%	0.808	S	S	*	*				0	111.7	0	-82.5	-164.2	148.3	0	0	108
2	C	31.8	Very low	35.6	Very low	130 Å²	130	164.9 Å²	164.9	88%	0.878	81%	0.806	S	S	*	*			trans	-174.1	84.9	154.5	-92.7	0	0	0	0	105.4
3	Q	35.9	Very low	35.4	Very low	188 Å²	188	166.3 Å²	166.3	88%	0.879	81%	0.809	S	S	*	*			trans	-69.5	132	161	-76.1	168	-41.7	0	0	107.4
4	V	35.4	Very low	35.4	Very low	110 Å²	110	171.6 Å²	171.6	67%	0.667	82%	0.817	S	S	*	*			trans	-137.8	79.6	158.2	-172.7	0	0	0	0	106.3	E6	V4-E6 VanDerWaalsContact C-N 3.34Å; V4-E6 HydrophobicContact CG1-CB 4.1Å; V4-E6 HydrophobicContact CG1-CG 3.71Å; V4-E6 PolarHBondContact O-N 3.11Å
5	E	35.8	Very low	35.6	Very low	184 Å²	184	169.5 Å²	169.5	86%	0.86	82%	0.819	S	S	*	*			trans	-79.3	92	152.8	-73.4	178.3	165.4	0	0	105.9
6	E	35.8	Very low	35.6	Very low	140 Å²	140	167.9 Å²	167.9	65%	0.654	82%	0.816	S	S	*	*			trans	-102.1	91.6	163.5	-84.3	-180	175.9	0	0	107.6	V4 Y8	V4-E6 VanDerWaalsContact C-N 3.34Å; V4-E6 HydrophobicContact CG1-CB 4.1Å; V4-E6 HydrophobicContact CG1-CG 3.71Å; V4-E6 PolarHBondContact O-N 3.11Å; E6-Y8 PolarHBondContact O-N 2.95Å; E6-Y8 VanDerWaalsContact O-N 3.13Å
7	E	32.5	Very low	35.9	Very low	162 Å²	162	165.8 Å²	165.8	76%	0.757	82%	0.815	S	S	*	*			trans	-62.5	105.1	160.8	-74.3	-177.5	150.3	0	0	108.3	H9	E7-H9 PolarHBondContact O-N 3.47Å
8	Y	34.3	Very low	36.5	Very low	188 Å²	188	161.1 Å²	161.1	74%	0.737	80%	0.799	S	S	*	*			trans	-67.7	84.1	168	-86.8	-101.5	0	0	0	109.5	E6 E10	E6-Y8 PolarHBondContact O-N 2.95Å; E6-Y8 VanDerWaalsContact O-N 3.13Å; Y8-E10 VanDerWaalsContact C-N 3.26Å; Y8-E10 PolarHBondContact O-N 3.04Å
9	H	35.8	Very low	37	Very low	156 Å²	156	158.9 Å²	158.9	72%	0.722	80%	0.801	S	S	*	*			trans	-87.2	61.9	162.5	-92.5	-64.4	0	0	0	110.2	E7 Q11	E7-H9 PolarHBondContact O-N 3.47Å; H9-Q11 PolarHBondContact O-N 3.02Å
10	E	34.6	Very low	37.9	Very low	150 Å²	150	154.1 Å²	154.1	70%	0.701	79%	0.787	S	S	*	*			trans	-79.1	101.8	159.6	-81.9	-172.5	162.5	0	0	108.1	Y8 L12	Y8-E10 VanDerWaalsContact C-N 3.26Å; Y8-E10 PolarHBondContact O-N 3.04Å; E10-L12 PolarHBondContact O-N 3.17Å
11	Q	35.8	Very low	38.8	Very low	182 Å²	182	149.2 Å²	149.2	85%	0.85	77%	0.767	S	S	*	*			trans	-62.5	90.4	162.2	-71.3	177.7	-8.9	0	0	107.6	H9 E13	H9-Q11 PolarHBondContact O-N 3.02Å; Q11-E13 PolarHBondContact O-N 2.93Å
12	L	38.8	Very low	40.3	Very low	148 Å²	148	146.2 Å²	146.2	78%	0.775	75%	0.747	S	S	*	*			trans	-56.6	106.8	170.2	-74.7	161.2	0	0	0	108.1	E10 R14	E10-L12 PolarHBondContact O-N 3.17Å; L12-R14 PolarHBondContact O-N 3.18Å; L12-R14 VanDerWaalsContact O-N 3.07Å
13	E	32.7	Very low	42.8	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	73%	0.732	S	S	*	*			trans	-51.4	117.6	172.1	-74.3	-175.9	154	0	0	108.4	Q11 V15	Q11-E13 PolarHBondContact O-N 2.93Å; E13-V15 PolarHBondContact O-N 3.24Å
14	R	35.6	Very low	45.2	Very low	241 Å²	241	137.2 Å²	137.2	91%	0.909	69%	0.69	S	S	*	*			trans	-62.6	106	173	-76.8	-179.4	176.9	168.9	0.6	107.4	L12 D16	L12-R14 PolarHBondContact O-N 3.18Å; L12-R14 VanDerWaalsContact O-N 3.07Å; R14-D16 PolarHBondContact O-N 3.44Å
15	V	37.8	Very low	47.6	Very low	140 Å²	140	135.1 Å²	135.1	85%	0.848	68%	0.678	S	S	*	*			trans	-52.6	123.2	169	179.5	0	0	0	0	108.1	E13	E13-V15 PolarHBondContact O-N 3.24Å
16	D	35.6	Very low	49.9	Very low	144 Å²	144	131.6 Å²	131.6	77%	0.77	66%	0.659	S	S	*	*			trans	-44.9	137.5	-179.2	-73.8	-53.2	0	0	0	112.2	R14 P18	R14-D16 PolarHBondContact O-N 3.44Å; D16-P18 WeakPolarHBondContact O-CD 3.38Å; D16-P18 VanDerWaalsContact O-N 3.11Å
17	T	42.2	Very low	52.3	Low	132 Å²	132	126.7 Å²	126.7	81%	0.81	64%	0.64	S	S	*	*			trans	-49.7	119.2	171.2	37.4	0	0	0	0	109.5	S19	T17-S19 PolarHBondContact O-N 3.46Å; T17-S19 VanDerWaalsContact O-N 3.08Å
18	P	46.5	Very low	54.7	Low	81 Å²	81	126.5 Å²	126.5	53%	0.526	64%	0.637	S	S	.	*			trans	-63.1	119.6	-174.2	21.6	-30.8	0	0	0	109.1	D16 A20 A38	D16-P18 WeakPolarHBondContact O-CD 3.38Å; D16-P18 VanDerWaalsContact O-N 3.11Å; P18-A20 PolarHBondContact O-N 2.89Å; P18-A38 HydrophobicContact CB-CB 3.94Å; P18-A38 HydrophobicContact CG-CB 4.08Å
19	S	44.6	Very low	57	Low	119 Å²	119	125.3 Å²	125.3	83%	0.832	64%	0.638	S	S	*	*			trans	-56.7	108.3	175.5	73.3	0	0	0	0	108.3	T17 S21	T17-S19 PolarHBondContact O-N 3.46Å; T17-S19 VanDerWaalsContact O-N 3.08Å; S19-S21 PolarHBondContact O-N 2.8Å
20	A	55.1	Low	59.2	Low	62 Å²	62	122.7 Å²	122.7	51%	0.512	63%	0.626	S	S	.	*			trans	-65.4	124.5	-179.3	0	0	0	0	0	108.6	P18 K22 V35	P18-A20 PolarHBondContact O-N 2.89Å; A20-K22 PolarHBondContact O-N 3.27Å; A20-K22 VanDerWaalsContact O-N 3.14Å; A20-V35 HydrophobicContact CB-CG2 4.05Å
21	S	58.3	Low	61.5	Low	53 Å²	53	121.2 Å²	121.2	37%	0.371	62%	0.622	S	S	.	*			trans	-56.1	122.5	167.3	59.7	0	0	0	0	108.2	S19 K23 A32 A41	S19-S21 PolarHBondContact O-N 2.8Å; S21-K23 PolarHBondContact O-N 2.91Å; S21-K23 PolarHBondContact OG-O 3.3Å; S21-A32 WeakPolarHBondContact O-CB 3.25Å; S21-A41 WeakPolarHBondContact OG-CB 3.3Å
22	K	71.9	Confident	63.8	Low	178 Å²	178	114 Å²	114	77%	0.774	59%	0.594	S	S	*	*	S	Bend	trans	-59.4	-21.6	-176.3	-68.2	-177.1	179.8	179	0	113.1	A20 L31 A32	A20-K22 PolarHBondContact O-N 3.27Å; A20-K22 VanDerWaalsContact O-N 3.14Å; K22-L31 HydrophobicContact CB-CD2 4.43Å; K22-L31 CarbonylContact O-C 3.54Å; K22-L31 VanDerWaalsContact O-CA 3.28Å; K22-L31 WeakPolarHBondContact O-CA 3.44Å; K22-L31 VanDerWaalsContact O-CD2 3.24Å; K22-L31 WeakPolarHBondContact O-CD2 3.2Å; K22-A32 PolarHBondContact O-N 3.3Å
23	K	84.1	Confident	65.9	Low	127 Å²	127	110 Å²	110	55%	0.552	58%	0.582	S	S	*	*	B	Isolated β-bridge	trans	-108.6	153.3	-176	-62.1	-176	175	-171	0	112.2	S21 E30	S21-K23 PolarHBondContact O-N 2.91Å; S21-K23 PolarHBondContact OG-O 3.3Å; K23-E30 WeakPolarHBondContact CA-O 3.21Å
24	C	85.8	Confident	68.3	Low	2 Å²	2	101.8 Å²	101.8	1%	0.014	55%	0.545	C	S	.	.			trans	-67.6	135.7	176.1	176	0	0	0	0	112.1	K26 C27 K28 E30 A41 C43	C24-K26 VanDerWaalsContact C-N 3.33Å; C24-K26 PolarHBondContact O-N 3.42Å; C24-K26 PolarHBondContact SG-N 2.97Å; C24-K26 VanDerWaalsContact SG-N 3.37Å; C24-C27 VanDerWaalsContact CB-SG 3.54Å; C24-K28 WeakPolarHBondContact O-CA 3.37Å; C24-K28 PolarHBondContact O-N 3.4Å; C24-E30 WeakPolarHBondContact CB-O 3.22Å; C24-E30 PolarHBondContact N-O 2.98Å; C24-A41 WeakPolarHBondContact CA-O 3.41Å; C24-C43 HydrophobicContact CB-CB 3.84Å; C24-C43 PolarHBondContact SG-N 3.47Å
25	V	86.6	Confident	70.6	Confident	66 Å²	66	92.5 Å²	92.5	40%	0.4	52%	0.515	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65	-34	178.5	177.7	0	0	0	0	112.6	G39 A41	V25-G39 WeakPolarHBondContact CG2-O 3.4Å; V25-A41 HydrophobicContact CG2-CB 4.37Å; V25-A41 WeakPolarHBondContact CG2-O 3.16Å; V25-A41 PolarHBondContact N-O 3.34Å
26	K	84	Confident	72.5	Confident	110 Å²	110	86.6 Å²	86.6	48%	0.478	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82	-50.6	-174.1	-163.2	-175.9	-179.1	-162	0	112.9	C24 Y42 C46 E49	C24-K26 VanDerWaalsContact C-N 3.33Å; C24-K26 PolarHBondContact O-N 3.42Å; C24-K26 PolarHBondContact SG-N 2.97Å; C24-K26 VanDerWaalsContact SG-N 3.37Å; K26-Y42 HydrophobicContact CB-CD1 4.42Å; K26-Y42 HydrophobicContact CB-CE1 4.41Å; K26-C46 HydrophobicContact CB-CB 4.01Å; K26-C46 HydrophobicContact CD-CB 3.82Å; K26-C46 HydrophobicContact CG-CB 4.45Å; K26-E49 IonicContact NZ-OE2 3.13Å; K26-E49 PolarHBondContact NZ-OE2 2.74Å
27	C	85.5	Confident	74.4	Confident	37 Å²	37	84.7 Å²	84.7	25%	0.25	46%	0.46	C	S	.	.	T	Hydrogen-bonded Turn	trans	-95.6	-18.7	-179.2	64.3	0	0	0	0	114.1	C24 E29	C24-C27 VanDerWaalsContact CB-SG 3.54Å; C27-E29 WeakPolarHBondContact O-CG 3.21Å; C27-E29 PolarHBondContact O-N 2.84Å
28	K	83.5	Confident	75.6	Confident	158 Å²	158	81.4 Å²	81.4	69%	0.687	45%	0.446	S	S	*	.	S	Bend	trans	57	2.8	-177.8	-57.3	-178.3	-179.9	179.9	0	116.2	C24	C24-K28 WeakPolarHBondContact O-CA 3.37Å; C24-K28 PolarHBondContact O-N 3.4Å
29	E	81.6	Confident	76.6	Confident	163 Å²	163	80.2 Å²	80.2	76%	0.762	45%	0.448	S	S	*	.	S	Bend	trans	-102.6	-58.6	-178.7	-70.8	170.2	-179.9	0	0	111.2	C27	C27-E29 WeakPolarHBondContact O-CG 3.21Å; C27-E29 PolarHBondContact O-N 2.84Å
30	E	82.6	Confident	78.3	Confident	100 Å²	100	77.1 Å²	77.1	47%	0.467	42%	0.422	S	S	.	.	S	Bend	trans	-75.6	153.3	-174.5	-71.4	-73.7	-178.4	0	0	112.7	K23 C24 C43	K23-E30 WeakPolarHBondContact CA-O 3.21Å; C24-E30 WeakPolarHBondContact CB-O 3.22Å; C24-E30 PolarHBondContact N-O 2.98Å; E30-C43 HydrophobicContact CB-CB 3.55Å; E30-C43 HydrophobicContact CG-CB 4.46Å
31	L	83.8	Confident	79.7	Confident	120 Å²	120	74.2 Å²	74.2	63%	0.628	40%	0.398	S	S	*	.	B	Isolated β-bridge	trans	-66.5	143.7	175	-65.5	176.2	0	0	0	111.3	K22 A33 C43	K22-L31 HydrophobicContact CB-CD2 4.43Å; K22-L31 CarbonylContact O-C 3.54Å; K22-L31 VanDerWaalsContact O-CA 3.28Å; K22-L31 WeakPolarHBondContact O-CA 3.44Å; K22-L31 VanDerWaalsContact O-CD2 3.24Å; K22-L31 WeakPolarHBondContact O-CD2 3.2Å; L31-A33 PolarHBondContact O-N 2.74Å; L31-C43 WeakPolarHBondContact O-CB 3.32Å
32	A	82.6	Confident	81.1	Confident	31 Å²	31	73.9 Å²	73.9	26%	0.256	39%	0.389	S	S	.	.	P	Polyproline II helix	trans	-66.3	120.1	174.5	0	0	0	0	0	110.1	S21 K22 A41	S21-A32 WeakPolarHBondContact O-CB 3.25Å; K22-A32 PolarHBondContact O-N 3.3Å; A32-A41 HydrophobicContact CB-CB 3.69Å
33	A	82.6	Confident	82	Confident	64 Å²	64	65.7 Å²	65.7	53%	0.529	36%	0.355	S	S	.	.			trans	-96.8	-28.5	176.6	0	0	0	0	0	112	L31 Y42 M304	L31-A33 PolarHBondContact O-N 2.74Å; A33-Y42 PolarHBondContact N-O 3.16Å; A33-M304 HydrophobicContact CB-SD 4.32Å
34	V	83.6	Confident	82.3	Confident	10 Å²	10	66 Å²	66	6%	0.061	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	136.4	-175.7	178.3	0	0	0	0	110	I36 A41 Y42 Y300 M304	V34-I36 HydrophobicContact CG1-CG1 4.22Å; V34-A41 WeakPolarHBondContact O-CA 3.34Å; V34-Y42 PolarHBondContact N-O 3.38Å; V34-Y42 PolarHBondContact O-N 3.16Å; V34-Y300 HydrophobicContact CG1-CD2 3.4Å; V34-Y300 VanDerWaalsContact CG1-CD2 3.4Å; V34-Y300 HydrophobicContact CG1-CE2 3.96Å; V34-Y300 HydrophobicContact CG1-CG 3.8Å; V34-M304 HydrophobicContact CG2-CE 3.86Å; V34-M304 HydrophobicContact CG2-SD 3.87Å
35	V	83.6	Confident	82.5	Confident	46 Å²	46	73 Å²	73	28%	0.279	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	108.7	172.6	-177.2	0	0	0	0	108.8	A20 R37 A41 K296	A20-V35 HydrophobicContact CB-CG2 4.05Å; V35-R37 WeakPolarHBondContact CG1-O 3.19Å; V35-A41 HydrophobicContact CG2-CB 4.23Å; V35-K296 PolarHBondContact O-NZ 3.5Å
36	I	78	Confident	82.6	Confident	16 Å²	16	70.5 Å²	70.5	8%	0.082	37%	0.368	C	S	.	.	S	Bend	trans	-79.6	-53	-177.5	-56.2	171.3	0	0	0	109.4	V34 D40 Y42 F47 K296 E297	V34-I36 HydrophobicContact CG1-CG1 4.22Å; I36-D40 PolarHBondContact N-O 3.31Å; I36-D40 VanDerWaalsContact N-O 3.09Å; I36-Y42 HydrophobicContact CD1-CD2 3.73Å; I36-Y42 HydrophobicContact CD1-CE2 3.71Å; I36-Y42 HydrophobicContact CG1-CD2 4.26Å; I36-Y42 HydrophobicContact CG1-CE2 4.48Å; I36-F47 HydrophobicContact CD1-CD2 3.85Å; I36-F47 HydrophobicContact CD1-CE2 3.51Å; I36-F47 HydrophobicContact CG1-CD2 4.5Å; I36-F47 HydrophobicContact CG1-CE2 4.04Å; I36-K296 PolarHBondContact O-NZ 3.49Å; I36-K296 VanDerWaalsContact O-NZ 3.11Å; I36-E297 HydrophobicContact CB-CG 4.4Å; I36-E297 HydrophobicContact CD1-CG 4.14Å; I36-E297 HydrophobicContact CG1-CG 4.21Å; I36-E297 HydrophobicContact CG2-CG 3.33Å
37	R	75.8	Confident	82.9	Confident	104 Å²	104	65.3 Å²	65.3	39%	0.392	35%	0.345	S	S	.	.	S	Bend	trans	-128.2	163.6	176.4	-63.1	174.3	176.5	-176.1	-5.4	109.5	V35 G39 D40	V35-R37 WeakPolarHBondContact CG1-O 3.19Å; R37-G39 PolarHBondContact O-N 3.19Å; R37-G39 VanDerWaalsContact O-N 3.1Å; R37-D40 HydrophobicContact CB-CB 4.12Å; R37-D40 PolarHBondContact O-N 3.33Å
38	A	67.3	Low	83.1	Confident	63 Å²	63	68.5 Å²	68.5	52%	0.521	35%	0.352	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.6	118.2	170.7	0	0	0	0	0	109.3	P18	P18-A38 HydrophobicContact CB-CB 3.94Å; P18-A38 HydrophobicContact CG-CB 4.08Å
39	G	68.3	Low	83.4	Confident	55 Å²	55	66.2 Å²	66.2	57%	0.567	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	92	-15.2	-176.5	0	0	0	0	0	116.2	V25 R37 A41	V25-G39 WeakPolarHBondContact CG2-O 3.4Å; R37-G39 PolarHBondContact O-N 3.19Å; R37-G39 VanDerWaalsContact O-N 3.1Å; G39-A41 PolarHBondContact O-N 2.73Å
40	D	79.2	Confident	83.8	Confident	54 Å²	54	60.1 Å²	60.1	29%	0.289	32%	0.319	S	S	.	.			trans	-99.3	77	-179.4	-78.9	-28.9	0	0	0	111.3	I36 R37 Y42	I36-D40 PolarHBondContact N-O 3.31Å; I36-D40 VanDerWaalsContact N-O 3.09Å; R37-D40 HydrophobicContact CB-CB 4.12Å; R37-D40 PolarHBondContact O-N 3.33Å; D40-Y42 HydrophobicContact CB-CE2 4.02Å
41	A	85.3	Confident	84.1	Confident	1 Å²	1	55.6 Å²	55.6	1%	0.008	30%	0.298	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.9	123.2	-178.9	0	0	0	0	0	111.9	S21 C24 V25 A32 V34 V35 G39	S21-A41 WeakPolarHBondContact OG-CB 3.3Å; C24-A41 WeakPolarHBondContact CA-O 3.41Å; V25-A41 HydrophobicContact CG2-CB 4.37Å; V25-A41 WeakPolarHBondContact CG2-O 3.16Å; V25-A41 PolarHBondContact N-O 3.34Å; A32-A41 HydrophobicContact CB-CB 3.69Å; V34-A41 WeakPolarHBondContact O-CA 3.34Å; V35-A41 HydrophobicContact CG2-CB 4.23Å; G39-A41 PolarHBondContact O-N 2.73Å
42	Y	87.4	Confident	84.4	Confident	46 Å²	46	51.4 Å²	51.4	18%	0.18	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.5	143.6	-177.2	-64.5	-86.1	0	0	0	112.3	K26 A33 V34 I36 D40 C46	K26-Y42 HydrophobicContact CB-CD1 4.42Å; K26-Y42 HydrophobicContact CB-CE1 4.41Å; A33-Y42 PolarHBondContact N-O 3.16Å; V34-Y42 PolarHBondContact N-O 3.38Å; V34-Y42 PolarHBondContact O-N 3.16Å; I36-Y42 HydrophobicContact CD1-CD2 3.73Å; I36-Y42 HydrophobicContact CD1-CE2 3.71Å; I36-Y42 HydrophobicContact CG1-CD2 4.26Å; I36-Y42 HydrophobicContact CG1-CE2 4.48Å; D40-Y42 HydrophobicContact CB-CE2 4.02Å; Y42-C46 HydrophobicContact CD1-CB 4.46Å
43	C	90.4	Very high	84.7	Confident	7 Å²	7	56.3 Å²	56.3	5%	0.047	29%	0.293	C	S	.	.			trans	-75.9	165.3	163.8	75.2	0	0	0	0	110.2	C24 E30 L31 K45 C46 F47	C24-C43 HydrophobicContact CB-CB 3.84Å; C24-C43 PolarHBondContact SG-N 3.47Å; E30-C43 HydrophobicContact CB-CB 3.55Å; E30-C43 HydrophobicContact CG-CB 4.46Å; L31-C43 WeakPolarHBondContact O-CB 3.32Å; C43-K45 VanDerWaalsContact C-N 3.34Å; C43-K45 PolarHBondContact O-N 2.91Å; C43-C46 PolarHBondContact O-N 2.97Å; C43-C46 VanDerWaalsContact SG-CB 3.59Å; C43-C46 PolarHBondContact SG-N 2.62Å; C43-C46 VanDerWaalsContact SG-N 3.43Å; C43-F47 VanDerWaalsContact O-CB 3.31Å; C43-F47 WeakPolarHBondContact O-CB 3.45Å; C43-F47 PolarHBondContact O-N 3.17Å
44	R	89.9	Confident	85.1	Confident	134 Å²	134	55.9 Å²	55.9	51%	0.506	28%	0.279	S	S	.	.	H	α-helix	trans	-56.4	-42.9	-177.1	-177	164.9	-173.6	-164.5	2.5	113.5	R48 M304 F305	R44-R48 PolarHBondContact O-N 3.31Å; R44-M304 HydrophobicContact CB-CE 4.23Å; R44-M304 HydrophobicContact CB-SD 3.78Å; R44-M304 HydrophobicContact CG-CE 3.96Å; R44-M304 HydrophobicContact CG-CG 3.82Å; R44-M304 HydrophobicContact CG-SD 3.56Å; R44-M304 VanDerWaalsContact CG-SD 3.56Å; R44-M304 PolarHBondContact NE-O 2.66Å; R44-M304 PolarHBondContact NH2-O 2.83Å; R44-F305 HydrophobicContact CG-CE1 4.04Å; R44-F305 HydrophobicContact CG-CZ 4.01Å
45	K	90.1	Very high	85.4	Confident	148 Å²	148	55.5 Å²	55.5	64%	0.643	28%	0.277	S	S	*	.	H	α-helix	trans	-69.1	-53.1	-178.9	-65.9	178.1	-178.1	169.9	0	111.7	C43 F47 R48 E49	C43-K45 VanDerWaalsContact C-N 3.34Å; C43-K45 PolarHBondContact O-N 2.91Å; K45-F47 VanDerWaalsContact C-N 3.25Å; K45-F47 PolarHBondContact O-N 3.46Å; K45-R48 WeakPolarHBondContact O-CB 3.31Å; K45-R48 PolarHBondContact O-N 2.93Å; K45-R48 VanDerWaalsContact O-N 3.1Å; K45-E49 PolarHBondContact O-N 2.87Å; K45-E49 VanDerWaalsContact O-N 3.11Å
46	C	89.6	Confident	85.5	Confident	13 Å²	13	56 Å²	56	9%	0.088	27%	0.274	C	S	.	.	H	α-helix	trans	-62	-34.1	-179.4	-69.7	0	0	0	0	112.7	K26 Y42 C43 S50	K26-C46 HydrophobicContact CB-CB 4.01Å; K26-C46 HydrophobicContact CD-CB 3.82Å; K26-C46 HydrophobicContact CG-CB 4.45Å; Y42-C46 HydrophobicContact CD1-CB 4.46Å; C43-C46 PolarHBondContact O-N 2.97Å; C43-C46 VanDerWaalsContact SG-CB 3.59Å; C43-C46 PolarHBondContact SG-N 2.62Å; C43-C46 VanDerWaalsContact SG-N 3.43Å; C46-S50 WeakPolarHBondContact O-CB 3.46Å; C46-S50 PolarHBondContact O-N 2.88Å; C46-S50 PolarHBondContact O-OG 3.48Å
47	F	90.8	Very high	86	Confident	2 Å²	2	56.5 Å²	56.5	1%	0.009	28%	0.281	C	S	.	.	H	α-helix	trans	-66.8	-42.6	174	-178	-109.5	0	0	0	112.2	I36 C43 K45 E49 S50 F51 Y301 M304 F305	I36-F47 HydrophobicContact CD1-CD2 3.85Å; I36-F47 HydrophobicContact CD1-CE2 3.51Å; I36-F47 HydrophobicContact CG1-CD2 4.5Å; I36-F47 HydrophobicContact CG1-CE2 4.04Å; C43-F47 VanDerWaalsContact O-CB 3.31Å; C43-F47 WeakPolarHBondContact O-CB 3.45Å; C43-F47 PolarHBondContact O-N 3.17Å; K45-F47 VanDerWaalsContact C-N 3.25Å; K45-F47 PolarHBondContact O-N 3.46Å; F47-E49 PolarHBondContact O-N 3.41Å; F47-S50 PolarHBondContact O-N 3.35Å; F47-S50 PolarHBondContact O-OG 3.46Å; F47-F51 HydrophobicContact CE1-CD2 4.48Å; F47-F51 HydrophobicContact CZ-CD2 4.05Å; F47-F51 WeakPolarHBondContact O-CB 3.41Å; F47-F51 PolarHBondContact O-N 3.15Å; F47-Y301 HydrophobicContact CD1-CD2 4.44Å; F47-Y301 AromaticContact CE1-CD2 3.94Å; F47-Y301 HydrophobicContact CE1-CD2 3.94Å; F47-Y301 HydrophobicContact CE1-CG 4.44Å; F47-M304 HydrophobicContact CB-CE 4.12Å; F47-M304 HydrophobicContact CD1-CE 3.28Å; F47-M304 HydrophobicContact CE1-CE 4.01Å; F47-M304 HydrophobicContact CG-CE 4.06Å; F47-F305 HydrophobicContact CD1-CE2 4.11Å
48	R	90.1	Very high	86.5	Confident	104 Å²	104	52.8 Å²	52.8	39%	0.392	27%	0.268	S	S	.	.	H	α-helix	trans	-58	-50	175.9	-167.4	178.4	171.1	172.8	-3.4	111.4	R44 K45 F51 I52 E90 Y301 F305	R44-R48 PolarHBondContact O-N 3.31Å; K45-R48 WeakPolarHBondContact O-CB 3.31Å; K45-R48 PolarHBondContact O-N 2.93Å; K45-R48 VanDerWaalsContact O-N 3.1Å; R48-F51 PolarHBondContact O-N 3.35Å; R48-I52 HydrophobicContact CG-CD1 3.81Å; R48-I52 WeakPolarHBondContact O-CG1 3.35Å; R48-I52 PolarHBondContact O-N 2.73Å; R48-E90 IonicContact CZ-OE1 2.67Å; R48-E90 IonicContact CZ-OE2 2.74Å; R48-E90 IonicContact NE-OE1 2.73Å; R48-E90 IonicContact NE-OE2 2.68Å; R48-E90 VanDerWaalsContact NH2-CD 3.28Å; R48-E90 IonicContact NH2-OE1 3Å; R48-E90 PolarHBondContact NH2-OE1 3.43Å; R48-E90 IonicContact NH2-OE2 3.7Å; R48-E90 PolarHBondContact NH2-OE2 3.46Å; R48-Y301 HydrophobicContact CG-CE2 4.42Å; R48-F305 HydrophobicContact CB-CE1 4.03Å; R48-F305 HydrophobicContact CB-CE2 4.14Å; R48-F305 HydrophobicContact CB-CZ 3.51Å; R48-F305 HydrophobicContact CG-CE1 4.04Å; R48-F305 HydrophobicContact CG-CE2 4.33Å; R48-F305 HydrophobicContact CG-CZ 3.87Å
49	E	89.1	Confident	87.3	Confident	110 Å²	110	50.8 Å²	50.8	51%	0.514	25%	0.248	S	C	.	.	H	α-helix	trans	-63.7	-43.6	-179.6	-70.2	174.8	-179.1	0	0	112.5	K26 K45 F47 F51 I52 H53	K26-E49 IonicContact NZ-OE2 3.13Å; K26-E49 PolarHBondContact NZ-OE2 2.74Å; K45-E49 PolarHBondContact O-N 2.87Å; K45-E49 VanDerWaalsContact O-N 3.11Å; F47-E49 PolarHBondContact O-N 3.41Å; E49-F51 VanDerWaalsContact C-N 3.29Å; E49-F51 PolarHBondContact O-N 3.03Å; E49-I52 PolarHBondContact O-N 3.49Å; E49-H53 WeakPolarHBondContact O-CB 3.48Å; E49-H53 PolarHBondContact O-N 3.2Å
50	S	88.9	Confident	87.9	Confident	35 Å²	35	50.2 Å²	50.2	25%	0.245	24%	0.242	C	C	.	.	H	α-helix	trans	-64.3	-39.5	178	68.5	0	0	0	0	110.8	C46 F47 H53 K54	C46-S50 WeakPolarHBondContact O-CB 3.46Å; C46-S50 PolarHBondContact O-N 2.88Å; C46-S50 PolarHBondContact O-OG 3.48Å; F47-S50 PolarHBondContact O-N 3.35Å; F47-S50 PolarHBondContact O-OG 3.46Å; S50-H53 PolarHBondContact O-N 2.81Å; S50-K54 VanDerWaalsContact O-CB 3.25Å; S50-K54 WeakPolarHBondContact O-CB 3.22Å; S50-K54 PolarHBondContact O-N 2.96Å
51	F	90.6	Very high	88	Confident	4 Å²	4	55.7 Å²	55.7	2%	0.018	26%	0.264	C	S	.	.	H	α-helix	trans	-62.8	-47.2	176	-163.1	-85.2	0	0	0	111.5	F47 R48 E49 F55 Q87 M290 Y293 Y301	F47-F51 HydrophobicContact CE1-CD2 4.48Å; F47-F51 HydrophobicContact CZ-CD2 4.05Å; F47-F51 WeakPolarHBondContact O-CB 3.41Å; F47-F51 PolarHBondContact O-N 3.15Å; R48-F51 PolarHBondContact O-N 3.35Å; E49-F51 VanDerWaalsContact C-N 3.29Å; E49-F51 PolarHBondContact O-N 3.03Å; F51-F55 PolarHBondContact O-N 2.93Å; F51-Q87 HydrophobicContact CD1-CG 4.38Å; F51-Q87 VanDerWaalsContact CD1-NE2 3.35Å; F51-Q87 HydrophobicContact CE1-CG 3.94Å; F51-Q87 PolarHBondContact O-NE2 2.83Å; F51-M290 HydrophobicContact CZ-CE 4.11Å; F51-Y293 AromaticContact CD1-CE1 3.93Å; F51-Y293 HydrophobicContact CD1-CE1 3.93Å; F51-Y293 AromaticContact CD2-CD1 3.73Å; F51-Y293 HydrophobicContact CD2-CD1 3.73Å; F51-Y293 AromaticContact CD2-CE1 3.43Å; F51-Y293 HydrophobicContact CD2-CE1 3.43Å; F51-Y293 VanDerWaalsContact CD2-CE1 3.43Å; F51-Y293 HydrophobicContact CE1-CD1 4.38Å; F51-Y293 AromaticContact CE1-CE1 3.85Å; F51-Y293 HydrophobicContact CE1-CE1 3.85Å; F51-Y293 AromaticContact CE2-CD1 3.27Å; F51-Y293 HydrophobicContact CE2-CD1 3.27Å; F51-Y293 AromaticContact CE2-CE1 3.35Å; F51-Y293 HydrophobicContact CE2-CE1 3.35Å; F51-Y293 HydrophobicContact CE2-CG 4.34Å; F51-Y293 HydrophobicContact CG-CD1 4.45Å; F51-Y293 AromaticContact CG-CE1 3.72Å; F51-Y293 HydrophobicContact CG-CE1 3.72Å; F51-Y293 AromaticContact CZ-CD1 3.63Å; F51-Y293 HydrophobicContact CZ-CD1 3.63Å; F51-Y293 AromaticContact CZ-CE1 3.56Å; F51-Y293 HydrophobicContact CZ-CE1 3.56Å; F51-Y293 HydrophobicContact CZ-CG 4.42Å; F51-Y293 PolarHBondContact O-OH 2.91Å; F51-Y301 HydrophobicContact CB-CD2 3.99Å; F51-Y301 HydrophobicContact CB-CE2 4.07Å; F51-Y301 HydrophobicContact CD1-CD1 4.33Å; F51-Y301 AromaticContact CD1-CD2 3.56Å; F51-Y301 HydrophobicContact CD1-CD2 3.56Å; F51-Y301 HydrophobicContact CD1-CE1 4.31Å; F51-Y301 AromaticContact CD1-CE2 3.55Å; F51-Y301 HydrophobicContact CD1-CE2 3.55Å; F51-Y301 AromaticContact CD1-CG 3.98Å; F51-Y301 HydrophobicContact CD1-CG 3.98Å; F51-Y301 AromaticContact CD1-CZ 3.95Å; F51-Y301 AromaticContact CD2-CD2 3.81Å; F51-Y301 HydrophobicContact CD2-CD2 3.81Å; F51-Y301 HydrophobicContact CD2-CG 4.1Å; F51-Y301 AromaticContact CE1-CD1 3.92Å; F51-Y301 HydrophobicContact CE1-CD1 3.92Å; F51-Y301 AromaticContact CE1-CD2 3.94Å; F51-Y301 HydrophobicContact CE1-CD2 3.94Å; F51-Y301 HydrophobicContact CE1-CE1 4.09Å; F51-Y301 HydrophobicContact CE1-CE2 4.12Å; F51-Y301 AromaticContact CE1-CG 3.85Å; F51-Y301 HydrophobicContact CE1-CG 3.85Å; F51-Y301 HydrophobicContact CE2-CD2 4.14Å; F51-Y301 AromaticContact CE2-CG 3.95Å; F51-Y301 HydrophobicContact CE2-CG 3.95Å; F51-Y301 AromaticContact CG-CD2 3.51Å; F51-Y301 HydrophobicContact CG-CD2 3.51Å; F51-Y301 AromaticContact CG-CE2 3.83Å; F51-Y301 HydrophobicContact CG-CE2 3.83Å; F51-Y301 HydrophobicContact CG-CG 4.13Å; F51-Y301 HydrophobicContact CZ-CD1 4.1Å; F51-Y301 HydrophobicContact CZ-CD2 4.22Å; F51-Y301 AromaticContact CZ-CG 3.84Å; F51-Y301 HydrophobicContact CZ-CG 3.84Å
52	I	89.4	Confident	87.7	Confident	33 Å²	33	58 Å²	58	17%	0.169	28%	0.278	C	S	.	.	H	α-helix	trans	-66.4	-44.7	176.5	-65.9	164.5	0	0	0	111.9	R48 E49 K54 F55 R56 E90	R48-I52 HydrophobicContact CG-CD1 3.81Å; R48-I52 WeakPolarHBondContact O-CG1 3.35Å; R48-I52 PolarHBondContact O-N 2.73Å; E49-I52 PolarHBondContact O-N 3.49Å; I52-K54 VanDerWaalsContact C-N 3.31Å; I52-K54 PolarHBondContact O-N 3.06Å; I52-F55 PolarHBondContact O-N 3.5Å; I52-R56 HydrophobicContact CG2-CG 4.31Å; I52-R56 VanDerWaalsContact O-CG 3.3Å; I52-R56 WeakPolarHBondContact O-CG 3.19Å; I52-R56 PolarHBondContact O-N 3.11Å; I52-R56 VanDerWaalsContact O-N 3.1Å; I52-E90 VanDerWaalsContact CD1-CD 3.49Å; I52-E90 VanDerWaalsContact CD1-OE1 3.22Å; I52-E90 WeakPolarHBondContact CD1-OE1 3.44Å
53	H	88.8	Confident	87.3	Confident	133 Å²	133	62.8 Å²	62.8	62%	0.616	30%	0.296	S	S	*	.	H	α-helix	trans	-60.6	-41.7	179.4	-178.6	-91.3	0	0	0	111.5	E49 S50 F55 R56 A57	E49-H53 WeakPolarHBondContact O-CB 3.48Å; E49-H53 PolarHBondContact O-N 3.2Å; S50-H53 PolarHBondContact O-N 2.81Å; H53-F55 VanDerWaalsContact C-N 3.35Å; H53-F55 PolarHBondContact O-N 2.78Å; H53-R56 PolarHBondContact O-N 3.38Å; H53-A57 WeakPolarHBondContact O-CB 3.18Å; H53-A57 PolarHBondContact O-N 3.39Å
54	K	90.4	Very high	86.7	Confident	56 Å²	56	63.9 Å²	63.9	24%	0.243	30%	0.302	C	S	.	.	H	α-helix	trans	-58.9	-44	177.1	-174.3	171.5	178.5	-179.4	0	111.7	S50 I52 M58 E292 Y293 E297	S50-K54 VanDerWaalsContact O-CB 3.25Å; S50-K54 WeakPolarHBondContact O-CB 3.22Å; S50-K54 PolarHBondContact O-N 2.96Å; I52-K54 VanDerWaalsContact C-N 3.31Å; I52-K54 PolarHBondContact O-N 3.06Å; K54-M58 VanDerWaalsContact O-CG 3.31Å; K54-M58 WeakPolarHBondContact O-CG 3.5Å; K54-M58 PolarHBondContact O-N 2.9Å; K54-M58 VanDerWaalsContact O-N 3.08Å; K54-E292 HydrophobicContact CD-CB 4.45Å; K54-E292 WeakPolarHBondContact CE-O 3.29Å; K54-E292 HydrophobicContact CG-CB 4.38Å; K54-E292 PolarHBondContact NZ-O 2.95Å; K54-Y293 HydrophobicContact CB-CE1 4.29Å; K54-Y293 WeakPolarHBondContact CB-OH 3.48Å; K54-Y293 HydrophobicContact CD-CD1 4.2Å; K54-Y293 HydrophobicContact CD-CE1 3.81Å; K54-Y293 HydrophobicContact CG-CE1 4.18Å; K54-Y293 HydrophobicContact CG-CE2 4.32Å; K54-E297 IonicContact NZ-OE1 3.54Å; K54-E297 PolarHBondContact NZ-OE1 2.89Å; K54-E297 IonicContact NZ-OE2 2.89Å
55	F	90.2	Very high	86.4	Confident	2 Å²	2	58.4 Å²	58.4	1%	0.009	28%	0.283	C	S	.	.	H	α-helix	trans	-63.2	-48.8	179.4	-178.6	-102.1	0	0	0	110.7	F51 I52 H53 M58 L59 M84 Q87 V88 L100 P289 M290 Y293	F51-F55 PolarHBondContact O-N 2.93Å; I52-F55 PolarHBondContact O-N 3.5Å; H53-F55 VanDerWaalsContact C-N 3.35Å; H53-F55 PolarHBondContact O-N 2.78Å; F55-M58 WeakPolarHBondContact O-CB 3.33Å; F55-M58 PolarHBondContact O-N 3.28Å; F55-L59 HydrophobicContact CD1-CD1 4.07Å; F55-L59 HydrophobicContact CE1-CD1 3.53Å; F55-L59 HydrophobicContact CE1-CG 4.48Å; F55-L59 HydrophobicContact CZ-CD1 3.94Å; F55-L59 PolarHBondContact O-N 3.39Å; F55-M84 HydrophobicContact CE2-CG 4.35Å; F55-Q87 HydrophobicContact CD1-CB 4.11Å; F55-Q87 HydrophobicContact CD2-CB 4.22Å; F55-Q87 HydrophobicContact CE1-CB 4.16Å; F55-Q87 HydrophobicContact CE2-CB 4.26Å; F55-Q87 HydrophobicContact CG-CB 4.15Å; F55-Q87 HydrophobicContact CZ-CB 4.25Å; F55-V88 HydrophobicContact CE1-CG2 4.26Å; F55-V88 HydrophobicContact CZ-CG2 3.76Å; F55-L100 HydrophobicContact CE1-CD1 4.27Å; F55-P289 HydrophobicContact CD2-CB 4.1Å; F55-P289 HydrophobicContact CE2-CB 3.54Å; F55-P289 HydrophobicContact CE2-CG 3.8Å; F55-P289 HydrophobicContact CZ-CB 4.19Å; F55-P289 HydrophobicContact CZ-CG 4.35Å; F55-M290 HydrophobicContact CD2-SD 4.08Å; F55-M290 HydrophobicContact CE2-SD 4.26Å; F55-Y293 VanDerWaalsContact CA-OH 3.24Å; F55-Y293 WeakPolarHBondContact CA-OH 3.3Å; F55-Y293 WeakPolarHBondContact CB-OH 3.22Å; F55-Y293 PolarHBondContact N-OH 3.15Å
56	R	86.7	Confident	85.9	Confident	55 Å²	55	52.6 Å²	52.6	21%	0.208	26%	0.257	C	S	.	.	H	α-helix	trans	-68.7	-38.7	-177.4	-64.1	171.5	60.8	73.8	32.8	112.1	I52 H53 M58 L59 G60 H97 K98	I52-R56 HydrophobicContact CG2-CG 4.31Å; I52-R56 VanDerWaalsContact O-CG 3.3Å; I52-R56 WeakPolarHBondContact O-CG 3.19Å; I52-R56 PolarHBondContact O-N 3.11Å; I52-R56 VanDerWaalsContact O-N 3.1Å; H53-R56 PolarHBondContact O-N 3.38Å; R56-M58 VanDerWaalsContact C-N 3.3Å; R56-M58 PolarHBondContact O-N 3.47Å; R56-L59 PolarHBondContact O-N 2.89Å; R56-G60 PolarHBondContact O-N 3.5Å; R56-H97 VanDerWaalsContact CZ-O 3.3Å; R56-H97 PolarHBondContact NH1-O 2.81Å; R56-H97 PolarHBondContact NH2-O 2.84Å; R56-K98 PolarHBondContact NH1-O 3.38Å; R56-K98 PolarHBondContact NH2-O 2.78Å
57	A	87.1	Confident	85.4	Confident	28 Å²	28	53.1 Å²	53.1	23%	0.231	26%	0.261	C	S	.	.	H	α-helix	trans	-62.6	-38.3	174.7	0	0	0	0	0	111.3	H53 G60 K61	H53-A57 WeakPolarHBondContact O-CB 3.18Å; H53-A57 PolarHBondContact O-N 3.39Å; A57-G60 PolarHBondContact O-N 3.06Å; A57-K61 WeakPolarHBondContact O-CB 3.13Å; A57-K61 WeakPolarHBondContact O-CG 3.15Å; A57-K61 PolarHBondContact O-N 2.87Å
58	M	86.4	Confident	84.9	Confident	26 Å²	26	54.7 Å²	54.7	13%	0.128	28%	0.278	C	S	.	.	H	α-helix	trans	-64	-45.1	176	-73.8	-56	-66.4	0	0	112.6	K54 F55 R56 T62 F276 E292	K54-M58 VanDerWaalsContact O-CG 3.31Å; K54-M58 WeakPolarHBondContact O-CG 3.5Å; K54-M58 PolarHBondContact O-N 2.9Å; K54-M58 VanDerWaalsContact O-N 3.08Å; F55-M58 WeakPolarHBondContact O-CB 3.33Å; F55-M58 PolarHBondContact O-N 3.28Å; R56-M58 VanDerWaalsContact C-N 3.3Å; R56-M58 PolarHBondContact O-N 3.47Å; M58-T62 WeakPolarHBondContact O-CG2 3.43Å; M58-T62 PolarHBondContact O-N 2.87Å; M58-T62 PolarHBondContact O-OG1 2.6Å; M58-F276 HydrophobicContact CE-CD2 4.13Å; M58-F276 HydrophobicContact CE-CE2 4.29Å; M58-E292 HydrophobicContact CE-CG 3.88Å; M58-E292 HydrophobicContact CG-CG 4.04Å; M58-E292 HydrophobicContact SD-CG 3.54Å; M58-E292 VanDerWaalsContact SD-CG 3.54Å
59	L	85.1	Confident	84.7	Confident	20 Å²	20	51.7 Å²	51.7	11%	0.105	27%	0.268	C	S	.	.	H	α-helix	trans	-64.3	-42	174.8	-66.3	178	0	0	0	111.8	F55 R56 T62 R63 I65 L100 M246 F276 P289	F55-L59 HydrophobicContact CD1-CD1 4.07Å; F55-L59 HydrophobicContact CE1-CD1 3.53Å; F55-L59 HydrophobicContact CE1-CG 4.48Å; F55-L59 HydrophobicContact CZ-CD1 3.94Å; F55-L59 PolarHBondContact O-N 3.39Å; R56-L59 PolarHBondContact O-N 2.89Å; L59-T62 PolarHBondContact O-OG1 2.81Å; L59-R63 PolarHBondContact O-N 3.48Å; L59-R63 VanDerWaalsContact O-N 3.11Å; L59-I65 HydrophobicContact CD2-CD1 4.08Å; L59-L100 HydrophobicContact CD1-CD1 4.33Å; L59-L100 HydrophobicContact CD1-CD2 4.1Å; L59-M246 HydrophobicContact CD1-CE 4.47Å; L59-M246 HydrophobicContact CD2-CE 4.05Å; L59-F276 HydrophobicContact CD2-CZ 4.48Å; L59-P289 HydrophobicContact CD2-CB 4.06Å
60	G	80.4	Confident	84.8	Confident	43 Å²	43	50.9 Å²	50.9	44%	0.443	26%	0.263	S	S	.	.	H	α-helix	trans	-71.8	-31.1	-178	0	0	0	0	0	115	R56 A57 R63	R56-G60 PolarHBondContact O-N 3.5Å; A57-G60 PolarHBondContact O-N 3.06Å; G60-R63 VanDerWaalsContact O-CG 3.22Å; G60-R63 WeakPolarHBondContact O-CG 3.32Å
61	K	82.3	Confident	84.9	Confident	169 Å²	169	49.2 Å²	49.2	74%	0.735	25%	0.251	S	S	*	.	H	α-helix	trans	-71.6	-38.8	176.6	-77.6	173.9	-178.6	-174.8	0	112.2	A57	A57-K61 WeakPolarHBondContact O-CB 3.13Å; A57-K61 WeakPolarHBondContact O-CG 3.15Å; A57-K61 PolarHBondContact O-N 2.87Å
62	T	78.4	Confident	85.1	Confident	50 Å²	50	49 Å²	49	31%	0.307	25%	0.25	S	S	.	.	H	α-helix	trans	-86.7	-28.8	-172.9	54	0	0	0	0	112.6	M58 L59 V64 F276	M58-T62 WeakPolarHBondContact O-CG2 3.43Å; M58-T62 PolarHBondContact O-N 2.87Å; M58-T62 PolarHBondContact O-OG1 2.6Å; L59-T62 PolarHBondContact O-OG1 2.81Å; T62-V64 PolarHBondContact O-N 3.42Å; T62-V64 VanDerWaalsContact O-N 3.15Å; T62-F276 HydrophobicContact CG2-CD1 3.66Å; T62-F276 HydrophobicContact CG2-CD2 3.98Å; T62-F276 HydrophobicContact CG2-CE1 3.71Å; T62-F276 HydrophobicContact CG2-CE2 4.01Å; T62-F276 HydrophobicContact CG2-CG 3.8Å; T62-F276 HydrophobicContact CG2-CZ 3.89Å; T62-F276 WeakPolarHBondContact OG1-CE1 3.04Å; T62-F276 WeakPolarHBondContact OG1-CZ 3.49Å
63	R	78.9	Confident	85.4	Confident	146 Å²	146	47.4 Å²	47.4	55%	0.551	24%	0.242	S	C	*	.			trans	51.3	35.3	176.2	-57.3	-175	-178.9	175.3	0.2	113.9	L59 G60 Y170	L59-R63 PolarHBondContact O-N 3.48Å; L59-R63 VanDerWaalsContact O-N 3.11Å; G60-R63 VanDerWaalsContact O-CG 3.22Å; G60-R63 WeakPolarHBondContact O-CG 3.32Å; R63-Y170 HydrophobicContact CB-CD1 4.38Å; R63-Y170 HydrophobicContact CB-CD2 4.12Å; R63-Y170 HydrophobicContact CB-CE1 4.48Å; R63-Y170 HydrophobicContact CB-CE2 4.23Å; R63-Y170 HydrophobicContact CB-CG 4.21Å; R63-Y170 HydrophobicContact CG-CD1 4.38Å; R63-Y170 HydrophobicContact CG-CE1 4.31Å
64	V	78.4	Confident	85.7	Confident	31 Å²	31	41.8 Å²	41.8	19%	0.188	22%	0.218	C	C	.	.			trans	-81.4	-25.8	-177.9	178.4	0	0	0	0	112	T62 K244 F276 T285 V287	T62-V64 PolarHBondContact O-N 3.42Å; T62-V64 VanDerWaalsContact O-N 3.15Å; V64-K244 HydrophobicContact CG1-CD 4.33Å; V64-K244 WeakPolarHBondContact O-CE 3.4Å; V64-F276 HydrophobicContact CB-CE1 4.31Å; V64-F276 HydrophobicContact CG2-CD1 4.16Å; V64-F276 HydrophobicContact CG2-CE1 3.88Å; V64-T285 HydrophobicContact CG1-CG2 4.17Å; V64-V287 HydrophobicContact CB-CG1 4.4Å; V64-V287 HydrophobicContact CG1-CG1 3.71Å
65	I	82.3	Confident	85.8	Confident	18 Å²	18	39.2 Å²	39.2	9%	0.092	21%	0.208	C	C	.	.	S	Bend	trans	-108.7	116.9	-172.6	-53.1	-179.5	0	0	0	109.5	L59 V71 F102 Y170 K244 M246 V287	L59-I65 HydrophobicContact CD2-CD1 4.08Å; I65-V71 HydrophobicContact CG2-CG2 3.73Å; I65-F102 HydrophobicContact CG2-CB 4.04Å; I65-F102 HydrophobicContact CG2-CD1 3.87Å; I65-F102 HydrophobicContact CG2-CG 4.09Å; I65-Y170 WeakPolarHBondContact O-CE2 3.47Å; I65-K244 HydrophobicContact CG1-CG 4.37Å; I65-M246 HydrophobicContact CD1-CE 3.13Å; I65-V287 HydrophobicContact CD1-CG2 4.33Å
66	F	79.6	Confident	85.8	Confident	26 Å²	26	42.4 Å²	42.4	11%	0.114	23%	0.23	C	C	.	.			trans	-85.8	153.6	-178.2	-63.7	-99.9	0	0	0	111.8	E69 Y170 A173	F66-E69 HydrophobicContact CB-CG 3.91Å; F66-E69 PolarHBondContact N-OE2 3.5Å; F66-E69 PolarHBondContact O-N 2.82Å; F66-Y170 AromaticContact CD1-CD2 3.47Å; F66-Y170 HydrophobicContact CD1-CD2 3.47Å; F66-Y170 VanDerWaalsContact CD1-CD2 3.47Å; F66-Y170 HydrophobicContact CD1-CE2 4.2Å; F66-Y170 HydrophobicContact CD1-CG 4.24Å; F66-Y170 AromaticContact CE1-CD2 3.6Å; F66-Y170 HydrophobicContact CE1-CD2 3.6Å; F66-Y170 HydrophobicContact CE1-CG 4.12Å; F66-Y170 HydrophobicContact CG-CD2 4.07Å; F66-Y170 HydrophobicContact CG-CE2 4.45Å; F66-Y170 HydrophobicContact CZ-CD2 4.26Å; F66-A173 HydrophobicContact CD1-CB 4.23Å
67	P	79.9	Confident	85.7	Confident	24 Å²	24	39.8 Å²	39.8	16%	0.156	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57.2	138.3	169.6	-21.5	32.9	0	0	0	111.6	E69 R101 V174 F177	P67-E69 VanDerWaalsContact C-N 3.32Å; P67-R101 CarbonylContact C-O 3.56Å; P67-R101 VanDerWaalsContact CA-O 3.25Å; P67-R101 WeakPolarHBondContact CA-O 3.28Å; P67-R101 HydrophobicContact CB-CB 3.89Å; P67-V174 HydrophobicContact CG-CG2 3.64Å; P67-F177 HydrophobicContact CB-CB 4.36Å; P67-F177 HydrophobicContact CB-CD1 4.27Å; P67-F177 HydrophobicContact CB-CD2 4.19Å; P67-F177 HydrophobicContact CB-CG 4Å
68	G	79.4	Confident	85.8	Confident	36 Å²	36	39.2 Å²	39.2	37%	0.371	22%	0.217	S	C	.	.	T	Hydrogen-bonded Turn	trans	85.1	-8	-179.2	0	0	0	0	0	115.2	R101	G68-R101 PolarHBondContact N-O 3.19Å
