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Carboxy-terminal domain RNA polymerase II polypeptide A small phosphatase 1

Preferentially catalyzes the dephosphorylation of 'Ser-5' within the tandem 7 residue repeats in the C-terminal domain (CTD) of the largest RNA polymerase II subunit POLR2A. Negatively regulates RNA polymerase II transcription, possibly by controlling the transition from initiation/capping to processive transcript elongation. Recruited by REST to neuronal genes that contain RE-1 elements, leading to neuronal gene silencing in non-neuronal cells.

AlphaFold DB , UniProt , Accession Q9GZU7, Species HUMAN (Homo sapiens, Human), Gene CTDSP1, Length 261 aa.

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	53.2	Low	61.1	Low	156 Å²	156	49.4 Å²	49.4	77%	0.768	28%	0.281	S	S	*	.				0	147.8	0	-71.7	168.9	174.8	0	0	107.9	S3 D121	M1-S3 PolarHBondContact O-N 3.42Å; M1-D121 VanDerWaalsContact N-CG 3.31Å; M1-D121 PolarHBondContact N-OD1 2.8Å; M1-D121 PolarHBondContact N-OD2 2.81Å
2	D	57.7	Low	59.2	Low	84 Å²	84	62 Å²	62	45%	0.449	33%	0.331	S	S	.	.			trans	-58.3	124.5	171.3	-174.5	-22.3	0	0	0	107.9	S4 A5	D2-S4 PolarHBondContact O-N 3.49Å; D2-S4 WeakPolarHBondContact OD1-CB 3.42Å; D2-S4 PolarHBondContact OD1-N 3.25Å; D2-S4 VanDerWaalsContact OD1-N 3.08Å; D2-S4 PolarHBondContact OD1-OG 2.98Å; D2-S4 PolarHBondContact OD2-OG 3.3Å; D2-A5 HydrophobicContact CB-CB 4.22Å; D2-A5 WeakPolarHBondContact O-CA 3.46Å; D2-A5 WeakPolarHBondContact O-CB 3.27Å; D2-A5 PolarHBondContact O-N 2.83Å
3	S	59.2	Low	57.6	Low	41 Å²	41	71.1 Å²	71.1	29%	0.287	37%	0.37	S	S	.	.	G	3₁₀ helix	trans	-55.7	-36.6	-176.2	-53.5	0	0	0	0	111.1	M1 A5 V6 F106	M1-S3 PolarHBondContact O-N 3.42Å; S3-A5 PolarHBondContact O-N 3.08Å; S3-V6 WeakPolarHBondContact O-CB 3.4Å; S3-V6 PolarHBondContact O-N 3.13Å; S3-V6 VanDerWaalsContact O-N 3.12Å; S3-F106 VanDerWaalsContact C-CE2 3.46Å; S3-F106 WeakPolarHBondContact O-CE2 3.33Å; S3-F106 WeakPolarHBondContact O-CZ 3.34Å
4	S	67.6	Low	56.3	Low	30 Å²	30	78.8 Å²	78.8	21%	0.21	40%	0.403	C	S	.	.	G	3₁₀ helix	trans	-61.1	-33.1	176.6	63.9	0	0	0	0	112.6	D2 V6 I7 T8 I10	D2-S4 PolarHBondContact O-N 3.49Å; D2-S4 WeakPolarHBondContact OD1-CB 3.42Å; D2-S4 PolarHBondContact OD1-N 3.25Å; D2-S4 VanDerWaalsContact OD1-N 3.08Å; D2-S4 PolarHBondContact OD1-OG 2.98Å; D2-S4 PolarHBondContact OD2-OG 3.3Å; S4-V6 PolarHBondContact O-N 3.12Å; S4-I7 PolarHBondContact O-N 3.36Å; S4-T8 PolarHBondContact O-N 2.66Å; S4-T8 PolarHBondContact O-OG1 2.94Å; S4-I10 WeakPolarHBondContact OG-CD1 3.37Å
