A0A077ZA18_TRITR Loading...

Homeobox protein extradenticle

AlphaFold DB , UniProt , Accession A0A077ZA18, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 371 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	35.7	Very low	33.1	Very low	234 Å²	234	158.7 Å²	158.7	100%	1.153	84%	0.841	S	S	*	*				0	95.4	0	-57	-178.6	-169.6	0	0	104.2
2	D	37.7	Very low	32.9	Very low	150 Å²	150	154.3 Å²	154.3	80%	0.802	83%	0.831	S	S	*	*			cis	-137.9	131.8	36.2	-71	-39.6	0	0	0	113
3	H	32.6	Very low	32.8	Very low	174 Å²	174	152.9 Å²	152.9	81%	0.806	84%	0.84	S	S	*	*			trans	-74.5	128.1	150	-86.1	-95.2	0	0	0	107.3
4	M	34	Very low	32.6	Very low	168 Å²	168	146.3 Å²	146.3	83%	0.828	82%	0.824	S	S	*	*			trans	-156.2	96.7	140.2	-109.3	177.8	-70.8	0	0	109.1	L6	M4-L6 PolarHBondContact O-N 3.08Å
5	V	37.2	Very low	32.7	Very low	121 Å²	121	141.4 Å²	141.4	73%	0.733	82%	0.819	S	S	*	*			trans	-65.1	109	160.7	173.4	0	0	0	0	106.6
6	L	35.3	Very low	33.1	Very low	168 Å²	168	142.9 Å²	142.9	88%	0.88	82%	0.819	S	S	*	*			trans	-95.3	106.5	163.2	-111.6	143.4	0	0	0	107.7	M4	M4-L6 PolarHBondContact O-N 3.08Å
7	N	32.1	Very low	33.8	Very low	138 Å²	138	139.9 Å²	139.9	74%	0.738	80%	0.804	S	S	*	*			trans	-67.3	129.5	-174.4	-143.5	-24.8	0	0	0	110	A9	N7-A9 PolarHBondContact O-N 3.33Å; N7-A9 VanDerWaalsContact O-N 3.16Å
8	N	28.7	Very low	34.5	Very low	164 Å²	164	138.6 Å²	138.6	88%	0.877	79%	0.794	S	S	*	*			trans	-65.6	101.4	163.5	-105.1	-15.7	0	0	0	108.5
9	A	29.5	Very low	35	Very low	82 Å²	82	139.7 Å²	139.7	68%	0.678	79%	0.791	S	S	*	*			trans	-167.7	109.7	154.1	0	0	0	0	0	111.3	N7	N7-A9 PolarHBondContact O-N 3.33Å; N7-A9 VanDerWaalsContact O-N 3.16Å
10	M	28.2	Very low	35.6	Very low	182 Å²	182	139.9 Å²	139.9	90%	0.897	79%	0.785	S	S	*	*				77.4	82.2	123.7	-149.4	153.3	-173.6	0	0	117
11	L	33.5	Very low	36.2	Very low	165 Å²	165	137.7 Å²	137.7	86%	0.864	77%	0.771	S	S	*	*			trans	-138.5	106.3	147.9	-73.6	178.2	0	0	0	111.3
12	C	30.6	Very low	37.2	Very low	106 Å²	106	132.9 Å²	132.9	72%	0.716	75%	0.745	S	S	*	*			trans	70.6	96	133.6	-55.8	0	0	0	0	119.5	G14	C12-G14 PolarHBondContact O-N 3.22Å
13	S	32.1	Very low	38	Very low	136 Å²	136	128.5 Å²	128.5	95%	0.951	73%	0.726	S	S	*	*				18.3	84.6	119.6	-48	0	0	0	0	117.5
14	G	29.5	Very low	39.4	Very low	60 Å²	60	122.3 Å²	122.3	62%	0.619	71%	0.706	S	S	*	*			trans	-125.2	4.3	161.1	0	0	0	0	0	113.8	C12 M16	C12-G14 PolarHBondContact O-N 3.22Å; G14-M16 PolarHBondContact O-N 3.3Å
15	G	33.6	Very low	41	Very low	73 Å²	73	119.1 Å²	119.1	75%	0.753	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.1	20.2	-153.3	0	0	0	0	0	119.1
16	M	39.2	Very low	42.6	Very low	166 Å²	166	118.3 Å²	118.3	82%	0.818	68%	0.682	S	S	*	*	T	Hydrogen-bonded Turn	trans	-121.7	-6.3	-179.6	-64.2	-177.3	88.3	0	0	115.5	G14	G14-M16 PolarHBondContact O-N 3.3Å
17	V	45.1	Very low	44.4	Very low	92 Å²	92	114.4 Å²	114.4	56%	0.558	66%	0.662	S	S	*	*	S	Bend	trans	-95.7	-35.8	-176.2	-157.3	0	0	0	0	112.4	Q19 Q20 I21	V17-Q19 PolarHBondContact O-N 3.16Å; V17-Q20 PolarHBondContact O-N 2.85Å; V17-I21 HydrophobicContact CG1-CD1 4Å; V17-I21 WeakPolarHBondContact O-CG1 3.47Å; V17-I21 PolarHBondContact O-N 2.87Å
18	D	45.9	Very low	46.3	Very low	116 Å²	116	111.2 Å²	111.2	62%	0.62	65%	0.645	S	S	*	*	H	α-helix	trans	-71.4	-32.9	-171.7	-70.4	-29.6	0	0	0	114.8	I21 Q22	D18-I21 PolarHBondContact O-N 3.25Å; D18-Q22 PolarHBondContact O-N 3.45Å; D18-Q22 VanDerWaalsContact O-N 3.12Å
19	Q	45.2	Very low	48.1	Very low	160 Å²	160	107.2 Å²	107.2	75%	0.748	62%	0.624	S	S	*	*	H	α-helix	trans	-74.3	-29.4	-179.6	-121.8	168.9	20.7	0	0	112.5	V17 S23	V17-Q19 PolarHBondContact O-N 3.16Å; Q19-S23 WeakPolarHBondContact O-CB 3.45Å; Q19-S23 PolarHBondContact O-N 3Å; Q19-S23 PolarHBondContact O-OG 3.31Å
20	Q	46.2	Very low	49.7	Very low	142 Å²	142	107.9 Å²	107.9	66%	0.664	62%	0.615	S	S	*	*	H	α-helix	trans	-73	-37.2	173	-75.5	-175.7	-25.9	0	0	111.3	V17 S23 A24	V17-Q20 PolarHBondContact O-N 2.85Å; Q20-S23 PolarHBondContact O-OG 2.88Å; Q20-A24 VanDerWaalsContact O-CB 3.26Å; Q20-A24 WeakPolarHBondContact O-CB 3.45Å; Q20-A24 PolarHBondContact O-N 2.98Å
21	I	49.6	Very low	51.5	Low	95 Å²	95	105.3 Å²	105.3	49%	0.487	60%	0.599	S	S	.	*	H	α-helix	trans	-65	-46.8	177.1	-65.4	172.4	0	0	0	111	V17 D18 S23 A24 D25	V17-I21 HydrophobicContact CG1-CD1 4Å; V17-I21 WeakPolarHBondContact O-CG1 3.47Å; V17-I21 PolarHBondContact O-N 2.87Å; D18-I21 PolarHBondContact O-N 3.25Å; I21-S23 PolarHBondContact O-N 3.27Å; I21-A24 PolarHBondContact O-N 3.27Å; I21-D25 PolarHBondContact O-N 2.99Å
22	Q	54.7	Low	52.8	Low	133 Å²	133	101.7 Å²	101.7	62%	0.621	58%	0.578	S	S	*	*	H	α-helix	trans	-67.4	-37.1	-179.8	-77.7	-178.2	-0.6	0	0	113.7	D18 D25 I26	D18-Q22 PolarHBondContact O-N 3.45Å; D18-Q22 VanDerWaalsContact O-N 3.12Å; Q22-D25 WeakPolarHBondContact O-CB 3.45Å; Q22-D25 PolarHBondContact O-N 3.41Å; Q22-I26 WeakPolarHBondContact O-CG1 3.46Å; Q22-I26 PolarHBondContact O-N 3.28Å; Q22-I26 VanDerWaalsContact O-N 3.1Å
23	S	55.3	Low	54	Low	57 Å²	57	100.5 Å²	100.5	40%	0.399	56%	0.563	S	S	.	*	H	α-helix	trans	-72.9	-34.7	177.8	55.4	0	0	0	0	112	Q19 Q20 I21 I26 N27	Q19-S23 WeakPolarHBondContact O-CB 3.45Å; Q19-S23 PolarHBondContact O-N 3Å; Q19-S23 PolarHBondContact O-OG 3.31Å; Q20-S23 PolarHBondContact O-OG 2.88Å; I21-S23 PolarHBondContact O-N 3.27Å; S23-I26 PolarHBondContact O-N 3.5Å; S23-N27 WeakPolarHBondContact O-CB 3.48Å; S23-N27 PolarHBondContact O-N 3.33Å; S23-N27 PolarHBondContact O-ND2 2.75Å
24	A	61.1	Low	55.3	Low	45 Å²	45	99.9 Å²	99.9	37%	0.372	55%	0.547	S	S	.	.	H	α-helix	trans	-59.3	-47.1	168.9	0	0	0	0	0	110.7	Q20 I21 I26 N27 D28	Q20-A24 VanDerWaalsContact O-CB 3.26Å; Q20-A24 WeakPolarHBondContact O-CB 3.45Å; Q20-A24 PolarHBondContact O-N 2.98Å; I21-A24 PolarHBondContact O-N 3.27Å; A24-I26 VanDerWaalsContact C-N 3.35Å; A24-I26 PolarHBondContact O-N 2.95Å; A24-N27 PolarHBondContact O-N 2.94Å; A24-D28 WeakPolarHBondContact O-CB 3.37Å; A24-D28 VanDerWaalsContact O-CG 3.28Å; A24-D28 PolarHBondContact O-N 2.61Å
25	D	68.8	Low	56.9	Low	100 Å²	100	101.5 Å²	101.5	54%	0.535	54%	0.541	S	S	.	.	H	α-helix	trans	-57.6	-42.5	177.8	-101	-17.6	0	0	0	113.1	I21 Q22 D28 L29	I21-D25 PolarHBondContact O-N 2.99Å; Q22-D25 WeakPolarHBondContact O-CB 3.45Å; Q22-D25 PolarHBondContact O-N 3.41Å; D25-D28 PolarHBondContact O-N 3.44Å; D25-L29 WeakPolarHBondContact O-CB 3.36Å; D25-L29 PolarHBondContact O-N 2.92Å
26	I	69.8	Low	57.8	Low	104 Å²	104	100.5 Å²	100.5	53%	0.533	52%	0.518	S	S	.	.	H	α-helix	trans	-68.5	-43.4	178.3	-67.9	167.4	0	0	0	111.1	Q22 S23 A24 D28 L29 L30	Q22-I26 WeakPolarHBondContact O-CG1 3.46Å; Q22-I26 PolarHBondContact O-N 3.28Å; Q22-I26 VanDerWaalsContact O-N 3.1Å; S23-I26 PolarHBondContact O-N 3.5Å; A24-I26 VanDerWaalsContact C-N 3.35Å; A24-I26 PolarHBondContact O-N 2.95Å; I26-D28 VanDerWaalsContact C-N 3.29Å; I26-D28 PolarHBondContact O-N 3.04Å; I26-L29 PolarHBondContact O-N 3.39Å; I26-L30 HydrophobicContact CG2-CD1 4.12Å; I26-L30 WeakPolarHBondContact O-CG 3.4Å; I26-L30 PolarHBondContact O-N 3.41Å
27	N	73.1	Confident	58.6	Low	87 Å²	87	97.3 Å²	97.3	47%	0.465	51%	0.508	S	S	.	.	H	α-helix	trans	-65	-37.1	178.2	-79.8	-65.9	0	0	0	111.4	S23 A24 L30 K31	S23-N27 WeakPolarHBondContact O-CB 3.48Å; S23-N27 PolarHBondContact O-N 3.33Å; S23-N27 PolarHBondContact O-ND2 2.75Å; A24-N27 PolarHBondContact O-N 2.94Å; N27-L30 PolarHBondContact O-N 3.2Å; N27-K31 WeakPolarHBondContact O-CB 3.34Å; N27-K31 VanDerWaalsContact O-CG 3.29Å; N27-K31 WeakPolarHBondContact O-CG 3.41Å; N27-K31 PolarHBondContact O-N 3.13Å
28	D	73.3	Confident	59.1	Low	71 Å²	71	99.4 Å²	99.4	38%	0.38	52%	0.516	S	S	.	.	H	α-helix	trans	-72	-37.4	177.1	-70.2	-20.4	0	0	0	111.5	A24 D25 I26 K31 Q32	A24-D28 WeakPolarHBondContact O-CB 3.37Å; A24-D28 VanDerWaalsContact O-CG 3.28Å; A24-D28 PolarHBondContact O-N 2.61Å; D25-D28 PolarHBondContact O-N 3.44Å; I26-D28 VanDerWaalsContact C-N 3.29Å; I26-D28 PolarHBondContact O-N 3.04Å; D28-K31 IonicContact OD1-NZ 3.79Å; D28-Q32 VanDerWaalsContact O-CB 3.25Å; D28-Q32 WeakPolarHBondContact O-CB 2.9Å; D28-Q32 WeakPolarHBondContact O-CG 3.45Å; D28-Q32 PolarHBondContact O-N 2.94Å
29	L	66.5	Low	59.2	Low	80 Å²	80	95.7 Å²	95.7	42%	0.419	50%	0.495	S	S	.	.	H	α-helix	trans	-59.2	-44.5	168.9	-96.1	158.1	0	0	0	112.1	D25 I26 Q32 I33	D25-L29 WeakPolarHBondContact O-CB 3.36Å; D25-L29 PolarHBondContact O-N 2.92Å; I26-L29 PolarHBondContact O-N 3.39Å; L29-Q32 WeakPolarHBondContact O-CB 3.37Å; L29-Q32 PolarHBondContact O-N 3.46Å; L29-I33 VanDerWaalsContact O-CG1 3.29Å; L29-I33 WeakPolarHBondContact O-CG1 3.48Å; L29-I33 PolarHBondContact O-N 2.91Å
30	L	63.2	Low	59.5	Low	95 Å²	95	91 Å²	91	50%	0.497	48%	0.48	S	S	.	.	H	α-helix	trans	-67.4	-46.6	178.5	-78.6	167.5	0	0	0	112.1	I26 N27 Q32 I33 M34	I26-L30 HydrophobicContact CG2-CD1 4.12Å; I26-L30 WeakPolarHBondContact O-CG 3.4Å; I26-L30 PolarHBondContact O-N 3.41Å; N27-L30 PolarHBondContact O-N 3.2Å; L30-Q32 PolarHBondContact O-N 2.89Å; L30-I33 PolarHBondContact O-N 2.95Å; L30-I33 VanDerWaalsContact O-N 3.13Å; L30-M34 PolarHBondContact O-N 3.12Å
31	K	65.9	Low	59.5	Low	129 Å²	129	90.9 Å²	90.9	56%	0.561	48%	0.483	S	S	*	.	H	α-helix	trans	-57.7	-40.3	173.4	-75.8	172.8	-173.1	167.4	0	111.2	N27 D28 M34 N35	N27-K31 WeakPolarHBondContact O-CB 3.34Å; N27-K31 VanDerWaalsContact O-CG 3.29Å; N27-K31 WeakPolarHBondContact O-CG 3.41Å; N27-K31 PolarHBondContact O-N 3.13Å; D28-K31 IonicContact OD1-NZ 3.79Å; K31-M34 PolarHBondContact O-N 3.23Å; K31-N35 PolarHBondContact O-N 2.91Å; K31-N35 VanDerWaalsContact O-N 3.08Å
32	Q	60.3	Low	59.8	Low	89 Å²	89	91.9 Å²	91.9	42%	0.416	49%	0.489	S	S	.	.	H	α-helix	trans	-62.7	-47.9	174.7	-80.6	177.4	34.2	0	0	111.1	D28 L29 L30 M34 N35 I36 R47	D28-Q32 VanDerWaalsContact O-CB 3.25Å; D28-Q32 WeakPolarHBondContact O-CB 2.9Å; D28-Q32 WeakPolarHBondContact O-CG 3.45Å; D28-Q32 PolarHBondContact O-N 2.94Å; L29-Q32 WeakPolarHBondContact O-CB 3.37Å; L29-Q32 PolarHBondContact O-N 3.46Å; L30-Q32 PolarHBondContact O-N 2.89Å; Q32-M34 VanDerWaalsContact C-N 3.26Å; Q32-M34 PolarHBondContact O-N 3.06Å; Q32-N35 PolarHBondContact O-N 2.73Å; Q32-I36 PolarHBondContact O-N 3.46Å; Q32-R47 PolarHBondContact O-NH1 2.63Å
33	I	55	Low	60	Low	80 Å²	80	90 Å²	90	41%	0.41	48%	0.481	S	S	.	.	H	α-helix	trans	-58.4	-40.6	178	-69.3	164	0	0	0	111.2	L29 L30 I36 L51	L29-I33 VanDerWaalsContact O-CG1 3.29Å; L29-I33 WeakPolarHBondContact O-CG1 3.48Å; L29-I33 PolarHBondContact O-N 2.91Å; L30-I33 PolarHBondContact O-N 2.95Å; L30-I33 VanDerWaalsContact O-N 3.13Å; I33-I36 WeakPolarHBondContact O-CB 3.4Å; I33-I36 WeakPolarHBondContact O-CG1 3.42Å; I33-I36 PolarHBondContact O-N 3.25Å; I33-L51 HydrophobicContact CD1-CD1 4.1Å; I33-L51 HydrophobicContact CG1-CD1 4.24Å
34	M	59.5	Low	59.8	Low	123 Å²	123	88.7 Å²	88.7	61%	0.606	47%	0.473	S	S	*	.	H	α-helix	trans	-63.9	-40.3	177.5	-72.4	-179.2	65.6	0	0	112.8	L30 K31 Q32 I36 T37	L30-M34 PolarHBondContact O-N 3.12Å; K31-M34 PolarHBondContact O-N 3.23Å; Q32-M34 VanDerWaalsContact C-N 3.26Å; Q32-M34 PolarHBondContact O-N 3.06Å; M34-I36 PolarHBondContact O-N 3.48Å; M34-T37 PolarHBondContact O-OG1 3.1Å
35	N	63.6	Low	59.7	Low	95 Å²	95	91.9 Å²	91.9	51%	0.508	48%	0.481	S	S	.	.	G	3₁₀ helix	trans	-72.7	-1.8	178.5	-85.9	7.3	0	0	0	114.4	K31 Q32 T37 D38 Q39	K31-N35 PolarHBondContact O-N 2.91Å; K31-N35 VanDerWaalsContact O-N 3.08Å; Q32-N35 PolarHBondContact O-N 2.73Å; N35-T37 PolarHBondContact O-N 3.42Å; N35-D38 PolarHBondContact O-N 2.98Å; N35-Q39 PolarHBondContact O-NE2 3.17Å
36	I	52.7	Low	59.4	Low	51 Å²	51	90.7 Å²	90.7	26%	0.262	48%	0.477	S	S	.	.	G	3₁₀ helix	trans	-64.3	-27.3	179.6	-69.3	178.1	0	0	0	111.8	Q32 I33 M34 D38 Q39 A44 R47	Q32-I36 PolarHBondContact O-N 3.46Å; I33-I36 WeakPolarHBondContact O-CB 3.4Å; I33-I36 WeakPolarHBondContact O-CG1 3.42Å; I33-I36 PolarHBondContact O-N 3.25Å; M34-I36 PolarHBondContact O-N 3.48Å; I36-D38 PolarHBondContact O-N 3.3Å; I36-Q39 PolarHBondContact O-N 3.41Å; I36-A44 HydrophobicContact CG2-CB 4.27Å; I36-R47 HydrophobicContact CD1-CB 3.83Å; I36-R47 HydrophobicContact CD1-CG 4.44Å; I36-R47 HydrophobicContact CG1-CB 4.43Å
37	T	56.6	Low	58.9	Low	99 Å²	99	88.5 Å²	88.5	61%	0.607	46%	0.462	S	S	*	.	G	3₁₀ helix	trans	-67.1	-24.1	178.6	43.1	0	0	0	0	113.6	M34 N35	M34-T37 PolarHBondContact O-OG1 3.1Å; N35-T37 PolarHBondContact O-N 3.42Å
38	D	54.8	Low	58.3	Low	136 Å²	136	89.1 Å²	89.1	73%	0.727	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-97.4	6.6	-177.9	-57.6	-34.8	0	0	0	113	N35 I36	N35-D38 PolarHBondContact O-N 2.98Å; I36-D38 PolarHBondContact O-N 3.3Å
39	Q	47.1	Very low	57.9	Low	38 Å²	38	91.7 Å²	91.7	18%	0.178	47%	0.47	C	S	.	.	S	Bend	trans	-99.7	154.6	-172.1	-85	167.2	61.8	0	0	113.4	N35 I36 E43	N35-Q39 PolarHBondContact O-NE2 3.17Å; I36-Q39 PolarHBondContact O-N 3.41Å; Q39-E43 HydrophobicContact CB-CB 3.94Å; Q39-E43 HydrophobicContact CG-CB 4.2Å
40	S	52.3	Low	58	Low	63 Å²	63	93 Å²	93	44%	0.441	47%	0.474	S	S	.	.			trans	-62.8	156.4	173.8	67.2	0	0	0	0	111.5	D42 E43 A44	S40-D42 PolarHBondContact O-N 3.45Å; S40-D42 VanDerWaalsContact O-N 3.1Å; S40-E43 PolarHBondContact N-OE2 3.41Å; S40-E43 PolarHBondContact O-N 3.45Å; S40-E43 VanDerWaalsContact O-N 3.12Å; S40-E43 WeakPolarHBondContact OG-CG 3.49Å; S40-E43 PolarHBondContact OG-OE2 3.42Å; S40-A44 PolarHBondContact O-N 3.01Å
41	L	45.9	Very low	58	Low	138 Å²	138	92.6 Å²	92.6	72%	0.723	47%	0.472	S	S	*	.	H	α-helix	trans	-54.2	-33.3	-178.7	-175.7	65.6	0	0	0	112.8	Q45	L41-Q45 WeakPolarHBondContact O-CG 3.46Å; L41-Q45 PolarHBondContact O-N 3.12Å
42	D	56.9	Low	57.9	Low	116 Å²	116	89.9 Å²	89.9	62%	0.62	46%	0.464	S	S	*	.	H	α-helix	trans	-73.1	-41.2	-179.6	-165.1	54.5	0	0	0	112.5	S40 Q45 T46	S40-D42 PolarHBondContact O-N 3.45Å; S40-D42 VanDerWaalsContact O-N 3.1Å; D42-Q45 PolarHBondContact O-N 3.49Å; D42-T46 PolarHBondContact O-N 3Å; D42-T46 PolarHBondContact O-OG1 3.25Å
43	E	58.4	Low	58.3	Low	93 Å²	93	89.6 Å²	89.6	44%	0.435	47%	0.471	S	S	.	.	H	α-helix	trans	-67.3	-40.9	176.3	-70.3	168.8	139.4	0	0	111.8	Q39 S40 Q45 T46 R47	Q39-E43 HydrophobicContact CB-CB 3.94Å; Q39-E43 HydrophobicContact CG-CB 4.2Å; S40-E43 PolarHBondContact N-OE2 3.41Å; S40-E43 PolarHBondContact O-N 3.45Å; S40-E43 VanDerWaalsContact O-N 3.12Å; S40-E43 WeakPolarHBondContact OG-CG 3.49Å; S40-E43 PolarHBondContact OG-OE2 3.42Å; E43-Q45 VanDerWaalsContact C-N 3.29Å; E43-Q45 PolarHBondContact O-N 3.2Å; E43-T46 PolarHBondContact O-N 2.85Å; E43-R47 PolarHBondContact O-N 3.26Å
44	A	51.8	Low	59.2	Low	30 Å²	30	89.7 Å²	89.7	25%	0.248	47%	0.469	C	S	.	.	H	α-helix	trans	-61	-37.5	174.8	0	0	0	0	0	111.9	I36 S40 K48	I36-A44 HydrophobicContact CG2-CB 4.27Å; S40-A44 PolarHBondContact O-N 3.01Å; A44-K48 VanDerWaalsContact O-CB 3.28Å; A44-K48 WeakPolarHBondContact O-CB 3.3Å; A44-K48 PolarHBondContact O-N 2.9Å
45	Q	57.6	Low	60.4	Low	113 Å²	113	95.6 Å²	95.6	53%	0.528	49%	0.485	S	S	.	.	H	α-helix	trans	-67.1	-42.5	174.9	-75.8	-176	14.4	0	0	112.4	L41 D42 E43 R47 K48 H49	L41-Q45 WeakPolarHBondContact O-CG 3.46Å; L41-Q45 PolarHBondContact O-N 3.12Å; D42-Q45 PolarHBondContact O-N 3.49Å; E43-Q45 VanDerWaalsContact C-N 3.29Å; E43-Q45 PolarHBondContact O-N 3.2Å; Q45-R47 PolarHBondContact O-N 2.81Å; Q45-K48 WeakPolarHBondContact O-CB 3.34Å; Q45-K48 PolarHBondContact O-N 3.44Å; Q45-H49 PolarHBondContact O-N 2.84Å
46	T	63.3	Low	61.1	Low	74 Å²	74	96.2 Å²	96.2	45%	0.454	49%	0.486	S	S	.	.	H	α-helix	trans	-61	-44.7	177.5	-61.3	0	0	0	0	111.2	D42 E43 H49 Q50	D42-T46 PolarHBondContact O-N 3Å; D42-T46 PolarHBondContact O-OG1 3.25Å; E43-T46 PolarHBondContact O-N 2.85Å; T46-H49 WeakPolarHBondContact O-CB 3.09Å; T46-H49 PolarHBondContact O-N 3.42Å; T46-Q50 WeakPolarHBondContact O-CG 3.49Å; T46-Q50 PolarHBondContact O-N 3.26Å
47	R	59.2	Low	62	Low	58 Å²	58	97.3 Å²	97.3	22%	0.219	49%	0.489	C	S	.	.	H	α-helix	trans	-71.5	-36.8	177	-70	-176.3	-176.6	-163	10.3	113	Q32 I36 E43 Q45 H49 Q50 L51	Q32-R47 PolarHBondContact O-NH1 2.63Å; I36-R47 HydrophobicContact CD1-CB 3.83Å; I36-R47 HydrophobicContact CD1-CG 4.44Å; I36-R47 HydrophobicContact CG1-CB 4.43Å; E43-R47 PolarHBondContact O-N 3.26Å; Q45-R47 PolarHBondContact O-N 2.81Å; R47-H49 PolarHBondContact O-N 3.29Å; R47-Q50 PolarHBondContact O-N 2.94Å; R47-L51 WeakPolarHBondContact O-CB 3.34Å; R47-L51 PolarHBondContact O-N 3.21Å
48	K	59.4	Low	62.7	Low	100 Å²	100	96.2 Å²	96.2	44%	0.435	49%	0.49	S	S	.	.	H	α-helix	trans	-54.9	-42	168.2	171.3	-172.5	167.4	-164.8	0	110.3	A44 Q45 N52	A44-K48 VanDerWaalsContact O-CB 3.28Å; A44-K48 WeakPolarHBondContact O-CB 3.3Å; A44-K48 PolarHBondContact O-N 2.9Å; Q45-K48 WeakPolarHBondContact O-CB 3.34Å; Q45-K48 PolarHBondContact O-N 3.44Å; K48-N52 VanDerWaalsContact CG-ND2 3.31Å; K48-N52 WeakPolarHBondContact CG-ND2 3.41Å; K48-N52 VanDerWaalsContact O-CB 3.24Å; K48-N52 WeakPolarHBondContact O-CB 3.44Å; K48-N52 VanDerWaalsContact O-CG 3.28Å; K48-N52 PolarHBondContact O-N 3.31Å; K48-N52 PolarHBondContact O-ND2 3.26Å
49	H	66.8	Low	63.8	Low	126 Å²	126	92.7 Å²	92.7	58%	0.583	48%	0.479	S	S	*	.	H	α-helix	trans	-63.4	-50	175.6	-177.3	75.2	0	0	0	111.4	Q45 T46 R47 L51 N52 C53	Q45-H49 PolarHBondContact O-N 2.84Å; T46-H49 WeakPolarHBondContact O-CB 3.09Å; T46-H49 PolarHBondContact O-N 3.42Å; R47-H49 PolarHBondContact O-N 3.29Å; H49-L51 VanDerWaalsContact C-N 3.34Å; H49-L51 PolarHBondContact O-N 2.96Å; H49-N52 CarbonylContact O-C 3.5Å; H49-N52 WeakPolarHBondContact O-CA 3.49Å; H49-N52 WeakPolarHBondContact O-CB 3.5Å; H49-N52 PolarHBondContact O-N 3.22Å; H49-N52 VanDerWaalsContact O-N 3.08Å; H49-C53 VanDerWaalsContact CE1-SG 3.55Å; H49-C53 WeakPolarHBondContact O-CB 3.42Å; H49-C53 PolarHBondContact O-N 3Å; H49-C53 PolarHBondContact O-SG 3.34Å
50	Q	68.1	Low	65	Low	106 Å²	106	95.4 Å²	95.4	50%	0.495	50%	0.495	S	S	.	.	H	α-helix	trans	-55	-46.4	177.2	-69.6	171.5	-14.5	0	0	112.6	T46 R47 N52 C53 H54	T46-Q50 WeakPolarHBondContact O-CG 3.49Å; T46-Q50 PolarHBondContact O-N 3.26Å; R47-Q50 PolarHBondContact O-N 2.94Å; Q50-N52 VanDerWaalsContact C-N 3.34Å; Q50-N52 PolarHBondContact O-N 2.98Å; Q50-C53 CarbonylContact O-C 3.46Å; Q50-C53 PolarHBondContact O-N 3.08Å; Q50-H54 PolarHBondContact O-N 3.29Å
51	L	63.1	Low	65.9	Low	88 Å²	88	96.4 Å²	96.4	46%	0.461	49%	0.491	S	S	.	.	H	α-helix	trans	-69.9	-32.8	179.2	-154.6	140	0	0	0	111.8	I33 R47 H49 C53 H54	I33-L51 HydrophobicContact CD1-CD1 4.1Å; I33-L51 HydrophobicContact CG1-CD1 4.24Å; R47-L51 WeakPolarHBondContact O-CB 3.34Å; R47-L51 PolarHBondContact O-N 3.21Å; H49-L51 VanDerWaalsContact C-N 3.34Å; H49-L51 PolarHBondContact O-N 2.96Å; L51-C53 VanDerWaalsContact C-N 3.29Å; L51-C53 PolarHBondContact O-N 2.87Å; L51-H54 PolarHBondContact O-N 2.96Å
52	N	63.6	Low	67.1	Low	72 Å²	72	92.9 Å²	92.9	39%	0.385	48%	0.478	S	S	.	.	H	α-helix	trans	-68.2	-28	172.3	-84.2	-57.1	0	0	0	113.4	K48 H49 Q50 K57	K48-N52 VanDerWaalsContact CG-ND2 3.31Å; K48-N52 WeakPolarHBondContact CG-ND2 3.41Å; K48-N52 VanDerWaalsContact O-CB 3.24Å; K48-N52 WeakPolarHBondContact O-CB 3.44Å; K48-N52 VanDerWaalsContact O-CG 3.28Å; K48-N52 PolarHBondContact O-N 3.31Å; K48-N52 PolarHBondContact O-ND2 3.26Å; H49-N52 CarbonylContact O-C 3.5Å; H49-N52 WeakPolarHBondContact O-CA 3.49Å; H49-N52 WeakPolarHBondContact O-CB 3.5Å; H49-N52 PolarHBondContact O-N 3.22Å; H49-N52 VanDerWaalsContact O-N 3.08Å; Q50-N52 VanDerWaalsContact C-N 3.34Å; Q50-N52 PolarHBondContact O-N 2.98Å; N52-K57 WeakPolarHBondContact O-CD 3.47Å; N52-K57 WeakPolarHBondContact OD1-CE 3.38Å; N52-K57 PolarHBondContact OD1-NZ 3.42Å
53	C	68.8	Low	67.9	Low	83 Å²	83	91.3 Å²	91.3	56%	0.561	47%	0.472	S	S	*	.	H	α-helix	trans	-94.2	-5.5	178.6	-65.8	0	0	0	0	113.3	H49 Q50 L51	H49-C53 VanDerWaalsContact CE1-SG 3.55Å; H49-C53 WeakPolarHBondContact O-CB 3.42Å; H49-C53 PolarHBondContact O-N 3Å; H49-C53 PolarHBondContact O-SG 3.34Å; Q50-C53 CarbonylContact O-C 3.46Å; Q50-C53 PolarHBondContact O-N 3.08Å; L51-C53 VanDerWaalsContact C-N 3.29Å; L51-C53 PolarHBondContact O-N 2.87Å
54	H	73.4	Confident	68.4	Low	82 Å²	82	91.2 Å²	91.2	38%	0.38	48%	0.475	S	S	.	.			trans	-69.3	131.7	-176.9	-166.4	-94	0	0	0	111.8	Q50 L51 M56 K57	Q50-H54 PolarHBondContact O-N 3.29Å; L51-H54 PolarHBondContact O-N 2.96Å; H54-M56 PolarHBondContact ND1-N 3.36Å; H54-M56 PolarHBondContact O-N 3.21Å; H54-M56 VanDerWaalsContact O-N 3.15Å; H54-K57 WeakPolarHBondContact O-CB 3.47Å; H54-K57 PolarHBondContact O-N 3.49Å
55	R	83.9	Confident	69.2	Low	246 Å²	246	90.4 Å²	90.4	93%	0.928	47%	0.467	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55	-36	-177.3	-92.7	179.2	69.2	-177.5	1.2	113.6	K57	R55-K57 VanDerWaalsContact C-N 3.32Å