69	E	87.3	Confident	86.1	Confident	41 Å²	41	41.4 Å²	41.4	19%	0.192	23%	0.233	C	C	.	.			trans	-72	146.7	179.5	-69.9	-170.5	140.6	0	0	112.7	F66 P67 F102 F103 K244	F66-E69 HydrophobicContact CB-CG 3.91Å; F66-E69 PolarHBondContact N-OE2 3.5Å; F66-E69 PolarHBondContact O-N 2.82Å; P67-E69 VanDerWaalsContact C-N 3.32Å; E69-F102 WeakPolarHBondContact O-CA 3.29Å; E69-F102 VanDerWaalsContact O-CB 3.32Å; E69-F102 WeakPolarHBondContact O-CB 3.42Å; E69-F103 PolarHBondContact O-N 2.84Å; E69-K244 IonicContact OE1-NZ 3.08Å; E69-K244 PolarHBondContact OE1-NZ 2.86Å; E69-K244 IonicContact OE2-NZ 3.29Å; E69-K244 PolarHBondContact OE2-NZ 3.22Å
70	K	89.6	Confident	86.4	Confident	92 Å²	92	41.3 Å²	41.3	40%	0.4	23%	0.234	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	125.2	168.2	-65.3	-172.8	178.8	-172.9	0	109.7	F103 Y242 S243	K70-F103 WeakPolarHBondContact CA-O 3.48Å; K70-F103 HydrophobicContact CG-CB 4.38Å; K70-Y242 HydrophobicContact CB-CD1 3.59Å; K70-Y242 HydrophobicContact CB-CE1 3.95Å; K70-Y242 HydrophobicContact CB-CG 4.34Å; K70-S243 PolarHBondContact O-N 2.67Å; K70-S243 PolarHBondContact O-OG 3.34Å
71	V	92.3	Very high	87	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.2	123	-178.5	-178.1	0	0	0	0	110.6	I65 L73 F102 F103 P104 G105 K244 M246	I65-V71 HydrophobicContact CG2-CG2 3.73Å; V71-L73 HydrophobicContact CG1-CD2 4.5Å; V71-F102 HydrophobicContact CB-CD2 3.73Å; V71-F102 HydrophobicContact CB-CE2 4.08Å; V71-F102 HydrophobicContact CB-CG 4.46Å; V71-F102 HydrophobicContact CG1-CE2 4.42Å; V71-F102 HydrophobicContact CG2-CB 3.88Å; V71-F102 HydrophobicContact CG2-CD2 3.53Å; V71-F102 HydrophobicContact CG2-CE2 4.19Å; V71-F102 HydrophobicContact CG2-CG 3.76Å; V71-F103 PolarHBondContact N-O 3.3Å; V71-P104 CarbonylContact O-C 3.6Å; V71-P104 WeakPolarHBondContact O-CA 3.47Å; V71-G105 PolarHBondContact O-N 3.17Å; V71-K244 HydrophobicContact CG1-CB 4.19Å; V71-K244 HydrophobicContact CG2-CB 4.17Å; V71-M246 HydrophobicContact CG1-CE 4.02Å; V71-M246 HydrophobicContact CG1-CG 3.56Å; V71-M246 HydrophobicContact CG1-SD 4.03Å
72	L	94.7	Very high	87.5	Confident	0 Å²	0	31.7 Å²	31.7	0%	0	18%	0.181	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.8	128	176.9	-167	61.4	0	0	0	110.6	G105 V107 Y142 T236 A237 Y242 K244 L245 M246	L72-G105 CarbonylContact C-O 3.44Å; L72-V107 HydrophobicContact CD1-CB 3.99Å; L72-V107 HydrophobicContact CD1-CG1 4.12Å; L72-V107 HydrophobicContact CD2-CB 4.11Å; L72-V107 HydrophobicContact CD2-CG1 3.76Å; L72-V107 HydrophobicContact CG-CB 4.1Å; L72-V107 HydrophobicContact CG-CG1 3.67Å; L72-Y142 HydrophobicContact CD1-CD2 4.22Å; L72-Y142 HydrophobicContact CD1-CE2 4.32Å; L72-T236 HydrophobicContact CD2-CG2 4.26Å; L72-A237 HydrophobicContact CD2-CB 3.9Å; L72-Y242 HydrophobicContact CB-CD1 3.88Å; L72-Y242 HydrophobicContact CB-CD2 4.19Å; L72-Y242 HydrophobicContact CB-CG 3.73Å; L72-Y242 HydrophobicContact CD1-CD1 4.43Å; L72-Y242 HydrophobicContact CD1-CD2 4.06Å; L72-Y242 HydrophobicContact CD1-CE1 4.31Å; L72-Y242 HydrophobicContact CD1-CE2 3.91Å; L72-Y242 HydrophobicContact CD1-CG 4.35Å; L72-Y242 HydrophobicContact CD2-CD2 4.33Å; L72-Y242 HydrophobicContact CG-CD2 4.44Å; L72-Y242 HydrophobicContact CG-CG 4.46Å; L72-K244 PolarHBondContact N-O 3.21Å; L72-L245 HydrophobicContact CB-CD1 4Å; L72-L245 HydrophobicContact CD2-CD1 4.03Å; L72-L245 HydrophobicContact CG-CD1 4.05Å; L72-L245 CarbonylContact O-C 3.5Å; L72-L245 WeakPolarHBondContact O-CA 3.48Å; L72-M246 PolarHBondContact O-N 3.47Å
73	L	95	Very high	88.2	Confident	0 Å²	0	29.3 Å²	29.3	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	112.6	179.3	-56.3	176	0	0	0	109.1	V71 V75 M84 L85 V88 P104 G105 I106 V107 M246	V71-L73 HydrophobicContact CG1-CD2 4.5Å; L73-V75 HydrophobicContact CB-CG2 4.25Å; L73-V75 PolarHBondContact O-N 2.94Å; L73-M84 HydrophobicContact CB-CE 4.45Å; L73-M84 HydrophobicContact CD2-CE 4.47Å; L73-L85 HydrophobicContact CD1-CD1 3.78Å; L73-V88 HydrophobicContact CD1-CB 4.23Å; L73-V88 HydrophobicContact CD1-CG1 3.99Å; L73-V88 HydrophobicContact CD1-CG2 4.45Å; L73-V88 HydrophobicContact CD2-CG2 4.06Å; L73-P104 HydrophobicContact CD1-CB 4.03Å; L73-P104 HydrophobicContact CG-CB 4.47Å; L73-G105 WeakPolarHBondContact CB-O 3.36Å; L73-G105 WeakPolarHBondContact CG-O 3.23Å; L73-G105 PolarHBondContact N-O 3.39Å; L73-I106 HydrophobicContact CD1-CG1 4.42Å; L73-V107 PolarHBondContact O-N 3.1Å; L73-M246 HydrophobicContact CD2-CB 3.75Å; L73-M246 HydrophobicContact CD2-CG 3.86Å; L73-M246 HydrophobicContact CD2-SD 3.39Å; L73-M246 WeakPolarHBondContact CD2-SD 3.37Å
74	A	94.8	Very high	89	Confident	14 Å²	14	22.3 Å²	22.3	12%	0.116	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	102.9	172	0	0	0	0	0	109.7	V107 L233 L245 M246 Q247	A74-V107 HydrophobicContact CB-CG1 4.34Å; A74-L233 HydrophobicContact CB-CD1 4.08Å; A74-L233 HydrophobicContact CB-CD2 3.92Å; A74-L245 HydrophobicContact CB-CD1 4.23Å; A74-M246 WeakPolarHBondContact CB-O 3.05Å; A74-M246 PolarHBondContact N-O 3.39Å; A74-Q247 HydrophobicContact CB-CG 4.37Å
75	V	93.3	Very high	89.7	Confident	3 Å²	3	21.1 Å²	21.1	2%	0.018	13%	0.133	C	C	.	.			trans	-108	120.7	179.7	-175.8	0	0	0	0	108.6	L73 L85 I106 V107 Y108 F134	L73-V75 HydrophobicContact CB-CG2 4.25Å; L73-V75 PolarHBondContact O-N 2.94Å; V75-L85 HydrophobicContact CG2-CB 4.26Å; V75-L85 HydrophobicContact CG2-CD2 4.33Å; V75-I106 HydrophobicContact CB-CG2 4.15Å; V75-I106 HydrophobicContact CG2-CG2 3.89Å; V75-V107 PolarHBondContact N-O 3.16Å; V75-Y108 WeakPolarHBondContact O-CA 3.38Å; V75-Y108 VanDerWaalsContact O-CD2 3.28Å; V75-Y108 WeakPolarHBondContact O-CD2 3.47Å; V75-F134 HydrophobicContact CB-CE1 4.06Å; V75-F134 HydrophobicContact CB-CZ 4.15Å; V75-F134 HydrophobicContact CG1-CE1 3.79Å; V75-F134 HydrophobicContact CG1-CZ 4.04Å
76	S	89.5	Confident	90.1	Very high	69 Å²	69	21.6 Å²	21.6	48%	0.483	14%	0.138	S	C	.	.			trans	-100.2	5.1	-178.8	78.1	0	0	0	0	112.9	G78 S81 I312	S76-G78 PolarHBondContact O-N 2.88Å; S76-G78 PolarHBondContact OG-N 3.19Å; S76-S81 PolarHBondContact N-OG 3.23Å; S76-S81 VanDerWaalsContact N-OG 3.1Å; S76-S81 PolarHBondContact OG-OG 3.19Å; S76-I312 VanDerWaalsContact O-CD1 3.22Å; S76-I312 WeakPolarHBondContact O-CD1 3.22Å
77	G	85.7	Confident	90.6	Very high	0 Å²	0	20.6 Å²	20.6	0%	0	13%	0.133	C	C	.	.	S	Bend	trans	77.1	-13	-170.4	0	0	0	0	0	114.7	S81 C82 V310	G77-S81 PolarHBondContact N-OG 3.26Å; G77-C82 PolarHBondContact O-SG 2.79Å; G77-C82 VanDerWaalsContact O-SG 3.38Å; G77-V310 PolarHBondContact O-N 3.31Å; G77-V310 VanDerWaalsContact O-O 3.04Å
78	G	88.9	Confident	91.1	Very high	16 Å²	16	19.4 Å²	19.4	17%	0.165	13%	0.126	C	C	.	.	S	Bend	trans	-73	161.2	178.8	0	0	0	0	0	113.1	S76 S80 S81 C82	S76-G78 PolarHBondContact O-N 2.88Å; S76-G78 PolarHBondContact OG-N 3.19Å; G78-S80 PolarHBondContact O-N 3.26Å; G78-S81 PolarHBondContact N-OG 3.48Å; G78-S81 PolarHBondContact O-N 2.93Å; G78-S81 VanDerWaalsContact O-N 3.12Å; G78-S81 PolarHBondContact O-OG 3.1Å; G78-C82 PolarHBondContact O-N 3.36Å; G78-C82 PolarHBondContact O-SG 3.44Å
79	P	91.6	Very high	91.6	Very high	71 Å²	71	21 Å²	21	46%	0.461	12%	0.124	S	C	.	.	H	α-helix	trans	-57.9	-42.9	-169.2	21.1	-33.4	0	0	0	113.3	S83 I298 N302	P79-S83 PolarHBondContact O-N 3.39Å; P79-S83 PolarHBondContact O-OG 3.03Å; P79-I298 HydrophobicContact CB-CG2 4.22Å; P79-N302 WeakPolarHBondContact CA-ND2 3.41Å; P79-N302 VanDerWaalsContact CB-ND2 3.32Å; P79-N302 WeakPolarHBondContact CB-ND2 3.37Å; P79-N302 PolarHBondContact O-ND2 2.97Å
80	S	92.8	Very high	91.6	Very high	18 Å²	18	21.6 Å²	21.6	13%	0.126	13%	0.127	C	C	.	.	H	α-helix	trans	-66.4	-40.2	-179.5	-169.1	0	0	0	0	112.8	G78 M84 G248 I298	G78-S80 PolarHBondContact O-N 3.26Å; S80-M84 PolarHBondContact O-N 2.91Å; S80-G248 WeakPolarHBondContact CB-O 3.37Å; S80-G248 PolarHBondContact OG-O 3.45Å; S80-I298 WeakPolarHBondContact OG-CD1 3.16Å
81	S	92.8	Very high	91.3	Very high	7 Å²	7	17.5 Å²	17.5	5%	0.049	11%	0.11	C	C	.	.	H	α-helix	trans	-72.8	-35.4	179.8	69.4	0	0	0	0	112.6	S76 G77 G78 M84 L85	S76-S81 PolarHBondContact N-OG 3.23Å; S76-S81 VanDerWaalsContact N-OG 3.1Å; S76-S81 PolarHBondContact OG-OG 3.19Å; G77-S81 PolarHBondContact N-OG 3.26Å; G78-S81 PolarHBondContact N-OG 3.48Å; G78-S81 PolarHBondContact O-N 2.93Å; G78-S81 VanDerWaalsContact O-N 3.12Å; G78-S81 PolarHBondContact O-OG 3.1Å; S81-M84 WeakPolarHBondContact O-CB 3.22Å; S81-M84 PolarHBondContact O-N 3.09Å; S81-L85 PolarHBondContact O-N 3.41Å
82	C	92.9	Very high	90.9	Very high	3 Å²	3	18.8 Å²	18.8	2%	0.02	12%	0.118	C	C	.	.	H	α-helix	trans	-70.8	-38.3	173.6	-65.7	0	0	0	0	112.2	G77 G78 M84 L85 S86 V307 P308	G77-C82 PolarHBondContact O-SG 2.79Å; G77-C82 VanDerWaalsContact O-SG 3.38Å; G78-C82 PolarHBondContact O-N 3.36Å; G78-C82 PolarHBondContact O-SG 3.44Å; C82-M84 VanDerWaalsContact C-N 3.31Å; C82-M84 PolarHBondContact O-N 3.24Å; C82-L85 PolarHBondContact O-N 2.57Å; C82-S86 PolarHBondContact O-N 3.1Å; C82-V307 HydrophobicContact CB-CG1 4.09Å; C82-P308 WeakPolarHBondContact CB-O 3.2Å; C82-P308 PolarHBondContact SG-O 3.37Å
83	S	93.4	Very high	90.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	13%	0.134	C	C	.	.	H	α-helix	trans	-60.2	-44.2	171.3	-49.9	0	0	0	0	110.8	P79 L85 S86 Q87 I298 N302	P79-S83 PolarHBondContact O-N 3.39Å; P79-S83 PolarHBondContact O-OG 3.03Å; S83-L85 VanDerWaalsContact C-N 3.32Å; S83-L85 PolarHBondContact O-N 3.31Å; S83-S86 PolarHBondContact O-N 3.19Å; S83-Q87 WeakPolarHBondContact O-CG 3.24Å; S83-Q87 PolarHBondContact O-N 3.29Å; S83-I298 WeakPolarHBondContact OG-CG2 3.49Å; S83-N302 PolarHBondContact OG-ND2 2.97Å; S83-N302 VanDerWaalsContact OG-ND2 3.12Å; S83-N302 PolarHBondContact OG-OD1 3.41Å
84	M	94.3	Very high	88.5	Confident	0 Å²	0	29.4 Å²	29.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-57.6	-46.1	176.1	-174.1	-178	68.5	0	0	111.6	F55 L73 S80 S81 C82 Q87 V88 M246 Q247 P289 M290	F55-M84 HydrophobicContact CE2-CG 4.35Å; L73-M84 HydrophobicContact CB-CE 4.45Å; L73-M84 HydrophobicContact CD2-CE 4.47Å; S80-M84 PolarHBondContact O-N 2.91Å; S81-M84 WeakPolarHBondContact O-CB 3.22Å; S81-M84 PolarHBondContact O-N 3.09Å; C82-M84 VanDerWaalsContact C-N 3.31Å; C82-M84 PolarHBondContact O-N 3.24Å; M84-Q87 PolarHBondContact O-N 3.3Å; M84-V88 WeakPolarHBondContact O-CG2 3.34Å; M84-V88 PolarHBondContact O-N 3.08Å; M84-M246 HydrophobicContact CE-CB 4.18Å; M84-M246 HydrophobicContact SD-CB 3.94Å; M84-Q247 VanDerWaalsContact SD-C 3.58Å; M84-P289 HydrophobicContact CG-CG 4.27Å; M84-P289 HydrophobicContact SD-CG 3.88Å; M84-M290 HydrophobicContact CB-CG 3.68Å; M84-M290 HydrophobicContact CB-SD 4.05Å; M84-M290 HydrophobicContact CG-CG 3.98Å; M84-M290 HydrophobicContact CG-SD 4.46Å; M84-M290 HydrophobicContact SD-CG 4.35Å
85	L	93.1	Very high	86.8	Confident	5 Å²	5	36.5 Å²	36.5	3%	0.026	21%	0.209	C	C	.	.	H	α-helix	trans	-59.2	-47.6	177.3	178.3	61.1	0	0	0	111.6	L73 V75 S81 C82 S83 Q87 V88 Q89 I106 F134 T137 F139	L73-L85 HydrophobicContact CD1-CD1 3.78Å; V75-L85 HydrophobicContact CG2-CB 4.26Å; V75-L85 HydrophobicContact CG2-CD2 4.33Å; S81-L85 PolarHBondContact O-N 3.41Å; C82-L85 PolarHBondContact O-N 2.57Å; S83-L85 VanDerWaalsContact C-N 3.32Å; S83-L85 PolarHBondContact O-N 3.31Å; L85-Q87 VanDerWaalsContact C-N 3.32Å; L85-Q87 PolarHBondContact O-N 3.11Å; L85-V88 PolarHBondContact O-N 3.47Å; L85-Q89 WeakPolarHBondContact O-CB 3.2Å; L85-Q89 PolarHBondContact O-N 2.91Å; L85-I106 HydrophobicContact CD1-CD1 3.64Å; L85-I106 HydrophobicContact CD1-CG1 3.96Å; L85-I106 HydrophobicContact CD2-CD1 4.21Å; L85-F134 HydrophobicContact CD2-CD1 4Å; L85-F134 HydrophobicContact CD2-CE1 4.06Å; L85-T137 HydrophobicContact CD1-CG2 4.31Å; L85-T137 HydrophobicContact CD2-CG2 4.04Å; L85-T137 HydrophobicContact CG-CG2 4.21Å; L85-F139 HydrophobicContact CD1-CD2 4.32Å
86	S	91.3	Very high	85.4	Confident	28 Å²	28	37.5 Å²	37.5	20%	0.196	22%	0.218	C	C	.	.	H	α-helix	trans	-60	-40.6	176.8	178.2	0	0	0	0	112.2	C82 S83 Q89 E90	C82-S86 PolarHBondContact O-N 3.1Å; S83-S86 PolarHBondContact O-N 3.19Å; S86-Q89 PolarHBondContact O-N 3.42Å; S86-E90 WeakPolarHBondContact O-CB 3.21Å; S86-E90 PolarHBondContact O-N 2.99Å
87	Q	90.6	Very high	83.7	Confident	5 Å²	5	42 Å²	42	2%	0.023	23%	0.231	C	C	.	.	H	α-helix	trans	-67	-37.9	177.4	-67.2	-71.4	94.2	0	0	112.7	F51 F55 S83 M84 L85 G91 Y301	F51-Q87 HydrophobicContact CD1-CG 4.38Å; F51-Q87 VanDerWaalsContact CD1-NE2 3.35Å; F51-Q87 HydrophobicContact CE1-CG 3.94Å; F51-Q87 PolarHBondContact O-NE2 2.83Å; F55-Q87 HydrophobicContact CD1-CB 4.11Å; F55-Q87 HydrophobicContact CD2-CB 4.22Å; F55-Q87 HydrophobicContact CE1-CB 4.16Å; F55-Q87 HydrophobicContact CE2-CB 4.26Å; F55-Q87 HydrophobicContact CG-CB 4.15Å; F55-Q87 HydrophobicContact CZ-CB 4.25Å; S83-Q87 WeakPolarHBondContact O-CG 3.24Å; S83-Q87 PolarHBondContact O-N 3.29Å; M84-Q87 PolarHBondContact O-N 3.3Å; L85-Q87 VanDerWaalsContact C-N 3.32Å; L85-Q87 PolarHBondContact O-N 3.11Å; Q87-G91 PolarHBondContact O-N 3.26Å; Q87-Y301 PolarHBondContact OE1-OH 3.18Å; Q87-Y301 VanDerWaalsContact OE1-OH 3.09Å
88	V	90.8	Very high	82.7	Confident	0 Å²	0	49.5 Å²	49.5	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-69.6	-42.9	175.3	173.9	0	0	0	0	110.3	F55 L73 M84 L85 E90 G91 V92 F102 P104 M246	F55-V88 HydrophobicContact CE1-CG2 4.26Å; F55-V88 HydrophobicContact CZ-CG2 3.76Å; L73-V88 HydrophobicContact CD1-CB 4.23Å; L73-V88 HydrophobicContact CD1-CG1 3.99Å; L73-V88 HydrophobicContact CD1-CG2 4.45Å; L73-V88 HydrophobicContact CD2-CG2 4.06Å; M84-V88 WeakPolarHBondContact O-CG2 3.34Å; M84-V88 PolarHBondContact O-N 3.08Å; L85-V88 PolarHBondContact O-N 3.47Å; V88-E90 PolarHBondContact O-N 3.23Å; V88-G91 PolarHBondContact O-N 2.95Å; V88-V92 HydrophobicContact CG1-CG2 4.11Å; V88-V92 WeakPolarHBondContact O-CB 3.31Å; V88-V92 VanDerWaalsContact O-CG2 3.31Å; V88-V92 WeakPolarHBondContact O-CG2 3.25Å; V88-V92 PolarHBondContact O-N 3.37Å; V88-F102 HydrophobicContact CG1-CE2 3.94Å; V88-F102 HydrophobicContact CG1-CZ 4.01Å; V88-P104 HydrophobicContact CG1-CB 4.03Å; V88-P104 HydrophobicContact CG1-CG 4.43Å; V88-M246 HydrophobicContact CG2-SD 4.13Å
89	Q	89.2	Confident	82	Confident	70 Å²	70	54 Å²	54	33%	0.327	28%	0.278	S	S	.	.	H	α-helix	trans	-58	-48.6	175.9	-171	-177.8	5.4	0	0	111.6	L85 S86 G91 S93 F139	L85-Q89 WeakPolarHBondContact O-CB 3.2Å; L85-Q89 PolarHBondContact O-N 2.91Å; S86-Q89 PolarHBondContact O-N 3.42Å; Q89-G91 PolarHBondContact O-N 3Å; Q89-S93 PolarHBondContact O-N 3.41Å; Q89-S93 VanDerWaalsContact O-N 3.15Å; Q89-F139 HydrophobicContact CB-CE2 4.07Å; Q89-F139 HydrophobicContact CB-CZ 4.32Å; Q89-F139 HydrophobicContact CG-CE2 4.34Å; Q89-F139 HydrophobicContact CG-CZ 4.35Å
90	E	86.9	Confident	81.4	Confident	53 Å²	53	51.7 Å²	51.7	25%	0.248	26%	0.262	C	S	.	.	H	α-helix	trans	-64.4	-39.9	175.9	-174.1	164.8	-175.3	0	0	111.5	R48 I52 S86 V88 S93 A96	R48-E90 IonicContact CZ-OE1 2.67Å; R48-E90 IonicContact CZ-OE2 2.74Å; R48-E90 IonicContact NE-OE1 2.73Å; R48-E90 IonicContact NE-OE2 2.68Å; R48-E90 VanDerWaalsContact NH2-CD 3.28Å; R48-E90 IonicContact NH2-OE1 3Å; R48-E90 PolarHBondContact NH2-OE1 3.43Å; R48-E90 IonicContact NH2-OE2 3.7Å; R48-E90 PolarHBondContact NH2-OE2 3.46Å; I52-E90 VanDerWaalsContact CD1-CD 3.49Å; I52-E90 VanDerWaalsContact CD1-OE1 3.22Å; I52-E90 WeakPolarHBondContact CD1-OE1 3.44Å; S86-E90 WeakPolarHBondContact O-CB 3.21Å; S86-E90 PolarHBondContact O-N 2.99Å; V88-E90 PolarHBondContact O-N 3.23Å; E90-S93 PolarHBondContact O-N 2.85Å; E90-S93 PolarHBondContact O-OG 2.98Å; E90-A96 WeakPolarHBondContact O-CB 3.44Å
91	G	83.9	Confident	80.8	Confident	6 Å²	6	55.4 Å²	55.4	6%	0.062	27%	0.273	C	S	.	.	H	α-helix	trans	-72	-26.5	-178.4	0	0	0	0	0	115.7	Q87 V88 Q89 L100	Q87-G91 PolarHBondContact O-N 3.26Å; V88-G91 PolarHBondContact O-N 2.95Å; Q89-G91 PolarHBondContact O-N 3Å; G91-L100 WeakPolarHBondContact O-CB 3.42Å; G91-L100 PolarHBondContact O-N 3.15Å
92	V	83.8	Confident	80.5	Confident	26 Å²	26	55.8 Å²	55.8	16%	0.158	27%	0.274	C	S	.	.	H	α-helix	trans	-87.7	-24.3	176.4	174.7	0	0	0	0	111.6	V88 K99 L100 P104	V88-V92 HydrophobicContact CG1-CG2 4.11Å; V88-V92 WeakPolarHBondContact O-CB 3.31Å; V88-V92 VanDerWaalsContact O-CG2 3.31Å; V88-V92 WeakPolarHBondContact O-CG2 3.25Å; V88-V92 PolarHBondContact O-N 3.37Å; V92-K99 WeakPolarHBondContact O-CE 3.31Å; V92-L100 HydrophobicContact CG2-CB 4.05Å; V92-P104 HydrophobicContact CG2-CG 4.42Å
93	S	79.3	Confident	80.3	Confident	49 Å²	49	62 Å²	62	34%	0.343	30%	0.301	S	S	.	.	S	Bend	trans	-56.6	147	179.5	76.4	0	0	0	0	113.1	Q89 E90 N95 A96	Q89-S93 PolarHBondContact O-N 3.41Å; Q89-S93 VanDerWaalsContact O-N 3.15Å; E90-S93 PolarHBondContact O-N 2.85Å; E90-S93 PolarHBondContact O-OG 2.98Å; S93-N95 PolarHBondContact O-N 2.84Å; S93-N95 VanDerWaalsContact O-N 3.16Å; S93-A96 WeakPolarHBondContact O-CB 3.39Å; S93-A96 PolarHBondContact O-N 2.7Å; S93-A96 VanDerWaalsContact O-N 3.16Å
94	Q	59.8	Low	80.2	Confident	174 Å²	174	62.5 Å²	62.5	81%	0.813	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-23.8	-175.9	-68.1	-178.3	-7.7	0	0	113.4	A96	Q94-A96 VanDerWaalsContact C-N 3.26Å; Q94-A96 PolarHBondContact O-N 3.38Å
95	N	59.5	Low	80.1	Confident	164 Å²	164	62.5 Å²	62.5	88%	0.877	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.4	2.1	-178.8	-63.6	-23.1	0	0	0	113.4	S93	S93-N95 PolarHBondContact O-N 2.84Å; S93-N95 VanDerWaalsContact O-N 3.16Å
96	A	64	Low	80.2	Confident	24 Å²	24	62.3 Å²	62.3	20%	0.198	30%	0.303	C	S	.	.	S	Bend	trans	-83.9	125.1	-176.9	0	0	0	0	0	112.6	E90 S93 Q94 K98	E90-A96 WeakPolarHBondContact O-CB 3.44Å; S93-A96 WeakPolarHBondContact O-CB 3.39Å; S93-A96 PolarHBondContact O-N 2.7Å; S93-A96 VanDerWaalsContact O-N 3.16Å; Q94-A96 VanDerWaalsContact C-N 3.26Å; Q94-A96 PolarHBondContact O-N 3.38Å; A96-K98 PolarHBondContact O-N 3.28Å; A96-K98 VanDerWaalsContact O-N 3.17Å
97	H	54.3	Low	80.3	Confident	163 Å²	163	61 Å²	61	76%	0.755	29%	0.294	S	S	*	.	S	Bend	trans	-62.7	117.1	168.7	-169.7	-103.8	0	0	0	109.7	R56	R56-H97 VanDerWaalsContact CZ-O 3.3Å; R56-H97 PolarHBondContact NH1-O 2.81Å; R56-H97 PolarHBondContact NH2-O 2.84Å
98	K	64.6	Low	80.3	Confident	158 Å²	158	61 Å²	61	69%	0.687	29%	0.294	S	S	*	.	S	Bend	trans	64.4	73.7	-169.4	-60	174.5	-179	-179.9	0	113	R56 A96 L100	R56-K98 PolarHBondContact NH1-O 3.38Å; R56-K98 PolarHBondContact NH2-O 2.78Å; A96-K98 PolarHBondContact O-N 3.28Å; A96-K98 VanDerWaalsContact O-N 3.17Å; K98-L100 PolarHBondContact O-N 2.98Å
99	K	72.6	Confident	80.2	Confident	110 Å²	110	61.4 Å²	61.4	48%	0.478	30%	0.296	S	S	.	.			trans	-49.2	135.1	179.3	-170	176.3	-179.6	-176.6	0	113.5	V92 R101	V92-K99 WeakPolarHBondContact O-CE 3.31Å; K99-R101 PolarHBondContact O-N 2.83Å
100	L	80.1	Confident	80	Confident	22 Å²	22	58.7 Å²	58.7	12%	0.115	28%	0.284	C	S	.	.			trans	-71.9	121.3	166.8	-64.6	177.8	0	0	0	108.4	F55 L59 G91 V92 K98 F102	F55-L100 HydrophobicContact CE1-CD1 4.27Å; L59-L100 HydrophobicContact CD1-CD1 4.33Å; L59-L100 HydrophobicContact CD1-CD2 4.1Å; G91-L100 WeakPolarHBondContact O-CB 3.42Å; G91-L100 PolarHBondContact O-N 3.15Å; V92-L100 HydrophobicContact CG2-CB 4.05Å; K98-L100 PolarHBondContact O-N 2.98Å; L100-F102 HydrophobicContact CB-CD1 4.09Å; L100-F102 HydrophobicContact CB-CE1 3.72Å; L100-F102 HydrophobicContact CB-CZ 4.35Å; L100-F102 HydrophobicContact CD1-CE1 3.85Å; L100-F102 HydrophobicContact CD1-CZ 4.01Å; L100-F102 HydrophobicContact CD2-CE1 4.23Å; L100-F102 HydrophobicContact CG-CE1 4.14Å; L100-F102 PolarHBondContact O-N 2.62Å
101	R	80.1	Confident	79.3	Confident	97 Å²	97	56.1 Å²	56.1	37%	0.366	27%	0.272	S	S	.	.			trans	-100.7	40.6	-170.2	-63.7	177.2	175.6	-179	-3.5	112.7	P67 G68 K99 F177	P67-R101 CarbonylContact C-O 3.56Å; P67-R101 VanDerWaalsContact CA-O 3.25Å; P67-R101 WeakPolarHBondContact CA-O 3.28Å; P67-R101 HydrophobicContact CB-CB 3.89Å; G68-R101 PolarHBondContact N-O 3.19Å; K99-R101 PolarHBondContact O-N 2.83Å; R101-F177 HydrophobicContact CB-CE1 4.48Å; R101-F177 HydrophobicContact CG-CE1 4.34Å
102	F	86.9	Confident	78.6	Confident	14 Å²	14	56.9 Å²	56.9	6%	0.061	27%	0.274	C	S	.	.	S	Bend	trans	-124	161.1	176.6	63.3	-102.9	0	0	0	110	I65 E69 V71 V88 L100 P104 M246	I65-F102 HydrophobicContact CG2-CB 4.04Å; I65-F102 HydrophobicContact CG2-CD1 3.87Å; I65-F102 HydrophobicContact CG2-CG 4.09Å; E69-F102 WeakPolarHBondContact O-CA 3.29Å; E69-F102 VanDerWaalsContact O-CB 3.32Å; E69-F102 WeakPolarHBondContact O-CB 3.42Å; V71-F102 HydrophobicContact CB-CD2 3.73Å; V71-F102 HydrophobicContact CB-CE2 4.08Å; V71-F102 HydrophobicContact CB-CG 4.46Å; V71-F102 HydrophobicContact CG1-CE2 4.42Å; V71-F102 HydrophobicContact CG2-CB 3.88Å; V71-F102 HydrophobicContact CG2-CD2 3.53Å; V71-F102 HydrophobicContact CG2-CE2 4.19Å; V71-F102 HydrophobicContact CG2-CG 3.76Å; V88-F102 HydrophobicContact CG1-CE2 3.94Å; V88-F102 HydrophobicContact CG1-CZ 4.01Å; L100-F102 HydrophobicContact CB-CD1 4.09Å; L100-F102 HydrophobicContact CB-CE1 3.72Å; L100-F102 HydrophobicContact CB-CZ 4.35Å; L100-F102 HydrophobicContact CD1-CE1 3.85Å; L100-F102 HydrophobicContact CD1-CZ 4.01Å; L100-F102 HydrophobicContact CD2-CE1 4.23Å; L100-F102 HydrophobicContact CG-CE1 4.14Å; L100-F102 PolarHBondContact O-N 2.62Å; F102-P104 HydrophobicContact CE2-CB 4.29Å; F102-P104 VanDerWaalsContact O-CD 3.29Å; F102-P104 WeakPolarHBondContact O-CD 3.43Å; F102-M246 HydrophobicContact CE1-CE 4.18Å; F102-M246 HydrophobicContact CE2-CE 4.34Å; F102-M246 HydrophobicContact CZ-CE 3.77Å
103	F	87.6	Confident	77.7	Confident	134 Å²	134	55.7 Å²	55.7	59%	0.588	27%	0.267	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.5	106.8	-179.6	-64.3	-76.7	0	0	0	110.3	E69 K70 V71	E69-F103 PolarHBondContact O-N 2.84Å; K70-F103 WeakPolarHBondContact CA-O 3.48Å; K70-F103 HydrophobicContact CG-CB 4.38Å; V71-F103 PolarHBondContact N-O 3.3Å
104	P	91.6	Very high	77.1	Confident	11 Å²	11	53.3 Å²	53.3	7%	0.071	25%	0.25	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	141.2	178.8	31.4	-34.7	0	0	0	111.5	V71 L73 V88 V92 F102 F139 P140	V71-P104 CarbonylContact O-C 3.6Å; V71-P104 WeakPolarHBondContact O-CA 3.47Å; L73-P104 HydrophobicContact CD1-CB 4.03Å; L73-P104 HydrophobicContact CG-CB 4.47Å; V88-P104 HydrophobicContact CG1-CB 4.03Å; V88-P104 HydrophobicContact CG1-CG 4.43Å; V92-P104 HydrophobicContact CG2-CG 4.42Å; F102-P104 HydrophobicContact CE2-CB 4.29Å; F102-P104 VanDerWaalsContact O-CD 3.29Å; F102-P104 WeakPolarHBondContact O-CD 3.43Å; P104-F139 HydrophobicContact CB-CD2 4.28Å; P104-F139 HydrophobicContact CB-CE2 4.39Å; P104-F139 HydrophobicContact CB-CG 4.35Å; P104-F139 HydrophobicContact CG-CD1 3.52Å; P104-F139 HydrophobicContact CG-CD2 3.98Å; P104-F139 HydrophobicContact CG-CE1 3.43Å; P104-F139 VanDerWaalsContact CG-CE1 3.43Å; P104-F139 HydrophobicContact CG-CE2 3.91Å; P104-F139 HydrophobicContact CG-CG 3.8Å; P104-F139 HydrophobicContact CG-CZ 3.63Å; P104-P140 WeakPolarHBondContact O-CD 3.35Å
105	G	92.4	Very high	77.5	Confident	0 Å²	0	45.9 Å²	45.9	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	156.8	159.4	0	0	0	0	0	109.9	V71 L72 L73 P140	V71-G105 PolarHBondContact O-N 3.17Å; L72-G105 CarbonylContact C-O 3.44Å; L73-G105 WeakPolarHBondContact CB-O 3.36Å; L73-G105 WeakPolarHBondContact CG-O 3.23Å; L73-G105 PolarHBondContact N-O 3.39Å; G105-P140 CarbonylContact C-O 3.58Å; G105-P140 VanDerWaalsContact CA-O 3.31Å; G105-P140 WeakPolarHBondContact CA-O 3.17Å
106	I	94.3	Very high	78	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	137.3	-177.4	-57.6	171.5	0	0	0	109.1	L73 V75 L85 F134 T137 F139 P140 F141 Y142	L73-I106 HydrophobicContact CD1-CG1 4.42Å; V75-I106 HydrophobicContact CB-CG2 4.15Å; V75-I106 HydrophobicContact CG2-CG2 3.89Å; L85-I106 HydrophobicContact CD1-CD1 3.64Å; L85-I106 HydrophobicContact CD1-CG1 3.96Å; L85-I106 HydrophobicContact CD2-CD1 4.21Å; I106-F134 HydrophobicContact CD1-CB 4.2Å; I106-F134 HydrophobicContact CD1-CD1 3.82Å; I106-F134 HydrophobicContact CD1-CG 4.2Å; I106-F134 HydrophobicContact CG2-CD1 3.82Å; I106-F134 HydrophobicContact CG2-CD2 4.33Å; I106-F134 HydrophobicContact CG2-CE1 3.66Å; I106-F134 HydrophobicContact CG2-CE2 4.21Å; I106-F134 HydrophobicContact CG2-CG 4.16Å; I106-F134 HydrophobicContact CG2-CZ 3.88Å; I106-T137 WeakPolarHBondContact CD1-OG1 3.38Å; I106-F139 HydrophobicContact CD1-CB 4.1Å; I106-F139 HydrophobicContact CD1-CD2 4.26Å; I106-F139 HydrophobicContact CG1-CB 4.25Å; I106-P140 PolarHBondContact N-O 2.92Å; I106-F141 HydrophobicContact CB-CB 3.82Å; I106-F141 HydrophobicContact CD1-CB 4.47Å; I106-F141 HydrophobicContact CG2-CB 4.36Å; I106-F141 CarbonylContact O-C 3.59Å; I106-F141 VanDerWaalsContact O-CA 3.3Å; I106-F141 WeakPolarHBondContact O-CA 3.06Å; I106-Y142 VanDerWaalsContact O-CD2 3.3Å; I106-Y142 WeakPolarHBondContact O-CD2 3.43Å; I106-Y142 PolarHBondContact O-N 3.02Å
107	V	93.8	Very high	78.2	Confident	1 Å²	1	42.1 Å²	42.1	1%	0.006	21%	0.205	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	129.4	167.7	64.3	0	0	0	0	110	L72 L73 A74 V75 I109 Y142 L144 L233 T236	L72-V107 HydrophobicContact CD1-CB 3.99Å; L72-V107 HydrophobicContact CD1-CG1 4.12Å; L72-V107 HydrophobicContact CD2-CB 4.11Å; L72-V107 HydrophobicContact CD2-CG1 3.76Å; L72-V107 HydrophobicContact CG-CB 4.1Å; L72-V107 HydrophobicContact CG-CG1 3.67Å; L73-V107 PolarHBondContact O-N 3.1Å; A74-V107 HydrophobicContact CB-CG1 4.34Å; V75-V107 PolarHBondContact N-O 3.16Å; V107-I109 HydrophobicContact CG2-CG1 4.44Å; V107-Y142 CarbonylContact C-O 3.53Å; V107-Y142 WeakPolarHBondContact CA-O 3.41Å; V107-L144 HydrophobicContact CG2-CD1 4.2Å; V107-L233 HydrophobicContact CG1-CD2 3.48Å; V107-L233 VanDerWaalsContact CG1-CD2 3.48Å; V107-L233 HydrophobicContact CG2-CD2 4.27Å; V107-T236 HydrophobicContact CG2-CG2 4.21Å
108	Y	91.6	Very high	79.2	Confident	4 Å²	4	36.4 Å²	36.4	2%	0.016	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	132.3	169.1	170.1	-107.6	0	0	0	108.8	V75 D110 L130 F134 Y142 I143 L144 I312	V75-Y108 WeakPolarHBondContact O-CA 3.38Å; V75-Y108 VanDerWaalsContact O-CD2 3.28Å; V75-Y108 WeakPolarHBondContact O-CD2 3.47Å; Y108-D110 HydrophobicContact CE1-CB 4.01Å; Y108-L130 HydrophobicContact CD1-CD1 3.83Å; Y108-L130 HydrophobicContact CD2-CD1 3.82Å; Y108-L130 HydrophobicContact CE1-CD1 3.52Å; Y108-L130 HydrophobicContact CE2-CD1 3.53Å; Y108-L130 HydrophobicContact CG-CD1 3.99Å; Y108-F134 HydrophobicContact CG-CE2 4.47Å; Y108-Y142 PolarHBondContact N-O 2.95Å; Y108-I143 HydrophobicContact CD1-CG1 4.27Å; Y108-I143 HydrophobicContact CD1-CG2 3.98Å; Y108-I143 WeakPolarHBondContact O-CA 3.44Å; Y108-L144 PolarHBondContact O-N 2.88Å; Y108-I312 HydrophobicContact CE2-CD1 3.81Å; Y108-I312 WeakPolarHBondContact OH-CD1 3.3Å
109	I	88.8	Confident	79.7	Confident	10 Å²	10	32.5 Å²	32.5	5%	0.051	17%	0.171	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	119.9	174.7	-62.9	169	0	0	0	108	V107 A111 L144 L146 R229 L232 L233	V107-I109 HydrophobicContact CG2-CG1 4.44Å; I109-A111 VanDerWaalsContact C-N 3.3Å; I109-A111 HydrophobicContact CG2-CB 4.23Å; I109-A111 PolarHBondContact O-N 3.15Å; I109-L144 CarbonylContact C-O 3.46Å; I109-L144 VanDerWaalsContact CA-O 3.24Å; I109-L144 WeakPolarHBondContact CA-O 3.24Å; I109-L146 HydrophobicContact CG2-CB 4.09Å; I109-L146 HydrophobicContact CG2-CD1 4.08Å; I109-R229 HydrophobicContact CB-CG 4.33Å; I109-R229 HydrophobicContact CD1-CG 3.78Å; I109-R229 HydrophobicContact CG2-CG 4.32Å; I109-L232 HydrophobicContact CD1-CB 3.95Å; I109-L232 HydrophobicContact CD1-CD2 3.91Å; I109-L232 HydrophobicContact CD1-CG 3.97Å; I109-L232 HydrophobicContact CG1-CD2 3.97Å; I109-L232 HydrophobicContact CG1-CG 4.4Å; I109-L232 HydrophobicContact CG2-CD2 3.84Å; I109-L233 HydrophobicContact CD1-CB 4.44Å; I109-L233 HydrophobicContact CD1-CD2 3.45Å; I109-L233 VanDerWaalsContact CD1-CD2 3.45Å; I109-L233 HydrophobicContact CD1-CG 3.48Å; I109-L233 VanDerWaalsContact CD1-CG 3.48Å; I109-L233 HydrophobicContact CG1-CD2 4.2Å
110	D	84	Confident	79.9	Confident	12 Å²	12	33.4 Å²	33.4	6%	0.064	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	82.9	170.2	-179.4	12.3	0	0	0	109	Y108 G113 R123 L144 L146	Y108-D110 HydrophobicContact CE1-CB 4.01Å; D110-G113 WeakPolarHBondContact OD1-CA 3.3Å; D110-G113 PolarHBondContact OD1-N 3.27Å; D110-R123 IonicContact OD2-CZ 3.06Å; D110-R123 IonicContact OD2-NE 3.4Å; D110-R123 PolarHBondContact OD2-NE 3.13Å; D110-R123 IonicContact OD2-NH2 2.66Å; D110-R123 PolarHBondContact OD2-NH2 2.9Å; D110-L144 PolarHBondContact N-O 3.48Å; D110-L146 WeakPolarHBondContact O-CB 3.37Å; D110-L146 PolarHBondContact O-N 2.92Å; D110-L146 VanDerWaalsContact O-N 3.1Å
111	A	71.9	Confident	79.9	Confident	0 Å²	0	39.6 Å²	39.6	0%	0	20%	0.203	C	C	.	.			trans	-86.9	-31.7	-179.8	0	0	0	0	0	112.6	I109 A115 L146	I109-A111 VanDerWaalsContact C-N 3.3Å; I109-A111 HydrophobicContact CG2-CB 4.23Å; I109-A111 PolarHBondContact O-N 3.15Å; A111-A115 WeakPolarHBondContact O-CB 3.45Å; A111-L146 HydrophobicContact CB-CB 4.24Å; A111-L146 HydrophobicContact CB-CD1 4.41Å; A111-L146 HydrophobicContact CB-CD2 3.84Å; A111-L146 HydrophobicContact CB-CG 4.4Å
112	E	70.2	Confident	79.8	Confident	21 Å²	21	39 Å²	39	10%	0.098	21%	0.205	C	C	.	.	H	α-helix	trans	-86.9	-32.3	-171	-64.8	74.2	-158.9	0	0	111.7	L116 R229 I312 P313	E112-L116 HydrophobicContact CB-CD1 3.97Å; E112-L116 WeakPolarHBondContact O-CB 3.39Å; E112-L116 VanDerWaalsContact O-CG 3.31Å; E112-L116 WeakPolarHBondContact O-CG 3.44Å; E112-L116 PolarHBondContact O-N 3.02Å; E112-R229 IonicContact OE1-CZ 3.33Å; E112-R229 IonicContact OE1-NH2 2.92Å; E112-R229 PolarHBondContact OE1-NH2 2.96Å; E112-I312 HydrophobicContact CB-CG2 4.24Å; E112-I312 HydrophobicContact CG-CG2 4.43Å; E112-P313 WeakPolarHBondContact CB-O 3.31Å
113	G	65.6	Low	79.5	Confident	1 Å²	1	39.2 Å²	39.2	1%	0.01	21%	0.206	C	C	.	.	H	α-helix	trans	-61.6	-48.8	-178.3	0	0	0	0	0	113.4	D110 G117 Q118	D110-G113 WeakPolarHBondContact OD1-CA 3.3Å; D110-G113 PolarHBondContact OD1-N 3.27Å; G113-G117 PolarHBondContact O-N 3.5Å; G113-Q118 PolarHBondContact O-N 2.71Å
114	G	65.6	Low	79.3	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	20%	0.202	C	C	.	.	H	α-helix	trans	-71.7	-46	178.8	0	0	0	0	0	113	L116 G117 Q209	G114-L116 PolarHBondContact O-N 2.64Å; G114-G117 PolarHBondContact O-N 3.14Å; G114-Q209 VanDerWaalsContact O-CG 3.28Å; G114-Q209 WeakPolarHBondContact O-CG 3.19Å; G114-Q209 PolarHBondContact O-NE2 3.39Å; G114-Q209 VanDerWaalsContact O-NE2 3.12Å
115	A	68.6	Low	79	Confident	17 Å²	17	43.6 Å²	43.6	14%	0.14	23%	0.225	C	C	.	.	H	α-helix	trans	-71.3	-30	-175.8	0	0	0	0	0	114.1	A111 L225	A111-A115 WeakPolarHBondContact O-CB 3.45Å; A115-L225 HydrophobicContact CB-CD1 3.9Å; A115-L225 HydrophobicContact CB-CD2 3.75Å; A115-L225 HydrophobicContact CB-CG 4.46Å
116	L	69.4	Low	78.6	Confident	66 Å²	66	44.1 Å²	44.1	35%	0.346	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	-90.3	-3	175.5	-66	169	0	0	0	113.4	E112 G114 Q118 P313 L315	E112-L116 HydrophobicContact CB-CD1 3.97Å; E112-L116 WeakPolarHBondContact O-CB 3.39Å; E112-L116 VanDerWaalsContact O-CG 3.31Å; E112-L116 WeakPolarHBondContact O-CG 3.44Å; E112-L116 PolarHBondContact O-N 3.02Å; G114-L116 PolarHBondContact O-N 2.64Å; L116-Q118 VanDerWaalsContact C-N 3.31Å; L116-Q118 HydrophobicContact CB-CG 4.13Å; L116-Q118 PolarHBondContact O-N 2.97Å; L116-P313 VanDerWaalsContact CD1-O 3.29Å; L116-P313 WeakPolarHBondContact CD1-O 3.31Å; L116-L315 HydrophobicContact CD2-CD2 3.54Å; L116-L315 HydrophobicContact CD2-CG 4.28Å; L116-L315 HydrophobicContact CG-CD2 4.37Å
117	G	68.8	Low	78.2	Confident	44 Å²	44	44.6 Å²	44.6	45%	0.454	23%	0.231	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.8	37.3	-176.5	0	0	0	0	0	113.4	G113 G114 Q209	G113-G117 PolarHBondContact O-N 3.5Å; G114-G117 PolarHBondContact O-N 3.14Å; G117-Q209 VanDerWaalsContact CA-NE2 3.35Å
118	Q	74.6	Confident	77.8	Confident	42 Å²	42	47.4 Å²	47.4	20%	0.196	25%	0.251	C	S	.	.			trans	-64.9	149.2	176.9	-66.6	179	7.1	0	0	111	G113 L116 R123	G113-Q118 PolarHBondContact O-N 2.71Å; L116-Q118 VanDerWaalsContact C-N 3.31Å; L116-Q118 HydrophobicContact CB-CG 4.13Å; L116-Q118 PolarHBondContact O-N 2.97Å; Q118-R123 HydrophobicContact CB-CG 4.11Å
119	C	75.1	Confident	77.7	Confident	77 Å²	77	51.3 Å²	51.3	52%	0.52	27%	0.269	S	S	.	.			trans	-63.3	148.4	174.5	65.9	0	0	0	0	111	E121 M122 R123	C119-E121 PolarHBondContact O-N 2.76Å; C119-M122 PolarHBondContact O-N 2.94Å; C119-M122 VanDerWaalsContact O-N 3.17Å; C119-M122 VanDerWaalsContact SG-CB 3.52Å; C119-R123 PolarHBondContact O-N 3.28Å
120	K	77.4	Confident	77.6	Confident	128 Å²	128	50.8 Å²	50.8	56%	0.557	27%	0.267	S	S	*	.	H	α-helix	trans	-56.2	-36.6	-179.3	-170.9	175.5	-178	175.3	0	112.2	R123 Q124	K120-R123 PolarHBondContact O-N 2.83Å; K120-Q124 WeakPolarHBondContact O-CB 3.42Å; K120-Q124 VanDerWaalsContact O-CG 3.25Å; K120-Q124 WeakPolarHBondContact O-CG 3.28Å; K120-Q124 PolarHBondContact O-N 3.24Å
121	E	79.3	Confident	77.8	Confident	153 Å²	153	50.7 Å²	50.7	72%	0.715	27%	0.267	S	S	*	.	H	α-helix	trans	-63.8	-44.4	178.9	-63.8	174.7	-177.5	0	0	112.4	C119 Q124 K125	C119-E121 PolarHBondContact O-N 2.76Å; E121-Q124 PolarHBondContact O-N 3.4Å; E121-K125 WeakPolarHBondContact O-CB 3.37Å; E121-K125 PolarHBondContact O-N 3.46Å
122	M	79	Confident	78.6	Confident	83 Å²	83	54.7 Å²	54.7	41%	0.409	29%	0.288	S	S	.	.	H	α-helix	trans	-66	-42.8	178	-172.4	67.3	179.3	0	0	111	C119 Q124 K125 T126	C119-M122 PolarHBondContact O-N 2.94Å; C119-M122 VanDerWaalsContact O-N 3.17Å; C119-M122 VanDerWaalsContact SG-CB 3.52Å; M122-Q124 VanDerWaalsContact C-N 3.34Å; M122-Q124 PolarHBondContact O-N 3.27Å; M122-K125 PolarHBondContact O-N 2.95Å; M122-T126 PolarHBondContact O-N 3.32Å; M122-T126 PolarHBondContact O-OG1 2.84Å