5	A	74.3	Confident	55.2	Low	29 Å²	29	77.9 Å²	77.9	24%	0.24	41%	0.413	C	S	.	.	G	3₁₀ helix	trans	-64.6	-8.2	177.8	0	0	0	0	0	113.1	D2 S3 R178	D2-A5 HydrophobicContact CB-CB 4.22Å; D2-A5 WeakPolarHBondContact O-CA 3.46Å; D2-A5 WeakPolarHBondContact O-CB 3.27Å; D2-A5 PolarHBondContact O-N 2.83Å; S3-A5 PolarHBondContact O-N 3.08Å; A5-R178 PolarHBondContact O-NH1 2.83Å; A5-R178 PolarHBondContact O-NH2 2.62Å
6	V	73.2	Confident	53.7	Low	1 Å²	1	88.1 Å²	88.1	1%	0.006	44%	0.444	C	S	.	.	G	3₁₀ helix	trans	-74.2	-35.4	171.6	175.7	0	0	0	0	112	S3 S4 F106 V118 I120 S154 L155 K157	S3-V6 WeakPolarHBondContact O-CB 3.4Å; S3-V6 PolarHBondContact O-N 3.13Å; S3-V6 VanDerWaalsContact O-N 3.12Å; S4-V6 PolarHBondContact O-N 3.12Å; V6-F106 HydrophobicContact CB-CZ 4.46Å; V6-V118 HydrophobicContact CG1-CG1 3.87Å; V6-I120 HydrophobicContact CB-CD1 4.23Å; V6-I120 HydrophobicContact CG2-CD1 3.6Å; V6-I120 HydrophobicContact CG2-CG1 3.89Å; V6-I120 HydrophobicContact CG2-CG2 4.35Å; V6-S154 WeakPolarHBondContact O-CB 3.48Å; V6-L155 HydrophobicContact CG1-CD1 4.48Å; V6-L155 HydrophobicContact CG2-CD1 4.26Å; V6-L155 PolarHBondContact O-N 3.46Å; V6-L155 VanDerWaalsContact O-N 3.16Å; V6-K157 HydrophobicContact CG1-CG 4.32Å
7	I	76.7	Confident	52.7	Low	5 Å²	5	86.4 Å²	86.4	3%	0.026	45%	0.454	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.3	-44.5	-172.4	-58.1	173.5	0	0	0	110.2	S4 D98 F106 V127 S154 Y158	S4-I7 PolarHBondContact O-N 3.36Å; I7-D98 WeakPolarHBondContact CG2-OD1 3.3Å; I7-F106 HydrophobicContact CD1-CD2 3.94Å; I7-F106 HydrophobicContact CD1-CE1 4.47Å; I7-F106 HydrophobicContact CD1-CE2 3.37Å; I7-F106 HydrophobicContact CD1-CZ 3.68Å; I7-F106 HydrophobicContact CG1-CE2 3.95Å; I7-F106 HydrophobicContact CG1-CZ 4.11Å; I7-V127 HydrophobicContact CD1-CB 4.47Å; I7-V127 HydrophobicContact CD1-CG1 3.54Å; I7-V127 HydrophobicContact CD1-CG2 4.04Å; I7-S154 VanDerWaalsContact O-CB 3.23Å; I7-S154 WeakPolarHBondContact O-CB 3.44Å; I7-Y158 HydrophobicContact CB-CE1 4.45Å; I7-Y158 HydrophobicContact CG1-CD1 4.31Å; I7-Y158 HydrophobicContact CG1-CD2 4.27Å; I7-Y158 HydrophobicContact CG1-CE1 4.38Å; I7-Y158 HydrophobicContact CG1-CE2 4.36Å; I7-Y158 HydrophobicContact CG1-CG 4.25Å; I7-Y158 HydrophobicContact CG2-CE1 4Å
8	T	66.8	Low	52	Low	34 Å²	34	89.1 Å²	89.1	21%	0.209	48%	0.477	C	S	.	.	S	Bend	trans	-107.3	157.8	-165.2	52.9	0	0	0	0	114.3	S4 I10 R178	S4-T8 PolarHBondContact O-N 2.66Å; S4-T8 PolarHBondContact O-OG1 2.94Å; T8-I10 PolarHBondContact O-N 2.92Å; T8-I10 WeakPolarHBondContact OG1-CD1 3.3Å; T8-I10 VanDerWaalsContact OG1-CG1 3.24Å; T8-I10 WeakPolarHBondContact OG1-CG1 3.37Å; T8-R178 PolarHBondContact O-NH2 3.18Å