56	M	78.5	Confident	69.8	Low	108 Å²	108	88.8 Å²	88.8	53%	0.532	46%	0.462	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.2	-5.9	-177.7	-61.6	-179.8	64.7	0	0	114.2	H54 A58 A59 L60	H54-M56 PolarHBondContact ND1-N 3.36Å; H54-M56 PolarHBondContact O-N 3.21Å; H54-M56 VanDerWaalsContact O-N 3.15Å; M56-A58 PolarHBondContact O-N 3.46Å; M56-A58 VanDerWaalsContact O-N 3.17Å; M56-A59 PolarHBondContact O-N 3.33Å; M56-L60 HydrophobicContact CB-CD1 4.13Å; M56-L60 HydrophobicContact CB-CG 4.33Å; M56-L60 WeakPolarHBondContact O-CG 3.48Å; M56-L60 PolarHBondContact O-N 3.38Å
57	K	71.6	Confident	70.1	Confident	74 Å²	74	89.5 Å²	89.5	32%	0.322	46%	0.462	S	S	.	.	H	α-helix	trans	-52.3	-44	-174.4	-177.4	-156.7	-175.4	-173.3	0	112.1	N52 H54 R55 L60 F61	N52-K57 WeakPolarHBondContact O-CD 3.47Å; N52-K57 WeakPolarHBondContact OD1-CE 3.38Å; N52-K57 PolarHBondContact OD1-NZ 3.42Å; H54-K57 WeakPolarHBondContact O-CB 3.47Å; H54-K57 PolarHBondContact O-N 3.49Å; R55-K57 VanDerWaalsContact C-N 3.32Å; K57-L60 PolarHBondContact O-N 2.98Å; K57-F61 WeakPolarHBondContact O-CB 3.44Å; K57-F61 PolarHBondContact O-N 3.5Å
58	A	73	Confident	70	Confident	76 Å²	76	88.2 Å²	88.2	63%	0.628	46%	0.458	S	S	*	.	H	α-helix	trans	-61.9	-45.4	180	0	0	0	0	0	112.4	M56 F61 S62	M56-A58 PolarHBondContact O-N 3.46Å; M56-A58 VanDerWaalsContact O-N 3.17Å; A58-F61 PolarHBondContact O-N 2.96Å; A58-S62 PolarHBondContact O-N 2.94Å
59	A	77.4	Confident	70	Confident	62 Å²	62	88.7 Å²	88.7	51%	0.512	46%	0.462	S	S	.	.	H	α-helix	trans	-65.6	-47.1	178.8	0	0	0	0	0	111.6	M56 F61 S62 V63	M56-A59 PolarHBondContact O-N 3.33Å; A59-F61 VanDerWaalsContact C-N 3.3Å; A59-F61 PolarHBondContact O-N 2.83Å; A59-S62 PolarHBondContact O-N 3.35Å; A59-V63 WeakPolarHBondContact O-CG2 3.22Å; A59-V63 PolarHBondContact O-N 2.92Å; A59-V63 VanDerWaalsContact O-N 3.17Å
60	L	72.7	Confident	69.9	Low	95 Å²	95	91 Å²	91	50%	0.497	47%	0.47	S	S	.	.	H	α-helix	trans	-61	-40.2	177	-67.4	171.9	0	0	0	111.5	M56 K57 V63 L64	M56-L60 HydrophobicContact CB-CD1 4.13Å; M56-L60 HydrophobicContact CB-CG 4.33Å; M56-L60 WeakPolarHBondContact O-CG 3.48Å; M56-L60 PolarHBondContact O-N 3.38Å; K57-L60 PolarHBondContact O-N 2.98Å; L60-V63 PolarHBondContact O-N 3.4Å; L60-L64 VanDerWaalsContact O-CG 3.3Å; L60-L64 WeakPolarHBondContact O-CG 3.46Å; L60-L64 PolarHBondContact O-N 3.01Å
61	F	70.4	Confident	69.7	Low	85 Å²	85	89.3 Å²	89.3	37%	0.373	47%	0.467	S	S	.	.	H	α-helix	trans	-64	-40.7	177.4	-175.7	-87.7	0	0	0	112.4	K57 A58 A59 L64 C65 P145 I146	K57-F61 WeakPolarHBondContact O-CB 3.44Å; K57-F61 PolarHBondContact O-N 3.5Å; A58-F61 PolarHBondContact O-N 2.96Å; A59-F61 VanDerWaalsContact C-N 3.3Å; A59-F61 PolarHBondContact O-N 2.83Å; F61-L64 PolarHBondContact O-N 2.84Å; F61-C65 WeakPolarHBondContact CE1-SG 3.21Å; F61-C65 PolarHBondContact O-N 2.92Å; F61-C65 PolarHBondContact O-SG 3.46Å; F61-P145 HydrophobicContact CD2-CB 3.54Å; F61-P145 HydrophobicContact CD2-CG 4.42Å; F61-P145 HydrophobicContact CE2-CB 3.07Å; F61-P145 HydrophobicContact CE2-CG 4.32Å; F61-P145 HydrophobicContact CZ-CB 3.71Å; F61-I146 WeakPolarHBondContact CZ-O 3.48Å
62	S	72	Confident	69.2	Low	63 Å²	63	90.8 Å²	90.8	44%	0.441	48%	0.48	S	S	.	.	H	α-helix	trans	-61.4	-48.5	176.4	-166.1	0	0	0	0	111.2	A58 A59 L64 C65 D66	A58-S62 PolarHBondContact O-N 2.94Å; A59-S62 PolarHBondContact O-N 3.35Å; S62-L64 VanDerWaalsContact C-N 3.32Å; S62-L64 PolarHBondContact O-N 3.39Å; S62-C65 WeakPolarHBondContact O-CB 3.2Å; S62-C65 PolarHBondContact O-N 3.21Å; S62-C65 VanDerWaalsContact O-N 3.13Å; S62-D66 PolarHBondContact O-N 3.5Å
63	V	73.3	Confident	68.4	Low	83 Å²	83	91.6 Å²	91.6	50%	0.503	48%	0.483	S	S	.	.	H	α-helix	trans	-60.6	-42.2	178.1	174.5	0	0	0	0	111.2	A59 L60 C65 D66 I67	A59-V63 WeakPolarHBondContact O-CG2 3.22Å; A59-V63 PolarHBondContact O-N 2.92Å; A59-V63 VanDerWaalsContact O-N 3.17Å; L60-V63 PolarHBondContact O-N 3.4Å; V63-C65 PolarHBondContact O-N 3.13Å; V63-D66 PolarHBondContact O-N 3.08Å; V63-I67 HydrophobicContact CG1-CD1 3.78Å; V63-I67 HydrophobicContact CG1-CG1 4.42Å; V63-I67 VanDerWaalsContact O-CG1 3.26Å; V63-I67 WeakPolarHBondContact O-CG1 3.19Å; V63-I67 PolarHBondContact O-N 3.26Å
64	L	69.1	Low	67.3	Low	92 Å²	92	90.5 Å²	90.5	48%	0.482	48%	0.477	S	S	.	.	H	α-helix	trans	-63.7	-39.1	175.7	-72.9	169.6	0	0	0	112.5	L60 F61 S62 K68 P145	L60-L64 VanDerWaalsContact O-CG 3.3Å; L60-L64 WeakPolarHBondContact O-CG 3.46Å; L60-L64 PolarHBondContact O-N 3.01Å; F61-L64 PolarHBondContact O-N 2.84Å; S62-L64 VanDerWaalsContact C-N 3.32Å; S62-L64 PolarHBondContact O-N 3.39Å; L64-K68 WeakPolarHBondContact O-CB 3.48Å; L64-K68 PolarHBondContact O-N 2.96Å; L64-P145 HydrophobicContact CB-CG 4.11Å; L64-P145 HydrophobicContact CD1-CG 4.46Å
65	C	68.7	Low	66.2	Low	12 Å²	12	93.2 Å²	93.2	8%	0.081	49%	0.493	C	S	.	.	H	α-helix	trans	-62.4	-44.8	174.3	-70.9	0	0	0	0	111.4	F61 S62 V63 K68 E69 T147	F61-C65 WeakPolarHBondContact CE1-SG 3.21Å; F61-C65 PolarHBondContact O-N 2.92Å; F61-C65 PolarHBondContact O-SG 3.46Å; S62-C65 WeakPolarHBondContact O-CB 3.2Å; S62-C65 PolarHBondContact O-N 3.21Å; S62-C65 VanDerWaalsContact O-N 3.13Å; V63-C65 PolarHBondContact O-N 3.13Å; C65-K68 PolarHBondContact O-N 3.33Å; C65-E69 PolarHBondContact O-N 2.93Å; C65-T147 HydrophobicContact CB-CG2 4.41Å
66	D	68.9	Low	64.1	Low	80 Å²	80	90 Å²	90	43%	0.428	48%	0.48	S	S	.	.	H	α-helix	trans	-63.9	-42.8	178.9	-67.9	-13.1	0	0	0	111.7	S62 V63 E69 K70	S62-D66 PolarHBondContact O-N 3.5Å; V63-D66 PolarHBondContact O-N 3.08Å; D66-E69 PolarHBondContact O-N 2.88Å; D66-K70 WeakPolarHBondContact O-CB 3.22Å; D66-K70 VanDerWaalsContact O-CG 3.28Å; D66-K70 WeakPolarHBondContact O-CG 3.23Å; D66-K70 PolarHBondContact O-N 3.36Å
67	I	69.4	Low	62.4	Low	88 Å²	88	91.4 Å²	91.4	45%	0.451	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-43.2	175.6	-68.3	167.5	0	0	0	110.3	V63 E69 K70 T71	V63-I67 HydrophobicContact CG1-CD1 3.78Å; V63-I67 HydrophobicContact CG1-CG1 4.42Å; V63-I67 VanDerWaalsContact O-CG1 3.26Å; V63-I67 WeakPolarHBondContact O-CG1 3.19Å; V63-I67 PolarHBondContact O-N 3.26Å; I67-E69 PolarHBondContact O-N 3.46Å; I67-K70 PolarHBondContact O-N 3.04Å; I67-T71 HydrophobicContact CG2-CG2 4.1Å; I67-T71 WeakPolarHBondContact O-CB 3.41Å; I67-T71 VanDerWaalsContact O-CG2 3.28Å; I67-T71 WeakPolarHBondContact O-CG2 3.3Å; I67-T71 PolarHBondContact O-N 3.41Å; I67-T71 PolarHBondContact O-OG1 2.74Å
68	K	57.6	Low	61.1	Low	31 Å²	31	92.9 Å²	92.9	14%	0.135	51%	0.51	C	S	.	.	H	α-helix	trans	-63.5	-40.3	178.4	-179.8	-179.4	167.6	-162.4	0	112.1	L64 C65 T71 V72 P145 T147 E150	L64-K68 WeakPolarHBondContact O-CB 3.48Å; L64-K68 PolarHBondContact O-N 2.96Å; C65-K68 PolarHBondContact O-N 3.33Å; K68-T71 WeakPolarHBondContact CA-OG1 3.38Å; K68-T71 PolarHBondContact O-OG1 2.94Å; K68-V72 PolarHBondContact O-N 2.89Å; K68-P145 PolarHBondContact NZ-O 3.22Å; K68-T147 HydrophobicContact CD-CG2 3.74Å; K68-T147 HydrophobicContact CG-CG2 4.48Å; K68-E150 IonicContact NZ-OE2 2.84Å; K68-E150 PolarHBondContact NZ-OE2 2.95Å
69	E	60.7	Low	59.6	Low	111 Å²	111	94.9 Å²	94.9	52%	0.519	51%	0.514	S	S	.	.	H	α-helix	trans	-65.1	-41.6	175.7	-178.3	162.2	-176.1	0	0	111.3	C65 D66 I67 K149	C65-E69 PolarHBondContact O-N 2.93Å; D66-E69 PolarHBondContact O-N 2.88Å; I67-E69 PolarHBondContact O-N 3.46Å; E69-K149 IonicContact OE1-NZ 3.25Å; E69-K149 PolarHBondContact OE1-NZ 2.89Å; E69-K149 IonicContact OE2-NZ 2.91Å
70	K	64.7	Low	58.3	Low	174 Å²	174	98.5 Å²	98.5	76%	0.757	53%	0.525	S	S	*	.	H	α-helix	trans	-71.8	-29.1	178.7	-71.9	173.4	-179.9	176.3	0	113.8	D66 I67	D66-K70 WeakPolarHBondContact O-CB 3.22Å; D66-K70 VanDerWaalsContact O-CG 3.28Å; D66-K70 WeakPolarHBondContact O-CG 3.23Å; D66-K70 PolarHBondContact O-N 3.36Å; I67-K70 PolarHBondContact O-N 3.04Å
71	T	62.5	Low	57	Low	70 Å²	70	103.6 Å²	103.6	43%	0.429	55%	0.546	S	S	.	.	H	α-helix	trans	-92.3	-5.3	-175.6	51.6	0	0	0	0	114.1	I67 K68 L73	I67-T71 HydrophobicContact CG2-CG2 4.1Å; I67-T71 WeakPolarHBondContact O-CB 3.41Å; I67-T71 VanDerWaalsContact O-CG2 3.28Å; I67-T71 WeakPolarHBondContact O-CG2 3.3Å; I67-T71 PolarHBondContact O-N 3.41Å; I67-T71 PolarHBondContact O-OG1 2.74Å; K68-T71 WeakPolarHBondContact CA-OG1 3.38Å; K68-T71 PolarHBondContact O-OG1 2.94Å; T71-L73 PolarHBondContact O-N 3.11Å; T71-L73 VanDerWaalsContact O-N 3.13Å
72	V	53	Low	56.1	Low	120 Å²	120	107.5 Å²	107.5	73%	0.727	57%	0.566	S	S	*	*	T	Hydrogen-bonded Turn	trans	54.6	32.2	176.8	-162.6	0	0	0	0	112.8	K68 S74	K68-V72 PolarHBondContact O-N 2.89Å; V72-S74 PolarHBondContact O-N 2.87Å
73	L	47.4	Very low	55.6	Low	88 Å²	88	109.6 Å²	109.6	46%	0.461	58%	0.578	S	S	.	*			trans	-77.6	31.4	177.5	-64.7	173.3	0	0	0	113.1	T71 I75 R144	T71-L73 PolarHBondContact O-N 3.11Å; T71-L73 VanDerWaalsContact O-N 3.13Å; L73-I75 PolarHBondContact O-N 3.32Å; L73-R144 PolarHBondContact O-NH1 3.47Å
74	S	45.7	Very low	55.1	Low	61 Å²	61	109 Å²	109	43%	0.427	58%	0.581	S	S	.	*			trans	-77.1	68.9	179.5	-172.7	0	0	0	0	111.4	V72 R76	V72-S74 PolarHBondContact O-N 2.87Å; S74-R76 PolarHBondContact O-N 2.85Å
75	I	48.9	Very low	55.2	Low	139 Å²	139	108.5 Å²	108.5	71%	0.713	58%	0.579	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	17	176.9	-68.5	160	0	0	0	113.2	L73	L73-I75 PolarHBondContact O-N 3.32Å
76	R	41.5	Very low	55.8	Low	178 Å²	178	112.8 Å²	112.8	67%	0.672	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-132	35.2	178.9	-71.8	-169.6	171	178.2	-4.1	114.1	S74 S78	S74-R76 PolarHBondContact O-N 2.85Å; R76-S78 PolarHBondContact O-N 3.45Å
77	N	42.4	Very low	56.3	Low	138 Å²	138	115.5 Å²	115.5	74%	0.738	62%	0.617	S	S	*	*			trans	-67.1	102.2	144	-83	8.7	0	0	0	106.3
78	S	42.8	Very low	56.6	Low	105 Å²	105	115.8 Å²	115.8	73%	0.734	62%	0.619	S	S	*	*			trans	-93.9	106.2	179.9	31.9	0	0	0	0	106.7	R76	R76-S78 PolarHBondContact O-N 3.45Å
79	T	42.4	Very low	57.6	Low	117 Å²	117	118.8 Å²	118.8	72%	0.718	64%	0.635	S	S	*	*			trans	-164.4	133.8	152.8	25.4	0	0	0	0	104
80	D	49.5	Very low	58.8	Low	139 Å²	139	123 Å²	123	74%	0.743	65%	0.646	S	S	*	*			trans	84.2	106.2	173.2	-43.7	-46.4	0	0	0	113.7	E82	D80-E82 PolarHBondContact O-N 3.48Å
81	E	45.6	Very low	59.6	Low	201 Å²	201	118.4 Å²	118.4	94%	0.939	63%	0.629	S	S	*	*			trans	-58.5	74.2	153.9	-77.6	-84.1	122.5	0	0	106.8	P83	E81-P83 WeakPolarHBondContact O-CD 3.45Å
82	E	51.5	Low	60.4	Low	167 Å²	167	118.6 Å²	118.6	78%	0.78	63%	0.627	S	S	*	*	P	Polyproline II helix	trans	-67.7	119.8	-179.2	-169.5	152.9	178.8	0	0	106.7	D80 A84	D80-E82 PolarHBondContact O-N 3.48Å; E82-A84 PolarHBondContact O-N 3.2Å
83	P	61.2	Low	61.9	Low	108 Å²	108	117.9 Å²	117.9	70%	0.701	62%	0.62	S	S	*	*	P	Polyproline II helix	trans	-52.8	141	-179	21	-33.1	0	0	0	109.5	E81 D85	E81-P83 WeakPolarHBondContact O-CD 3.45Å; P83-D85 PolarHBondContact O-N 2.94Å
84	A	63.2	Low	63.8	Low	69 Å²	69	118.7 Å²	118.7	57%	0.57	62%	0.622	S	S	*	*	P	Polyproline II helix	trans	-46.1	118.2	179.3	0	0	0	0	0	109.9	E82 P86 M89	E82-A84 PolarHBondContact O-N 3.2Å; A84-P86 WeakPolarHBondContact O-CD 3.37Å; A84-P86 VanDerWaalsContact O-N 3.1Å; A84-M89 HydrophobicContact CB-CE 3.81Å
85	D	72.1	Confident	65.5	Low	82 Å²	82	118 Å²	118	44%	0.439	61%	0.613	S	S	.	*	P	Polyproline II helix	trans	-49.1	118.4	-175.2	170.7	7	0	0	0	109.4	P83 Q87 L88 M89	P83-D85 PolarHBondContact O-N 2.94Å; D85-Q87 PolarHBondContact O-N 3.44Å; D85-Q87 VanDerWaalsContact O-N 3.11Å; D85-Q87 WeakPolarHBondContact OD1-CB 3.47Å; D85-Q87 PolarHBondContact OD1-N 3.26Å; D85-L88 HydrophobicContact CB-CB 3.8Å; D85-L88 WeakPolarHBondContact O-CA 3.31Å; D85-L88 WeakPolarHBondContact O-CB 3.35Å; D85-L88 PolarHBondContact O-N 3.27Å; D85-M89 PolarHBondContact O-N 2.89Å
86	P	80.7	Confident	67.1	Low	102 Å²	102	115.1 Å²	115.1	66%	0.662	60%	0.602	S	S	*	*	H	α-helix	trans	-55.1	-31.6	-179.1	-26.8	34.4	0	0	0	112.9	A84 R90	A84-P86 WeakPolarHBondContact O-CD 3.37Å; A84-P86 VanDerWaalsContact O-N 3.1Å; P86-R90 WeakPolarHBondContact O-CB 3.5Å; P86-R90 PolarHBondContact O-N 2.97Å
87	Q	79.3	Confident	68.9	Low	137 Å²	137	110.6 Å²	110.6	64%	0.64	60%	0.603	S	S	*	*	H	α-helix	trans	-70	-44.6	176.3	-169.1	176.7	-80.7	0	0	110.9	D85 R90 L91	D85-Q87 PolarHBondContact O-N 3.44Å; D85-Q87 VanDerWaalsContact O-N 3.11Å; D85-Q87 WeakPolarHBondContact OD1-CB 3.47Å; D85-Q87 PolarHBondContact OD1-N 3.26Å; Q87-R90 WeakPolarHBondContact O-CB 3.28Å; Q87-R90 PolarHBondContact O-N 3.41Å; Q87-L91 HydrophobicContact CG-CD1 4.45Å; Q87-L91 VanDerWaalsContact O-CG 3.29Å; Q87-L91 WeakPolarHBondContact O-CG 3.33Å; Q87-L91 PolarHBondContact O-N 2.8Å
88	L	75.3	Confident	70.8	Confident	94 Å²	94	108.2 Å²	108.2	49%	0.492	59%	0.588	S	S	.	*	H	α-helix	trans	-63.3	-43.5	176.8	-170.1	63	0	0	0	111.5	D85 R90 L91 D92	D85-L88 HydrophobicContact CB-CB 3.8Å; D85-L88 WeakPolarHBondContact O-CA 3.31Å; D85-L88 WeakPolarHBondContact O-CB 3.35Å; D85-L88 PolarHBondContact O-N 3.27Å; L88-R90 VanDerWaalsContact C-N 3.31Å; L88-R90 PolarHBondContact O-N 3.4Å; L88-L91 CarbonylContact O-C 3.35Å; L88-L91 WeakPolarHBondContact O-CB 3.49Å; L88-L91 PolarHBondContact O-N 3.5Å; L88-L91 VanDerWaalsContact O-N 3.11Å; L88-D92 PolarHBondContact O-N 3.26Å
89	M	78.9	Confident	72.4	Confident	95 Å²	95	104.4 Å²	104.4	47%	0.468	57%	0.565	S	S	.	*	H	α-helix	trans	-61.4	-40.2	175.4	-169.4	-173.5	-56.7	0	0	111.7	A84 D85 L91 D92 N93	A84-M89 HydrophobicContact CB-CE 3.81Å; D85-M89 PolarHBondContact O-N 2.89Å; M89-L91 VanDerWaalsContact C-N 3.33Å; M89-D92 PolarHBondContact O-N 3.02Å; M89-N93 WeakPolarHBondContact O-CB 3.47Å; M89-N93 PolarHBondContact O-N 2.95Å; M89-N93 PolarHBondContact O-ND2 3.34Å
90	R	85.7	Confident	74.3	Confident	200 Å²	200	99.3 Å²	99.3	76%	0.755	53%	0.533	S	S	*	.	H	α-helix	trans	-63	-40.6	174.1	-176.1	179.3	179.3	-177.8	0.5	111.5	P86 Q87 L88 M94	P86-R90 WeakPolarHBondContact O-CB 3.5Å; P86-R90 PolarHBondContact O-N 2.97Å; Q87-R90 WeakPolarHBondContact O-CB 3.28Å; Q87-R90 PolarHBondContact O-N 3.41Å; L88-R90 VanDerWaalsContact C-N 3.31Å; L88-R90 PolarHBondContact O-N 3.4Å; R90-M94 WeakPolarHBondContact O-CB 3.31Å; R90-M94 PolarHBondContact O-N 2.93Å
91	L	81.8	Confident	75.5	Confident	76 Å²	76	93.4 Å²	93.4	40%	0.398	50%	0.504	S	S	.	.	H	α-helix	trans	-67.7	-42.5	176.6	-69.4	169.1	0	0	0	111.7	Q87 L88 M89 N93 M94 L95	Q87-L91 HydrophobicContact CG-CD1 4.45Å; Q87-L91 VanDerWaalsContact O-CG 3.29Å; Q87-L91 WeakPolarHBondContact O-CG 3.33Å; Q87-L91 PolarHBondContact O-N 2.8Å; L88-L91 CarbonylContact O-C 3.35Å; L88-L91 WeakPolarHBondContact O-CB 3.49Å; L88-L91 PolarHBondContact O-N 3.5Å; L88-L91 VanDerWaalsContact O-N 3.11Å; M89-L91 VanDerWaalsContact C-N 3.33Å; L91-N93 PolarHBondContact O-N 3.05Å; L91-M94 HydrophobicContact CD2-CE 4.49Å; L91-M94 CarbonylContact O-C 3.58Å; L91-M94 WeakPolarHBondContact O-CA 3.24Å; L91-M94 WeakPolarHBondContact O-CB 3.44Å; L91-M94 PolarHBondContact O-N 3.42Å; L91-M94 VanDerWaalsContact O-N 3.1Å; L91-L95 WeakPolarHBondContact O-CG 3.39Å; L91-L95 PolarHBondContact O-N 3.26Å
92	D	79.3	Confident	76.5	Confident	74 Å²	74	85.9 Å²	85.9	40%	0.396	48%	0.48	S	S	.	.	H	α-helix	trans	-60.7	-46.2	175.4	-81.8	-13.7	0	0	0	111.1	L88 M89 M94 L95 V96	L88-D92 PolarHBondContact O-N 3.26Å; M89-D92 PolarHBondContact O-N 3.02Å; D92-M94 PolarHBondContact O-N 2.92Å; D92-L95 PolarHBondContact O-N 3.37Å; D92-V96 WeakPolarHBondContact O-CB 3.38Å; D92-V96 VanDerWaalsContact O-CG2 3.26Å; D92-V96 WeakPolarHBondContact O-CG2 3.45Å; D92-V96 PolarHBondContact O-N 2.79Å
93	N	84.9	Confident	77	Confident	106 Å²	106	83.6 Å²	83.6	57%	0.567	48%	0.48	S	S	*	.	H	α-helix	trans	-59.8	-37	174.4	-72.2	-27.9	0	0	0	111.8	M89 L91 A97	M89-N93 WeakPolarHBondContact O-CB 3.47Å; M89-N93 PolarHBondContact O-N 2.95Å; M89-N93 PolarHBondContact O-ND2 3.34Å; L91-N93 PolarHBondContact O-N 3.05Å; N93-A97 WeakPolarHBondContact O-CB 3.25Å; N93-A97 PolarHBondContact O-N 3.34Å
94	M	86.1	Confident	76.7	Confident	104 Å²	104	84.5 Å²	84.5	51%	0.512	48%	0.479	S	S	.	.	H	α-helix	trans	-67.7	-45.6	175.8	-166.6	-178.3	87.9	0	0	111.6	R90 L91 D92 V96 A97 E98	R90-M94 WeakPolarHBondContact O-CB 3.31Å; R90-M94 PolarHBondContact O-N 2.93Å; L91-M94 HydrophobicContact CD2-CE 4.49Å; L91-M94 CarbonylContact O-C 3.58Å; L91-M94 WeakPolarHBondContact O-CA 3.24Å; L91-M94 WeakPolarHBondContact O-CB 3.44Å; L91-M94 PolarHBondContact O-N 3.42Å; L91-M94 VanDerWaalsContact O-N 3.1Å; D92-M94 PolarHBondContact O-N 2.92Å; M94-V96 VanDerWaalsContact C-N 3.28Å; M94-V96 PolarHBondContact O-N 3.43Å; M94-A97 PolarHBondContact O-N 2.85Å; M94-E98 WeakPolarHBondContact O-CG 3.32Å; M94-E98 PolarHBondContact O-N 3.42Å
95	L	82.3	Confident	76.1	Confident	46 Å²	46	90.7 Å²	90.7	24%	0.241	49%	0.493	C	S	.	.	H	α-helix	trans	-62.9	-37	177.5	-70.5	174.3	0	0	0	111.9	L91 D92 G99 V100 A101 Y131	L91-L95 WeakPolarHBondContact O-CG 3.39Å; L91-L95 PolarHBondContact O-N 3.26Å; D92-L95 PolarHBondContact O-N 3.37Å; L95-G99 PolarHBondContact O-N 3.31Å; L95-V100 HydrophobicContact CB-CB 4.39Å; L95-V100 HydrophobicContact CD2-CB 3.93Å; L95-V100 HydrophobicContact CD2-CG1 3.93Å; L95-V100 HydrophobicContact CD2-CG2 4.44Å; L95-V100 PolarHBondContact O-N 3.3Å; L95-A101 HydrophobicContact CB-CB 3.87Å; L95-A101 PolarHBondContact O-N 3.36Å; L95-A101 VanDerWaalsContact O-N 3.15Å; L95-Y131 HydrophobicContact CD1-CE2 4.46Å
96	V	81.8	Confident	74.9	Confident	80 Å²	80	89.9 Å²	89.9	49%	0.485	50%	0.504	S	S	.	.	H	α-helix	trans	-66.2	-42.9	174.2	172.1	0	0	0	0	111.1	D92 M94 G99 A101	D92-V96 WeakPolarHBondContact O-CB 3.38Å; D92-V96 VanDerWaalsContact O-CG2 3.26Å; D92-V96 WeakPolarHBondContact O-CG2 3.45Å; D92-V96 PolarHBondContact O-N 2.79Å; M94-V96 VanDerWaalsContact C-N 3.28Å; M94-V96 PolarHBondContact O-N 3.43Å; V96-G99 WeakPolarHBondContact O-CA 3.41Å; V96-G99 PolarHBondContact O-N 3.13Å; V96-G99 VanDerWaalsContact O-N 3.07Å; V96-A101 WeakPolarHBondContact CA-O 3.45Å; V96-A101 HydrophobicContact CG2-CB 4.37Å
97	A	79.1	Confident	73.4	Confident	83 Å²	83	90.8 Å²	90.8	69%	0.686	51%	0.508	S	S	*	.	H	α-helix	trans	-64.4	-40.2	178.3	0	0	0	0	0	112.9	N93 M94 G99	N93-A97 WeakPolarHBondContact O-CB 3.25Å; N93-A97 PolarHBondContact O-N 3.34Å; M94-A97 PolarHBondContact O-N 2.85Å; A97-G99 PolarHBondContact O-N 2.92Å
98	E	83.9	Confident	71.9	Confident	88 Å²	88	88.8 Å²	88.8	41%	0.411	51%	0.506	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-5.1	174.4	-63.6	-65.1	134.4	0	0	112.7	M94 V100 Y120 L124 R128	M94-E98 WeakPolarHBondContact O-CG 3.32Å; M94-E98 PolarHBondContact O-N 3.42Å; E98-V100 HydrophobicContact CB-CG2 4.09Å; E98-V100 PolarHBondContact O-N 3.27Å; E98-Y120 PolarHBondContact OE2-OH 3.23Å; E98-L124 HydrophobicContact CB-CD2 4.45Å; E98-R128 PolarHBondContact O-NH2 3.46Å; E98-R128 VanDerWaalsContact O-NH2 3.08Å
99	G	75.8	Confident	70.8	Confident	25 Å²	25	90.5 Å²	90.5	26%	0.258	52%	0.521	S	S	.	.	T	Hydrogen-bonded Turn	trans	68.1	19.6	-177.5	0	0	0	0	0	113.9	L95 V96 A97 R128	L95-G99 PolarHBondContact O-N 3.31Å; V96-G99 WeakPolarHBondContact O-CA 3.41Å; V96-G99 PolarHBondContact O-N 3.13Å; V96-G99 VanDerWaalsContact O-N 3.07Å; A97-G99 PolarHBondContact O-N 2.92Å; G99-R128 WeakPolarHBondContact O-CD 3.47Å; G99-R128 PolarHBondContact O-NE 2.98Å; G99-R128 PolarHBondContact O-NH2 3.32Å
100	V	81.4	Confident	69.2	Low	9 Å²	9	90.2 Å²	90.2	6%	0.055	53%	0.533	C	S	.	.	S	Bend	trans	-74.7	-35.6	175.1	179.7	0	0	0	0	111.2	L95 E98 L124 I127 R128 Y131	L95-V100 HydrophobicContact CB-CB 4.39Å; L95-V100 HydrophobicContact CD2-CB 3.93Å; L95-V100 HydrophobicContact CD2-CG1 3.93Å; L95-V100 HydrophobicContact CD2-CG2 4.44Å; L95-V100 PolarHBondContact O-N 3.3Å; E98-V100 HydrophobicContact CB-CG2 4.09Å; E98-V100 PolarHBondContact O-N 3.27Å; V100-L124 HydrophobicContact CG2-CD2 3.77Å; V100-I127 HydrophobicContact CG1-CG2 4.04Å; V100-I127 HydrophobicContact CG2-CG2 4.22Å; V100-R128 HydrophobicContact CB-CG 4.47Å; V100-R128 HydrophobicContact CG1-CG 4.47Å; V100-Y131 HydrophobicContact CG1-CD1 4.49Å; V100-Y131 HydrophobicContact CG1-CG 4.29Å
101	A	75.8	Confident	67.4	Low	16 Å²	16	84.9 Å²	84.9	13%	0.132	53%	0.527	C	S	.	.	S	Bend	trans	-125.7	164.2	177.3	0	0	0	0	0	111.5	L95 V96 Y131	L95-A101 HydrophobicContact CB-CB 3.87Å; L95-A101 PolarHBondContact O-N 3.36Å; L95-A101 VanDerWaalsContact O-N 3.15Å; V96-A101 WeakPolarHBondContact CA-O 3.45Å; V96-A101 HydrophobicContact CG2-CB 4.37Å; A101-Y131 HydrophobicContact CB-CE1 4.2Å
102	G	66	Low	65.7	Low	42 Å²	42	89 Å²	89	43%	0.433	55%	0.549	S	S	.	.	S	Bend	trans	105	165.8	175.4	0	0	0	0	0	115.4	N104	G102-N104 VanDerWaalsContact C-N 3.3Å; G102-N104 PolarHBondContact O-N 3.43Å
103	P	63.6	Low	64.5	Low	119 Å²	119	89.2 Å²	89.2	77%	0.773	56%	0.556	S	S	*	*	S	Bend	trans	-72.4	-20.5	-173.1	27.2	-33.9	0	0	0	114	K105	P103-K105 PolarHBondContact O-N 3.11Å; P103-K105 VanDerWaalsContact O-N 3.11Å
104	N	53.6	Low	63.4	Low	127 Å²	127	89.4 Å²	89.4	68%	0.679	57%	0.566	S	S	*	*			trans	-88.7	82.8	-171.8	-66.3	-38.8	0	0	0	110.9	G102 G106	G102-N104 VanDerWaalsContact C-N 3.3Å; G102-N104 PolarHBondContact O-N 3.43Å; N104-G106 PolarHBondContact O-N 3.39Å