123	R	80.6	Confident	79.4	Confident	20 Å²	20	54.5 Å²	54.5	8%	0.075	29%	0.287	C	S	.	.	H	α-helix	trans	-59.5	-45.3	175	-67.4	-179.8	70.4	169.9	2.1	111.2	D110 Q118 C119 K120 T127 E147	D110-R123 IonicContact OD2-CZ 3.06Å; D110-R123 IonicContact OD2-NE 3.4Å; D110-R123 PolarHBondContact OD2-NE 3.13Å; D110-R123 IonicContact OD2-NH2 2.66Å; D110-R123 PolarHBondContact OD2-NH2 2.9Å; Q118-R123 HydrophobicContact CB-CG 4.11Å; C119-R123 PolarHBondContact O-N 3.28Å; K120-R123 PolarHBondContact O-N 2.83Å; R123-T127 VanDerWaalsContact O-CB 3.26Å; R123-T127 WeakPolarHBondContact O-CB 3.44Å; R123-T127 PolarHBondContact O-N 3.2Å; R123-T127 PolarHBondContact O-OG1 2.93Å; R123-E147 IonicContact CZ-OE1 3.28Å; R123-E147 IonicContact NH1-OE1 3.86Å; R123-E147 PolarHBondContact NH1-OE1 2.8Å; R123-E147 IonicContact NH2-OE1 2.77Å; R123-E147 PolarHBondContact NH2-OE1 3.23Å; R123-E147 IonicContact NH2-OE2 2.93Å; R123-E147 PolarHBondContact NH2-OE2 2.85Å
124	Q	82.3	Confident	80.6	Confident	111 Å²	111	54.5 Å²	54.5	52%	0.519	29%	0.287	S	S	.	.	H	α-helix	trans	-63.5	-42.3	177.6	-77	175.4	-14.1	0	0	112.1	K120 E121 M122 T127 S128	K120-Q124 WeakPolarHBondContact O-CB 3.42Å; K120-Q124 VanDerWaalsContact O-CG 3.25Å; K120-Q124 WeakPolarHBondContact O-CG 3.28Å; K120-Q124 PolarHBondContact O-N 3.24Å; E121-Q124 PolarHBondContact O-N 3.4Å; M122-Q124 VanDerWaalsContact C-N 3.34Å; M122-Q124 PolarHBondContact O-N 3.27Å; Q124-T127 PolarHBondContact O-N 3.01Å; Q124-S128 WeakPolarHBondContact O-CB 3.33Å; Q124-S128 PolarHBondContact O-N 3.43Å
125	K	85.1	Confident	81.7	Confident	125 Å²	125	60.9 Å²	60.9	54%	0.543	31%	0.311	S	S	.	.	H	α-helix	trans	-61	-53	176.6	-177.3	179.8	175.6	-179.3	0	111.7	E121 M122 T127 S128 E129	E121-K125 WeakPolarHBondContact O-CB 3.37Å; E121-K125 PolarHBondContact O-N 3.46Å; M122-K125 PolarHBondContact O-N 2.95Å; K125-T127 VanDerWaalsContact C-N 3.28Å; K125-T127 PolarHBondContact O-N 2.88Å; K125-S128 WeakPolarHBondContact O-CB 3.39Å; K125-S128 PolarHBondContact O-N 2.76Å; K125-S128 VanDerWaalsContact O-N 3.17Å; K125-E129 WeakPolarHBondContact CE-OE1 3.26Å; K125-E129 WeakPolarHBondContact O-CG 3.31Å; K125-E129 PolarHBondContact O-N 3.04Å
126	T	84.5	Confident	82.6	Confident	11 Å²	11	64.1 Å²	64.1	7%	0.067	33%	0.333	C	S	.	.	H	α-helix	trans	-59	-42	177.8	-62.6	0	0	0	0	111.3	M122 E129 L130 V310 I312	M122-T126 PolarHBondContact O-N 3.32Å; M122-T126 PolarHBondContact O-OG1 2.84Å; T126-E129 PolarHBondContact O-N 3.4Å; T126-L130 HydrophobicContact CG2-CD1 4.1Å; T126-L130 WeakPolarHBondContact O-CB 3.33Å; T126-L130 VanDerWaalsContact O-CG 3.3Å; T126-L130 WeakPolarHBondContact O-CG 3.46Å; T126-L130 PolarHBondContact O-N 2.94Å; T126-V310 HydrophobicContact CG2-CG1 4.14Å; T126-I312 HydrophobicContact CG2-CD1 4.12Å; T126-I312 HydrophobicContact CG2-CG1 4.18Å
127	T	85.3	Confident	83.4	Confident	11 Å²	11	61.6 Å²	61.6	7%	0.067	32%	0.32	C	S	.	.	H	α-helix	trans	-66	-39.2	178.2	-55.2	0	0	0	0	111.8	R123 Q124 K125 L130 C131 I143 L197	R123-T127 VanDerWaalsContact O-CB 3.26Å; R123-T127 WeakPolarHBondContact O-CB 3.44Å; R123-T127 PolarHBondContact O-N 3.2Å; R123-T127 PolarHBondContact O-OG1 2.93Å; Q124-T127 PolarHBondContact O-N 3.01Å; K125-T127 VanDerWaalsContact C-N 3.28Å; K125-T127 PolarHBondContact O-N 2.88Å; T127-L130 PolarHBondContact O-N 3.39Å; T127-C131 WeakPolarHBondContact O-CB 3.29Å; T127-C131 PolarHBondContact O-N 3.43Å; T127-C131 PolarHBondContact O-SG 3.47Å; T127-I143 HydrophobicContact CG2-CD1 3.77Å; T127-I143 HydrophobicContact CG2-CG2 3.75Å; T127-L197 HydrophobicContact CG2-CD2 3.32Å
128	S	86.8	Confident	84.1	Confident	60 Å²	60	62.7 Å²	62.7	42%	0.42	33%	0.332	S	S	.	.	H	α-helix	trans	-63.7	-46.5	175.7	-167.7	0	0	0	0	111.6	Q124 K125 L130 C131 D132	Q124-S128 WeakPolarHBondContact O-CB 3.33Å; Q124-S128 PolarHBondContact O-N 3.43Å; K125-S128 WeakPolarHBondContact O-CB 3.39Å; K125-S128 PolarHBondContact O-N 2.76Å; K125-S128 VanDerWaalsContact O-N 3.17Å; S128-L130 VanDerWaalsContact C-N 3.29Å; S128-L130 PolarHBondContact O-N 3.3Å; S128-C131 WeakPolarHBondContact O-CB 3.23Å; S128-C131 PolarHBondContact O-N 2.85Å; S128-D132 PolarHBondContact O-N 2.96Å
129	E	88.1	Confident	84.8	Confident	85 Å²	85	62.2 Å²	62.2	40%	0.397	33%	0.329	S	S	.	.	H	α-helix	trans	-59	-41.5	176.7	-70.9	173.7	-171.7	0	0	111.5	K125 T126 M133	K125-E129 WeakPolarHBondContact CE-OE1 3.26Å; K125-E129 WeakPolarHBondContact O-CG 3.31Å; K125-E129 PolarHBondContact O-N 3.04Å; T126-E129 PolarHBondContact O-N 3.4Å; E129-M133 PolarHBondContact O-N 2.89Å; E129-M133 VanDerWaalsContact O-N 3.14Å
130	L	87.9	Confident	85.5	Confident	0 Å²	0	61.6 Å²	61.6	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-69.6	-39.5	175.9	-69.8	173.1	0	0	0	112.5	Y108 T126 T127 S128 D132 M133 F134 V310 I312	Y108-L130 HydrophobicContact CD1-CD1 3.83Å; Y108-L130 HydrophobicContact CD2-CD1 3.82Å; Y108-L130 HydrophobicContact CE1-CD1 3.52Å; Y108-L130 HydrophobicContact CE2-CD1 3.53Å; Y108-L130 HydrophobicContact CG-CD1 3.99Å; T126-L130 HydrophobicContact CG2-CD1 4.1Å; T126-L130 WeakPolarHBondContact O-CB 3.33Å; T126-L130 VanDerWaalsContact O-CG 3.3Å; T126-L130 WeakPolarHBondContact O-CG 3.46Å; T126-L130 PolarHBondContact O-N 2.94Å; T127-L130 PolarHBondContact O-N 3.39Å; S128-L130 VanDerWaalsContact C-N 3.29Å; S128-L130 PolarHBondContact O-N 3.3Å; L130-D132 VanDerWaalsContact C-N 3.33Å; L130-D132 PolarHBondContact O-N 3.24Å; L130-M133 HydrophobicContact CD2-CE 3.57Å; L130-M133 WeakPolarHBondContact O-CB 3.37Å; L130-M133 PolarHBondContact O-N 2.75Å; L130-F134 HydrophobicContact CB-CD2 4.46Å; L130-F134 HydrophobicContact CB-CE2 3.94Å; L130-F134 HydrophobicContact CB-CZ 4.31Å; L130-F134 HydrophobicContact CD2-CZ 4.34Å; L130-F134 WeakPolarHBondContact O-CD2 3.32Å; L130-F134 WeakPolarHBondContact O-CG 3.14Å; L130-F134 PolarHBondContact O-N 3.41Å; L130-V310 HydrophobicContact CD2-CB 4.23Å; L130-V310 HydrophobicContact CD2-CG2 3.73Å; L130-V310 HydrophobicContact CG-CG2 4.28Å; L130-I312 HydrophobicContact CD1-CD1 4.29Å
131	C	87.6	Confident	86.2	Confident	10 Å²	10	56.6 Å²	56.6	7%	0.068	30%	0.302	C	S	.	.	H	α-helix	trans	-56.5	-47.8	173.8	-80.9	0	0	0	0	111.2	T127 S128 M133 F134 R135 I143	T127-C131 WeakPolarHBondContact O-CB 3.29Å; T127-C131 PolarHBondContact O-N 3.43Å; T127-C131 PolarHBondContact O-SG 3.47Å; S128-C131 WeakPolarHBondContact O-CB 3.23Å; S128-C131 PolarHBondContact O-N 2.85Å; C131-M133 VanDerWaalsContact C-N 3.32Å; C131-M133 PolarHBondContact O-N 2.79Å; C131-F134 PolarHBondContact O-N 3.29Å; C131-R135 WeakPolarHBondContact O-CB 3.49Å; C131-R135 VanDerWaalsContact O-CG 3.23Å; C131-R135 WeakPolarHBondContact O-CG 3.43Å; C131-R135 PolarHBondContact O-N 3.04Å; C131-I143 WeakPolarHBondContact SG-CD1 3.3Å
132	D	88.3	Confident	86.7	Confident	84 Å²	84	50.1 Å²	50.1	45%	0.449	27%	0.271	S	S	.	.	H	α-helix	trans	-65.9	-39.5	-178.7	-64.7	-25.6	0	0	0	111.2	S128 L130 R135 S136	S128-D132 PolarHBondContact O-N 2.96Å; L130-D132 VanDerWaalsContact C-N 3.33Å; L130-D132 PolarHBondContact O-N 3.24Å; D132-R135 IonicContact OD1-NH1 2.78Å; D132-R135 PolarHBondContact OD1-NH1 2.83Å; D132-S136 PolarHBondContact O-N 3.28Å; D132-S136 VanDerWaalsContact O-N 3.17Å
133	M	88.6	Confident	87.2	Confident	17 Å²	17	46.7 Å²	46.7	8%	0.084	26%	0.255	C	S	.	.	H	α-helix	trans	-60.2	-46.8	171.8	-175.1	-175.5	68.3	0	0	111.7	E129 L130 C131 S136 P308	E129-M133 PolarHBondContact O-N 2.89Å; E129-M133 VanDerWaalsContact O-N 3.14Å; L130-M133 HydrophobicContact CD2-CE 3.57Å; L130-M133 WeakPolarHBondContact O-CB 3.37Å; L130-M133 PolarHBondContact O-N 2.75Å; C131-M133 VanDerWaalsContact C-N 3.32Å; C131-M133 PolarHBondContact O-N 2.79Å; M133-S136 PolarHBondContact O-N 3.25Å; M133-S136 PolarHBondContact O-OG 2.9Å; M133-P308 HydrophobicContact CG-CB 4.12Å; M133-P308 HydrophobicContact CG-CG 3.77Å; M133-P308 HydrophobicContact SD-CB 3.9Å; M133-P308 HydrophobicContact SD-CG 3.83Å
134	F	90	Very high	87.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-69.9	-39.3	-179.2	-61	-32.9	0	0	0	112.7	V75 L85 I106 Y108 L130 C131 S136 T137 F141 I143	V75-F134 HydrophobicContact CB-CE1 4.06Å; V75-F134 HydrophobicContact CB-CZ 4.15Å; V75-F134 HydrophobicContact CG1-CE1 3.79Å; V75-F134 HydrophobicContact CG1-CZ 4.04Å; L85-F134 HydrophobicContact CD2-CD1 4Å; L85-F134 HydrophobicContact CD2-CE1 4.06Å; I106-F134 HydrophobicContact CD1-CB 4.2Å; I106-F134 HydrophobicContact CD1-CD1 3.82Å; I106-F134 HydrophobicContact CD1-CG 4.2Å; I106-F134 HydrophobicContact CG2-CD1 3.82Å; I106-F134 HydrophobicContact CG2-CD2 4.33Å; I106-F134 HydrophobicContact CG2-CE1 3.66Å; I106-F134 HydrophobicContact CG2-CE2 4.21Å; I106-F134 HydrophobicContact CG2-CG 4.16Å; I106-F134 HydrophobicContact CG2-CZ 3.88Å; Y108-F134 HydrophobicContact CG-CE2 4.47Å; L130-F134 HydrophobicContact CB-CD2 4.46Å; L130-F134 HydrophobicContact CB-CE2 3.94Å; L130-F134 HydrophobicContact CB-CZ 4.31Å; L130-F134 HydrophobicContact CD2-CZ 4.34Å; L130-F134 WeakPolarHBondContact O-CD2 3.32Å; L130-F134 WeakPolarHBondContact O-CG 3.14Å; L130-F134 PolarHBondContact O-N 3.41Å; C131-F134 PolarHBondContact O-N 3.29Å; F134-S136 PolarHBondContact O-N 2.71Å; F134-T137 WeakPolarHBondContact O-CB 3.41Å; F134-T137 PolarHBondContact O-N 2.8Å; F134-T137 PolarHBondContact O-OG1 3.33Å; F134-F141 HydrophobicContact CB-CB 3.94Å; F134-F141 HydrophobicContact CB-CD1 3.91Å; F134-F141 HydrophobicContact CB-CD2 4.22Å; F134-F141 HydrophobicContact CB-CG 3.75Å; F134-F141 HydrophobicContact CD2-CB 4.23Å; F134-F141 HydrophobicContact CD2-CD2 4.14Å; F134-F141 HydrophobicContact CD2-CG 4.3Å; F134-F141 HydrophobicContact CG-CB 4.27Å; F134-F141 HydrophobicContact CG-CG 4.41Å; F134-I143 HydrophobicContact CD2-CD1 4.46Å; F134-I143 HydrophobicContact CE2-CG1 4.46Å
135	R	88.8	Confident	87.8	Confident	134 Å²	134	41.9 Å²	41.9	51%	0.506	23%	0.234	S	C	.	.	H	α-helix	trans	-57.1	-39.2	174.2	-75.6	171.4	-176.3	151.2	-4.1	111.8	C131 D132 T137 G138 F141	C131-R135 WeakPolarHBondContact O-CB 3.49Å; C131-R135 VanDerWaalsContact O-CG 3.23Å; C131-R135 WeakPolarHBondContact O-CG 3.43Å; C131-R135 PolarHBondContact O-N 3.04Å; D132-R135 IonicContact OD1-NH1 2.78Å; D132-R135 PolarHBondContact OD1-NH1 2.83Å; R135-T137 PolarHBondContact O-N 3.09Å; R135-T137 VanDerWaalsContact O-N 3.15Å; R135-G138 PolarHBondContact O-N 2.85Å; R135-F141 HydrophobicContact CG-CE1 3.81Å; R135-F141 HydrophobicContact CG-CZ 3.98Å
136	S	87.1	Confident	87.8	Confident	85 Å²	85	35.9 Å²	35.9	59%	0.594	21%	0.209	S	C	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.8	177.4	80.7	0	0	0	0	114	D132 M133 F134	D132-S136 PolarHBondContact O-N 3.28Å; D132-S136 VanDerWaalsContact O-N 3.17Å; M133-S136 PolarHBondContact O-N 3.25Å; M133-S136 PolarHBondContact O-OG 2.9Å; F134-S136 PolarHBondContact O-N 2.71Å
137	T	85.5	Confident	87.8	Confident	13 Å²	13	35.7 Å²	35.7	8%	0.08	21%	0.207	C	C	.	.	T	Hydrogen-bonded Turn	trans	-82.9	-21.6	179.1	70.1	0	0	0	0	113.9	L85 I106 F134 R135 F139	L85-T137 HydrophobicContact CD1-CG2 4.31Å; L85-T137 HydrophobicContact CD2-CG2 4.04Å; L85-T137 HydrophobicContact CG-CG2 4.21Å; I106-T137 WeakPolarHBondContact CD1-OG1 3.38Å; F134-T137 WeakPolarHBondContact O-CB 3.41Å; F134-T137 PolarHBondContact O-N 2.8Å; F134-T137 PolarHBondContact O-OG1 3.33Å; R135-T137 PolarHBondContact O-N 3.09Å; R135-T137 VanDerWaalsContact O-N 3.15Å; T137-F139 PolarHBondContact O-N 3.4Å
138	G	84.7	Confident	87.8	Confident	68 Å²	68	38.2 Å²	38.2	70%	0.701	22%	0.218	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.2	11.4	-176.6	0	0	0	0	0	115	R135	R135-G138 PolarHBondContact O-N 2.85Å
139	F	88.9	Confident	87.6	Confident	32 Å²	32	35.5 Å²	35.5	14%	0.14	20%	0.199	C	C	.	.	S	Bend	trans	-95.8	151.4	177.5	-56.9	-35.8	0	0	0	111.9	L85 Q89 P104 I106 T137 F141	L85-F139 HydrophobicContact CD1-CD2 4.32Å; Q89-F139 HydrophobicContact CB-CE2 4.07Å; Q89-F139 HydrophobicContact CB-CZ 4.32Å; Q89-F139 HydrophobicContact CG-CE2 4.34Å; Q89-F139 HydrophobicContact CG-CZ 4.35Å; P104-F139 HydrophobicContact CB-CD2 4.28Å; P104-F139 HydrophobicContact CB-CE2 4.39Å; P104-F139 HydrophobicContact CB-CG 4.35Å; P104-F139 HydrophobicContact CG-CD1 3.52Å; P104-F139 HydrophobicContact CG-CD2 3.98Å; P104-F139 HydrophobicContact CG-CE1 3.43Å; P104-F139 VanDerWaalsContact CG-CE1 3.43Å; P104-F139 HydrophobicContact CG-CE2 3.91Å; P104-F139 HydrophobicContact CG-CG 3.8Å; P104-F139 HydrophobicContact CG-CZ 3.63Å; I106-F139 HydrophobicContact CD1-CB 4.1Å; I106-F139 HydrophobicContact CD1-CD2 4.26Å; I106-F139 HydrophobicContact CG1-CB 4.25Å; T137-F139 PolarHBondContact O-N 3.4Å; F139-F141 PolarHBondContact O-N 3.29Å
140	P	90.8	Very high	87.2	Confident	64 Å²	64	33.1 Å²	33.1	42%	0.416	19%	0.188	S	C	.	.			trans	-61.7	131.5	170.4	25.9	-32.6	0	0	0	109.2	P104 G105 I106	P104-P140 WeakPolarHBondContact O-CD 3.35Å; G105-P140 CarbonylContact C-O 3.58Å; G105-P140 VanDerWaalsContact CA-O 3.31Å; G105-P140 WeakPolarHBondContact CA-O 3.17Å; I106-P140 PolarHBondContact N-O 2.92Å
141	F	91.4	Very high	87	Confident	22 Å²	22	38 Å²	38	10%	0.096	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130	144.3	-177.5	66.7	-91.1	0	0	0	111.7	I106 F134 R135 F139 I143	I106-F141 HydrophobicContact CB-CB 3.82Å; I106-F141 HydrophobicContact CD1-CB 4.47Å; I106-F141 HydrophobicContact CG2-CB 4.36Å; I106-F141 CarbonylContact O-C 3.59Å; I106-F141 VanDerWaalsContact O-CA 3.3Å; I106-F141 WeakPolarHBondContact O-CA 3.06Å; F134-F141 HydrophobicContact CB-CB 3.94Å; F134-F141 HydrophobicContact CB-CD1 3.91Å; F134-F141 HydrophobicContact CB-CD2 4.22Å; F134-F141 HydrophobicContact CB-CG 3.75Å; F134-F141 HydrophobicContact CD2-CB 4.23Å; F134-F141 HydrophobicContact CD2-CD2 4.14Å; F134-F141 HydrophobicContact CD2-CG 4.3Å; F134-F141 HydrophobicContact CG-CB 4.27Å; F134-F141 HydrophobicContact CG-CG 4.41Å; R135-F141 HydrophobicContact CG-CE1 3.81Å; R135-F141 HydrophobicContact CG-CZ 3.98Å; F139-F141 PolarHBondContact O-N 3.29Å; F141-I143 HydrophobicContact CD2-CD1 4.32Å; F141-I143 HydrophobicContact CD2-CG1 4.35Å; F141-I143 HydrophobicContact CE2-CD1 4.33Å
142	Y	90.2	Very high	86.7	Confident	17 Å²	17	38.1 Å²	38.1	7%	0.067	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	129	179	-49.9	-78.7	0	0	0	109.1	L72 I106 V107 Y108 V195 Y242	L72-Y142 HydrophobicContact CD1-CD2 4.22Å; L72-Y142 HydrophobicContact CD1-CE2 4.32Å; I106-Y142 VanDerWaalsContact O-CD2 3.3Å; I106-Y142 WeakPolarHBondContact O-CD2 3.43Å; I106-Y142 PolarHBondContact O-N 3.02Å; V107-Y142 CarbonylContact C-O 3.53Å; V107-Y142 WeakPolarHBondContact CA-O 3.41Å; Y108-Y142 PolarHBondContact N-O 2.95Å; Y142-V195 HydrophobicContact CD1-CG2 4.02Å; Y142-V195 HydrophobicContact CE1-CG2 4.21Å; Y142-Y242 AromaticContact CE2-CE2 3.85Å; Y142-Y242 HydrophobicContact CE2-CE2 3.85Å; Y142-Y242 WeakPolarHBondContact CE2-OH 3.45Å; Y142-Y242 PolarHBondContact OH-OH 3.14Å
143	I	88.6	Confident	86.2	Confident	12 Å²	12	36.8 Å²	36.8	6%	0.062	21%	0.21	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115	119	174.8	-67.1	174.6	0	0	0	107.3	Y108 T127 C131 F134 F141 P198	Y108-I143 HydrophobicContact CD1-CG1 4.27Å; Y108-I143 HydrophobicContact CD1-CG2 3.98Å; Y108-I143 WeakPolarHBondContact O-CA 3.44Å; T127-I143 HydrophobicContact CG2-CD1 3.77Å; T127-I143 HydrophobicContact CG2-CG2 3.75Å; C131-I143 WeakPolarHBondContact SG-CD1 3.3Å; F134-I143 HydrophobicContact CD2-CD1 4.46Å; F134-I143 HydrophobicContact CE2-CG1 4.46Å; F141-I143 HydrophobicContact CD2-CD1 4.32Å; F141-I143 HydrophobicContact CD2-CG1 4.35Å; F141-I143 HydrophobicContact CE2-CD1 4.33Å; I143-P198 WeakPolarHBondContact O-CD 3.12Å; I143-P198 WeakPolarHBondContact O-CG 2.9Å
144	L	87.8	Confident	85.2	Confident	18 Å²	18	37 Å²	37	9%	0.094	22%	0.217	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125	130.5	-173.6	-55.9	176	0	0	0	110.7	V107 Y108 I109 D110 L232 T236	V107-L144 HydrophobicContact CG2-CD1 4.2Å; Y108-L144 PolarHBondContact O-N 2.88Å; I109-L144 CarbonylContact C-O 3.46Å; I109-L144 VanDerWaalsContact CA-O 3.24Å; I109-L144 WeakPolarHBondContact CA-O 3.24Å; D110-L144 PolarHBondContact N-O 3.48Å; L144-L232 HydrophobicContact CB-CD2 4.25Å; L144-L232 HydrophobicContact CD1-CG 4.46Å; L144-T236 HydrophobicContact CD1-CG2 3.81Å; L144-T236 WeakPolarHBondContact CD1-OG1 3.23Å
145	P	87.1	Confident	84.3	Confident	11 Å²	11	40 Å²	40	7%	0.071	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69	141.2	166.9	26.4	-31.6	0	0	0	110.1	E147 Q148 P198	P145-E147 WeakPolarHBondContact CA-OE2 3.37Å; P145-E147 HydrophobicContact CB-CB 4.28Å; P145-E147 WeakPolarHBondContact CB-OE2 3.38Å; P145-E147 PolarHBondContact O-N 3.23Å; P145-Q148 HydrophobicContact CG-CG 4.13Å; P145-Q148 PolarHBondContact O-N 3.46Å; P145-P198 HydrophobicContact CG-CB 3.81Å; P145-P198 HydrophobicContact CG-CG 4.36Å
146	L	86.3	Confident	83.5	Confident	0 Å²	0	33.6 Å²	33.6	0%	0	21%	0.214	C	C	.	.	G	3₁₀ helix	trans	-62.5	-22	175.2	-177.3	71.7	0	0	0	112.4	I109 D110 A111 Q148 V149 L208 L225 F228 R229	I109-L146 HydrophobicContact CG2-CB 4.09Å; I109-L146 HydrophobicContact CG2-CD1 4.08Å; D110-L146 WeakPolarHBondContact O-CB 3.37Å; D110-L146 PolarHBondContact O-N 2.92Å; D110-L146 VanDerWaalsContact O-N 3.1Å; A111-L146 HydrophobicContact CB-CB 4.24Å; A111-L146 HydrophobicContact CB-CD1 4.41Å; A111-L146 HydrophobicContact CB-CD2 3.84Å; A111-L146 HydrophobicContact CB-CG 4.4Å; L146-Q148 PolarHBondContact O-N 2.99Å; L146-Q148 VanDerWaalsContact O-N 3.11Å; L146-V149 HydrophobicContact CD1-CG2 3.7Å; L146-V149 HydrophobicContact CG-CG2 4.27Å; L146-V149 WeakPolarHBondContact O-CB 3.47Å; L146-V149 WeakPolarHBondContact O-CG2 3.46Å; L146-V149 PolarHBondContact O-N 3.2Å; L146-L208 HydrophobicContact CB-CD2 4.27Å; L146-L208 HydrophobicContact CD2-CD1 4.4Å; L146-L208 HydrophobicContact CD2-CD2 4.17Å; L146-L208 HydrophobicContact CG-CD2 4.3Å; L146-L225 HydrophobicContact CD2-CD2 3.43Å; L146-L225 VanDerWaalsContact CD2-CD2 3.43Å; L146-F228 HydrophobicContact CD1-CB 4.16Å; L146-R229 HydrophobicContact CD1-CB 4.41Å
147	E	85.1	Confident	82.6	Confident	7 Å²	7	29.6 Å²	29.6	3%	0.033	19%	0.186	C	C	.	.	G	3₁₀ helix	trans	-51.7	-29.8	173.9	-66.8	87.3	155.2	0	0	112.8	R123 P145 V149 L150 H204 T205 L208	R123-E147 IonicContact CZ-OE1 3.28Å; R123-E147 IonicContact NH1-OE1 3.86Å; R123-E147 PolarHBondContact NH1-OE1 2.8Å; R123-E147 IonicContact NH2-OE1 2.77Å; R123-E147 PolarHBondContact NH2-OE1 3.23Å; R123-E147 IonicContact NH2-OE2 2.93Å; R123-E147 PolarHBondContact NH2-OE2 2.85Å; P145-E147 WeakPolarHBondContact CA-OE2 3.37Å; P145-E147 HydrophobicContact CB-CB 4.28Å; P145-E147 WeakPolarHBondContact CB-OE2 3.38Å; P145-E147 PolarHBondContact O-N 3.23Å; E147-V149 PolarHBondContact O-N 3.27Å; E147-V149 VanDerWaalsContact O-N 3.08Å; E147-L150 WeakPolarHBondContact O-CB 3.16Å; E147-L150 WeakPolarHBondContact O-CG 3.16Å; E147-L150 PolarHBondContact O-N 2.86Å; E147-L150 VanDerWaalsContact O-N 3.13Å; E147-H204 HydrophobicContact CB-CB 3.96Å; E147-H204 HydrophobicContact CG-CB 4.38Å; E147-T205 PolarHBondContact OE1-OG1 2.98Å; E147-L208 HydrophobicContact CG-CB 4.5Å; E147-L208 HydrophobicContact CG-CD2 3.96Å
148	Q	84.1	Confident	81.6	Confident	64 Å²	64	32 Å²	32	30%	0.299	20%	0.2	S	C	.	.	G	3₁₀ helix	trans	-62.6	-14.6	174.9	-75	179.1	7.5	0	0	113.9	P145 L146 L150 D151 L232	P145-Q148 HydrophobicContact CG-CG 4.13Å; P145-Q148 PolarHBondContact O-N 3.46Å; L146-Q148 PolarHBondContact O-N 2.99Å; L146-Q148 VanDerWaalsContact O-N 3.11Å; Q148-L150 PolarHBondContact O-N 3.47Å; Q148-D151 PolarHBondContact O-N 2.82Å; Q148-D151 VanDerWaalsContact O-N 3.15Å; Q148-L232 HydrophobicContact CB-CD1 4.08Å
149	V	82.9	Confident	80.5	Confident	2 Å²	2	32.1 Å²	32.1	1%	0.012	19%	0.189	C	C	.	.	G	3₁₀ helix	trans	-57.8	-32.3	173.5	171.7	0	0	0	0	111.1	L146 E147 D151 L152 F228 L232 P470 Y472	L146-V149 HydrophobicContact CD1-CG2 3.7Å; L146-V149 HydrophobicContact CG-CG2 4.27Å; L146-V149 WeakPolarHBondContact O-CB 3.47Å; L146-V149 WeakPolarHBondContact O-CG2 3.46Å; L146-V149 PolarHBondContact O-N 3.2Å; E147-V149 PolarHBondContact O-N 3.27Å; E147-V149 VanDerWaalsContact O-N 3.08Å; V149-D151 PolarHBondContact O-N 3.31Å; V149-L152 HydrophobicContact CB-CD1 4.21Å; V149-L152 HydrophobicContact CG1-CD1 4.13Å; V149-L152 HydrophobicContact CG2-CD1 4.16Å; V149-L152 PolarHBondContact O-N 3.14Å; V149-F228 HydrophobicContact CB-CB 4.45Å; V149-F228 HydrophobicContact CG1-CB 3.88Å; V149-F228 HydrophobicContact CG1-CD1 3.71Å; V149-F228 HydrophobicContact CG1-CE1 4.4Å; V149-F228 HydrophobicContact CG1-CG 3.79Å; V149-F228 HydrophobicContact CG2-CB 3.99Å; V149-L232 HydrophobicContact CG2-CB 3.95Å; V149-L232 HydrophobicContact CG2-CD2 4.3Å; V149-P470 HydrophobicContact CG1-CG 4.33Å; V149-Y472 HydrophobicContact CG1-CE1 3.89Å; V149-Y472 WeakPolarHBondContact CG1-OH 3.48Å; V149-Y472 WeakPolarHBondContact O-CD1 3.27Å; V149-Y472 WeakPolarHBondContact O-CE1 3.35Å
150	L	80.8	Confident	78.9	Confident	35 Å²	35	32.5 Å²	32.5	18%	0.183	20%	0.196	C	C	.	.	G	3₁₀ helix	trans	-64	-30.3	-179.7	-60.7	176.3	0	0	0	112.6	E147 Q148 H204 L207 L211 P470	E147-L150 WeakPolarHBondContact O-CB 3.16Å; E147-L150 WeakPolarHBondContact O-CG 3.16Å; E147-L150 PolarHBondContact O-N 2.86Å; E147-L150 VanDerWaalsContact O-N 3.13Å; Q148-L150 PolarHBondContact O-N 3.47Å; L150-H204 HydrophobicContact CD1-CB 4.16Å; L150-L207 HydrophobicContact CD1-CB 3.7Å; L150-L207 HydrophobicContact CD1-CD1 4.26Å; L150-L211 HydrophobicContact CD2-CD1 4.3Å; L150-P470 HydrophobicContact CD2-CB 4.41Å; L150-P470 HydrophobicContact CD2-CG 4.24Å
151	D	82	Confident	77	Confident	104 Å²	104	34.7 Å²	34.7	56%	0.556	21%	0.21	S	C	*	.	G	3₁₀ helix	trans	-98.2	7.4	-176.1	-54.7	-49.6	0	0	0	113.1	Q148 V149 H204	Q148-D151 PolarHBondContact O-N 2.82Å; Q148-D151 VanDerWaalsContact O-N 3.15Å; V149-D151 PolarHBondContact O-N 3.31Å; D151-H204 IonicContact OD1-CE1 2.81Å; D151-H204 PolarHBondContact OD1-CE1 2.94Å; D151-H204 IonicContact OD2-CE1 2.86Å; D151-H204 PolarHBondContact OD2-CE1 3.41Å; D151-H204 IonicContact OD2-ND1 3.5Å; D151-H204 PolarHBondContact OD2-ND1 3.47Å
152	L	81.4	Confident	74.9	Confident	12 Å²	12	38 Å²	38	6%	0.063	23%	0.234	C	C	.	.			trans	-66.9	143.1	-176.5	-73.7	176.4	0	0	0	111.9	V149 V156 H231 L232 H235 Y472	V149-L152 HydrophobicContact CB-CD1 4.21Å; V149-L152 HydrophobicContact CG1-CD1 4.13Å; V149-L152 HydrophobicContact CG2-CD1 4.16Å; V149-L152 PolarHBondContact O-N 3.14Å; L152-V156 HydrophobicContact CB-CG2 4.47Å; L152-V156 HydrophobicContact CD2-CG2 4.43Å; L152-H231 HydrophobicContact CD1-CB 4.08Å; L152-L232 HydrophobicContact CD2-CD1 4.05Å; L152-H235 HydrophobicContact CD2-CB 3.69Å; L152-H235 WeakPolarHBondContact CD2-CD2 3.42Å; L152-Y472 HydrophobicContact CB-CD1 3.9Å; L152-Y472 HydrophobicContact CB-CE1 4.06Å; L152-Y472 HydrophobicContact CB-CG 4.24Å; L152-Y472 HydrophobicContact CD1-CE1 4.38Å; L152-Y472 WeakPolarHBondContact O-CB 3.46Å
153	P	78.4	Confident	72.8	Confident	55 Å²	55	42 Å²	42	36%	0.357	26%	0.264	S	S	.	.			trans	-74.2	150.2	170.8	30.1	-33.7	0	0	0	111.2	S155 V156 H235	P153-S155 WeakPolarHBondContact CG-OG 3.32Å; P153-S155 PolarHBondContact O-N 3.46Å; P153-V156 WeakPolarHBondContact O-CG2 3.16Å; P153-V156 PolarHBondContact O-N 3.24Å; P153-H235 VanDerWaalsContact CD-CE1 3.46Å; P153-H235 WeakPolarHBondContact CD-CE1 3.42Å
154	G	67.6	Low	70.4	Confident	22 Å²	22	47.6 Å²	47.6	23%	0.227	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-59.6	-14.6	175.3	0	0	0	0	0	114.6	V156 L157	G154-V156 PolarHBondContact O-N 3.04Å; G154-V156 VanDerWaalsContact O-N 3.17Å; G154-L157 PolarHBondContact O-N 2.91Å
155	S	71.1	Confident	68.2	Low	62 Å²	62	52.4 Å²	52.4	43%	0.434	32%	0.316	S	S	.	.	G	3₁₀ helix	trans	-61.5	-21	176.5	62.4	0	0	0	0	113.5	P153 L157 T158 R238	P153-S155 WeakPolarHBondContact CG-OG 3.32Å; P153-S155 PolarHBondContact O-N 3.46Å; S155-L157 PolarHBondContact O-N 3.36Å; S155-T158 WeakPolarHBondContact CA-OG1 3.34Å; S155-T158 PolarHBondContact O-N 3Å; S155-T158 VanDerWaalsContact O-O 3.06Å; S155-T158 PolarHBondContact O-OG1 2.86Å; S155-R238 PolarHBondContact O-NH1 3.1Å
156	V	71.8	Confident	66.1	Low	0 Å²	0	56 Å²	56	0%	0	34%	0.339	C	S	.	.	G	3₁₀ helix	trans	-61.7	-33.1	174.4	-179.1	0	0	0	0	111.6	L152 P153 G154 H231 H235	L152-V156 HydrophobicContact CB-CG2 4.47Å; L152-V156 HydrophobicContact CD2-CG2 4.43Å; P153-V156 WeakPolarHBondContact O-CG2 3.16Å; P153-V156 PolarHBondContact O-N 3.24Å; G154-V156 PolarHBondContact O-N 3.04Å; G154-V156 VanDerWaalsContact O-N 3.17Å; V156-H231 HydrophobicContact CG1-CB 3.87Å; V156-H231 WeakPolarHBondContact CG1-O 3.48Å; V156-H235 HydrophobicContact CG2-CB 3.62Å
157	L	68.6	Low	64.1	Low	1 Å²	1	58.9 Å²	58.9	1%	0.005	37%	0.369	C	S	.	.	G	3₁₀ helix	trans	-87.9	-7.3	-176.5	-58.1	174.7	0	0	0	113.8	G154 S155 H231 A371 C374 Y472 V473 V476 R480	G154-L157 PolarHBondContact O-N 2.91Å; S155-L157 PolarHBondContact O-N 3.36Å; L157-H231 VanDerWaalsContact CD2-CE1 3.46Å; L157-H231 WeakPolarHBondContact CD2-CE1 3.49Å; L157-A371 WeakPolarHBondContact CD1-O 3.44Å; L157-A371 WeakPolarHBondContact CD2-O 3.25Å; L157-C374 WeakPolarHBondContact CD2-SG 3.26Å; L157-Y472 HydrophobicContact CD1-CD2 3.69Å; L157-Y472 HydrophobicContact CD1-CE2 3.87Å; L157-Y472 HydrophobicContact CD2-CE2 4.12Å; L157-Y472 HydrophobicContact CG-CD2 4.08Å; L157-Y472 HydrophobicContact CG-CE2 4.03Å; L157-V473 HydrophobicContact CD1-CG2 4.43Å; L157-V476 HydrophobicContact CB-CG1 4.14Å; L157-V476 HydrophobicContact CB-CG2 4.45Å; L157-V476 HydrophobicContact CD1-CB 3.83Å; L157-V476 HydrophobicContact CD1-CG1 3.96Å; L157-V476 HydrophobicContact CD1-CG2 3.92Å; L157-R480 PolarHBondContact O-NH2 2.91Å
158	T	64.7	Low	62.2	Low	64 Å²	64	64 Å²	64	39%	0.393	41%	0.405	S	S	.	.	S	Bend	trans	-102.2	132.7	174.3	49.8	0	0	0	0	110	S155 S160 R238	S155-T158 WeakPolarHBondContact CA-OG1 3.34Å; S155-T158 PolarHBondContact O-N 3Å; S155-T158 VanDerWaalsContact O-O 3.06Å; S155-T158 PolarHBondContact O-OG1 2.86Å; T158-S160 PolarHBondContact O-N 3.36Å; T158-R238 PolarHBondContact O-NH1 2.71Å; T158-R238 PolarHBondContact O-NH2 2.93Å
159	P	60.2	Low	60.9	Low	71 Å²	71	63.4 Å²	63.4	46%	0.461	41%	0.406	S	S	.	.	P	Polyproline II helix	trans	-60.5	130	168	-18.5	30.7	0	0	0	109.8	Y281	P159-Y281 VanDerWaalsContact CA-O 3.26Å; P159-Y281 WeakPolarHBondContact CA-O 3.21Å
160	S	56.2	Low	60	Low	40 Å²	40	65.8 Å²	65.8	28%	0.28	42%	0.415	S	S	.	.	P	Polyproline II helix	trans	-76.7	151.3	166.6	69.8	0	0	0	0	109	T158 Y281 G282 G283	T158-S160 PolarHBondContact O-N 3.36Å; S160-Y281 PolarHBondContact N-O 2.91Å; S160-G282 VanDerWaalsContact O-CA 3.31Å; S160-G282 WeakPolarHBondContact O-CA 3.32Å; S160-G282 PolarHBondContact OG-O 3.39Å; S160-G283 VanDerWaalsContact OG-CA 3.28Å; S160-G283 WeakPolarHBondContact OG-CA 3.38Å; S160-G283 PolarHBondContact OG-N 3.23Å; S160-G283 VanDerWaalsContact OG-N 3.14Å
161	P	50.1	Low	59.2	Low	110 Å²	110	71.2 Å²	71.2	71%	0.714	44%	0.437	S	S	*	.	P	Polyproline II helix	trans	-52.8	138.2	176.7	20.2	-31.4	0	0	0	110.1	S163	P161-S163 PolarHBondContact O-N 3.41Å
162	P	47.8	Very low	58.3	Low	92 Å²	92	69 Å²	69	60%	0.597	43%	0.433	S	S	*	.	P	Polyproline II helix	trans	-62	128	177.9	24.9	-31.2	0	0	0	109.2	D164	P162-D164 VanDerWaalsContact C-N 3.25Å; P162-D164 PolarHBondContact O-N 2.74Å
163	S	45.4	Very low	57.5	Low	100 Å²	100	69.7 Å²	69.7	70%	0.699	44%	0.441	S	S	*	.			trans	-75.3	88.6	159.1	66.4	0	0	0	0	106.6	P161 Q165	P161-S163 PolarHBondContact O-N 3.41Å; S163-Q165 PolarHBondContact O-N 2.6Å
164	D	39	Very low	56.9	Low	129 Å²	129	68.5 Å²	68.5	69%	0.69	43%	0.432	S	S	*	.			trans	-62.8	117.5	-179.6	-84.7	-31.1	0	0	0	111.1	P162	P162-D164 VanDerWaalsContact C-N 3.25Å; P162-D164 PolarHBondContact O-N 2.74Å
165	Q	41.8	Very low	56.8	Low	120 Å²	120	70.4 Å²	70.4	56%	0.561	44%	0.437	S	S	*	.			trans	-134.6	93.9	158.5	-76.6	-91.3	-23.3	0	0	106.8	S163	S163-Q165 PolarHBondContact O-N 2.6Å
166	P	42.9	Very low	56.7	Low	86 Å²	86	73 Å²	73	56%	0.558	45%	0.446	S	S	*	.			trans	-61.4	145.1	179.1	-20.1	30.5	0	0	0	111.7	S168 V169	P166-S168 PolarHBondContact O-N 3.35Å; P166-V169 PolarHBondContact O-N 3.31Å
167	G	44.4	Very low	56.4	Low	61 Å²	61	77.3 Å²	77.3	63%	0.629	47%	0.465	S	S	*	.	G	3₁₀ helix	trans	-57.1	-10.6	-177.7	0	0	0	0	0	116.4	V169 Y170	G167-V169 PolarHBondContact O-N 2.87Å; G167-Y170 PolarHBondContact O-N 3.02Å
168	S	45.2	Very low	56.4	Low	113 Å²	113	81.6 Å²	81.6	79%	0.79	49%	0.487	S	S	*	.	G	3₁₀ helix	trans	-63.1	-23.6	169	-171.3	0	0	0	0	112.8	P166	P166-S168 PolarHBondContact O-N 3.35Å
169	V	57.2	Low	56.3	Low	52 Å²	52	86 Å²	86	32%	0.315	50%	0.503	S	S	.	.	G	3₁₀ helix	trans	-87.6	-9.9	-179.4	-170.5	0	0	0	0	112	P166 G167 K171 A172 A173	P166-V169 PolarHBondContact O-N 3.31Å; G167-V169 PolarHBondContact O-N 2.87Å; V169-K171 PolarHBondContact O-N 3.39Å; V169-A172 CarbonylContact O-C 3.46Å; V169-A172 PolarHBondContact O-N 2.91Å; V169-A173 VanDerWaalsContact O-CB 3.3Å; V169-A173 WeakPolarHBondContact O-CB 3.46Å; V169-A173 PolarHBondContact O-N 3.22Å
170	Y	63.6	Low	56.1	Low	52 Å²	52	86.1 Å²	86.1	20%	0.204	51%	0.506	C	S	.	.	H	α-helix	trans	-60.6	-44	-175.1	-174.3	-87.2	0	0	0	113.1	R63 I65 F66 G167 A173 V174	R63-Y170 HydrophobicContact CB-CD1 4.38Å; R63-Y170 HydrophobicContact CB-CD2 4.12Å; R63-Y170 HydrophobicContact CB-CE1 4.48Å; R63-Y170 HydrophobicContact CB-CE2 4.23Å; R63-Y170 HydrophobicContact CB-CG 4.21Å; R63-Y170 HydrophobicContact CG-CD1 4.38Å; R63-Y170 HydrophobicContact CG-CE1 4.31Å; I65-Y170 WeakPolarHBondContact O-CE2 3.47Å; F66-Y170 AromaticContact CD1-CD2 3.47Å; F66-Y170 HydrophobicContact CD1-CD2 3.47Å; F66-Y170 VanDerWaalsContact CD1-CD2 3.47Å; F66-Y170 HydrophobicContact CD1-CE2 4.2Å; F66-Y170 HydrophobicContact CD1-CG 4.24Å; F66-Y170 AromaticContact CE1-CD2 3.6Å; F66-Y170 HydrophobicContact CE1-CD2 3.6Å; F66-Y170 HydrophobicContact CE1-CG 4.12Å; F66-Y170 HydrophobicContact CG-CD2 4.07Å; F66-Y170 HydrophobicContact CG-CE2 4.45Å; F66-Y170 HydrophobicContact CZ-CD2 4.26Å; G167-Y170 PolarHBondContact O-N 3.02Å; Y170-A173 PolarHBondContact O-N 3.38Å; Y170-V174 HydrophobicContact CD1-CG2 3.99Å; Y170-V174 HydrophobicContact CE1-CG2 3.63Å; Y170-V174 WeakPolarHBondContact O-CB 3.38Å; Y170-V174 WeakPolarHBondContact O-CG2 3.43Å; Y170-V174 PolarHBondContact O-N 3.3Å
171	K	63.6	Low	55.5	Low	150 Å²	150	86.6 Å²	86.6	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-66.9	-43.4	177.7	-167.2	-178.9	175.4	-171.7	0	110.8	V169 A173 V174 D175	V169-K171 PolarHBondContact O-N 3.39Å; K171-A173 PolarHBondContact O-N 3.5Å; K171-V174 PolarHBondContact O-N 3.01Å; K171-D175 WeakPolarHBondContact O-CB 3.35Å; K171-D175 PolarHBondContact O-N 3.36Å
172	A	64.4	Low	55.1	Low	56 Å²	56	89.7 Å²	89.7	46%	0.463	53%	0.527	S	S	.	.	H	α-helix	trans	-63.8	-39	176.5	0	0	0	0	0	113	V169 D175 L176	V169-A172 CarbonylContact O-C 3.46Å; V169-A172 PolarHBondContact O-N 2.91Å; A172-D175 PolarHBondContact O-N 3.47Å; A172-L176 WeakPolarHBondContact O-CB 3.44Å; A172-L176 PolarHBondContact O-N 3.46Å
173	A	63.2	Low	54.4	Low	27 Å²	27	90.2 Å²	90.2	22%	0.223	53%	0.533	C	S	.	.	H	α-helix	trans	-68.3	-38.3	175.7	0	0	0	0	0	111.8	F66 V169 Y170 K171 F177	F66-A173 HydrophobicContact CD1-CB 4.23Å; V169-A173 VanDerWaalsContact O-CB 3.3Å; V169-A173 WeakPolarHBondContact O-CB 3.46Å; V169-A173 PolarHBondContact O-N 3.22Å; Y170-A173 PolarHBondContact O-N 3.38Å; K171-A173 PolarHBondContact O-N 3.5Å; A173-F177 WeakPolarHBondContact O-CB 3.35Å; A173-F177 PolarHBondContact O-N 3.35Å
174	V	66	Low	54.2	Low	30 Å²	30	90.6 Å²	90.6	18%	0.182	54%	0.536	C	S	.	.	H	α-helix	trans	-66.2	-43.7	172.8	172	0	0	0	0	110.8	P67 Y170 K171 F177 L178	P67-V174 HydrophobicContact CG-CG2 3.64Å; Y170-V174 HydrophobicContact CD1-CG2 3.99Å; Y170-V174 HydrophobicContact CE1-CG2 3.63Å; Y170-V174 WeakPolarHBondContact O-CB 3.38Å; Y170-V174 WeakPolarHBondContact O-CG2 3.43Å; Y170-V174 PolarHBondContact O-N 3.3Å; K171-V174 PolarHBondContact O-N 3.01Å; V174-F177 PolarHBondContact O-N 3.04Å; V174-L178 HydrophobicContact CG1-CD1 3.91Å; V174-L178 HydrophobicContact CG1-CG 4.46Å; V174-L178 WeakPolarHBondContact O-CB 3.5Å; V174-L178 WeakPolarHBondContact O-CG 3.45Å; V174-L178 PolarHBondContact O-N 2.86Å
175	D	65.9	Low	53.8	Low	63 Å²	63	90 Å²	90	34%	0.337	54%	0.542	S	S	.	.	H	α-helix	trans	-67.5	-41.6	179.5	-68	-20.7	0	0	0	111.1	K171 A172 L178 Q179	K171-D175 WeakPolarHBondContact O-CB 3.35Å; K171-D175 PolarHBondContact O-N 3.36Å; A172-D175 PolarHBondContact O-N 3.47Å; D175-L178 PolarHBondContact O-N 2.89Å; D175-Q179 WeakPolarHBondContact O-CB 3.46Å; D175-Q179 WeakPolarHBondContact O-CG 3.38Å; D175-Q179 PolarHBondContact O-N 2.81Å
176	L	69.8	Low	53.2	Low	117 Å²	117	91.7 Å²	91.7	61%	0.613	56%	0.555	S	S	*	*	H	α-helix	trans	-62.1	-44.7	173.6	-171.5	72	0	0	0	111.3	A172 L178 Q179 S180	A172-L176 WeakPolarHBondContact O-CB 3.44Å; A172-L176 PolarHBondContact O-N 3.46Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 PolarHBondContact O-N 3.1Å; L176-Q179 PolarHBondContact O-N 3.4Å; L176-S180 PolarHBondContact O-N 2.88Å; L176-S180 PolarHBondContact O-OG 2.99Å
177	F	65.4	Low	52.5	Low	90 Å²	90	90.5 Å²	90.5	40%	0.395	56%	0.558	S	S	.	*	H	α-helix	trans	-65.4	-33.8	176.8	-173.6	-86.7	0	0	0	112.7	P67 R101 A173 V174 S180	P67-F177 HydrophobicContact CB-CB 4.36Å; P67-F177 HydrophobicContact CB-CD1 4.27Å; P67-F177 HydrophobicContact CB-CD2 4.19Å; P67-F177 HydrophobicContact CB-CG 4Å; R101-F177 HydrophobicContact CB-CE1 4.48Å; R101-F177 HydrophobicContact CG-CE1 4.34Å; A173-F177 WeakPolarHBondContact O-CB 3.35Å; A173-F177 PolarHBondContact O-N 3.35Å; V174-F177 PolarHBondContact O-N 3.04Å; F177-S180 WeakPolarHBondContact CA-OG 3.17Å; F177-S180 PolarHBondContact O-OG 2.97Å
178	L	68.5	Low	51.5	Low	90 Å²	90	97.1 Å²	97.1	47%	0.471	57%	0.569	S	S	.	*	H	α-helix	trans	-71	-37	173.9	-77.1	168.2	0	0	0	112.1	V174 D175 L176 G181	V174-L178 HydrophobicContact CG1-CD1 3.91Å; V174-L178 HydrophobicContact CG1-CG 4.46Å; V174-L178 WeakPolarHBondContact O-CB 3.5Å; V174-L178 WeakPolarHBondContact O-CG 3.45Å; V174-L178 PolarHBondContact O-N 2.86Å; D175-L178 PolarHBondContact O-N 2.89Å; L176-L178 VanDerWaalsContact C-N 3.32Å; L176-L178 PolarHBondContact O-N 3.1Å; L178-G181 PolarHBondContact O-N 3.12Å
179	Q	62.4	Low	50.6	Low	158 Å²	158	96 Å²	96	74%	0.738	57%	0.567	S	S	*	*	H	α-helix	trans	-72.9	-32.1	178.5	-73.3	169.5	18.2	0	0	112.2	D175 L176 G181	D175-Q179 WeakPolarHBondContact O-CB 3.46Å; D175-Q179 WeakPolarHBondContact O-CG 3.38Å; D175-Q179 PolarHBondContact O-N 2.81Å; L176-Q179 PolarHBondContact O-N 3.4Å; Q179-G181 PolarHBondContact O-N 3.06Å