9	Q	57.8	Low	51.4	Low	54 Å²	54	93.9 Å²	93.9	25%	0.252	50%	0.502	S	S	.	.			trans	-74.5	62.3	166.3	-68.5	-171.8	-0.2	0	0	111	S11 A153 Y188 S211	Q9-S11 PolarHBondContact O-N 2.79Å; Q9-A153 HydrophobicContact CG-CB 3.35Å; Q9-A153 VanDerWaalsContact NE2-CB 3.35Å; Q9-Y188 HydrophobicContact CG-CD2 4.47Å; Q9-S211 PolarHBondContact NE2-OG 3.46Å; Q9-S211 VanDerWaalsContact NE2-OG 3.09Å
10	I	47.1	Very low	50.8	Low	61 Å²	61	101.6 Å²	101.6	31%	0.313	52%	0.523	S	S	.	.			trans	-81.4	108.8	177.6	-70.1	165	0	0	0	110.4	S4 T8 K12	S4-I10 WeakPolarHBondContact OG-CD1 3.37Å; T8-I10 PolarHBondContact O-N 2.92Å; T8-I10 WeakPolarHBondContact OG1-CD1 3.3Å; T8-I10 VanDerWaalsContact OG1-CG1 3.24Å; T8-I10 WeakPolarHBondContact OG1-CG1 3.37Å; I10-K12 PolarHBondContact O-N 2.7Å
11	S	38.7	Very low	50.4	Low	48 Å²	48	100.4 Å²	100.4	34%	0.336	54%	0.536	S	S	.	.			trans	-52.5	126	154.1	-48.3	0	0	0	0	108.8	Q9 E13	Q9-S11 PolarHBondContact O-N 2.79Å; S11-E13 PolarHBondContact O-N 3.4Å
12	K	38.1	Very low	49.7	Very low	201 Å²	201	103.6 Å²	103.6	87%	0.874	55%	0.546	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	9.8	-172.9	-127.9	176.2	-175.8	177.1	0	116.2	I10	I10-K12 PolarHBondContact O-N 2.7Å
13	E	37.7	Very low	48.9	Very low	180 Å²	180	103.2 Å²	103.2	84%	0.841	56%	0.562	S	S	*	*	T	Hydrogen-bonded Turn	trans	-94.9	-21.2	-174.1	-71.7	-168.7	141	0	0	114.8	S11	S11-E13 PolarHBondContact O-N 3.4Å
14	E	40.4	Very low	48.1	Very low	179 Å²	179	108.7 Å²	108.7	84%	0.836	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.4	-6.7	179.4	-69.8	-171	146.6	0	0	114.6	R16	E14-R16 PolarHBondContact O-N 3.47Å
15	A	39	Very low	47	Very low	66 Å²	66	114.6 Å²	114.6	55%	0.545	61%	0.612	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.2	3.3	-177.9	0	0	0	0	0	115.3	G17	A15-G17 PolarHBondContact O-N 2.75Å
16	R	31.4	Very low	45.4	Very low	240 Å²	240	121.6 Å²	121.6	91%	0.906	64%	0.637	S	S	*	*			trans	-99.1	74.3	176.7	-77.8	-175.3	174.9	-177.2	-0.2	112.1	E14	E14-R16 PolarHBondContact O-N 3.47Å
17	G	37.8	Very low	43.8	Very low	60 Å²	60	127.4 Å²	127.4	62%	0.619	68%	0.678	S	S	*	*	P	Polyproline II helix	trans	-78.3	148.9	156.8	0	0	0	0	0	111.4	A15 L19	A15-G17 PolarHBondContact O-N 2.75Å; G17-L19 PolarHBondContact O-N 3.11Å
18	P	38.9	Very low	42.2	Very low	135 Å²	135	131.7 Å²	131.7	88%	0.877	71%	0.714	S	S	*	*	P	Polyproline II helix	trans	-71.7	128.4	-169	-12.7	27.6	0	0	0	113.1	R20	P18-R20 PolarHBondContact O-N 3.15Å