105	K	51	Low	62.3	Low	200 Å²	200	89.4 Å²	89.4	87%	0.87	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.2	9.4	178	-74.9	-172.8	175.2	179.8	0	116	P103	P103-K105 PolarHBondContact O-N 3.11Å; P103-K105 VanDerWaalsContact O-N 3.11Å
106	G	47	Very low	61.5	Low	65 Å²	65	93.2 Å²	93.2	67%	0.67	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-173.3	42.6	-165.2	0	0	0	0	0	119.8	N104 P108	N104-G106 PolarHBondContact O-N 3.39Å; G106-P108 VanDerWaalsContact O-CD 3.26Å; G106-P108 WeakPolarHBondContact O-CD 3.32Å
107	T	48.9	Very low	61.2	Low	121 Å²	121	92.9 Å²	92.9	74%	0.742	59%	0.586	S	S	*	*			trans	-89	104.7	159.7	42.1	0	0	0	0	109.5	V109	T107-V109 PolarHBondContact O-N 3.36Å
108	P	48.5	Very low	61.4	Low	94 Å²	94	92 Å²	92	61%	0.61	57%	0.574	S	S	*	*			trans	-74.6	114.9	175	23.4	-12.6	0	0	0	107.5	G106 A110	G106-P108 VanDerWaalsContact O-CD 3.26Å; G106-P108 WeakPolarHBondContact O-CD 3.32Å; P108-A110 VanDerWaalsContact C-N 3.27Å; P108-A110 PolarHBondContact O-N 3.22Å
109	V	51.4	Low	61.4	Low	131 Å²	131	92.4 Å²	92.4	79%	0.794	58%	0.58	S	S	*	*			trans	-67.3	96.2	165.5	-95.3	0	0	0	0	107.8	T107 S111	T107-V109 PolarHBondContact O-N 3.36Å; V109-S111 PolarHBondContact O-N 3.19Å
110	A	45.7	Very low	61.9	Low	89 Å²	89	97.1 Å²	97.1	74%	0.736	59%	0.59	S	S	*	*			trans	-63.3	122.2	169.2	0	0	0	0	0	109.2	P108	P108-A110 VanDerWaalsContact C-N 3.27Å; P108-A110 PolarHBondContact O-N 3.22Å
111	S	47.3	Very low	62	Low	88 Å²	88	104.6 Å²	104.6	62%	0.615	62%	0.618	S	S	*	*			trans	168.5	120.7	142.3	42.3	0	0	0	0	111.4	V109 Q117	V109-S111 PolarHBondContact O-N 3.19Å; S111-Q117 PolarHBondContact O-NE2 3.02Å
112	D	46.5	Very low	62.5	Low	163 Å²	163	106.8 Å²	106.8	87%	0.872	64%	0.635	S	S	*	*	S	Bend	trans	35.8	88.1	145.2	-82.5	-19.6	0	0	0	119
113	S	55	Low	63.7	Low	77 Å²	77	111.2 Å²	111.2	54%	0.538	64%	0.643	S	S	.	*			trans	179	92.2	138.3	-79.1	0	0	0	0	107.8	T115 Q117	S113-T115 VanDerWaalsContact C-N 3.35Å; S113-T115 PolarHBondContact O-N 2.9Å; S113-Q117 VanDerWaalsContact O-CB 3.26Å; S113-Q117 WeakPolarHBondContact O-CB 3.35Å; S113-Q117 WeakPolarHBondContact O-CG 3.34Å; S113-Q117 PolarHBondContact O-N 2.85Å; S113-Q117 VanDerWaalsContact O-N 3.12Å
114	S	61.8	Low	64.7	Low	111 Å²	111	106.5 Å²	106.5	78%	0.776	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	-27	-155.6	52.9	0	0	0	0	116.6
115	T	61.2	Low	66.2	Low	103 Å²	103	102.9 Å²	102.9	63%	0.632	60%	0.599	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	-44.1	-174.5	-10	0	0	0	0	111.6	S113 Q117 S118	S113-T115 VanDerWaalsContact C-N 3.35Å; S113-T115 PolarHBondContact O-N 2.9Å; T115-Q117 VanDerWaalsContact C-N 3.3Å; T115-Q117 PolarHBondContact O-N 3.02Å; T115-S118 PolarHBondContact O-N 2.87Å; T115-S118 PolarHBondContact O-OG 2.94Å; T115-S118 VanDerWaalsContact O-OG 3.11Å
116	D	67	Low	68.1	Low	127 Å²	127	99.8 Å²	99.8	68%	0.679	59%	0.587	S	S	*	*	H	α-helix	trans	-69.2	-29.6	177.8	-69.1	-33	0	0	0	112.2	S118 Y120	D116-S118 PolarHBondContact O-N 3.46Å; D116-Y120 WeakPolarHBondContact O-CB 3.28Å; D116-Y120 PolarHBondContact O-N 3Å; D116-Y120 VanDerWaalsContact O-N 3.11Å
117	Q	74.2	Confident	70	Confident	72 Å²	72	101.1 Å²	101.1	34%	0.336	58%	0.578	S	S	.	*	H	α-helix	trans	-65.1	-36.4	175.3	-91.4	-138	15.7	0	0	113.1	S111 S113 T115 R121	S111-Q117 PolarHBondContact O-NE2 3.02Å; S113-Q117 VanDerWaalsContact O-CB 3.26Å; S113-Q117 WeakPolarHBondContact O-CB 3.35Å; S113-Q117 WeakPolarHBondContact O-CG 3.34Å; S113-Q117 PolarHBondContact O-N 2.85Å; S113-Q117 VanDerWaalsContact O-N 3.12Å; T115-Q117 VanDerWaalsContact C-N 3.3Å; T115-Q117 PolarHBondContact O-N 3.02Å; Q117-R121 WeakPolarHBondContact O-CB 3.37Å; Q117-R121 PolarHBondContact O-N 3.23Å
118	S	82.9	Confident	71.9	Confident	64 Å²	64	99.3 Å²	99.3	45%	0.448	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-44.5	-176.5	70.8	0	0	0	0	110.9	T115 D116 R121 A122	T115-S118 PolarHBondContact O-N 2.87Å; T115-S118 PolarHBondContact O-OG 2.94Å; T115-S118 VanDerWaalsContact O-OG 3.11Å; D116-S118 PolarHBondContact O-N 3.46Å; S118-R121 PolarHBondContact O-N 3.35Å; S118-A122 WeakPolarHBondContact O-CB 3.46Å; S118-A122 PolarHBondContact O-N 3.39Å
119	D	85.4	Confident	73.7	Confident	98 Å²	98	98.6 Å²	98.6	52%	0.524	56%	0.555	S	S	.	*	H	α-helix	trans	-68.4	-40.8	-179.3	-71.4	-3.3	0	0	0	111.1	A122 K123	D119-A122 PolarHBondContact O-N 2.85Å; D119-K123 WeakPolarHBondContact O-CG 3.42Å; D119-K123 PolarHBondContact O-N 3.21Å
120	Y	85.2	Confident	75.5	Confident	123 Å²	123	96.4 Å²	96.4	48%	0.482	54%	0.542	S	S	.	.	H	α-helix	trans	-62.4	-45	174	175.2	-105.7	0	0	0	112	E98 D116 A122 K123 L124	E98-Y120 PolarHBondContact OE2-OH 3.23Å; D116-Y120 WeakPolarHBondContact O-CB 3.28Å; D116-Y120 PolarHBondContact O-N 3Å; D116-Y120 VanDerWaalsContact O-N 3.11Å; Y120-A122 VanDerWaalsContact C-N 3.34Å; Y120-A122 PolarHBondContact O-N 3.34Å; Y120-K123 PolarHBondContact O-N 2.78Å; Y120-L124 HydrophobicContact CD1-CD1 3.9Å; Y120-L124 HydrophobicContact CE1-CD1 3.27Å; Y120-L124 HydrophobicContact CE1-CG 4.33Å; Y120-L124 HydrophobicContact CE2-CD1 4.19Å; Y120-L124 HydrophobicContact CE2-CG 4.48Å; Y120-L124 VanDerWaalsContact CZ-CD1 3.44Å; Y120-L124 PolarHBondContact O-N 3.04Å
121	R	83.6	Confident	77.5	Confident	167 Å²	167	96 Å²	96	63%	0.63	52%	0.522	S	S	*	.	H	α-helix	trans	-64.2	-38.4	177.6	-170.7	177.6	-174.5	169	1.4	112.2	Q117 S118 L124 A125	Q117-R121 WeakPolarHBondContact O-CB 3.37Å; Q117-R121 PolarHBondContact O-N 3.23Å; S118-R121 PolarHBondContact O-N 3.35Å; R121-L124 PolarHBondContact O-N 3.5Å; R121-A125 WeakPolarHBondContact O-CB 3.37Å; R121-A125 PolarHBondContact O-N 3.38Å
122	A	87.6	Confident	79.3	Confident	61 Å²	61	95.9 Å²	95.9	50%	0.504	51%	0.512	S	S	.	.	H	α-helix	trans	-64	-44.8	174.6	0	0	0	0	0	111.5	S118 D119 Y120 L124 A125 Q126	S118-A122 WeakPolarHBondContact O-CB 3.46Å; S118-A122 PolarHBondContact O-N 3.39Å; D119-A122 PolarHBondContact O-N 2.85Å; Y120-A122 VanDerWaalsContact C-N 3.34Å; Y120-A122 PolarHBondContact O-N 3.34Å; A122-L124 PolarHBondContact O-N 2.99Å; A122-A125 PolarHBondContact O-N 2.83Å; A122-Q126 PolarHBondContact O-N 3.48Å
123	K	89.4	Confident	80.9	Confident	136 Å²	136	90 Å²	90	59%	0.591	49%	0.486	S	S	*	.	H	α-helix	trans	-60.8	-43.8	174.4	-73.5	174.3	-176.8	176.2	0	112	D119 Y120 A125 Q126 I127	D119-K123 WeakPolarHBondContact O-CG 3.42Å; D119-K123 PolarHBondContact O-N 3.21Å; Y120-K123 PolarHBondContact O-N 2.78Å; K123-A125 PolarHBondContact O-N 2.99Å; K123-Q126 WeakPolarHBondContact O-CB 3.5Å; K123-Q126 PolarHBondContact O-N 3.22Å; K123-I127 WeakPolarHBondContact O-CG1 3.36Å; K123-I127 PolarHBondContact O-N 3.4Å
124	L	84.8	Confident	82.1	Confident	19 Å²	19	90.5 Å²	90.5	10%	0.099	48%	0.479	C	S	.	.	H	α-helix	trans	-60.4	-41.8	175	-97.1	167.5	0	0	0	112.7	E98 V100 Y120 R121 A122 Q126 I127 R128	E98-L124 HydrophobicContact CB-CD2 4.45Å; V100-L124 HydrophobicContact CG2-CD2 3.77Å; Y120-L124 HydrophobicContact CD1-CD1 3.9Å; Y120-L124 HydrophobicContact CE1-CD1 3.27Å; Y120-L124 HydrophobicContact CE1-CG 4.33Å; Y120-L124 HydrophobicContact CE2-CD1 4.19Å; Y120-L124 HydrophobicContact CE2-CG 4.48Å; Y120-L124 VanDerWaalsContact CZ-CD1 3.44Å; Y120-L124 PolarHBondContact O-N 3.04Å; R121-L124 PolarHBondContact O-N 3.5Å; A122-L124 PolarHBondContact O-N 2.99Å; L124-Q126 VanDerWaalsContact C-N 3.33Å; L124-I127 PolarHBondContact O-N 3.47Å; L124-R128 WeakPolarHBondContact O-CG 3.29Å; L124-R128 PolarHBondContact O-N 3.02Å
125	A	85.2	Confident	82.8	Confident	52 Å²	52	88.6 Å²	88.6	43%	0.43	46%	0.46	S	S	.	.	H	α-helix	trans	-63.4	-40.2	176.5	0	0	0	0	0	111.7	R121 A122 K123 R128 S129	R121-A125 WeakPolarHBondContact O-CB 3.37Å; R121-A125 PolarHBondContact O-N 3.38Å; A122-A125 PolarHBondContact O-N 2.83Å; K123-A125 PolarHBondContact O-N 2.99Å; A125-R128 PolarHBondContact O-N 3.5Å; A125-S129 PolarHBondContact O-N 2.99Å
126	Q	91	Very high	83.2	Confident	134 Å²	134	89.6 Å²	89.6	63%	0.626	46%	0.458	S	S	*	.	H	α-helix	trans	-62.4	-44.3	173.8	-171.6	179.7	6.7	0	0	111.5	A122 K123 L124 R128 S129 V130	A122-Q126 PolarHBondContact O-N 3.48Å; K123-Q126 WeakPolarHBondContact O-CB 3.5Å; K123-Q126 PolarHBondContact O-N 3.22Å; L124-Q126 VanDerWaalsContact C-N 3.33Å; Q126-R128 PolarHBondContact O-N 3.41Å; Q126-S129 WeakPolarHBondContact O-CB 3.36Å; Q126-S129 PolarHBondContact O-N 2.98Å; Q126-V130 WeakPolarHBondContact O-CG2 3.37Å; Q126-V130 PolarHBondContact O-N 3.36Å
127	I	88.3	Confident	83.2	Confident	94 Å²	94	89.3 Å²	89.3	48%	0.482	45%	0.45	S	S	.	.	H	α-helix	trans	-61	-44.4	177.3	-68	165.5	0	0	0	111.2	V100 K123 L124 S129 V130 Y131	V100-I127 HydrophobicContact CG1-CG2 4.04Å; V100-I127 HydrophobicContact CG2-CG2 4.22Å; K123-I127 WeakPolarHBondContact O-CG1 3.36Å; K123-I127 PolarHBondContact O-N 3.4Å; L124-I127 PolarHBondContact O-N 3.47Å; I127-S129 VanDerWaalsContact C-N 3.34Å; I127-S129 PolarHBondContact O-N 3.23Å; I127-V130 PolarHBondContact O-N 3Å; I127-Y131 WeakPolarHBondContact O-CB 3.42Å; I127-Y131 PolarHBondContact O-N 3.23Å
128	R	87.2	Confident	82.4	Confident	82 Å²	82	93.7 Å²	93.7	31%	0.309	47%	0.465	S	S	.	.	H	α-helix	trans	-56.9	-46.8	174.2	-74.4	165.8	-160	-165	-5.4	111.8	E98 G99 V100 L124 A125 Q126 V130 Y131 H132	E98-R128 PolarHBondContact O-NH2 3.46Å; E98-R128 VanDerWaalsContact O-NH2 3.08Å; G99-R128 WeakPolarHBondContact O-CD 3.47Å; G99-R128 PolarHBondContact O-NE 2.98Å; G99-R128 PolarHBondContact O-NH2 3.32Å; V100-R128 HydrophobicContact CB-CG 4.47Å; V100-R128 HydrophobicContact CG1-CG 4.47Å; L124-R128 WeakPolarHBondContact O-CG 3.29Å; L124-R128 PolarHBondContact O-N 3.02Å; A125-R128 PolarHBondContact O-N 3.5Å; Q126-R128 PolarHBondContact O-N 3.41Å; R128-V130 VanDerWaalsContact C-N 3.32Å; R128-V130 PolarHBondContact O-N 3.3Å; R128-Y131 PolarHBondContact O-N 3.42Å; R128-H132 WeakPolarHBondContact O-CB 3.32Å; R128-H132 PolarHBondContact O-CD2 3.39Å; R128-H132 PolarHBondContact O-N 2.9Å
129	S	86.8	Confident	81.2	Confident	80 Å²	80	96.3 Å²	96.3	56%	0.559	47%	0.47	S	S	*	.	H	α-helix	trans	-60.1	-43.6	179	-175.9	0	0	0	0	111.6	A125 Q126 I127 A133	A125-S129 PolarHBondContact O-N 2.99Å; Q126-S129 WeakPolarHBondContact O-CB 3.36Å; Q126-S129 PolarHBondContact O-N 2.98Å; I127-S129 VanDerWaalsContact C-N 3.34Å; I127-S129 PolarHBondContact O-N 3.23Å; S129-A133 WeakPolarHBondContact O-CB 3.3Å; S129-A133 PolarHBondContact O-N 3.45Å
130	V	89.3	Confident	79.6	Confident	85 Å²	85	97 Å²	97	52%	0.515	47%	0.47	S	S	.	.	H	α-helix	trans	-67.1	-46.7	178.5	174.2	0	0	0	0	110.6	Q126 I127 R128 H132 A133 E134	Q126-V130 WeakPolarHBondContact O-CG2 3.37Å; Q126-V130 PolarHBondContact O-N 3.36Å; I127-V130 PolarHBondContact O-N 3Å; R128-V130 VanDerWaalsContact C-N 3.32Å; R128-V130 PolarHBondContact O-N 3.3Å; V130-H132 PolarHBondContact O-N 3.48Å; V130-A133 PolarHBondContact O-N 2.93Å; V130-E134 WeakPolarHBondContact O-CB 3.37Å; V130-E134 PolarHBondContact O-N 3.48Å
131	Y	88.8	Confident	77.9	Confident	80 Å²	80	94.6 Å²	94.6	31%	0.314	47%	0.472	S	S	.	.	H	α-helix	trans	-58.6	-48.5	179.2	175.1	-99.6	0	0	0	112.3	L95 V100 A101 I127 R128 E134 L135	L95-Y131 HydrophobicContact CD1-CE2 4.46Å; V100-Y131 HydrophobicContact CG1-CD1 4.49Å; V100-Y131 HydrophobicContact CG1-CG 4.29Å; A101-Y131 HydrophobicContact CB-CE1 4.2Å; I127-Y131 WeakPolarHBondContact O-CB 3.42Å; I127-Y131 PolarHBondContact O-N 3.23Å; R128-Y131 PolarHBondContact O-N 3.42Å; Y131-E134 PolarHBondContact O-N 2.92Å; Y131-L135 HydrophobicContact CE1-CD2 4.29Å; Y131-L135 WeakPolarHBondContact O-CB 3.4Å; Y131-L135 PolarHBondContact O-N 3.43Å
132	H	83.6	Confident	76.4	Confident	85 Å²	85	96.4 Å²	96.4	39%	0.394	48%	0.479	S	S	.	.	H	α-helix	trans	-69.1	-39.5	-179.6	-73.6	-59.2	0	0	0	112.8	R128 V130 E134 L135 E136	R128-H132 WeakPolarHBondContact O-CB 3.32Å; R128-H132 PolarHBondContact O-CD2 3.39Å; R128-H132 PolarHBondContact O-N 2.9Å; V130-H132 PolarHBondContact O-N 3.48Å; H132-E134 VanDerWaalsContact C-N 3.27Å; H132-E134 PolarHBondContact O-N 3.39Å; H132-L135 PolarHBondContact O-N 3.13Å; H132-E136 PolarHBondContact O-N 3.17Å
133	A	80.2	Confident	74.5	Confident	40 Å²	40	100 Å²	100	33%	0.331	50%	0.495	S	S	.	.	H	α-helix	trans	-61	-39	174.7	0	0	0	0	0	111.5	S129 V130 K137	S129-A133 WeakPolarHBondContact O-CB 3.3Å; S129-A133 PolarHBondContact O-N 3.45Å; V130-A133 PolarHBondContact O-N 2.93Å; A133-K137 VanDerWaalsContact O-CG 3.26Å; A133-K137 WeakPolarHBondContact O-CG 3.39Å; A133-K137 PolarHBondContact O-N 3.4Å
134	E	81.7	Confident	73	Confident	87 Å²	87	97.7 Å²	97.7	41%	0.407	48%	0.482	S	S	.	.	H	α-helix	trans	-71.6	-37	175.9	-116.6	53.4	-154.4	0	0	112.1	V130 Y131 H132 K137 Y138	V130-E134 WeakPolarHBondContact O-CB 3.37Å; V130-E134 PolarHBondContact O-N 3.48Å; Y131-E134 PolarHBondContact O-N 2.92Å; H132-E134 VanDerWaalsContact C-N 3.27Å; H132-E134 PolarHBondContact O-N 3.39Å; E134-K137 WeakPolarHBondContact O-CB 3.3Å; E134-K137 PolarHBondContact O-N 2.91Å; E134-K137 IonicContact OE1-NZ 2.77Å; E134-K137 PolarHBondContact OE1-NZ 3.34Å; E134-K137 IonicContact OE2-NZ 3.72Å; E134-K137 PolarHBondContact OE2-NZ 3.34Å; E134-Y138 WeakPolarHBondContact O-CD2 3.39Å; E134-Y138 PolarHBondContact O-N 2.93Å
135	L	75.8	Confident	71.8	Confident	71 Å²	71	98.2 Å²	98.2	37%	0.372	49%	0.487	S	S	.	.	H	α-helix	trans	-65.5	-44.3	177.3	-170.5	68.2	0	0	0	112.1	Y131 H132 K137 Y138 E139	Y131-L135 HydrophobicContact CE1-CD2 4.29Å; Y131-L135 WeakPolarHBondContact O-CB 3.4Å; Y131-L135 PolarHBondContact O-N 3.43Å; H132-L135 PolarHBondContact O-N 3.13Å; L135-K137 VanDerWaalsContact C-N 3.33Å; L135-K137 PolarHBondContact O-N 2.99Å; L135-Y138 WeakPolarHBondContact O-CA 3.4Å; L135-Y138 WeakPolarHBondContact O-CB 3.29Å; L135-Y138 PolarHBondContact O-N 3.09Å; L135-E139 PolarHBondContact O-N 3.47Å
136	E	68.6	Low	70.6	Confident	124 Å²	124	98.9 Å²	98.9	58%	0.579	48%	0.482	S	S	*	.	H	α-helix	trans	-61.2	-41.3	176.1	-78	-173.9	167.4	0	0	111.8	H132 Y138 E139 Q140	H132-E136 PolarHBondContact O-N 3.17Å; E136-Y138 PolarHBondContact O-N 3.4Å; E136-E139 PolarHBondContact O-N 3.33Å; E136-Q140 WeakPolarHBondContact O-CG 3.32Å; E136-Q140 PolarHBondContact O-N 3.28Å
137	K	68.2	Low	69.7	Low	121 Å²	121	93.6 Å²	93.6	53%	0.526	46%	0.459	S	S	.	.	H	α-helix	trans	-57.6	-36.9	173.3	-72.1	169.2	-172.2	162.2	0	111.7	A133 E134 L135	A133-K137 VanDerWaalsContact O-CG 3.26Å; A133-K137 WeakPolarHBondContact O-CG 3.39Å; A133-K137 PolarHBondContact O-N 3.4Å; E134-K137 WeakPolarHBondContact O-CB 3.3Å; E134-K137 PolarHBondContact O-N 2.91Å; E134-K137 IonicContact OE1-NZ 2.77Å; E134-K137 PolarHBondContact OE1-NZ 3.34Å; E134-K137 IonicContact OE2-NZ 3.72Å; E134-K137 PolarHBondContact OE2-NZ 3.34Å; L135-K137 VanDerWaalsContact C-N 3.33Å; L135-K137 PolarHBondContact O-N 2.99Å
138	Y	58	Low	69.1	Low	165 Å²	165	92.6 Å²	92.6	65%	0.647	46%	0.459	S	S	*	.	H	α-helix	trans	-72.5	-43.5	176.5	-96.2	-80.6	0	0	0	112.7	E134 L135 E136 S141	E134-Y138 WeakPolarHBondContact O-CD2 3.39Å; E134-Y138 PolarHBondContact O-N 2.93Å; L135-Y138 WeakPolarHBondContact O-CA 3.4Å; L135-Y138 WeakPolarHBondContact O-CB 3.29Å; L135-Y138 PolarHBondContact O-N 3.09Å; E136-Y138 PolarHBondContact O-N 3.4Å; Y138-S141 WeakPolarHBondContact O-CB 3.41Å; Y138-S141 PolarHBondContact O-N 3.24Å; Y138-S141 PolarHBondContact O-OG 2.96Å
139	E	56	Low	68.5	Low	119 Å²	119	94 Å²	94	56%	0.556	47%	0.467	S	S	*	.	H	α-helix	trans	-67	-38.4	-178.3	-71.8	-162.6	136.6	0	0	113.1	L135 E136 S141 R142	L135-E139 PolarHBondContact O-N 3.47Å; E136-E139 PolarHBondContact O-N 3.33Å; E139-S141 PolarHBondContact O-N 3.49Å; E139-S141 VanDerWaalsContact O-N 3.07Å; E139-R142 WeakPolarHBondContact O-CB 3.38Å; E139-R142 WeakPolarHBondContact O-CG 3.39Å; E139-R142 PolarHBondContact O-N 3.45Å; E139-R142 VanDerWaalsContact O-N 3.09Å
140	Q	52.1	Low	67.9	Low	112 Å²	112	91.8 Å²	91.8	52%	0.523	45%	0.448	S	S	.	.	G	3₁₀ helix	trans	-59.4	-20.8	175	-72.4	176.6	-6	0	0	112.7	E136 R142	E136-Q140 WeakPolarHBondContact O-CG 3.32Å; E136-Q140 PolarHBondContact O-N 3.28Å; Q140-R142 VanDerWaalsContact C-N 3.27Å; Q140-R142 PolarHBondContact O-N 3.33Å
141	S	49.5	Very low	67.3	Low	73 Å²	73	91.8 Å²	91.8	51%	0.51	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-75.6	-5.2	177.5	81	0	0	0	0	115	Y138 E139 T143	Y138-S141 WeakPolarHBondContact O-CB 3.41Å; Y138-S141 PolarHBondContact O-N 3.24Å; Y138-S141 PolarHBondContact O-OG 2.96Å; E139-S141 PolarHBondContact O-N 3.49Å; E139-S141 VanDerWaalsContact O-N 3.07Å; S141-T143 PolarHBondContact O-N 3.12Å
142	R	51.5	Low	67	Low	205 Å²	205	93.5 Å²	93.5	77%	0.774	46%	0.455	S	S	*	.	G	3₁₀ helix	trans	-74.2	-15.8	-171.3	-68.1	-175.1	72.8	178.2	2.4	115.5	E139 Q140 R144	E139-R142 WeakPolarHBondContact O-CB 3.38Å; E139-R142 WeakPolarHBondContact O-CG 3.39Å; E139-R142 PolarHBondContact O-N 3.45Å; E139-R142 VanDerWaalsContact O-N 3.09Å; Q140-R142 VanDerWaalsContact C-N 3.27Å; Q140-R142 PolarHBondContact O-N 3.33Å; R142-R144 PolarHBondContact O-N 3.35Å
143	T	48.6	Very low	66.7	Low	137 Å²	137	94.9 Å²	94.9	84%	0.84	46%	0.457	S	S	*	.	S	Bend	trans	-91.1	79	170.3	-43.7	0	0	0	0	109.6	S141	S141-T143 PolarHBondContact O-N 3.12Å
144	R	58.9	Low	66.5	Low	86 Å²	86	97.1 Å²	97.1	33%	0.325	46%	0.461	S	S	.	.			trans	-104.3	146.7	-173.6	77.8	-178.6	-173	-177.7	1.9	114	L73 R142	L73-R144 PolarHBondContact O-NH1 3.47Å; R142-R144 PolarHBondContact O-N 3.35Å
145	P	58.6	Low	66.4	Low	31 Å²	31	95.3 Å²	95.3	20%	0.201	46%	0.456	C	S	.	.	P	Polyproline II helix	trans	-63.3	141.2	171.5	23	-31.3	0	0	0	113.2	F61 L64 K68	F61-P145 HydrophobicContact CD2-CB 3.54Å; F61-P145 HydrophobicContact CD2-CG 4.42Å; F61-P145 HydrophobicContact CE2-CB 3.07Å; F61-P145 HydrophobicContact CE2-CG 4.32Å; F61-P145 HydrophobicContact CZ-CB 3.71Å; L64-P145 HydrophobicContact CB-CG 4.11Å; L64-P145 HydrophobicContact CD1-CG 4.46Å; K68-P145 PolarHBondContact NZ-O 3.22Å
146	I	61.2	Low	66.7	Low	66 Å²	66	98 Å²	98	34%	0.338	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-79.6	125.5	173	-55.5	176	0	0	0	107.5	F61 E150 I151	F61-I146 WeakPolarHBondContact CZ-O 3.48Å; I146-E150 HydrophobicContact CG2-CB 3.82Å; I146-E150 HydrophobicContact CG2-CG 3.81Å; I146-I151 HydrophobicContact CG2-CD1 4.49Å; I146-I151 HydrophobicContact CG2-CG1 3.71Å
147	T	70.8	Confident	67.5	Low	22 Å²	22	96.5 Å²	96.5	14%	0.135	46%	0.462	C	S	.	.	P	Polyproline II helix	trans	-77.3	152.7	-178.8	49.3	0	0	0	0	110.9	C65 K68 K149 E150 I151	C65-T147 HydrophobicContact CB-CG2 4.41Å; K68-T147 HydrophobicContact CD-CG2 3.74Å; K68-T147 HydrophobicContact CG-CG2 4.48Å; T147-K149 PolarHBondContact O-N 2.99Å; T147-E150 WeakPolarHBondContact O-CA 3.49Å; T147-E150 WeakPolarHBondContact O-CB 3.41Å; T147-E150 PolarHBondContact O-N 2.8Å; T147-I151 PolarHBondContact O-N 3.4Å; T147-I151 VanDerWaalsContact O-N 3.1Å
148	P	75.9	Confident	68	Low	74 Å²	74	93.2 Å²	93.2	48%	0.481	45%	0.45	S	S	.	.	H	α-helix	trans	-51.9	-41.4	175.8	-28.3	35.5	0	0	0	113.3	E150 I151 E152	P148-E150 VanDerWaalsContact C-N 3.27Å; P148-E150 PolarHBondContact O-N 3.49Å; P148-I151 WeakPolarHBondContact O-CB 3.42Å; P148-I151 PolarHBondContact O-N 2.93Å; P148-I151 VanDerWaalsContact O-N 3.12Å; P148-E152 WeakPolarHBondContact O-CG 3.29Å; P148-E152 PolarHBondContact O-N 3.15Å
149	K	74.2	Confident	69.4	Low	111 Å²	111	90.9 Å²	90.9	48%	0.483	44%	0.444	S	S	.	.	H	α-helix	trans	-61.6	-30.5	175.2	-59.4	-175.3	-175.6	178.4	0	113.7	E69 T147 R153	E69-K149 IonicContact OE1-NZ 3.25Å; E69-K149 PolarHBondContact OE1-NZ 2.89Å; E69-K149 IonicContact OE2-NZ 2.91Å; T147-K149 PolarHBondContact O-N 2.99Å; K149-R153 WeakPolarHBondContact O-CG 3.35Å; K149-R153 PolarHBondContact O-N 3.32Å; K149-R153 PolarHBondContact O-NE 3.34Å
150	E	74.7	Confident	70.7	Confident	34 Å²	34	93.2 Å²	93.2	16%	0.159	45%	0.453	C	S	.	.	H	α-helix	trans	-74	-40.9	175.4	-171.9	169.7	-170.2	0	0	110.4	K68 I146 T147 P148 R153 M154	K68-E150 IonicContact NZ-OE2 2.84Å; K68-E150 PolarHBondContact NZ-OE2 2.95Å; I146-E150 HydrophobicContact CG2-CB 3.82Å; I146-E150 HydrophobicContact CG2-CG 3.81Å; T147-E150 WeakPolarHBondContact O-CA 3.49Å; T147-E150 WeakPolarHBondContact O-CB 3.41Å; T147-E150 PolarHBondContact O-N 2.8Å; P148-E150 VanDerWaalsContact C-N 3.27Å; P148-E150 PolarHBondContact O-N 3.49Å; E150-R153 PolarHBondContact O-N 2.94Å; E150-M154 VanDerWaalsContact O-CG 3.31Å; E150-M154 WeakPolarHBondContact O-CG 3.25Å; E150-M154 PolarHBondContact O-N 3.34Å
151	I	76.7	Confident	72.3	Confident	85 Å²	85	94.4 Å²	94.4	44%	0.436	46%	0.456	S	S	.	.	H	α-helix	trans	-60.2	-48.3	172.6	-58.3	174.1	0	0	0	110.5	I146 T147 P148 R153 M154 V155	I146-I151 HydrophobicContact CG2-CD1 4.49Å; I146-I151 HydrophobicContact CG2-CG1 3.71Å; T147-I151 PolarHBondContact O-N 3.4Å; T147-I151 VanDerWaalsContact O-N 3.1Å; P148-I151 WeakPolarHBondContact O-CB 3.42Å; P148-I151 PolarHBondContact O-N 2.93Å; P148-I151 VanDerWaalsContact O-N 3.12Å; I151-R153 PolarHBondContact O-N 2.95Å; I151-M154 WeakPolarHBondContact O-CB 3.31Å; I151-M154 PolarHBondContact O-N 3.38Å; I151-M154 VanDerWaalsContact O-N 3.15Å; I151-V155 HydrophobicContact CG2-CG2 4.29Å; I151-V155 VanDerWaalsContact O-CG2 3.3Å; I151-V155 WeakPolarHBondContact O-CG2 3.41Å; I151-V155 PolarHBondContact O-N 3.1Å