180	S	55.4	Low	49.3	Very low	73 Å²	73	101.4 Å²	101.4	51%	0.51	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-80.2	23.3	172.8	59.8	0	0	0	0	113.9	L176 F177 D182	L176-S180 PolarHBondContact O-N 2.88Å; L176-S180 PolarHBondContact O-OG 2.99Å; F177-S180 WeakPolarHBondContact CA-OG 3.17Å; F177-S180 PolarHBondContact O-OG 2.97Å; S180-D182 PolarHBondContact O-N 2.93Å
181	G	43.3	Very low	47.6	Very low	49 Å²	49	106.7 Å²	106.7	51%	0.505	62%	0.615	S	S	.	*	T	Hydrogen-bonded Turn	trans	-53.7	133.7	-173.9	0	0	0	0	0	114.3	L178 Q179 S183	L178-G181 PolarHBondContact O-N 3.12Å; Q179-G181 PolarHBondContact O-N 3.06Å; G181-S183 VanDerWaalsContact C-N 3.29Å; G181-S183 PolarHBondContact O-N 2.84Å
182	D	41	Very low	46.3	Very low	175 Å²	175	108.9 Å²	108.9	94%	0.936	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	49.3	31	163.5	-83.3	-4.6	0	0	0	118.3	S180 S184	S180-D182 PolarHBondContact O-N 2.93Å; D182-S184 VanDerWaalsContact C-N 3.35Å; D182-S184 PolarHBondContact O-N 3.12Å; D182-S184 VanDerWaalsContact O-N 3.11Å
183	S	34.5	Very low	45.1	Very low	104 Å²	104	111.6 Å²	111.6	73%	0.727	63%	0.631	S	S	*	*			trans	-76.6	95.6	154.2	-53.7	0	0	0	0	107.8	G181 S185	G181-S183 VanDerWaalsContact C-N 3.29Å; G181-S183 PolarHBondContact O-N 2.84Å; S183-S185 PolarHBondContact O-N 2.57Å
184	S	40.3	Very low	43.7	Very low	107 Å²	107	114.2 Å²	114.2	75%	0.748	65%	0.647	S	S	*	*			trans	-31.1	101.3	168.6	52	0	0	0	0	113.4	D182 D186	D182-S184 VanDerWaalsContact C-N 3.35Å; D182-S184 PolarHBondContact O-N 3.12Å; D182-S184 VanDerWaalsContact O-N 3.11Å; S184-D186 PolarHBondContact O-N 3.48Å
185	S	31.1	Very low	42.7	Very low	118 Å²	118	114.9 Å²	114.9	83%	0.825	65%	0.651	S	S	*	*			trans	-85.6	76.4	140	65.8	0	0	0	0	106.1	S183	S183-S185 PolarHBondContact O-N 2.57Å
186	D	28.5	Very low	41.6	Very low	154 Å²	154	116 Å²	116	82%	0.824	66%	0.664	S	S	*	*			trans	-51.9	139.8	161.8	-148.3	-5.8	0	0	0	108.1	S184 K188	S184-D186 PolarHBondContact O-N 3.48Å; D186-K188 PolarHBondContact O-N 2.97Å
187	G	28.9	Very low	40.6	Very low	61 Å²	61	116 Å²	116	63%	0.629	66%	0.664	S	S	*	*			trans	-55.3	126.8	-159.8	0	0	0	0	0	113.5	A189	G187-A189 PolarHBondContact O-N 3.41Å
188	K	23.5	Very low	40	Very low	200 Å²	200	113.2 Å²	113.2	87%	0.87	66%	0.655	S	S	*	*				-73.6	98.8	121.9	-74.7	-171.5	177.6	-176.5	0	104.8	D186 E190	D186-K188 PolarHBondContact O-N 2.97Å; K188-E190 PolarHBondContact O-N 2.89Å
189	A	26.8	Very low	39.3	Very low	90 Å²	90	113.3 Å²	113.3	74%	0.744	67%	0.669	S	S	*	*			trans	-53.1	86.1	150.8	0	0	0	0	0	105.7	G187 E191	G187-A189 PolarHBondContact O-N 3.41Å; A189-E191 VanDerWaalsContact C-N 3.29Å; A189-E191 PolarHBondContact O-N 2.92Å
190	E	28.5	Very low	39.3	Very low	165 Å²	165	108.4 Å²	108.4	77%	0.771	65%	0.649	S	S	*	*			trans	-53.9	112.9	150.8	-72.7	-178	173.1	0	0	102.6	K188	K188-E190 PolarHBondContact O-N 2.89Å
191	E	28.6	Very low	39.8	Very low	163 Å²	163	110.2 Å²	110.2	76%	0.762	65%	0.65	S	S	*	*			trans	-37	145.4	179.8	-67.1	165.7	150.7	0	0	108.9	A189 E193	A189-E191 VanDerWaalsContact C-N 3.29Å; A189-E191 PolarHBondContact O-N 2.92Å; E191-E193 PolarHBondContact O-N 2.65Å
192	Q	36.5	Very low	41.2	Very low	197 Å²	197	113.9 Å²	113.9	92%	0.921	65%	0.654	S	S	*	*			trans	-51.5	91.9	159.7	-85.2	163.4	-42	0	0	106.9	C194	Q192-C194 PolarHBondContact O-N 3.49Å
193	E	38.5	Very low	43	Very low	112 Å²	112	108.7 Å²	108.7	52%	0.523	63%	0.631	S	S	.	*			trans	-69.5	76.2	168.2	-94.1	-163.2	155.9	0	0	104.1	E191 V195 R240	E191-E193 PolarHBondContact O-N 2.65Å; E193-V195 HydrophobicContact CB-CG2 4.32Å; E193-V195 PolarHBondContact O-N 3.21Å; E193-R240 IonicContact OE2-NH1 2.81Å; E193-R240 PolarHBondContact OE2-NH1 3.28Å
194	C	34.3	Very low	45.1	Very low	82 Å²	82	105.5 Å²	105.5	55%	0.554	61%	0.605	S	S	*	*			trans	-62.8	82.2	153.7	178.6	0	0	0	0	104.6	Q192 S196	Q192-C194 PolarHBondContact O-N 3.49Å; C194-S196 VanDerWaalsContact C-N 3.34Å; C194-S196 PolarHBondContact O-N 2.68Å
195	V	45.8	Very low	47.1	Very low	44 Å²	44	101.2 Å²	101.2	27%	0.267	57%	0.574	S	S	.	*			trans	-61.8	108.9	169.1	179.7	0	0	0	0	105	Y142 E193 L197	Y142-V195 HydrophobicContact CD1-CG2 4.02Å; Y142-V195 HydrophobicContact CE1-CG2 4.21Å; E193-V195 HydrophobicContact CB-CG2 4.32Å; E193-V195 PolarHBondContact O-N 3.21Å; V195-L197 PolarHBondContact O-N 3.29Å
196	S	42.9	Very low	49.6	Very low	88 Å²	88	103.2 Å²	103.2	62%	0.615	56%	0.564	S	S	*	*			trans	-38.1	134.2	176.3	39.4	0	0	0	0	111	C194 P198	C194-S196 VanDerWaalsContact C-N 3.34Å; C194-S196 PolarHBondContact O-N 2.68Å; S196-P198 VanDerWaalsContact O-CD 3.24Å; S196-P198 WeakPolarHBondContact O-CD 3.05Å
197	L	48.8	Very low	52.2	Low	115 Å²	115	100 Å²	100	60%	0.602	55%	0.546	S	S	*	.			trans	-40.2	112.4	167.8	-74.3	160.2	0	0	0	108.1	T127 V195 A199	T127-L197 HydrophobicContact CG2-CD2 3.32Å; V195-L197 PolarHBondContact O-N 3.29Å; L197-A199 PolarHBondContact O-N 2.83Å; L197-A199 VanDerWaalsContact O-N 3.1Å
198	P	52.7	Low	54.9	Low	33 Å²	33	97.2 Å²	97.2	21%	0.214	52%	0.517	C	S	.	.			trans	-57.6	125.7	-176.1	-28.2	37.6	0	0	0	108.4	I143 P145 S196 V200	I143-P198 WeakPolarHBondContact O-CD 3.12Å; I143-P198 WeakPolarHBondContact O-CG 2.9Å; P145-P198 HydrophobicContact CG-CB 3.81Å; P145-P198 HydrophobicContact CG-CG 4.36Å; S196-P198 VanDerWaalsContact O-CD 3.24Å; S196-P198 WeakPolarHBondContact O-CD 3.05Å; P198-V200 PolarHBondContact O-N 2.99Å
199	A	54	Low	57.9	Low	92 Å²	92	91.1 Å²	91.1	76%	0.76	49%	0.491	S	S	*	.			trans	-60	105.3	172.3	0	0	0	0	0	107.1	L197 Q201	L197-A199 PolarHBondContact O-N 2.83Å; L197-A199 VanDerWaalsContact O-N 3.1Å; A199-Q201 PolarHBondContact O-N 3.47Å
200	V	61.3	Low	60.7	Low	54 Å²	54	92.9 Å²	92.9	33%	0.327	48%	0.484	S	S	.	.			trans	-63.2	105.5	177.3	179.2	0	0	0	0	107	P198 E202 T205	P198-V200 PolarHBondContact O-N 2.99Å; V200-E202 PolarHBondContact O-N 3.27Å; V200-T205 VanDerWaalsContact CG1-OG1 3.23Å; V200-T205 WeakPolarHBondContact CG1-OG1 3.48Å
201	Q	67	Low	63.5	Low	111 Å²	111	85.2 Å²	85.2	52%	0.519	45%	0.448	S	S	.	.			trans	-71.7	116.7	173.8	-69.4	-175.1	-10.8	0	0	108.4	A199 S203 H204 T205	A199-Q201 PolarHBondContact O-N 3.47Å; Q201-S203 PolarHBondContact O-N 3.16Å; Q201-S203 VanDerWaalsContact O-N 3.15Å; Q201-H204 HydrophobicContact CB-CB 4.44Å; Q201-H204 PolarHBondContact O-N 3.5Å; Q201-H204 PolarHBondContact OE1-CE1 3.04Å; Q201-H204 PolarHBondContact OE1-NE2 3.18Å; Q201-T205 PolarHBondContact O-N 3.08Å; Q201-T205 PolarHBondContact O-OG1 3.39Å
202	E	72.9	Confident	66.3	Low	127 Å²	127	77.7 Å²	77.7	59%	0.593	41%	0.413	S	S	*	.	H	α-helix	trans	-59	-28.9	-177.3	-65.6	-178.3	-179.9	0	0	112.7	V200 R206	V200-E202 PolarHBondContact O-N 3.27Å; E202-R206 WeakPolarHBondContact O-CG 3.27Å; E202-R206 PolarHBondContact O-N 2.57Å; E202-R206 VanDerWaalsContact O-N 3.1Å
203	S	77.3	Confident	68.6	Low	66 Å²	66	70.6 Å²	70.6	46%	0.462	39%	0.393	S	S	.	.	H	α-helix	trans	-60.7	-49.3	173.1	49.7	0	0	0	0	112.1	Q201 T205 R206 L207	Q201-S203 PolarHBondContact O-N 3.16Å; Q201-S203 VanDerWaalsContact O-N 3.15Å; S203-T205 VanDerWaalsContact C-N 3.34Å; S203-T205 PolarHBondContact O-N 2.96Å; S203-R206 PolarHBondContact O-N 3.33Å; S203-L207 WeakPolarHBondContact O-CG 3.48Å; S203-L207 PolarHBondContact O-N 3.33Å
204	H	80.1	Confident	71	Confident	37 Å²	37	65.6 Å²	65.6	17%	0.171	37%	0.37	C	S	.	.	H	α-helix	trans	-69.7	-34.2	-178.1	-69.4	-161.4	0	0	0	111.3	E147 L150 D151 Q201 L207 L208	E147-H204 HydrophobicContact CB-CB 3.96Å; E147-H204 HydrophobicContact CG-CB 4.38Å; L150-H204 HydrophobicContact CD1-CB 4.16Å; D151-H204 IonicContact OD1-CE1 2.81Å; D151-H204 PolarHBondContact OD1-CE1 2.94Å; D151-H204 IonicContact OD2-CE1 2.86Å; D151-H204 PolarHBondContact OD2-CE1 3.41Å; D151-H204 IonicContact OD2-ND1 3.5Å; D151-H204 PolarHBondContact OD2-ND1 3.47Å; Q201-H204 HydrophobicContact CB-CB 4.44Å; Q201-H204 PolarHBondContact O-N 3.5Å; Q201-H204 PolarHBondContact OE1-CE1 3.04Å; Q201-H204 PolarHBondContact OE1-NE2 3.18Å; H204-L207 PolarHBondContact O-N 3.5Å; H204-L208 WeakPolarHBondContact O-CB 3.22Å; H204-L208 PolarHBondContact O-N 3.15Å
205	T	81.6	Confident	73.5	Confident	17 Å²	17	61.7 Å²	61.7	10%	0.104	34%	0.344	C	S	.	.	H	α-helix	trans	-62	-43.9	172.9	-50	0	0	0	0	111.6	E147 V200 Q201 S203 L208 Q209	E147-T205 PolarHBondContact OE1-OG1 2.98Å; V200-T205 VanDerWaalsContact CG1-OG1 3.23Å; V200-T205 WeakPolarHBondContact CG1-OG1 3.48Å; Q201-T205 PolarHBondContact O-N 3.08Å; Q201-T205 PolarHBondContact O-OG1 3.39Å; S203-T205 VanDerWaalsContact C-N 3.34Å; S203-T205 PolarHBondContact O-N 2.96Å; T205-L208 PolarHBondContact O-N 2.65Å; T205-Q209 VanDerWaalsContact O-CG 3.28Å; T205-Q209 WeakPolarHBondContact O-CG 3.32Å; T205-Q209 PolarHBondContact O-N 3.37Å
206	R	83	Confident	75.5	Confident	160 Å²	160	66.8 Å²	66.8	60%	0.604	36%	0.364	S	S	*	.	H	α-helix	trans	-64.6	-42.2	176.7	-73.6	178.3	-175.4	173.1	5.1	112	E202 S203 Q209 Q210	E202-R206 WeakPolarHBondContact O-CG 3.27Å; E202-R206 PolarHBondContact O-N 2.57Å; E202-R206 VanDerWaalsContact O-N 3.1Å; S203-R206 PolarHBondContact O-N 3.33Å; R206-Q209 WeakPolarHBondContact O-CB 3.21Å; R206-Q209 PolarHBondContact O-N 3.42Å; R206-Q210 WeakPolarHBondContact O-CG 3.4Å; R206-Q210 PolarHBondContact O-N 2.64Å
207	L	84.4	Confident	77.8	Confident	87 Å²	87	65.5 Å²	65.5	46%	0.455	35%	0.353	S	S	.	.	H	α-helix	trans	-62	-44.2	175.8	-72.4	170.4	0	0	0	111.6	L150 S203 H204 Q209 Q210 L211	L150-L207 HydrophobicContact CD1-CB 3.7Å; L150-L207 HydrophobicContact CD1-CD1 4.26Å; S203-L207 WeakPolarHBondContact O-CG 3.48Å; S203-L207 PolarHBondContact O-N 3.33Å; H204-L207 PolarHBondContact O-N 3.5Å; L207-Q209 VanDerWaalsContact C-N 3.32Å; L207-Q209 PolarHBondContact O-N 2.92Å; L207-Q210 PolarHBondContact O-N 2.82Å; L207-L211 WeakPolarHBondContact O-CB 3.23Å; L207-L211 PolarHBondContact O-N 2.76Å
208	L	85	Confident	79.7	Confident	2 Å²	2	62.1 Å²	62.1	1%	0.01	34%	0.335	C	S	.	.	H	α-helix	trans	-61.8	-40.6	175.2	-179.1	64.8	0	0	0	111.6	L146 E147 H204 T205 L211 I212	L146-L208 HydrophobicContact CB-CD2 4.27Å; L146-L208 HydrophobicContact CD2-CD1 4.4Å; L146-L208 HydrophobicContact CD2-CD2 4.17Å; L146-L208 HydrophobicContact CG-CD2 4.3Å; E147-L208 HydrophobicContact CG-CB 4.5Å; E147-L208 HydrophobicContact CG-CD2 3.96Å; H204-L208 WeakPolarHBondContact O-CB 3.22Å; H204-L208 PolarHBondContact O-N 3.15Å; T205-L208 PolarHBondContact O-N 2.65Å; L208-L211 PolarHBondContact O-N 2.82Å; L208-I212 HydrophobicContact CD1-CG1 4.2Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 3.18Å
209	Q	85.3	Confident	81.6	Confident	72 Å²	72	61.6 Å²	61.6	34%	0.336	33%	0.332	S	S	.	.	H	α-helix	trans	-64.7	-40.2	175.3	-74.7	172.3	-4.9	0	0	112.4	G114 G117 T205 R206 L207 G213	G114-Q209 VanDerWaalsContact O-CG 3.28Å; G114-Q209 WeakPolarHBondContact O-CG 3.19Å; G114-Q209 PolarHBondContact O-NE2 3.39Å; G114-Q209 VanDerWaalsContact O-NE2 3.12Å; G117-Q209 VanDerWaalsContact CA-NE2 3.35Å; T205-Q209 VanDerWaalsContact O-CG 3.28Å; T205-Q209 WeakPolarHBondContact O-CG 3.32Å; T205-Q209 PolarHBondContact O-N 3.37Å; R206-Q209 WeakPolarHBondContact O-CB 3.21Å; R206-Q209 PolarHBondContact O-N 3.42Å; L207-Q209 VanDerWaalsContact C-N 3.32Å; L207-Q209 PolarHBondContact O-N 2.92Å; Q209-G213 WeakPolarHBondContact O-CA 3.43Å; Q209-G213 PolarHBondContact O-N 3.14Å
210	Q	86.8	Confident	83.3	Confident	127 Å²	127	57.4 Å²	57.4	59%	0.593	30%	0.297	S	S	*	.	H	α-helix	trans	-64.1	-42.9	174	-74.2	175.4	-29.2	0	0	111.3	R206 L207 G213 S214	R206-Q210 WeakPolarHBondContact O-CG 3.4Å; R206-Q210 PolarHBondContact O-N 2.64Å; L207-Q210 PolarHBondContact O-N 2.82Å; Q210-G213 PolarHBondContact O-N 3.15Å; Q210-S214 PolarHBondContact O-N 2.77Å
211	L	86.9	Confident	84.7	Confident	4 Å²	4	57.1 Å²	57.1	2%	0.021	29%	0.292	C	S	.	.	H	α-helix	trans	-59.6	-55.2	176.4	-172.3	167.4	0	0	0	110.8	L150 L207 L208 G213 S214 L224 F228 C468 P470	L150-L211 HydrophobicContact CD2-CD1 4.3Å; L207-L211 WeakPolarHBondContact O-CB 3.23Å; L207-L211 PolarHBondContact O-N 2.76Å; L208-L211 PolarHBondContact O-N 2.82Å; L211-G213 VanDerWaalsContact C-N 3.28Å; L211-G213 PolarHBondContact O-N 3.27Å; L211-S214 WeakPolarHBondContact O-CB 3.3Å; L211-S214 PolarHBondContact O-N 3.23Å; L211-S214 PolarHBondContact O-OG 3.24Å; L211-L224 HydrophobicContact CD2-CD1 4.27Å; L211-F228 HydrophobicContact CD1-CE2 4.04Å; L211-F228 HydrophobicContact CD1-CZ 4.22Å; L211-F228 HydrophobicContact CD2-CE2 3.52Å; L211-F228 HydrophobicContact CD2-CZ 4.14Å; L211-F228 HydrophobicContact CG-CE2 4.49Å; L211-C468 WeakPolarHBondContact CD1-O 3.34Å; L211-C468 WeakPolarHBondContact CG-O 3.5Å; L211-P470 HydrophobicContact CD1-CG 3.92Å
212	I	86.9	Confident	85.7	Confident	5 Å²	5	52.3 Å²	52.3	3%	0.026	27%	0.269	C	S	.	.	H	α-helix	trans	-67.8	-32.9	-179.3	-60.3	-60.6	0	0	0	111	L208 S214 A215 K221 L224 L225	L208-I212 HydrophobicContact CD1-CG1 4.2Å; L208-I212 WeakPolarHBondContact O-CG1 3.25Å; L208-I212 PolarHBondContact O-N 3.18Å; I212-S214 VanDerWaalsContact C-N 3.28Å; I212-S214 PolarHBondContact O-N 2.82Å; I212-A215 PolarHBondContact O-N 3.16Å; I212-K221 HydrophobicContact CG2-CB 4.02Å; I212-K221 HydrophobicContact CG2-CD 4.03Å; I212-K221 HydrophobicContact CG2-CG 3.91Å; I212-K221 VanDerWaalsContact O-CE 3.23Å; I212-K221 WeakPolarHBondContact O-CE 3.39Å; I212-K221 WeakPolarHBondContact O-CG 3.24Å; I212-L224 HydrophobicContact CD1-CB 4.1Å; I212-L225 HydrophobicContact CD1-CD2 3.52Å; I212-L225 HydrophobicContact CD1-CG 3.92Å; I212-L225 HydrophobicContact CG1-CD2 3.9Å
213	G	85.4	Confident	86.5	Confident	47 Å²	47	46.9 Å²	46.9	49%	0.485	24%	0.244	S	C	.	.	H	α-helix	trans	-66.6	-26.1	174.8	0	0	0	0	0	113.9	Q209 Q210 L211 A215	Q209-G213 WeakPolarHBondContact O-CA 3.43Å; Q209-G213 PolarHBondContact O-N 3.14Å; Q210-G213 PolarHBondContact O-N 3.15Å; L211-G213 VanDerWaalsContact C-N 3.28Å; L211-G213 PolarHBondContact O-N 3.27Å; G213-A215 VanDerWaalsContact C-N 3.29Å; G213-A215 PolarHBondContact O-N 3.42Å
214	S	87.9	Confident	87	Confident	7 Å²	7	43.7 Å²	43.7	5%	0.049	22%	0.222	C	C	.	.	H	α-helix	trans	-66.6	-28.6	178.9	74.1	0	0	0	0	113.4	Q210 L211 I212 M463 S464	Q210-S214 PolarHBondContact O-N 2.77Å; L211-S214 WeakPolarHBondContact O-CB 3.3Å; L211-S214 PolarHBondContact O-N 3.23Å; L211-S214 PolarHBondContact O-OG 3.24Å; I212-S214 VanDerWaalsContact C-N 3.28Å; I212-S214 PolarHBondContact O-N 2.82Å; S214-M463 CarbonylContact O-C 3.59Å; S214-M463 WeakPolarHBondContact O-CA 3.36Å; S214-M463 WeakPolarHBondContact OG-CE 3.46Å; S214-S464 WeakPolarHBondContact CB-OG 3.18Å; S214-S464 PolarHBondContact O-N 3.14Å
215	A	88.1	Confident	87.5	Confident	0 Å²	0	42.3 Å²	42.3	0%	0	22%	0.215	C	C	.	.	B	Isolated β-bridge	trans	-76.4	126.6	174.7	0	0	0	0	0	110.3	I212 G213 A220 K221 L224 M463	I212-A215 PolarHBondContact O-N 3.16Å; G213-A215 VanDerWaalsContact C-N 3.29Å; G213-A215 PolarHBondContact O-N 3.42Å; A215-A220 HydrophobicContact CB-CB 3.92Å; A215-K221 HydrophobicContact CB-CG 3.89Å; A215-K221 WeakPolarHBondContact O-CE 3.46Å; A215-L224 HydrophobicContact CB-CD1 4.14Å; A215-M463 HydrophobicContact CB-CG 4.25Å
216	Q	88.1	Confident	87.8	Confident	151 Å²	151	44.5 Å²	44.5	71%	0.706	23%	0.227	S	C	*	.			trans	-74.6	-41.6	-175.1	-64.2	178.6	14.5	0	0	112.2	D462	Q216-D462 WeakPolarHBondContact CG-O 3.34Å; Q216-D462 PolarHBondContact N-O 3.4Å; Q216-D462 PolarHBondContact N-OD2 2.76Å
217	T	90.3	Very high	88.1	Confident	61 Å²	61	37.6 Å²	37.6	37%	0.374	20%	0.202	S	C	.	.	S	Bend	trans	-92.3	146.4	-175.5	66.8	0	0	0	0	112.7	T219 A220 K221 D462	T217-T219 PolarHBondContact O-N 2.99Å; T217-A220 PolarHBondContact O-N 3.4Å; T217-A220 WeakPolarHBondContact OG1-CB 3.5Å; T217-A220 PolarHBondContact OG1-N 3.39Å; T217-K221 WeakPolarHBondContact O-CG 3.24Å; T217-K221 PolarHBondContact O-N 3.39Å; T217-K221 VanDerWaalsContact O-N 3.14Å; T217-D462 WeakPolarHBondContact CB-OD2 3.27Å; T217-D462 WeakPolarHBondContact CG2-OD1 3.28Å; T217-D462 PolarHBondContact N-OD2 2.91Å; T217-D462 PolarHBondContact OG1-OD2 3.21Å
218	L	89.4	Confident	88.3	Confident	44 Å²	44	33.5 Å²	33.5	23%	0.23	18%	0.181	C	C	.	.	H	α-helix	trans	-62.8	-33.2	174.5	-66.5	169.4	0	0	0	112.3	A220 K221 Q222 M319 A323	L218-A220 PolarHBondContact O-N 3.33Å; L218-K221 HydrophobicContact CD2-CD 4.46Å; L218-K221 PolarHBondContact O-N 3.44Å; L218-Q222 WeakPolarHBondContact O-CB 3.26Å; L218-Q222 VanDerWaalsContact O-CG 3.28Å; L218-Q222 WeakPolarHBondContact O-CG 3.5Å; L218-Q222 PolarHBondContact O-N 3.21Å; L218-M319 HydrophobicContact CD1-CE 3.43Å; L218-M319 VanDerWaalsContact CD1-CE 3.43Å; L218-A323 HydrophobicContact CD1-CB 3.82Å
219	T	91.2	Very high	88.6	Confident	23 Å²	23	35.9 Å²	35.9	14%	0.141	19%	0.19	C	C	.	.	H	α-helix	trans	-58.7	-46.6	175.5	-59.4	0	0	0	0	111.4	T217 D223 L264 I325 Q326	T217-T219 PolarHBondContact O-N 2.99Å; T219-D223 WeakPolarHBondContact O-CB 3.3Å; T219-D223 PolarHBondContact O-N 3.3Å; T219-D223 VanDerWaalsContact O-N 3.08Å; T219-L264 HydrophobicContact CG2-CD2 3.77Å; T219-I325 HydrophobicContact CG2-CB 4.1Å; T219-I325 HydrophobicContact CG2-CD1 3.99Å; T219-I325 HydrophobicContact CG2-CG1 4.06Å; T219-I325 PolarHBondContact OG1-N 3.07Å; T219-I325 VanDerWaalsContact OG1-N 3.16Å; T219-Q326 PolarHBondContact O-NE2 3.01Å; T219-Q326 VanDerWaalsContact O-NE2 3.13Å
220	A	90	Very high	88.8	Confident	4 Å²	4	33.8 Å²	33.8	3%	0.033	18%	0.18	C	C	.	.	H	α-helix	trans	-67.2	-43.7	178.4	0	0	0	0	0	111.6	A215 T217 L218 Q222 D223 L224 T459 D462	A215-A220 HydrophobicContact CB-CB 3.92Å; T217-A220 PolarHBondContact O-N 3.4Å; T217-A220 WeakPolarHBondContact OG1-CB 3.5Å; T217-A220 PolarHBondContact OG1-N 3.39Å; L218-A220 PolarHBondContact O-N 3.33Å; A220-Q222 VanDerWaalsContact C-N 3.33Å; A220-Q222 PolarHBondContact O-N 3.11Å; A220-D223 PolarHBondContact O-N 3.36Å; A220-L224 WeakPolarHBondContact O-CG 3.43Å; A220-L224 PolarHBondContact O-N 2.92Å; A220-T459 HydrophobicContact CB-CG2 4.06Å; A220-D462 HydrophobicContact CB-CB 4.1Å; A220-D462 WeakPolarHBondContact CB-OD2 3.14Å
221	K	90.7	Very high	88.9	Confident	48 Å²	48	27.9 Å²	27.9	21%	0.209	15%	0.152	C	C	.	.	H	α-helix	trans	-55	-47.1	175.1	-67.6	-176	-173.3	-174.4	0	112.3	I212 A215 T217 L218 L224 L225 L315	I212-K221 HydrophobicContact CG2-CB 4.02Å; I212-K221 HydrophobicContact CG2-CD 4.03Å; I212-K221 HydrophobicContact CG2-CG 3.91Å; I212-K221 VanDerWaalsContact O-CE 3.23Å; I212-K221 WeakPolarHBondContact O-CE 3.39Å; I212-K221 WeakPolarHBondContact O-CG 3.24Å; A215-K221 HydrophobicContact CB-CG 3.89Å; A215-K221 WeakPolarHBondContact O-CE 3.46Å; T217-K221 WeakPolarHBondContact O-CG 3.24Å; T217-K221 PolarHBondContact O-N 3.39Å; T217-K221 VanDerWaalsContact O-N 3.14Å; L218-K221 HydrophobicContact CD2-CD 4.46Å; L218-K221 PolarHBondContact O-N 3.44Å; K221-L224 PolarHBondContact O-N 3.24Å; K221-L225 WeakPolarHBondContact O-CG 3.36Å; K221-L225 PolarHBondContact O-N 3.28Å; K221-L315 HydrophobicContact CB-CD1 4.01Å
222	Q	89	Confident	89.1	Confident	10 Å²	10	27.8 Å²	27.8	5%	0.047	15%	0.152	C	C	.	.	H	α-helix	trans	-66.7	-38	179.5	-72.8	172.2	9	0	0	112.6	L218 A220 N226 L315 D316 S324 Q326	L218-Q222 WeakPolarHBondContact O-CB 3.26Å; L218-Q222 VanDerWaalsContact O-CG 3.28Å; L218-Q222 WeakPolarHBondContact O-CG 3.5Å; L218-Q222 PolarHBondContact O-N 3.21Å; A220-Q222 VanDerWaalsContact C-N 3.33Å; A220-Q222 PolarHBondContact O-N 3.11Å; Q222-N226 WeakPolarHBondContact O-CB 3.4Å; Q222-N226 PolarHBondContact O-N 3.1Å; Q222-N226 PolarHBondContact O-ND2 2.9Å; Q222-L315 HydrophobicContact CG-CB 4.15Å; Q222-L315 HydrophobicContact CG-CD1 3.72Å; Q222-D316 PolarHBondContact NE2-OD1 3.37Å; Q222-D316 PolarHBondContact NE2-OD2 3.34Å; Q222-S324 PolarHBondContact OE1-OG 3.24Å; Q222-S324 VanDerWaalsContact OE1-OG 3.14Å; Q222-Q326 VanDerWaalsContact OE1-CB 3.22Å
223	D	89.1	Confident	89.3	Confident	12 Å²	12	28 Å²	28	6%	0.064	15%	0.153	C	C	.	.	H	α-helix	trans	-67.1	-42.4	177.6	-170.9	55.4	0	0	0	112.2	T219 A220 N226 T227 R266 T459	T219-D223 WeakPolarHBondContact O-CB 3.3Å; T219-D223 PolarHBondContact O-N 3.3Å; T219-D223 VanDerWaalsContact O-N 3.08Å; A220-D223 PolarHBondContact O-N 3.36Å; D223-N226 PolarHBondContact O-N 2.88Å; D223-T227 WeakPolarHBondContact O-CB 3.37Å; D223-T227 PolarHBondContact O-N 3.37Å; D223-T227 PolarHBondContact O-OG1 3.39Å; D223-R266 IonicContact OD1-CZ 3.4Å; D223-R266 IonicContact OD1-NH1 3.64Å; D223-R266 PolarHBondContact OD1-NH1 3.35Å; D223-R266 IonicContact OD1-NH2 3.29Å; D223-R266 PolarHBondContact OD1-NH2 3.46Å; D223-R266 IonicContact OD2-CZ 3.61Å; D223-R266 IonicContact OD2-NH1 3.65Å; D223-R266 PolarHBondContact OD2-NH1 2.92Å; D223-R266 IonicContact OD2-NH2 2.68Å; D223-R266 PolarHBondContact OD2-NH2 3.34Å; D223-T459 PolarHBondContact OD2-OG1 2.85Å; D223-T459 VanDerWaalsContact OD2-OG1 3.1Å
224	L	88.7	Confident	89.5	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	13%	0.13	C	C	.	.	H	α-helix	trans	-59.8	-50.5	173.5	-73	173.7	0	0	0	111.2	L211 I212 A215 A220 K221 N226 T227 F228 L372 T459 M463	L211-L224 HydrophobicContact CD2-CD1 4.27Å; I212-L224 HydrophobicContact CD1-CB 4.1Å; A215-L224 HydrophobicContact CB-CD1 4.14Å; A220-L224 WeakPolarHBondContact O-CG 3.43Å; A220-L224 PolarHBondContact O-N 2.92Å; K221-L224 PolarHBondContact O-N 3.24Å; L224-N226 VanDerWaalsContact C-N 3.33Å; L224-N226 PolarHBondContact O-N 2.76Å; L224-T227 PolarHBondContact O-N 3.1Å; L224-T227 VanDerWaalsContact O-N 3.17Å; L224-F228 HydrophobicContact CB-CD2 4.4Å; L224-F228 HydrophobicContact CB-CE2 4.06Å; L224-F228 HydrophobicContact CD2-CE2 4.22Å; L224-F228 HydrophobicContact CD2-CZ 4.17Å; L224-F228 WeakPolarHBondContact O-CB 3.28Å; L224-F228 VanDerWaalsContact O-CD2 3.25Å; L224-F228 WeakPolarHBondContact O-CD2 3.47Å; L224-F228 WeakPolarHBondContact O-CG 3.48Å; L224-F228 PolarHBondContact O-N 3.02Å; L224-L372 HydrophobicContact CD2-CD2 4.38Å; L224-T459 HydrophobicContact CD1-CG2 4.13Å; L224-T459 HydrophobicContact CD2-CG2 3.67Å; L224-T459 HydrophobicContact CG-CG2 3.56Å; L224-M463 HydrophobicContact CD1-CE 4.5Å; L224-M463 HydrophobicContact CD1-SD 4.09Å
225	L	89.3	Confident	89.6	Confident	7 Å²	7	27.4 Å²	27.4	4%	0.037	14%	0.137	C	C	.	.	H	α-helix	trans	-58.7	-43.4	178.5	-73.4	-174	0	0	0	112.5	A115 L146 I212 K221 T227 R229 L315	A115-L225 HydrophobicContact CB-CD1 3.9Å; A115-L225 HydrophobicContact CB-CD2 3.75Å; A115-L225 HydrophobicContact CB-CG 4.46Å; L146-L225 HydrophobicContact CD2-CD2 3.43Å; L146-L225 VanDerWaalsContact CD2-CD2 3.43Å; I212-L225 HydrophobicContact CD1-CD2 3.52Å; I212-L225 HydrophobicContact CD1-CG 3.92Å; I212-L225 HydrophobicContact CG1-CD2 3.9Å; K221-L225 WeakPolarHBondContact O-CG 3.36Å; K221-L225 PolarHBondContact O-N 3.28Å; L225-T227 VanDerWaalsContact C-N 3.34Å; L225-T227 PolarHBondContact O-N 2.92Å; L225-R229 VanDerWaalsContact O-CB 3.23Å; L225-R229 WeakPolarHBondContact O-CB 3.3Å; L225-R229 PolarHBondContact O-N 3.17Å; L225-L315 HydrophobicContact CD1-CD1 3.34Å; L225-L315 HydrophobicContact CD1-CG 3.91Å; L225-L315 HydrophobicContact CG-CD1 4.31Å
226	N	88.9	Confident	89.6	Confident	64 Å²	64	27.8 Å²	27.8	34%	0.342	14%	0.139	S	C	.	.	H	α-helix	trans	-65.5	-39.2	178.5	-72.5	-32.1	0	0	0	111.9	Q222 D223 L224 R229 Q230	Q222-N226 WeakPolarHBondContact O-CB 3.4Å; Q222-N226 PolarHBondContact O-N 3.1Å; Q222-N226 PolarHBondContact O-ND2 2.9Å; D223-N226 PolarHBondContact O-N 2.88Å; L224-N226 VanDerWaalsContact C-N 3.33Å; L224-N226 PolarHBondContact O-N 2.76Å; N226-R229 PolarHBondContact OD1-NH1 3.42Å; N226-Q230 WeakPolarHBondContact O-CB 3.2Å; N226-Q230 PolarHBondContact O-N 2.99Å
227	T	88.9	Confident	89.7	Confident	15 Å²	15	20.6 Å²	20.6	9%	0.092	11%	0.106	C	C	.	.	H	α-helix	trans	-65.3	-48.8	178.3	-57.9	0	0	0	0	110.9	D223 L224 L225 Q230 H231 L372	D223-T227 WeakPolarHBondContact O-CB 3.37Å; D223-T227 PolarHBondContact O-N 3.37Å; D223-T227 PolarHBondContact O-OG1 3.39Å; L224-T227 PolarHBondContact O-N 3.1Å; L224-T227 VanDerWaalsContact O-N 3.17Å; L225-T227 VanDerWaalsContact C-N 3.34Å; L225-T227 PolarHBondContact O-N 2.92Å; T227-Q230 WeakPolarHBondContact O-CB 3.3Å; T227-Q230 PolarHBondContact O-N 3.22Å; T227-Q230 VanDerWaalsContact O-N 3.16Å; T227-H231 PolarHBondContact O-CD2 2.98Å; T227-H231 VanDerWaalsContact O-CD2 3.29Å; T227-H231 PolarHBondContact O-N 3.07Å; T227-L372 WeakPolarHBondContact CG2-O 3.44Å
228	F	88.8	Confident	89.6	Confident	1 Å²	1	20.3 Å²	20.3	0%	0.004	10%	0.098	C	C	.	.	H	α-helix	trans	-66.5	-39.2	178.1	-67	-32.4	0	0	0	113.5	L146 V149 L211 L224 Q230 H231 L232 L372 L469 P470 Y472	L146-F228 HydrophobicContact CD1-CB 4.16Å; V149-F228 HydrophobicContact CB-CB 4.45Å; V149-F228 HydrophobicContact CG1-CB 3.88Å; V149-F228 HydrophobicContact CG1-CD1 3.71Å; V149-F228 HydrophobicContact CG1-CE1 4.4Å; V149-F228 HydrophobicContact CG1-CG 3.79Å; V149-F228 HydrophobicContact CG2-CB 3.99Å; L211-F228 HydrophobicContact CD1-CE2 4.04Å; L211-F228 HydrophobicContact CD1-CZ 4.22Å; L211-F228 HydrophobicContact CD2-CE2 3.52Å; L211-F228 HydrophobicContact CD2-CZ 4.14Å; L211-F228 HydrophobicContact CG-CE2 4.49Å; L224-F228 HydrophobicContact CB-CD2 4.4Å; L224-F228 HydrophobicContact CB-CE2 4.06Å; L224-F228 HydrophobicContact CD2-CE2 4.22Å; L224-F228 HydrophobicContact CD2-CZ 4.17Å; L224-F228 WeakPolarHBondContact O-CB 3.28Å; L224-F228 VanDerWaalsContact O-CD2 3.25Å; L224-F228 WeakPolarHBondContact O-CD2 3.47Å; L224-F228 WeakPolarHBondContact O-CG 3.48Å; L224-F228 PolarHBondContact O-N 3.02Å; F228-Q230 PolarHBondContact O-N 3.46Å; F228-H231 PolarHBondContact O-N 3.17Å; F228-L232 PolarHBondContact O-N 3.41Å; F228-L372 HydrophobicContact CE1-CD1 4.28Å; F228-L469 HydrophobicContact CZ-CD2 4.39Å; F228-P470 HydrophobicContact CE1-CG 4.01Å; F228-P470 HydrophobicContact CZ-CG 4.03Å; F228-Y472 WeakPolarHBondContact CD1-OH 3.37Å
229	R	91	Very high	89.5	Confident	52 Å²	52	22.6 Å²	22.6	20%	0.196	11%	0.113	C	C	.	.	H	α-helix	trans	-57.4	-43.3	172	-169.1	-173	-60.9	110.1	-4.5	110.2	I109 E112 L146 L225 N226 L232 L233	I109-R229 HydrophobicContact CB-CG 4.33Å; I109-R229 HydrophobicContact CD1-CG 3.78Å; I109-R229 HydrophobicContact CG2-CG 4.32Å; E112-R229 IonicContact OE1-CZ 3.33Å; E112-R229 IonicContact OE1-NH2 2.92Å; E112-R229 PolarHBondContact OE1-NH2 2.96Å; L146-R229 HydrophobicContact CD1-CB 4.41Å; L225-R229 VanDerWaalsContact O-CB 3.23Å; L225-R229 WeakPolarHBondContact O-CB 3.3Å; L225-R229 PolarHBondContact O-N 3.17Å; N226-R229 PolarHBondContact OD1-NH1 3.42Å; R229-L232 PolarHBondContact O-N 3.29Å; R229-L233 HydrophobicContact CG-CD1 4.5Å; R229-L233 VanDerWaalsContact O-CG 3.3Å; R229-L233 WeakPolarHBondContact O-CG 3.4Å; R229-L233 PolarHBondContact O-N 3.38Å
230	Q	89.8	Confident	89.3	Confident	27 Å²	27	26.2 Å²	26.2	13%	0.126	12%	0.124	C	C	.	.	H	α-helix	trans	-65.8	-40.7	178.5	-172.7	61.7	28	0	0	112.3	N226 T227 F228 L232 L233 V234 Y281	N226-Q230 WeakPolarHBondContact O-CB 3.2Å; N226-Q230 PolarHBondContact O-N 2.99Å; T227-Q230 WeakPolarHBondContact O-CB 3.3Å; T227-Q230 PolarHBondContact O-N 3.22Å; T227-Q230 VanDerWaalsContact O-N 3.16Å; F228-Q230 PolarHBondContact O-N 3.46Å; Q230-L232 PolarHBondContact O-N 2.96Å; Q230-L233 PolarHBondContact O-N 2.98Å; Q230-V234 VanDerWaalsContact O-CG2 3.32Å; Q230-V234 WeakPolarHBondContact O-CG2 3.5Å; Q230-V234 PolarHBondContact O-N 3.35Å; Q230-Y281 HydrophobicContact CG-CE1 4.47Å; Q230-Y281 WeakPolarHBondContact CG-OH 3.45Å
231	H	89.3	Confident	89.1	Confident	4 Å²	4	28.6 Å²	28.6	2%	0.019	15%	0.149	C	C	.	.	H	α-helix	trans	-59.3	-46.4	174.8	-69.2	-176.8	0	0	0	111.7	L152 V156 L157 T227 F228 V234 H235 L372 Y472	L152-H231 HydrophobicContact CD1-CB 4.08Å; V156-H231 HydrophobicContact CG1-CB 3.87Å; V156-H231 WeakPolarHBondContact CG1-O 3.48Å; L157-H231 VanDerWaalsContact CD2-CE1 3.46Å; L157-H231 WeakPolarHBondContact CD2-CE1 3.49Å; T227-H231 PolarHBondContact O-CD2 2.98Å; T227-H231 VanDerWaalsContact O-CD2 3.29Å; T227-H231 PolarHBondContact O-N 3.07Å; F228-H231 PolarHBondContact O-N 3.17Å; H231-V234 PolarHBondContact O-N 3.07Å; H231-H235 VanDerWaalsContact O-CB 3.3Å; H231-H235 WeakPolarHBondContact O-CB 3.15Å; H231-H235 PolarHBondContact O-N 3.16Å; H231-L372 PolarHBondContact CE1-O 3.49Å; H231-L372 PolarHBondContact NE2-O 2.93Å; H231-Y472 AromaticContact ND1-CE2 3.83Å; H231-Y472 AromaticContact ND1-CZ 3.8Å; H231-Y472 PolarHBondContact ND1-OH 3.37Å
232	L	90.1	Very high	89.1	Confident	1 Å²	1	27 Å²	27	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-66.4	-39.9	179.5	-173.1	61.2	0	0	0	112.2	I109 L144 Q148 V149 L152 F228 R229 Q230 H235 T236	I109-L232 HydrophobicContact CD1-CB 3.95Å; I109-L232 HydrophobicContact CD1-CD2 3.91Å; I109-L232 HydrophobicContact CD1-CG 3.97Å; I109-L232 HydrophobicContact CG1-CD2 3.97Å; I109-L232 HydrophobicContact CG1-CG 4.4Å; I109-L232 HydrophobicContact CG2-CD2 3.84Å; L144-L232 HydrophobicContact CB-CD2 4.25Å; L144-L232 HydrophobicContact CD1-CG 4.46Å; Q148-L232 HydrophobicContact CB-CD1 4.08Å; V149-L232 HydrophobicContact CG2-CB 3.95Å; V149-L232 HydrophobicContact CG2-CD2 4.3Å; L152-L232 HydrophobicContact CD2-CD1 4.05Å; F228-L232 PolarHBondContact O-N 3.41Å; R229-L232 PolarHBondContact O-N 3.29Å; Q230-L232 PolarHBondContact O-N 2.96Å; L232-H235 PolarHBondContact O-N 3.21Å; L232-T236 WeakPolarHBondContact O-CB 3.38Å; L232-T236 PolarHBondContact O-N 2.95Å; L232-T236 PolarHBondContact O-OG1 3.01Å
233	L	91.4	Very high	89	Confident	9 Å²	9	27.9 Å²	27.9	5%	0.047	15%	0.149	C	C	.	.	H	α-helix	trans	-60.3	-47.5	174.8	-73.4	174.1	0	0	0	111.8	A74 V107 I109 R229 Q230 T236 A237 L245	A74-L233 HydrophobicContact CB-CD1 4.08Å; A74-L233 HydrophobicContact CB-CD2 3.92Å; V107-L233 HydrophobicContact CG1-CD2 3.48Å; V107-L233 VanDerWaalsContact CG1-CD2 3.48Å; V107-L233 HydrophobicContact CG2-CD2 4.27Å; I109-L233 HydrophobicContact CD1-CB 4.44Å; I109-L233 HydrophobicContact CD1-CD2 3.45Å; I109-L233 VanDerWaalsContact CD1-CD2 3.45Å; I109-L233 HydrophobicContact CD1-CG 3.48Å; I109-L233 VanDerWaalsContact CD1-CG 3.48Å; I109-L233 HydrophobicContact CG1-CD2 4.2Å; R229-L233 HydrophobicContact CG-CD1 4.5Å; R229-L233 VanDerWaalsContact O-CG 3.3Å; R229-L233 WeakPolarHBondContact O-CG 3.4Å; R229-L233 PolarHBondContact O-N 3.38Å; Q230-L233 PolarHBondContact O-N 2.98Å; L233-T236 PolarHBondContact O-N 3.38Å; L233-A237 WeakPolarHBondContact O-CB 3.49Å; L233-A237 PolarHBondContact O-N 3.38Å; L233-L245 HydrophobicContact CB-CD2 3.83Å; L233-L245 HydrophobicContact CD1-CD2 4.31Å
234	V	89.9	Confident	89.1	Confident	0 Å²	0	28.1 Å²	28.1	0%	0	15%	0.15	C	C	.	.	H	α-helix	trans	-67.2	-42.8	-179.5	171.9	0	0	0	0	110.7	Q230 H231 A237 R238 Y281	Q230-V234 VanDerWaalsContact O-CG2 3.32Å; Q230-V234 WeakPolarHBondContact O-CG2 3.5Å; Q230-V234 PolarHBondContact O-N 3.35Å; H231-V234 PolarHBondContact O-N 3.07Å; V234-A237 PolarHBondContact O-N 3.18Å; V234-R238 WeakPolarHBondContact O-CG 3.12Å; V234-R238 PolarHBondContact O-N 3.22Å; V234-Y281 HydrophobicContact CB-CD1 4.31Å; V234-Y281 HydrophobicContact CB-CG 4.45Å; V234-Y281 HydrophobicContact CG1-CD1 3.87Å; V234-Y281 HydrophobicContact CG1-CG 3.88Å; V234-Y281 HydrophobicContact CG2-CD1 3.77Å; V234-Y281 HydrophobicContact CG2-CD2 3.86Å; V234-Y281 HydrophobicContact CG2-CE1 3.95Å; V234-Y281 HydrophobicContact CG2-CE2 4.06Å; V234-Y281 HydrophobicContact CG2-CG 3.73Å
235	H	88.9	Confident	89.4	Confident	42 Å²	42	28.1 Å²	28.1	19%	0.194	15%	0.15	C	C	.	.	H	α-helix	trans	-56.9	-51.2	174.7	179.4	70.6	0	0	0	111.4	L152 P153 V156 H231 L232 A237 R238 T239	L152-H235 HydrophobicContact CD2-CB 3.69Å; L152-H235 WeakPolarHBondContact CD2-CD2 3.42Å; P153-H235 VanDerWaalsContact CD-CE1 3.46Å; P153-H235 WeakPolarHBondContact CD-CE1 3.42Å; V156-H235 HydrophobicContact CG2-CB 3.62Å; H231-H235 VanDerWaalsContact O-CB 3.3Å; H231-H235 WeakPolarHBondContact O-CB 3.15Å; H231-H235 PolarHBondContact O-N 3.16Å; L232-H235 PolarHBondContact O-N 3.21Å; H235-A237 VanDerWaalsContact C-N 3.3Å; H235-A237 PolarHBondContact O-N 3.43Å; H235-R238 PolarHBondContact O-N 3.26Å; H235-R238 VanDerWaalsContact O-N 3.15Å; H235-T239 PolarHBondContact CE1-OG1 2.84Å; H235-T239 VanDerWaalsContact CE1-OG1 3.24Å; H235-T239 PolarHBondContact NE2-OG1 3.18Å; H235-T239 PolarHBondContact O-N 3.16Å; H235-T239 PolarHBondContact O-OG1 3.21Å
236	T	89.3	Confident	89.6	Confident	9 Å²	9	27.8 Å²	27.8	6%	0.055	15%	0.148	C	C	.	.	H	α-helix	trans	-59.8	-42.7	-179.3	-54.9	0	0	0	0	111.3	L72 V107 L144 L232 L233 R238 R240	L72-T236 HydrophobicContact CD2-CG2 4.26Å; V107-T236 HydrophobicContact CG2-CG2 4.21Å; L144-T236 HydrophobicContact CD1-CG2 3.81Å; L144-T236 WeakPolarHBondContact CD1-OG1 3.23Å; L232-T236 WeakPolarHBondContact O-CB 3.38Å; L232-T236 PolarHBondContact O-N 2.95Å; L232-T236 PolarHBondContact O-OG1 3.01Å; L233-T236 PolarHBondContact O-N 3.38Å; T236-R238 PolarHBondContact O-N 2.82Å; T236-R240 HydrophobicContact CG2-CG 4.47Å; T236-R240 WeakPolarHBondContact O-CB 3.44Å; T236-R240 WeakPolarHBondContact O-CG 3.37Å; T236-R240 PolarHBondContact O-N 2.81Å; T236-R240 VanDerWaalsContact O-N 3.13Å
237	A	90.3	Very high	89.8	Confident	0 Å²	0	25.7 Å²	25.7	0%	0	14%	0.136	C	C	.	.	H	α-helix	trans	-60	-46.3	176.2	0	0	0	0	0	111.8	L72 L233 V234 H235 G241 Y242 V284	L72-A237 HydrophobicContact CD2-CB 3.9Å; L233-A237 WeakPolarHBondContact O-CB 3.49Å; L233-A237 PolarHBondContact O-N 3.38Å; V234-A237 PolarHBondContact O-N 3.18Å; H235-A237 VanDerWaalsContact C-N 3.3Å; H235-A237 PolarHBondContact O-N 3.43Å; A237-G241 PolarHBondContact O-N 2.85Å; A237-G241 VanDerWaalsContact O-N 3.16Å; A237-Y242 PolarHBondContact O-N 3.3Å; A237-V284 HydrophobicContact CB-CB 4.5Å; A237-V284 HydrophobicContact CB-CG1 3.8Å; A237-V284 HydrophobicContact CB-CG2 3.91Å
238	R	88.2	Confident	89.9	Confident	55 Å²	55	25.7 Å²	25.7	21%	0.208	14%	0.139	C	C	.	.	H	α-helix	trans	-66	-49.6	179.1	-71	-176.5	-170.1	158.3	3	112.7	S155 T158 V234 H235 T236 R240 G241 Y281 V284	S155-R238 PolarHBondContact O-NH1 3.1Å; T158-R238 PolarHBondContact O-NH1 2.71Å; T158-R238 PolarHBondContact O-NH2 2.93Å; V234-R238 WeakPolarHBondContact O-CG 3.12Å; V234-R238 PolarHBondContact O-N 3.22Å; H235-R238 PolarHBondContact O-N 3.26Å; H235-R238 VanDerWaalsContact O-N 3.15Å; T236-R238 PolarHBondContact O-N 2.82Å; R238-R240 PolarHBondContact O-N 2.76Å; R238-G241 PolarHBondContact O-N 3.32Å; R238-G241 VanDerWaalsContact O-N 3.1Å; R238-Y281 PolarHBondContact NH2-O 3.39Å; R238-V284 HydrophobicContact CG-CG2 3.5Å; R238-V284 VanDerWaalsContact CG-CG2 3.5Å