19	L	41.8	Very low	41	Very low	180 Å²	180	134.7 Å²	134.7	94%	0.942	74%	0.742	S	S	*	*	P	Polyproline II helix	trans	-62.2	126.6	167.2	-79.5	156.5	0	0	0	110.5	G17	G17-L19 PolarHBondContact O-N 3.11Å
20	R	37.9	Very low	40.2	Very low	247 Å²	247	136.7 Å²	136.7	93%	0.932	76%	0.762	S	S	*	*			trans	-84.6	114.1	-176.4	-159	176.6	-178.2	-150.4	1.4	110.3	P18	P18-R20 PolarHBondContact O-N 3.15Å
21	G	42.6	Very low	40	Very low	77 Å²	77	142.8 Å²	142.8	79%	0.794	79%	0.789	S	S	*	*			trans	-85.5	126.7	167.4	0	0	0	0	0	111.6
22	K	39.9	Very low	40.1	Very low	224 Å²	224	150.2 Å²	150.2	97%	0.974	82%	0.816	S	S	*	*			trans	-72.9	135.6	170.9	-82.5	177.2	171.3	177.6	0	110.4
23	G	40.8	Very low	40.2	Very low	76 Å²	76	145.7 Å²	145.7	78%	0.784	81%	0.807	S	S	*	*			trans	-163.3	124.9	166.5	0	0	0	0	0	109.6
24	D	41.3	Very low	40.1	Very low	156 Å²	156	148.9 Å²	148.9	83%	0.834	81%	0.811	S	S	*	*			trans	-74.5	162.3	-165	-80.8	-47.4	0	0	0	116.9
25	Q	44.6	Very low	40.4	Very low	153 Å²	153	145.6 Å²	145.6	72%	0.715	81%	0.808	S	S	*	*			trans	92	112.9	148.9	-80.4	176.7	67.8	0	0	122.1
26	K	41.4	Very low	40.4	Very low	177 Å²	177	154.5 Å²	154.5	77%	0.77	83%	0.828	S	S	*	*			trans	83.4	107.3	131.9	-72.8	174.9	177.7	167	0	121.1
27	S	40.1	Very low	40.9	Very low	123 Å²	123	146.2 Å²	146.2	86%	0.86	82%	0.817	S	S	*	*			trans	61.6	131.3	131.8	-86.1	0	0	0	0	123.3
28	A	41.8	Very low	41.6	Very low	94 Å²	94	150.7 Å²	150.7	78%	0.777	83%	0.825	S	S	*	*			trans	98.7	100.9	141.9	0	0	0	0	0	118.9
29	A	41.5	Very low	42.2	Very low	97 Å²	97	151.7 Å²	151.7	80%	0.802	82%	0.822	S	S	*	*				70.4	110.7	124.2	0	0	0	0	0	121.1
30	S	42.5	Very low	41.8	Very low	97 Å²	97	150.8 Å²	150.8	68%	0.678	81%	0.813	S	S	*	*				89.4	116.4	123.7	-146.1	0	0	0	0	120.8
31	Q	42.5	Very low	42.1	Very low	189 Å²	189	144.7 Å²	144.7	88%	0.883	81%	0.808	S	S	*	*			trans	94.5	135.7	139.5	-77.9	169.5	3.3	0	0	121.2
32	K	40.8	Very low	42.4	Very low	204 Å²	204	146.8 Å²	146.8	89%	0.887	80%	0.8	S	S	*	*			trans	-96.8	178.9	-157.2	-115.3	-172.7	-177.6	176.3	0	111.4
33	P	39.8	Very low	42.5	Very low	106 Å²	106	144.7 Å²	144.7	69%	0.688	79%	0.792	S	S	*	*				-127.9	-169.8	-127.7	34.9	-12	0	0	0	115.1
34	R	35.2	Very low	42.2	Very low	246 Å²	246	146.1 Å²	146.1	93%	0.928	79%	0.788	S	S	*	*			trans	115.8	117.1	151	-68	178.1	111.9	167.2	2.3	117.3
35	S	46.5	Very low	42.3	Very low	111 Å²	111	144.8 Å²	144.8	78%	0.776	79%	0.79	S	S	*	*			trans	-147.9	120.1	144.1	69.5	0	0	0	0	107.4
36	R	39.6	Very low	42.2	Very low	253 Å²	253	144.1 Å²	144.1	96%	0.955	80%	0.796	S	S	*	*				66.1	126	93.5	-84	-171.3	165.8	178.7	-3.4	116.3