152	E	82.9	Confident	74	Confident	115 Å²	115	94.7 Å²	94.7	54%	0.537	45%	0.448	S	S	.	.	H	α-helix	trans	-57.8	-44.9	178.6	-73.8	169.9	-163.5	0	0	112.3	P148 V155 Q156	P148-E152 WeakPolarHBondContact O-CG 3.29Å; P148-E152 PolarHBondContact O-N 3.15Å; E152-V155 PolarHBondContact O-N 3.45Å; E152-Q156 WeakPolarHBondContact O-CG 3.38Å; E152-Q156 PolarHBondContact O-N 2.94Å
153	R	78	Confident	75.6	Confident	115 Å²	115	88.2 Å²	88.2	43%	0.434	43%	0.434	S	S	.	.	H	α-helix	trans	-61.4	-44.7	174.7	-78.3	-173.9	-67.2	146.6	-2.9	112	K149 E150 I151 V155 Q156 I157	K149-R153 WeakPolarHBondContact O-CG 3.35Å; K149-R153 PolarHBondContact O-N 3.32Å; K149-R153 PolarHBondContact O-NE 3.34Å; E150-R153 PolarHBondContact O-N 2.94Å; I151-R153 PolarHBondContact O-N 2.95Å; R153-V155 VanDerWaalsContact C-N 3.33Å; R153-V155 PolarHBondContact O-N 3.19Å; R153-Q156 PolarHBondContact O-N 3.38Å; R153-I157 WeakPolarHBondContact O-CG1 3.49Å; R153-I157 PolarHBondContact O-N 3.37Å
154	M	74	Confident	77.4	Confident	86 Å²	86	84 Å²	84	42%	0.424	41%	0.414	S	S	.	.	H	α-helix	trans	-59.5	-45.8	176.2	-71.3	178.5	70.6	0	0	111.1	E150 I151 Q156 I157 I158	E150-M154 VanDerWaalsContact O-CG 3.31Å; E150-M154 WeakPolarHBondContact O-CG 3.25Å; E150-M154 PolarHBondContact O-N 3.34Å; I151-M154 WeakPolarHBondContact O-CB 3.31Å; I151-M154 PolarHBondContact O-N 3.38Å; I151-M154 VanDerWaalsContact O-N 3.15Å; M154-Q156 VanDerWaalsContact C-N 3.33Å; M154-Q156 PolarHBondContact O-N 2.88Å; M154-I157 WeakPolarHBondContact O-CB 3.33Å; M154-I157 PolarHBondContact O-N 2.75Å; M154-I158 WeakPolarHBondContact O-CD1 3.12Å; M154-I158 VanDerWaalsContact O-CG1 3.27Å; M154-I158 WeakPolarHBondContact O-CG1 3.29Å; M154-I158 PolarHBondContact O-N 3.03Å
155	V	81.3	Confident	78.6	Confident	50 Å²	50	83.7 Å²	83.7	30%	0.303	42%	0.418	S	S	.	.	H	α-helix	trans	-58.1	-43.2	176.3	169.4	0	0	0	0	111.4	I151 E152 R153 I158 H159	I151-V155 HydrophobicContact CG2-CG2 4.29Å; I151-V155 VanDerWaalsContact O-CG2 3.3Å; I151-V155 WeakPolarHBondContact O-CG2 3.41Å; I151-V155 PolarHBondContact O-N 3.1Å; E152-V155 PolarHBondContact O-N 3.45Å; R153-V155 VanDerWaalsContact C-N 3.33Å; R153-V155 PolarHBondContact O-N 3.19Å; V155-I158 PolarHBondContact O-N 3.29Å; V155-H159 WeakPolarHBondContact CG1-CE1 3.11Å; V155-H159 PolarHBondContact O-N 2.91Å; V155-H159 PolarHBondContact O-ND1 3.1Å; V155-H159 VanDerWaalsContact O-ND1 3.09Å
156	Q	81.4	Confident	79.9	Confident	127 Å²	127	86.2 Å²	86.2	59%	0.593	43%	0.427	S	S	*	.	H	α-helix	trans	-62.9	-43.1	175.3	-70.6	171.6	8.4	0	0	112.7	E152 R153 M154 I158 H159 K160	E152-Q156 WeakPolarHBondContact O-CG 3.38Å; E152-Q156 PolarHBondContact O-N 2.94Å; R153-Q156 PolarHBondContact O-N 3.38Å; M154-Q156 VanDerWaalsContact C-N 3.33Å; M154-Q156 PolarHBondContact O-N 2.88Å; Q156-I158 PolarHBondContact O-N 2.89Å; Q156-H159 PolarHBondContact O-N 3.48Å; Q156-K160 PolarHBondContact O-N 2.87Å
157	I	84.9	Confident	80.9	Confident	92 Å²	92	89.4 Å²	89.4	47%	0.472	44%	0.442	S	S	.	.	H	α-helix	trans	-59.2	-40.3	175.6	-68.4	165.5	0	0	0	110.3	R153 M154 K160 K161	R153-I157 WeakPolarHBondContact O-CG1 3.49Å; R153-I157 PolarHBondContact O-N 3.37Å; M154-I157 WeakPolarHBondContact O-CB 3.33Å; M154-I157 PolarHBondContact O-N 2.75Å; I157-K160 PolarHBondContact O-N 2.97Å; I157-K161 HydrophobicContact CG2-CD 4.32Å; I157-K161 WeakPolarHBondContact O-CG 3.46Å; I157-K161 PolarHBondContact O-N 3.1Å
158	I	79.1	Confident	81.8	Confident	53 Å²	53	95 Å²	95	27%	0.272	47%	0.466	S	S	.	.	H	α-helix	trans	-68.9	-46.1	179.6	-67.1	151.9	0	0	0	111.2	M154 V155 Q156 K160 K161 F162 F338	M154-I158 WeakPolarHBondContact O-CD1 3.12Å; M154-I158 VanDerWaalsContact O-CG1 3.27Å; M154-I158 WeakPolarHBondContact O-CG1 3.29Å; M154-I158 PolarHBondContact O-N 3.03Å; V155-I158 PolarHBondContact O-N 3.29Å; Q156-I158 PolarHBondContact O-N 2.89Å; I158-K160 PolarHBondContact O-N 3.03Å; I158-K161 PolarHBondContact O-N 3.45Å; I158-K161 VanDerWaalsContact O-N 3.14Å; I158-F162 VanDerWaalsContact O-CB 3.29Å; I158-F162 WeakPolarHBondContact O-CB 3.39Å; I158-F162 PolarHBondContact O-N 2.85Å; I158-F338 HydrophobicContact CD1-CD2 3.89Å; I158-F338 HydrophobicContact CD1-CE1 3.86Å; I158-F338 HydrophobicContact CD1-CE2 3Å; I158-F338 HydrophobicContact CD1-CZ 2.99Å; I158-F338 HydrophobicContact CG1-CE2 4.08Å; I158-F338 HydrophobicContact CG1-CZ 4.37Å
159	H	86.9	Confident	82.4	Confident	116 Å²	116	96.4 Å²	96.4	54%	0.537	47%	0.469	S	S	.	.	H	α-helix	trans	-55.7	-43.1	174.4	-71.6	128.5	0	0	0	111.2	V155 Q156 F162 S163	V155-H159 WeakPolarHBondContact CG1-CE1 3.11Å; V155-H159 PolarHBondContact O-N 2.91Å; V155-H159 PolarHBondContact O-ND1 3.1Å; V155-H159 VanDerWaalsContact O-ND1 3.09Å; Q156-H159 PolarHBondContact O-N 3.48Å; H159-F162 WeakPolarHBondContact O-CB 3.3Å; H159-F162 PolarHBondContact O-N 3.44Å; H159-S163 PolarHBondContact O-N 3.17Å; H159-S163 PolarHBondContact O-OG 3.36Å; H159-S163 VanDerWaalsContact O-OG 3.13Å
160	K	84.4	Confident	82.9	Confident	167 Å²	167	96.9 Å²	96.9	73%	0.726	47%	0.472	S	S	*	.	H	α-helix	trans	-62.1	-45.8	175.8	-172.8	176.2	-179.3	176.9	0	112.4	Q156 I157 I158 F162 S163 A164	Q156-K160 PolarHBondContact O-N 2.87Å; I157-K160 PolarHBondContact O-N 2.97Å; I158-K160 PolarHBondContact O-N 3.03Å; K160-F162 VanDerWaalsContact C-N 3.33Å; K160-S163 PolarHBondContact O-N 2.86Å; K160-A164 PolarHBondContact O-N 3.34Å
161	K	84.4	Confident	83.6	Confident	137 Å²	137	100.4 Å²	100.4	60%	0.596	49%	0.488	S	S	*	.	H	α-helix	trans	-62.1	-41.6	175.5	-75.1	-176.1	176.4	-172.5	0	111.5	I157 I158 A164 I165	I157-K161 HydrophobicContact CG2-CD 4.32Å; I157-K161 WeakPolarHBondContact O-CG 3.46Å; I157-K161 PolarHBondContact O-N 3.1Å; I158-K161 PolarHBondContact O-N 3.45Å; I158-K161 VanDerWaalsContact O-N 3.14Å; K161-A164 PolarHBondContact O-N 2.87Å; K161-I165 WeakPolarHBondContact O-CG1 3.34Å; K161-I165 PolarHBondContact O-N 3.28Å
162	F	86.8	Confident	84.1	Confident	79 Å²	79	98.6 Å²	98.6	35%	0.346	48%	0.483	S	S	.	.	H	α-helix	trans	-62.7	-47.3	178.2	-174.6	-93.8	0	0	0	111.4	I158 H159 K160 A164 I165 Q166 N331	I158-F162 VanDerWaalsContact O-CB 3.29Å; I158-F162 WeakPolarHBondContact O-CB 3.39Å; I158-F162 PolarHBondContact O-N 2.85Å; H159-F162 WeakPolarHBondContact O-CB 3.3Å; H159-F162 PolarHBondContact O-N 3.44Å; K160-F162 VanDerWaalsContact C-N 3.33Å; F162-A164 VanDerWaalsContact C-N 3.3Å; F162-A164 PolarHBondContact O-N 2.95Å; F162-I165 PolarHBondContact O-N 3.24Å; F162-Q166 WeakPolarHBondContact O-CB 3.42Å; F162-Q166 PolarHBondContact O-N 2.94Å; F162-N331 WeakPolarHBondContact CE2-OD1 3.48Å; F162-N331 WeakPolarHBondContact CZ-OD1 3.34Å
163	S	84.2	Confident	84.1	Confident	69 Å²	69	95.3 Å²	95.3	48%	0.483	47%	0.471	S	S	.	.	H	α-helix	trans	-60.6	-38.7	174.9	-61.8	0	0	0	0	112.4	H159 K160 Q166 M167	H159-S163 PolarHBondContact O-N 3.17Å; H159-S163 PolarHBondContact O-OG 3.36Å; H159-S163 VanDerWaalsContact O-OG 3.13Å; K160-S163 PolarHBondContact O-N 2.86Å; S163-Q166 PolarHBondContact O-N 2.82Å; S163-M167 WeakPolarHBondContact O-CB 3.28Å; S163-M167 PolarHBondContact O-N 2.81Å
164	A	86	Confident	84.4	Confident	50 Å²	50	93.2 Å²	93.2	41%	0.413	47%	0.473	S	S	.	.	H	α-helix	trans	-64.6	-45.9	176.2	0	0	0	0	0	112	K160 K161 F162 M167 Q168	K160-A164 PolarHBondContact O-N 3.34Å; K161-A164 PolarHBondContact O-N 2.87Å; F162-A164 VanDerWaalsContact C-N 3.3Å; F162-A164 PolarHBondContact O-N 2.95Å; A164-M167 PolarHBondContact O-N 3.28Å; A164-Q168 WeakPolarHBondContact O-CB 3.49Å; A164-Q168 PolarHBondContact O-N 3.48Å
165	I	84.4	Confident	85	Confident	78 Å²	78	93.6 Å²	93.6	40%	0.4	47%	0.474	S	S	.	.	H	α-helix	trans	-61.5	-45.4	175.4	-67.9	166.7	0	0	0	110.4	K161 F162 M167 Q168 L169	K161-I165 WeakPolarHBondContact O-CG1 3.34Å; K161-I165 PolarHBondContact O-N 3.28Å; F162-I165 PolarHBondContact O-N 3.24Å; I165-M167 VanDerWaalsContact C-N 3.28Å; I165-M167 PolarHBondContact O-N 2.92Å; I165-Q168 PolarHBondContact O-N 3.27Å; I165-Q168 VanDerWaalsContact O-N 3.17Å; I165-L169 HydrophobicContact CG2-CD1 3.99Å; I165-L169 HydrophobicContact CG2-CG 4.36Å; I165-L169 WeakPolarHBondContact O-CG 3.39Å; I165-L169 PolarHBondContact O-N 2.82Å
166	Q	85	Confident	85.3	Confident	84 Å²	84	93.5 Å²	93.5	39%	0.393	48%	0.478	S	S	.	.	H	α-helix	trans	-58.3	-42.7	177.4	-172.7	-170	-1.2	0	0	111.2	F162 S163 K170	F162-Q166 WeakPolarHBondContact O-CB 3.42Å; F162-Q166 PolarHBondContact O-N 2.94Å; S163-Q166 PolarHBondContact O-N 2.82Å; Q166-K170 WeakPolarHBondContact O-CB 3.42Å; Q166-K170 VanDerWaalsContact O-CG 3.29Å; Q166-K170 WeakPolarHBondContact O-CG 3.5Å; Q166-K170 PolarHBondContact O-N 3.02Å
167	M	82.6	Confident	85.4	Confident	134 Å²	134	91.6 Å²	91.6	66%	0.66	48%	0.475	S	S	*	.	H	α-helix	trans	-64.7	-44.1	176.4	-171.1	178.9	72.7	0	0	111.5	S163 A164 I165 L169 K170 Q171	S163-M167 WeakPolarHBondContact O-CB 3.28Å; S163-M167 PolarHBondContact O-N 2.81Å; A164-M167 PolarHBondContact O-N 3.28Å; I165-M167 VanDerWaalsContact C-N 3.28Å; I165-M167 PolarHBondContact O-N 2.92Å; M167-L169 PolarHBondContact O-N 3.18Å; M167-K170 PolarHBondContact O-N 3.42Å; M167-Q171 WeakPolarHBondContact O-CB 3.28Å; M167-Q171 PolarHBondContact O-N 3.26Å
168	Q	89.2	Confident	85.3	Confident	138 Å²	138	93.8 Å²	93.8	65%	0.645	49%	0.485	S	S	*	.	H	α-helix	trans	-62.5	-42	178.2	-171.1	177	6.7	0	0	112.1	A164 I165 Q171 S172	A164-Q168 WeakPolarHBondContact O-CB 3.49Å; A164-Q168 PolarHBondContact O-N 3.48Å; I165-Q168 PolarHBondContact O-N 3.27Å; I165-Q168 VanDerWaalsContact O-N 3.17Å; Q168-Q171 PolarHBondContact O-N 3.31Å; Q168-S172 WeakPolarHBondContact O-CB 3.2Å; Q168-S172 PolarHBondContact O-N 3.29Å
169	L	88.5	Confident	85.8	Confident	104 Å²	104	95.8 Å²	95.8	55%	0.545	50%	0.495	S	S	.	.	H	α-helix	trans	-64	-43.7	175.3	-73.3	172.8	0	0	0	111.8	I165 M167 T173	I165-L169 HydrophobicContact CG2-CD1 3.99Å; I165-L169 HydrophobicContact CG2-CG 4.36Å; I165-L169 WeakPolarHBondContact O-CG 3.39Å; I165-L169 PolarHBondContact O-N 2.82Å; M167-L169 PolarHBondContact O-N 3.18Å; L169-T173 WeakPolarHBondContact O-CB 3.27Å; L169-T173 PolarHBondContact O-N 2.76Å; L169-T173 PolarHBondContact O-OG1 3.05Å
170	K	84.7	Confident	85.8	Confident	122 Å²	122	94.9 Å²	94.9	53%	0.53	49%	0.493	S	S	.	.	H	α-helix	trans	-59.9	-46	174.7	-75.5	175.6	177.5	-177.7	0	111.4	Q166 M167 T173 C174	Q166-K170 WeakPolarHBondContact O-CB 3.42Å; Q166-K170 VanDerWaalsContact O-CG 3.29Å; Q166-K170 WeakPolarHBondContact O-CG 3.5Å; Q166-K170 PolarHBondContact O-N 3.02Å; M167-K170 PolarHBondContact O-N 3.42Å; K170-T173 PolarHBondContact O-N 3.27Å; K170-C174 PolarHBondContact O-N 3.45Å; K170-C174 PolarHBondContact O-SG 3.38Å; K170-C174 VanDerWaalsContact O-SG 3.34Å
171	Q	89.7	Confident	85.5	Confident	108 Å²	108	95.5 Å²	95.5	51%	0.505	49%	0.491	S	S	.	.	H	α-helix	trans	-60.9	-51.6	178.9	-177.4	60.9	29.1	0	0	111.6	M167 Q168 T173 C174 E175	M167-Q171 WeakPolarHBondContact O-CB 3.28Å; M167-Q171 PolarHBondContact O-N 3.26Å; Q168-Q171 PolarHBondContact O-N 3.31Å; Q171-T173 VanDerWaalsContact C-N 3.27Å; Q171-T173 PolarHBondContact O-N 2.95Å; Q171-C174 PolarHBondContact O-N 2.78Å; Q171-C174 VanDerWaalsContact O-N 3.15Å; Q171-E175 WeakPolarHBondContact CG-OE1 3.3Å; Q171-E175 PolarHBondContact NE2-OE1 3.45Å; Q171-E175 WeakPolarHBondContact O-CG 3.46Å; Q171-E175 PolarHBondContact O-N 3.13Å
172	S	88.5	Confident	85.5	Confident	47 Å²	47	92 Å²	92	33%	0.329	48%	0.484	S	S	.	.	H	α-helix	trans	-59.2	-38.8	178.1	-179.5	0	0	0	0	112.2	Q168 E175 A176	Q168-S172 WeakPolarHBondContact O-CB 3.2Å; Q168-S172 PolarHBondContact O-N 3.29Å; S172-E175 PolarHBondContact O-N 2.88Å; S172-A176 WeakPolarHBondContact O-CB 3.5Å; S172-A176 PolarHBondContact O-N 3.45Å
173	T	82.3	Confident	85.4	Confident	46 Å²	46	96.9 Å²	96.9	28%	0.282	50%	0.5	S	S	.	.	H	α-helix	trans	-63.5	-49.2	174.6	-57.3	0	0	0	0	111.4	L169 K170 Q171 E175 A176 V177 F323	L169-T173 WeakPolarHBondContact O-CB 3.27Å; L169-T173 PolarHBondContact O-N 2.76Å; L169-T173 PolarHBondContact O-OG1 3.05Å; K170-T173 PolarHBondContact O-N 3.27Å; Q171-T173 VanDerWaalsContact C-N 3.27Å; Q171-T173 PolarHBondContact O-N 2.95Å; T173-E175 VanDerWaalsContact C-N 3.3Å; T173-E175 PolarHBondContact O-N 3.07Å; T173-A176 PolarHBondContact O-N 3.14Å; T173-V177 HydrophobicContact CG2-CG2 4.43Å; T173-V177 WeakPolarHBondContact O-CG2 3.41Å; T173-V177 PolarHBondContact O-N 2.91Å; T173-F323 HydrophobicContact CG2-CD2 4.31Å; T173-F323 HydrophobicContact CG2-CE2 3.36Å; T173-F323 HydrophobicContact CG2-CZ 3.81Å
174	C	83.4	Confident	85.1	Confident	71 Å²	71	100.5 Å²	100.5	48%	0.48	51%	0.508	S	S	.	.	H	α-helix	trans	-57.8	-44.6	178.4	-73.8	0	0	0	0	111.3	K170 Q171 V177 M178	K170-C174 PolarHBondContact O-N 3.45Å; K170-C174 PolarHBondContact O-SG 3.38Å; K170-C174 VanDerWaalsContact O-SG 3.34Å; Q171-C174 PolarHBondContact O-N 2.78Å; Q171-C174 VanDerWaalsContact O-N 3.15Å; C174-V177 PolarHBondContact O-N 3.47Å; C174-M178 VanDerWaalsContact O-CG 3.29Å; C174-M178 WeakPolarHBondContact O-CG 3.34Å; C174-M178 PolarHBondContact O-N 3.43Å
175	E	86.8	Confident	84.8	Confident	94 Å²	94	100.7 Å²	100.7	44%	0.439	50%	0.501	S	S	.	.	H	α-helix	trans	-60.7	-47.4	176.2	-72.3	171.1	-170.6	0	0	111.9	Q171 S172 T173 V177 M178 I179	Q171-E175 WeakPolarHBondContact CG-OE1 3.3Å; Q171-E175 PolarHBondContact NE2-OE1 3.45Å; Q171-E175 WeakPolarHBondContact O-CG 3.46Å; Q171-E175 PolarHBondContact O-N 3.13Å; S172-E175 PolarHBondContact O-N 2.88Å; T173-E175 VanDerWaalsContact C-N 3.3Å; T173-E175 PolarHBondContact O-N 3.07Å; E175-V177 VanDerWaalsContact C-N 3.33Å; E175-V177 PolarHBondContact O-N 2.91Å; E175-M178 PolarHBondContact O-N 2.94Å; E175-M178 VanDerWaalsContact O-N 3.17Å; E175-I179 VanDerWaalsContact O-CG1 3.32Å; E175-I179 WeakPolarHBondContact O-CG1 3.5Å; E175-I179 PolarHBondContact O-N 2.95Å
176	A	88.9	Confident	84.5	Confident	47 Å²	47	100.2 Å²	100.2	39%	0.388	50%	0.5	S	S	.	.	H	α-helix	trans	-59.4	-43.5	177.3	0	0	0	0	0	111.8	S172 T173 I179 L180	S172-A176 WeakPolarHBondContact O-CB 3.5Å; S172-A176 PolarHBondContact O-N 3.45Å; T173-A176 PolarHBondContact O-N 3.14Å; A176-I179 PolarHBondContact O-N 2.93Å; A176-L180 VanDerWaalsContact O-CB 3.3Å; A176-L180 WeakPolarHBondContact O-CB 3.19Å; A176-L180 PolarHBondContact O-N 3.14Å
177	V	83.2	Confident	84	Confident	88 Å²	88	99.1 Å²	99.1	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-62.3	-43	175.8	170.7	0	0	0	0	111.2	T173 C174 E175 L180 R181	T173-V177 HydrophobicContact CG2-CG2 4.43Å; T173-V177 WeakPolarHBondContact O-CG2 3.41Å; T173-V177 PolarHBondContact O-N 2.91Å; C174-V177 PolarHBondContact O-N 3.47Å; E175-V177 VanDerWaalsContact C-N 3.33Å; E175-V177 PolarHBondContact O-N 2.91Å; V177-L180 PolarHBondContact O-N 3.4Å; V177-R181 WeakPolarHBondContact O-CB 3.31Å; V177-R181 PolarHBondContact O-N 3.31Å
178	M	82.2	Confident	83.5	Confident	138 Å²	138	101.7 Å²	101.7	68%	0.68	51%	0.507	S	S	*	.	H	α-helix	trans	-63.5	-46.1	177.9	-74.2	-175.4	75.4	0	0	112	C174 E175 L180 R181 S182	C174-M178 VanDerWaalsContact O-CG 3.29Å; C174-M178 WeakPolarHBondContact O-CG 3.34Å; C174-M178 PolarHBondContact O-N 3.43Å; E175-M178 PolarHBondContact O-N 2.94Å; E175-M178 VanDerWaalsContact O-N 3.17Å; M178-L180 VanDerWaalsContact C-N 3.33Å; M178-L180 PolarHBondContact O-N 3Å; M178-R181 PolarHBondContact O-N 3.36Å; M178-S182 PolarHBondContact O-N 3.34Å
179	I	89.5	Confident	82.6	Confident	94 Å²	94	103.2 Å²	103.2	48%	0.482	51%	0.507	S	S	.	.	H	α-helix	trans	-60.6	-45.8	176.8	-68.7	167.2	0	0	0	110.3	E175 A176 R181 S182 R183	E175-I179 VanDerWaalsContact O-CG1 3.32Å; E175-I179 WeakPolarHBondContact O-CG1 3.5Å; E175-I179 PolarHBondContact O-N 2.95Å; A176-I179 PolarHBondContact O-N 2.93Å; I179-R181 PolarHBondContact O-N 2.98Å; I179-S182 PolarHBondContact O-N 2.94Å; I179-R183 WeakPolarHBondContact O-CG 3.35Å; I179-R183 PolarHBondContact O-N 3.1Å
180	L	86.4	Confident	81.7	Confident	97 Å²	97	106.5 Å²	106.5	51%	0.508	52%	0.517	S	S	.	.	H	α-helix	trans	-59.3	-47.9	178.4	-172	62.2	0	0	0	110.9	A176 V177 M178 S182 R183 F184	A176-L180 VanDerWaalsContact O-CB 3.3Å; A176-L180 WeakPolarHBondContact O-CB 3.19Å; A176-L180 PolarHBondContact O-N 3.14Å; V177-L180 PolarHBondContact O-N 3.4Å; M178-L180 VanDerWaalsContact C-N 3.33Å; M178-L180 PolarHBondContact O-N 3Å; L180-S182 VanDerWaalsContact C-N 3.34Å; L180-S182 PolarHBondContact O-N 3.36Å; L180-R183 PolarHBondContact O-N 3.35Å; L180-F184 HydrophobicContact CD1-CD2 3.84Å; L180-F184 HydrophobicContact CD1-CE2 3.59Å; L180-F184 HydrophobicContact CD2-CE2 4.45Å; L180-F184 HydrophobicContact CG-CD2 3.87Å; L180-F184 HydrophobicContact CG-CE2 3.87Å; L180-F184 WeakPolarHBondContact O-CD2 3.3Å; L180-F184 PolarHBondContact O-N 3.35Å
181	R	78.8	Confident	81.1	Confident	180 Å²	180	111 Å²	111	68%	0.679	53%	0.531	S	S	*	.	H	α-helix	trans	-59.6	-43	178.1	-175.2	172.2	-179	172.4	-0.2	112.2	V177 M178 I179 F184 L185	V177-R181 WeakPolarHBondContact O-CB 3.31Å; V177-R181 PolarHBondContact O-N 3.31Å; M178-R181 PolarHBondContact O-N 3.36Å; I179-R181 PolarHBondContact O-N 2.98Å; R181-F184 PolarHBondContact O-N 3.14Å; R181-L185 HydrophobicContact CG-CD1 4.04Å; R181-L185 HydrophobicContact CG-CG 4.47Å; R181-L185 WeakPolarHBondContact O-CB 3.47Å; R181-L185 VanDerWaalsContact O-CG 3.29Å; R181-L185 WeakPolarHBondContact O-CG 3.41Å; R181-L185 PolarHBondContact O-N 3.24Å
182	S	84.2	Confident	80.6	Confident	63 Å²	63	116 Å²	116	44%	0.441	55%	0.545	S	S	.	.	H	α-helix	trans	-59.5	-50	175.3	165.6	0	0	0	0	111.3	M178 I179 L180 F184 L185 D186	M178-S182 PolarHBondContact O-N 3.34Å; I179-S182 PolarHBondContact O-N 2.94Å; L180-S182 VanDerWaalsContact C-N 3.34Å; L180-S182 PolarHBondContact O-N 3.36Å; S182-F184 VanDerWaalsContact C-N 3.35Å; S182-F184 PolarHBondContact O-N 3.44Å; S182-L185 PolarHBondContact O-N 3Å; S182-D186 PolarHBondContact O-N 3.41Å
183	R	84	Confident	80.6	Confident	182 Å²	182	121.1 Å²	121.1	69%	0.687	57%	0.568	S	S	*	*	H	α-helix	trans	-59.5	-42	179.3	-70.9	-177.6	177.3	-169.8	0.5	112.7	I179 L180 A187	I179-R183 WeakPolarHBondContact O-CG 3.35Å; I179-R183 PolarHBondContact O-N 3.1Å; L180-R183 PolarHBondContact O-N 3.35Å; R183-A187 WeakPolarHBondContact O-CB 3.41Å; R183-A187 PolarHBondContact O-N 2.99Å
184	F	79	Confident	81	Confident	146 Å²	146	121.6 Å²	121.6	64%	0.64	57%	0.567	S	S	*	*	H	α-helix	trans	-65.7	-44	177.1	-93.8	-80.3	0	0	0	112.8	L180 R181 S182 D186 A187 R188	L180-F184 HydrophobicContact CD1-CD2 3.84Å; L180-F184 HydrophobicContact CD1-CE2 3.59Å; L180-F184 HydrophobicContact CD2-CE2 4.45Å; L180-F184 HydrophobicContact CG-CD2 3.87Å; L180-F184 HydrophobicContact CG-CE2 3.87Å; L180-F184 WeakPolarHBondContact O-CD2 3.3Å; L180-F184 PolarHBondContact O-N 3.35Å; R181-F184 PolarHBondContact O-N 3.14Å; S182-F184 VanDerWaalsContact C-N 3.35Å; S182-F184 PolarHBondContact O-N 3.44Å; F184-D186 VanDerWaalsContact C-N 3.34Å; F184-D186 PolarHBondContact O-N 2.88Å; F184-A187 PolarHBondContact O-N 3.41Å; F184-R188 PolarHBondContact O-N 3.26Å
185	L	79	Confident	81.5	Confident	54 Å²	54	121.4 Å²	121.4	28%	0.283	57%	0.566	S	S	.	*	H	α-helix	trans	-65.6	-38.7	179.6	-71.5	175.3	0	0	0	111.6	R181 S182 R188 R189	R181-L185 HydrophobicContact CG-CD1 4.04Å; R181-L185 HydrophobicContact CG-CG 4.47Å; R181-L185 WeakPolarHBondContact O-CB 3.47Å; R181-L185 VanDerWaalsContact O-CG 3.29Å; R181-L185 WeakPolarHBondContact O-CG 3.41Å; R181-L185 PolarHBondContact O-N 3.24Å; S182-L185 PolarHBondContact O-N 3Å; L185-R188 PolarHBondContact O-N 2.94Å; L185-R189 WeakPolarHBondContact O-CG 3.26Å; L185-R189 PolarHBondContact O-N 3.47Å
186	D	78.6	Confident	81.7	Confident	68 Å²	68	125 Å²	125	36%	0.364	58%	0.58	S	S	.	*	H	α-helix	trans	-72.4	-38.3	177.9	-67.2	-24.3	0	0	0	112.5	S182 F184 R188 R189 K190	S182-D186 PolarHBondContact O-N 3.41Å; F184-D186 VanDerWaalsContact C-N 3.34Å; F184-D186 PolarHBondContact O-N 2.88Å; D186-R188 VanDerWaalsContact C-N 3.28Å; D186-R188 PolarHBondContact O-N 3.21Å; D186-R189 PolarHBondContact O-N 2.74Å; D186-R189 IonicContact OD1-NH1 2.58Å; D186-R189 PolarHBondContact OD1-NH1 3.18Å; D186-K190 WeakPolarHBondContact O-CB 3.46Å; D186-K190 WeakPolarHBondContact O-CG 3.33Å; D186-K190 PolarHBondContact O-N 3.3Å
187	A	73.9	Confident	82	Confident	61 Å²	61	129.6 Å²	129.6	50%	0.504	59%	0.594	S	S	.	*	H	α-helix	trans	-59.4	-40.1	171.4	0	0	0	0	0	111.8	R183 F184 K190	R183-A187 WeakPolarHBondContact O-CB 3.41Å; R183-A187 PolarHBondContact O-N 2.99Å; F184-A187 PolarHBondContact O-N 3.41Å; A187-K190 PolarHBondContact O-N 2.86Å