239	T	86.5	Confident	90.1	Very high	91 Å²	91	27 Å²	27	56%	0.558	15%	0.146	S	C	*	.	H	α-helix	trans	-61.6	-33.4	-176.7	-56.7	0	0	0	0	111.9	H235	H235-T239 PolarHBondContact CE1-OG1 2.84Å; H235-T239 VanDerWaalsContact CE1-OG1 3.24Å; H235-T239 PolarHBondContact NE2-OG1 3.18Å; H235-T239 PolarHBondContact O-N 3.16Å; H235-T239 PolarHBondContact O-OG1 3.21Å
240	R	87.3	Confident	90.2	Very high	99 Å²	99	25 Å²	25	37%	0.374	14%	0.14	S	C	.	.	T	Hydrogen-bonded Turn	trans	-95.4	4.6	179.8	-58.5	-67.5	-176.9	164	-1.2	113.8	E193 T236 R238 Y242	E193-R240 IonicContact OE2-NH1 2.81Å; E193-R240 PolarHBondContact OE2-NH1 3.28Å; T236-R240 HydrophobicContact CG2-CG 4.47Å; T236-R240 WeakPolarHBondContact O-CB 3.44Å; T236-R240 WeakPolarHBondContact O-CG 3.37Å; T236-R240 PolarHBondContact O-N 2.81Å; T236-R240 VanDerWaalsContact O-N 3.13Å; R238-R240 PolarHBondContact O-N 2.76Å; R240-Y242 HydrophobicContact CB-CD2 3.59Å; R240-Y242 HydrophobicContact CB-CE2 3.5Å; R240-Y242 HydrophobicContact CG-CE2 4.45Å
241	G	85.9	Confident	90.2	Very high	54 Å²	54	24.2 Å²	24.2	56%	0.557	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	71.3	27	176.1	0	0	0	0	0	115.2	A237 R238	A237-G241 PolarHBondContact O-N 2.85Å; A237-G241 VanDerWaalsContact O-N 3.16Å; R238-G241 PolarHBondContact O-N 3.32Å; R238-G241 VanDerWaalsContact O-N 3.1Å
242	Y	90.3	Very high	90.4	Very high	15 Å²	15	24.7 Å²	24.7	6%	0.059	14%	0.14	C	C	.	.			trans	-84	124.7	172	-67.3	-86.9	0	0	0	110.4	K70 L72 Y142 A237 R240	K70-Y242 HydrophobicContact CB-CD1 3.59Å; K70-Y242 HydrophobicContact CB-CE1 3.95Å; K70-Y242 HydrophobicContact CB-CG 4.34Å; L72-Y242 HydrophobicContact CB-CD1 3.88Å; L72-Y242 HydrophobicContact CB-CD2 4.19Å; L72-Y242 HydrophobicContact CB-CG 3.73Å; L72-Y242 HydrophobicContact CD1-CD1 4.43Å; L72-Y242 HydrophobicContact CD1-CD2 4.06Å; L72-Y242 HydrophobicContact CD1-CE1 4.31Å; L72-Y242 HydrophobicContact CD1-CE2 3.91Å; L72-Y242 HydrophobicContact CD1-CG 4.35Å; L72-Y242 HydrophobicContact CD2-CD2 4.33Å; L72-Y242 HydrophobicContact CG-CD2 4.44Å; L72-Y242 HydrophobicContact CG-CG 4.46Å; Y142-Y242 AromaticContact CE2-CE2 3.85Å; Y142-Y242 HydrophobicContact CE2-CE2 3.85Å; Y142-Y242 WeakPolarHBondContact CE2-OH 3.45Å; Y142-Y242 PolarHBondContact OH-OH 3.14Å; A237-Y242 PolarHBondContact O-N 3.3Å; R240-Y242 HydrophobicContact CB-CD2 3.59Å; R240-Y242 HydrophobicContact CB-CE2 3.5Å; R240-Y242 HydrophobicContact CG-CE2 4.45Å
243	S	87.9	Confident	90.4	Very high	28 Å²	28	31.3 Å²	31.3	20%	0.196	17%	0.165	C	C	.	.	S	Bend	trans	-84.1	-22.3	-178.2	60.6	0	0	0	0	113.1	K70 V284 T285	K70-S243 PolarHBondContact O-N 2.67Å; K70-S243 PolarHBondContact O-OG 3.34Å; S243-V284 WeakPolarHBondContact O-CA 3.45Å; S243-T285 PolarHBondContact O-N 3Å
244	K	91.3	Very high	90.4	Very high	17 Å²	17	30.9 Å²	30.9	7%	0.074	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	142.8	-178.4	-54.2	-63	-175.2	-55.2	0	111.2	V64 I65 E69 V71 L72 T285	V64-K244 HydrophobicContact CG1-CD 4.33Å; V64-K244 WeakPolarHBondContact O-CE 3.4Å; I65-K244 HydrophobicContact CG1-CG 4.37Å; E69-K244 IonicContact OE1-NZ 3.08Å; E69-K244 PolarHBondContact OE1-NZ 2.86Å; E69-K244 IonicContact OE2-NZ 3.29Å; E69-K244 PolarHBondContact OE2-NZ 3.22Å; V71-K244 HydrophobicContact CG1-CB 4.19Å; V71-K244 HydrophobicContact CG2-CB 4.17Å; L72-K244 PolarHBondContact N-O 3.21Å; K244-T285 WeakPolarHBondContact CA-O 3.35Å
245	L	93.4	Very high	90.6	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.163	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	113.8	174.4	178.7	72.2	0	0	0	109.8	L72 A74 L233 V284 T285 V286 V287	L72-L245 HydrophobicContact CB-CD1 4Å; L72-L245 HydrophobicContact CD2-CD1 4.03Å; L72-L245 HydrophobicContact CG-CD1 4.05Å; L72-L245 CarbonylContact O-C 3.5Å; L72-L245 WeakPolarHBondContact O-CA 3.48Å; A74-L245 HydrophobicContact CB-CD1 4.23Å; L233-L245 HydrophobicContact CB-CD2 3.83Å; L233-L245 HydrophobicContact CD1-CD2 4.31Å; L245-V284 HydrophobicContact CB-CG1 4.04Å; L245-T285 PolarHBondContact N-O 3.06Å; L245-V286 HydrophobicContact CB-CG1 4.48Å; L245-V286 HydrophobicContact CB-CG2 4.3Å; L245-V286 HydrophobicContact CD2-CG1 4.14Å; L245-V286 HydrophobicContact CD2-CG2 3.97Å; L245-V286 HydrophobicContact CG-CG1 4.41Å; L245-V286 CarbonylContact O-C 3.49Å; L245-V286 VanDerWaalsContact O-CA 3.26Å; L245-V286 WeakPolarHBondContact O-CA 3.48Å; L245-V287 PolarHBondContact O-N 3.47Å
246	M	94.1	Very high	90.8	Very high	0 Å²	0	29.5 Å²	29.5	0%	0	16%	0.158	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	129.4	174	-63.2	-170.2	164.6	0	0	111.6	L59 I65 V71 L72 L73 A74 M84 V88 F102 V287 P289	L59-M246 HydrophobicContact CD1-CE 4.47Å; L59-M246 HydrophobicContact CD2-CE 4.05Å; I65-M246 HydrophobicContact CD1-CE 3.13Å; V71-M246 HydrophobicContact CG1-CE 4.02Å; V71-M246 HydrophobicContact CG1-CG 3.56Å; V71-M246 HydrophobicContact CG1-SD 4.03Å; L72-M246 PolarHBondContact O-N 3.47Å; L73-M246 HydrophobicContact CD2-CB 3.75Å; L73-M246 HydrophobicContact CD2-CG 3.86Å; L73-M246 HydrophobicContact CD2-SD 3.39Å; L73-M246 WeakPolarHBondContact CD2-SD 3.37Å; A74-M246 WeakPolarHBondContact CB-O 3.05Å; A74-M246 PolarHBondContact N-O 3.39Å; M84-M246 HydrophobicContact CE-CB 4.18Å; M84-M246 HydrophobicContact SD-CB 3.94Å; V88-M246 HydrophobicContact CG2-SD 4.13Å; F102-M246 HydrophobicContact CE1-CE 4.18Å; F102-M246 HydrophobicContact CE2-CE 4.34Å; F102-M246 HydrophobicContact CZ-CE 3.77Å; M246-V287 CarbonylContact C-O 3.6Å; M246-V287 WeakPolarHBondContact CA-O 3.38Å; M246-V287 HydrophobicContact CB-CG2 4.19Å; M246-V287 HydrophobicContact CG-CG2 3.57Å; M246-P289 HydrophobicContact SD-CG 4.24Å
247	Q	93.4	Very high	90.9	Very high	21 Å²	21	32 Å²	32	10%	0.098	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	136.4	171.7	-69.1	-176.9	-38.6	0	0	111.2	A74 M84 D249 V286 V287 R288	A74-Q247 HydrophobicContact CB-CG 4.37Å; M84-Q247 VanDerWaalsContact SD-C 3.58Å; Q247-D249 PolarHBondContact O-N 2.92Å; Q247-V286 HydrophobicContact CG-CG1 3.77Å; Q247-V287 PolarHBondContact N-O 3.25Å; Q247-R288 HydrophobicContact CB-CG 4.35Å
248	G	91.4	Very high	91	Very high	14 Å²	14	32.4 Å²	32.4	14%	0.144	17%	0.17	C	C	.	.			trans	-78.4	40.2	177.4	0	0	0	0	0	114.1	S80 S250	S80-G248 WeakPolarHBondContact CB-O 3.37Å; S80-G248 PolarHBondContact OG-O 3.45Å; G248-S250 PolarHBondContact O-N 2.98Å
249	D	92.4	Very high	91.2	Very high	29 Å²	29	31.9 Å²	31.9	16%	0.155	17%	0.171	C	C	.	.			trans	-75	118	-179.9	-74.3	-29.7	0	0	0	110.9	Q247 L254 R288 M290 R291	Q247-D249 PolarHBondContact O-N 2.92Å; D249-L254 HydrophobicContact CB-CD1 4.37Å; D249-L254 HydrophobicContact CB-CD2 3.87Å; D249-L254 HydrophobicContact CB-CG 3.98Å; D249-R288 HydrophobicContact CB-CG 4.42Å; D249-R288 WeakPolarHBondContact OD2-CD 3.33Å; D249-R288 IonicContact OD2-NE 3.23Å; D249-R288 PolarHBondContact OD2-NE 3.19Å; D249-R288 VanDerWaalsContact OD2-NE 3.08Å; D249-M290 CarbonylContact O-C 3.56Å; D249-R291 WeakPolarHBondContact O-CA 3.41Å; D249-R291 PolarHBondContact O-N 3.11Å
250	S	92.9	Very high	91.5	Very high	10 Å²	10	28.1 Å²	28.1	7%	0.07	15%	0.148	C	C	.	.			trans	-80.8	162.5	175.7	70.5	0	0	0	0	112.3	G248 T252 R253 L254 M290 Y293	G248-S250 PolarHBondContact O-N 2.98Å; S250-T252 VanDerWaalsContact C-N 3.28Å; S250-T252 PolarHBondContact O-N 2.74Å; S250-R253 PolarHBondContact O-N 3.39Å; S250-R253 VanDerWaalsContact O-N 3.08Å; S250-R253 WeakPolarHBondContact OG-CB 3.22Å; S250-R253 PolarHBondContact OG-N 3.46Å; S250-L254 WeakPolarHBondContact O-CG 3.15Å; S250-L254 PolarHBondContact O-N 2.84Å; S250-M290 WeakPolarHBondContact CA-O 3.46Å; S250-Y293 WeakPolarHBondContact CB-O 3.42Å
251	C	90.8	Very high	91.6	Very high	11 Å²	11	23.7 Å²	23.7	7%	0.074	13%	0.132	C	C	.	.	H	α-helix	trans	-53.1	-47.1	174.8	-170.7	0	0	0	0	111.5	R253 L254 A255 R291 Y293	C251-R253 VanDerWaalsContact C-N 3.34Å; C251-R253 PolarHBondContact O-N 2.89Å; C251-L254 PolarHBondContact O-N 3.45Å; C251-A255 PolarHBondContact O-N 3.09Å; C251-R291 WeakPolarHBondContact CA-O 3.19Å; C251-R291 WeakPolarHBondContact CB-O 3.36Å; C251-R291 PolarHBondContact N-O 3.02Å; C251-R291 VanDerWaalsContact N-O 3.14Å; C251-Y293 VanDerWaalsContact CB-O 3.27Å; C251-Y293 WeakPolarHBondContact CB-O 3.46Å; C251-Y293 PolarHBondContact N-O 2.8Å
252	T	91.5	Very high	91.7	Very high	13 Å²	13	25.5 Å²	25.5	8%	0.08	13%	0.128	C	C	.	.	H	α-helix	trans	-61.4	-43.4	178.1	-49.4	0	0	0	0	110.9	S250 L254 A255 V256 A295 V333	S250-T252 VanDerWaalsContact C-N 3.28Å; S250-T252 PolarHBondContact O-N 2.74Å; T252-L254 VanDerWaalsContact C-N 3.35Å; T252-L254 PolarHBondContact O-N 2.89Å; T252-A255 PolarHBondContact O-N 3.33Å; T252-V256 WeakPolarHBondContact O-CG2 3.35Å; T252-V256 PolarHBondContact O-N 3.3Å; T252-V256 VanDerWaalsContact O-N 3.09Å; T252-A295 HydrophobicContact CG2-CB 4.35Å; T252-A295 PolarHBondContact OG1-N 3.36Å; T252-A295 VanDerWaalsContact OG1-N 3.15Å; T252-V333 HydrophobicContact CG2-CG1 4.39Å
253	R	91.7	Very high	91.7	Very high	140 Å²	140	28 Å²	28	53%	0.528	15%	0.148	S	C	.	.	H	α-helix	trans	-66.3	-37.8	178	-173.9	59.6	174.3	-94.6	2.6	111.9	S250 C251 V256 K257	S250-R253 PolarHBondContact O-N 3.39Å; S250-R253 VanDerWaalsContact O-N 3.08Å; S250-R253 WeakPolarHBondContact OG-CB 3.22Å; S250-R253 PolarHBondContact OG-N 3.46Å; C251-R253 VanDerWaalsContact C-N 3.34Å; C251-R253 PolarHBondContact O-N 2.89Å; R253-V256 PolarHBondContact O-N 3.49Å; R253-K257 WeakPolarHBondContact O-CB 3.36Å; R253-K257 PolarHBondContact O-N 3.25Å
254	L	91.8	Very high	91.7	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68	-39	176.4	-70.2	170.5	0	0	0	112.2	D249 S250 C251 T252 K257 L258 R291 Y348	D249-L254 HydrophobicContact CB-CD1 4.37Å; D249-L254 HydrophobicContact CB-CD2 3.87Å; D249-L254 HydrophobicContact CB-CG 3.98Å; S250-L254 WeakPolarHBondContact O-CG 3.15Å; S250-L254 PolarHBondContact O-N 2.84Å; C251-L254 PolarHBondContact O-N 3.45Å; T252-L254 VanDerWaalsContact C-N 3.35Å; T252-L254 PolarHBondContact O-N 2.89Å; L254-K257 PolarHBondContact O-N 3.45Å; L254-L258 VanDerWaalsContact O-CB 3.22Å; L254-L258 WeakPolarHBondContact O-CB 3.37Å; L254-L258 PolarHBondContact O-N 3.08Å; L254-R291 HydrophobicContact CD1-CB 3.75Å; L254-R291 HydrophobicContact CD1-CG 3.53Å; L254-Y348 HydrophobicContact CB-CD2 3.95Å; L254-Y348 HydrophobicContact CB-CE2 4.47Å; L254-Y348 HydrophobicContact CD1-CD2 4.3Å; L254-Y348 HydrophobicContact CD1-CE2 4.09Å
255	A	92.7	Very high	91.3	Very high	0 Å²	0	28 Å²	28	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-63	-42	174	0	0	0	0	0	111.9	C251 T252 L258 L259 V333 V344 I347	C251-A255 PolarHBondContact O-N 3.09Å; T252-A255 PolarHBondContact O-N 3.33Å; A255-L258 WeakPolarHBondContact O-CB 3.2Å; A255-L258 PolarHBondContact O-N 3.07Å; A255-L259 PolarHBondContact O-N 3.07Å; A255-L259 VanDerWaalsContact O-N 3.13Å; A255-V333 HydrophobicContact CB-CG1 4.3Å; A255-V344 HydrophobicContact CB-CG1 3.81Å; A255-I347 HydrophobicContact CB-CG2 4.03Å
256	V	92.8	Very high	90.8	Very high	14 Å²	14	28.6 Å²	28.6	9%	0.085	16%	0.155	C	C	.	.	H	α-helix	trans	-62.1	-49	172.5	175	0	0	0	0	110.4	T252 R253 L258 L259 T260 T329 Q330 V333	T252-V256 WeakPolarHBondContact O-CG2 3.35Å; T252-V256 PolarHBondContact O-N 3.3Å; T252-V256 VanDerWaalsContact O-N 3.09Å; R253-V256 PolarHBondContact O-N 3.49Å; V256-L258 VanDerWaalsContact C-N 3.29Å; V256-L258 PolarHBondContact O-N 3.38Å; V256-L259 PolarHBondContact O-N 3.15Å; V256-T260 VanDerWaalsContact O-CB 3.31Å; V256-T260 WeakPolarHBondContact O-CB 3.18Å; V256-T260 PolarHBondContact O-N 3.19Å; V256-T260 PolarHBondContact O-OG1 3.12Å; V256-T329 HydrophobicContact CG1-CG2 4.14Å; V256-Q330 HydrophobicContact CG1-CB 4.06Å; V256-Q330 HydrophobicContact CG2-CB 4.31Å; V256-Q330 HydrophobicContact CG2-CG 4.43Å; V256-V333 HydrophobicContact CG2-CB 3.83Å; V256-V333 HydrophobicContact CG2-CG1 4.02Å; V256-V333 HydrophobicContact CG2-CG2 3.94Å
257	K	91.8	Very high	90.1	Very high	61 Å²	61	30.9 Å²	30.9	27%	0.265	18%	0.179	S	C	.	.	H	α-helix	trans	-59.9	-38.6	179.1	-170.1	-178.9	-179.5	-170.7	0	112.2	R253 L254 S261 D273	R253-K257 WeakPolarHBondContact O-CB 3.36Å; R253-K257 PolarHBondContact O-N 3.25Å; L254-K257 PolarHBondContact O-N 3.45Å; K257-S261 WeakPolarHBondContact O-CB 3.47Å; K257-S261 PolarHBondContact O-N 3.17Å; K257-S261 PolarHBondContact O-OG 3.14Å; K257-D273 PolarHBondContact NZ-O 2.72Å
258	L	92.1	Very high	89.2	Confident	9 Å²	9	34.7 Å²	34.7	5%	0.047	21%	0.214	C	C	.	.	H	α-helix	trans	-59.2	-57.9	176	171.9	54.3	0	0	0	110.8	L254 A255 V256 T260 S261 I262 L270 T274 I347	L254-L258 VanDerWaalsContact O-CB 3.22Å; L254-L258 WeakPolarHBondContact O-CB 3.37Å; L254-L258 PolarHBondContact O-N 3.08Å; A255-L258 WeakPolarHBondContact O-CB 3.2Å; A255-L258 PolarHBondContact O-N 3.07Å; V256-L258 VanDerWaalsContact C-N 3.29Å; V256-L258 PolarHBondContact O-N 3.38Å; L258-T260 PolarHBondContact O-N 3Å; L258-S261 PolarHBondContact O-N 3.34Å; L258-I262 HydrophobicContact CD1-CD1 3.95Å; L258-I262 HydrophobicContact CG-CD1 4.37Å; L258-I262 WeakPolarHBondContact O-CG1 3.37Å; L258-I262 PolarHBondContact O-N 3.25Å; L258-L270 HydrophobicContact CD1-CD1 3.41Å; L258-L270 VanDerWaalsContact CD1-CD1 3.41Å; L258-L270 HydrophobicContact CD1-CD2 3.44Å; L258-L270 VanDerWaalsContact CD1-CD2 3.44Å; L258-L270 HydrophobicContact CD1-CG 3.43Å; L258-L270 VanDerWaalsContact CD1-CG 3.43Å; L258-T274 HydrophobicContact CB-CG2 3.86Å; L258-T274 HydrophobicContact CD1-CG2 4.12Å; L258-T274 HydrophobicContact CG-CG2 4.47Å; L258-I347 HydrophobicContact CD2-CG2 3.79Å; L258-I347 WeakPolarHBondContact CD2-O 3.46Å
259	L	92.6	Very high	88.6	Confident	44 Å²	44	34.6 Å²	34.6	23%	0.23	21%	0.21	C	C	.	.	H	α-helix	trans	-64.2	-42.5	-179.5	-69.2	-180	0	0	0	112.1	A255 V256 S261 I262 S263 T329 F332 V333 I347	A255-L259 PolarHBondContact O-N 3.07Å; A255-L259 VanDerWaalsContact O-N 3.13Å; V256-L259 PolarHBondContact O-N 3.15Å; L259-S261 VanDerWaalsContact C-N 3.32Å; L259-S261 PolarHBondContact O-N 3.2Å; L259-I262 WeakPolarHBondContact O-CB 3.49Å; L259-I262 PolarHBondContact O-N 3.02Å; L259-S263 PolarHBondContact O-N 3.08Å; L259-S263 PolarHBondContact O-OG 2.95Å; L259-S263 VanDerWaalsContact O-OG 3.06Å; L259-T329 HydrophobicContact CB-CG2 3.43Å; L259-T329 VanDerWaalsContact CB-CG2 3.43Å; L259-T329 HydrophobicContact CD1-CG2 4.21Å; L259-T329 HydrophobicContact CG-CG2 4.47Å; L259-F332 HydrophobicContact CD1-CD1 4.13Å; L259-F332 HydrophobicContact CD1-CE1 4.11Å; L259-V333 HydrophobicContact CD1-CG2 3.66Å; L259-I347 HydrophobicContact CD1-CD1 4.43Å; L259-I347 HydrophobicContact CG-CG2 4.31Å
260	T	92.4	Very high	88.2	Confident	11 Å²	11	33.7 Å²	33.7	7%	0.067	21%	0.205	C	C	.	.	H	α-helix	trans	-60.4	-42.2	175	-63.8	0	0	0	0	111.6	V256 L258 I262 S263 L264 I325 Q326 T329	V256-T260 VanDerWaalsContact O-CB 3.31Å; V256-T260 WeakPolarHBondContact O-CB 3.18Å; V256-T260 PolarHBondContact O-N 3.19Å; V256-T260 PolarHBondContact O-OG1 3.12Å; L258-T260 PolarHBondContact O-N 3Å; T260-I262 VanDerWaalsContact C-N 3.32Å; T260-I262 PolarHBondContact O-N 2.9Å; T260-S263 PolarHBondContact O-N 3.13Å; T260-L264 HydrophobicContact CG2-CD1 3.79Å; T260-L264 HydrophobicContact CG2-CG 4.34Å; T260-L264 WeakPolarHBondContact O-CB 3.46Å; T260-L264 VanDerWaalsContact O-CG 3.27Å; T260-L264 WeakPolarHBondContact O-CG 3.25Å; T260-L264 PolarHBondContact O-N 2.88Å; T260-I325 HydrophobicContact CG2-CG2 4.35Å; T260-Q326 HydrophobicContact CG2-CG 3.99Å; T260-T329 WeakPolarHBondContact OG1-CB 3.47Å; T260-T329 PolarHBondContact OG1-OG1 3.45Å
261	S	89.6	Confident	87.7	Confident	7 Å²	7	34.1 Å²	34.1	5%	0.049	21%	0.209	C	C	.	.	H	α-helix	trans	-64.4	-39.2	178.8	-63.5	0	0	0	0	111.3	K257 L258 L259 L264 G265 R266	K257-S261 WeakPolarHBondContact O-CB 3.47Å; K257-S261 PolarHBondContact O-N 3.17Å; K257-S261 PolarHBondContact O-OG 3.14Å; L258-S261 PolarHBondContact O-N 3.34Å; L259-S261 VanDerWaalsContact C-N 3.32Å; L259-S261 PolarHBondContact O-N 3.2Å; S261-L264 PolarHBondContact O-N 2.89Å; S261-G265 PolarHBondContact O-N 3.36Å; S261-R266 WeakPolarHBondContact O-CA 3.39Å; S261-R266 VanDerWaalsContact O-CB 3.32Å; S261-R266 WeakPolarHBondContact O-CB 3.49Å; S261-R266 PolarHBondContact O-N 2.83Å
262	I	89.3	Confident	87.4	Confident	91 Å²	91	35.7 Å²	35.7	47%	0.467	22%	0.215	S	C	.	.	H	α-helix	trans	-61.9	-50.2	173	-66.4	164.9	0	0	0	110.2	L258 L259 T260 L264 G265 L270	L258-I262 HydrophobicContact CD1-CD1 3.95Å; L258-I262 HydrophobicContact CG-CD1 4.37Å; L258-I262 WeakPolarHBondContact O-CG1 3.37Å; L258-I262 PolarHBondContact O-N 3.25Å; L259-I262 WeakPolarHBondContact O-CB 3.49Å; L259-I262 PolarHBondContact O-N 3.02Å; T260-I262 VanDerWaalsContact C-N 3.32Å; T260-I262 PolarHBondContact O-N 2.9Å; I262-L264 PolarHBondContact O-N 3.29Å; I262-G265 PolarHBondContact O-N 3.4Å; I262-L270 HydrophobicContact CD1-CD2 3.92Å; I262-L270 HydrophobicContact CG1-CD1 4.43Å; I262-L270 HydrophobicContact CG1-CD2 3.63Å
263	S	90.6	Very high	87	Confident	67 Å²	67	35.6 Å²	35.6	47%	0.469	21%	0.214	S	C	.	.	H	α-helix	trans	-60.9	-29.6	179.2	-57	0	0	0	0	113.5	L259 T260 G265	L259-S263 PolarHBondContact O-N 3.08Å; L259-S263 PolarHBondContact O-OG 2.95Å; L259-S263 VanDerWaalsContact O-OG 3.06Å; T260-S263 PolarHBondContact O-N 3.13Å; S263-G265 VanDerWaalsContact C-N 3.32Å
264	L	87.6	Confident	86.6	Confident	16 Å²	16	28.9 Å²	28.9	8%	0.084	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	trans	-85.8	0.6	175.8	-66.1	174.4	0	0	0	113.5	T219 T260 S261 I262 R266 I325 S455	T219-L264 HydrophobicContact CG2-CD2 3.77Å; T260-L264 HydrophobicContact CG2-CD1 3.79Å; T260-L264 HydrophobicContact CG2-CG 4.34Å; T260-L264 WeakPolarHBondContact O-CB 3.46Å; T260-L264 VanDerWaalsContact O-CG 3.27Å; T260-L264 WeakPolarHBondContact O-CG 3.25Å; T260-L264 PolarHBondContact O-N 2.88Å; S261-L264 PolarHBondContact O-N 2.89Å; I262-L264 PolarHBondContact O-N 3.29Å; L264-R266 HydrophobicContact CB-CG 4.24Å; L264-I325 HydrophobicContact CD2-CD1 3.82Å; L264-S455 VanDerWaalsContact O-CB 3.22Å; L264-S455 WeakPolarHBondContact O-CB 3.27Å
265	G	83.3	Confident	86.3	Confident	29 Å²	29	29.6 Å²	29.6	30%	0.299	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.6	34.7	-179.7	0	0	0	0	0	114	S261 I262 S263	S261-G265 PolarHBondContact O-N 3.36Å; I262-G265 PolarHBondContact O-N 3.4Å; S263-G265 VanDerWaalsContact C-N 3.32Å
266	R	81.7	Confident	85.9	Confident	13 Å²	13	30.8 Å²	30.8	5%	0.049	20%	0.202	C	C	.	.			trans	-102.7	38.7	-179.8	-58.3	-176.6	-153.2	-124.5	-21.8	112.9	D223 S261 L264 A268 Q269 R375 S455	D223-R266 IonicContact OD1-CZ 3.4Å; D223-R266 IonicContact OD1-NH1 3.64Å; D223-R266 PolarHBondContact OD1-NH1 3.35Å; D223-R266 IonicContact OD1-NH2 3.29Å; D223-R266 PolarHBondContact OD1-NH2 3.46Å; D223-R266 IonicContact OD2-CZ 3.61Å; D223-R266 IonicContact OD2-NH1 3.65Å; D223-R266 PolarHBondContact OD2-NH1 2.92Å; D223-R266 IonicContact OD2-NH2 2.68Å; D223-R266 PolarHBondContact OD2-NH2 3.34Å; S261-R266 WeakPolarHBondContact O-CA 3.39Å; S261-R266 VanDerWaalsContact O-CB 3.32Å; S261-R266 WeakPolarHBondContact O-CB 3.49Å; S261-R266 PolarHBondContact O-N 2.83Å; L264-R266 HydrophobicContact CB-CG 4.24Å; R266-A268 PolarHBondContact O-N 3.33Å; R266-Q269 HydrophobicContact CB-CG 3.82Å; R266-Q269 WeakPolarHBondContact O-CG 3.47Å; R266-Q269 PolarHBondContact O-N 3.24Å; R266-R375 VanDerWaalsContact NH1-NH2 3.11Å; R266-S455 VanDerWaalsContact CG-CB 3.45Å; R266-S455 VanDerWaalsContact CG-OG 3.31Å; R266-S455 WeakPolarHBondContact CG-OG 3.49Å; R266-S455 VanDerWaalsContact CZ-CB 3.5Å; R266-S455 PolarHBondContact NE-OG 3.38Å; R266-S455 PolarHBondContact NH2-OG 3.15Å
267	G	79.5	Confident	85.6	Confident	48 Å²	48	32.2 Å²	32.2	50%	0.495	21%	0.212	S	C	.	.	G	3₁₀ helix	trans	-60.1	-43.5	-176.4	0	0	0	0	0	113.7	Q269 L270	G267-Q269 PolarHBondContact O-N 3.21Å; G267-Q269 VanDerWaalsContact O-N 3.11Å; G267-L270 WeakPolarHBondContact O-CB 3.05Å; G267-L270 PolarHBondContact O-N 3.08Å; G267-L270 VanDerWaalsContact O-N 3.12Å
268	A	75.6	Confident	85.3	Confident	101 Å²	101	29.4 Å²	29.4	84%	0.835	20%	0.2	S	C	*	.	G	3₁₀ helix	trans	-60	-27.5	-176	0	0	0	0	0	114.3	R266	R266-A268 PolarHBondContact O-N 3.33Å
269	Q	77.8	Confident	84.8	Confident	13 Å²	13	33 Å²	33	6%	0.061	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-102	-1	-177.5	62.8	168.9	17.4	0	0	114	R266 G267 A271 Q272 D273 R375	R266-Q269 HydrophobicContact CB-CG 3.82Å; R266-Q269 WeakPolarHBondContact O-CG 3.47Å; R266-Q269 PolarHBondContact O-N 3.24Å; G267-Q269 PolarHBondContact O-N 3.21Å; G267-Q269 VanDerWaalsContact O-N 3.11Å; Q269-A271 VanDerWaalsContact C-N 3.26Å; Q269-A271 PolarHBondContact O-N 3.11Å; Q269-Q272 PolarHBondContact O-N 3.19Å; Q269-D273 WeakPolarHBondContact CG-OD2 3.37Å; Q269-D273 PolarHBondContact NE2-OD2 2.74Å; Q269-D273 PolarHBondContact O-N 3.13Å; Q269-R375 VanDerWaalsContact CD-CZ 3.43Å
270	L	83.6	Confident	84	Confident	10 Å²	10	32.3 Å²	32.3	5%	0.052	22%	0.219	C	C	.	.	H	α-helix	trans	-61	-38.2	-167.6	-165.8	57.6	0	0	0	112.7	L258 I262 G267 Q272 D273 T274 L354	L258-L270 HydrophobicContact CD1-CD1 3.41Å; L258-L270 VanDerWaalsContact CD1-CD1 3.41Å; L258-L270 HydrophobicContact CD1-CD2 3.44Å; L258-L270 VanDerWaalsContact CD1-CD2 3.44Å; L258-L270 HydrophobicContact CD1-CG 3.43Å; L258-L270 VanDerWaalsContact CD1-CG 3.43Å; I262-L270 HydrophobicContact CD1-CD2 3.92Å; I262-L270 HydrophobicContact CG1-CD1 4.43Å; I262-L270 HydrophobicContact CG1-CD2 3.63Å; G267-L270 WeakPolarHBondContact O-CB 3.05Å; G267-L270 PolarHBondContact O-N 3.08Å; G267-L270 VanDerWaalsContact O-N 3.12Å; L270-Q272 VanDerWaalsContact C-N 3.3Å; L270-Q272 PolarHBondContact O-N 2.69Å; L270-D273 PolarHBondContact O-N 2.73Å; L270-T274 HydrophobicContact CD1-CG2 4.2Å; L270-T274 WeakPolarHBondContact O-CB 3.29Å; L270-T274 WeakPolarHBondContact O-CG2 3.03Å; L270-T274 PolarHBondContact O-N 2.92Å; L270-T274 PolarHBondContact O-OG1 3.36Å; L270-L354 HydrophobicContact CB-CD1 4.42Å; L270-L354 HydrophobicContact CD2-CD1 3.45Å; L270-L354 VanDerWaalsContact CD2-CD1 3.45Å; L270-L354 HydrophobicContact CG-CD1 3.93Å
271	A	83.9	Confident	83.2	Confident	19 Å²	19	32.5 Å²	32.5	16%	0.157	22%	0.219	C	C	.	.	H	α-helix	trans	-63.6	-33	176.1	0	0	0	0	0	112.7	Q269 G275 L354 T356	Q269-A271 VanDerWaalsContact C-N 3.26Å; Q269-A271 PolarHBondContact O-N 3.11Å; A271-G275 WeakPolarHBondContact O-CA 3.43Å; A271-G275 PolarHBondContact O-N 3.25Å; A271-L354 HydrophobicContact CB-CB 4.35Å; A271-L354 WeakPolarHBondContact CB-O 3.11Å; A271-T356 HydrophobicContact CB-CG2 3.76Å
272	Q	83.1	Confident	82.2	Confident	43 Å²	43	32.7 Å²	32.7	20%	0.201	22%	0.222	C	C	.	.	H	α-helix	trans	-85	-36.4	178.3	-65.8	167.9	-10.9	0	0	111.7	Q269 L270 T274 R288 T356	Q269-Q272 PolarHBondContact O-N 3.19Å; L270-Q272 VanDerWaalsContact C-N 3.3Å; L270-Q272 PolarHBondContact O-N 2.69Å; Q272-T274 VanDerWaalsContact C-N 3.35Å; Q272-R288 PolarHBondContact O-NH1 2.98Å; Q272-R288 VanDerWaalsContact O-NH1 3.16Å; Q272-T356 HydrophobicContact CG-CG2 4.09Å
273	D	83.1	Confident	81.5	Confident	11 Å²	11	29.8 Å²	29.8	6%	0.059	22%	0.215	C	C	.	.	H	α-helix	trans	-67.5	-35.8	177.7	-79.1	-15	0	0	0	112.8	K257 Q269 L270 R280 R288	K257-D273 PolarHBondContact NZ-O 2.72Å; Q269-D273 WeakPolarHBondContact CG-OD2 3.37Å; Q269-D273 PolarHBondContact NE2-OD2 2.74Å; Q269-D273 PolarHBondContact O-N 3.13Å; L270-D273 PolarHBondContact O-N 2.73Å; D273-R280 IonicContact OD1-CZ 3.83Å; D273-R280 VanDerWaalsContact OD1-CZ 3.29Å; D273-R280 IonicContact OD1-NH1 3.62Å; D273-R280 PolarHBondContact OD1-NH1 3.04Å; D273-R280 IonicContact OD1-NH2 3.38Å; D273-R280 PolarHBondContact OD1-NH2 2.94Å; D273-R288 PolarHBondContact O-NH1 3.26Å
274	T	83.6	Confident	81.2	Confident	0 Å²	0	26.7 Å²	26.7	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-102.7	-12.5	-179.4	67.2	0	0	0	0	113.2	L258 L270 Q272 R291	L258-T274 HydrophobicContact CB-CG2 3.86Å; L258-T274 HydrophobicContact CD1-CG2 4.12Å; L258-T274 HydrophobicContact CG-CG2 4.47Å; L270-T274 HydrophobicContact CD1-CG2 4.2Å; L270-T274 WeakPolarHBondContact O-CB 3.29Å; L270-T274 WeakPolarHBondContact O-CG2 3.03Å; L270-T274 PolarHBondContact O-N 2.92Å; L270-T274 PolarHBondContact O-OG1 3.36Å; Q272-T274 VanDerWaalsContact C-N 3.35Å; T274-R291 PolarHBondContact O-NH1 2.89Å; T274-R291 PolarHBondContact O-NH2 2.68Å
275	G	85.3	Confident	81.3	Confident	15 Å²	15	27.5 Å²	27.5	16%	0.155	20%	0.199	C	C	.	.	S	Bend	trans	-74	156.8	178	0	0	0	0	0	114.5	A271 S277 R288 R291	A271-G275 WeakPolarHBondContact O-CA 3.43Å; A271-G275 PolarHBondContact O-N 3.25Å; G275-S277 VanDerWaalsContact C-N 3.32Å; G275-S277 PolarHBondContact O-N 2.78Å; G275-R288 PolarHBondContact O-NH1 3.43Å; G275-R291 VanDerWaalsContact CA-NH1 3.35Å; G275-R291 PolarHBondContact O-NH2 2.97Å
276	F	85.8	Confident	81.7	Confident	25 Å²	25	26.1 Å²	26.1	11%	0.11	19%	0.185	C	C	.	.	S	Bend	trans	-61.3	-43.6	-168.6	175	-90.5	0	0	0	111.6	M58 L59 T62 V64 V287 R288 R291	M58-F276 HydrophobicContact CE-CD2 4.13Å; M58-F276 HydrophobicContact CE-CE2 4.29Å; L59-F276 HydrophobicContact CD2-CZ 4.48Å; T62-F276 HydrophobicContact CG2-CD1 3.66Å; T62-F276 HydrophobicContact CG2-CD2 3.98Å; T62-F276 HydrophobicContact CG2-CE1 3.71Å; T62-F276 HydrophobicContact CG2-CE2 4.01Å; T62-F276 HydrophobicContact CG2-CG 3.8Å; T62-F276 HydrophobicContact CG2-CZ 3.89Å; T62-F276 WeakPolarHBondContact OG1-CE1 3.04Å; T62-F276 WeakPolarHBondContact OG1-CZ 3.49Å; V64-F276 HydrophobicContact CB-CE1 4.31Å; V64-F276 HydrophobicContact CG2-CD1 4.16Å; V64-F276 HydrophobicContact CG2-CE1 3.88Å; F276-V287 HydrophobicContact CE1-CB 4.25Å; F276-V287 HydrophobicContact CE1-CG1 4.29Å; F276-V287 CarbonylContact O-C 3.16Å; F276-V287 VanDerWaalsContact O-CA 3.32Å; F276-V287 WeakPolarHBondContact O-CA 3.46Å; F276-R288 PolarHBondContact O-N 2.91Å; F276-R291 VanDerWaalsContact CA-NH2 3.31Å
277	S	85.9	Confident	82.2	Confident	44 Å²	44	25.5 Å²	25.5	31%	0.308	18%	0.182	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139.3	176.4	55.5	0	0	0	0	110.1	G275 V286	G275-S277 VanDerWaalsContact C-N 3.32Å; G275-S277 PolarHBondContact O-N 2.78Å; S277-V286 CarbonylContact C-O 3.48Å; S277-V286 VanDerWaalsContact CA-O 3.23Å; S277-V286 WeakPolarHBondContact CA-O 3.22Å
278	D	85.1	Confident	82.8	Confident	1 Å²	1	23.3 Å²	23.3	1%	0.005	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	115.3	172.8	171.5	16	0	0	0	108.7	R280 V286	D278-R280 WeakPolarHBondContact OD1-CB 3.22Å; D278-R280 WeakPolarHBondContact OD1-CG 3.14Å; D278-R280 IonicContact OD1-CZ 3.35Å; D278-R280 PolarHBondContact OD1-N 3.1Å; D278-R280 IonicContact OD1-NE 2.78Å; D278-R280 PolarHBondContact OD1-NE 3.24Å; D278-R280 IonicContact OD1-NH2 3Å; D278-R280 IonicContact OD2-CZ 3.45Å; D278-R280 IonicContact OD2-NE 3.43Å; D278-R280 PolarHBondContact OD2-NE 3.08Å; D278-R280 IonicContact OD2-NH2 3.29Å; D278-R280 PolarHBondContact OD2-NH2 2.92Å; D278-V286 HydrophobicContact CB-CB 4.17Å; D278-V286 PolarHBondContact N-O 3.36Å; D278-V286 PolarHBondContact O-N 3.18Å
279	C	81.3	Confident	83.5	Confident	85 Å²	85	18.5 Å²	18.5	57%	0.574	12%	0.119	S	C	*	.			trans	-107.3	6	-173.6	50	0	0	0	0	113.3	Y281 G282	C279-Y281 PolarHBondContact O-N 2.9Å; C279-G282 PolarHBondContact O-N 3.47Å
280	R	77.1	Confident	84.2	Confident	29 Å²	29	17.9 Å²	17.9	11%	0.109	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-55	-30.4	-175.9	-76.5	178.2	-82.4	-163.5	5.2	114.6	D273 D278	D273-R280 IonicContact OD1-CZ 3.83Å; D273-R280 VanDerWaalsContact OD1-CZ 3.29Å; D273-R280 IonicContact OD1-NH1 3.62Å; D273-R280 PolarHBondContact OD1-NH1 3.04Å; D273-R280 IonicContact OD1-NH2 3.38Å; D273-R280 PolarHBondContact OD1-NH2 2.94Å; D278-R280 WeakPolarHBondContact OD1-CB 3.22Å; D278-R280 WeakPolarHBondContact OD1-CG 3.14Å; D278-R280 IonicContact OD1-CZ 3.35Å; D278-R280 PolarHBondContact OD1-N 3.1Å; D278-R280 IonicContact OD1-NE 2.78Å; D278-R280 PolarHBondContact OD1-NE 3.24Å; D278-R280 IonicContact OD1-NH2 3Å; D278-R280 IonicContact OD2-CZ 3.45Å; D278-R280 IonicContact OD2-NE 3.43Å; D278-R280 PolarHBondContact OD2-NE 3.08Å; D278-R280 IonicContact OD2-NH2 3.29Å; D278-R280 PolarHBondContact OD2-NH2 2.92Å
281	Y	74.3	Confident	84.4	Confident	15 Å²	15	17.6 Å²	17.6	6%	0.059	11%	0.114	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-19.6	-172.8	-57.9	-75.9	0	0	0	112.4	P159 S160 Q230 V234 R238 C279 V286 C374	P159-Y281 VanDerWaalsContact CA-O 3.26Å; P159-Y281 WeakPolarHBondContact CA-O 3.21Å; S160-Y281 PolarHBondContact N-O 2.91Å; Q230-Y281 HydrophobicContact CG-CE1 4.47Å; Q230-Y281 WeakPolarHBondContact CG-OH 3.45Å; V234-Y281 HydrophobicContact CB-CD1 4.31Å; V234-Y281 HydrophobicContact CB-CG 4.45Å; V234-Y281 HydrophobicContact CG1-CD1 3.87Å; V234-Y281 HydrophobicContact CG1-CG 3.88Å; V234-Y281 HydrophobicContact CG2-CD1 3.77Å; V234-Y281 HydrophobicContact CG2-CD2 3.86Å; V234-Y281 HydrophobicContact CG2-CE1 3.95Å; V234-Y281 HydrophobicContact CG2-CE2 4.06Å; V234-Y281 HydrophobicContact CG2-CG 3.73Å; R238-Y281 PolarHBondContact NH2-O 3.39Å; C279-Y281 PolarHBondContact O-N 2.9Å; Y281-V286 HydrophobicContact CD2-CG2 4.04Å; Y281-V286 HydrophobicContact CE2-CG2 4.05Å; Y281-C374 HydrophobicContact CD1-CB 4.17Å; Y281-C374 HydrophobicContact CE1-CB 3.89Å
282	G	68.3	Low	84.6	Confident	12 Å²	12	19.4 Å²	19.4	12%	0.124	12%	0.12	C	C	.	.	S	Bend	trans	64.3	136.1	-172.5	0	0	0	0	0	112.5	S160 C279 V284	S160-G282 VanDerWaalsContact O-CA 3.31Å; S160-G282 WeakPolarHBondContact O-CA 3.32Å; S160-G282 PolarHBondContact OG-O 3.39Å; C279-G282 PolarHBondContact O-N 3.47Å; G282-V284 PolarHBondContact O-N 3.02Å
283	G	75.1	Confident	85	Confident	30 Å²	30	17.4 Å²	17.4	31%	0.309	11%	0.11	S	C	.	.	S	Bend	trans	70.4	-28.5	-176.2	0	0	0	0	0	116	S160	S160-G283 VanDerWaalsContact OG-CA 3.28Å; S160-G283 WeakPolarHBondContact OG-CA 3.38Å; S160-G283 PolarHBondContact OG-N 3.23Å; S160-G283 VanDerWaalsContact OG-N 3.14Å
284	V	85.3	Confident	85.3	Confident	2 Å²	2	17.8 Å²	17.8	1%	0.012	11%	0.114	C	C	.	.			trans	-123.7	121.5	175.1	-174.8	0	0	0	0	110.3	A237 R238 S243 L245 G282	A237-V284 HydrophobicContact CB-CB 4.5Å; A237-V284 HydrophobicContact CB-CG1 3.8Å; A237-V284 HydrophobicContact CB-CG2 3.91Å; R238-V284 HydrophobicContact CG-CG2 3.5Å; R238-V284 VanDerWaalsContact CG-CG2 3.5Å; S243-V284 WeakPolarHBondContact O-CA 3.45Å; L245-V284 HydrophobicContact CB-CG1 4.04Å; G282-V284 PolarHBondContact O-N 3.02Å
285	T	89.2	Confident	85.6	Confident	33 Å²	33	20 Å²	20	20%	0.202	13%	0.132	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	122.7	173.1	-56.3	0	0	0	0	110.5	V64 S243 K244 L245 V287	V64-T285 HydrophobicContact CG1-CG2 4.17Å; S243-T285 PolarHBondContact O-N 3Å; K244-T285 WeakPolarHBondContact CA-O 3.35Å; L245-T285 PolarHBondContact N-O 3.06Å; T285-V287 HydrophobicContact CG2-CG1 4.18Å
286	V	90.9	Very high	85.8	Confident	0 Å²	0	22.7 Å²	22.7	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	127.9	175.9	-171.2	0	0	0	0	109.2	L245 Q247 S277 D278 Y281	L245-V286 HydrophobicContact CB-CG1 4.48Å; L245-V286 HydrophobicContact CB-CG2 4.3Å; L245-V286 HydrophobicContact CD2-CG1 4.14Å; L245-V286 HydrophobicContact CD2-CG2 3.97Å; L245-V286 HydrophobicContact CG-CG1 4.41Å; L245-V286 CarbonylContact O-C 3.49Å; L245-V286 VanDerWaalsContact O-CA 3.26Å; L245-V286 WeakPolarHBondContact O-CA 3.48Å; Q247-V286 HydrophobicContact CG-CG1 3.77Å; S277-V286 CarbonylContact C-O 3.48Å; S277-V286 VanDerWaalsContact CA-O 3.23Å; S277-V286 WeakPolarHBondContact CA-O 3.22Å; D278-V286 HydrophobicContact CB-CB 4.17Å; D278-V286 PolarHBondContact N-O 3.36Å; D278-V286 PolarHBondContact O-N 3.18Å; Y281-V286 HydrophobicContact CD2-CG2 4.04Å; Y281-V286 HydrophobicContact CE2-CG2 4.05Å
287	V	92.3	Very high	86	Confident	0 Å²	0	22.6 Å²	22.6	0%	0	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	147.1	-177.5	-60.4	0	0	0	0	111.4	V64 I65 L245 M246 Q247 F276 T285 P289	V64-V287 HydrophobicContact CB-CG1 4.4Å; V64-V287 HydrophobicContact CG1-CG1 3.71Å; I65-V287 HydrophobicContact CD1-CG2 4.33Å; L245-V287 PolarHBondContact O-N 3.47Å; M246-V287 CarbonylContact C-O 3.6Å; M246-V287 WeakPolarHBondContact CA-O 3.38Å; M246-V287 HydrophobicContact CB-CG2 4.19Å; M246-V287 HydrophobicContact CG-CG2 3.57Å; Q247-V287 PolarHBondContact N-O 3.25Å; F276-V287 HydrophobicContact CE1-CB 4.25Å; F276-V287 HydrophobicContact CE1-CG1 4.29Å; F276-V287 CarbonylContact O-C 3.16Å; F276-V287 VanDerWaalsContact O-CA 3.32Å; F276-V287 WeakPolarHBondContact O-CA 3.46Å; T285-V287 HydrophobicContact CG2-CG1 4.18Å; V287-P289 WeakPolarHBondContact O-CD 3.46Å
288	R	92.4	Very high	86.3	Confident	2 Å²	2	20.7 Å²	20.7	1%	0.008	13%	0.126	C	C	.	.			trans	-125.2	78.4	-173.5	-61.8	-178.7	-179	91.9	10.1	111.9	Q247 D249 Q272 D273 G275 F276 M290 R291	Q247-R288 HydrophobicContact CB-CG 4.35Å; D249-R288 HydrophobicContact CB-CG 4.42Å; D249-R288 WeakPolarHBondContact OD2-CD 3.33Å; D249-R288 IonicContact OD2-NE 3.23Å; D249-R288 PolarHBondContact OD2-NE 3.19Å; D249-R288 VanDerWaalsContact OD2-NE 3.08Å; Q272-R288 PolarHBondContact O-NH1 2.98Å; Q272-R288 VanDerWaalsContact O-NH1 3.16Å; D273-R288 PolarHBondContact O-NH1 3.26Å; G275-R288 PolarHBondContact O-NH1 3.43Å; F276-R288 PolarHBondContact O-N 2.91Å; R288-M290 PolarHBondContact O-N 3.42Å; R288-R291 VanDerWaalsContact O-CB 3.3Å; R288-R291 WeakPolarHBondContact O-CB 3.29Å
289	P	90.6	Very high	86.7	Confident	0 Å²	0	23.2 Å²	23.2	0%	0	15%	0.147	C	C	.	.	G	3₁₀ helix	trans	-73.1	-24.6	-173.9	29.9	-36.4	0	0	0	114	F55 L59 M84 M246 V287 R291	F55-P289 HydrophobicContact CD2-CB 4.1Å; F55-P289 HydrophobicContact CE2-CB 3.54Å; F55-P289 HydrophobicContact CE2-CG 3.8Å; F55-P289 HydrophobicContact CZ-CB 4.19Å; F55-P289 HydrophobicContact CZ-CG 4.35Å; L59-P289 HydrophobicContact CD2-CB 4.06Å; M84-P289 HydrophobicContact CG-CG 4.27Å; M84-P289 HydrophobicContact SD-CG 3.88Å; M246-P289 HydrophobicContact SD-CG 4.24Å; V287-P289 WeakPolarHBondContact O-CD 3.46Å; P289-R291 PolarHBondContact O-N 3.49Å