37	G	41.3	Very low	42.1	Very low	66 Å²	66	141 Å²	141	68%	0.68	80%	0.795	S	S	*	*			trans	148.3	88.8	171.9	0	0	0	0	0	111.6
38	I	53.9	Low	42	Very low	154 Å²	154	145.5 Å²	145.5	79%	0.79	79%	0.793	S	S	*	*				73.2	132.6	73.7	-40.4	163.9	0	0	0	114.9
39	L	49.8	Very low	41.6	Very low	156 Å²	156	148.3 Å²	148.3	82%	0.817	80%	0.795	S	S	*	*			trans	95.3	112.3	157.1	-52.8	176.4	0	0	0	117.2
40	H	35.2	Very low	41.7	Very low	160 Å²	160	150.8 Å²	150.8	74%	0.741	80%	0.795	S	S	*	*				85.9	114	63.9	-161.3	-77.8	0	0	0	113
41	S	42.6	Very low	41.3	Very low	120 Å²	120	149.7 Å²	149.7	84%	0.839	80%	0.799	S	S	*	*			trans	-167.3	101.5	151.8	-170.6	0	0	0	0	111.1
42	L	48.5	Very low	41	Very low	120 Å²	120	149.3 Å²	149.3	63%	0.628	80%	0.797	S	S	*	*			trans	-67.2	161.1	153.9	-79.3	150.2	0	0	0	110.3
43	F	43.4	Very low	40.6	Very low	181 Å²	181	144.1 Å²	144.1	79%	0.794	79%	0.793	S	S	*	*			trans	124.9	121.8	143.7	-77.9	-80.2	0	0	0	118.8
44	C	34	Very low	40.7	Very low	105 Å²	105	146.3 Å²	146.3	71%	0.709	80%	0.798	S	S	*	*			trans	63.9	122.6	134.3	-87.2	0	0	0	0	121.6
45	C	43.7	Very low	40.8	Very low	128 Å²	128	139.9 Å²	139.9	87%	0.865	79%	0.788	S	S	*	*				-154.8	106.1	116.8	-105.4	0	0	0	0	111.4
46	V	42.5	Very low	40.2	Very low	140 Å²	140	139.1 Å²	139.1	85%	0.848	79%	0.789	S	S	*	*			trans	-91.6	123.6	156.1	168.5	0	0	0	0	106.4
47	C	39.7	Very low	40.5	Very low	112 Å²	112	136.2 Å²	136.2	76%	0.757	79%	0.786	S	S	*	*			trans	-165.6	146.9	164.8	-84.5	0	0	0	0	107.1
48	R	37.6	Very low	40.5	Very low	216 Å²	216	139.1 Å²	139.1	82%	0.815	80%	0.795	S	S	*	*			cis	-172.4	133.6	-21.4	-158.8	167.6	157	161.4	-6.6	103.1
49	D	33.8	Very low	39.9	Very low	154 Å²	154	135.2 Å²	135.2	82%	0.824	79%	0.793	S	S	*	*			trans	-77.9	129.8	176.7	-169.5	25.2	0	0	0	108.6
50	D	43.3	Very low	39.5	Very low	148 Å²	148	132.2 Å²	132.2	79%	0.791	79%	0.791	S	S	*	*			trans	-136.3	108	170.4	-80.6	-43.4	0	0	0	107.7
51	G	34	Very low	39.6	Very low	75 Å²	75	130.9 Å²	130.9	77%	0.773	80%	0.797	S	S	*	*			trans	-88	146	170.6	0	0	0	0	0	111.6
52	E	35.8	Very low	39.5	Very low	180 Å²	180	133 Å²	133	84%	0.841	80%	0.798	S	S	*	*			trans	-142.3	117	162.1	-151.8	158.6	151	0	0	109.7
53	A	33.4	Very low	39.1	Very low	96 Å²	96	135.4 Å²	135.4	79%	0.793	81%	0.81	S	S	*	*			trans	-114.4	126.9	172.2	0	0	0	0	0	108
54	L	41.5	Very low	39.4	Very low	151 Å²	151	132.3 Å²	132.3	79%	0.791	81%	0.806	S	S	*	*			trans	-141.1	154.3	170.1	-80.4	176.2	0	0	0	110.8
55	P	36.5	Very low	39.9	Very low	112 Å²	112	135.8 Å²	135.8	73%	0.727	81%	0.811	S	S	*	*			trans	-106.4	172.1	-130.1	38.7	-36	0	0	0	116