188	R	72.5	Confident	82.7	Confident	187 Å²	187	125.4 Å²	125.4	71%	0.706	57%	0.569	S	S	*	*	H	α-helix	trans	-66.4	-41.4	175.4	-170.6	174.7	65.5	147.8	0.8	112.1	F184 L185 D186 K190 R191	F184-R188 PolarHBondContact O-N 3.26Å; L185-R188 PolarHBondContact O-N 2.94Å; D186-R188 VanDerWaalsContact C-N 3.28Å; D186-R188 PolarHBondContact O-N 3.21Å; R188-K190 VanDerWaalsContact C-N 3.31Å; R188-K190 PolarHBondContact O-N 3.09Å; R188-R191 WeakPolarHBondContact O-CB 3.29Å; R188-R191 PolarHBondContact O-N 3.19Å
189	R	71.5	Confident	83.3	Confident	170 Å²	170	120.9 Å²	120.9	64%	0.642	55%	0.549	S	S	*	.	H	α-helix	trans	-66.1	-32.3	175.2	-71.5	176.5	-172.1	129.5	-5.2	112.5	L185 D186 R191	L185-R189 WeakPolarHBondContact O-CG 3.26Å; L185-R189 PolarHBondContact O-N 3.47Å; D186-R189 PolarHBondContact O-N 2.74Å; D186-R189 IonicContact OD1-NH1 2.58Å; D186-R189 PolarHBondContact OD1-NH1 3.18Å; R189-R191 PolarHBondContact O-N 2.93Å
190	K	68.9	Low	83.6	Confident	174 Å²	174	118.8 Å²	118.8	76%	0.757	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-16.3	174.5	-79.2	-178.4	-178.6	-177.6	0	113.5	D186 A187 R188 R192	D186-K190 WeakPolarHBondContact O-CB 3.46Å; D186-K190 WeakPolarHBondContact O-CG 3.33Å; D186-K190 PolarHBondContact O-N 3.3Å; A187-K190 PolarHBondContact O-N 2.86Å; R188-K190 VanDerWaalsContact C-N 3.31Å; R188-K190 PolarHBondContact O-N 3.09Å; K190-R192 PolarHBondContact O-N 3.22Å
191	R	72.9	Confident	84.1	Confident	217 Å²	217	115.8 Å²	115.8	82%	0.819	52%	0.523	S	S	*	.			trans	-68.3	82.9	169.3	-166.9	-176.6	-169.8	-131.8	6	109.4	R188 R189	R188-R191 WeakPolarHBondContact O-CB 3.29Å; R188-R191 PolarHBondContact O-N 3.19Å; R189-R191 PolarHBondContact O-N 2.93Å
192	R	79.1	Confident	84.9	Confident	213 Å²	213	107.2 Å²	107.2	80%	0.804	49%	0.49	S	S	*	.	P	Polyproline II helix	trans	-82.6	140.1	177.1	-63.4	-177.9	73.3	-177.3	2.9	109.7	K190	K190-R192 PolarHBondContact O-N 3.22Å
193	N	87.2	Confident	85.5	Confident	153 Å²	153	104.7 Å²	104.7	82%	0.818	47%	0.472	S	S	*	.	P	Polyproline II helix	trans	-65.8	147.7	164.9	-66.3	-30.2	0	0	0	108.9
194	F	91.7	Very high	86	Confident	56 Å²	56	100.3 Å²	100.3	25%	0.246	46%	0.459	C	S	.	.	P	Polyproline II helix	trans	-61.5	155.4	169.7	-61	-22.7	0	0	0	110.1	A198 L202 I229 Q233 W237	F194-A198 HydrophobicContact CB-CB 4.21Å; F194-L202 HydrophobicContact CD2-CD1 3.99Å; F194-L202 HydrophobicContact CE2-CD1 4.25Å; F194-I229 HydrophobicContact CD1-CG2 4.04Å; F194-I229 HydrophobicContact CD2-CD1 4.02Å; F194-I229 HydrophobicContact CE1-CD1 4.47Å; F194-I229 HydrophobicContact CE1-CG2 4.17Å; F194-I229 HydrophobicContact CE2-CD1 3.69Å; F194-I229 HydrophobicContact CG-CG2 4.44Å; F194-I229 HydrophobicContact CZ-CD1 3.97Å; F194-Q233 HydrophobicContact CE1-CB 4.34Å; F194-Q233 HydrophobicContact CE1-CG 4.4Å; F194-Q233 HydrophobicContact CZ-CB 3.81Å; F194-Q233 HydrophobicContact CZ-CG 4.24Å; F194-W237 AromaticContact CD2-CD1 3.71Å; F194-W237 HydrophobicContact CE2-CB 4.05Å; F194-W237 AromaticContact CE2-CD1 3.49Å; F194-W237 VanDerWaalsContact CE2-CD1 3.49Å; F194-W237 HydrophobicContact CE2-CG 4.05Å
195	S	93.2	Very high	86.8	Confident	67 Å²	67	95.7 Å²	95.7	47%	0.469	44%	0.438	S	S	.	.	P	Polyproline II helix	trans	-57.8	155	175.2	69.7	0	0	0	0	110.3	Q197 A198 T199	S195-Q197 PolarHBondContact O-N 3.34Å; S195-A198 PolarHBondContact O-N 2.95Å; S195-A198 VanDerWaalsContact OG-CB 3.22Å; S195-A198 WeakPolarHBondContact OG-CB 3.49Å; S195-A198 PolarHBondContact OG-N 3.44Å; S195-A198 VanDerWaalsContact OG-N 3.08Å; S195-T199 WeakPolarHBondContact O-CB 3.45Å; S195-T199 PolarHBondContact O-N 2.85Å; S195-T199 PolarHBondContact O-OG1 3.46Å
196	K	92.1	Very high	87.6	Confident	170 Å²	170	93.1 Å²	93.1	74%	0.739	42%	0.424	S	S	*	.	H	α-helix	trans	-56.2	-43.1	176.8	-174.4	-180	177.8	-176.4	0	110.8	T199 E200	K196-T199 PolarHBondContact O-N 2.98Å; K196-E200 WeakPolarHBondContact O-CB 3.32Å; K196-E200 PolarHBondContact O-N 3.05Å
197	Q	95	Very high	88.2	Confident	143 Å²	143	91.2 Å²	91.2	67%	0.668	41%	0.412	S	S	*	.	H	α-helix	trans	-61.8	-48.7	177.1	-175.6	-177.4	3.2	0	0	112.3	S195 T199 E200 V201	S195-Q197 PolarHBondContact O-N 3.34Å; Q197-T199 VanDerWaalsContact C-N 3.31Å; Q197-T199 PolarHBondContact O-N 3.02Å; Q197-E200 WeakPolarHBondContact O-CB 3.44Å; Q197-E200 PolarHBondContact O-N 3.42Å; Q197-V201 WeakPolarHBondContact O-CG2 3.44Å; Q197-V201 PolarHBondContact O-N 3.39Å
198	A	96.2	Very high	89.1	Confident	1 Å²	1	92 Å²	92	1%	0.008	41%	0.414	C	S	.	.	H	α-helix	trans	-59.8	-44.1	176.7	0	0	0	0	0	111.4	F194 S195 E200 V201 L202 C227	F194-A198 HydrophobicContact CB-CB 4.21Å; S195-A198 PolarHBondContact O-N 2.95Å; S195-A198 VanDerWaalsContact OG-CB 3.22Å; S195-A198 WeakPolarHBondContact OG-CB 3.49Å; S195-A198 PolarHBondContact OG-N 3.44Å; S195-A198 VanDerWaalsContact OG-N 3.08Å; A198-E200 VanDerWaalsContact C-N 3.29Å; A198-E200 PolarHBondContact O-N 3.28Å; A198-V201 PolarHBondContact O-N 3.21Å; A198-L202 VanDerWaalsContact O-CG 3.23Å; A198-L202 WeakPolarHBondContact O-CG 3.33Å; A198-L202 PolarHBondContact O-N 2.88Å; A198-C227 HydrophobicContact CB-CB 3.64Å; A198-C227 PolarHBondContact O-SG 3.01Å
199	T	95.8	Very high	90.1	Very high	43 Å²	43	86.4 Å²	86.4	26%	0.264	40%	0.396	S	S	.	.	H	α-helix	trans	-63.1	-37.5	177.6	-56.2	0	0	0	0	111.7	S195 K196 Q197 N203	S195-T199 WeakPolarHBondContact O-CB 3.45Å; S195-T199 PolarHBondContact O-N 2.85Å; S195-T199 PolarHBondContact O-OG1 3.46Å; K196-T199 PolarHBondContact O-N 2.98Å; Q197-T199 VanDerWaalsContact C-N 3.31Å; Q197-T199 PolarHBondContact O-N 3.02Å; T199-N203 WeakPolarHBondContact CG2-ND2 3.34Å; T199-N203 WeakPolarHBondContact O-CB 3.4Å; T199-N203 VanDerWaalsContact O-CG 3.27Å; T199-N203 PolarHBondContact O-N 3.18Å; T199-N203 PolarHBondContact O-ND2 2.96Å
200	E	95.7	Very high	90.9	Very high	50 Å²	50	81.2 Å²	81.2	23%	0.234	38%	0.38	C	S	.	.	H	α-helix	trans	-66.3	-47.3	177.4	-177.2	160	-161.9	0	0	112	K196 Q197 A198 L202 N203 E204 K262	K196-E200 WeakPolarHBondContact O-CB 3.32Å; K196-E200 PolarHBondContact O-N 3.05Å; Q197-E200 WeakPolarHBondContact O-CB 3.44Å; Q197-E200 PolarHBondContact O-N 3.42Å; A198-E200 VanDerWaalsContact C-N 3.29Å; A198-E200 PolarHBondContact O-N 3.28Å; E200-L202 VanDerWaalsContact C-N 3.34Å; E200-L202 PolarHBondContact O-N 3.45Å; E200-N203 PolarHBondContact O-N 3.15Å; E200-E204 WeakPolarHBondContact O-CB 3.26Å; E200-E204 PolarHBondContact O-N 3.42Å; E200-K262 WeakPolarHBondContact OE1-CE 3.44Å; E200-K262 IonicContact OE1-NZ 2.8Å; E200-K262 PolarHBondContact OE1-NZ 2.99Å; E200-K262 IonicContact OE2-NZ 3.28Å; E200-K262 PolarHBondContact OE2-NZ 3.4Å
201	V	96.4	Very high	91.9	Very high	34 Å²	34	78.9 Å²	78.9	21%	0.206	39%	0.386	C	S	.	.	H	α-helix	trans	-58.7	-44.8	175.5	172.5	0	0	0	0	111.4	Q197 A198 E204 Y205 L223 K226	Q197-V201 WeakPolarHBondContact O-CG2 3.44Å; Q197-V201 PolarHBondContact O-N 3.39Å; A198-V201 PolarHBondContact O-N 3.21Å; V201-E204 PolarHBondContact O-N 3.27Å; V201-Y205 PolarHBondContact O-N 3Å; V201-Y205 VanDerWaalsContact O-N 3.12Å; V201-L223 HydrophobicContact CG1-CD2 3.85Å; V201-K226 HydrophobicContact CG1-CB 4.2Å; V201-K226 HydrophobicContact CG1-CD 4.41Å
202	L	97	Very high	92.8	Very high	0 Å²	0	73.1 Å²	73.1	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-66.5	-40.5	178.6	-66.8	169.9	0	0	0	112.3	F194 A198 E200 F206 L223 I229 V234 W237 F238	F194-L202 HydrophobicContact CD2-CD1 3.99Å; F194-L202 HydrophobicContact CE2-CD1 4.25Å; A198-L202 VanDerWaalsContact O-CG 3.23Å; A198-L202 WeakPolarHBondContact O-CG 3.33Å; A198-L202 PolarHBondContact O-N 2.88Å; E200-L202 VanDerWaalsContact C-N 3.34Å; E200-L202 PolarHBondContact O-N 3.45Å; L202-F206 WeakPolarHBondContact O-CB 3.4Å; L202-F206 PolarHBondContact O-N 2.81Å; L202-L223 HydrophobicContact CD2-CB 4.28Å; L202-I229 HydrophobicContact CD1-CD1 4.03Å; L202-V234 HydrophobicContact CD2-CG1 4.13Å; L202-V234 HydrophobicContact CD2-CG2 4.43Å; L202-W237 HydrophobicContact CB-CD2 4.08Å; L202-W237 HydrophobicContact CB-CE3 3.92Å; L202-W237 HydrophobicContact CB-CH2 3.66Å; L202-W237 HydrophobicContact CB-CZ2 3.79Å; L202-W237 HydrophobicContact CB-CZ3 3.73Å; L202-W237 HydrophobicContact CD1-CD2 3.84Å; L202-W237 HydrophobicContact CD1-CE3 4.32Å; L202-W237 HydrophobicContact CD1-CG 3.9Å; L202-W237 HydrophobicContact CG-CD2 4.47Å; L202-F238 HydrophobicContact CD2-CE2 3.71Å; L202-F238 HydrophobicContact CD2-CZ 4.43Å
203	N	94.9	Very high	93.4	Very high	9 Å²	9	63.8 Å²	63.8	5%	0.048	34%	0.338	C	S	.	.	H	α-helix	trans	-67.1	-41.6	176.3	-78.5	-47.2	0	0	0	111.7	T199 E200 Y205 F206 Y207 W237 K241 Y259	T199-N203 WeakPolarHBondContact CG2-ND2 3.34Å; T199-N203 WeakPolarHBondContact O-CB 3.4Å; T199-N203 VanDerWaalsContact O-CG 3.27Å; T199-N203 PolarHBondContact O-N 3.18Å; T199-N203 PolarHBondContact O-ND2 2.96Å; E200-N203 PolarHBondContact O-N 3.15Å; N203-Y205 VanDerWaalsContact C-N 3.34Å; N203-Y205 PolarHBondContact O-N 3.4Å; N203-F206 PolarHBondContact O-N 3.11Å; N203-Y207 HydrophobicContact CB-CD2 4.2Å; N203-Y207 HydrophobicContact CB-CE2 4.09Å; N203-Y207 WeakPolarHBondContact O-CD2 3.48Å; N203-Y207 PolarHBondContact O-N 3.11Å; N203-W237 VanDerWaalsContact OD1-CH2 3.3Å; N203-W237 WeakPolarHBondContact OD1-CH2 3.47Å; N203-W237 WeakPolarHBondContact OD1-CZ2 3.28Å; N203-K241 WeakPolarHBondContact OD1-CE 3.41Å; N203-K241 PolarHBondContact OD1-NZ 3.43Å; N203-Y259 HydrophobicContact CB-CD1 4.22Å; N203-Y259 HydrophobicContact CB-CE1 3.54Å; N203-Y259 HydrophobicContact CB-CE2 3.91Å; N203-Y259 PolarHBondContact ND2-OH 3.29Å
204	E	95	Very high	93.8	Very high	91 Å²	91	63.4 Å²	63.4	43%	0.425	33%	0.326	S	S	.	.	H	α-helix	trans	-58.1	-47.7	176.6	-175.7	-178.8	-174.8	0	0	111.2	E200 V201 F206 S208 K263	E200-E204 WeakPolarHBondContact O-CB 3.26Å; E200-E204 PolarHBondContact O-N 3.42Å; V201-E204 PolarHBondContact O-N 3.27Å; E204-F206 PolarHBondContact O-N 2.97Å; E204-S208 WeakPolarHBondContact O-CB 3.44Å; E204-S208 PolarHBondContact O-N 2.88Å; E204-S208 PolarHBondContact O-OG 2.9Å; E204-K263 WeakPolarHBondContact OE1-CE 3.47Å; E204-K263 IonicContact OE1-NZ 2.75Å; E204-K263 PolarHBondContact OE1-NZ 3.19Å
205	Y	95.9	Very high	94	Very high	48 Å²	48	61.3 Å²	61.3	19%	0.188	32%	0.318	C	S	.	.	H	α-helix	trans	-61.1	-45.7	175.7	-172.2	-81	0	0	0	111.4	V201 N203 Y207 S208 H209 P215 A219 L223 F238	V201-Y205 PolarHBondContact O-N 3Å; V201-Y205 VanDerWaalsContact O-N 3.12Å; N203-Y205 VanDerWaalsContact C-N 3.34Å; N203-Y205 PolarHBondContact O-N 3.4Å; Y205-Y207 PolarHBondContact O-N 2.94Å; Y205-S208 WeakPolarHBondContact CA-OG 3.31Å; Y205-S208 PolarHBondContact O-N 2.86Å; Y205-S208 PolarHBondContact O-OG 3.28Å; Y205-H209 AromaticContact CD2-CE1 3.97Å; Y205-H209 HydrophobicContact CE1-CB 4.39Å; Y205-H209 AromaticContact CE1-CG 3.99Å; Y205-H209 AromaticContact CE1-ND1 3.96Å; Y205-H209 AromaticContact CE2-CE1 3.67Å; Y205-H209 AromaticContact CZ-CE1 3.84Å; Y205-H209 AromaticContact CZ-ND1 3.98Å; Y205-H209 AromaticContact CZ-NE2 3.89Å; Y205-H209 WeakPolarHBondContact O-CB 3.48Å; Y205-H209 PolarHBondContact O-N 3.12Å; Y205-H209 VanDerWaalsContact O-N 3.12Å; Y205-H209 PolarHBondContact O-ND1 3.2Å; Y205-P215 HydrophobicContact CE1-CB 3.76Å; Y205-P215 HydrophobicContact CE1-CG 4.41Å; Y205-A219 HydrophobicContact CE2-CB 4.46Å; Y205-L223 HydrophobicContact CD1-CD1 4.08Å; Y205-L223 HydrophobicContact CD2-CD1 4.06Å; Y205-L223 HydrophobicContact CD2-CD2 4.17Å; Y205-L223 HydrophobicContact CD2-CG 4.47Å; Y205-L223 HydrophobicContact CE1-CD1 4.43Å; Y205-L223 HydrophobicContact CE2-CD1 4.41Å; Y205-L223 HydrophobicContact CG-CD1 3.88Å; Y205-L223 HydrophobicContact CG-CD2 4.2Å; Y205-F238 AromaticContact CD1-CE1 3.69Å; Y205-F238 HydrophobicContact CD1-CE1 3.69Å; Y205-F238 AromaticContact CD1-CZ 3.51Å; Y205-F238 HydrophobicContact CD1-CZ 3.51Å; Y205-F238 HydrophobicContact CE1-CE1 4.29Å; Y205-F238 HydrophobicContact CE1-CZ 4.28Å; Y205-F238 HydrophobicContact CG-CZ 4.2Å
206	F	95.2	Very high	94.1	Very high	1 Å²	1	61.4 Å²	61.4	0%	0.004	32%	0.319	C	S	.	.	H	α-helix	trans	-60	-47	-179.7	-175.9	-90.3	0	0	0	112.8	L202 N203 E204 H209 L210 P213 W237 F238 K241 R242 Y245	L202-F206 WeakPolarHBondContact O-CB 3.4Å; L202-F206 PolarHBondContact O-N 2.81Å; N203-F206 PolarHBondContact O-N 3.11Å; E204-F206 PolarHBondContact O-N 2.97Å; F206-H209 CarbonylContact O-C 3.31Å; F206-H209 PolarHBondContact O-N 3.1Å; F206-L210 HydrophobicContact CD1-CD2 4.1Å; F206-L210 HydrophobicContact CE1-CD2 3.71Å; F206-L210 HydrophobicContact CZ-CD2 4.49Å; F206-L210 PolarHBondContact O-N 3.1Å; F206-P213 HydrophobicContact CD2-CB 3.92Å; F206-P213 HydrophobicContact CE2-CB 3.63Å; F206-P213 HydrophobicContact CE2-CG 4.27Å; F206-P213 HydrophobicContact CZ-CB 4.33Å; F206-W237 HydrophobicContact CB-CH2 4.39Å; F206-W237 HydrophobicContact CB-CZ3 4.23Å; F206-F238 HydrophobicContact CB-CE1 3.97Å; F206-F238 AromaticContact CD2-CD1 3.88Å; F206-F238 HydrophobicContact CD2-CD1 3.88Å; F206-F238 AromaticContact CD2-CE1 3.95Å; F206-F238 HydrophobicContact CD2-CE1 3.95Å; F206-F238 HydrophobicContact CG-CE1 4.48Å; F206-K241 HydrophobicContact CD1-CG 4Å; F206-K241 HydrophobicContact CD2-CB 4.29Å; F206-K241 HydrophobicContact CD2-CG 3.6Å; F206-K241 HydrophobicContact CE1-CG 3.98Å; F206-K241 HydrophobicContact CE2-CB 4.15Å; F206-K241 HydrophobicContact CE2-CG 3.56Å; F206-K241 HydrophobicContact CG-CG 3.82Å; F206-K241 HydrophobicContact CZ-CG 3.78Å; F206-R242 HydrophobicContact CE2-CG 3.81Å; F206-R242 HydrophobicContact CZ-CG 4.45Å; F206-Y245 AromaticContact CE1-CD2 3.67Å; F206-Y245 HydrophobicContact CE1-CD2 3.67Å; F206-Y245 HydrophobicContact CE1-CE2 4.29Å; F206-Y245 HydrophobicContact CE1-CG 4.02Å; F206-Y245 HydrophobicContact CZ-CD2 4.13Å; F206-Y245 AromaticContact CZ-CG 3.98Å; F206-Y245 HydrophobicContact CZ-CG 3.98Å
207	Y	92.4	Very high	94.3	Very high	28 Å²	28	58.1 Å²	58.1	11%	0.11	31%	0.306	C	S	.	.	H	α-helix	trans	-76	-26.8	-177.5	-69.2	-61.8	0	0	0	113.2	N203 Y205 H209 L210 K241 Y245 E255 A256 Y259	N203-Y207 HydrophobicContact CB-CD2 4.2Å; N203-Y207 HydrophobicContact CB-CE2 4.09Å; N203-Y207 WeakPolarHBondContact O-CD2 3.48Å; N203-Y207 PolarHBondContact O-N 3.11Å; Y205-Y207 PolarHBondContact O-N 2.94Å; Y207-H209 PolarHBondContact O-N 3.28Å; Y207-L210 HydrophobicContact CD1-CD1 4.29Å; Y207-L210 HydrophobicContact CD1-CD2 3.92Å; Y207-L210 HydrophobicContact CD1-CG 4.29Å; Y207-L210 HydrophobicContact CE1-CD2 4.47Å; Y207-L210 WeakPolarHBondContact O-CG 3.19Å; Y207-K241 PolarHBondContact OH-NZ 3.44Å; Y207-Y245 HydrophobicContact CE1-CE2 4.3Å; Y207-E255 VanDerWaalsContact OH-CB 3.31Å; Y207-E255 WeakPolarHBondContact OH-CB 3.34Å; Y207-E255 PolarHBondContact OH-OE2 2.88Å; Y207-E255 VanDerWaalsContact OH-OE2 3.11Å; Y207-A256 HydrophobicContact CD1-CB 3.48Å; Y207-A256 VanDerWaalsContact CD1-CB 3.48Å; Y207-A256 HydrophobicContact CE1-CB 3.54Å; Y207-A256 HydrophobicContact CG-CB 4.3Å; Y207-Y259 HydrophobicContact CD2-CD1 4.48Å; Y207-Y259 AromaticContact CD2-CD2 3.71Å; Y207-Y259 HydrophobicContact CD2-CD2 3.71Å; Y207-Y259 HydrophobicContact CD2-CE2 4.38Å; Y207-Y259 AromaticContact CD2-CG 3.78Å; Y207-Y259 HydrophobicContact CD2-CG 3.78Å; Y207-Y259 AromaticContact CE2-CD2 3.33Å; Y207-Y259 HydrophobicContact CE2-CD2 3.33Å; Y207-Y259 AromaticContact CE2-CE2 3.76Å; Y207-Y259 HydrophobicContact CE2-CE2 3.76Å; Y207-Y259 AromaticContact CE2-CG 3.93Å; Y207-Y259 HydrophobicContact CE2-CG 3.93Å
208	S	93.1	Very high	94.4	Very high	76 Å²	76	58.6 Å²	58.6	53%	0.531	31%	0.309	S	S	.	.	H	α-helix	trans	-73.1	-17.1	169.9	53.2	0	0	0	0	113.1	E204 Y205	E204-S208 WeakPolarHBondContact O-CB 3.44Å; E204-S208 PolarHBondContact O-N 2.88Å; E204-S208 PolarHBondContact O-OG 2.9Å; Y205-S208 WeakPolarHBondContact CA-OG 3.31Å; Y205-S208 PolarHBondContact O-N 2.86Å; Y205-S208 PolarHBondContact O-OG 3.28Å
209	H	92.7	Very high	94.4	Very high	71 Å²	71	59.4 Å²	59.4	33%	0.329	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	35.9	-179	-63.2	72.6	0	0	0	112.4	Y205 F206 Y207 S211 N212 P213	Y205-H209 AromaticContact CD2-CE1 3.97Å; Y205-H209 HydrophobicContact CE1-CB 4.39Å; Y205-H209 AromaticContact CE1-CG 3.99Å; Y205-H209 AromaticContact CE1-ND1 3.96Å; Y205-H209 AromaticContact CE2-CE1 3.67Å; Y205-H209 AromaticContact CZ-CE1 3.84Å; Y205-H209 AromaticContact CZ-ND1 3.98Å; Y205-H209 AromaticContact CZ-NE2 3.89Å; Y205-H209 WeakPolarHBondContact O-CB 3.48Å; Y205-H209 PolarHBondContact O-N 3.12Å; Y205-H209 VanDerWaalsContact O-N 3.12Å; Y205-H209 PolarHBondContact O-ND1 3.2Å; F206-H209 CarbonylContact O-C 3.31Å; F206-H209 PolarHBondContact O-N 3.1Å; Y207-H209 PolarHBondContact O-N 3.28Å; H209-S211 VanDerWaalsContact C-N 3.27Å; H209-S211 PolarHBondContact O-N 3.24Å; H209-N212 CarbonylContact O-C 3.07Å; H209-N212 PolarHBondContact O-N 2.89Å; H209-N212 VanDerWaalsContact O-N 3.1Å; H209-P213 WeakPolarHBondContact O-CA 3.38Å; H209-P213 WeakPolarHBondContact O-CD 3.45Å
210	L	89.2	Confident	94.5	Very high	60 Å²	60	59.2 Å²	59.2	31%	0.314	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-34.1	-176.7	-81.1	178.4	0	0	0	114.4	F206 Y207 N212 Y245	F206-L210 HydrophobicContact CD1-CD2 4.1Å; F206-L210 HydrophobicContact CE1-CD2 3.71Å; F206-L210 HydrophobicContact CZ-CD2 4.49Å; F206-L210 PolarHBondContact O-N 3.1Å; Y207-L210 HydrophobicContact CD1-CD1 4.29Å; Y207-L210 HydrophobicContact CD1-CD2 3.92Å; Y207-L210 HydrophobicContact CD1-CG 4.29Å; Y207-L210 HydrophobicContact CE1-CD2 4.47Å; Y207-L210 WeakPolarHBondContact O-CG 3.19Å; L210-N212 VanDerWaalsContact C-N 3.3Å; L210-N212 PolarHBondContact O-N 3.18Å; L210-Y245 HydrophobicContact CD2-CD2 4.31Å; L210-Y245 HydrophobicContact CD2-CE1 4.32Å; L210-Y245 HydrophobicContact CD2-CE2 3.66Å
211	S	89	Confident	94.6	Very high	125 Å²	125	61.6 Å²	61.6	87%	0.874	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.4	-32.5	178.2	53.7	0	0	0	0	112.3	H209	H209-S211 VanDerWaalsContact C-N 3.27Å; H209-S211 PolarHBondContact O-N 3.24Å
212	N	92.4	Very high	94.7	Very high	97 Å²	97	62.8 Å²	62.8	52%	0.519	33%	0.325	S	S	.	.			trans	-146.3	78.5	179.6	-173.2	24	0	0	0	111.7	H209 L210 Y214	H209-N212 CarbonylContact O-C 3.07Å; H209-N212 PolarHBondContact O-N 2.89Å; H209-N212 VanDerWaalsContact O-N 3.1Å; L210-N212 VanDerWaalsContact C-N 3.3Å; L210-N212 PolarHBondContact O-N 3.18Å; N212-Y214 PolarHBondContact O-N 3Å; N212-Y214 WeakPolarHBondContact OD1-CD2 3.41Å
213	P	91.7	Very high	94.7	Very high	17 Å²	17	63.2 Å²	63.2	11%	0.11	33%	0.327	C	S	.	.			trans	-80.5	53.6	-176.5	31.3	-34.2	0	0	0	111.8	F206 H209 R242	F206-P213 HydrophobicContact CD2-CB 3.92Å; F206-P213 HydrophobicContact CE2-CB 3.63Å; F206-P213 HydrophobicContact CE2-CG 4.27Å; F206-P213 HydrophobicContact CZ-CB 4.33Å; H209-P213 WeakPolarHBondContact O-CA 3.38Å; H209-P213 WeakPolarHBondContact O-CD 3.45Å; P213-R242 HydrophobicContact CB-CG 4.15Å; P213-R242 HydrophobicContact CG-CG 3.86Å; P213-R242 WeakPolarHBondContact O-CD 3.43Å; P213-R242 PolarHBondContact O-NH1 3.18Å
214	Y	95.4	Very high	94.8	Very high	144 Å²	144	63.1 Å²	63.1	57%	0.565	33%	0.328	S	S	*	.			trans	-124.9	84.7	179.6	-69.5	-106.6	0	0	0	108.5	N212 S216 R242	N212-Y214 PolarHBondContact O-N 3Å; N212-Y214 WeakPolarHBondContact OD1-CD2 3.41Å; Y214-S216 PolarHBondContact O-N 3.4Å; Y214-R242 VanDerWaalsContact CE1-CZ 3.44Å
215	P	94.7	Very high	94.9	Very high	12 Å²	12	67 Å²	67	8%	0.078	34%	0.339	C	S	.	.			trans	-61.1	137.4	177	24.1	-32.1	0	0	0	110.5	Y205 A219 K220 F238	Y205-P215 HydrophobicContact CE1-CB 3.76Å; Y205-P215 HydrophobicContact CE1-CG 4.41Å; P215-A219 HydrophobicContact CB-CB 3.99Å; P215-K220 HydrophobicContact CB-CG 3.96Å; P215-K220 HydrophobicContact CG-CG 3.81Å; P215-K220 VanDerWaalsContact O-CE 3.24Å; P215-K220 WeakPolarHBondContact O-CE 3.35Å; P215-F238 HydrophobicContact CG-CD1 4.28Å; P215-F238 HydrophobicContact CG-CD2 4.12Å; P215-F238 HydrophobicContact CG-CE1 4.47Å; P215-F238 HydrophobicContact CG-CE2 4.32Å; P215-F238 HydrophobicContact CG-CG 4.12Å; P215-F238 HydrophobicContact CG-CZ 4.5Å
216	S	96.5	Very high	95	Very high	69 Å²	69	70.4 Å²	70.4	48%	0.483	36%	0.355	S	S	.	.			trans	-61.9	167.9	169	62.3	0	0	0	0	111	Y214 E218 A219 K220	Y214-S216 PolarHBondContact O-N 3.4Å; S216-E218 PolarHBondContact O-N 3.32Å; S216-A219 PolarHBondContact O-N 2.76Å; S216-A219 WeakPolarHBondContact OG-CB 3.49Å; S216-A219 PolarHBondContact OG-N 3.29Å; S216-K220 WeakPolarHBondContact O-CG 3.38Å; S216-K220 PolarHBondContact O-N 2.89Å