290	M	91.6	Very high	87.2	Confident	0 Å²	0	23.4 Å²	23.4	0%	0	14%	0.136	C	C	.	.	G	3₁₀ helix	trans	-79.9	6.9	-179.6	-66.3	-58.7	-68	0	0	114.5	F51 F55 M84 D249 S250 R288 E292 Y293 I298	F51-M290 HydrophobicContact CZ-CE 4.11Å; F55-M290 HydrophobicContact CD2-SD 4.08Å; F55-M290 HydrophobicContact CE2-SD 4.26Å; M84-M290 HydrophobicContact CB-CG 3.68Å; M84-M290 HydrophobicContact CB-SD 4.05Å; M84-M290 HydrophobicContact CG-CG 3.98Å; M84-M290 HydrophobicContact CG-SD 4.46Å; M84-M290 HydrophobicContact SD-CG 4.35Å; D249-M290 CarbonylContact O-C 3.56Å; S250-M290 WeakPolarHBondContact CA-O 3.46Å; R288-M290 PolarHBondContact O-N 3.42Å; M290-E292 PolarHBondContact O-N 3.27Å; M290-Y293 HydrophobicContact CB-CD2 4.41Å; M290-Y293 HydrophobicContact CE-CD2 3.91Å; M290-Y293 HydrophobicContact CE-CE2 4.29Å; M290-Y293 HydrophobicContact CE-CG 4.08Å; M290-Y293 WeakPolarHBondContact O-CB 3.49Å; M290-Y293 WeakPolarHBondContact O-CD2 3.08Å; M290-Y293 PolarHBondContact O-N 2.94Å; M290-Y293 VanDerWaalsContact O-N 3.15Å; M290-Y293 HydrophobicContact SD-CD2 4.09Å; M290-Y293 HydrophobicContact SD-CE2 4.05Å; M290-I298 HydrophobicContact CE-CD1 4.11Å; M290-I298 HydrophobicContact CE-CG1 4.11Å
291	R	88.9	Confident	87.9	Confident	3 Å²	3	22.2 Å²	22.2	1%	0.011	13%	0.132	C	C	.	.	G	3₁₀ helix	trans	-61.9	-34.8	-171.1	165.7	178.6	-34.1	-128.9	-38.6	116	D249 C251 L254 T274 G275 F276 R288 P289 Y293 Y348	D249-R291 WeakPolarHBondContact O-CA 3.41Å; D249-R291 PolarHBondContact O-N 3.11Å; C251-R291 WeakPolarHBondContact CA-O 3.19Å; C251-R291 WeakPolarHBondContact CB-O 3.36Å; C251-R291 PolarHBondContact N-O 3.02Å; C251-R291 VanDerWaalsContact N-O 3.14Å; L254-R291 HydrophobicContact CD1-CB 3.75Å; L254-R291 HydrophobicContact CD1-CG 3.53Å; T274-R291 PolarHBondContact O-NH1 2.89Å; T274-R291 PolarHBondContact O-NH2 2.68Å; G275-R291 VanDerWaalsContact CA-NH1 3.35Å; G275-R291 PolarHBondContact O-NH2 2.97Å; F276-R291 VanDerWaalsContact CA-NH2 3.31Å; R288-R291 VanDerWaalsContact O-CB 3.3Å; R288-R291 WeakPolarHBondContact O-CB 3.29Å; P289-R291 PolarHBondContact O-N 3.49Å; R291-Y293 PolarHBondContact O-N 2.89Å; R291-Y348 WeakPolarHBondContact CD-OH 3.38Å; R291-Y348 HydrophobicContact CG-CE1 4.04Å; R291-Y348 HydrophobicContact CG-CE2 3.81Å; R291-Y348 PolarHBondContact NH1-OH 3.5Å
292	E	87.7	Confident	88.7	Confident	58 Å²	58	22.1 Å²	22.1	27%	0.271	13%	0.132	S	C	.	.	G	3₁₀ helix	trans	-80.2	-5	-177.5	-74.4	-69.6	134.2	0	0	112.2	K54 M58 M290	K54-E292 HydrophobicContact CD-CB 4.45Å; K54-E292 WeakPolarHBondContact CE-O 3.29Å; K54-E292 HydrophobicContact CG-CB 4.38Å; K54-E292 PolarHBondContact NZ-O 2.95Å; M58-E292 HydrophobicContact CE-CG 3.88Å; M58-E292 HydrophobicContact CG-CG 4.04Å; M58-E292 HydrophobicContact SD-CG 3.54Å; M58-E292 VanDerWaalsContact SD-CG 3.54Å; M290-E292 PolarHBondContact O-N 3.27Å
293	Y	90.9	Very high	89.9	Confident	0 Å²	0	29.2 Å²	29.2	0%	0	16%	0.162	C	C	.	.			trans	-94.2	132	-176.9	-60.5	-92.1	0	0	0	111.3	F51 K54 F55 S250 C251 M290 R291	F51-Y293 AromaticContact CD1-CE1 3.93Å; F51-Y293 HydrophobicContact CD1-CE1 3.93Å; F51-Y293 AromaticContact CD2-CD1 3.73Å; F51-Y293 HydrophobicContact CD2-CD1 3.73Å; F51-Y293 AromaticContact CD2-CE1 3.43Å; F51-Y293 HydrophobicContact CD2-CE1 3.43Å; F51-Y293 VanDerWaalsContact CD2-CE1 3.43Å; F51-Y293 HydrophobicContact CE1-CD1 4.38Å; F51-Y293 AromaticContact CE1-CE1 3.85Å; F51-Y293 HydrophobicContact CE1-CE1 3.85Å; F51-Y293 AromaticContact CE2-CD1 3.27Å; F51-Y293 HydrophobicContact CE2-CD1 3.27Å; F51-Y293 AromaticContact CE2-CE1 3.35Å; F51-Y293 HydrophobicContact CE2-CE1 3.35Å; F51-Y293 HydrophobicContact CE2-CG 4.34Å; F51-Y293 HydrophobicContact CG-CD1 4.45Å; F51-Y293 AromaticContact CG-CE1 3.72Å; F51-Y293 HydrophobicContact CG-CE1 3.72Å; F51-Y293 AromaticContact CZ-CD1 3.63Å; F51-Y293 HydrophobicContact CZ-CD1 3.63Å; F51-Y293 AromaticContact CZ-CE1 3.56Å; F51-Y293 HydrophobicContact CZ-CE1 3.56Å; F51-Y293 HydrophobicContact CZ-CG 4.42Å; F51-Y293 PolarHBondContact O-OH 2.91Å; K54-Y293 HydrophobicContact CB-CE1 4.29Å; K54-Y293 WeakPolarHBondContact CB-OH 3.48Å; K54-Y293 HydrophobicContact CD-CD1 4.2Å; K54-Y293 HydrophobicContact CD-CE1 3.81Å; K54-Y293 HydrophobicContact CG-CE1 4.18Å; K54-Y293 HydrophobicContact CG-CE2 4.32Å; F55-Y293 VanDerWaalsContact CA-OH 3.24Å; F55-Y293 WeakPolarHBondContact CA-OH 3.3Å; F55-Y293 WeakPolarHBondContact CB-OH 3.22Å; F55-Y293 PolarHBondContact N-OH 3.15Å; S250-Y293 WeakPolarHBondContact CB-O 3.42Å; C251-Y293 VanDerWaalsContact CB-O 3.27Å; C251-Y293 WeakPolarHBondContact CB-O 3.46Å; C251-Y293 PolarHBondContact N-O 2.8Å; M290-Y293 HydrophobicContact CB-CD2 4.41Å; M290-Y293 HydrophobicContact CE-CD2 3.91Å; M290-Y293 HydrophobicContact CE-CE2 4.29Å; M290-Y293 HydrophobicContact CE-CG 4.08Å; M290-Y293 WeakPolarHBondContact O-CB 3.49Å; M290-Y293 WeakPolarHBondContact O-CD2 3.08Å; M290-Y293 PolarHBondContact O-N 2.94Å; M290-Y293 VanDerWaalsContact O-N 3.15Å; M290-Y293 HydrophobicContact SD-CD2 4.09Å; M290-Y293 HydrophobicContact SD-CE2 4.05Å; R291-Y293 PolarHBondContact O-N 2.89Å
294	S	89.8	Confident	90.6	Very high	19 Å²	19	29 Å²	29	13%	0.133	15%	0.153	C	C	.	.			trans	-77.2	155.2	168.7	64.7	0	0	0	0	111.3	K296 E297 I298	S294-K296 PolarHBondContact O-N 3.4Å; S294-E297 WeakPolarHBondContact CB-OE2 3.49Å; S294-E297 PolarHBondContact N-OE2 3.33Å; S294-E297 PolarHBondContact O-N 2.82Å; S294-E297 WeakPolarHBondContact OG-CG 3.23Å; S294-E297 PolarHBondContact OG-N 3.1Å; S294-E297 PolarHBondContact OG-OE2 3.41Å; S294-I298 WeakPolarHBondContact O-CG1 3.47Å; S294-I298 PolarHBondContact O-N 3.41Å; S294-I298 VanDerWaalsContact O-N 3.15Å
295	A	90	Very high	90.7	Very high	47 Å²	47	31.1 Å²	31.1	39%	0.388	16%	0.162	S	C	.	.	H	α-helix	trans	-57.5	-34.2	175.4	0	0	0	0	0	112.6	T252 I298 A299	T252-A295 HydrophobicContact CG2-CB 4.35Å; T252-A295 PolarHBondContact OG1-N 3.36Å; T252-A295 VanDerWaalsContact OG1-N 3.15Å; A295-I298 PolarHBondContact O-N 2.94Å; A295-A299 WeakPolarHBondContact O-CB 3.41Å; A295-A299 PolarHBondContact O-N 3.14Å
296	K	89.2	Confident	90.7	Very high	71 Å²	71	38.3 Å²	38.3	31%	0.309	19%	0.191	S	C	.	.	H	α-helix	trans	-64.8	-47	177.1	-169.1	-175.2	-174.9	-162.6	0	112.1	V35 I36 S294 I298 A299 Y300	V35-K296 PolarHBondContact O-NZ 3.5Å; I36-K296 PolarHBondContact O-NZ 3.49Å; I36-K296 VanDerWaalsContact O-NZ 3.11Å; S294-K296 PolarHBondContact O-N 3.4Å; K296-I298 VanDerWaalsContact C-N 3.34Å; K296-I298 PolarHBondContact O-N 2.86Å; K296-A299 PolarHBondContact O-N 3.34Å; K296-Y300 HydrophobicContact CD-CE2 3.99Å; K296-Y300 WeakPolarHBondContact CE-OH 3.31Å; K296-Y300 HydrophobicContact CG-CD2 4.08Å; K296-Y300 HydrophobicContact CG-CE2 3.53Å; K296-Y300 VanDerWaalsContact O-CD2 3.32Å; K296-Y300 WeakPolarHBondContact O-CD2 3.25Å; K296-Y300 PolarHBondContact O-N 2.65Å
297	E	90.4	Very high	90.6	Very high	24 Å²	24	39 Å²	39	11%	0.112	19%	0.194	C	C	.	.	H	α-helix	trans	-60.3	-44.5	176.6	-73.3	166.7	127.1	0	0	111.7	I36 K54 S294 Y300 Y301	I36-E297 HydrophobicContact CB-CG 4.4Å; I36-E297 HydrophobicContact CD1-CG 4.14Å; I36-E297 HydrophobicContact CG1-CG 4.21Å; I36-E297 HydrophobicContact CG2-CG 3.33Å; K54-E297 IonicContact NZ-OE1 3.54Å; K54-E297 PolarHBondContact NZ-OE1 2.89Å; K54-E297 IonicContact NZ-OE2 2.89Å; S294-E297 WeakPolarHBondContact CB-OE2 3.49Å; S294-E297 PolarHBondContact N-OE2 3.33Å; S294-E297 PolarHBondContact O-N 2.82Å; S294-E297 WeakPolarHBondContact OG-CG 3.23Å; S294-E297 PolarHBondContact OG-N 3.1Å; S294-E297 PolarHBondContact OG-OE2 3.41Å; E297-Y300 PolarHBondContact O-N 3.48Å; E297-Y301 WeakPolarHBondContact O-CB 3.13Å; E297-Y301 PolarHBondContact O-N 2.89Å
298	I	92.9	Very high	90.3	Very high	4 Å²	4	42.6 Å²	42.6	2%	0.021	22%	0.218	C	C	.	.	H	α-helix	trans	-62.2	-45	178.5	-67.8	169.6	0	0	0	110.5	P79 S80 S83 M290 S294 A295 K296 Y300 Y301 N302	P79-I298 HydrophobicContact CB-CG2 4.22Å; S80-I298 WeakPolarHBondContact OG-CD1 3.16Å; S83-I298 WeakPolarHBondContact OG-CG2 3.49Å; M290-I298 HydrophobicContact CE-CD1 4.11Å; M290-I298 HydrophobicContact CE-CG1 4.11Å; S294-I298 WeakPolarHBondContact O-CG1 3.47Å; S294-I298 PolarHBondContact O-N 3.41Å; S294-I298 VanDerWaalsContact O-N 3.15Å; A295-I298 PolarHBondContact O-N 2.94Å; K296-I298 VanDerWaalsContact C-N 3.34Å; K296-I298 PolarHBondContact O-N 2.86Å; I298-Y300 PolarHBondContact O-N 2.83Å; I298-Y301 PolarHBondContact O-N 3.16Å; I298-N302 WeakPolarHBondContact O-CB 3.37Å; I298-N302 VanDerWaalsContact O-CG 3.29Å; I298-N302 PolarHBondContact O-N 3.39Å
299	A	91.9	Very high	90	Very high	53 Å²	53	45.2 Å²	45.2	44%	0.438	24%	0.237	S	C	.	.	H	α-helix	trans	-61.3	-45.6	178.5	0	0	0	0	0	111.8	A295 K296 N302 H303	A295-A299 WeakPolarHBondContact O-CB 3.41Å; A295-A299 PolarHBondContact O-N 3.14Å; K296-A299 PolarHBondContact O-N 3.34Å; A299-N302 PolarHBondContact O-N 2.77Å; A299-H303 WeakPolarHBondContact O-CB 3.33Å; A299-H303 PolarHBondContact O-N 3.01Å
300	Y	91.6	Very high	89.7	Confident	90 Å²	90	46.3 Å²	46.3	35%	0.353	24%	0.243	S	C	.	.	H	α-helix	trans	-64.9	-40.3	176.5	-68.3	-40.9	0	0	0	112.9	V34 K296 E297 I298 H303 M304	V34-Y300 HydrophobicContact CG1-CD2 3.4Å; V34-Y300 VanDerWaalsContact CG1-CD2 3.4Å; V34-Y300 HydrophobicContact CG1-CE2 3.96Å; V34-Y300 HydrophobicContact CG1-CG 3.8Å; K296-Y300 HydrophobicContact CD-CE2 3.99Å; K296-Y300 WeakPolarHBondContact CE-OH 3.31Å; K296-Y300 HydrophobicContact CG-CD2 4.08Å; K296-Y300 HydrophobicContact CG-CE2 3.53Å; K296-Y300 VanDerWaalsContact O-CD2 3.32Å; K296-Y300 WeakPolarHBondContact O-CD2 3.25Å; K296-Y300 PolarHBondContact O-N 2.65Å; E297-Y300 PolarHBondContact O-N 3.48Å; I298-Y300 PolarHBondContact O-N 2.83Å; Y300-H303 PolarHBondContact O-N 2.76Å; Y300-M304 WeakPolarHBondContact O-CB 3.46Å; Y300-M304 PolarHBondContact O-N 3.07Å
301	Y	91.9	Very high	89.2	Confident	3 Å²	3	52.6 Å²	52.6	1%	0.012	28%	0.282	C	S	.	.	H	α-helix	trans	-59.9	-50.2	175.2	-173.8	-93.1	0	0	0	111.1	F47 R48 F51 Q87 E297 I298 H303 M304 F305 V307	F47-Y301 HydrophobicContact CD1-CD2 4.44Å; F47-Y301 AromaticContact CE1-CD2 3.94Å; F47-Y301 HydrophobicContact CE1-CD2 3.94Å; F47-Y301 HydrophobicContact CE1-CG 4.44Å; R48-Y301 HydrophobicContact CG-CE2 4.42Å; F51-Y301 HydrophobicContact CB-CD2 3.99Å; F51-Y301 HydrophobicContact CB-CE2 4.07Å; F51-Y301 HydrophobicContact CD1-CD1 4.33Å; F51-Y301 AromaticContact CD1-CD2 3.56Å; F51-Y301 HydrophobicContact CD1-CD2 3.56Å; F51-Y301 HydrophobicContact CD1-CE1 4.31Å; F51-Y301 AromaticContact CD1-CE2 3.55Å; F51-Y301 HydrophobicContact CD1-CE2 3.55Å; F51-Y301 AromaticContact CD1-CG 3.98Å; F51-Y301 HydrophobicContact CD1-CG 3.98Å; F51-Y301 AromaticContact CD1-CZ 3.95Å; F51-Y301 AromaticContact CD2-CD2 3.81Å; F51-Y301 HydrophobicContact CD2-CD2 3.81Å; F51-Y301 HydrophobicContact CD2-CG 4.1Å; F51-Y301 AromaticContact CE1-CD1 3.92Å; F51-Y301 HydrophobicContact CE1-CD1 3.92Å; F51-Y301 AromaticContact CE1-CD2 3.94Å; F51-Y301 HydrophobicContact CE1-CD2 3.94Å; F51-Y301 HydrophobicContact CE1-CE1 4.09Å; F51-Y301 HydrophobicContact CE1-CE2 4.12Å; F51-Y301 AromaticContact CE1-CG 3.85Å; F51-Y301 HydrophobicContact CE1-CG 3.85Å; F51-Y301 HydrophobicContact CE2-CD2 4.14Å; F51-Y301 AromaticContact CE2-CG 3.95Å; F51-Y301 HydrophobicContact CE2-CG 3.95Å; F51-Y301 AromaticContact CG-CD2 3.51Å; F51-Y301 HydrophobicContact CG-CD2 3.51Å; F51-Y301 AromaticContact CG-CE2 3.83Å; F51-Y301 HydrophobicContact CG-CE2 3.83Å; F51-Y301 HydrophobicContact CG-CG 4.13Å; F51-Y301 HydrophobicContact CZ-CD1 4.1Å; F51-Y301 HydrophobicContact CZ-CD2 4.22Å; F51-Y301 AromaticContact CZ-CG 3.84Å; F51-Y301 HydrophobicContact CZ-CG 3.84Å; Q87-Y301 PolarHBondContact OE1-OH 3.18Å; Q87-Y301 VanDerWaalsContact OE1-OH 3.09Å; E297-Y301 WeakPolarHBondContact O-CB 3.13Å; E297-Y301 PolarHBondContact O-N 2.89Å; I298-Y301 PolarHBondContact O-N 3.16Å; Y301-H303 VanDerWaalsContact C-N 3.33Å; Y301-H303 PolarHBondContact O-N 3.39Å; Y301-M304 PolarHBondContact O-N 3.14Å; Y301-F305 HydrophobicContact CD1-CD2 4.28Å; Y301-F305 AromaticContact CD2-CD2 3.4Å; Y301-F305 HydrophobicContact CD2-CD2 3.4Å; Y301-F305 AromaticContact CD2-CE2 3.53Å; Y301-F305 HydrophobicContact CD2-CE2 3.53Å; Y301-F305 HydrophobicContact CE1-CD2 4.26Å; Y301-F305 AromaticContact CE2-CD2 3.35Å; Y301-F305 HydrophobicContact CE2-CD2 3.35Å; Y301-F305 AromaticContact CE2-CE2 3.54Å; Y301-F305 HydrophobicContact CE2-CE2 3.54Å; Y301-F305 HydrophobicContact CE2-CG 4.24Å; Y301-F305 AromaticContact CG-CD2 3.87Å; Y301-F305 HydrophobicContact CG-CD2 3.87Å; Y301-F305 HydrophobicContact CG-CE2 4.37Å; Y301-F305 AromaticContact CZ-CD2 3.81Å; Y301-F305 VanDerWaalsContact O-CD2 3.29Å; Y301-F305 WeakPolarHBondContact O-CD2 3.05Å; Y301-F305 PolarHBondContact O-N 3.13Å; Y301-V307 HydrophobicContact CD1-CG2 4.03Å; Y301-V307 HydrophobicContact CE1-CG2 3.81Å
302	N	92.6	Very high	88.8	Confident	13 Å²	13	53.5 Å²	53.5	7%	0.07	29%	0.286	C	S	.	.	H	α-helix	trans	-62.6	-41.4	-178.9	-70.9	-6.4	0	0	0	112.2	P79 S83 I298 A299 K306 V307	P79-N302 WeakPolarHBondContact CA-ND2 3.41Å; P79-N302 VanDerWaalsContact CB-ND2 3.32Å; P79-N302 WeakPolarHBondContact CB-ND2 3.37Å; P79-N302 PolarHBondContact O-ND2 2.97Å; S83-N302 PolarHBondContact OG-ND2 2.97Å; S83-N302 VanDerWaalsContact OG-ND2 3.12Å; S83-N302 PolarHBondContact OG-OD1 3.41Å; I298-N302 WeakPolarHBondContact O-CB 3.37Å; I298-N302 VanDerWaalsContact O-CG 3.29Å; I298-N302 PolarHBondContact O-N 3.39Å; A299-N302 PolarHBondContact O-N 2.77Å; N302-K306 CarbonylContact O-C 3.56Å; N302-K306 VanDerWaalsContact O-CA 3.25Å; N302-K306 WeakPolarHBondContact O-CA 3.33Å; N302-K306 PolarHBondContact O-N 2.09Å; N302-V307 HydrophobicContact CB-CB 4.19Å; N302-V307 PolarHBondContact O-N 2.66Å; N302-V307 WeakPolarHBondContact OD1-CB 3.34Å
303	H	91.7	Very high	88.5	Confident	161 Å²	161	52.7 Å²	52.7	75%	0.745	29%	0.286	S	S	*	.	H	α-helix	trans	-65.8	-47.1	176.7	-174.9	72.2	0	0	0	112.1	A299 Y300 Y301	A299-H303 WeakPolarHBondContact O-CB 3.33Å; A299-H303 PolarHBondContact O-N 3.01Å; Y300-H303 PolarHBondContact O-N 2.76Å; Y301-H303 VanDerWaalsContact C-N 3.33Å; Y301-H303 PolarHBondContact O-N 3.39Å
304	M	89.8	Confident	88.1	Confident	27 Å²	27	55.9 Å²	55.9	13%	0.133	30%	0.303	C	S	.	.	H	α-helix	trans	-74.2	-29	-173.6	-170.8	160.8	64.9	0	0	113.5	A33 V34 R44 F47 Y300 Y301	A33-M304 HydrophobicContact CB-SD 4.32Å; V34-M304 HydrophobicContact CG2-CE 3.86Å; V34-M304 HydrophobicContact CG2-SD 3.87Å; R44-M304 HydrophobicContact CB-CE 4.23Å; R44-M304 HydrophobicContact CB-SD 3.78Å; R44-M304 HydrophobicContact CG-CE 3.96Å; R44-M304 HydrophobicContact CG-CG 3.82Å; R44-M304 HydrophobicContact CG-SD 3.56Å; R44-M304 VanDerWaalsContact CG-SD 3.56Å; R44-M304 PolarHBondContact NE-O 2.66Å; R44-M304 PolarHBondContact NH2-O 2.83Å; F47-M304 HydrophobicContact CB-CE 4.12Å; F47-M304 HydrophobicContact CD1-CE 3.28Å; F47-M304 HydrophobicContact CE1-CE 4.01Å; F47-M304 HydrophobicContact CG-CE 4.06Å; Y300-M304 WeakPolarHBondContact O-CB 3.46Å; Y300-M304 PolarHBondContact O-N 3.07Å; Y301-M304 PolarHBondContact O-N 3.14Å
305	F	88.6	Confident	87.7	Confident	46 Å²	46	56.4 Å²	56.4	20%	0.202	30%	0.304	C	S	.	.	H	α-helix	trans	-106.4	6.1	178.2	-59.8	-71.3	0	0	0	113.5	R44 F47 R48 Y301 V307	R44-F305 HydrophobicContact CG-CE1 4.04Å; R44-F305 HydrophobicContact CG-CZ 4.01Å; F47-F305 HydrophobicContact CD1-CE2 4.11Å; R48-F305 HydrophobicContact CB-CE1 4.03Å; R48-F305 HydrophobicContact CB-CE2 4.14Å; R48-F305 HydrophobicContact CB-CZ 3.51Å; R48-F305 HydrophobicContact CG-CE1 4.04Å; R48-F305 HydrophobicContact CG-CE2 4.33Å; R48-F305 HydrophobicContact CG-CZ 3.87Å; Y301-F305 HydrophobicContact CD1-CD2 4.28Å; Y301-F305 AromaticContact CD2-CD2 3.4Å; Y301-F305 HydrophobicContact CD2-CD2 3.4Å; Y301-F305 AromaticContact CD2-CE2 3.53Å; Y301-F305 HydrophobicContact CD2-CE2 3.53Å; Y301-F305 HydrophobicContact CE1-CD2 4.26Å; Y301-F305 AromaticContact CE2-CD2 3.35Å; Y301-F305 HydrophobicContact CE2-CD2 3.35Å; Y301-F305 AromaticContact CE2-CE2 3.54Å; Y301-F305 HydrophobicContact CE2-CE2 3.54Å; Y301-F305 HydrophobicContact CE2-CG 4.24Å; Y301-F305 AromaticContact CG-CD2 3.87Å; Y301-F305 HydrophobicContact CG-CD2 3.87Å; Y301-F305 HydrophobicContact CG-CE2 4.37Å; Y301-F305 AromaticContact CZ-CD2 3.81Å; Y301-F305 VanDerWaalsContact O-CD2 3.29Å; Y301-F305 WeakPolarHBondContact O-CD2 3.05Å; Y301-F305 PolarHBondContact O-N 3.13Å; F305-V307 VanDerWaalsContact C-N 3.26Å; F305-V307 HydrophobicContact CB-CG2 4.35Å; F305-V307 PolarHBondContact O-N 3.03Å
306	K	89.8	Confident	87.3	Confident	184 Å²	184	55.8 Å²	55.8	80%	0.8	29%	0.294	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.7	44.5	179.1	-57.8	-176.6	177.9	-176.4	0	112.3	N302	N302-K306 CarbonylContact O-C 3.56Å; N302-K306 VanDerWaalsContact O-CA 3.25Å; N302-K306 WeakPolarHBondContact O-CA 3.33Å; N302-K306 PolarHBondContact O-N 2.09Å
307	V	87.7	Confident	87	Confident	13 Å²	13	55.8 Å²	55.8	8%	0.079	30%	0.3	C	S	.	.			trans	-66.9	125.9	175.3	179.7	0	0	0	0	107.9	C82 Y301 N302 F305 S309	C82-V307 HydrophobicContact CB-CG1 4.09Å; Y301-V307 HydrophobicContact CD1-CG2 4.03Å; Y301-V307 HydrophobicContact CE1-CG2 3.81Å; N302-V307 HydrophobicContact CB-CB 4.19Å; N302-V307 PolarHBondContact O-N 2.66Å; N302-V307 WeakPolarHBondContact OD1-CB 3.34Å; F305-V307 VanDerWaalsContact C-N 3.26Å; F305-V307 HydrophobicContact CB-CG2 4.35Å; F305-V307 PolarHBondContact O-N 3.03Å; V307-S309 PolarHBondContact O-N 3.41Å
308	P	86	Confident	86.5	Confident	76 Å²	76	64.6 Å²	64.6	49%	0.494	34%	0.338	S	S	.	.			trans	-64.8	128.9	-179.8	26.7	-33.7	0	0	0	109.8	C82 M133	C82-P308 WeakPolarHBondContact CB-O 3.2Å; C82-P308 PolarHBondContact SG-O 3.37Å; M133-P308 HydrophobicContact CG-CB 4.12Å; M133-P308 HydrophobicContact CG-CG 3.77Å; M133-P308 HydrophobicContact SD-CB 3.9Å; M133-P308 HydrophobicContact SD-CG 3.83Å
309	S	86.4	Confident	86.2	Confident	57 Å²	57	67.7 Å²	67.7	40%	0.399	35%	0.353	S	S	.	.			trans	-140.8	138.5	174.3	64.2	0	0	0	0	109.4	V307	V307-S309 PolarHBondContact O-N 3.41Å
310	V	84.8	Confident	86	Confident	23 Å²	23	69.2 Å²	69.2	14%	0.139	36%	0.359	C	S	.	.			trans	-105	133	-179.2	-175.9	0	0	0	0	108.6	G77 T126 L130 I312	G77-V310 PolarHBondContact O-N 3.31Å; G77-V310 VanDerWaalsContact O-O 3.04Å; T126-V310 HydrophobicContact CG2-CG1 4.14Å; L130-V310 HydrophobicContact CD2-CB 4.23Å; L130-V310 HydrophobicContact CD2-CG2 3.73Å; L130-V310 HydrophobicContact CG-CG2 4.28Å; V310-I312 HydrophobicContact CB-CG1 4.44Å; V310-I312 HydrophobicContact CG1-CG1 4.1Å; V310-I312 PolarHBondContact O-N 3.24Å
311	V	81.5	Confident	85.7	Confident	133 Å²	133	68.2 Å²	68.2	81%	0.806	36%	0.36	S	S	*	.			trans	-84.6	100.9	175.3	-178	0	0	0	0	108.2
312	I	80	Confident	85.5	Confident	22 Å²	22	77 Å²	77	11%	0.113	40%	0.398	C	S	.	.			trans	-96.1	125.1	176	-50.7	-174.7	0	0	0	107.8	S76 Y108 E112 T126 L130 V310 N314	S76-I312 VanDerWaalsContact O-CD1 3.22Å; S76-I312 WeakPolarHBondContact O-CD1 3.22Å; Y108-I312 HydrophobicContact CE2-CD1 3.81Å; Y108-I312 WeakPolarHBondContact OH-CD1 3.3Å; E112-I312 HydrophobicContact CB-CG2 4.24Å; E112-I312 HydrophobicContact CG-CG2 4.43Å; T126-I312 HydrophobicContact CG2-CD1 4.12Å; T126-I312 HydrophobicContact CG2-CG1 4.18Å; L130-I312 HydrophobicContact CD1-CD1 4.29Å; V310-I312 HydrophobicContact CB-CG1 4.44Å; V310-I312 HydrophobicContact CG1-CG1 4.1Å; V310-I312 PolarHBondContact O-N 3.24Å; I312-N314 PolarHBondContact O-OD1 2.87Å
313	P	80.6	Confident	85.4	Confident	40 Å²	40	77.5 Å²	77.5	26%	0.26	40%	0.404	S	S	.	.			trans	-73.2	139.8	175.6	29.7	-32.5	0	0	0	110.3	E112 L116 T317	E112-P313 WeakPolarHBondContact CB-O 3.31Å; L116-P313 VanDerWaalsContact CD1-O 3.29Å; L116-P313 WeakPolarHBondContact CD1-O 3.31Å; P313-T317 HydrophobicContact CB-CG2 4.15Å
314	N	82.8	Confident	85.4	Confident	68 Å²	68	70 Å²	70	36%	0.364	37%	0.37	S	S	.	.			trans	-115.4	174	-177	-57.3	-4.1	0	0	0	109.7	I312 D316 T317	I312-N314 PolarHBondContact O-OD1 2.87Å; N314-D316 PolarHBondContact O-N 3.33Å; N314-T317 PolarHBondContact N-OG1 2.87Å; N314-T317 WeakPolarHBondContact O-CB 3.32Å; N314-T317 PolarHBondContact O-N 3.44Å; N314-T317 PolarHBondContact O-OG1 3Å
315	L	81.1	Confident	85.5	Confident	29 Å²	29	70.9 Å²	70.9	15%	0.152	38%	0.375	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-23.9	172.4	-71.5	177.2	0	0	0	114.2	L116 K221 Q222 L225 M319	L116-L315 HydrophobicContact CD2-CD2 3.54Å; L116-L315 HydrophobicContact CD2-CG 4.28Å; L116-L315 HydrophobicContact CG-CD2 4.37Å; K221-L315 HydrophobicContact CB-CD1 4.01Å; Q222-L315 HydrophobicContact CG-CB 4.15Å; Q222-L315 HydrophobicContact CG-CD1 3.72Å; L225-L315 HydrophobicContact CD1-CD1 3.34Å; L225-L315 HydrophobicContact CD1-CG 3.91Å; L225-L315 HydrophobicContact CG-CD1 4.31Å; L315-M319 VanDerWaalsContact O-CG 3.27Å; L315-M319 WeakPolarHBondContact O-CG 3.46Å
316	D	81.8	Confident	85.6	Confident	34 Å²	34	69.8 Å²	69.8	18%	0.182	37%	0.37	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87	-10.8	178.7	-70	-55.4	0	0	0	113.8	Q222 N314 K318 M319 S324	Q222-D316 PolarHBondContact NE2-OD1 3.37Å; Q222-D316 PolarHBondContact NE2-OD2 3.34Å; N314-D316 PolarHBondContact O-N 3.33Å; D316-K318 PolarHBondContact O-N 2.7Å; D316-M319 WeakPolarHBondContact O-CB 3.16Å; D316-M319 PolarHBondContact O-N 3.31Å; D316-M319 VanDerWaalsContact O-N 3.11Å; D316-S324 PolarHBondContact OD1-OG 3.38Å
317	T	82.8	Confident	85.7	Confident	71 Å²	71	63.7 Å²	63.7	44%	0.436	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.2	124.7	-172.4	-64.2	0	0	0	0	110.4	P313 N314 M319	P313-T317 HydrophobicContact CB-CG2 4.15Å; N314-T317 PolarHBondContact N-OG1 2.87Å; N314-T317 WeakPolarHBondContact O-CB 3.32Å; N314-T317 PolarHBondContact O-N 3.44Å; N314-T317 PolarHBondContact O-OG1 3Å; T317-M319 PolarHBondContact O-N 3.45Å
318	K	81.2	Confident	86	Confident	209 Å²	209	67.3 Å²	67.3	91%	0.909	36%	0.36	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.3	14	-174.5	-61.8	-177	175.1	-177.4	0	115.4	D316	D316-K318 PolarHBondContact O-N 2.7Å
319	M	85.9	Confident	86.3	Confident	69 Å²	69	64.1 Å²	64.1	34%	0.34	34%	0.34	S	S	.	.			trans	-83.3	150.8	175.7	-64.1	-53.9	-75.5	0	0	112	L218 L315 D316 T317 A323	L218-M319 HydrophobicContact CD1-CE 3.43Å; L218-M319 VanDerWaalsContact CD1-CE 3.43Å; L315-M319 VanDerWaalsContact O-CG 3.27Å; L315-M319 WeakPolarHBondContact O-CG 3.46Å; D316-M319 WeakPolarHBondContact O-CB 3.16Å; D316-M319 PolarHBondContact O-N 3.31Å; D316-M319 VanDerWaalsContact O-N 3.11Å; T317-M319 PolarHBondContact O-N 3.45Å; M319-A323 HydrophobicContact CB-CB 3.87Å; M319-A323 HydrophobicContact CE-CB 4.41Å
320	P	87.7	Confident	86.5	Confident	86 Å²	86	65.1 Å²	65.1	56%	0.558	34%	0.338	S	S	*	.			trans	-65	157.9	179.1	25.4	-32.4	0	0	0	111.8	K322 A323	P320-K322 PolarHBondContact O-N 3.24Å; P320-A323 HydrophobicContact CG-CB 3.97Å; P320-A323 WeakPolarHBondContact O-CB 3.31Å; P320-A323 PolarHBondContact O-N 3.04Å
321	D	84.3	Confident	86.9	Confident	69 Å²	69	65 Å²	65	37%	0.369	34%	0.337	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.7	-25.9	-173.7	-77.3	-3.5	0	0	0	114.4	R327 L328 N331 K335	D321-R327 IonicContact OD1-NH2 2.83Å; D321-L328 WeakPolarHBondContact O-CA 3.32Å; D321-L328 PolarHBondContact O-N 3.38Å; D321-N331 VanDerWaalsContact CA-ND2 3.35Å; D321-N331 WeakPolarHBondContact CA-ND2 3.44Å; D321-N331 VanDerWaalsContact CB-ND2 3.27Å; D321-N331 WeakPolarHBondContact CB-ND2 3.4Å; D321-N331 PolarHBondContact OD1-ND2 2.9Å; D321-K335 IonicContact OD2-NZ 3.87Å
322	K	89.1	Confident	87.3	Confident	186 Å²	186	64 Å²	64	81%	0.809	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-101	12.4	-179.9	-58	-176.9	-179.9	178.4	0	113.3	P320 S324 L328	P320-K322 PolarHBondContact O-N 3.24Å; K322-S324 PolarHBondContact O-N 3.13Å; K322-L328 HydrophobicContact CG-CD1 4.03Å
323	A	88.9	Confident	87.9	Confident	24 Å²	24	63 Å²	63	20%	0.198	32%	0.316	C	S	.	.	S	Bend	trans	-65.1	-37.1	-174.7	0	0	0	0	0	114	L218 M319 P320	L218-A323 HydrophobicContact CD1-CB 3.82Å; M319-A323 HydrophobicContact CB-CB 3.87Å; M319-A323 HydrophobicContact CE-CB 4.41Å; P320-A323 HydrophobicContact CG-CB 3.97Å; P320-A323 WeakPolarHBondContact O-CB 3.31Å; P320-A323 PolarHBondContact O-N 3.04Å
324	S	91.8	Very high	88.2	Confident	5 Å²	5	64.3 Å²	64.3	4%	0.035	32%	0.324	C	S	.	.			trans	-144	160.3	179.3	73.1	0	0	0	0	110.7	Q222 D316 K322 Q326 R327 L328	Q222-S324 PolarHBondContact OE1-OG 3.24Å; Q222-S324 VanDerWaalsContact OE1-OG 3.14Å; D316-S324 PolarHBondContact OD1-OG 3.38Å; K322-S324 PolarHBondContact O-N 3.13Å; S324-Q326 PolarHBondContact O-N 3.35Å; S324-R327 PolarHBondContact O-N 3.22Å; S324-R327 WeakPolarHBondContact OG-CB 3.36Å; S324-R327 PolarHBondContact OG-N 2.96Å; S324-L328 VanDerWaalsContact O-CB 3.31Å; S324-L328 WeakPolarHBondContact O-CB 3.49Å; S324-L328 PolarHBondContact O-N 2.81Å
325	I	92.5	Very high	88.5	Confident	44 Å²	44	67.1 Å²	67.1	23%	0.226	33%	0.333	C	S	.	.	H	α-helix	trans	-61.9	-37.7	175.1	-64.4	-180	0	0	0	110.1	T219 T260 L264 T329	T219-I325 HydrophobicContact CG2-CB 4.1Å; T219-I325 HydrophobicContact CG2-CD1 3.99Å; T219-I325 HydrophobicContact CG2-CG1 4.06Å; T219-I325 PolarHBondContact OG1-N 3.07Å; T219-I325 VanDerWaalsContact OG1-N 3.16Å; T260-I325 HydrophobicContact CG2-CG2 4.35Å; L264-I325 HydrophobicContact CD2-CD1 3.82Å; I325-T329 VanDerWaalsContact O-CB 3.26Å; I325-T329 WeakPolarHBondContact O-CB 3.09Å; I325-T329 PolarHBondContact O-N 3.18Å; I325-T329 PolarHBondContact O-OG1 3.29Å
326	Q	91.6	Very high	88.8	Confident	23 Å²	23	67.5 Å²	67.5	11%	0.107	34%	0.335	C	S	.	.	H	α-helix	trans	-60.8	-48.7	176.9	-62.6	79.1	-16.7	0	0	110.7	T219 Q222 T260 S324 T329 Q330	T219-Q326 PolarHBondContact O-NE2 3.01Å; T219-Q326 VanDerWaalsContact O-NE2 3.13Å; Q222-Q326 VanDerWaalsContact OE1-CB 3.22Å; T260-Q326 HydrophobicContact CG2-CG 3.99Å; S324-Q326 PolarHBondContact O-N 3.35Å; Q326-T329 PolarHBondContact O-N 2.95Å; Q326-Q330 WeakPolarHBondContact O-CB 3.37Å; Q326-Q330 PolarHBondContact O-N 3.06Å
327	R	90.9	Very high	88.9	Confident	57 Å²	57	67.8 Å²	67.8	22%	0.215	34%	0.335	C	S	.	.	H	α-helix	trans	-67.2	-44.7	-179.4	-174.9	63.8	-179	144.5	10.4	111.8	D321 S324 T329 Q330 N331	D321-R327 IonicContact OD1-NH2 2.83Å; S324-R327 PolarHBondContact O-N 3.22Å; S324-R327 WeakPolarHBondContact OG-CB 3.36Å; S324-R327 PolarHBondContact OG-N 2.96Å; R327-T329 VanDerWaalsContact C-N 3.34Å; R327-T329 PolarHBondContact O-N 3.41Å; R327-Q330 PolarHBondContact O-N 3.32Å; R327-N331 PolarHBondContact NH1-OD1 3.17Å; R327-N331 PolarHBondContact NH2-OD1 2.83Å; R327-N331 WeakPolarHBondContact O-CB 3.5Å; R327-N331 PolarHBondContact O-N 3.29Å; R327-N331 PolarHBondContact O-ND2 3.29Å
328	L	93.8	Very high	88.9	Confident	88 Å²	88	67.7 Å²	67.7	46%	0.461	34%	0.342	S	S	.	.	H	α-helix	trans	-57.7	-48.7	176.3	-176.1	81.4	0	0	0	110.7	D321 K322 S324 N331 F332	D321-L328 WeakPolarHBondContact O-CA 3.32Å; D321-L328 PolarHBondContact O-N 3.38Å; K322-L328 HydrophobicContact CG-CD1 4.03Å; S324-L328 VanDerWaalsContact O-CB 3.31Å; S324-L328 WeakPolarHBondContact O-CB 3.49Å; S324-L328 PolarHBondContact O-N 2.81Å; L328-N331 PolarHBondContact O-N 3.17Å; L328-F332 WeakPolarHBondContact O-CB 3.38Å; L328-F332 PolarHBondContact O-N 3.15Å
329	T	92.8	Very high	89	Confident	10 Å²	10	62.9 Å²	62.9	6%	0.061	33%	0.326	C	S	.	.	H	α-helix	trans	-63.9	-42.6	178.9	-53.8	0	0	0	0	111	V256 L259 T260 I325 Q326 R327 N331 F332 V333	V256-T329 HydrophobicContact CG1-CG2 4.14Å; L259-T329 HydrophobicContact CB-CG2 3.43Å; L259-T329 VanDerWaalsContact CB-CG2 3.43Å; L259-T329 HydrophobicContact CD1-CG2 4.21Å; L259-T329 HydrophobicContact CG-CG2 4.47Å; T260-T329 WeakPolarHBondContact OG1-CB 3.47Å; T260-T329 PolarHBondContact OG1-OG1 3.45Å; I325-T329 VanDerWaalsContact O-CB 3.26Å; I325-T329 WeakPolarHBondContact O-CB 3.09Å; I325-T329 PolarHBondContact O-N 3.18Å; I325-T329 PolarHBondContact O-OG1 3.29Å; Q326-T329 PolarHBondContact O-N 2.95Å; R327-T329 VanDerWaalsContact C-N 3.34Å; R327-T329 PolarHBondContact O-N 3.41Å; T329-N331 PolarHBondContact O-N 3.22Å; T329-F332 PolarHBondContact O-N 3.41Å; T329-V333 HydrophobicContact CG2-CG2 4.35Å; T329-V333 VanDerWaalsContact O-CG2 3.32Å; T329-V333 WeakPolarHBondContact O-CG2 3.31Å; T329-V333 PolarHBondContact O-N 3.13Å
330	Q	91.2	Very high	88.8	Confident	77 Å²	77	65.8 Å²	65.8	36%	0.36	34%	0.337	S	S	.	.	H	α-helix	trans	-59.7	-47.2	177.3	-176.1	-175.7	1.8	0	0	111.4	V256 Q326 R327 V333 T334	V256-Q330 HydrophobicContact CG1-CB 4.06Å; V256-Q330 HydrophobicContact CG2-CB 4.31Å; V256-Q330 HydrophobicContact CG2-CG 4.43Å; Q326-Q330 WeakPolarHBondContact O-CB 3.37Å; Q326-Q330 PolarHBondContact O-N 3.06Å; R327-Q330 PolarHBondContact O-N 3.32Å; Q330-V333 PolarHBondContact O-N 3.15Å; Q330-T334 WeakPolarHBondContact O-CB 3.48Å; Q330-T334 PolarHBondContact O-N 3.19Å; Q330-T334 PolarHBondContact O-OG1 2.78Å
331	N	91.8	Very high	88.2	Confident	21 Å²	21	66.1 Å²	66.1	11%	0.112	33%	0.331	C	S	.	.	H	α-helix	trans	-65.3	-41.9	178.7	-74.2	-24	0	0	0	111.5	D321 R327 L328 T329 T334 K335	D321-N331 VanDerWaalsContact CA-ND2 3.35Å; D321-N331 WeakPolarHBondContact CA-ND2 3.44Å; D321-N331 VanDerWaalsContact CB-ND2 3.27Å; D321-N331 WeakPolarHBondContact CB-ND2 3.4Å; D321-N331 PolarHBondContact OD1-ND2 2.9Å; R327-N331 PolarHBondContact NH1-OD1 3.17Å; R327-N331 PolarHBondContact NH2-OD1 2.83Å; R327-N331 WeakPolarHBondContact O-CB 3.5Å; R327-N331 PolarHBondContact O-N 3.29Å; R327-N331 PolarHBondContact O-ND2 3.29Å; L328-N331 PolarHBondContact O-N 3.17Å; T329-N331 PolarHBondContact O-N 3.22Å; N331-T334 PolarHBondContact O-N 3.43Å; N331-K335 WeakPolarHBondContact O-CB 3.47Å; N331-K335 VanDerWaalsContact O-CG 3.29Å; N331-K335 WeakPolarHBondContact O-CG 3.23Å; N331-K335 PolarHBondContact O-N 3.44Å
332	F	91.9	Very high	87.9	Confident	112 Å²	112	66 Å²	66	49%	0.491	34%	0.336	S	S	.	.	H	α-helix	trans	-57.7	-51.9	174.3	174.9	-108.6	0	0	0	112	L259 L328 T329 T334 K335 L336	L259-F332 HydrophobicContact CD1-CD1 4.13Å; L259-F332 HydrophobicContact CD1-CE1 4.11Å; L328-F332 WeakPolarHBondContact O-CB 3.38Å; L328-F332 PolarHBondContact O-N 3.15Å; T329-F332 PolarHBondContact O-N 3.41Å; F332-T334 VanDerWaalsContact C-N 3.31Å; F332-T334 PolarHBondContact O-N 3Å; F332-K335 PolarHBondContact O-N 3.38Å; F332-L336 HydrophobicContact CD1-CD1 3.87Å; F332-L336 HydrophobicContact CD2-CD1 4.4Å; F332-L336 HydrophobicContact CD2-CG 4.38Å; F332-L336 HydrophobicContact CE1-CD1 3.34Å; F332-L336 HydrophobicContact CE1-CG 4.29Å; F332-L336 HydrophobicContact CE2-CD1 3.93Å; F332-L336 HydrophobicContact CE2-CD2 4.37Å; F332-L336 HydrophobicContact CE2-CG 4.07Å; F332-L336 HydrophobicContact CG-CD1 4.38Å; F332-L336 HydrophobicContact CZ-CD1 3.38Å; F332-L336 HydrophobicContact CZ-CD2 4.42Å; F332-L336 HydrophobicContact CZ-CG 4.04Å; F332-L336 WeakPolarHBondContact O-CB 3.43Å; F332-L336 WeakPolarHBondContact O-CG 3.33Å; F332-L336 PolarHBondContact O-N 3.01Å
333	V	90.9	Very high	87.7	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-62.8	-38.2	179	173.5	0	0	0	0	111.8	T252 A255 V256 L259 T329 Q330 Q337 V344	T252-V333 HydrophobicContact CG2-CG1 4.39Å; A255-V333 HydrophobicContact CB-CG1 4.3Å; V256-V333 HydrophobicContact CG2-CB 3.83Å; V256-V333 HydrophobicContact CG2-CG1 4.02Å; V256-V333 HydrophobicContact CG2-CG2 3.94Å; L259-V333 HydrophobicContact CD1-CG2 3.66Å; T329-V333 HydrophobicContact CG2-CG2 4.35Å; T329-V333 VanDerWaalsContact O-CG2 3.32Å; T329-V333 WeakPolarHBondContact O-CG2 3.31Å; T329-V333 PolarHBondContact O-N 3.13Å; Q330-V333 PolarHBondContact O-N 3.15Å; V333-Q337 WeakPolarHBondContact O-CB 3.14Å; V333-Q337 PolarHBondContact O-N 3.33Å; V333-V344 HydrophobicContact CG1-CG1 4.3Å; V333-V344 HydrophobicContact CG1-CG2 3.86Å
334	T	87.9	Confident	87.6	Confident	69 Å²	69	58.3 Å²	58.3	42%	0.423	30%	0.302	S	S	.	.	H	α-helix	trans	-70.2	-41.4	-180	-52.2	0	0	0	0	111.5	Q330 N331 F332 Q337 A338	Q330-T334 WeakPolarHBondContact O-CB 3.48Å; Q330-T334 PolarHBondContact O-N 3.19Å; Q330-T334 PolarHBondContact O-OG1 2.78Å; N331-T334 PolarHBondContact O-N 3.43Å; F332-T334 VanDerWaalsContact C-N 3.31Å; F332-T334 PolarHBondContact O-N 3Å; T334-Q337 PolarHBondContact O-N 3.39Å; T334-A338 PolarHBondContact O-N 2.84Å
335	K	89.3	Confident	87.2	Confident	126 Å²	126	59.1 Å²	59.1	55%	0.548	31%	0.307	S	S	.	.	H	α-helix	trans	-63.7	-47.6	174.1	-72.8	177	-176.7	179.8	0	110.9	D321 N331 F332 Q337 A338 D339	D321-K335 IonicContact OD2-NZ 3.87Å; N331-K335 WeakPolarHBondContact O-CB 3.47Å; N331-K335 VanDerWaalsContact O-CG 3.29Å; N331-K335 WeakPolarHBondContact O-CG 3.23Å; N331-K335 PolarHBondContact O-N 3.44Å; F332-K335 PolarHBondContact O-N 3.38Å; K335-Q337 PolarHBondContact O-N 3.2Å; K335-Q337 VanDerWaalsContact O-N 3.17Å; K335-A338 WeakPolarHBondContact O-CB 3.43Å; K335-A338 PolarHBondContact O-N 3.37Å; K335-D339 PolarHBondContact O-N 3.4Å; K335-D339 VanDerWaalsContact O-N 3.15Å
336	L	87.8	Confident	86.9	Confident	37 Å²	37	60.8 Å²	60.8	19%	0.194	32%	0.32	C	S	.	.	H	α-helix	trans	-55.3	-36.2	173.8	-78.7	-178.9	0	0	0	113.1	F332 F340 T343 I347	F332-L336 HydrophobicContact CD1-CD1 3.87Å; F332-L336 HydrophobicContact CD2-CD1 4.4Å; F332-L336 HydrophobicContact CD2-CG 4.38Å; F332-L336 HydrophobicContact CE1-CD1 3.34Å; F332-L336 HydrophobicContact CE1-CG 4.29Å; F332-L336 HydrophobicContact CE2-CD1 3.93Å; F332-L336 HydrophobicContact CE2-CD2 4.37Å; F332-L336 HydrophobicContact CE2-CG 4.07Å; F332-L336 HydrophobicContact CG-CD1 4.38Å; F332-L336 HydrophobicContact CZ-CD1 3.38Å; F332-L336 HydrophobicContact CZ-CD2 4.42Å; F332-L336 HydrophobicContact CZ-CG 4.04Å; F332-L336 WeakPolarHBondContact O-CB 3.43Å; F332-L336 WeakPolarHBondContact O-CG 3.33Å; F332-L336 PolarHBondContact O-N 3.01Å; L336-F340 CarbonylContact O-C 3.56Å; L336-F340 WeakPolarHBondContact O-CA 3.42Å; L336-F340 WeakPolarHBondContact O-CB 3.23Å; L336-F340 PolarHBondContact O-N 2.93Å; L336-T343 HydrophobicContact CD1-CG2 4.31Å; L336-I347 HydrophobicContact CD1-CD1 4.45Å