56	A	33.4	Very low	39.8	Very low	95 Å²	95	138.7 Å²	138.7	79%	0.785	81%	0.812	S	S	*	*			trans	-56.8	139.3	176.7	0	0	0	0	0	114.9
57	H	46	Very low	40	Very low	192 Å²	192	139.9 Å²	139.9	89%	0.889	81%	0.814	S	S	*	*			trans	-131	126.9	156.3	-94.4	-72.4	0	0	0	110.9
58	S	42.6	Very low	39.9	Very low	126 Å²	126	138.5 Å²	138.5	88%	0.881	82%	0.819	S	S	*	*			trans	-56.7	149.2	174.9	-60	0	0	0	0	114.3
59	G	40.4	Very low	40.4	Very low	72 Å²	72	132.5 Å²	132.5	74%	0.742	82%	0.815	S	S	*	*			trans	170.8	88.8	160.7	0	0	0	0	0	114.5
60	A	40.8	Very low	41.5	Very low	94 Å²	94	132.6 Å²	132.6	78%	0.777	81%	0.814	S	S	*	*			trans	41.8	136.1	150.4	0	0	0	0	0	121.8	L62	A60-L62 PolarHBondContact O-N 3.09Å
61	P	37.7	Very low	41.8	Very low	132 Å²	132	130.8 Å²	130.8	86%	0.857	81%	0.81	S	S	*	*			trans	-77.2	125.7	-179.4	31.5	-31.4	0	0	0	111.7
62	L	40.7	Very low	42.6	Very low	165 Å²	165	136.8 Å²	136.8	86%	0.864	82%	0.815	S	S	*	*			trans	-100.8	111.6	165.4	-87.3	163.8	0	0	0	109.2	A60 V64	A60-L62 PolarHBondContact O-N 3.09Å; L62-V64 PolarHBondContact O-N 3.36Å
63	L	40.9	Very low	43.6	Very low	169 Å²	169	137 Å²	137	89%	0.885	82%	0.816	S	S	*	*			trans	-64	115.7	161.9	-67.9	164	0	0	0	108.4
64	V	48.6	Very low	44.6	Very low	116 Å²	116	138.2 Å²	138.2	70%	0.703	81%	0.814	S	S	*	*			trans	-143.3	105.5	160.3	-174.7	0	0	0	0	109.7	L62	L62-V64 PolarHBondContact O-N 3.36Å
65	E	44.7	Very low	46	Very low	178 Å²	178	136.7 Å²	136.7	83%	0.832	81%	0.813	S	S	*	*			trans	47.4	108.5	139.4	-56.4	-168.2	142.8	0	0	120.8	N67	E65-N67 PolarHBondContact O-N 3.09Å
66	E	41.5	Very low	47.8	Very low	189 Å²	189	136.5 Å²	136.5	88%	0.883	81%	0.81	S	S	*	*			trans	-11.3	105.9	136	-164.3	179.7	138.9	0	0	115.5
67	N	47.5	Very low	50.5	Low	165 Å²	165	140.6 Å²	140.6	88%	0.882	81%	0.812	S	S	*	*			trans	-149.2	95.9	144.3	-98.6	-37.2	0	0	0	108.4	E65 A69	E65-N67 PolarHBondContact O-N 3.09Å; N67-A69 PolarHBondContact O-N 2.95Å
68	G	38.4	Very low	52.9	Low	83 Å²	83	137.4 Å²	137.4	86%	0.856	79%	0.793	S	S	*	*			trans	-67.7	111.1	176.5	0	0	0	0	0	111.5
69	A	48	Very low	55.5	Low	90 Å²	90	133.2 Å²	133.2	74%	0.744	76%	0.761	S	S	*	*			trans	-131.8	89.4	155.2	0	0	0	0	0	107.5	N67 P71	N67-A69 PolarHBondContact O-N 2.95Å; A69-P71 WeakPolarHBondContact O-CD 3.35Å
70	I	55	Low	58.3	Low	157 Å²	157	130.2 Å²	130.2	81%	0.805	73%	0.728	S	S	*	*			trans	-58.2	123.8	165.2	-59.8	172.1	0	0	0	106	K72	I70-K72 PolarHBondContact O-N 3.11Å
71	P	50.8	Low	61	Low	109 Å²	109	130.5 Å²	130.5	71%	0.708	72%	0.722	S	S	*	*			trans	-58.6	115.2	171.2	-15.3	27.7	0	0	0	106.9	A69 Q73	A69-P71 WeakPolarHBondContact O-CD 3.35Å; P71-Q73 VanDerWaalsContact C-N 3.33Å; P71-Q73 PolarHBondContact O-N 2.8Å