217	E	95.7	Very high	95	Very high	101 Å²	101	71 Å²	71	47%	0.472	36%	0.359	S	S	.	.	H	α-helix	trans	-61.6	-46.6	-178.3	-162.5	58.2	-155.8	0	0	112.1	A219 K220 E221	E217-A219 VanDerWaalsContact C-N 3.31Å; E217-A219 PolarHBondContact O-N 2.82Å; E217-K220 WeakPolarHBondContact O-CB 3.28Å; E217-K220 PolarHBondContact O-N 3.22Å; E217-K220 VanDerWaalsContact O-N 3.08Å; E217-K220 IonicContact OE2-NZ 3.59Å; E217-K220 PolarHBondContact OE2-NZ 3.02Å; E217-E221 PolarHBondContact O-N 3.1Å
218	E	97.3	Very high	95.2	Very high	154 Å²	154	73 Å²	73	72%	0.72	39%	0.388	S	S	*	.	H	α-helix	trans	-56.5	-42.6	173.1	-174.4	-172.8	-175.8	0	0	112.4	S216 K220 E221 E222	S216-E218 PolarHBondContact O-N 3.32Å; E218-K220 VanDerWaalsContact C-N 3.32Å; E218-K220 PolarHBondContact O-N 3.49Å; E218-E221 PolarHBondContact O-N 3.34Å; E218-E222 PolarHBondContact O-N 2.65Å
219	A	96.9	Very high	95.3	Very high	18 Å²	18	70.6 Å²	70.6	15%	0.149	37%	0.369	C	S	.	.	H	α-helix	trans	-65.3	-35.8	177.6	0	0	0	0	0	112.1	Y205 P215 S216 E217 L223	Y205-A219 HydrophobicContact CE2-CB 4.46Å; P215-A219 HydrophobicContact CB-CB 3.99Å; S216-A219 PolarHBondContact O-N 2.76Å; S216-A219 WeakPolarHBondContact OG-CB 3.49Å; S216-A219 PolarHBondContact OG-N 3.29Å; E217-A219 VanDerWaalsContact C-N 3.31Å; E217-A219 PolarHBondContact O-N 2.82Å; A219-L223 WeakPolarHBondContact O-CB 3.47Å; A219-L223 VanDerWaalsContact O-CG 3.22Å; A219-L223 WeakPolarHBondContact O-CG 3.42Å; A219-L223 PolarHBondContact O-N 3.45Å
220	K	97.5	Very high	95.5	Very high	38 Å²	38	71 Å²	71	17%	0.165	38%	0.376	C	S	.	.	H	α-helix	trans	-68.3	-39.7	174.5	-65.1	176.9	-149.9	149	0	111.8	P215 S216 E217 E218 E222 L223 A224 V231 V234	P215-K220 HydrophobicContact CB-CG 3.96Å; P215-K220 HydrophobicContact CG-CG 3.81Å; P215-K220 VanDerWaalsContact O-CE 3.24Å; P215-K220 WeakPolarHBondContact O-CE 3.35Å; S216-K220 WeakPolarHBondContact O-CG 3.38Å; S216-K220 PolarHBondContact O-N 2.89Å; E217-K220 WeakPolarHBondContact O-CB 3.28Å; E217-K220 PolarHBondContact O-N 3.22Å; E217-K220 VanDerWaalsContact O-N 3.08Å; E217-K220 IonicContact OE2-NZ 3.59Å; E217-K220 PolarHBondContact OE2-NZ 3.02Å; E218-K220 VanDerWaalsContact C-N 3.32Å; E218-K220 PolarHBondContact O-N 3.49Å; K220-E222 VanDerWaalsContact C-N 3.34Å; K220-L223 PolarHBondContact O-N 2.58Å; K220-A224 WeakPolarHBondContact O-CB 3.45Å; K220-A224 PolarHBondContact O-N 2.84Å; K220-V231 HydrophobicContact CB-CG1 3.94Å; K220-V231 HydrophobicContact CD-CG1 4.39Å; K220-V234 HydrophobicContact CB-CG1 4.26Å; K220-V234 HydrophobicContact CG-CG1 4.29Å
221	E	97.8	Very high	95.9	Very high	100 Å²	100	70.3 Å²	70.3	47%	0.467	37%	0.374	S	S	.	.	H	α-helix	trans	-61.5	-43.1	175.3	-71.3	179.3	-177.4	0	0	111.6	E217 E218 A224 R225 V231	E217-E221 PolarHBondContact O-N 3.1Å; E218-E221 PolarHBondContact O-N 3.34Å; E221-A224 WeakPolarHBondContact O-CB 3.4Å; E221-A224 PolarHBondContact O-N 3.05Å; E221-R225 WeakPolarHBondContact O-CB 3.36Å; E221-R225 PolarHBondContact O-N 2.87Å; E221-V231 HydrophobicContact CG-CG2 4.07Å
222	E	97.6	Very high	96.3	Very high	59 Å²	59	67.9 Å²	67.9	28%	0.276	36%	0.357	S	S	.	.	H	α-helix	trans	-63.2	-46	175.7	-178.8	58.2	-152.2	0	0	112	E218 K220 A224 R225 K226	E218-E222 PolarHBondContact O-N 2.65Å; K220-E222 VanDerWaalsContact C-N 3.34Å; E222-A224 VanDerWaalsContact C-N 3.35Å; E222-A224 PolarHBondContact O-N 2.89Å; E222-R225 PolarHBondContact O-N 3.11Å; E222-R225 IonicContact OE1-NH1 2.63Å; E222-R225 IonicContact OE2-CZ 3.06Å; E222-R225 IonicContact OE2-NH1 3.13Å; E222-R225 PolarHBondContact OE2-NH1 3.38Å; E222-R225 IonicContact OE2-NH2 2.61Å; E222-R225 PolarHBondContact OE2-NH2 3.37Å; E222-K226 HydrophobicContact CG-CD 4.27Å; E222-K226 WeakPolarHBondContact O-CG 3.38Å; E222-K226 PolarHBondContact O-N 3.13Å; E222-K226 WeakPolarHBondContact OE1-CE 3.39Å; E222-K226 IonicContact OE1-NZ 2.83Å; E222-K226 PolarHBondContact OE1-NZ 3.32Å
223	L	97.8	Very high	96.4	Very high	9 Å²	9	67.1 Å²	67.1	5%	0.047	35%	0.351	C	S	.	.	H	α-helix	trans	-63.7	-40.5	176.3	-71.5	168.9	0	0	0	111.8	V201 L202 Y205 A219 K220 K226 C227 V234 F238	V201-L223 HydrophobicContact CG1-CD2 3.85Å; L202-L223 HydrophobicContact CD2-CB 4.28Å; Y205-L223 HydrophobicContact CD1-CD1 4.08Å; Y205-L223 HydrophobicContact CD2-CD1 4.06Å; Y205-L223 HydrophobicContact CD2-CD2 4.17Å; Y205-L223 HydrophobicContact CD2-CG 4.47Å; Y205-L223 HydrophobicContact CE1-CD1 4.43Å; Y205-L223 HydrophobicContact CE2-CD1 4.41Å; Y205-L223 HydrophobicContact CG-CD1 3.88Å; Y205-L223 HydrophobicContact CG-CD2 4.2Å; A219-L223 WeakPolarHBondContact O-CB 3.47Å; A219-L223 VanDerWaalsContact O-CG 3.22Å; A219-L223 WeakPolarHBondContact O-CG 3.42Å; A219-L223 PolarHBondContact O-N 3.45Å; K220-L223 PolarHBondContact O-N 2.58Å; L223-K226 PolarHBondContact O-N 3.35Å; L223-C227 WeakPolarHBondContact O-CB 3.24Å; L223-C227 PolarHBondContact O-N 3.38Å; L223-C227 PolarHBondContact O-SG 2.98Å; L223-V234 HydrophobicContact CB-CG1 4.16Å; L223-V234 HydrophobicContact CB-CG2 4.46Å; L223-V234 HydrophobicContact CD1-CG1 4.33Å; L223-F238 HydrophobicContact CD1-CE2 3.74Å; L223-F238 HydrophobicContact CD1-CZ 3.89Å
224	A	97.7	Very high	96.7	Very high	8 Å²	8	66.3 Å²	66.3	7%	0.066	35%	0.346	C	S	.	.	H	α-helix	trans	-59.4	-46.8	175.4	0	0	0	0	0	110.9	K220 E221 E222 C227 G228 I229 V231 V234	K220-A224 WeakPolarHBondContact O-CB 3.45Å; K220-A224 PolarHBondContact O-N 2.84Å; E221-A224 WeakPolarHBondContact O-CB 3.4Å; E221-A224 PolarHBondContact O-N 3.05Å; E222-A224 VanDerWaalsContact C-N 3.35Å; E222-A224 PolarHBondContact O-N 2.89Å; A224-C227 PolarHBondContact O-N 3.3Å; A224-G228 PolarHBondContact O-N 3.23Å; A224-I229 WeakPolarHBondContact CA-O 3.48Å; A224-I229 VanDerWaalsContact CB-O 3.28Å; A224-I229 WeakPolarHBondContact CB-O 3.41Å; A224-I229 PolarHBondContact O-N 2.88Å; A224-V231 HydrophobicContact CB-CG2 3.89Å; A224-V234 HydrophobicContact CB-CG2 3.91Å
225	R	97.2	Very high	96.8	Very high	172 Å²	172	62 Å²	62	65%	0.649	34%	0.337	S	S	*	.	H	α-helix	trans	-61.4	-46.5	177.1	-155.5	-169.2	-46.7	126.1	12.4	111.9	E221 E222 C227	E221-R225 WeakPolarHBondContact O-CB 3.36Å; E221-R225 PolarHBondContact O-N 2.87Å; E222-R225 PolarHBondContact O-N 3.11Å; E222-R225 IonicContact OE1-NH1 2.63Å; E222-R225 IonicContact OE2-CZ 3.06Å; E222-R225 IonicContact OE2-NH1 3.13Å; E222-R225 PolarHBondContact OE2-NH1 3.38Å; E222-R225 IonicContact OE2-NH2 2.61Å; E222-R225 PolarHBondContact OE2-NH2 3.37Å; R225-C227 VanDerWaalsContact C-N 3.34Å; R225-C227 PolarHBondContact O-N 3.06Å
226	K	96.7	Very high	96.8	Very high	119 Å²	119	65.9 Å²	65.9	52%	0.517	36%	0.357	S	S	.	.	H	α-helix	trans	-64.6	-35.5	178.2	-77.1	172.9	168	147.9	0	113.5	V201 E222 L223	V201-K226 HydrophobicContact CG1-CB 4.2Å; V201-K226 HydrophobicContact CG1-CD 4.41Å; E222-K226 HydrophobicContact CG-CD 4.27Å; E222-K226 WeakPolarHBondContact O-CG 3.38Å; E222-K226 PolarHBondContact O-N 3.13Å; E222-K226 WeakPolarHBondContact OE1-CE 3.39Å; E222-K226 IonicContact OE1-NZ 2.83Å; E222-K226 PolarHBondContact OE1-NZ 3.32Å; L223-K226 PolarHBondContact O-N 3.35Å
227	C	96.8	Very high	96.8	Very high	14 Å²	14	64 Å²	64	10%	0.095	34%	0.339	C	S	.	.	H	α-helix	trans	-90.4	-14.6	-175.7	-66.8	0	0	0	0	113.6	A198 L223 A224 R225 I229	A198-C227 HydrophobicContact CB-CB 3.64Å; A198-C227 PolarHBondContact O-SG 3.01Å; L223-C227 WeakPolarHBondContact O-CB 3.24Å; L223-C227 PolarHBondContact O-N 3.38Å; L223-C227 PolarHBondContact O-SG 2.98Å; A224-C227 PolarHBondContact O-N 3.3Å; R225-C227 VanDerWaalsContact C-N 3.34Å; R225-C227 PolarHBondContact O-N 3.06Å; C227-I229 VanDerWaalsContact C-N 3.33Å; C227-I229 HydrophobicContact CB-CD1 3.96Å; C227-I229 HydrophobicContact CB-CG1 3.71Å
228	G	95.9	Very high	96.9	Very high	70 Å²	70	59.4 Å²	59.4	72%	0.722	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.4	36.1	-172.5	0	0	0	0	0	112.9	A224	A224-G228 PolarHBondContact O-N 3.23Å
229	I	95.6	Very high	96.9	Very high	26 Å²	26	53.1 Å²	53.1	13%	0.133	30%	0.295	C	S	.	.	S	Bend	trans	-127.6	166.7	178.6	65	178.5	0	0	0	110	F194 L202 A224 C227 Q233 V234	F194-I229 HydrophobicContact CD1-CG2 4.04Å; F194-I229 HydrophobicContact CD2-CD1 4.02Å; F194-I229 HydrophobicContact CE1-CD1 4.47Å; F194-I229 HydrophobicContact CE1-CG2 4.17Å; F194-I229 HydrophobicContact CE2-CD1 3.69Å; F194-I229 HydrophobicContact CG-CG2 4.44Å; F194-I229 HydrophobicContact CZ-CD1 3.97Å; L202-I229 HydrophobicContact CD1-CD1 4.03Å; A224-I229 WeakPolarHBondContact CA-O 3.48Å; A224-I229 VanDerWaalsContact CB-O 3.28Å; A224-I229 WeakPolarHBondContact CB-O 3.41Å; A224-I229 PolarHBondContact O-N 2.88Å; C227-I229 VanDerWaalsContact C-N 3.33Å; C227-I229 HydrophobicContact CB-CD1 3.96Å; C227-I229 HydrophobicContact CB-CG1 3.71Å; I229-Q233 HydrophobicContact CB-CB 4.21Å; I229-Q233 HydrophobicContact CD1-CB 4.26Å; I229-Q233 HydrophobicContact CG1-CB 4.41Å; I229-V234 HydrophobicContact CD1-CG2 3.71Å; I229-V234 HydrophobicContact CG1-CG2 3.78Å
230	T	96.8	Very high	96.8	Very high	79 Å²	79	56.5 Å²	56.5	49%	0.485	31%	0.31	S	S	.	.			trans	-76.7	153.4	-179.8	70.9	0	0	0	0	112	S232 Q233 V234	T230-S232 PolarHBondContact O-N 3.17Å; T230-Q233 WeakPolarHBondContact O-CA 3.46Å; T230-Q233 VanDerWaalsContact O-CB 3.31Å; T230-Q233 WeakPolarHBondContact O-CB 3.49Å; T230-Q233 PolarHBondContact O-N 3.12Å; T230-Q233 WeakPolarHBondContact OG1-CG 3.46Å; T230-Q233 PolarHBondContact OG1-N 3.15Å; T230-Q233 PolarHBondContact OG1-OE1 2.92Å; T230-V234 PolarHBondContact O-N 3.19Å
231	V	97.4	Very high	96.7	Very high	45 Å²	45	55.4 Å²	55.4	27%	0.273	31%	0.305	S	S	.	.	H	α-helix	trans	-55.4	-37.7	174.9	-179.4	0	0	0	0	111.5	K220 E221 A224 Q233 V234 S235	K220-V231 HydrophobicContact CB-CG1 3.94Å; K220-V231 HydrophobicContact CD-CG1 4.39Å; E221-V231 HydrophobicContact CG-CG2 4.07Å; A224-V231 HydrophobicContact CB-CG2 3.89Å; V231-Q233 PolarHBondContact O-N 3.06Å; V231-V234 WeakPolarHBondContact O-CB 3.43Å; V231-V234 PolarHBondContact O-N 3.3Å; V231-S235 PolarHBondContact O-N 3.07Å
232	S	96.4	Very high	96.5	Very high	74 Å²	74	53.8 Å²	53.8	52%	0.517	30%	0.295	S	S	.	.	H	α-helix	trans	-63.4	-40.2	174	-177.9	0	0	0	0	112.4	T230 S235 N236	T230-S232 PolarHBondContact O-N 3.17Å; S232-S235 PolarHBondContact O-N 3.19Å; S232-N236 WeakPolarHBondContact O-CB 3.42Å; S232-N236 PolarHBondContact O-N 2.98Å; S232-N236 PolarHBondContact O-ND2 3.15Å; S232-N236 PolarHBondContact OG-ND2 3.36Å
233	Q	95.7	Very high	96.3	Very high	81 Å²	81	55.7 Å²	55.7	38%	0.379	31%	0.306	S	S	.	.	H	α-helix	trans	-63.4	-40.1	174	-78.4	172.5	-41	0	0	112	F194 I229 T230 V231 W237	F194-Q233 HydrophobicContact CE1-CB 4.34Å; F194-Q233 HydrophobicContact CE1-CG 4.4Å; F194-Q233 HydrophobicContact CZ-CB 3.81Å; F194-Q233 HydrophobicContact CZ-CG 4.24Å; I229-Q233 HydrophobicContact CB-CB 4.21Å; I229-Q233 HydrophobicContact CD1-CB 4.26Å; I229-Q233 HydrophobicContact CG1-CB 4.41Å; T230-Q233 WeakPolarHBondContact O-CA 3.46Å; T230-Q233 VanDerWaalsContact O-CB 3.31Å; T230-Q233 WeakPolarHBondContact O-CB 3.49Å; T230-Q233 PolarHBondContact O-N 3.12Å; T230-Q233 WeakPolarHBondContact OG1-CG 3.46Å; T230-Q233 PolarHBondContact OG1-N 3.15Å; T230-Q233 PolarHBondContact OG1-OE1 2.92Å; V231-Q233 PolarHBondContact O-N 3.06Å; Q233-W237 VanDerWaalsContact O-CB 3.28Å; Q233-W237 WeakPolarHBondContact O-CB 3.33Å; Q233-W237 PolarHBondContact O-N 2.79Å
234	V	97.5	Very high	96	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	33%	0.328	C	S	.	.	H	α-helix	trans	-61.6	-52.3	173.2	178.3	0	0	0	0	110.5	L202 K220 L223 A224 I229 T230 V231 N236 W237 F238	L202-V234 HydrophobicContact CD2-CG1 4.13Å; L202-V234 HydrophobicContact CD2-CG2 4.43Å; K220-V234 HydrophobicContact CB-CG1 4.26Å; K220-V234 HydrophobicContact CG-CG1 4.29Å; L223-V234 HydrophobicContact CB-CG1 4.16Å; L223-V234 HydrophobicContact CB-CG2 4.46Å; L223-V234 HydrophobicContact CD1-CG1 4.33Å; A224-V234 HydrophobicContact CB-CG2 3.91Å; I229-V234 HydrophobicContact CD1-CG2 3.71Å; I229-V234 HydrophobicContact CG1-CG2 3.78Å; T230-V234 PolarHBondContact O-N 3.19Å; V231-V234 WeakPolarHBondContact O-CB 3.43Å; V231-V234 PolarHBondContact O-N 3.3Å; V234-N236 VanDerWaalsContact C-N 3.33Å; V234-N236 PolarHBondContact O-N 2.99Å; V234-W237 WeakPolarHBondContact O-CB 3.17Å; V234-W237 PolarHBondContact O-N 3.33Å; V234-F238 HydrophobicContact CG1-CD2 3.75Å; V234-F238 HydrophobicContact CG1-CE2 3.79Å; V234-F238 WeakPolarHBondContact O-CD2 3.33Å; V234-F238 PolarHBondContact O-N 3.05Å
235	S	96.7	Very high	95.5	Very high	55 Å²	55	63.7 Å²	63.7	39%	0.385	33%	0.334	S	S	.	.	H	α-helix	trans	-54.4	-48.5	179.2	-174.2	0	0	0	0	111.8	V231 S232 W237 F238 G239	V231-S235 PolarHBondContact O-N 3.07Å; S232-S235 PolarHBondContact O-N 3.19Å; S235-W237 PolarHBondContact O-N 2.87Å; S235-F238 PolarHBondContact O-N 2.95Å; S235-G239 PolarHBondContact O-N 2.92Å
236	N	96.1	Very high	95.1	Very high	93 Å²	93	63.6 Å²	63.6	50%	0.497	34%	0.338	S	S	.	.	H	α-helix	trans	-64.3	-37.5	176.5	-76.3	-51	0	0	0	112.7	S232 V234 N240	S232-N236 WeakPolarHBondContact O-CB 3.42Å; S232-N236 PolarHBondContact O-N 2.98Å; S232-N236 PolarHBondContact O-ND2 3.15Å; S232-N236 PolarHBondContact OG-ND2 3.36Å; V234-N236 VanDerWaalsContact C-N 3.33Å; V234-N236 PolarHBondContact O-N 2.99Å; N236-N240 WeakPolarHBondContact O-CB 3.3Å; N236-N240 PolarHBondContact O-N 3.34Å; N236-N240 PolarHBondContact O-ND2 2.94Å
237	W	96.7	Very high	94.8	Very high	29 Å²	29	65.6 Å²	65.6	11%	0.11	35%	0.347	C	S	.	.	H	α-helix	trans	-64.2	-46.8	177.6	-172.9	100.1	0	0	0	111.3	F194 L202 N203 F206 Q233 V234 S235 N240 K241	F194-W237 AromaticContact CD2-CD1 3.71Å; F194-W237 HydrophobicContact CE2-CB 4.05Å; F194-W237 AromaticContact CE2-CD1 3.49Å; F194-W237 VanDerWaalsContact CE2-CD1 3.49Å; F194-W237 HydrophobicContact CE2-CG 4.05Å; L202-W237 HydrophobicContact CB-CD2 4.08Å; L202-W237 HydrophobicContact CB-CE3 3.92Å; L202-W237 HydrophobicContact CB-CH2 3.66Å; L202-W237 HydrophobicContact CB-CZ2 3.79Å; L202-W237 HydrophobicContact CB-CZ3 3.73Å; L202-W237 HydrophobicContact CD1-CD2 3.84Å; L202-W237 HydrophobicContact CD1-CE3 4.32Å; L202-W237 HydrophobicContact CD1-CG 3.9Å; L202-W237 HydrophobicContact CG-CD2 4.47Å; N203-W237 VanDerWaalsContact OD1-CH2 3.3Å; N203-W237 WeakPolarHBondContact OD1-CH2 3.47Å; N203-W237 WeakPolarHBondContact OD1-CZ2 3.28Å; F206-W237 HydrophobicContact CB-CH2 4.39Å; F206-W237 HydrophobicContact CB-CZ3 4.23Å; Q233-W237 VanDerWaalsContact O-CB 3.28Å; Q233-W237 WeakPolarHBondContact O-CB 3.33Å; Q233-W237 PolarHBondContact O-N 2.79Å; V234-W237 WeakPolarHBondContact O-CB 3.17Å; V234-W237 PolarHBondContact O-N 3.33Å; S235-W237 PolarHBondContact O-N 2.87Å; W237-N240 PolarHBondContact O-N 3.49Å; W237-K241 HydrophobicContact CD2-CB 4.48Å; W237-K241 HydrophobicContact CE3-CB 4.03Å; W237-K241 HydrophobicContact CE3-CG 4.49Å; W237-K241 HydrophobicContact CH2-CB 4.17Å; W237-K241 HydrophobicContact CH2-CD 3.79Å; W237-K241 HydrophobicContact CH2-CG 3.79Å; W237-K241 HydrophobicContact CZ2-CD 4.11Å; W237-K241 HydrophobicContact CZ2-CG 4.45Å; W237-K241 HydrophobicContact CZ3-CB 3.85Å; W237-K241 HydrophobicContact CZ3-CD 4.33Å; W237-K241 HydrophobicContact CZ3-CG 3.81Å; W237-K241 VanDerWaalsContact O-CB 3.25Å; W237-K241 WeakPolarHBondContact O-CB 3.13Å; W237-K241 PolarHBondContact O-N 3.44Å
238	F	97.6	Very high	94.3	Very high	4 Å²	4	69.7 Å²	69.7	2%	0.018	37%	0.368	C	S	.	.	H	α-helix	trans	-64.7	-44.4	177.9	-86.6	-86.8	0	0	0	112	L202 Y205 F206 P215 L223 V234 S235 N240 K241 R242	L202-F238 HydrophobicContact CD2-CE2 3.71Å; L202-F238 HydrophobicContact CD2-CZ 4.43Å; Y205-F238 AromaticContact CD1-CE1 3.69Å; Y205-F238 HydrophobicContact CD1-CE1 3.69Å; Y205-F238 AromaticContact CD1-CZ 3.51Å; Y205-F238 HydrophobicContact CD1-CZ 3.51Å; Y205-F238 HydrophobicContact CE1-CE1 4.29Å; Y205-F238 HydrophobicContact CE1-CZ 4.28Å; Y205-F238 HydrophobicContact CG-CZ 4.2Å; F206-F238 HydrophobicContact CB-CE1 3.97Å; F206-F238 AromaticContact CD2-CD1 3.88Å; F206-F238 HydrophobicContact CD2-CD1 3.88Å; F206-F238 AromaticContact CD2-CE1 3.95Å; F206-F238 HydrophobicContact CD2-CE1 3.95Å; F206-F238 HydrophobicContact CG-CE1 4.48Å; P215-F238 HydrophobicContact CG-CD1 4.28Å; P215-F238 HydrophobicContact CG-CD2 4.12Å; P215-F238 HydrophobicContact CG-CE1 4.47Å; P215-F238 HydrophobicContact CG-CE2 4.32Å; P215-F238 HydrophobicContact CG-CG 4.12Å; P215-F238 HydrophobicContact CG-CZ 4.5Å; L223-F238 HydrophobicContact CD1-CE2 3.74Å; L223-F238 HydrophobicContact CD1-CZ 3.89Å; V234-F238 HydrophobicContact CG1-CD2 3.75Å; V234-F238 HydrophobicContact CG1-CE2 3.79Å; V234-F238 WeakPolarHBondContact O-CD2 3.33Å; V234-F238 PolarHBondContact O-N 3.05Å; S235-F238 PolarHBondContact O-N 2.95Å; F238-N240 VanDerWaalsContact C-N 3.35Å; F238-N240 PolarHBondContact O-N 3.06Å; F238-K241 PolarHBondContact O-N 3.25Å; F238-R242 WeakPolarHBondContact O-CG 3.36Å; F238-R242 PolarHBondContact O-N 3.29Å
239	G	96.2	Very high	93.6	Very high	23 Å²	23	71.2 Å²	71.2	24%	0.237	36%	0.358	C	S	.	.	H	α-helix	trans	-53.7	-52.1	173.8	0	0	0	0	0	111.7	S235 R242 I243	S235-G239 PolarHBondContact O-N 2.92Å; G239-R242 PolarHBondContact O-N 3.48Å; G239-I243 WeakPolarHBondContact O-CG1 3.43Å; G239-I243 PolarHBondContact O-N 3.33Å
240	N	95.2	Very high	92.9	Very high	89 Å²	89	74.1 Å²	74.1	48%	0.476	39%	0.386	S	S	.	.	H	α-helix	trans	-65	-40.6	178	-75.7	-51.2	0	0	0	113.2	N236 W237 F238 I243 R244	N236-N240 WeakPolarHBondContact O-CB 3.3Å; N236-N240 PolarHBondContact O-N 3.34Å; N236-N240 PolarHBondContact O-ND2 2.94Å; W237-N240 PolarHBondContact O-N 3.49Å; F238-N240 VanDerWaalsContact C-N 3.35Å; F238-N240 PolarHBondContact O-N 3.06Å; N240-I243 PolarHBondContact O-N 3.07Å; N240-R244 WeakPolarHBondContact O-CG 3.43Å; N240-R244 PolarHBondContact O-N 3.09Å
241	K	94.5	Very high	92.1	Very high	14 Å²	14	76.5 Å²	76.5	6%	0.061	39%	0.39	C	S	.	.	H	α-helix	trans	-62.3	-42.3	178.4	-178	75.5	-178.5	-162.7	0	110.9	N203 F206 Y207 W237 F238 R244 Y245 E255	N203-K241 WeakPolarHBondContact OD1-CE 3.41Å; N203-K241 PolarHBondContact OD1-NZ 3.43Å; F206-K241 HydrophobicContact CD1-CG 4Å; F206-K241 HydrophobicContact CD2-CB 4.29Å; F206-K241 HydrophobicContact CD2-CG 3.6Å; F206-K241 HydrophobicContact CE1-CG 3.98Å; F206-K241 HydrophobicContact CE2-CB 4.15Å; F206-K241 HydrophobicContact CE2-CG 3.56Å; F206-K241 HydrophobicContact CG-CG 3.82Å; F206-K241 HydrophobicContact CZ-CG 3.78Å; Y207-K241 PolarHBondContact OH-NZ 3.44Å; W237-K241 HydrophobicContact CD2-CB 4.48Å; W237-K241 HydrophobicContact CE3-CB 4.03Å; W237-K241 HydrophobicContact CE3-CG 4.49Å; W237-K241 HydrophobicContact CH2-CB 4.17Å; W237-K241 HydrophobicContact CH2-CD 3.79Å; W237-K241 HydrophobicContact CH2-CG 3.79Å; W237-K241 HydrophobicContact CZ2-CD 4.11Å; W237-K241 HydrophobicContact CZ2-CG 4.45Å; W237-K241 HydrophobicContact CZ3-CB 3.85Å; W237-K241 HydrophobicContact CZ3-CD 4.33Å; W237-K241 HydrophobicContact CZ3-CG 3.81Å; W237-K241 VanDerWaalsContact O-CB 3.25Å; W237-K241 WeakPolarHBondContact O-CB 3.13Å; W237-K241 PolarHBondContact O-N 3.44Å; F238-K241 PolarHBondContact O-N 3.25Å; K241-R244 PolarHBondContact O-N 3.49Å; K241-Y245 WeakPolarHBondContact O-CB 3.28Å; K241-Y245 PolarHBondContact O-N 3.08Å; K241-E255 IonicContact NZ-OE2 3.88Å
242	R	94.7	Very high	91.2	Very high	67 Å²	67	74.6 Å²	74.6	25%	0.253	38%	0.379	S	S	.	.	H	α-helix	trans	-61.3	-46.9	174.7	-72.9	-171.9	-57.9	-147.3	15	113	F206 P213 Y214 F238 G239 R244 Y245 K246	F206-R242 HydrophobicContact CE2-CG 3.81Å; F206-R242 HydrophobicContact CZ-CG 4.45Å; P213-R242 HydrophobicContact CB-CG 4.15Å; P213-R242 HydrophobicContact CG-CG 3.86Å; P213-R242 WeakPolarHBondContact O-CD 3.43Å; P213-R242 PolarHBondContact O-NH1 3.18Å; Y214-R242 VanDerWaalsContact CE1-CZ 3.44Å; F238-R242 WeakPolarHBondContact O-CG 3.36Å; F238-R242 PolarHBondContact O-N 3.29Å; G239-R242 PolarHBondContact O-N 3.48Å; R242-R244 VanDerWaalsContact C-N 3.3Å; R242-R244 PolarHBondContact O-N 3.3Å; R242-Y245 PolarHBondContact O-N 2.92Å; R242-K246 WeakPolarHBondContact O-CB 3.26Å; R242-K246 PolarHBondContact O-N 3.17Å
243	I	92.8	Very high	90.3	Very high	98 Å²	98	75.1 Å²	75.1	50%	0.503	37%	0.374	S	S	.	.	H	α-helix	trans	-60.8	-42.3	177.9	-61.8	-61.1	0	0	0	110.6	G239 N240 K247	G239-I243 WeakPolarHBondContact O-CG1 3.43Å; G239-I243 PolarHBondContact O-N 3.33Å; N240-I243 PolarHBondContact O-N 3.07Å; I243-K247 HydrophobicContact CG2-CD 4.35Å; I243-K247 WeakPolarHBondContact O-CG 3.4Å; I243-K247 PolarHBondContact O-N 3.17Å; I243-K247 VanDerWaalsContact O-N 3.11Å
244	R	90.8	Very high	89.6	Confident	137 Å²	137	77.5 Å²	77.5	52%	0.517	39%	0.385	S	S	.	.	H	α-helix	trans	-66.2	-43.6	176.1	-72.4	-166	-63.6	-100.6	0.6	113	N240 K241 R242 K247 N248	N240-R244 WeakPolarHBondContact O-CG 3.43Å; N240-R244 PolarHBondContact O-N 3.09Å; K241-R244 PolarHBondContact O-N 3.49Å; R242-R244 VanDerWaalsContact C-N 3.3Å; R242-R244 PolarHBondContact O-N 3.3Å; R244-K247 PolarHBondContact O-N 3.33Å; R244-N248 PolarHBondContact O-N 2.59Å; R244-N248 VanDerWaalsContact O-N 3.13Å