337	Q	83.9	Confident	86.8	Confident	40 Å²	40	61.2 Å²	61.2	19%	0.187	32%	0.322	C	S	.	.	H	α-helix	trans	-70.5	-32.4	178	-167.7	174.7	-18.6	0	0	112.7	V333 T334 K335 F340 V344	V333-Q337 WeakPolarHBondContact O-CB 3.14Å; V333-Q337 PolarHBondContact O-N 3.33Å; T334-Q337 PolarHBondContact O-N 3.39Å; K335-Q337 PolarHBondContact O-N 3.2Å; K335-Q337 VanDerWaalsContact O-N 3.17Å; Q337-F340 CarbonylContact O-C 3.48Å; Q337-V344 HydrophobicContact CB-CG2 3.61Å; Q337-V344 HydrophobicContact CG-CG2 3.79Å
338	A	81.4	Confident	86.5	Confident	70 Å²	70	58.6 Å²	58.6	58%	0.579	31%	0.313	S	S	*	.	H	α-helix	trans	-68.5	-42.7	177.6	0	0	0	0	0	110.9	T334 K335	T334-A338 PolarHBondContact O-N 2.84Å; K335-A338 WeakPolarHBondContact O-CB 3.43Å; K335-A338 PolarHBondContact O-N 3.37Å
339	D	83.2	Confident	86.1	Confident	108 Å²	108	61.2 Å²	61.2	58%	0.578	32%	0.316	S	S	*	.	H	α-helix	trans	-79.1	-38.5	-179.7	-53.4	-32.8	0	0	0	111.1	K335	K335-D339 PolarHBondContact O-N 3.4Å; K335-D339 VanDerWaalsContact O-N 3.15Å
340	F	82.7	Confident	85.7	Confident	129 Å²	129	64.6 Å²	64.6	57%	0.566	34%	0.337	S	S	*	.			trans	-134.4	94.8	-175.7	-56.6	-80.6	0	0	0	112.5	L336 Q337 S342 T343	L336-F340 CarbonylContact O-C 3.56Å; L336-F340 WeakPolarHBondContact O-CA 3.42Å; L336-F340 WeakPolarHBondContact O-CB 3.23Å; L336-F340 PolarHBondContact O-N 2.93Å; Q337-F340 CarbonylContact O-C 3.48Å; F340-S342 PolarHBondContact O-N 3.39Å; F340-T343 WeakPolarHBondContact CB-OG1 3.36Å; F340-T343 PolarHBondContact O-N 3.46Å; F340-T343 VanDerWaalsContact O-N 3.14Å; F340-T343 PolarHBondContact O-OG1 2.86Å
341	H	74.4	Confident	85.3	Confident	93 Å²	93	61 Å²	61	43%	0.431	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.9	-27.3	-173.5	-63.6	83.8	0	0	0	116.1
342	S	79.1	Confident	84.8	Confident	67 Å²	67	64.9 Å²	64.9	47%	0.469	34%	0.338	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.3	-13.2	-176.4	-66.3	0	0	0	0	114.3	F340 V344 S345 T346	F340-S342 PolarHBondContact O-N 3.39Å; S342-V344 PolarHBondContact O-N 2.93Å; S342-S345 PolarHBondContact O-N 3.02Å; S342-S345 PolarHBondContact O-OG 3.17Å; S342-T346 PolarHBondContact O-N 3.36Å; S342-T346 PolarHBondContact O-OG1 2.95Å
343	T	84.1	Confident	84.5	Confident	41 Å²	41	67.5 Å²	67.5	25%	0.252	35%	0.35	S	S	.	.	H	α-helix	trans	-63.8	-40.8	-168.9	-59.9	0	0	0	0	113.1	L336 F340 S345 T346 I347	L336-T343 HydrophobicContact CD1-CG2 4.31Å; F340-T343 WeakPolarHBondContact CB-OG1 3.36Å; F340-T343 PolarHBondContact O-N 3.46Å; F340-T343 VanDerWaalsContact O-N 3.14Å; F340-T343 PolarHBondContact O-OG1 2.86Å; T343-S345 VanDerWaalsContact C-N 3.29Å; T343-S345 PolarHBondContact O-N 3.3Å; T343-T346 WeakPolarHBondContact O-CB 3.42Å; T343-T346 PolarHBondContact O-N 3.03Å; T343-T346 VanDerWaalsContact O-N 3.13Å; T343-I347 HydrophobicContact CG2-CD1 3.88Å; T343-I347 HydrophobicContact CG2-CG1 4.36Å; T343-I347 WeakPolarHBondContact O-CG1 3.25Å; T343-I347 PolarHBondContact O-N 2.9Å
344	V	85.9	Confident	84	Confident	7 Å²	7	71.2 Å²	71.2	4%	0.042	37%	0.369	C	S	.	.	H	α-helix	trans	-60.2	-41.1	178.8	-178.7	0	0	0	0	111.6	A255 V333 Q337 S342 Y348	A255-V344 HydrophobicContact CB-CG1 3.81Å; V333-V344 HydrophobicContact CG1-CG1 4.3Å; V333-V344 HydrophobicContact CG1-CG2 3.86Å; Q337-V344 HydrophobicContact CB-CG2 3.61Å; Q337-V344 HydrophobicContact CG-CG2 3.79Å; S342-V344 PolarHBondContact O-N 2.93Å; V344-Y348 WeakPolarHBondContact O-CB 3.42Å; V344-Y348 PolarHBondContact O-N 3.1Å
345	S	83.2	Confident	83	Confident	22 Å²	22	75.8 Å²	75.8	15%	0.154	39%	0.386	C	S	.	.	H	α-helix	trans	-70.5	-33.2	178.3	67.1	0	0	0	0	112.3	S342 T343 R349	S342-S345 PolarHBondContact O-N 3.02Å; S342-S345 PolarHBondContact O-OG 3.17Å; T343-S345 VanDerWaalsContact C-N 3.29Å; T343-S345 PolarHBondContact O-N 3.3Å; S345-R349 VanDerWaalsContact O-CB 3.3Å; S345-R349 WeakPolarHBondContact O-CB 3.44Å; S345-R349 VanDerWaalsContact O-CG 3.23Å; S345-R349 WeakPolarHBondContact O-CG 3.37Å; S345-R349 PolarHBondContact O-N 3.18Å
346	T	87.8	Confident	81.6	Confident	80 Å²	80	72 Å²	72	49%	0.491	37%	0.373	S	S	.	.	H	α-helix	trans	-67	-48.1	174	-53.8	0	0	0	0	111	S342 T343 Y348 R349 T350	S342-T346 PolarHBondContact O-N 3.36Å; S342-T346 PolarHBondContact O-OG1 2.95Å; T343-T346 WeakPolarHBondContact O-CB 3.42Å; T343-T346 PolarHBondContact O-N 3.03Å; T343-T346 VanDerWaalsContact O-N 3.13Å; T346-Y348 VanDerWaalsContact C-N 3.32Å; T346-Y348 PolarHBondContact O-N 3.29Å; T346-R349 PolarHBondContact O-N 3.08Å; T346-T350 WeakPolarHBondContact O-CB 3.48Å; T346-T350 PolarHBondContact O-N 3.32Å; T346-T350 PolarHBondContact O-OG1 3.45Å
347	I	88.9	Confident	79.7	Confident	31 Å²	31	74.6 Å²	74.6	16%	0.159	40%	0.4	C	S	.	.	H	α-helix	trans	-54.3	-51.2	176.6	-69.5	164.7	0	0	0	110.1	A255 L258 L259 L336 T343 T350 G351	A255-I347 HydrophobicContact CB-CG2 4.03Å; L258-I347 HydrophobicContact CD2-CG2 3.79Å; L258-I347 WeakPolarHBondContact CD2-O 3.46Å; L259-I347 HydrophobicContact CD1-CD1 4.43Å; L259-I347 HydrophobicContact CG-CG2 4.31Å; L336-I347 HydrophobicContact CD1-CD1 4.45Å; T343-I347 HydrophobicContact CG2-CD1 3.88Å; T343-I347 HydrophobicContact CG2-CG1 4.36Å; T343-I347 WeakPolarHBondContact O-CG1 3.25Å; T343-I347 PolarHBondContact O-N 2.9Å; I347-T350 PolarHBondContact O-N 3.41Å; I347-G351 PolarHBondContact O-N 2.9Å
348	Y	83.9	Confident	77.9	Confident	3 Å²	3	75 Å²	75	1%	0.012	41%	0.414	C	S	.	.	H	α-helix	trans	-61.8	-46.7	179.2	165.5	-99.4	0	0	0	112.3	L254 R291 V344 T346 T350 G351 E352	L254-Y348 HydrophobicContact CB-CD2 3.95Å; L254-Y348 HydrophobicContact CB-CE2 4.47Å; L254-Y348 HydrophobicContact CD1-CD2 4.3Å; L254-Y348 HydrophobicContact CD1-CE2 4.09Å; R291-Y348 WeakPolarHBondContact CD-OH 3.38Å; R291-Y348 HydrophobicContact CG-CE1 4.04Å; R291-Y348 HydrophobicContact CG-CE2 3.81Å; R291-Y348 PolarHBondContact NH1-OH 3.5Å; V344-Y348 WeakPolarHBondContact O-CB 3.42Å; V344-Y348 PolarHBondContact O-N 3.1Å; T346-Y348 VanDerWaalsContact C-N 3.32Å; T346-Y348 PolarHBondContact O-N 3.29Å; Y348-T350 VanDerWaalsContact C-N 3.31Å; Y348-T350 PolarHBondContact O-N 3.46Å; Y348-G351 WeakPolarHBondContact O-CA 3.29Å; Y348-G351 PolarHBondContact O-N 2.92Å; Y348-E352 PolarHBondContact O-N 2.77Å; Y348-E352 VanDerWaalsContact OH-CD 3.27Å; Y348-E352 PolarHBondContact OH-OE2 3.01Å
349	R	85.1	Confident	75.8	Confident	143 Å²	143	82.6 Å²	82.6	54%	0.54	43%	0.428	S	S	.	.	H	α-helix	trans	-64.4	-33.2	178.4	-77.3	178.2	178.7	-179.5	0.3	113.1	S345 T346 G351 E352 K353	S345-R349 VanDerWaalsContact O-CB 3.3Å; S345-R349 WeakPolarHBondContact O-CB 3.44Å; S345-R349 VanDerWaalsContact O-CG 3.23Å; S345-R349 WeakPolarHBondContact O-CG 3.37Å; S345-R349 PolarHBondContact O-N 3.18Å; T346-R349 PolarHBondContact O-N 3.08Å; R349-G351 VanDerWaalsContact C-N 3.33Å; R349-E352 PolarHBondContact O-N 2.91Å; R349-K353 PolarHBondContact O-N 3.1Å
350	T	86.2	Confident	73.3	Confident	80 Å²	80	81 Å²	81	49%	0.491	44%	0.437	S	S	.	.	H	α-helix	trans	-64.4	-42.3	171.9	-60.5	0	0	0	0	110.4	T346 I347 Y348 E352 K353	T346-T350 WeakPolarHBondContact O-CB 3.48Å; T346-T350 PolarHBondContact O-N 3.32Å; T346-T350 PolarHBondContact O-OG1 3.45Å; I347-T350 PolarHBondContact O-N 3.41Å; Y348-T350 VanDerWaalsContact C-N 3.31Å; Y348-T350 PolarHBondContact O-N 3.46Å; T350-E352 VanDerWaalsContact C-N 3.3Å; T350-E352 PolarHBondContact O-N 3.42Å; T350-K353 PolarHBondContact O-N 3.24Å
351	G	82.6	Confident	70.7	Confident	2 Å²	2	78.3 Å²	78.3	2%	0.021	43%	0.434	C	S	.	.	H	α-helix	trans	-59.9	-36.7	172.8	0	0	0	0	0	113.7	I347 Y348 R349 K353 L354	I347-G351 PolarHBondContact O-N 2.9Å; Y348-G351 WeakPolarHBondContact O-CA 3.29Å; Y348-G351 PolarHBondContact O-N 2.92Å; R349-G351 VanDerWaalsContact C-N 3.33Å; G351-K353 VanDerWaalsContact C-N 3.3Å; G351-K353 PolarHBondContact O-N 3.11Å; G351-L354 VanDerWaalsContact O-CB 3.25Å; G351-L354 WeakPolarHBondContact O-CB 3.43Å; G351-L354 WeakPolarHBondContact O-CG 3.46Å; G351-L354 PolarHBondContact O-N 3.19Å; G351-L354 VanDerWaalsContact O-N 3.16Å
352	E	81.4	Confident	68.6	Low	103 Å²	103	80.3 Å²	80.3	48%	0.481	46%	0.459	S	S	.	.	H	α-helix	trans	-67.6	-28.6	177.9	-173.7	174.4	-178.1	0	0	113.5	Y348 R349 T350 L354	Y348-E352 PolarHBondContact O-N 2.77Å; Y348-E352 VanDerWaalsContact OH-CD 3.27Å; Y348-E352 PolarHBondContact OH-OE2 3.01Å; R349-E352 PolarHBondContact O-N 2.91Å; T350-E352 VanDerWaalsContact C-N 3.3Å; T350-E352 PolarHBondContact O-N 3.42Å; E352-L354 PolarHBondContact O-N 2.85Å
353	K	84.4	Confident	66.1	Low	167 Å²	167	79.7 Å²	79.7	73%	0.726	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71.8	-15.6	175.1	-67.8	176.7	-178.8	-177.5	0	112.8	R349 T350 G351 Q355	R349-K353 PolarHBondContact O-N 3.1Å; T350-K353 PolarHBondContact O-N 3.24Å; G351-K353 VanDerWaalsContact C-N 3.3Å; G351-K353 PolarHBondContact O-N 3.11Å; K353-Q355 PolarHBondContact O-N 3.13Å
354	L	80.9	Confident	63.6	Low	77 Å²	77	83 Å²	83	40%	0.403	49%	0.49	S	S	.	.			trans	-69.7	115.2	176.5	-56.5	176.4	0	0	0	108.6	L270 A271 G351 E352	L270-L354 HydrophobicContact CB-CD1 4.42Å; L270-L354 HydrophobicContact CD2-CD1 3.45Å; L270-L354 VanDerWaalsContact CD2-CD1 3.45Å; L270-L354 HydrophobicContact CG-CD1 3.93Å; A271-L354 HydrophobicContact CB-CB 4.35Å; A271-L354 WeakPolarHBondContact CB-O 3.11Å; G351-L354 VanDerWaalsContact O-CB 3.25Å; G351-L354 WeakPolarHBondContact O-CB 3.43Å; G351-L354 WeakPolarHBondContact O-CG 3.46Å; G351-L354 PolarHBondContact O-N 3.19Å; G351-L354 VanDerWaalsContact O-N 3.16Å; E352-L354 PolarHBondContact O-N 2.85Å
355	Q	66.1	Low	61.2	Low	166 Å²	166	90 Å²	90	78%	0.776	52%	0.522	S	S	*	.			trans	-98.3	144.4	173.9	-61.1	-177.4	19.7	0	0	108.5	K353 A357	K353-Q355 PolarHBondContact O-N 3.13Å; Q355-A357 PolarHBondContact O-N 2.66Å
356	T	61.4	Low	59.2	Low	47 Å²	47	94.1 Å²	94.1	29%	0.288	54%	0.542	S	S	.	.			trans	-72.6	123.9	164.3	43.9	0	0	0	0	107.3	A271 Q272 G358	A271-T356 HydrophobicContact CB-CG2 3.76Å; Q272-T356 HydrophobicContact CG-CG2 4.09Å; T356-G358 PolarHBondContact O-N 3.46Å
357	A	48	Very low	57.2	Low	91 Å²	91	92.6 Å²	92.6	75%	0.752	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63	90	166.3	0	0	0	0	0	107.5	Q355	Q355-A357 PolarHBondContact O-N 2.66Å
358	G	45.6	Very low	55.6	Low	48 Å²	48	94.2 Å²	94.2	50%	0.495	54%	0.544	S	S	.	.	T	Hydrogen-bonded Turn	trans	162.8	12.7	-172.1	0	0	0	0	0	117.2	T356 G360	T356-G358 PolarHBondContact O-N 3.46Å; G358-G360 PolarHBondContact O-N 2.93Å
359	R	36.6	Very low	54.4	Low	229 Å²	229	94.3 Å²	94.3	86%	0.864	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.8	9	172.8	-101.4	-175.9	171	-167.1	-3.1	114.5
360	G	30.3	Very low	53.3	Low	75 Å²	75	88 Å²	88	77%	0.773	52%	0.523	S	S	*	.	T	Hydrogen-bonded Turn	trans	-123.2	6.1	-165.5	0	0	0	0	0	117.8	G358	G358-G360 PolarHBondContact O-N 2.93Å
361	S	28.2	Very low	52.1	Low	72 Å²	72	84.2 Å²	84.2	50%	0.503	50%	0.499	S	S	.	.			trans	-135.4	102.3	175.3	31.2	0	0	0	0	111.6	A363	S361-A363 PolarHBondContact O-N 3.28Å
362	S	30	Very low	51.4	Low	136 Å²	136	84.1 Å²	84.1	95%	0.951	50%	0.499	S	S	*	.			trans	-65.7	57.9	155.1	53.3	0	0	0	0	110.2
363	A	27.8	Very low	50.5	Low	53 Å²	53	79.6 Å²	79.6	44%	0.438	48%	0.478	S	S	.	.			trans	-111.2	106.6	165.8	0	0	0	0	0	105.7	S361 E365	S361-A363 PolarHBondContact O-N 3.28Å; A363-E365 HydrophobicContact CB-CG 4.31Å; A363-E365 PolarHBondContact O-N 2.77Å
364	A	32	Very low	49.2	Very low	112 Å²	112	71.9 Å²	71.9	93%	0.926	45%	0.445	S	S	*	.			trans	-69.5	54.6	165.9	0	0	0	0	0	109.5
365	E	34.7	Very low	48.4	Very low	154 Å²	154	69.5 Å²	69.5	72%	0.72	43%	0.431	S	S	*	.			trans	-81	133.8	164.4	-73.6	-179.1	-171.3	0	0	107.2	A363 A367	A363-E365 HydrophobicContact CB-CG 4.31Å; A363-E365 PolarHBondContact O-N 2.77Å; E365-A367 VanDerWaalsContact C-N 3.26Å; E365-A367 PolarHBondContact O-N 3.1Å
366	D	40.1	Very low	47.8	Very low	108 Å²	108	64.6 Å²	64.6	58%	0.578	42%	0.415	S	S	*	.			trans	-45.3	82.6	-178.5	-69.7	-72.9	0	0	0	112.7	E368 R483	D366-E368 PolarHBondContact O-N 3.13Å; D366-R483 IonicContact OD1-CZ 3.13Å; D366-R483 IonicContact OD1-NH1 3.98Å; D366-R483 IonicContact OD1-NH2 3.54Å; D366-R483 PolarHBondContact OD1-NH2 2.85Å; D366-R483 IonicContact OD2-NH2 3.06Å; D366-R483 PolarHBondContact OD2-NH2 3.25Å
367	A	46.8	Very low	47.2	Very low	47 Å²	47	64.1 Å²	64.1	39%	0.388	41%	0.412	S	S	.	.			trans	-71.5	88.4	171.5	0	0	0	0	0	106.6	E365 A369	E365-A367 VanDerWaalsContact C-N 3.26Å; E365-A367 PolarHBondContact O-N 3.1Å; A367-A369 PolarHBondContact O-N 3.3Å
368	E	54.6	Low	46.9	Very low	65 Å²	65	66.6 Å²	66.6	30%	0.304	41%	0.406	S	S	.	.			trans	-56.6	105.3	178.2	-69.7	-170	166	0	0	108.4	D366 V377	D366-E368 PolarHBondContact O-N 3.13Å; E368-V377 WeakPolarHBondContact O-CG2 3.22Å; E368-V377 PolarHBondContact O-N 3.38Å
369	A	58.7	Low	47	Very low	6 Å²	6	70 Å²	70	5%	0.05	41%	0.407	C	S	.	.	B	Isolated β-bridge	trans	-65.6	150	176.8	0	0	0	0	0	109	A367 R375 R480	A367-A369 PolarHBondContact O-N 3.3Å; A369-R375 CarbonylContact C-O 3.45Å; A369-R375 VanDerWaalsContact C-O 3.29Å; A369-R375 WeakPolarHBondContact CA-O 3.26Å; A369-R480 PolarHBondContact O-NE 3.34Å; A369-R480 PolarHBondContact O-NH1 2.99Å; A369-R480 PolarHBondContact O-NH2 3.28Å
370	L	63	Low	47.4	Very low	10 Å²	10	64.3 Å²	64.3	5%	0.052	40%	0.403	C	S	.	.			trans	-71.7	147	175.8	-68	170.3	0	0	0	111.6	L372 C374 R375 V377 L451 C453 R480	L370-L372 PolarHBondContact O-N 3.39Å; L370-C374 PolarHBondContact O-N 3.25Å; L370-R375 HydrophobicContact CB-CB 4.3Å; L370-R375 HydrophobicContact CD1-CB 3.87Å; L370-R375 HydrophobicContact CG-CB 4.22Å; L370-R375 PolarHBondContact N-O 3.47Å; L370-V377 HydrophobicContact CD1-CG2 4.06Å; L370-V377 HydrophobicContact CD2-CG2 3.22Å; L370-V377 HydrophobicContact CG-CG2 3.36Å; L370-L451 WeakPolarHBondContact CD2-O 3.27Å; L370-C453 HydrophobicContact CD1-CB 3.36Å; L370-C453 VanDerWaalsContact CD1-N 3.29Å; L370-R480 VanDerWaalsContact C-NH1 3.27Å; L370-R480 PolarHBondContact O-NH1 3.06Å
371	A	60.1	Low	48.4	Very low	0 Å²	0	67.3 Å²	67.3	0%	0	40%	0.396	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.5	-37.2	-172	0	0	0	0	0	113.9	L157 L448 L451 A477 R480	L157-A371 WeakPolarHBondContact CD1-O 3.44Å; L157-A371 WeakPolarHBondContact CD2-O 3.25Å; A371-L448 HydrophobicContact CB-CD1 4.3Å; A371-L451 HydrophobicContact CB-CB 4.34Å; A371-L451 PolarHBondContact N-O 2.81Å; A371-L451 VanDerWaalsContact N-O 3.14Å; A371-A477 HydrophobicContact CB-CB 3.96Å; A371-R480 VanDerWaalsContact CA-NH1 3.33Å
372	L	68.6	Low	49.6	Very low	1 Å²	1	72.7 Å²	72.7	1%	0.005	41%	0.414	C	S	.	.	T	Hydrogen-bonded Turn	trans	-94.4	-22.7	-176.9	-167.4	67.9	0	0	0	113.6	L224 T227 F228 H231 L370 L452 C456 V460 L469 V473	L224-L372 HydrophobicContact CD2-CD2 4.38Å; T227-L372 WeakPolarHBondContact CG2-O 3.44Å; F228-L372 HydrophobicContact CE1-CD1 4.28Å; H231-L372 PolarHBondContact CE1-O 3.49Å; H231-L372 PolarHBondContact NE2-O 2.93Å; L370-L372 PolarHBondContact O-N 3.39Å; L372-L452 HydrophobicContact CB-CD2 3.49Å; L372-L452 VanDerWaalsContact CB-CD2 3.49Å; L372-C456 HydrophobicContact CB-CB 4.39Å; L372-C456 HydrophobicContact CD2-CB 3.97Å; L372-V460 HydrophobicContact CD2-CG2 4.29Å; L372-L469 HydrophobicContact CD1-CD2 4.13Å; L372-V473 HydrophobicContact CD1-CG1 3.87Å; L372-V473 HydrophobicContact CD1-CG2 4.21Å
373	C	62.8	Low	51	Low	7 Å²	7	70.6 Å²	70.6	5%	0.047	41%	0.405	C	S	.	.	T	Hydrogen-bonded Turn	trans	-129.1	4.8	-159.9	-56.6	0	0	0	0	113.4	R375 C456	C373-R375 VanDerWaalsContact C-N 3.3Å; C373-R375 HydrophobicContact CB-CG 4.19Å; C373-R375 VanDerWaalsContact CB-CZ 3.47Å; C373-R375 WeakPolarHBondContact O-CG 3.35Å; C373-R375 PolarHBondContact O-N 3.28Å; C373-C456 WeakPolarHBondContact CB-SG 3.37Å; C373-C456 WeakPolarHBondContact SG-CB 3.34Å; C373-C456 CovalentContact SG-SG 2.09Å; C373-C456 PolarHBondContact SG-SG 3.22Å
374	C	56.7	Low	53.1	Low	6 Å²	6	69.9 Å²	69.9	4%	0.041	40%	0.396	C	S	.	.			trans	52.1	39.3	179.5	-50.1	0	0	0	0	114.4	L157 Y281 L370	L157-C374 WeakPolarHBondContact CD2-SG 3.26Å; Y281-C374 HydrophobicContact CD1-CB 4.17Å; Y281-C374 HydrophobicContact CE1-CB 3.89Å; L370-C374 PolarHBondContact O-N 3.25Å
375	R	63.7	Low	55	Low	27 Å²	27	67.1 Å²	67.1	10%	0.102	37%	0.374	C	S	.	.			trans	-108.6	128.1	-170.5	-72.9	163.9	-158.1	-171	2.8	111.5	R266 Q269 A369 L370 C373 V377 C453 S455	R266-R375 VanDerWaalsContact NH1-NH2 3.11Å; Q269-R375 VanDerWaalsContact CD-CZ 3.43Å; A369-R375 CarbonylContact C-O 3.45Å; A369-R375 VanDerWaalsContact C-O 3.29Å; A369-R375 WeakPolarHBondContact CA-O 3.26Å; L370-R375 HydrophobicContact CB-CB 4.3Å; L370-R375 HydrophobicContact CD1-CB 3.87Å; L370-R375 HydrophobicContact CG-CB 4.22Å; L370-R375 PolarHBondContact N-O 3.47Å; C373-R375 VanDerWaalsContact C-N 3.3Å; C373-R375 HydrophobicContact CB-CG 4.19Å; C373-R375 VanDerWaalsContact CB-CZ 3.47Å; C373-R375 WeakPolarHBondContact O-CG 3.35Å; C373-R375 PolarHBondContact O-N 3.28Å; R375-V377 PolarHBondContact O-N 3.26Å; R375-C453 PolarHBondContact NH1-SG 2.64Å; R375-S455 PolarHBondContact NH1-OG 3.49Å; R375-S455 VanDerWaalsContact NH1-OG 3.13Å
376	S	53.3	Low	56.9	Low	62 Å²	62	60.7 Å²	60.7	43%	0.434	34%	0.344	S	S	.	.	B	Isolated β-bridge	trans	-60.3	125.2	170	59.6	0	0	0	0	110.4	K378	S376-K378 PolarHBondContact O-N 2.89Å
377	V	48.5	Very low	58.5	Low	38 Å²	38	59 Å²	59	23%	0.23	33%	0.333	C	S	.	.			trans	-89.8	100.2	172.4	-178.8	0	0	0	0	108.2	E368 L370 R375 F379	E368-V377 WeakPolarHBondContact O-CG2 3.22Å; E368-V377 PolarHBondContact O-N 3.38Å; L370-V377 HydrophobicContact CD1-CG2 4.06Å; L370-V377 HydrophobicContact CD2-CG2 3.22Å; L370-V377 HydrophobicContact CG-CG2 3.36Å; R375-V377 PolarHBondContact O-N 3.26Å; V377-F379 HydrophobicContact CB-CD2 4.4Å; V377-F379 HydrophobicContact CB-CE2 4.32Å; V377-F379 HydrophobicContact CG1-CB 4.2Å; V377-F379 HydrophobicContact CG1-CD1 3.9Å; V377-F379 HydrophobicContact CG1-CD2 2.91Å; V377-F379 HydrophobicContact CG1-CE1 3.96Å; V377-F379 HydrophobicContact CG1-CE2 3Å; V377-F379 HydrophobicContact CG1-CG 3.37Å; V377-F379 HydrophobicContact CG1-CZ 3.53Å; V377-F379 HydrophobicContact CG2-CE2 4.46Å
378	K	43.5	Very low	60	Low	143 Å²	143	59.4 Å²	59.4	62%	0.622	34%	0.335	S	S	*	.			trans	-101	93.4	154.7	-68.6	-164.7	176.9	-169.9	0	106.3	S376 S380	S376-K378 PolarHBondContact O-N 2.89Å; K378-S380 PolarHBondContact O-N 3.46Å
379	F	46.6	Very low	61.2	Low	119 Å²	119	59.1 Å²	59.1	52%	0.522	34%	0.339	S	S	.	.			trans	-77.4	21.7	174.6	-78.5	-49.9	0	0	0	112.6	V377 E381 L386	V377-F379 HydrophobicContact CB-CD2 4.4Å; V377-F379 HydrophobicContact CB-CE2 4.32Å; V377-F379 HydrophobicContact CG1-CB 4.2Å; V377-F379 HydrophobicContact CG1-CD1 3.9Å; V377-F379 HydrophobicContact CG1-CD2 2.91Å; V377-F379 HydrophobicContact CG1-CE1 3.96Å; V377-F379 HydrophobicContact CG1-CE2 3Å; V377-F379 HydrophobicContact CG1-CG 3.37Å; V377-F379 HydrophobicContact CG1-CZ 3.53Å; V377-F379 HydrophobicContact CG2-CE2 4.46Å; F379-E381 VanDerWaalsContact C-N 3.31Å; F379-E381 PolarHBondContact O-N 3.26Å; F379-L386 HydrophobicContact CE1-CD2 3.62Å; F379-L386 HydrophobicContact CZ-CD2 3.79Å
380	S	44.4	Very low	62.2	Low	110 Å²	110	62 Å²	62	77%	0.769	35%	0.353	S	S	*	.			trans	-83.1	2.3	-169.3	-168.8	0	0	0	0	114.9	K378	K378-S380 PolarHBondContact O-N 3.46Å
381	E	52	Low	63.2	Low	137 Å²	137	65.2 Å²	65.2	64%	0.64	37%	0.369	S	S	*	.			trans	-99.9	120.6	176.2	-71	-175.4	174.5	0	0	110	F379 A383	F379-E381 VanDerWaalsContact C-N 3.31Å; F379-E381 PolarHBondContact O-N 3.26Å; E381-A383 PolarHBondContact O-N 3.46Å
382	E	54	Low	64.3	Low	186 Å²	186	68.5 Å²	68.5	87%	0.869	39%	0.392	S	S	*	.	S	Bend	trans	-54.2	-5	180	-64.1	176	154.1	0	0	114.9	Q387	E382-Q387 PolarHBondContact O-NE2 2.94Å; E382-Q387 PolarHBondContact O-OE1 3.06Å
383	A	59.7	Low	65	Low	92 Å²	92	73 Å²	73	76%	0.76	41%	0.413	S	S	*	.			trans	-132.8	69.5	-176.1	0	0	0	0	0	112	E381	E381-A383 PolarHBondContact O-N 3.46Å
384	S	72.1	Confident	66	Low	38 Å²	38	78.7 Å²	78.7	27%	0.266	44%	0.439	S	S	.	.			trans	-100.1	145.7	171	77.2	0	0	0	0	112.7	L386 Q387 A388	S384-L386 PolarHBondContact O-N 3.36Å; S384-L386 VanDerWaalsContact O-N 3.13Å; S384-Q387 PolarHBondContact O-N 3.48Å; S384-Q387 VanDerWaalsContact OG-CB 3.27Å; S384-Q387 WeakPolarHBondContact OG-CB 3.27Å; S384-Q387 PolarHBondContact OG-N 3.46Å; S384-A388 PolarHBondContact O-N 2.92Å
385	A	71.9	Confident	67.4	Low	54 Å²	54	83.5 Å²	83.5	45%	0.446	46%	0.464	S	S	.	.	H	α-helix	trans	-57.2	-28.9	173.7	0	0	0	0	0	112.4	T389	A385-T389 PolarHBondContact O-N 2.93Å; A385-T389 PolarHBondContact O-OG1 3.35Å
386	L	73.6	Confident	68.4	Low	18 Å²	18	86.2 Å²	86.2	9%	0.094	49%	0.487	C	S	.	.	H	α-helix	trans	-67.4	-50.5	174.3	-175.2	67.5	0	0	0	111	F379 S384 A388 T389 L390 Y454	F379-L386 HydrophobicContact CE1-CD2 3.62Å; F379-L386 HydrophobicContact CZ-CD2 3.79Å; S384-L386 PolarHBondContact O-N 3.36Å; S384-L386 VanDerWaalsContact O-N 3.13Å; L386-A388 PolarHBondContact O-N 2.92Å; L386-T389 WeakPolarHBondContact O-CB 3.35Å; L386-T389 PolarHBondContact O-N 2.92Å; L386-T389 VanDerWaalsContact O-N 3.14Å; L386-L390 HydrophobicContact CG-CD1 4.15Å; L386-L390 WeakPolarHBondContact O-CG 3.29Å; L386-L390 PolarHBondContact O-N 2.9Å; L386-Y454 HydrophobicContact CD1-CD2 4.46Å
387	Q	74.4	Confident	69.5	Low	74 Å²	74	89.3 Å²	89.3	35%	0.346	49%	0.494	S	S	.	.	H	α-helix	trans	-61.3	-42.8	178.6	-175.5	178.6	-7.9	0	0	111.7	E382 S384 T389 L390 I391	E382-Q387 PolarHBondContact O-NE2 2.94Å; E382-Q387 PolarHBondContact O-OE1 3.06Å; S384-Q387 PolarHBondContact O-N 3.48Å; S384-Q387 VanDerWaalsContact OG-CB 3.27Å; S384-Q387 WeakPolarHBondContact OG-CB 3.27Å; S384-Q387 PolarHBondContact OG-N 3.46Å; Q387-T389 VanDerWaalsContact C-N 3.26Å; Q387-T389 PolarHBondContact O-N 3.06Å; Q387-L390 PolarHBondContact O-N 3.35Å; Q387-I391 HydrophobicContact CG-CD1 3.87Å; Q387-I391 HydrophobicContact CG-CG1 4.44Å; Q387-I391 WeakPolarHBondContact O-CB 3.39Å; Q387-I391 VanDerWaalsContact O-CG1 3.28Å; Q387-I391 WeakPolarHBondContact O-CG1 3.37Å; Q387-I391 PolarHBondContact O-N 3.46Å
388	A	78.6	Confident	70.3	Confident	54 Å²	54	91.2 Å²	91.2	45%	0.446	51%	0.509	S	S	.	.	H	α-helix	trans	-58.6	-39.3	174.6	0	0	0	0	0	112.3	S384 L386 S392	S384-A388 PolarHBondContact O-N 2.92Å; L386-A388 PolarHBondContact O-N 2.92Å; A388-S392 WeakPolarHBondContact O-CB 3.4Å; A388-S392 PolarHBondContact O-N 3.05Å; A388-S392 PolarHBondContact O-OG 3.13Å
389	T	79.4	Confident	70.9	Confident	60 Å²	60	89.2 Å²	89.2	37%	0.368	51%	0.514	S	S	.	.	H	α-helix	trans	-69.3	-43.5	176.9	-52.9	0	0	0	0	111.5	A385 L386 Q387 S392 E393 Y454	A385-T389 PolarHBondContact O-N 2.93Å; A385-T389 PolarHBondContact O-OG1 3.35Å; L386-T389 WeakPolarHBondContact O-CB 3.35Å; L386-T389 PolarHBondContact O-N 2.92Å; L386-T389 VanDerWaalsContact O-N 3.14Å; Q387-T389 VanDerWaalsContact C-N 3.26Å; Q387-T389 PolarHBondContact O-N 3.06Å; T389-S392 PolarHBondContact O-N 2.91Å; T389-E393 WeakPolarHBondContact O-CB 3.35Å; T389-E393 PolarHBondContact O-N 2.95Å; T389-Y454 HydrophobicContact CG2-CE2 4.44Å; T389-Y454 WeakPolarHBondContact OG1-CE2 3.48Å
390	L	79.9	Confident	70.9	Confident	66 Å²	66	89.2 Å²	89.2	35%	0.346	52%	0.523	S	S	.	.	H	α-helix	trans	-63.6	-43.1	178.2	-69.7	172.9	0	0	0	111.7	L386 Q387 E393 Q394	L386-L390 HydrophobicContact CG-CD1 4.15Å; L386-L390 WeakPolarHBondContact O-CG 3.29Å; L386-L390 PolarHBondContact O-N 2.9Å; Q387-L390 PolarHBondContact O-N 3.35Å; L390-E393 PolarHBondContact O-N 2.89Å; L390-Q394 WeakPolarHBondContact O-CB 3.49Å; L390-Q394 VanDerWaalsContact O-CG 3.31Å; L390-Q394 WeakPolarHBondContact O-CG 3.28Å; L390-Q394 PolarHBondContact O-N 3.27Å
391	I	82.9	Confident	70.7	Confident	77 Å²	77	92.7 Å²	92.7	40%	0.395	52%	0.524	S	S	.	.	H	α-helix	trans	-61.8	-46.4	174.9	-68	167.4	0	0	0	110.3	Q387 E393 Q394 L395	Q387-I391 HydrophobicContact CG-CD1 3.87Å; Q387-I391 HydrophobicContact CG-CG1 4.44Å; Q387-I391 WeakPolarHBondContact O-CB 3.39Å; Q387-I391 VanDerWaalsContact O-CG1 3.28Å; Q387-I391 WeakPolarHBondContact O-CG1 3.37Å; Q387-I391 PolarHBondContact O-N 3.46Å; I391-E393 VanDerWaalsContact C-N 3.28Å; I391-E393 PolarHBondContact O-N 3.07Å; I391-Q394 PolarHBondContact O-N 3.48Å; I391-L395 HydrophobicContact CG2-CD1 3.83Å; I391-L395 HydrophobicContact CG2-CG 4.29Å; I391-L395 WeakPolarHBondContact O-CB 3.42Å; I391-L395 VanDerWaalsContact O-CG 3.29Å; I391-L395 WeakPolarHBondContact O-CG 3.28Å; I391-L395 PolarHBondContact O-N 3.24Å
392	S	83.9	Confident	70.1	Confident	69 Å²	69	92 Å²	92	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-60.5	-38.9	177.9	-59.1	0	0	0	0	112.1	A388 T389 S396	A388-S392 WeakPolarHBondContact O-CB 3.4Å; A388-S392 PolarHBondContact O-N 3.05Å; A388-S392 PolarHBondContact O-OG 3.13Å; T389-S392 PolarHBondContact O-N 2.91Å; S392-S396 WeakPolarHBondContact O-CB 3.2Å; S392-S396 PolarHBondContact O-N 3.25Å; S392-S396 PolarHBondContact O-OG 2.94Å
393	E	82.7	Confident	69.1	Low	96 Å²	96	91.6 Å²	91.6	45%	0.449	53%	0.53	S	S	.	.	H	α-helix	trans	-66.2	-47.3	175.7	-178.6	170.9	-160	0	0	111.8	T389 L390 I391 L395 S396 Q397	T389-E393 WeakPolarHBondContact O-CB 3.35Å; T389-E393 PolarHBondContact O-N 2.95Å; L390-E393 PolarHBondContact O-N 2.89Å; I391-E393 VanDerWaalsContact C-N 3.28Å; I391-E393 PolarHBondContact O-N 3.07Å; E393-L395 PolarHBondContact O-N 2.96Å; E393-S396 PolarHBondContact O-N 3.02Å; E393-Q397 WeakPolarHBondContact O-CG 3.21Å; E393-Q397 PolarHBondContact O-N 3.12Å
394	Q	83.8	Confident	68.1	Low	127 Å²	127	92.7 Å²	92.7	59%	0.593	53%	0.529	S	S	*	.	H	α-helix	trans	-59.1	-45.6	176.1	-74.3	174.6	-10.5	0	0	112	L390 I391 S396 Q397 S398	L390-Q394 WeakPolarHBondContact O-CB 3.49Å; L390-Q394 VanDerWaalsContact O-CG 3.31Å; L390-Q394 WeakPolarHBondContact O-CG 3.28Å; L390-Q394 PolarHBondContact O-N 3.27Å; I391-Q394 PolarHBondContact O-N 3.48Å; Q394-S396 VanDerWaalsContact C-N 3.34Å; Q394-S396 PolarHBondContact O-N 3.1Å; Q394-Q397 PolarHBondContact O-N 3.42Å; Q394-S398 WeakPolarHBondContact O-CB 3.42Å; Q394-S398 PolarHBondContact O-N 2.86Å; Q394-S398 PolarHBondContact O-OG 3.44Å
395	L	86.2	Confident	66.5	Low	106 Å²	106	97.3 Å²	97.3	56%	0.555	56%	0.558	S	S	*	*	H	α-helix	trans	-62.6	-42.1	177.6	-70.6	173.3	0	0	0	111.7	I391 E393 Q397 S398 S399	I391-L395 HydrophobicContact CG2-CD1 3.83Å; I391-L395 HydrophobicContact CG2-CG 4.29Å; I391-L395 WeakPolarHBondContact O-CB 3.42Å; I391-L395 VanDerWaalsContact O-CG 3.29Å; I391-L395 WeakPolarHBondContact O-CG 3.28Å; I391-L395 PolarHBondContact O-N 3.24Å; E393-L395 PolarHBondContact O-N 2.96Å; L395-Q397 VanDerWaalsContact C-N 3.34Å; L395-Q397 PolarHBondContact O-N 3.34Å; L395-S398 WeakPolarHBondContact CA-OG 3.34Å; L395-S398 PolarHBondContact O-N 3.34Å; L395-S398 PolarHBondContact O-OG 2.91Å; L395-S399 PolarHBondContact O-N 3.4Å; L395-S399 PolarHBondContact O-OG 2.88Å; L395-S399 VanDerWaalsContact O-OG 3.14Å
396	S	84.8	Confident	64.5	Low	84 Å²	84	99.2 Å²	99.2	59%	0.587	57%	0.574	S	S	*	*	H	α-helix	trans	-64.4	-37.6	177.8	-58.7	0	0	0	0	112.3	S392 E393 Q394	S392-S396 WeakPolarHBondContact O-CB 3.2Å; S392-S396 PolarHBondContact O-N 3.25Å; S392-S396 PolarHBondContact O-OG 2.94Å; E393-S396 PolarHBondContact O-N 3.02Å; Q394-S396 VanDerWaalsContact C-N 3.34Å; Q394-S396 PolarHBondContact O-N 3.1Å
397	Q	77.1	Confident	62.9	Low	127 Å²	127	106.3 Å²	106.3	59%	0.593	61%	0.612	S	S	*	*	H	α-helix	trans	-74.7	-34.7	177.2	-69.4	173	5.8	0	0	112.3	E393 Q394 L395 S399 V400	E393-Q397 WeakPolarHBondContact O-CG 3.21Å; E393-Q397 PolarHBondContact O-N 3.12Å; Q394-Q397 PolarHBondContact O-N 3.42Å; L395-Q397 VanDerWaalsContact C-N 3.34Å; L395-Q397 PolarHBondContact O-N 3.34Å; Q397-S399 VanDerWaalsContact C-N 3.26Å; Q397-S399 PolarHBondContact O-N 3.02Å; Q397-V400 PolarHBondContact O-N 3.14Å
398	S	65	Low	61	Low	78 Å²	78	109.8 Å²	109.8	55%	0.545	64%	0.638	S	S	.	*	H	α-helix	trans	-70.1	-18.2	179.9	69.9	0	0	0	0	114.5	Q394 L395 V400	Q394-S398 WeakPolarHBondContact O-CB 3.42Å; Q394-S398 PolarHBondContact O-N 2.86Å; Q394-S398 PolarHBondContact O-OG 3.44Å; L395-S398 WeakPolarHBondContact CA-OG 3.34Å; L395-S398 PolarHBondContact O-N 3.34Å; L395-S398 PolarHBondContact O-OG 2.91Å; S398-V400 VanDerWaalsContact C-N 3.26Å; S398-V400 PolarHBondContact O-N 3.25Å
399	S	55.2	Low	58.7	Low	102 Å²	102	110.5 Å²	110.5	71%	0.713	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.8	1.3	179.5	-60.3	0	0	0	0	114.2	L395 Q397	L395-S399 PolarHBondContact O-N 3.4Å; L395-S399 PolarHBondContact O-OG 2.88Å; L395-S399 VanDerWaalsContact O-OG 3.14Å; Q397-S399 VanDerWaalsContact C-N 3.26Å; Q397-S399 PolarHBondContact O-N 3.02Å
400	V	48.3	Very low	56.7	Low	119 Å²	119	116 Å²	116	72%	0.721	67%	0.672	S	S	*	*			trans	-108.8	73.9	176.5	-169.2	0	0	0	0	110.1	Q397 S398	Q397-V400 PolarHBondContact O-N 3.14Å; S398-V400 VanDerWaalsContact C-N 3.26Å; S398-V400 PolarHBondContact O-N 3.25Å
401	K	39.7	Very low	54	Low	183 Å²	183	119.2 Å²	119.2	80%	0.796	70%	0.699	S	S	*	*			trans	-110.5	114.8	154.2	-76.5	-175.8	179.5	178.4	0	107.4	E403	K401-E403 PolarHBondContact O-N 3.29Å
402	P	39.3	Very low	51.6	Low	123 Å²	123	119.7 Å²	119.7	80%	0.799	71%	0.708	S	S	*	*			trans	-72	109.9	171.9	27.4	-28.4	0	0	0	108.4
403	E	33.6	Very low	49.3	Very low	177 Å²	177	121.8 Å²	121.8	83%	0.827	72%	0.723	S	S	*	*			trans	-68.8	143.6	161	-68	-156.6	157	0	0	109.3	K401	K401-E403 PolarHBondContact O-N 3.29Å
404	P	37.8	Very low	46.7	Very low	114 Å²	114	123.1 Å²	123.1	74%	0.74	74%	0.743	S	S	*	*			trans	-66.7	151.3	178.9	29.2	-33	0	0	0	110.3	A406	P404-A406 PolarHBondContact O-N 3.5Å
405	P	37.6	Very low	44.3	Very low	136 Å²	136	125.9 Å²	125.9	88%	0.883	76%	0.756	S	S	*	*			trans	-72.2	110	-172.2	29.6	-32	0	0	0	110
406	A	30.9	Very low	41.6	Very low	94 Å²	94	132.5 Å²	132.5	78%	0.777	77%	0.773	S	S	*	*			trans	-89.3	122.1	162.2	0	0	0	0	0	109	P404 V408	P404-A406 PolarHBondContact O-N 3.5Å; A406-V408 PolarHBondContact O-N 2.6Å
407	N	39.9	Very low	40	Very low	167 Å²	167	133.7 Å²	133.7	89%	0.893	78%	0.779	S	S	*	*			trans	-39	121.7	173.6	-81.9	-32.3	0	0	0	113.7
408	V	34.2	Very low	37.6	Very low	146 Å²	146	134 Å²	134	89%	0.885	79%	0.793	S	S	*	*			trans	-136.4	122.8	148.4	-173.3	0	0	0	0	108.4	A406	A406-V408 PolarHBondContact O-N 2.6Å
409	G	31.6	Very low	35.8	Very low	69 Å²	69	134.2 Å²	134.2	71%	0.711	81%	0.808	S	S	*	*			trans	-67.2	137.2	-169.4	0	0	0	0	0	115
410	Q	35.6	Very low	34.5	Very low	175 Å²	175	133.1 Å²	133.1	82%	0.818	81%	0.813	S	S	*	*				29.5	114.7	123.8	-159	155.1	1.7	0	0	117.9
411	C	24.7	Very low	33.5	Very low	135 Å²	135	132 Å²	132	91%	0.912	82%	0.817	S	S	*	*			trans	-139.4	130.5	140.6	-154.4	0	0	0	0	110.3
412	C	31.1	Very low	33.1	Very low	86 Å²	86	132.9 Å²	132.9	58%	0.581	82%	0.824	S	S	*	*			trans	-83.3	146.4	-162.3	-58.9	0	0	0	0	113.5
413	S	35.5	Very low	32.7	Very low	114 Å²	114	130.6 Å²	130.6	80%	0.797	82%	0.822	S	S	*	*				36.3	123.1	125.7	-38.6	0	0	0	0	120.4
414	S	29.8	Very low	32.8	Very low	124 Å²	124	129.5 Å²	129.5	87%	0.867	83%	0.827	S	S	*	*			trans	-153.2	126.6	130.3	56.8	0	0	0	0	111.1
415	E	31.9	Very low	32.4	Very low	185 Å²	185	127.4 Å²	127.4	86%	0.864	83%	0.827	S	S	*	*			trans	-75.3	148	-178.3	-52.8	179.6	146.9	0	0	112.6
416	R	30.9	Very low	32	Very low	244 Å²	244	127.8 Å²	127.8	92%	0.921	82%	0.821	S	S	*	*				-173	156.6	118.9	-99.8	176.9	-177.5	-150.2	1.1	112.9
417	P	51.3	Low	32.2	Very low	110 Å²	110	128.6 Å²	128.6	71%	0.714	82%	0.82	S	S	*	*			trans	-113.8	-171.3	-154.5	42.8	-31.9	0	0	0	114.1
418	C	26.4	Very low	32.1	Very low	132 Å²	132	126.3 Å²	126.3	89%	0.892	82%	0.816	S	S	*	*			trans	101.5	126.2	175.2	-57	0	0	0	0	112.4
419	G	27	Very low	32	Very low	84 Å²	84	129.9 Å²	129.9	87%	0.866	81%	0.813	S	S	*	*			cis	150.2	132.7	8.6	0	0	0	0	0	107
420	G	26.6	Very low	31.8	Very low	79 Å²	79	132.4 Å²	132.4	81%	0.814	82%	0.82	S	S	*	*			trans	126.9	106.2	165	0	0	0	0	0	117.6
421	A	28.9	Very low	31.6	Very low	96 Å²	96	130 Å²	130	79%	0.793	82%	0.822	S	S	*	*			trans	60.6	115.9	140.5	0	0	0	0	0	122.6
422	E	31.2	Very low	31.9	Very low	201 Å²	201	128.7 Å²	128.7	94%	0.939	82%	0.815	S	S	*	*			trans	53.7	114.4	134.9	-60.3	-172.3	167.5	0	0	121
423	G	29.9	Very low	31.7	Very low	74 Å²	74	133.1 Å²	133.1	76%	0.763	83%	0.827	S	S	*	*			trans	170.2	84.9	164.5	0	0	0	0	0	111.3	G425	G423-G425 PolarHBondContact O-N 3.2Å
424	T	35.9	Very low	31.5	Very low	154 Å²	154	135.8 Å²	135.8	95%	0.945	83%	0.831	S	S	*	*			trans	-56.6	105.9	171.6	40.8	0	0	0	0	110.8
425	G	30.6	Very low	31.7	Very low	70 Å²	70	137.5 Å²	137.5	72%	0.722	84%	0.836	S	S	*	*			trans	-123.5	67.9	170.2	0	0	0	0	0	110.1	G423 C427	G423-G425 PolarHBondContact O-N 3.2Å; G425-C427 VanDerWaalsContact C-N 3.27Å; G425-C427 PolarHBondContact O-N 3.41Å
426	D	27.9	Very low	31.4	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	82%	0.821	S	S	*	*			trans	-79	82.4	170.1	-160.5	13.9	0	0	0	108.3
427	C	36.1	Very low	31.2	Very low	111 Å²	111	125.2 Å²	125.2	75%	0.75	82%	0.816	S	S	*	*			trans	-105.1	116.4	176.7	-153.6	0	0	0	0	107.9	G425	G425-C427 VanDerWaalsContact C-N 3.27Å; G425-C427 PolarHBondContact O-N 3.41Å
428	C	36.5	Very low	30.2	Very low	118 Å²	118	127.1 Å²	127.1	80%	0.797	82%	0.82	S	S	*	*	S	Bend	trans	81.6	43	164.9	-53.7	0	0	0	0	118.7
429	R	33	Very low	30.3	Very low	222 Å²	222	123.4 Å²	123.4	84%	0.838	80%	0.795	S	S	*	*			trans	-143.7	86.1	158	-70.1	-169	178.6	-174.5	-0.4	113
430	S	27.9	Very low	30.8	Very low	122 Å²	122	124 Å²	124	85%	0.853	79%	0.786	S	S	*	*	S	Bend	trans	-164.5	90.2	155.9	-82.1	0	0	0	0	110.9
431	S	29.8	Very low	31.4	Very low	123 Å²	123	128.6 Å²	128.6	86%	0.86	78%	0.779	S	S	*	*			trans	162.8	59.5	146.3	174.9	0	0	0	0	109.9
432	S	31.2	Very low	32	Very low	108 Å²	108	128.2 Å²	128.2	76%	0.755	76%	0.763	S	S	*	*			trans	-128.8	60.1	167.1	62.3	0	0	0	0	109.2
433	H	28.4	Very low	32.7	Very low	180 Å²	180	124.1 Å²	124.1	83%	0.833	74%	0.744	S	S	*	*			trans	-146.1	97.5	160.5	-89.7	-69.4	0	0	0	108.1
434	L	29.6	Very low	33.7	Very low	170 Å²	170	126.9 Å²	126.9	89%	0.89	74%	0.737	S	S	*	*			trans	-174.9	76.8	145.3	-96.8	158.4	0	0	0	106.8
435	V	35.2	Very low	34.5	Very low	159 Å²	159	120.5 Å²	120.5	96%	0.964	70%	0.7	S	S	*	*			trans	-89.5	107	156.1	-175.9	0	0	0	0	104.6
436	G	26.1	Very low	35.8	Very low	54 Å²	54	121 Å²	121	56%	0.557	69%	0.689	S	S	*	*			trans	170.6	101.9	-179.8	0	0	0	0	0	112.9
437	S	26.2	Very low	37.6	Very low	118 Å²	118	116.7 Å²	116.7	83%	0.825	67%	0.666	S	S	*	*			trans	71.7	100.5	161.9	-50.9	0	0	0	0	117.2	S439	S437-S439 PolarHBondContact O-N 3.05Å
438	L	31	Very low	39.4	Very low	149 Å²	149	111.9 Å²	111.9	78%	0.78	63%	0.633	S	S	*	*			trans	-55.4	104.5	161.8	-78.9	152.4	0	0	0	108.9