245	Y	88.8	Confident	88.8	Confident	48 Å²	48	81.3 Å²	81.3	19%	0.188	40%	0.402	C	S	.	.	H	α-helix	trans	-59.4	-47.1	177.7	-174.7	-89.6	0	0	0	111	F206 Y207 L210 K241 R242 K247 N248 I249 A252	F206-Y245 AromaticContact CE1-CD2 3.67Å; F206-Y245 HydrophobicContact CE1-CD2 3.67Å; F206-Y245 HydrophobicContact CE1-CE2 4.29Å; F206-Y245 HydrophobicContact CE1-CG 4.02Å; F206-Y245 HydrophobicContact CZ-CD2 4.13Å; F206-Y245 AromaticContact CZ-CG 3.98Å; F206-Y245 HydrophobicContact CZ-CG 3.98Å; Y207-Y245 HydrophobicContact CE1-CE2 4.3Å; L210-Y245 HydrophobicContact CD2-CD2 4.31Å; L210-Y245 HydrophobicContact CD2-CE1 4.32Å; L210-Y245 HydrophobicContact CD2-CE2 3.66Å; K241-Y245 WeakPolarHBondContact O-CB 3.28Å; K241-Y245 PolarHBondContact O-N 3.08Å; R242-Y245 PolarHBondContact O-N 2.92Å; Y245-K247 VanDerWaalsContact C-N 3.35Å; Y245-K247 PolarHBondContact O-N 2.93Å; Y245-N248 CarbonylContact O-C 3.58Å; Y245-N248 PolarHBondContact O-N 3.39Å; Y245-I249 PolarHBondContact O-N 3.22Å; Y245-A252 HydrophobicContact CD2-CB 3.28Å; Y245-A252 HydrophobicContact CE2-CB 3.48Å; Y245-A252 VanDerWaalsContact CE2-CB 3.48Å; Y245-A252 HydrophobicContact CG-CB 4.06Å
246	K	88.7	Confident	87.9	Confident	170 Å²	170	79.1 Å²	79.1	74%	0.739	39%	0.388	S	S	*	.	H	α-helix	trans	-64.8	-35.2	178.6	-170.4	175.3	-179.3	178.3	0	112.9	R242	R242-K246 WeakPolarHBondContact O-CB 3.26Å; R242-K246 PolarHBondContact O-N 3.17Å
247	K	90.9	Very high	87.3	Confident	162 Å²	162	79 Å²	79	70%	0.704	39%	0.387	S	S	*	.	H	α-helix	trans	-73.3	-30.4	178.6	-76.5	-175	176.8	-170.4	0	113.5	I243 R244 Y245	I243-K247 HydrophobicContact CG2-CD 4.35Å; I243-K247 WeakPolarHBondContact O-CG 3.4Å; I243-K247 PolarHBondContact O-N 3.17Å; I243-K247 VanDerWaalsContact O-N 3.11Å; R244-K247 PolarHBondContact O-N 3.33Å; Y245-K247 VanDerWaalsContact C-N 3.35Å; Y245-K247 PolarHBondContact O-N 2.93Å
248	N	85.7	Confident	86.5	Confident	100 Å²	100	83.4 Å²	83.4	54%	0.535	41%	0.41	S	S	.	.			trans	-133.6	58.8	-173.5	-66.7	-48.4	0	0	0	111.7	R244 Y245 A250 K251 A252	R244-N248 PolarHBondContact O-N 2.59Å; R244-N248 VanDerWaalsContact O-N 3.13Å; Y245-N248 CarbonylContact O-C 3.58Å; Y245-N248 PolarHBondContact O-N 3.39Å; N248-A250 VanDerWaalsContact C-N 3.29Å; N248-A250 PolarHBondContact O-N 2.86Å; N248-K251 HydrophobicContact CB-CB 4.33Å; N248-K251 PolarHBondContact O-N 3.04Å; N248-A252 WeakPolarHBondContact O-CB 3.5Å; N248-A252 PolarHBondContact O-N 3.17Å
249	I	81.2	Confident	85.6	Confident	101 Å²	101	86.6 Å²	86.6	52%	0.518	42%	0.423	S	S	.	.	H	α-helix	trans	-54.3	-44.9	-174.5	-60.9	175.2	0	0	0	111.6	Y245 K251 A252 Q253	Y245-I249 PolarHBondContact O-N 3.22Å; I249-K251 PolarHBondContact O-N 3.4Å; I249-A252 PolarHBondContact O-N 3.42Å; I249-Q253 WeakPolarHBondContact O-CB 3.36Å; I249-Q253 PolarHBondContact O-N 2.88Å
250	A	80.7	Confident	84.9	Confident	87 Å²	87	88.5 Å²	88.5	72%	0.719	44%	0.436	S	S	*	.	H	α-helix	trans	-59.2	-49.9	-178.9	0	0	0	0	0	112.9	N248 A252 Q253 E254	N248-A250 VanDerWaalsContact C-N 3.29Å; N248-A250 PolarHBondContact O-N 2.86Å; A250-A252 VanDerWaalsContact C-N 3.3Å; A250-A252 PolarHBondContact O-N 3.49Å; A250-Q253 WeakPolarHBondContact O-CB 3.45Å; A250-Q253 PolarHBondContact O-N 3.27Å; A250-E254 PolarHBondContact O-N 3.48Å
251	K	79.9	Confident	84.2	Confident	129 Å²	129	86.6 Å²	86.6	56%	0.561	43%	0.433	S	S	*	.	H	α-helix	trans	-65.6	-35.8	176.6	-175.7	173.4	180	170.9	0	111.8	N248 I249 Q253 E254 E255	N248-K251 HydrophobicContact CB-CB 4.33Å; N248-K251 PolarHBondContact O-N 3.04Å; I249-K251 PolarHBondContact O-N 3.4Å; K251-Q253 VanDerWaalsContact C-N 3.32Å; K251-E254 WeakPolarHBondContact O-CB 3.37Å; K251-E254 PolarHBondContact O-N 2.93Å; K251-E255 WeakPolarHBondContact O-CG 3.44Å; K251-E255 PolarHBondContact O-N 3.42Å
252	A	77.6	Confident	83.5	Confident	6 Å²	6	89.8 Å²	89.8	5%	0.05	45%	0.447	C	S	.	.	H	α-helix	trans	-72.4	-29.1	-180	0	0	0	0	0	112.7	Y245 N248 I249 A250 E255 A256	Y245-A252 HydrophobicContact CD2-CB 3.28Å; Y245-A252 HydrophobicContact CE2-CB 3.48Å; Y245-A252 VanDerWaalsContact CE2-CB 3.48Å; Y245-A252 HydrophobicContact CG-CB 4.06Å; N248-A252 WeakPolarHBondContact O-CB 3.5Å; N248-A252 PolarHBondContact O-N 3.17Å; I249-A252 PolarHBondContact O-N 3.42Å; A250-A252 VanDerWaalsContact C-N 3.3Å; A250-A252 PolarHBondContact O-N 3.49Å; A252-E255 PolarHBondContact O-N 2.7Å; A252-A256 WeakPolarHBondContact O-CB 3.48Å; A252-A256 PolarHBondContact O-N 3.26Å
253	Q	78.4	Confident	82.5	Confident	85 Å²	85	92.3 Å²	92.3	40%	0.397	46%	0.46	S	S	.	.	H	α-helix	trans	-66.6	-40.9	170.7	-169.6	63.5	44.3	0	0	110.9	I249 A250 K251 A256 N257	I249-Q253 WeakPolarHBondContact O-CB 3.36Å; I249-Q253 PolarHBondContact O-N 2.88Å; A250-Q253 WeakPolarHBondContact O-CB 3.45Å; A250-Q253 PolarHBondContact O-N 3.27Å; K251-Q253 VanDerWaalsContact C-N 3.32Å; Q253-A256 PolarHBondContact O-N 2.95Å; Q253-N257 PolarHBondContact NE2-OD1 3.25Å; Q253-N257 VanDerWaalsContact NE2-OD1 3.13Å; Q253-N257 WeakPolarHBondContact O-CB 3.26Å; Q253-N257 PolarHBondContact O-N 3.13Å; Q253-N257 PolarHBondContact O-OD1 3.39Å
254	E	81	Confident	81.8	Confident	131 Å²	131	90.4 Å²	90.4	61%	0.612	46%	0.459	S	S	*	.	H	α-helix	trans	-61	-46.6	172	-172.3	-174	178.8	0	0	111.4	A250 K251 A256 N257 M258	A250-E254 PolarHBondContact O-N 3.48Å; K251-E254 WeakPolarHBondContact O-CB 3.37Å; K251-E254 PolarHBondContact O-N 2.93Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 2.93Å; E254-N257 PolarHBondContact O-N 3.49Å; E254-M258 WeakPolarHBondContact O-CG 3.48Å; E254-M258 PolarHBondContact O-N 3Å
255	E	81	Confident	81.1	Confident	79 Å²	79	86.8 Å²	86.8	37%	0.369	46%	0.458	S	S	.	.	H	α-helix	trans	-58.8	-44	174	-71.7	178	-169.8	0	0	111.4	Y207 K241 K251 A252 M258 Y259	Y207-E255 VanDerWaalsContact OH-CB 3.31Å; Y207-E255 WeakPolarHBondContact OH-CB 3.34Å; Y207-E255 PolarHBondContact OH-OE2 2.88Å; Y207-E255 VanDerWaalsContact OH-OE2 3.11Å; K241-E255 IonicContact NZ-OE2 3.88Å; K251-E255 WeakPolarHBondContact O-CG 3.44Å; K251-E255 PolarHBondContact O-N 3.42Å; A252-E255 PolarHBondContact O-N 2.7Å; E255-M258 WeakPolarHBondContact O-CB 3.29Å; E255-M258 PolarHBondContact O-N 2.89Å; E255-Y259 VanDerWaalsContact O-CD2 3.3Å; E255-Y259 WeakPolarHBondContact O-CD2 3.48Å; E255-Y259 PolarHBondContact O-N 3.48Å
256	A	77.7	Confident	80.1	Confident	9 Å²	9	89.3 Å²	89.3	7%	0.074	47%	0.472	C	S	.	.	H	α-helix	trans	-61.7	-44.4	178	0	0	0	0	0	111.8	Y207 A252 Q253 E254 M258 Y259 A260	Y207-A256 HydrophobicContact CD1-CB 3.48Å; Y207-A256 VanDerWaalsContact CD1-CB 3.48Å; Y207-A256 HydrophobicContact CE1-CB 3.54Å; Y207-A256 HydrophobicContact CG-CB 4.3Å; A252-A256 WeakPolarHBondContact O-CB 3.48Å; A252-A256 PolarHBondContact O-N 3.26Å; Q253-A256 PolarHBondContact O-N 2.95Å; E254-A256 VanDerWaalsContact C-N 3.33Å; E254-A256 PolarHBondContact O-N 2.93Å; A256-M258 VanDerWaalsContact C-N 3.3Å; A256-M258 PolarHBondContact O-N 2.95Å; A256-Y259 PolarHBondContact O-N 3.3Å; A256-A260 PolarHBondContact O-N 2.78Å
257	N	83.2	Confident	78.7	Confident	91 Å²	91	83.6 Å²	83.6	49%	0.487	46%	0.46	S	S	.	.	H	α-helix	trans	-62.5	-39.3	177	-68.2	-3.2	0	0	0	111	Q253 E254 A260 A261	Q253-N257 PolarHBondContact NE2-OD1 3.25Å; Q253-N257 VanDerWaalsContact NE2-OD1 3.13Å; Q253-N257 WeakPolarHBondContact O-CB 3.26Å; Q253-N257 PolarHBondContact O-N 3.13Å; Q253-N257 PolarHBondContact O-OD1 3.39Å; E254-N257 PolarHBondContact O-N 3.49Å; N257-A260 PolarHBondContact O-N 3.33Å; N257-A261 WeakPolarHBondContact O-CB 3.26Å; N257-A261 PolarHBondContact O-N 2.81Å
258	M	80.2	Confident	77	Confident	122 Å²	122	82.8 Å²	82.8	60%	0.601	46%	0.461	S	S	*	.	H	α-helix	trans	-64.2	-41.2	173.7	-74.6	-67.8	98.4	0	0	112.9	E254 E255 A256 A261 K262	E254-M258 WeakPolarHBondContact O-CG 3.48Å; E254-M258 PolarHBondContact O-N 3Å; E255-M258 WeakPolarHBondContact O-CB 3.29Å; E255-M258 PolarHBondContact O-N 2.89Å; A256-M258 VanDerWaalsContact C-N 3.3Å; A256-M258 PolarHBondContact O-N 2.95Å; M258-A261 HydrophobicContact CE-CB 4.5Å; M258-A261 PolarHBondContact O-N 3.15Å; M258-K262 WeakPolarHBondContact O-CB 3.5Å; M258-K262 PolarHBondContact O-N 3.19Å
259	Y	78.9	Confident	75.6	Confident	70 Å²	70	81.1 Å²	81.1	28%	0.275	46%	0.457	S	S	.	.	H	α-helix	trans	-64.2	-42.8	174.4	-90.7	-81.8	0	0	0	112.1	N203 Y207 E255 A256 K262 K263	N203-Y259 HydrophobicContact CB-CD1 4.22Å; N203-Y259 HydrophobicContact CB-CE1 3.54Å; N203-Y259 HydrophobicContact CB-CE2 3.91Å; N203-Y259 PolarHBondContact ND2-OH 3.29Å; Y207-Y259 HydrophobicContact CD2-CD1 4.48Å; Y207-Y259 AromaticContact CD2-CD2 3.71Å; Y207-Y259 HydrophobicContact CD2-CD2 3.71Å; Y207-Y259 HydrophobicContact CD2-CE2 4.38Å; Y207-Y259 AromaticContact CD2-CG 3.78Å; Y207-Y259 HydrophobicContact CD2-CG 3.78Å; Y207-Y259 AromaticContact CE2-CD2 3.33Å; Y207-Y259 HydrophobicContact CE2-CD2 3.33Å; Y207-Y259 AromaticContact CE2-CE2 3.76Å; Y207-Y259 HydrophobicContact CE2-CE2 3.76Å; Y207-Y259 AromaticContact CE2-CG 3.93Å; Y207-Y259 HydrophobicContact CE2-CG 3.93Å; E255-Y259 VanDerWaalsContact O-CD2 3.3Å; E255-Y259 WeakPolarHBondContact O-CD2 3.48Å; E255-Y259 PolarHBondContact O-N 3.48Å; A256-Y259 PolarHBondContact O-N 3.3Å; Y259-K262 PolarHBondContact O-N 3.3Å; Y259-K263 PolarHBondContact O-N 3.18Å
260	A	80.3	Confident	74	Confident	63 Å²	63	79.7 Å²	79.7	52%	0.521	46%	0.461	S	S	.	.	H	α-helix	trans	-62.3	-45.2	175.9	0	0	0	0	0	111.9	A256 N257 K262 K263 A264	A256-A260 PolarHBondContact O-N 2.78Å; N257-A260 PolarHBondContact O-N 3.33Å; A260-K262 PolarHBondContact O-N 3.08Å; A260-K263 PolarHBondContact O-N 3.24Å; A260-A264 PolarHBondContact O-N 3.08Å
261	A	82.1	Confident	72.5	Confident	50 Å²	50	79.4 Å²	79.4	41%	0.413	46%	0.458	S	S	.	.	H	α-helix	trans	-62.1	-43.2	176.9	0	0	0	0	0	112.2	N257 M258 K263 A264 A265	N257-A261 WeakPolarHBondContact O-CB 3.26Å; N257-A261 PolarHBondContact O-N 2.81Å; M258-A261 HydrophobicContact CE-CB 4.5Å; M258-A261 PolarHBondContact O-N 3.15Å; A261-K263 VanDerWaalsContact C-N 3.33Å; A261-K263 PolarHBondContact O-N 3.28Å; A261-A264 PolarHBondContact O-N 3.33Å; A261-A265 PolarHBondContact O-N 2.81Å
262	K	78.2	Confident	70.7	Confident	81 Å²	81	77.2 Å²	77.2	35%	0.352	46%	0.464	S	S	.	.	H	α-helix	trans	-61.5	-41.4	176.3	-170.7	-176.7	-177.8	-167.9	0	111.9	E200 M258 Y259 A260 A265 Q266	E200-K262 WeakPolarHBondContact OE1-CE 3.44Å; E200-K262 IonicContact OE1-NZ 2.8Å; E200-K262 PolarHBondContact OE1-NZ 2.99Å; E200-K262 IonicContact OE2-NZ 3.28Å; E200-K262 PolarHBondContact OE2-NZ 3.4Å; M258-K262 WeakPolarHBondContact O-CB 3.5Å; M258-K262 PolarHBondContact O-N 3.19Å; Y259-K262 PolarHBondContact O-N 3.3Å; A260-K262 PolarHBondContact O-N 3.08Å; K262-A265 PolarHBondContact O-N 3.48Å; K262-Q266 WeakPolarHBondContact O-CG 3.26Å; K262-Q266 PolarHBondContact O-N 2.95Å
263	K	74.9	Confident	68.8	Low	119 Å²	119	84.4 Å²	84.4	52%	0.517	50%	0.497	S	S	.	.	H	α-helix	trans	-65.2	-40.4	177.2	-161.8	177.2	-176.2	162.2	0	111.7	E204 Y259 A260 A261 Q266 G267	E204-K263 WeakPolarHBondContact OE1-CE 3.47Å; E204-K263 IonicContact OE1-NZ 2.75Å; E204-K263 PolarHBondContact OE1-NZ 3.19Å; Y259-K263 PolarHBondContact O-N 3.18Å; A260-K263 PolarHBondContact O-N 3.24Å; A261-K263 VanDerWaalsContact C-N 3.33Å; A261-K263 PolarHBondContact O-N 3.28Å; K263-Q266 PolarHBondContact O-N 3.46Å; K263-G267 PolarHBondContact O-N 2.88Å
264	A	78.1	Confident	66.7	Low	59 Å²	59	91.5 Å²	91.5	49%	0.488	52%	0.521	S	S	.	.	H	α-helix	trans	-62.7	-42.3	173.8	0	0	0	0	0	112.1	A260 A261 G267 M268	A260-A264 PolarHBondContact O-N 3.08Å; A261-A264 PolarHBondContact O-N 3.33Å; A264-G267 PolarHBondContact O-N 2.63Å; A264-M268 PolarHBondContact O-N 3.47Å
265	A	75.4	Confident	64.2	Low	60 Å²	60	87.8 Å²	87.8	50%	0.496	52%	0.519	S	S	.	.	H	α-helix	trans	-66.4	-38.7	176.9	0	0	0	0	0	113	A261 K262 M268 S269	A261-A265 PolarHBondContact O-N 2.81Å; K262-A265 PolarHBondContact O-N 3.48Å; A265-M268 PolarHBondContact O-N 2.96Å; A265-S269 WeakPolarHBondContact O-CB 3.2Å; A265-S269 PolarHBondContact O-N 2.89Å
266	Q	67.5	Low	61.8	Low	102 Å²	102	93.3 Å²	93.3	48%	0.477	55%	0.547	S	S	.	.	H	α-helix	trans	-65.9	-38.6	173.4	-75.7	176.4	-6.6	0	0	111.9	K262 K263 M268 S269 A270	K262-Q266 WeakPolarHBondContact O-CG 3.26Å; K262-Q266 PolarHBondContact O-N 2.95Å; K263-Q266 PolarHBondContact O-N 3.46Å; Q266-M268 VanDerWaalsContact C-N 3.29Å; Q266-M268 PolarHBondContact O-N 3.26Å; Q266-S269 PolarHBondContact O-N 3.45Å; Q266-A270 WeakPolarHBondContact O-CB 3.49Å; Q266-A270 PolarHBondContact O-N 3.34Å
267	G	58.8	Low	59.4	Low	49 Å²	49	101 Å²	101	51%	0.505	59%	0.585	S	S	.	*	H	α-helix	trans	-60.2	-38.9	171.9	0	0	0	0	0	112.5	K263 A264	K263-G267 PolarHBondContact O-N 2.88Å; A264-G267 PolarHBondContact O-N 2.63Å
268	M	55.7	Low	56.9	Low	146 Å²	146	101 Å²	101	72%	0.719	60%	0.597	S	S	*	*	H	α-helix	trans	-69.5	-39.5	174.4	-133.6	90.4	81	0	0	112.4	A264 A265 Q266 A271	A264-M268 PolarHBondContact O-N 3.47Å; A265-M268 PolarHBondContact O-N 2.96Å; Q266-M268 VanDerWaalsContact C-N 3.29Å; Q266-M268 PolarHBondContact O-N 3.26Å; M268-A271 WeakPolarHBondContact O-CB 3.21Å; M268-A271 PolarHBondContact O-N 3.37Å
269	S	55.7	Low	54.6	Low	65 Å²	65	101 Å²	101	46%	0.455	61%	0.61	S	S	.	*	H	α-helix	trans	-68.2	-37.6	178.2	178.8	0	0	0	0	112.5	A265 Q266 A271 A272 Q273	A265-S269 WeakPolarHBondContact O-CB 3.2Å; A265-S269 PolarHBondContact O-N 2.89Å; Q266-S269 PolarHBondContact O-N 3.45Å; S269-A271 PolarHBondContact O-N 2.99Å; S269-A272 WeakPolarHBondContact O-CA 3.25Å; S269-A272 PolarHBondContact O-N 3.41Å; S269-Q273 PolarHBondContact O-N 3.44Å; S269-Q273 VanDerWaalsContact O-N 3.16Å
270	A	48.5	Very low	52.7	Low	71 Å²	71	103.5 Å²	103.5	59%	0.587	63%	0.634	S	S	*	*	H	α-helix	trans	-60.7	-28.5	175.1	0	0	0	0	0	112.1	Q266 A272	Q266-A270 WeakPolarHBondContact O-CB 3.49Å; Q266-A270 PolarHBondContact O-N 3.34Å; A270-A272 VanDerWaalsContact C-N 3.33Å
271	A	48.3	Very low	50.4	Low	81 Å²	81	104.4 Å²	104.4	67%	0.669	65%	0.65	S	S	*	*	H	α-helix	trans	-73.7	-21.9	171.3	0	0	0	0	0	113.4	M268 S269	M268-A271 WeakPolarHBondContact O-CB 3.21Å; M268-A271 PolarHBondContact O-N 3.37Å; S269-A271 PolarHBondContact O-N 2.99Å
272	A	43.1	Very low	47.9	Very low	82 Å²	82	109.2 Å²	109.2	68%	0.678	67%	0.674	S	S	*	*	H	α-helix	trans	-98.5	-9.9	-175.6	0	0	0	0	0	114.7	S269 A270 Y274	S269-A272 WeakPolarHBondContact O-CA 3.25Å; S269-A272 PolarHBondContact O-N 3.41Å; A270-A272 VanDerWaalsContact C-N 3.33Å; A272-Y274 PolarHBondContact O-N 3.22Å
273	Q	37.1	Very low	45.6	Very low	158 Å²	158	108.8 Å²	108.8	74%	0.738	69%	0.692	S	S	*	*			trans	-92.4	27.1	-171.7	-151.8	173.8	14.8	0	0	115.1	S269 G275	S269-Q273 PolarHBondContact O-N 3.44Å; S269-Q273 VanDerWaalsContact O-N 3.16Å; Q273-G275 VanDerWaalsContact C-N 3.27Å; Q273-G275 PolarHBondContact O-N 2.93Å; Q273-G275 VanDerWaalsContact O-N 3.08Å
274	Y	34.1	Very low	43.4	Very low	233 Å²	233	111.1 Å²	111.1	91%	0.914	71%	0.71	S	S	*	*			trans	-77.7	81.3	160.1	-85.6	-84.8	0	0	0	109.2	A272	A272-Y274 PolarHBondContact O-N 3.22Å
275	G	28.7	Very low	41.2	Very low	54 Å²	54	113.6 Å²	113.6	56%	0.557	72%	0.721	S	S	*	*			trans	145.7	94.2	170	0	0	0	0	0	112.7	Q273	Q273-G275 VanDerWaalsContact C-N 3.27Å; Q273-G275 PolarHBondContact O-N 2.93Å; Q273-G275 VanDerWaalsContact O-N 3.08Å
276	M	31.8	Very low	38.9	Very low	195 Å²	195	118.6 Å²	118.6	96%	0.961	74%	0.738	S	S	*	*				171.4	129.3	124.7	-83.3	-48.5	164.2	0	0	108.8
277	I	26.1	Very low	37.1	Very low	170 Å²	170	120.1 Å²	120.1	87%	0.872	75%	0.754	S	S	*	*			trans	-107.6	133	-174	-62.8	173.7	0	0	0	108
278	A	32.2	Very low	35.8	Very low	91 Å²	91	123.3 Å²	123.3	75%	0.752	77%	0.768	S	S	*	*			trans	173.4	105.4	149.6	0	0	0	0	0	108.7
279	S	31.4	Very low	34.7	Very low	123 Å²	123	121.2 Å²	121.2	86%	0.86	77%	0.768	S	S	*	*				75.1	147.8	86.9	-102.5	0	0	0	0	116.8
280	P	38.5	Very low	33.6	Very low	121 Å²	121	123.8 Å²	123.8	79%	0.786	78%	0.781	S	S	*	*			trans	-117.8	167.4	-136.2	41.1	-30.4	0	0	0	114.9
281	G	32.1	Very low	33.1	Very low	82 Å²	82	124 Å²	124	85%	0.845	78%	0.783	S	S	*	*			trans	-150.2	113	170.8	0	0	0	0	0	112.2
282	V	29.3	Very low	32.7	Very low	152 Å²	152	127.4 Å²	127.4	92%	0.921	79%	0.79	S	S	*	*			trans	-102.4	138.4	177.3	179.3	0	0	0	0	108.2
283	G	29.8	Very low	32.3	Very low	71 Å²	71	130.3 Å²	130.3	73%	0.732	79%	0.793	S	S	*	*			trans	-172.6	99.5	171.9	0	0	0	0	0	113.3
284	N	28.7	Very low	32.4	Very low	169 Å²	169	132.7 Å²	132.7	90%	0.904	80%	0.797	S	S	*	*			trans	-109.7	138.1	165.4	-82.7	-18.7	0	0	0	108.6
285	P	31.6	Very low	32.7	Very low	110 Å²	110	126.6 Å²	126.6	71%	0.714	79%	0.788	S	S	*	*			trans	-134.8	128.1	154.3	31.6	-14.1	0	0	0	114.5
286	I	28.2	Very low	32.9	Very low	165 Å²	165	131.2 Å²	131.2	85%	0.846	80%	0.799	S	S	*	*				66.9	127.6	123.1	-55.2	174.7	0	0	0	120.4
287	V	29.6	Very low	33.4	Very low	134 Å²	134	125 Å²	125	81%	0.812	78%	0.779	S	S	*	*			trans	-72.9	140.3	177.4	175.6	0	0	0	0	111.7
288	S	31.6	Very low	34.1	Very low	116 Å²	116	121.1 Å²	121.1	81%	0.811	77%	0.767	S	S	*	*			trans	-130.3	141.8	165.7	-100.1	0	0	0	0	112.1
289	S	31.8	Very low	34.4	Very low	102 Å²	102	121.2 Å²	121.2	71%	0.713	77%	0.768	S	S	*	*			trans	-45.5	138.3	-167.2	-171.9	0	0	0	0	118
290	T	33.6	Very low	34.9	Very low	120 Å²	120	122.7 Å²	122.7	74%	0.736	76%	0.761	S	S	*	*			trans	-115.8	21.5	174.1	53.8	0	0	0	0	113.3	D292	T290-D292 VanDerWaalsContact C-N 3.32Å; T290-D292 PolarHBondContact O-N 3.4Å
291	A	38.5	Very low	35.1	Very low	74 Å²	74	120.3 Å²	120.3	61%	0.612	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-72.6	-16.3	-171.2	0	0	0	0	0	115.3
292	D	38.4	Very low	35.7	Very low	154 Å²	154	124.5 Å²	124.5	82%	0.824	75%	0.745	S	S	*	*	G	3₁₀ helix	trans	-90.7	-0.5	-172.4	-67.1	-29.4	0	0	0	115.5	T290	T290-D292 VanDerWaalsContact C-N 3.32Å; T290-D292 PolarHBondContact O-N 3.4Å
293	L	36	Very low	36.1	Very low	142 Å²	142	124.5 Å²	124.5	74%	0.743	74%	0.739	S	S	*	*	G	3₁₀ helix	trans	-86.7	-9.8	-179.2	-75.2	172.3	0	0	0	114.5
294	Y	37.8	Very low	36.5	Very low	209 Å²	209	123.4 Å²	123.4	82%	0.82	72%	0.72	S	S	*	*	S	Bend	trans	-81.3	-21.6	-175.5	-111.6	-93.1	0	0	0	114.3
295	S	41.3	Very low	37.1	Very low	105 Å²	105	118.6 Å²	118.6	73%	0.734	70%	0.7	S	S	*	*	S	Bend	trans	-81.6	-17.6	-174.2	-164	0	0	0	0	114.5
296	L	33.7	Very low	37.5	Very low	151 Å²	151	119.9 Å²	119.9	79%	0.791	70%	0.699	S	S	*	*	S	Bend	trans	-89.6	-12.8	179.7	-145	74	0	0	0	113.1
297	A	41.3	Very low	38	Very low	64 Å²	64	117 Å²	117	53%	0.529	69%	0.685	S	S	.	*	S	Bend	trans	-84.8	-22.7	-173.5	0	0	0	0	0	114.4
298	S	40	Very low	38.5	Very low	89 Å²	89	115.7 Å²	115.7	62%	0.622	67%	0.672	S	S	*	*	S	Bend	trans	-81.3	-29.7	-175.5	66.5	0	0	0	0	113.8	Q300 S301	S298-Q300 VanDerWaalsContact C-N 3.32Å; S298-Q300 PolarHBondContact O-N 3.28Å; S298-S301 PolarHBondContact O-OG 2.84Å
299	A	39	Very low	38.9	Very low	93 Å²	93	117.9 Å²	117.9	77%	0.769	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-75.2	-20.5	-179.4	0	0	0	0	0	113.4
300	Q	41.6	Very low	39.2	Very low	153 Å²	153	115.2 Å²	115.2	72%	0.715	66%	0.658	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.7	-9.2	179.6	-100.9	177	-10.4	0	0	114.4	S298 Q302 S304	S298-Q300 VanDerWaalsContact C-N 3.32Å; S298-Q300 PolarHBondContact O-N 3.28Å; Q300-Q302 PolarHBondContact O-N 3.06Å; Q300-S304 PolarHBondContact O-OG 3.41Å
301	S	42.5	Very low	39.4	Very low	71 Å²	71	114.4 Å²	114.4	50%	0.497	65%	0.648	S	S	.	*	T	Hydrogen-bonded Turn	trans	-78.8	-14.3	-170.1	83	0	0	0	0	114.9	S298 S304	S298-S301 PolarHBondContact O-OG 2.84Å; S301-S304 PolarHBondContact O-OG 2.96Å
302	Q	44.7	Very low	39.4	Very low	171 Å²	171	118.9 Å²	118.9	80%	0.799	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-18.5	-177.7	-66.5	-163.2	18.3	0	0	114.3	Q300	Q300-Q302 PolarHBondContact O-N 3.06Å
303	L	38.1	Very low	39.4	Very low	152 Å²	152	119.6 Å²	119.6	80%	0.796	66%	0.655	S	S	*	*	T	Hydrogen-bonded Turn	trans	-100.2	-12.3	176	-68.4	175.1	0	0	0	113.4
304	S	39.1	Very low	39.5	Very low	48 Å²	48	116.8 Å²	116.8	34%	0.336	64%	0.64	S	S	.	*	H	α-helix	trans	-81.9	-19.4	-176.8	54.2	0	0	0	0	115	Q300 S301 I306 L307 I308	Q300-S304 PolarHBondContact O-OG 3.41Å; S301-S304 PolarHBondContact O-OG 2.96Å; S304-I306 PolarHBondContact O-N 3.01Å; S304-L307 PolarHBondContact O-N 3.24Å; S304-I308 VanDerWaalsContact O-CG1 3.3Å; S304-I308 WeakPolarHBondContact O-CG1 3.5Å; S304-I308 PolarHBondContact O-N 3.15Å; S304-I308 VanDerWaalsContact O-N 3.12Å
305	S	40.6	Very low	39.4	Very low	68 Å²	68	111.3 Å²	111.3	48%	0.476	64%	0.638	S	S	.	*	H	α-helix	trans	-70.1	-34.2	-174.5	61.1	0	0	0	0	113.2
306	I	40.6	Very low	39.1	Very low	137 Å²	137	110 Å²	110	70%	0.703	64%	0.641	S	S	*	*	H	α-helix	trans	-72.8	-34.9	179.3	-62.9	175.3	0	0	0	111.2	S304	S304-I306 PolarHBondContact O-N 3.01Å