439	S	28.2	Very low	41.2	Very low	54 Å²	54	111.5 Å²	111.5	38%	0.378	62%	0.615	S	S	.	*			trans	-88.5	154.2	171.3	68.4	0	0	0	0	109.3	S437 R441 D442	S437-S439 PolarHBondContact O-N 3.05Å; S439-R441 PolarHBondContact O-N 3.3Å; S439-D442 PolarHBondContact O-N 2.96Å; S439-D442 VanDerWaalsContact O-N 3.17Å
440	S	36.8	Very low	43.1	Very low	96 Å²	96	104.1 Å²	104.1	67%	0.671	60%	0.597	S	S	*	*	H	α-helix	trans	-51.9	-16.4	176.7	50.5	0	0	0	0	115
441	R	40	Very low	45.3	Very low	177 Å²	177	99.3 Å²	99.3	67%	0.668	56%	0.562	S	S	*	*	H	α-helix	trans	-74.1	-27	-178.6	-59.1	178.6	110.5	176.9	2.7	113.9	S439	S439-R441 PolarHBondContact O-N 3.3Å
442	D	41.4	Very low	47.6	Very low	87 Å²	87	93.5 Å²	93.5	47%	0.465	52%	0.521	S	S	.	.	H	α-helix	trans	-78.7	-26.7	178.4	-72.1	-44	0	0	0	112.1	S439 T446	S439-D442 PolarHBondContact O-N 2.96Å; S439-D442 VanDerWaalsContact O-N 3.17Å; D442-T446 WeakPolarHBondContact O-CB 3.47Å; D442-T446 PolarHBondContact O-N 3.38Å; D442-T446 VanDerWaalsContact O-N 3.13Å; D442-T446 PolarHBondContact O-OG1 2.77Å
443	H	45.7	Very low	49.8	Very low	116 Å²	116	89.4 Å²	89.4	54%	0.537	49%	0.492	S	S	.	.	H	α-helix	trans	-68.2	-48.3	176.5	-79.8	-70.6	0	0	0	112	A445 T446 D447	H443-A445 VanDerWaalsContact C-N 3.32Å; H443-A445 PolarHBondContact O-N 3.23Å; H443-T446 PolarHBondContact O-N 2.69Å; H443-T446 VanDerWaalsContact O-N 3.1Å; H443-D447 PolarHBondContact O-N 2.99Å
444	E	49.9	Very low	52.4	Low	131 Å²	131	83.4 Å²	83.4	61%	0.612	46%	0.462	S	S	*	.	H	α-helix	trans	-60.7	-38.2	178	-75.5	-178	147	0	0	113	L448	E444-L448 PolarHBondContact O-N 3.28Å
445	A	54	Low	54.9	Low	20 Å²	20	75.4 Å²	75.4	17%	0.165	42%	0.42	C	S	.	.	H	α-helix	trans	-71.1	-30.3	177.3	0	0	0	0	0	112.9	H443 R449 V466	H443-A445 VanDerWaalsContact C-N 3.32Å; H443-A445 PolarHBondContact O-N 3.23Å; A445-R449 WeakPolarHBondContact O-CD 3.1Å; A445-R449 VanDerWaalsContact O-CG 3.27Å; A445-R449 WeakPolarHBondContact O-CG 3.35Å; A445-V466 HydrophobicContact CB-CG2 4.25Å
446	T	56.8	Low	57.2	Low	80 Å²	80	67.8 Å²	67.8	49%	0.491	38%	0.375	S	S	.	.	H	α-helix	trans	-75.1	-36.8	177.7	-54	0	0	0	0	110.9	D442 H443 R449	D442-T446 WeakPolarHBondContact O-CB 3.47Å; D442-T446 PolarHBondContact O-N 3.38Å; D442-T446 VanDerWaalsContact O-N 3.13Å; D442-T446 PolarHBondContact O-OG1 2.77Å; H443-T446 PolarHBondContact O-N 2.69Å; H443-T446 VanDerWaalsContact O-N 3.1Å; T446-R449 PolarHBondContact O-N 3.36Å
447	D	66.7	Low	60	Low	56 Å²	56	67.9 Å²	67.9	30%	0.299	36%	0.358	S	S	.	.	H	α-helix	trans	-67.4	-43	179.1	-68.6	-18.9	0	0	0	112.3	H443 R449 S450 Q481	H443-D447 PolarHBondContact O-N 2.99Å; D447-R449 VanDerWaalsContact C-N 3.3Å; D447-R449 PolarHBondContact O-N 3.43Å; D447-S450 PolarHBondContact O-N 2.98Å; D447-S450 PolarHBondContact O-OG 3.48Å; D447-Q481 PolarHBondContact OD2-NE2 3.31Å
448	L	73.4	Confident	62.7	Low	10 Å²	10	68.3 Å²	68.3	5%	0.052	34%	0.341	C	S	.	.	H	α-helix	trans	-63.8	-35	176.1	-176.5	66.2	0	0	0	112.4	A371 E444 S450 L451 L452 V466 L469 L474 A477	A371-L448 HydrophobicContact CB-CD1 4.3Å; E444-L448 PolarHBondContact O-N 3.28Å; L448-S450 VanDerWaalsContact C-N 3.25Å; L448-S450 PolarHBondContact O-N 3.14Å; L448-L451 PolarHBondContact O-N 3.38Å; L448-L451 VanDerWaalsContact O-N 3.1Å; L448-L452 HydrophobicContact CD2-CD1 4.33Å; L448-L452 HydrophobicContact CG-CD1 4Å; L448-L452 HydrophobicContact CG-CG 4.36Å; L448-L452 WeakPolarHBondContact O-CG 3.42Å; L448-V466 HydrophobicContact CD2-CG1 3.31Å; L448-L469 HydrophobicContact CD2-CD1 3.91Å; L448-L474 HydrophobicContact CD2-CD2 4.48Å; L448-A477 HydrophobicContact CD1-CB 3.34Å
449	R	73.1	Confident	65.3	Low	110 Å²	110	61.6 Å²	61.6	42%	0.415	31%	0.307	S	S	.	.	H	α-helix	trans	-59.4	-39.1	-178.3	-75.3	168.6	-172.7	-176.5	5.7	111.2	A445 T446 D447 L451 L452 R457	A445-R449 WeakPolarHBondContact O-CD 3.1Å; A445-R449 VanDerWaalsContact O-CG 3.27Å; A445-R449 WeakPolarHBondContact O-CG 3.35Å; T446-R449 PolarHBondContact O-N 3.36Å; D447-R449 VanDerWaalsContact C-N 3.3Å; D447-R449 PolarHBondContact O-N 3.43Å; R449-L451 PolarHBondContact O-N 3.27Å; R449-L452 PolarHBondContact O-N 3.11Å; R449-L452 VanDerWaalsContact O-N 3.11Å; R449-R457 PolarHBondContact O-NE 3.36Å; R449-R457 PolarHBondContact O-NH2 2.99Å
450	S	73.6	Confident	68.1	Low	66 Å²	66	59.5 Å²	59.5	46%	0.462	29%	0.292	S	S	.	.	H	α-helix	trans	-55.1	-36	178.7	73	0	0	0	0	112.3	D447 L448 L452 R457	D447-S450 PolarHBondContact O-N 2.98Å; D447-S450 PolarHBondContact O-OG 3.48Å; L448-S450 VanDerWaalsContact C-N 3.25Å; L448-S450 PolarHBondContact O-N 3.14Å; S450-L452 PolarHBondContact O-N 3.49Å; S450-R457 PolarHBondContact O-NH2 2.64Å
451	L	75.3	Confident	70.4	Confident	22 Å²	22	64.8 Å²	64.8	12%	0.115	30%	0.297	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.6	14.1	-177.5	-57.8	175.5	0	0	0	114.6	L370 A371 L448 R449 A477 R480	L370-L451 WeakPolarHBondContact CD2-O 3.27Å; A371-L451 HydrophobicContact CB-CB 4.34Å; A371-L451 PolarHBondContact N-O 2.81Å; A371-L451 VanDerWaalsContact N-O 3.14Å; L448-L451 PolarHBondContact O-N 3.38Å; L448-L451 VanDerWaalsContact O-N 3.1Å; R449-L451 PolarHBondContact O-N 3.27Å; L451-A477 HydrophobicContact CD1-CB 4Å; L451-A477 VanDerWaalsContact CD1-O 3.23Å; L451-A477 WeakPolarHBondContact CD1-O 3.47Å; L451-R480 HydrophobicContact CD1-CB 3.99Å; L451-R480 HydrophobicContact CD2-CB 4.31Å
452	L	77.3	Confident	72.6	Confident	1 Å²	1	57.7 Å²	57.7	1%	0.005	27%	0.272	C	S	.	.	S	Bend	trans	-121.2	141.2	178.7	-64.1	175.8	0	0	0	111.6	L372 L448 R449 S450 C456 R457 V460	L372-L452 HydrophobicContact CB-CD2 3.49Å; L372-L452 VanDerWaalsContact CB-CD2 3.49Å; L448-L452 HydrophobicContact CD2-CD1 4.33Å; L448-L452 HydrophobicContact CG-CD1 4Å; L448-L452 HydrophobicContact CG-CG 4.36Å; L448-L452 WeakPolarHBondContact O-CG 3.42Å; R449-L452 PolarHBondContact O-N 3.11Å; R449-L452 VanDerWaalsContact O-N 3.11Å; S450-L452 PolarHBondContact O-N 3.49Å; L452-C456 HydrophobicContact CB-CB 4.32Å; L452-C456 HydrophobicContact CD2-CB 4.11Å; L452-R457 HydrophobicContact CB-CG 3.63Å; L452-R457 PolarHBondContact O-NE 3.26Å; L452-V460 HydrophobicContact CD1-CB 4.18Å; L452-V460 HydrophobicContact CD1-CG2 3.73Å
453	C	78	Confident	74.6	Confident	21 Å²	21	54.3 Å²	54.3	14%	0.142	25%	0.254	C	S	.	.			trans	-69.3	164.3	168.9	67.8	0	0	0	0	110.8	L370 R375 S455 C456 R457	L370-C453 HydrophobicContact CD1-CB 3.36Å; L370-C453 VanDerWaalsContact CD1-N 3.29Å; R375-C453 PolarHBondContact NH1-SG 2.64Å; C453-S455 VanDerWaalsContact C-N 3.27Å; C453-S455 PolarHBondContact O-N 3.33Å; C453-S455 VanDerWaalsContact O-N 3.13Å; C453-S455 PolarHBondContact SG-OG 3.27Å; C453-C456 PolarHBondContact O-N 3.42Å; C453-C456 PolarHBondContact SG-N 3.17Å; C453-C456 VanDerWaalsContact SG-N 3.42Å; C453-C456 PolarHBondContact SG-SG 2.86Å; C453-R457 WeakPolarHBondContact O-CG 3.33Å; C453-R457 PolarHBondContact O-N 3.07Å
454	Y	81.8	Confident	76.3	Confident	54 Å²	54	53.1 Å²	53.1	21%	0.212	26%	0.258	C	S	.	.	H	α-helix	trans	-41.7	-51.8	175.1	178.2	-97.8	0	0	0	113.7	L386 T389 R457 R458	L386-Y454 HydrophobicContact CD1-CD2 4.46Å; T389-Y454 HydrophobicContact CG2-CE2 4.44Å; T389-Y454 WeakPolarHBondContact OG1-CE2 3.48Å; Y454-R457 PolarHBondContact O-N 3.11Å; Y454-R458 HydrophobicContact CE1-CG 4.43Å; Y454-R458 PolarHBondContact O-N 3.28Å; Y454-R458 VanDerWaalsContact O-N 3.07Å; Y454-R458 PolarHBondContact OH-NH1 3.29Å
455	S	82.5	Confident	77.7	Confident	2 Å²	2	48.7 Å²	48.7	1%	0.014	24%	0.242	C	C	.	.	H	α-helix	trans	-65.9	-42.1	-178.2	72.4	0	0	0	0	113.4	L264 R266 R375 C453 R457 R458 T459	L264-S455 VanDerWaalsContact O-CB 3.22Å; L264-S455 WeakPolarHBondContact O-CB 3.27Å; R266-S455 VanDerWaalsContact CG-CB 3.45Å; R266-S455 VanDerWaalsContact CG-OG 3.31Å; R266-S455 WeakPolarHBondContact CG-OG 3.49Å; R266-S455 VanDerWaalsContact CZ-CB 3.5Å; R266-S455 PolarHBondContact NE-OG 3.38Å; R266-S455 PolarHBondContact NH2-OG 3.15Å; R375-S455 PolarHBondContact NH1-OG 3.49Å; R375-S455 VanDerWaalsContact NH1-OG 3.13Å; C453-S455 VanDerWaalsContact C-N 3.27Å; C453-S455 PolarHBondContact O-N 3.33Å; C453-S455 VanDerWaalsContact O-N 3.13Å; C453-S455 PolarHBondContact SG-OG 3.27Å; S455-R457 VanDerWaalsContact C-N 3.35Å; S455-R458 PolarHBondContact O-N 3.14Å; S455-T459 PolarHBondContact O-N 3.41Å; S455-T459 VanDerWaalsContact O-N 3.11Å; S455-T459 PolarHBondContact O-OG1 3.36Å
456	C	83.3	Confident	78.9	Confident	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-73.5	-30.4	-178.6	-51.8	0	0	0	0	109.6	L372 C373 L452 C453 T459 V460	L372-C456 HydrophobicContact CB-CB 4.39Å; L372-C456 HydrophobicContact CD2-CB 3.97Å; C373-C456 WeakPolarHBondContact CB-SG 3.37Å; C373-C456 WeakPolarHBondContact SG-CB 3.34Å; C373-C456 CovalentContact SG-SG 2.09Å; C373-C456 PolarHBondContact SG-SG 3.22Å; L452-C456 HydrophobicContact CB-CB 4.32Å; L452-C456 HydrophobicContact CD2-CB 4.11Å; C453-C456 PolarHBondContact O-N 3.42Å; C453-C456 PolarHBondContact SG-N 3.17Å; C453-C456 VanDerWaalsContact SG-N 3.42Å; C453-C456 PolarHBondContact SG-SG 2.86Å; C456-T459 PolarHBondContact O-N 3.11Å; C456-V460 WeakPolarHBondContact O-CG2 3.17Å; C456-V460 PolarHBondContact O-N 3.39Å
457	R	84.3	Confident	79.7	Confident	56 Å²	56	50 Å²	50	21%	0.211	24%	0.244	C	C	.	.	H	α-helix	trans	-62.6	-41.5	169.1	-69.5	-178.5	-170.4	-151.6	-2.6	112.5	R449 S450 L452 C453 Y454 S455 V460 R461	R449-R457 PolarHBondContact O-NE 3.36Å; R449-R457 PolarHBondContact O-NH2 2.99Å; S450-R457 PolarHBondContact O-NH2 2.64Å; L452-R457 HydrophobicContact CB-CG 3.63Å; L452-R457 PolarHBondContact O-NE 3.26Å; C453-R457 WeakPolarHBondContact O-CG 3.33Å; C453-R457 PolarHBondContact O-N 3.07Å; Y454-R457 PolarHBondContact O-N 3.11Å; S455-R457 VanDerWaalsContact C-N 3.35Å; R457-V460 PolarHBondContact O-N 2.89Å; R457-R461 VanDerWaalsContact O-CB 3.31Å; R457-R461 WeakPolarHBondContact O-CB 3.35Å; R457-R461 PolarHBondContact O-N 3.39Å
458	R	84.6	Confident	80.3	Confident	126 Å²	126	49.5 Å²	49.5	48%	0.475	25%	0.245	S	C	.	.	H	α-helix	trans	-64.4	-43.8	176.1	-73.7	-174.9	68.3	171.5	-0	111.7	Y454 S455 R461 D462	Y454-R458 HydrophobicContact CE1-CG 4.43Å; Y454-R458 PolarHBondContact O-N 3.28Å; Y454-R458 VanDerWaalsContact O-N 3.07Å; Y454-R458 PolarHBondContact OH-NH1 3.29Å; S455-R458 PolarHBondContact O-N 3.14Å; R458-R461 PolarHBondContact O-N 3.16Å; R458-D462 WeakPolarHBondContact O-CB 3.5Å; R458-D462 PolarHBondContact O-N 3Å; R458-D462 VanDerWaalsContact O-N 3.11Å
459	T	85.4	Confident	80.7	Confident	9 Å²	9	49.3 Å²	49.3	6%	0.055	24%	0.244	C	C	.	.	H	α-helix	trans	-60.4	-45.3	175.9	-55.7	0	0	0	0	111.2	A220 D223 L224 S455 C456 D462 M463	A220-T459 HydrophobicContact CB-CG2 4.06Å; D223-T459 PolarHBondContact OD2-OG1 2.85Å; D223-T459 VanDerWaalsContact OD2-OG1 3.1Å; L224-T459 HydrophobicContact CD1-CG2 4.13Å; L224-T459 HydrophobicContact CD2-CG2 3.67Å; L224-T459 HydrophobicContact CG-CG2 3.56Å; S455-T459 PolarHBondContact O-N 3.41Å; S455-T459 VanDerWaalsContact O-N 3.11Å; S455-T459 PolarHBondContact O-OG1 3.36Å; C456-T459 PolarHBondContact O-N 3.11Å; T459-D462 WeakPolarHBondContact O-CB 3.44Å; T459-D462 PolarHBondContact O-N 3.47Å; T459-M463 WeakPolarHBondContact O-CG 3.44Å; T459-M463 PolarHBondContact O-N 3.39Å
460	V	85.3	Confident	81.2	Confident	9 Å²	9	44.3 Å²	44.3	6%	0.055	23%	0.226	C	C	.	.	H	α-helix	trans	-69.5	-36.3	178.6	173.1	0	0	0	0	112.4	L372 L452 C456 R457 D462 M463 V466 L469	L372-V460 HydrophobicContact CD2-CG2 4.29Å; L452-V460 HydrophobicContact CD1-CB 4.18Å; L452-V460 HydrophobicContact CD1-CG2 3.73Å; C456-V460 WeakPolarHBondContact O-CG2 3.17Å; C456-V460 PolarHBondContact O-N 3.39Å; R457-V460 PolarHBondContact O-N 2.89Å; V460-D462 PolarHBondContact O-N 2.93Å; V460-M463 WeakPolarHBondContact O-CB 3.45Å; V460-M463 PolarHBondContact O-N 3.35Å; V460-M463 VanDerWaalsContact O-N 3.09Å; V460-V466 HydrophobicContact CG1-CG2 3.91Å; V460-L469 HydrophobicContact CG2-CD1 4.36Å
461	R	85.6	Confident	81.6	Confident	208 Å²	208	48.9 Å²	48.9	79%	0.785	24%	0.24	S	C	*	.	H	α-helix	trans	-62.8	-29.7	174	-178.8	177.8	176.3	179.3	0.7	112.6	R457 R458 M463	R457-R461 VanDerWaalsContact O-CB 3.31Å; R457-R461 WeakPolarHBondContact O-CB 3.35Å; R457-R461 PolarHBondContact O-N 3.39Å; R458-R461 PolarHBondContact O-N 3.16Å; R461-M463 VanDerWaalsContact C-N 3.25Å
462	D	86.1	Confident	81.8	Confident	28 Å²	28	48.2 Å²	48.2	15%	0.15	24%	0.236	C	C	.	.	T	Hydrogen-bonded Turn	trans	-78.5	-9.8	177.4	-162.7	60.9	0	0	0	113	Q216 T217 A220 R458 T459 V460	Q216-D462 WeakPolarHBondContact CG-O 3.34Å; Q216-D462 PolarHBondContact N-O 3.4Å; Q216-D462 PolarHBondContact N-OD2 2.76Å; T217-D462 WeakPolarHBondContact CB-OD2 3.27Å; T217-D462 WeakPolarHBondContact CG2-OD1 3.28Å; T217-D462 PolarHBondContact N-OD2 2.91Å; T217-D462 PolarHBondContact OG1-OD2 3.21Å; A220-D462 HydrophobicContact CB-CB 4.1Å; A220-D462 WeakPolarHBondContact CB-OD2 3.14Å; R458-D462 WeakPolarHBondContact O-CB 3.5Å; R458-D462 PolarHBondContact O-N 3Å; R458-D462 VanDerWaalsContact O-N 3.11Å; T459-D462 WeakPolarHBondContact O-CB 3.44Å; T459-D462 PolarHBondContact O-N 3.47Å; V460-D462 PolarHBondContact O-N 2.93Å
463	M	84.9	Confident	82	Confident	15 Å²	15	48.2 Å²	48.2	7%	0.074	24%	0.236	C	C	.	.	B	Isolated β-bridge	trans	-84.6	142.3	176.5	-65.1	174.5	73.1	0	0	111	S214 A215 L224 T459 V460 R461 C468 L469	S214-M463 CarbonylContact O-C 3.59Å; S214-M463 WeakPolarHBondContact O-CA 3.36Å; S214-M463 WeakPolarHBondContact OG-CE 3.46Å; A215-M463 HydrophobicContact CB-CG 4.25Å; L224-M463 HydrophobicContact CD1-CE 4.5Å; L224-M463 HydrophobicContact CD1-SD 4.09Å; T459-M463 WeakPolarHBondContact O-CG 3.44Å; T459-M463 PolarHBondContact O-N 3.39Å; V460-M463 WeakPolarHBondContact O-CB 3.45Å; V460-M463 PolarHBondContact O-N 3.35Å; V460-M463 VanDerWaalsContact O-N 3.09Å; R461-M463 VanDerWaalsContact C-N 3.25Å; M463-C468 HydrophobicContact CE-CB 4.16Å; M463-L469 HydrophobicContact CE-CD2 3.91Å; M463-L469 HydrophobicContact CE-CG 4.16Å; M463-L469 HydrophobicContact SD-CD2 4.05Å; M463-L469 HydrophobicContact SD-CG 4.47Å
464	S	81.1	Confident	82.2	Confident	91 Å²	91	49.8 Å²	49.8	64%	0.636	24%	0.242	S	C	*	.	S	Bend	trans	-68.6	-30.5	175.9	56.4	0	0	0	0	113.9	S214	S214-S464 WeakPolarHBondContact CB-OG 3.18Å; S214-S464 PolarHBondContact O-N 3.14Å
465	S	78.8	Confident	82	Confident	38 Å²	38	50 Å²	50	27%	0.266	25%	0.252	S	S	.	.			trans	-147.8	144.4	171.6	179.1	0	0	0	0	111.1	D467	S465-D467 VanDerWaalsContact C-N 3.33Å; S465-D467 WeakPolarHBondContact OG-CB 3.31Å; S465-D467 PolarHBondContact OG-N 3.32Å; S465-D467 VanDerWaalsContact OG-N 3.16Å; S465-D467 PolarHBondContact OG-OD2 3.18Å
466	V	78.4	Confident	81.9	Confident	30 Å²	30	50.6 Å²	50.6	18%	0.182	26%	0.255	C	S	.	.	G	3₁₀ helix	trans	-76	-24.9	175.1	-173.8	0	0	0	0	111.2	A445 L448 V460 C468 L469 L474	A445-V466 HydrophobicContact CB-CG2 4.25Å; L448-V466 HydrophobicContact CD2-CG1 3.31Å; V460-V466 HydrophobicContact CG1-CG2 3.91Å; V466-C468 PolarHBondContact O-N 3.47Å; V466-C468 VanDerWaalsContact O-N 3.14Å; V466-L469 HydrophobicContact CG1-CD1 4Å; V466-L469 WeakPolarHBondContact O-CB 3.36Å; V466-L469 WeakPolarHBondContact O-CG 3.31Å; V466-L469 PolarHBondContact O-N 2.76Å; V466-L474 HydrophobicContact CG1-CD2 4.26Å
467	D	75.3	Confident	81.6	Confident	97 Å²	97	51 Å²	51	52%	0.519	26%	0.258	S	S	.	.	G	3₁₀ helix	trans	-64.3	-19.7	-180	-54.6	-32.3	0	0	0	112.7	S465 L469	S465-D467 VanDerWaalsContact C-N 3.33Å; S465-D467 WeakPolarHBondContact OG-CB 3.31Å; S465-D467 PolarHBondContact OG-N 3.32Å; S465-D467 VanDerWaalsContact OG-N 3.16Å; S465-D467 PolarHBondContact OG-OD2 3.18Å; D467-L469 PolarHBondContact O-N 2.87Å
468	C	79.1	Confident	81.3	Confident	47 Å²	47	54 Å²	54	32%	0.318	28%	0.275	S	S	.	.	G	3₁₀ helix	trans	-70.8	-13.7	175.5	-64.9	0	0	0	0	112.7	L211 M463 V466	L211-C468 WeakPolarHBondContact CD1-O 3.34Å; L211-C468 WeakPolarHBondContact CG-O 3.5Å; M463-C468 HydrophobicContact CE-CB 4.16Å; V466-C468 PolarHBondContact O-N 3.47Å; V466-C468 VanDerWaalsContact O-N 3.14Å
469	L	81.6	Confident	81	Confident	6 Å²	6	57.5 Å²	57.5	3%	0.031	29%	0.288	C	S	.	.	S	Bend	trans	-68.5	150.8	176.9	-71.1	174.6	0	0	0	111.3	F228 L372 L448 V460 M463 V466 D467 L474	F228-L469 HydrophobicContact CZ-CD2 4.39Å; L372-L469 HydrophobicContact CD1-CD2 4.13Å; L448-L469 HydrophobicContact CD2-CD1 3.91Å; V460-L469 HydrophobicContact CG2-CD1 4.36Å; M463-L469 HydrophobicContact CE-CD2 3.91Å; M463-L469 HydrophobicContact CE-CG 4.16Å; M463-L469 HydrophobicContact SD-CD2 4.05Å; M463-L469 HydrophobicContact SD-CG 4.47Å; V466-L469 HydrophobicContact CG1-CD1 4Å; V466-L469 WeakPolarHBondContact O-CB 3.36Å; V466-L469 WeakPolarHBondContact O-CG 3.31Å; V466-L469 PolarHBondContact O-N 2.76Å; D467-L469 PolarHBondContact O-N 2.87Å; L469-L474 HydrophobicContact CB-CD2 4.25Å; L469-L474 HydrophobicContact CB-CG 4.33Å; L469-L474 HydrophobicContact CD1-CD2 4.46Å
470	P	82.6	Confident	80.6	Confident	5 Å²	5	58.3 Å²	58.3	3%	0.032	29%	0.29	C	S	.	.			trans	-62.2	144.2	179.3	-22.4	35.8	0	0	0	111.9	V149 L150 L211 F228 Y472 V473 L474	V149-P470 HydrophobicContact CG1-CG 4.33Å; L150-P470 HydrophobicContact CD2-CB 4.41Å; L150-P470 HydrophobicContact CD2-CG 4.24Å; L211-P470 HydrophobicContact CD1-CG 3.92Å; F228-P470 HydrophobicContact CE1-CG 4.01Å; F228-P470 HydrophobicContact CZ-CG 4.03Å; P470-Y472 HydrophobicContact CB-CD1 3.42Å; P470-Y472 VanDerWaalsContact CB-CD1 3.42Å; P470-Y472 HydrophobicContact CB-CE1 3.21Å; P470-Y472 HydrophobicContact CB-CG 4.49Å; P470-Y472 HydrophobicContact CG-CD1 4.41Å; P470-Y472 HydrophobicContact CG-CE1 3.72Å; P470-Y472 PolarHBondContact O-N 2.92Å; P470-Y472 VanDerWaalsContact O-N 3.08Å; P470-V473 HydrophobicContact CB-CG2 4.47Å; P470-V473 WeakPolarHBondContact O-CB 3.34Å; P470-V473 PolarHBondContact O-N 2.76Å; P470-L474 PolarHBondContact O-N 3.04Å
471	Q	81.8	Confident	80.2	Confident	162 Å²	162	61.1 Å²	61.1	76%	0.757	30%	0.303	S	S	*	.	H	α-helix	trans	-56.9	-30.8	-176.1	-69.4	-175.4	-13.9	0	0	113.5	V473 L474 S475	Q471-V473 VanDerWaalsContact C-N 3.29Å; Q471-V473 PolarHBondContact O-N 2.86Å; Q471-L474 PolarHBondContact O-N 3.21Å; Q471-S475 VanDerWaalsContact O-CB 3.29Å; Q471-S475 WeakPolarHBondContact O-CB 3.46Å; Q471-S475 PolarHBondContact O-N 2.77Å; Q471-S475 PolarHBondContact O-OG 3.16Å
472	Y	80.4	Confident	79.9	Confident	8 Å²	8	55.8 Å²	55.8	3%	0.031	29%	0.29	C	S	.	.	H	α-helix	trans	-66.6	-29.8	177.5	78.5	-94.7	0	0	0	113.2	V149 L152 L157 F228 H231 P470 S475 V476	V149-Y472 HydrophobicContact CG1-CE1 3.89Å; V149-Y472 WeakPolarHBondContact CG1-OH 3.48Å; V149-Y472 WeakPolarHBondContact O-CD1 3.27Å; V149-Y472 WeakPolarHBondContact O-CE1 3.35Å; L152-Y472 HydrophobicContact CB-CD1 3.9Å; L152-Y472 HydrophobicContact CB-CE1 4.06Å; L152-Y472 HydrophobicContact CB-CG 4.24Å; L152-Y472 HydrophobicContact CD1-CE1 4.38Å; L152-Y472 WeakPolarHBondContact O-CB 3.46Å; L157-Y472 HydrophobicContact CD1-CD2 3.69Å; L157-Y472 HydrophobicContact CD1-CE2 3.87Å; L157-Y472 HydrophobicContact CD2-CE2 4.12Å; L157-Y472 HydrophobicContact CG-CD2 4.08Å; L157-Y472 HydrophobicContact CG-CE2 4.03Å; F228-Y472 WeakPolarHBondContact CD1-OH 3.37Å; H231-Y472 AromaticContact ND1-CE2 3.83Å; H231-Y472 AromaticContact ND1-CZ 3.8Å; H231-Y472 PolarHBondContact ND1-OH 3.37Å; P470-Y472 HydrophobicContact CB-CD1 3.42Å; P470-Y472 VanDerWaalsContact CB-CD1 3.42Å; P470-Y472 HydrophobicContact CB-CE1 3.21Å; P470-Y472 HydrophobicContact CB-CG 4.49Å; P470-Y472 HydrophobicContact CG-CD1 4.41Å; P470-Y472 HydrophobicContact CG-CE1 3.72Å; P470-Y472 PolarHBondContact O-N 2.92Å; P470-Y472 VanDerWaalsContact O-N 3.08Å; Y472-S475 WeakPolarHBondContact CA-OG 3.33Å; Y472-S475 PolarHBondContact O-OG 2.93Å; Y472-V476 WeakPolarHBondContact O-CB 3.28Å; Y472-V476 WeakPolarHBondContact O-CG2 3.49Å; Y472-V476 PolarHBondContact O-N 3.41Å
473	V	81.8	Confident	79.6	Confident	1 Å²	1	60.2 Å²	60.2	1%	0.006	30%	0.304	C	S	.	.	H	α-helix	trans	-73.3	-46.2	175.7	179.9	0	0	0	0	109.6	L157 L372 P470 Q471 V476 A477	L157-V473 HydrophobicContact CD1-CG2 4.43Å; L372-V473 HydrophobicContact CD1-CG1 3.87Å; L372-V473 HydrophobicContact CD1-CG2 4.21Å; P470-V473 HydrophobicContact CB-CG2 4.47Å; P470-V473 WeakPolarHBondContact O-CB 3.34Å; P470-V473 PolarHBondContact O-N 2.76Å; Q471-V473 VanDerWaalsContact C-N 3.29Å; Q471-V473 PolarHBondContact O-N 2.86Å; V473-V476 PolarHBondContact O-N 3.48Å; V473-A477 WeakPolarHBondContact O-CB 3.36Å; V473-A477 PolarHBondContact O-N 3.1Å
474	L	81.1	Confident	79.2	Confident	54 Å²	54	61.7 Å²	61.7	28%	0.283	32%	0.316	S	S	.	.	H	α-helix	trans	-65.7	-46.4	-179.2	-62.2	177.1	0	0	0	111.6	L448 V466 L469 P470 Q471 V476 A477 Q478	L448-L474 HydrophobicContact CD2-CD2 4.48Å; V466-L474 HydrophobicContact CG1-CD2 4.26Å; L469-L474 HydrophobicContact CB-CD2 4.25Å; L469-L474 HydrophobicContact CB-CG 4.33Å; L469-L474 HydrophobicContact CD1-CD2 4.46Å; P470-L474 PolarHBondContact O-N 3.04Å; Q471-L474 PolarHBondContact O-N 3.21Å; L474-V476 PolarHBondContact O-N 3.44Å; L474-A477 WeakPolarHBondContact O-CB 3.32Å; L474-A477 PolarHBondContact O-N 3.13Å; L474-Q478 WeakPolarHBondContact O-CB 3.37Å; L474-Q478 PolarHBondContact O-N 2.63Å
475	S	79.1	Confident	79.1	Confident	59 Å²	59	59.2 Å²	59.2	41%	0.413	30%	0.301	S	S	.	.	H	α-helix	trans	-63.4	-38.1	177.9	56.5	0	0	0	0	112.9	Q471 Y472 R479	Q471-S475 VanDerWaalsContact O-CB 3.29Å; Q471-S475 WeakPolarHBondContact O-CB 3.46Å; Q471-S475 PolarHBondContact O-N 2.77Å; Q471-S475 PolarHBondContact O-OG 3.16Å; Y472-S475 WeakPolarHBondContact CA-OG 3.33Å; Y472-S475 PolarHBondContact O-OG 2.93Å; S475-R479 VanDerWaalsContact O-CB 3.29Å; S475-R479 WeakPolarHBondContact O-CB 3.23Å; S475-R479 PolarHBondContact O-N 3.09Å
476	V	78.6	Confident	79.2	Confident	14 Å²	14	62.7 Å²	62.7	9%	0.085	31%	0.314	C	S	.	.	H	α-helix	trans	-68.7	-38.9	174.4	168.6	0	0	0	0	111.2	L157 Y472 V473 L474 R480	L157-V476 HydrophobicContact CB-CG1 4.14Å; L157-V476 HydrophobicContact CB-CG2 4.45Å; L157-V476 HydrophobicContact CD1-CB 3.83Å; L157-V476 HydrophobicContact CD1-CG1 3.96Å; L157-V476 HydrophobicContact CD1-CG2 3.92Å; Y472-V476 WeakPolarHBondContact O-CB 3.28Å; Y472-V476 WeakPolarHBondContact O-CG2 3.49Å; Y472-V476 PolarHBondContact O-N 3.41Å; V473-V476 PolarHBondContact O-N 3.48Å; L474-V476 PolarHBondContact O-N 3.44Å; V476-R480 VanDerWaalsContact CG1-CZ 3.47Å; V476-R480 WeakPolarHBondContact O-CB 3.49Å; V476-R480 WeakPolarHBondContact O-CG 3.39Å; V476-R480 PolarHBondContact O-N 3.22Å
477	A	77.5	Confident	79.3	Confident	7 Å²	7	67.2 Å²	67.2	6%	0.058	33%	0.332	C	S	.	.	H	α-helix	trans	-61.1	-50.3	174.2	0	0	0	0	0	111.3	A371 L448 L451 V473 L474 R479 R480 Q481	A371-A477 HydrophobicContact CB-CB 3.96Å; L448-A477 HydrophobicContact CD1-CB 3.34Å; L451-A477 HydrophobicContact CD1-CB 4Å; L451-A477 VanDerWaalsContact CD1-O 3.23Å; L451-A477 WeakPolarHBondContact CD1-O 3.47Å; V473-A477 WeakPolarHBondContact O-CB 3.36Å; V473-A477 PolarHBondContact O-N 3.1Å; L474-A477 WeakPolarHBondContact O-CB 3.32Å; L474-A477 PolarHBondContact O-N 3.13Å; A477-R479 PolarHBondContact O-N 3.05Å; A477-R480 PolarHBondContact O-N 2.65Å; A477-Q481 PolarHBondContact O-N 3.32Å
478	Q	78.9	Confident	79.6	Confident	119 Å²	119	68.9 Å²	68.9	56%	0.556	34%	0.336	S	S	*	.	H	α-helix	trans	-60.4	-43.7	178	-169.9	-179	17.1	0	0	111.9	L474 R480 Q481 N482	L474-Q478 WeakPolarHBondContact O-CB 3.37Å; L474-Q478 PolarHBondContact O-N 2.63Å; Q478-R480 VanDerWaalsContact C-N 3.29Å; Q478-R480 PolarHBondContact O-N 3.25Å; Q478-Q481 PolarHBondContact O-N 3.32Å; Q478-N482 WeakPolarHBondContact O-CB 3.39Å; Q478-N482 PolarHBondContact O-N 2.91Å; Q478-N482 PolarHBondContact O-OD1 3.32Å
479	R	78.4	Confident	79.8	Confident	201 Å²	201	73.8 Å²	73.8	76%	0.758	35%	0.354	S	S	*	.	H	α-helix	trans	-61.3	-38.3	177.4	-170.9	177.2	-171.3	-179.2	3.5	112.2	S475 A477 R483	S475-R479 VanDerWaalsContact O-CB 3.29Å; S475-R479 WeakPolarHBondContact O-CB 3.23Å; S475-R479 PolarHBondContact O-N 3.09Å; A477-R479 PolarHBondContact O-N 3.05Å; R479-R483 WeakPolarHBondContact O-CB 2.78Å; R479-R483 PolarHBondContact O-N 2.76Å
480	R	76.6	Confident	79.9	Confident	26 Å²	26	76.5 Å²	76.5	10%	0.098	37%	0.368	C	S	.	.	H	α-helix	trans	-70.5	-42.4	177.2	-76.1	177.1	178.2	150.7	1.6	111.9	L157 A369 L370 A371 L451 V476 A477 Q478 N482 R483 S484	L157-R480 PolarHBondContact O-NH2 2.91Å; A369-R480 PolarHBondContact O-NE 3.34Å; A369-R480 PolarHBondContact O-NH1 2.99Å; A369-R480 PolarHBondContact O-NH2 3.28Å; L370-R480 VanDerWaalsContact C-NH1 3.27Å; L370-R480 PolarHBondContact O-NH1 3.06Å; A371-R480 VanDerWaalsContact CA-NH1 3.33Å; L451-R480 HydrophobicContact CD1-CB 3.99Å; L451-R480 HydrophobicContact CD2-CB 4.31Å; V476-R480 VanDerWaalsContact CG1-CZ 3.47Å; V476-R480 WeakPolarHBondContact O-CB 3.49Å; V476-R480 WeakPolarHBondContact O-CG 3.39Å; V476-R480 PolarHBondContact O-N 3.22Å; A477-R480 PolarHBondContact O-N 2.65Å; Q478-R480 VanDerWaalsContact C-N 3.29Å; Q478-R480 PolarHBondContact O-N 3.25Å; R480-N482 VanDerWaalsContact C-N 3.34Å; R480-N482 PolarHBondContact O-N 3.36Å; R480-R483 CarbonylContact O-C 3.6Å; R480-R483 WeakPolarHBondContact O-CB 3.4Å; R480-R483 PolarHBondContact O-N 2.91Å; R480-R483 VanDerWaalsContact O-N 3.14Å; R480-S484 PolarHBondContact O-N 2.88Å
481	Q	76.6	Confident	79.7	Confident	68 Å²	68	79.4 Å²	79.4	32%	0.318	39%	0.389	S	S	.	.	H	α-helix	trans	-59	-47.1	174	-174.1	-178	4.8	0	0	111.3	D447 A477 Q478 R483 S484 A485	D447-Q481 PolarHBondContact OD2-NE2 3.31Å; A477-Q481 PolarHBondContact O-N 3.32Å; Q478-Q481 PolarHBondContact O-N 3.32Å; Q481-R483 VanDerWaalsContact C-N 3.27Å; Q481-R483 PolarHBondContact O-N 3.33Å; Q481-S484 PolarHBondContact O-N 3.17Å; Q481-S484 VanDerWaalsContact O-N 3.16Å; Q481-A485 WeakPolarHBondContact O-CB 3.34Å; Q481-A485 PolarHBondContact O-N 2.98Å
482	N	79.6	Confident	79.3	Confident	96 Å²	96	79.8 Å²	79.8	51%	0.513	39%	0.39	S	S	.	.	H	α-helix	trans	-60	-38.6	175.7	-68.1	-10	0	0	0	111.8	Q478 R480 M486	Q478-N482 WeakPolarHBondContact O-CB 3.39Å; Q478-N482 PolarHBondContact O-N 2.91Å; Q478-N482 PolarHBondContact O-OD1 3.32Å; R480-N482 VanDerWaalsContact C-N 3.34Å; R480-N482 PolarHBondContact O-N 3.36Å; N482-M486 WeakPolarHBondContact O-CB 3.14Å; N482-M486 PolarHBondContact O-N 3.46Å
483	R	79.4	Confident	79.1	Confident	121 Å²	121	87 Å²	87	46%	0.457	42%	0.422	S	S	.	.	H	α-helix	trans	-67.2	-40.5	175.5	-176.7	178.4	169.1	168.1	-1.6	112	D366 R479 R480 Q481 M486 K487	D366-R483 IonicContact OD1-CZ 3.13Å; D366-R483 IonicContact OD1-NH1 3.98Å; D366-R483 IonicContact OD1-NH2 3.54Å; D366-R483 PolarHBondContact OD1-NH2 2.85Å; D366-R483 IonicContact OD2-NH2 3.06Å; D366-R483 PolarHBondContact OD2-NH2 3.25Å; R479-R483 WeakPolarHBondContact O-CB 2.78Å; R479-R483 PolarHBondContact O-N 2.76Å; R480-R483 CarbonylContact O-C 3.6Å; R480-R483 WeakPolarHBondContact O-CB 3.4Å; R480-R483 PolarHBondContact O-N 2.91Å; R480-R483 VanDerWaalsContact O-N 3.14Å; Q481-R483 VanDerWaalsContact C-N 3.27Å; Q481-R483 PolarHBondContact O-N 3.33Å; R483-M486 PolarHBondContact O-N 3.26Å; R483-K487 VanDerWaalsContact O-CB 3.31Å; R483-K487 WeakPolarHBondContact O-CB 3.48Å; R483-K487 PolarHBondContact O-N 3.34Å
484	S	76	Confident	78.5	Confident	46 Å²	46	91.1 Å²	91.1	32%	0.322	44%	0.444	S	S	.	.	H	α-helix	trans	-64.6	-48.5	175.8	-167.9	0	0	0	0	110.9	R480 Q481 M486 K487 E488	R480-S484 PolarHBondContact O-N 2.88Å; Q481-S484 PolarHBondContact O-N 3.17Å; Q481-S484 VanDerWaalsContact O-N 3.16Å; S484-M486 VanDerWaalsContact C-N 3.32Å; S484-M486 PolarHBondContact O-N 2.82Å; S484-K487 CarbonylContact O-C 3.58Å; S484-K487 WeakPolarHBondContact O-CB 3.31Å; S484-K487 PolarHBondContact O-N 2.91Å; S484-K487 VanDerWaalsContact O-N 3.1Å; S484-E488 WeakPolarHBondContact O-CG 3.5Å; S484-E488 PolarHBondContact O-N 3.14Å
485	A	80.1	Confident	77.6	Confident	38 Å²	38	96.2 Å²	96.2	31%	0.314	47%	0.47	S	S	.	.	H	α-helix	trans	-60.9	-41.3	176.7	0	0	0	0	0	111.7	Q481 E488 Q489	Q481-A485 WeakPolarHBondContact O-CB 3.34Å; Q481-A485 PolarHBondContact O-N 2.98Å; A485-E488 PolarHBondContact O-N 3.46Å; A485-Q489 WeakPolarHBondContact O-CB 3.4Å; A485-Q489 VanDerWaalsContact O-CG 3.25Å; A485-Q489 WeakPolarHBondContact O-CG 3.35Å; A485-Q489 PolarHBondContact O-N 3.31Å
486	M	80.9	Confident	76.6	Confident	111 Å²	111	101 Å²	101	55%	0.547	49%	0.492	S	S	.	.	H	α-helix	trans	-64.9	-40.2	173.7	-179.9	-177.5	153.4	0	0	111.6	N482 R483 S484 Q489 I490	N482-M486 WeakPolarHBondContact O-CB 3.14Å; N482-M486 PolarHBondContact O-N 3.46Å; R483-M486 PolarHBondContact O-N 3.26Å; S484-M486 VanDerWaalsContact C-N 3.32Å; S484-M486 PolarHBondContact O-N 2.82Å; M486-Q489 PolarHBondContact O-N 3.32Å; M486-I490 HydrophobicContact CE-CD1 3.52Å; M486-I490 HydrophobicContact CG-CD1 3.55Å; M486-I490 HydrophobicContact CG-CG1 4.42Å; M486-I490 WeakPolarHBondContact O-CB 3.29Å; M486-I490 WeakPolarHBondContact O-CG1 3.46Å; M486-I490 PolarHBondContact O-N 3.35Å; M486-I490 HydrophobicContact SD-CD1 4.4Å
487	K	80.8	Confident	75.1	Confident	126 Å²	126	108.4 Å²	108.4	55%	0.548	53%	0.531	S	S	.	.	H	α-helix	trans	-65.3	-39.5	176.2	-171.1	177.7	-179.7	-180	0	111.4	R483 S484 I490 S491 L494	R483-K487 VanDerWaalsContact O-CB 3.31Å; R483-K487 WeakPolarHBondContact O-CB 3.48Å; R483-K487 PolarHBondContact O-N 3.34Å; S484-K487 CarbonylContact O-C 3.58Å; S484-K487 WeakPolarHBondContact O-CB 3.31Å; S484-K487 PolarHBondContact O-N 2.91Å; S484-K487 VanDerWaalsContact O-N 3.1Å; K487-I490 CarbonylContact O-C 3.59Å; K487-I490 PolarHBondContact O-N 3.47Å; K487-S491 WeakPolarHBondContact O-CA 3.33Å; K487-S491 WeakPolarHBondContact O-CB 3.36Å; K487-S491 PolarHBondContact O-N 3.04Å; K487-L494 HydrophobicContact CG-CD1 4.2Å
488	E	81.2	Confident	73.2	Confident	132 Å²	132	116.2 Å²	116.2	62%	0.617	60%	0.595	S	S	*	*	H	α-helix	trans	-63.1	-45.9	173.3	-74.8	170.3	-162.9	0	0	111.3	S484 A485 I490 S491	S484-E488 WeakPolarHBondContact O-CG 3.5Å; S484-E488 PolarHBondContact O-N 3.14Å; A485-E488 PolarHBondContact O-N 3.46Å; E488-I490 VanDerWaalsContact C-N 3.27Å; E488-I490 PolarHBondContact O-N 2.71Å; E488-S491 WeakPolarHBondContact O-CB 3.37Å; E488-S491 PolarHBondContact O-N 3.13Å; E488-S491 PolarHBondContact O-OG 2.99Å
489	Q	83.4	Confident	72.9	Confident	149 Å²	149	116.1 Å²	116.1	70%	0.696	60%	0.597	S	S	*	*	H	α-helix	trans	-63.7	-30.6	177	-73.6	173.7	1.4	0	0	113.6	A485 M486	A485-Q489 WeakPolarHBondContact O-CB 3.4Å; A485-Q489 VanDerWaalsContact O-CG 3.25Å; A485-Q489 WeakPolarHBondContact O-CG 3.35Å; A485-Q489 PolarHBondContact O-N 3.31Å; M486-Q489 PolarHBondContact O-N 3.32Å
490	I	83.7	Confident	72.6	Confident	64 Å²	64	111.6 Å²	111.6	33%	0.328	59%	0.589	S	S	.	*	H	α-helix	trans	-96.8	-5.2	-179.4	-57.4	169.4	0	0	0	111	M486 K487 E488 E492 F493 L494	M486-I490 HydrophobicContact CE-CD1 3.52Å; M486-I490 HydrophobicContact CG-CD1 3.55Å; M486-I490 HydrophobicContact CG-CG1 4.42Å; M486-I490 WeakPolarHBondContact O-CB 3.29Å; M486-I490 WeakPolarHBondContact O-CG1 3.46Å; M486-I490 PolarHBondContact O-N 3.35Å; M486-I490 HydrophobicContact SD-CD1 4.4Å; K487-I490 CarbonylContact O-C 3.59Å; K487-I490 PolarHBondContact O-N 3.47Å; E488-I490 VanDerWaalsContact C-N 3.27Å; E488-I490 PolarHBondContact O-N 2.71Å; I490-E492 PolarHBondContact O-N 3.47Å; I490-E492 VanDerWaalsContact O-N 3.16Å; I490-F493 HydrophobicContact CG2-CB 4.24Å; I490-F493 CarbonylContact O-C 3.29Å; I490-F493 WeakPolarHBondContact O-CA 3.44Å; I490-F493 PolarHBondContact O-N 3.34Å; I490-L494 HydrophobicContact CG2-CD2 4.26Å; I490-L494 HydrophobicContact CG2-CG 4.28Å; I490-L494 PolarHBondContact O-N 3.19Å; I490-L494 VanDerWaalsContact O-N 3.1Å
491	S	76.7	Confident	72.4	Confident	66 Å²	66	116.3 Å²	116.3	46%	0.462	62%	0.616	S	S	.	*	G	3₁₀ helix	trans	-58.5	-33.3	-174.6	64	0	0	0	0	113.1	K487 E488 F493 L494	K487-S491 WeakPolarHBondContact O-CA 3.33Å; K487-S491 WeakPolarHBondContact O-CB 3.36Å; K487-S491 PolarHBondContact O-N 3.04Å; E488-S491 WeakPolarHBondContact O-CB 3.37Å; E488-S491 PolarHBondContact O-N 3.13Å; E488-S491 PolarHBondContact O-OG 2.99Å; S491-F493 PolarHBondContact O-N 3.38Å; S491-L494 PolarHBondContact O-N 3.06Å
492	E	75.3	Confident	72.1	Confident	169 Å²	169	119.2 Å²	119.2	79%	0.79	63%	0.633	S	S	*	*	G	3₁₀ helix	trans	-66.9	-17.4	174.6	-62.9	-176	169.9	0	0	113.8	I490	I490-E492 PolarHBondContact O-N 3.47Å; I490-E492 VanDerWaalsContact O-N 3.16Å
493	F	74.4	Confident	71.7	Confident	159 Å²	159	120.6 Å²	120.6	70%	0.697	64%	0.641	S	S	*	*	G	3₁₀ helix	trans	-110.5	-6.5	-178.8	-54.8	-81.4	0	0	0	113.3	I490 S491 L495	I490-F493 HydrophobicContact CG2-CB 4.24Å; I490-F493 CarbonylContact O-C 3.29Å; I490-F493 WeakPolarHBondContact O-CA 3.44Å; I490-F493 PolarHBondContact O-N 3.34Å; S491-F493 PolarHBondContact O-N 3.38Å; F493-L495 PolarHBondContact O-N 3.41Å
494	L	71.2	Confident	71.1	Confident	88 Å²	88	120.6 Å²	120.6	46%	0.461	65%	0.653	S	S	.	*	S	Bend	trans	-77.2	121.7	172.5	-66.5	175.9	0	0	0	107.7	K487 I490 S491 D496	K487-L494 HydrophobicContact CG-CD1 4.2Å; I490-L494 HydrophobicContact CG2-CD2 4.26Å; I490-L494 HydrophobicContact CG2-CG 4.28Å; I490-L494 PolarHBondContact O-N 3.19Å; I490-L494 VanDerWaalsContact O-N 3.1Å; S491-L494 PolarHBondContact O-N 3.06Å; L494-D496 PolarHBondContact O-N 3.04Å
495	L	62	Low	70.8	Confident	161 Å²	161	125.9 Å²	125.9	84%	0.843	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-64.6	127.3	168.6	-65.1	169	0	0	0	107.2	F493 D497	F493-L495 PolarHBondContact O-N 3.41Å; L495-D497 PolarHBondContact O-N 3.05Å
496	D	57.5	Low	70.1	Confident	160 Å²	160	132.7 Å²	132.7	86%	0.856	71%	0.705	S	S	*	*	P	Polyproline II helix	trans	-56.7	122.3	170.6	-73.2	-40.6	0	0	0	108.1	L494 A498	L494-D496 PolarHBondContact O-N 3.04Å; D496-A498 PolarHBondContact O-N 3.36Å
497	D	47.2	Very low	69.2	Low	169 Å²	169	134.5 Å²	134.5	90%	0.904	72%	0.718	S	S	*	*			trans	-61.7	99.3	176.4	-75.7	-42.3	0	0	0	108.3	L495	L495-D497 PolarHBondContact O-N 3.05Å
498	A	36.6	Very low	68.1	Low	171 Å²	171	135.3 Å²	135.3	100%	1.413	73%	0.733	S	S	*	*			trans	-78.3	0	179.8	0	0	0	0	0	113.1	D496	D496-A498 PolarHBondContact O-N 3.36Å

Retrieved 498 of 498 residues in 486.3 ms (Link to these results)

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