307	L	37.4	Very low	39	Very low	104 Å²	104	105.6 Å²	105.6	55%	0.545	63%	0.626	S	S	.	*	H	α-helix	trans	-82.4	-31.7	-178.4	-69.9	176.7	0	0	0	113.7	S304 Q309 G310 L311	S304-L307 PolarHBondContact O-N 3.24Å; L307-Q309 VanDerWaalsContact C-N 3.34Å; L307-G310 PolarHBondContact O-N 3.01Å; L307-L311 PolarHBondContact O-N 3.06Å
308	I	40.1	Very low	38.6	Very low	106 Å²	106	106.8 Å²	106.8	54%	0.544	64%	0.636	S	S	.	*	H	α-helix	trans	-69.2	-34.7	178.4	-67.5	170.4	0	0	0	111.2	S304 G310 L311 H312	S304-I308 VanDerWaalsContact O-CG1 3.3Å; S304-I308 WeakPolarHBondContact O-CG1 3.5Å; S304-I308 PolarHBondContact O-N 3.15Å; S304-I308 VanDerWaalsContact O-N 3.12Å; I308-G310 VanDerWaalsContact C-N 3.31Å; I308-G310 PolarHBondContact O-N 2.96Å; I308-L311 PolarHBondContact O-N 3.43Å; I308-H312 PolarHBondContact O-N 2.85Å
309	Q	41.6	Very low	38.5	Very low	163 Å²	163	111.1 Å²	111.1	76%	0.762	65%	0.646	S	S	*	*	H	α-helix	trans	-65.9	-33.6	174.5	-72.5	-177.6	-6.7	0	0	112.3	L307	L307-Q309 VanDerWaalsContact C-N 3.34Å
310	G	36.7	Very low	38.4	Very low	45 Å²	45	112 Å²	112	46%	0.464	65%	0.647	S	S	.	*	H	α-helix	trans	-68.8	-34	174.6	0	0	0	0	0	114.1	L307 I308	L307-G310 PolarHBondContact O-N 3.01Å; I308-G310 VanDerWaalsContact C-N 3.31Å; I308-G310 PolarHBondContact O-N 2.96Å
311	L	38.7	Very low	38.3	Very low	103 Å²	103	109.7 Å²	109.7	54%	0.539	64%	0.639	S	S	.	*	H	α-helix	trans	-80.9	-26.9	-173.9	-76.8	161.9	0	0	0	114	L307 I308 H313 L314 A315	L307-L311 PolarHBondContact O-N 3.06Å; I308-L311 PolarHBondContact O-N 3.43Å; L311-H313 PolarHBondContact O-N 2.9Å; L311-L314 PolarHBondContact O-N 3.17Å; L311-L314 VanDerWaalsContact O-N 3.13Å; L311-A315 PolarHBondContact O-N 3.37Å
312	H	37.6	Very low	38.1	Very low	168 Å²	168	108 Å²	108	78%	0.778	63%	0.629	S	S	*	*	H	α-helix	trans	-68.4	-24.1	176	-123.6	-110.9	0	0	0	112.5	I308	I308-H312 PolarHBondContact O-N 2.85Å
313	H	39.8	Very low	37.8	Very low	170 Å²	170	106.1 Å²	106.1	79%	0.787	62%	0.619	S	S	*	*	H	α-helix	trans	-79.5	-21	173	-142.3	68.8	0	0	0	112.9	L311	L311-H313 PolarHBondContact O-N 2.9Å
314	L	36.7	Very low	37.9	Very low	82 Å²	82	102.2 Å²	102.2	43%	0.429	61%	0.605	S	S	.	*	H	α-helix	trans	-91.7	-19.4	-175.2	-131.4	76.9	0	0	0	114.4	L311 G316 A317	L311-L314 PolarHBondContact O-N 3.17Å; L311-L314 VanDerWaalsContact O-N 3.13Å; L314-G316 PolarHBondContact O-N 2.98Å; L314-G316 VanDerWaalsContact O-N 3.09Å; L314-A317 PolarHBondContact O-N 3.27Å
315	A	37.1	Very low	37.9	Very low	95 Å²	95	104.8 Å²	104.8	79%	0.785	62%	0.615	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.4	-13.9	178.8	0	0	0	0	0	113.7	L311	L311-A315 PolarHBondContact O-N 3.37Å
316	G	33.6	Very low	37.8	Very low	77 Å²	77	106 Å²	106	79%	0.794	61%	0.614	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.7	-15.3	171.7	0	0	0	0	0	115	L314 A318	L314-G316 PolarHBondContact O-N 2.98Å; L314-G316 VanDerWaalsContact O-N 3.09Å; G316-A318 PolarHBondContact O-N 3.44Å
317	A	33.1	Very low	37.7	Very low	59 Å²	59	102.3 Å²	102.3	49%	0.488	60%	0.601	S	S	.	*			trans	-107.2	64.6	-170.4	0	0	0	0	0	111.4	L314 Q319	L314-A317 PolarHBondContact O-N 3.27Å; A317-Q319 VanDerWaalsContact C-N 3.26Å; A317-Q319 PolarHBondContact O-N 3.46Å
318	A	31.7	Very low	38	Very low	88 Å²	88	99.8 Å²	99.8	73%	0.727	60%	0.595	S	S	*	*			trans	-71.6	84.3	163.2	0	0	0	0	0	109.1	G316	G316-A318 PolarHBondContact O-N 3.44Å
319	Q	38.9	Very low	38	Very low	180 Å²	180	97.6 Å²	97.6	84%	0.841	59%	0.593	S	S	*	*	S	Bend	trans	-168.5	137.8	158.7	-103.4	152.9	85.3	0	0	110.6	A317 N321	A317-Q319 VanDerWaalsContact C-N 3.26Å; A317-Q319 PolarHBondContact O-N 3.46Å; Q319-N321 VanDerWaalsContact C-N 3.28Å; Q319-N321 PolarHBondContact O-N 3.41Å
320	S	37.1	Very low	38	Very low	111 Å²	111	97.7 Å²	97.7	78%	0.776	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.9	8.7	-151	49.4	0	0	0	0	119.6
321	N	39.3	Very low	38.2	Very low	105 Å²	105	98.2 Å²	98.2	56%	0.561	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-116.4	-7	-164.5	-63.4	-6.1	0	0	0	115.3	Q319 F323 S324	Q319-N321 VanDerWaalsContact C-N 3.28Å; Q319-N321 PolarHBondContact O-N 3.41Å; N321-F323 PolarHBondContact O-N 2.92Å; N321-F323 VanDerWaalsContact O-N 3.1Å; N321-S324 PolarHBondContact O-N 3.02Å; N321-S324 PolarHBondContact O-OG 3.39Å
322	A	37.5	Very low	38.6	Very low	35 Å²	35	97.9 Å²	97.9	29%	0.289	58%	0.582	S	S	.	*	H	α-helix	trans	-63.6	-22.2	-179.2	0	0	0	0	0	114	D325 I326	A322-D325 PolarHBondContact O-N 2.97Å; A322-I326 WeakPolarHBondContact O-CG1 3.46Å; A322-I326 PolarHBondContact O-N 3.13Å
323	F	37.5	Very low	39.1	Very low	133 Å²	133	92.7 Å²	92.7	58%	0.583	57%	0.565	S	S	*	*	H	α-helix	trans	-70.8	-38.5	-177.6	-164.2	-99.3	0	0	0	113	T173 N321 D325	T173-F323 HydrophobicContact CG2-CD2 4.31Å; T173-F323 HydrophobicContact CG2-CE2 3.36Å; T173-F323 HydrophobicContact CG2-CZ 3.81Å; N321-F323 PolarHBondContact O-N 2.92Å; N321-F323 VanDerWaalsContact O-N 3.1Å; F323-D325 VanDerWaalsContact C-N 3.33Å
324	S	40.5	Very low	39.4	Very low	70 Å²	70	88.6 Å²	88.6	49%	0.49	55%	0.548	S	S	.	.	H	α-helix	trans	-67.9	-37.9	174.9	50.5	0	0	0	0	111.2	N321 A328	N321-S324 PolarHBondContact O-N 3.02Å; N321-S324 PolarHBondContact O-OG 3.39Å; S324-A328 VanDerWaalsContact O-CB 3.25Å; S324-A328 WeakPolarHBondContact O-CB 3.4Å; S324-A328 PolarHBondContact O-N 2.97Å
325	D	39.3	Very low	39.7	Very low	102 Å²	102	89.1 Å²	89.1	55%	0.545	56%	0.555	S	S	.	*	H	α-helix	trans	-76	-39.2	-169.3	-61.4	-11.8	0	0	0	112.1	A322 F323 A328 A329	A322-D325 PolarHBondContact O-N 2.97Å; F323-D325 VanDerWaalsContact C-N 3.33Å; D325-A328 PolarHBondContact O-N 3.24Å; D325-A329 WeakPolarHBondContact O-CB 3.44Å; D325-A329 PolarHBondContact O-N 3.36Å
326	I	39.7	Very low	40	Very low	92 Å²	92	88.5 Å²	88.5	47%	0.472	55%	0.545	S	S	.	.	H	α-helix	trans	-67.7	-42.8	176.1	-64.4	169.4	0	0	0	110.6	A322 A328 A329 Y330	A322-I326 WeakPolarHBondContact O-CG1 3.46Å; A322-I326 PolarHBondContact O-N 3.13Å; I326-A328 VanDerWaalsContact C-N 3.33Å; I326-A329 PolarHBondContact O-N 2.85Å; I326-Y330 PolarHBondContact O-N 3.38Å; I326-Y330 VanDerWaalsContact O-N 3.1Å
327	S	37.6	Very low	40.4	Very low	60 Å²	60	90.1 Å²	90.1	42%	0.42	53%	0.527	S	S	.	.	H	α-helix	trans	-59.9	-45.6	173.4	174.6	0	0	0	0	110.6	N331	S327-N331 VanDerWaalsContact O-CB 3.31Å; S327-N331 WeakPolarHBondContact O-CB 3.34Å; S327-N331 PolarHBondContact O-N 3.39Å; S327-N331 PolarHBondContact O-ND2 2.89Å; S327-N331 PolarHBondContact OG-ND2 2.9Å
328	A	42.9	Very low	40.8	Very low	52 Å²	52	90.3 Å²	90.3	43%	0.43	52%	0.518	S	S	.	.	H	α-helix	trans	-61.1	-48.8	178.5	0	0	0	0	0	111.7	S324 D325 I326 Y330 N331 T332	S324-A328 VanDerWaalsContact O-CB 3.25Å; S324-A328 WeakPolarHBondContact O-CB 3.4Å; S324-A328 PolarHBondContact O-N 2.97Å; D325-A328 PolarHBondContact O-N 3.24Å; I326-A328 VanDerWaalsContact C-N 3.33Å; A328-Y330 PolarHBondContact O-N 3Å; A328-N331 PolarHBondContact O-N 2.77Å; A328-T332 PolarHBondContact O-N 3.26Å; A328-T332 PolarHBondContact O-OG1 3.12Å
329	A	41	Very low	41.3	Very low	60 Å²	60	93.1 Å²	93.1	50%	0.496	51%	0.514	S	S	.	.	H	α-helix	trans	-61.7	-40.4	-178.3	0	0	0	0	0	113.3	D325 I326 T332 S333	D325-A329 WeakPolarHBondContact O-CB 3.44Å; D325-A329 PolarHBondContact O-N 3.36Å; I326-A329 PolarHBondContact O-N 2.85Å; A329-T332 PolarHBondContact O-OG1 3.11Å; A329-S333 PolarHBondContact O-N 3.29Å
330	Y	41.5	Very low	41.2	Very low	165 Å²	165	86.8 Å²	86.8	65%	0.647	49%	0.488	S	S	*	.	H	α-helix	trans	-69.9	-38.4	175.2	-104.4	-87.3	0	0	0	112.3	I326 A328 S333 L334	I326-Y330 PolarHBondContact O-N 3.38Å; I326-Y330 VanDerWaalsContact O-N 3.1Å; A328-Y330 PolarHBondContact O-N 3Å; Y330-S333 PolarHBondContact O-N 3.23Å; Y330-L334 PolarHBondContact O-N 2.93Å
331	N	41.3	Very low	41.3	Very low	55 Å²	55	84.9 Å²	84.9	29%	0.294	47%	0.469	S	S	.	.	H	α-helix	trans	-65.7	-43	178.4	-76.8	-44.1	0	0	0	112	F162 S327 A328 V335	F162-N331 WeakPolarHBondContact CE2-OD1 3.48Å; F162-N331 WeakPolarHBondContact CZ-OD1 3.34Å; S327-N331 VanDerWaalsContact O-CB 3.31Å; S327-N331 WeakPolarHBondContact O-CB 3.34Å; S327-N331 PolarHBondContact O-N 3.39Å; S327-N331 PolarHBondContact O-ND2 2.89Å; S327-N331 PolarHBondContact OG-ND2 2.9Å; A328-N331 PolarHBondContact O-N 2.77Å; N331-V335 VanDerWaalsContact O-CG2 3.3Å; N331-V335 WeakPolarHBondContact O-CG2 3.22Å; N331-V335 PolarHBondContact O-N 3.5Å; N331-V335 VanDerWaalsContact O-N 3.14Å
332	T	47.3	Very low	41.4	Very low	97 Å²	97	83.6 Å²	83.6	60%	0.595	47%	0.467	S	S	*	.	H	α-helix	trans	-65.1	-40.7	176.9	21.7	0	0	0	0	112.3	A328 A329 L334 V335 S336	A328-T332 PolarHBondContact O-N 3.26Å; A328-T332 PolarHBondContact O-OG1 3.12Å; A329-T332 PolarHBondContact O-OG1 3.11Å; T332-L334 PolarHBondContact O-N 3.32Å; T332-V335 PolarHBondContact O-N 3.03Å; T332-S336 VanDerWaalsContact O-CB 3.28Å; T332-S336 WeakPolarHBondContact O-CB 3.39Å; T332-S336 PolarHBondContact O-N 3.41Å
333	S	47.9	Very low	41.4	Very low	59 Å²	59	88.3 Å²	88.3	41%	0.413	48%	0.481	S	S	.	.	H	α-helix	trans	-60.7	-44	-179.8	-175.1	0	0	0	0	112.2	A329 Y330 S336 Y337	A329-S333 PolarHBondContact O-N 3.29Å; Y330-S333 PolarHBondContact O-N 3.23Å; S333-S336 PolarHBondContact O-N 3.49Å; S333-Y337 WeakPolarHBondContact O-CB 3.29Å; S333-Y337 PolarHBondContact O-N 3.11Å
334	L	45	Very low	41.3	Very low	84 Å²	84	87.3 Å²	87.3	44%	0.44	47%	0.474	S	S	.	.	H	α-helix	trans	-73.3	-38.3	-180	-72	178.3	0	0	0	113.3	Y330 T332 S336 Y337 F338	Y330-L334 PolarHBondContact O-N 2.93Å; T332-L334 PolarHBondContact O-N 3.32Å; L334-S336 VanDerWaalsContact C-N 3.29Å; L334-S336 PolarHBondContact O-N 3.19Å; L334-Y337 PolarHBondContact O-N 3.36Å; L334-F338 WeakPolarHBondContact O-CB 3.34Å; L334-F338 PolarHBondContact O-N 2.91Å
335	V	43.6	Very low	41.4	Very low	93 Å²	93	87.7 Å²	87.7	56%	0.564	48%	0.475	S	S	*	.	H	α-helix	trans	-63.1	-40.3	174.2	173.6	0	0	0	0	110.4	N331 T332 F338 F339	N331-V335 VanDerWaalsContact O-CG2 3.3Å; N331-V335 WeakPolarHBondContact O-CG2 3.22Å; N331-V335 PolarHBondContact O-N 3.5Å; N331-V335 VanDerWaalsContact O-N 3.14Å; T332-V335 PolarHBondContact O-N 3.03Å; V335-F338 WeakPolarHBondContact O-CB 3.38Å; V335-F338 PolarHBondContact O-N 3.49Å; V335-F339 PolarHBondContact O-N 3.05Å
336	S	44.8	Very low	41.7	Very low	82 Å²	82	88.6 Å²	88.6	57%	0.573	48%	0.48	S	S	*	.	H	α-helix	trans	-66.6	-41	177	-155.6	0	0	0	0	112	T332 S333 L334 F338 F339 C340	T332-S336 VanDerWaalsContact O-CB 3.28Å; T332-S336 WeakPolarHBondContact O-CB 3.39Å; T332-S336 PolarHBondContact O-N 3.41Å; S333-S336 PolarHBondContact O-N 3.49Å; L334-S336 VanDerWaalsContact C-N 3.29Å; L334-S336 PolarHBondContact O-N 3.19Å; S336-F338 VanDerWaalsContact C-N 3.26Å; S336-F338 PolarHBondContact O-N 3.45Å; S336-F339 PolarHBondContact O-N 3.41Å; S336-C340 PolarHBondContact O-N 2.97Å; S336-C340 VanDerWaalsContact O-N 3.14Å
337	Y	40.1	Very low	41.4	Very low	110 Å²	110	89.7 Å²	89.7	43%	0.431	49%	0.486	S	S	.	.	H	α-helix	trans	-59.4	-39.9	171.8	-171.2	-101.8	0	0	0	111.3	S333 L334 C340 I341 P349	S333-Y337 WeakPolarHBondContact O-CB 3.29Å; S333-Y337 PolarHBondContact O-N 3.11Å; L334-Y337 PolarHBondContact O-N 3.36Å; Y337-C340 WeakPolarHBondContact O-CB 3.42Å; Y337-C340 PolarHBondContact O-N 2.9Å; Y337-I341 HydrophobicContact CD1-CD1 3.89Å; Y337-I341 HydrophobicContact CE1-CD1 3.38Å; Y337-I341 HydrophobicContact CE1-CG1 4.29Å; Y337-I341 PolarHBondContact O-N 3.48Å; Y337-I341 VanDerWaalsContact O-N 3.1Å; Y337-P349 WeakPolarHBondContact OH-CB 3.39Å
338	F	42.4	Very low	41.4	Very low	64 Å²	64	92.8 Å²	92.8	28%	0.281	50%	0.498	S	S	.	.	H	α-helix	trans	-70.1	-42.9	179.7	-159.1	-105.8	0	0	0	113.3	I158 L334 V335 S336 C340 I341 C342	I158-F338 HydrophobicContact CD1-CD2 3.89Å; I158-F338 HydrophobicContact CD1-CE1 3.86Å; I158-F338 HydrophobicContact CD1-CE2 3Å; I158-F338 HydrophobicContact CD1-CZ 2.99Å; I158-F338 HydrophobicContact CG1-CE2 4.08Å; I158-F338 HydrophobicContact CG1-CZ 4.37Å; L334-F338 WeakPolarHBondContact O-CB 3.34Å; L334-F338 PolarHBondContact O-N 2.91Å; V335-F338 WeakPolarHBondContact O-CB 3.38Å; V335-F338 PolarHBondContact O-N 3.49Å; S336-F338 VanDerWaalsContact C-N 3.26Å; S336-F338 PolarHBondContact O-N 3.45Å; F338-C340 PolarHBondContact O-N 2.83Å; F338-I341 PolarHBondContact O-N 2.8Å; F338-C342 WeakPolarHBondContact CE1-SG 3.33Å; F338-C342 WeakPolarHBondContact CZ-SG 3.49Å; F338-C342 WeakPolarHBondContact O-CB 3.43Å; F338-C342 PolarHBondContact O-N 2.97Å; F338-C342 PolarHBondContact O-SG 3.19Å
339	F	42.9	Very low	40.9	Very low	147 Å²	147	94.1 Å²	94.1	65%	0.645	50%	0.502	S	S	*	.	H	α-helix	trans	-59.9	-34.6	174.9	-138.8	-90.7	0	0	0	111.2	V335 S336 K343	V335-F339 PolarHBondContact O-N 3.05Å; S336-F339 PolarHBondContact O-N 3.41Å; F339-K343 WeakPolarHBondContact O-CB 3.48Å; F339-K343 PolarHBondContact O-N 3.4Å
340	C	36.7	Very low	40.9	Very low	46 Å²	46	97.3 Å²	97.3	31%	0.311	52%	0.516	S	S	.	.	H	α-helix	trans	-67.3	-47.3	175.8	-164.2	0	0	0	0	112.3	S336 Y337 F338 C342 K343 Y344	S336-C340 PolarHBondContact O-N 2.97Å; S336-C340 VanDerWaalsContact O-N 3.14Å; Y337-C340 WeakPolarHBondContact O-CB 3.42Å; Y337-C340 PolarHBondContact O-N 2.9Å; F338-C340 PolarHBondContact O-N 2.83Å; C340-C342 PolarHBondContact O-N 3.34Å; C340-K343 PolarHBondContact O-N 3.46Å; C340-Y344 WeakPolarHBondContact O-CB 3.26Å; C340-Y344 PolarHBondContact O-N 3.1Å
341	I	39.3	Very low	40.5	Very low	72 Å²	72	97.7 Å²	97.7	37%	0.369	52%	0.523	S	S	.	.	H	α-helix	trans	-61.7	-43.5	176.6	-69.2	-178.1	0	0	0	111.2	Y337 F338 Y344 P345	Y337-I341 HydrophobicContact CD1-CD1 3.89Å; Y337-I341 HydrophobicContact CE1-CD1 3.38Å; Y337-I341 HydrophobicContact CE1-CG1 4.29Å; Y337-I341 PolarHBondContact O-N 3.48Å; Y337-I341 VanDerWaalsContact O-N 3.1Å; F338-I341 PolarHBondContact O-N 2.8Å; I341-Y344 CarbonylContact O-C 3.58Å; I341-Y344 VanDerWaalsContact O-C 3.31Å; I341-Y344 PolarHBondContact O-N 3.41Å; I341-P345 VanDerWaalsContact O-CA 3.26Å; I341-P345 WeakPolarHBondContact O-CA 3.45Å; I341-P345 VanDerWaalsContact O-N 3.12Å
342	C	39.8	Very low	40.2	Very low	77 Å²	77	102.7 Å²	102.7	52%	0.52	54%	0.543	S	S	.	.	H	α-helix	trans	-66.2	-38.8	179.2	-72	0	0	0	0	112.6	F338 C340	F338-C342 WeakPolarHBondContact CE1-SG 3.33Å; F338-C342 WeakPolarHBondContact CZ-SG 3.49Å; F338-C342 WeakPolarHBondContact O-CB 3.43Å; F338-C342 PolarHBondContact O-N 2.97Å; F338-C342 PolarHBondContact O-SG 3.19Å; C340-C342 PolarHBondContact O-N 3.34Å
343	K	37.9	Very low	39.5	Very low	135 Å²	135	107.1 Å²	107.1	59%	0.587	56%	0.556	S	S	*	*	H	α-helix	trans	-77.4	-27.1	179.5	-162.4	174.6	-179.6	-172.9	0	112.1	F339 C340	F339-K343 WeakPolarHBondContact O-CB 3.48Å; F339-K343 PolarHBondContact O-N 3.4Å; C340-K343 PolarHBondContact O-N 3.46Å
344	Y	36.8	Very low	38.7	Very low	111 Å²	111	111.3 Å²	111.3	44%	0.435	57%	0.571	S	S	.	*			trans	-141.3	71.2	-174.7	-54	-75	0	0	0	112.1	C340 I341 N346 L347	C340-Y344 WeakPolarHBondContact O-CB 3.26Å; C340-Y344 PolarHBondContact O-N 3.1Å; I341-Y344 CarbonylContact O-C 3.58Å; I341-Y344 VanDerWaalsContact O-C 3.31Å; I341-Y344 PolarHBondContact O-N 3.41Å; Y344-N346 PolarHBondContact O-N 3Å; Y344-L347 VanDerWaalsContact CB-CD1 3.46Å; Y344-L347 HydrophobicContact CD2-CD1 4.19Å; Y344-L347 HydrophobicContact CG-CD1 3.83Å; Y344-L347 PolarHBondContact O-N 3.48Å
345	P	41.6	Very low	37.9	Very low	78 Å²	78	112 Å²	112	51%	0.506	59%	0.589	S	S	.	*	T	Hydrogen-bonded Turn	trans	-65.8	-7.2	-172.8	23.7	-33.9	0	0	0	115.3	I341	I341-P345 VanDerWaalsContact O-CA 3.26Å; I341-P345 WeakPolarHBondContact O-CA 3.45Å; I341-P345 VanDerWaalsContact O-N 3.12Å
346	N	46.4	Very low	37.3	Very low	122 Å²	122	113 Å²	113	65%	0.652	60%	0.601	S	S	*	*	T	Hydrogen-bonded Turn	trans	-112	12.1	-178.1	-63.2	-42.2	0	0	0	113.4	Y344	Y344-N346 PolarHBondContact O-N 3Å
347	L	33	Very low	36.5	Very low	114 Å²	114	112.6 Å²	112.6	60%	0.597	61%	0.609	S	S	*	*			trans	-81.4	126.6	170.6	-84.4	167.3	0	0	0	109.9	Y344	Y344-L347 VanDerWaalsContact CB-CD1 3.46Å; Y344-L347 HydrophobicContact CD2-CD1 4.19Å; Y344-L347 HydrophobicContact CG-CD1 3.83Å; Y344-L347 PolarHBondContact O-N 3.48Å
348	N	36.5	Very low	36	Very low	126 Å²	126	111.9 Å²	111.9	67%	0.674	63%	0.626	S	S	*	*			trans	-69.7	125.2	174.3	-147.8	-23.6	0	0	0	108.7	T350	N348-T350 PolarHBondContact O-N 3.23Å
349	P	34	Very low	35.3	Very low	80 Å²	80	111.9 Å²	111.9	52%	0.519	64%	0.644	S	S	.	*	G	3₁₀ helix	trans	-69.9	2.2	-167	22.2	-32.7	0	0	0	116.4	Y337 H351	Y337-P349 WeakPolarHBondContact OH-CB 3.39Å; P349-H351 VanDerWaalsContact C-N 3.31Å; P349-H351 PolarHBondContact O-N 3.12Å
350	T	40.4	Very low	34.7	Very low	127 Å²	127	111.6 Å²	111.6	78%	0.779	65%	0.654	S	S	*	*	G	3₁₀ helix	trans	-79.6	-3.2	-176.1	50.5	0	0	0	0	115.2	N348	N348-T350 PolarHBondContact O-N 3.23Å
351	H	33.9	Very low	34.3	Very low	173 Å²	173	119.3 Å²	119.3	80%	0.801	68%	0.682	S	S	*	*	G	3₁₀ helix	trans	-94.4	13.6	-177.7	-154.7	-79.7	0	0	0	115	P349	P349-H351 VanDerWaalsContact C-N 3.31Å; P349-H351 PolarHBondContact O-N 3.12Å
352	F	33.6	Very low	33.8	Very low	160 Å²	160	118.5 Å²	118.5	70%	0.702	69%	0.692	S	S	*	*			trans	-103.3	85.9	172.6	-111.3	-93	0	0	0	111	M354	F352-M354 PolarHBondContact O-N 2.81Å; F352-M354 VanDerWaalsContact O-N 3.07Å
353	Q	33.4	Very low	33.1	Very low	189 Å²	189	120.6 Å²	120.6	88%	0.883	71%	0.708	S	S	*	*			trans	-67.1	103.7	163.8	-156	162.5	6.5	0	0	106.7	A355	Q353-A355 PolarHBondContact O-N 3.2Å
354	M	29.8	Very low	32.9	Very low	147 Å²	147	120.9 Å²	120.9	72%	0.724	72%	0.721	S	S	*	*			trans	-51	105.9	175.4	-68.7	-79.2	-116	0	0	108.1	F352 S356	F352-M354 PolarHBondContact O-N 2.81Å; F352-M354 VanDerWaalsContact O-N 3.07Å; M354-S356 PolarHBondContact O-N 3.24Å
355	A	29.3	Very low	32.5	Very low	99 Å²	99	123.3 Å²	123.3	82%	0.818	74%	0.741	S	S	*	*			trans	-67.9	89.4	171.8	0	0	0	0	0	107.4	Q353 G357	Q353-A355 PolarHBondContact O-N 3.2Å; A355-G357 PolarHBondContact O-N 3.41Å
356	S	31	Very low	32.1	Very low	115 Å²	115	128.7 Å²	128.7	80%	0.804	76%	0.759	S	S	*	*			trans	-65	79	162.9	-61.3	0	0	0	0	107.7	M354 A358	M354-S356 PolarHBondContact O-N 3.24Å; S356-A358 PolarHBondContact O-N 3.43Å
357	G	28	Very low	31.3	Very low	73 Å²	73	126.6 Å²	126.6	75%	0.753	77%	0.767	S	S	*	*			trans	-70.4	78.1	172.8	0	0	0	0	0	109.9	A355 G359	A355-G357 PolarHBondContact O-N 3.41Å; G357-G359 PolarHBondContact O-N 3.37Å
358	A	28.7	Very low	31.6	Very low	95 Å²	95	125.8 Å²	125.8	79%	0.785	78%	0.777	S	S	*	*			trans	-67.9	79.4	157.8	0	0	0	0	0	107.4	S356 V360	S356-A358 PolarHBondContact O-N 3.43Å; A358-V360 PolarHBondContact O-N 3.43Å; A358-V360 VanDerWaalsContact O-N 3.1Å
359	G	28.3	Very low	31.4	Very low	63 Å²	63	125.7 Å²	125.7	65%	0.649	79%	0.786	S	S	*	*			trans	-67.1	104.8	172.5	0	0	0	0	0	109	G357 F361	G357-G359 PolarHBondContact O-N 3.37Å; G359-F361 PolarHBondContact O-N 3.33Å
360	V	29.9	Very low	32.1	Very low	142 Å²	142	127.2 Å²	127.2	86%	0.861	80%	0.796	S	S	*	*			trans	-55.5	100.5	168.8	176.3	0	0	0	0	107.8	A358 G362	A358-V360 PolarHBondContact O-N 3.43Å; A358-V360 VanDerWaalsContact O-N 3.1Å; V360-G362 PolarHBondContact O-N 3.18Å
361	F	29.2	Very low	31.9	Very low	207 Å²	207	134 Å²	134	91%	0.908	82%	0.819	S	S	*	*			trans	-73.1	96	173.6	-120.8	-92.6	0	0	0	108.1	G359	G359-F361 PolarHBondContact O-N 3.33Å
362	G	27.6	Very low	31.8	Very low	55 Å²	55	132.1 Å²	132.1	57%	0.567	82%	0.82	S	S	*	*			trans	-66.4	128.6	168	0	0	0	0	0	110.2	V360 T364	V360-G362 PolarHBondContact O-N 3.18Å; G362-T364 PolarHBondContact O-N 3.16Å
363	S	26.4	Very low	31.7	Very low	122 Å²	122	130.6 Å²	130.6	85%	0.853	83%	0.826	S	S	*	*			trans	-61.9	120.4	171.5	-61	0	0	0	0	111.1
364	T	32.7	Very low	31.6	Very low	140 Å²	140	127.4 Å²	127.4	86%	0.859	82%	0.823	S	S	*	*			trans	-114.8	107.5	156.4	50	0	0	0	0	107.9	G362	G362-T364 PolarHBondContact O-N 3.16Å
365	N	28.5	Very low	31.7	Very low	163 Å²	163	126.2 Å²	126.2	87%	0.872	83%	0.829	S	S	*	*			trans	-100.5	91.1	177.2	-169	23.4	0	0	0	107
366	E	33.9	Very low	31.8	Very low	190 Å²	190	127.9 Å²	127.9	89%	0.888	83%	0.829	S	S	*	*			trans	-144.2	121	166.6	-70.5	-162.9	158.3	0	0	105.2
367	G	30.1	Very low	31.9	Very low	78 Å²	78	128.8 Å²	128.8	80%	0.804	83%	0.831	S	S	*	*			cis	94.5	73	30.2	0	0	0	0	0	109.8
368	A	38	Very low	32.2	Very low	98 Å²	98	132.8 Å²	132.8	81%	0.81	84%	0.837	S	S	*	*			trans	-179.1	118	151.2	0	0	0	0	0	111
369	S	32.5	Very low	32.4	Very low	124 Å²	124	135.7 Å²	135.7	87%	0.867	84%	0.841	S	S	*	*			trans	-89	122.6	160.1	-173.1	0	0	0	0	107.3
370	P	49.3	Very low	32.8	Very low	112 Å²	112	141.8 Å²	141.8	73%	0.727	86%	0.856	S	S	*	*			trans	-105.9	125.2	160.6	31.8	-19.3	0	0	0	109.8
371	E	35.2	Very low	33	Very low	270 Å²	270	141.7 Å²	141.7	100%	1.262	86%	0.856	S	S	*	*			trans	27.8	0	154.3	-64.8	-177.3	150.6	0	0	121.4

Retrieved 371 of 371 residues in 1755.6 ms (Link to these results)

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