72	K	51.2	Low	63.8	Low	202 Å²	202	133 Å²	133	88%	0.878	72%	0.722	S	S	*	*			trans	-57.9	102.3	170.2	-77.1	-177.7	178	179	0	106.7	I70 T74	I70-K72 PolarHBondContact O-N 3.11Å; K72-T74 PolarHBondContact O-N 3.4Å; K72-T74 VanDerWaalsContact O-N 3.08Å
73	Q	55.9	Low	66.5	Low	184 Å²	184	126.8 Å²	126.8	86%	0.86	69%	0.694	S	S	*	*			trans	-59.6	114.5	170.8	-71.6	178.9	-7.8	0	0	106.7	P71	P71-Q73 VanDerWaalsContact C-N 3.33Å; P71-Q73 PolarHBondContact O-N 2.8Å
74	T	55.1	Low	69.2	Low	122 Å²	122	125 Å²	125	75%	0.748	68%	0.679	S	S	*	*			trans	-56	130.6	173.1	-37.1	0	0	0	0	107.5	K72 V76	K72-T74 PolarHBondContact O-N 3.4Å; K72-T74 VanDerWaalsContact O-N 3.08Å; T74-V76 PolarHBondContact O-N 3.45Å; T74-V76 VanDerWaalsContact O-N 3.13Å
75	P	69.9	Low	71.5	Confident	118 Å²	118	123.9 Å²	123.9	77%	0.766	68%	0.683	S	S	*	*			trans	-57.1	123.8	-179.1	19.9	-29.5	0	0	0	109.3	Q77	P75-Q77 PolarHBondContact O-N 3.13Å; P75-Q77 VanDerWaalsContact O-N 3.12Å
76	V	74.1	Confident	74	Confident	108 Å²	108	121.6 Å²	121.6	66%	0.655	67%	0.672	S	S	*	*			trans	-65.5	112.9	175.7	178.2	0	0	0	0	107.1	T74 Y78	T74-V76 PolarHBondContact O-N 3.45Å; T74-V76 VanDerWaalsContact O-N 3.13Å; V76-Y78 HydrophobicContact CG1-CD1 4.45Å; V76-Y78 HydrophobicContact CG1-CE1 4.16Å; V76-Y78 PolarHBondContact O-N 3.25Å
77	Q	89.9	Confident	76.7	Confident	181 Å²	181	112.8 Å²	112.8	85%	0.846	63%	0.631	S	S	*	*			trans	-82.1	108.1	176	-171.9	176.3	10.4	0	0	109.1	P75	P75-Q77 PolarHBondContact O-N 3.13Å; P75-Q77 VanDerWaalsContact O-N 3.12Å
78	Y	97.4	Very high	79	Confident	125 Å²	125	108 Å²	108	49%	0.49	61%	0.61	S	S	.	*			trans	-73.4	157.6	172.7	-65.3	-67.9	0	0	0	111.7	V76 R194 G196	V76-Y78 HydrophobicContact CG1-CD1 4.45Å; V76-Y78 HydrophobicContact CG1-CE1 4.16Å; V76-Y78 PolarHBondContact O-N 3.25Å; Y78-R194 CarbonylContact C-O 3.6Å; Y78-R194 WeakPolarHBondContact CA-O 3.41Å; Y78-G196 VanDerWaalsContact CD1-N 3.25Å
79	L	98.2	Very high	81.7	Confident	38 Å²	38	110.4 Å²	110.4	20%	0.199	60%	0.604	C	S	.	*	S	Bend	trans	-71.7	-31.8	179.3	-66.6	175	0	0	0	112.4	F151 L176 R194 L195	L79-F151 HydrophobicContact CD1-CE1 4.26Å; L79-F151 HydrophobicContact CD1-CZ 4.27Å; L79-L176 HydrophobicContact CB-CD1 4.05Å; L79-L176 HydrophobicContact CB-CD2 4.13Å; L79-L176 HydrophobicContact CD1-CD1 4.17Å; L79-R194 HydrophobicContact CD1-CB 3.76Å; L79-R194 HydrophobicContact CG-CB 3.96Å; L79-R194 WeakPolarHBondContact CG-O 3.4Å; L79-R194 PolarHBondContact N-O 2.88Å; L79-L195 HydrophobicContact CD1-CD2 4.41Å
80	L	98.3	Very high	84.1	Confident	10 Å²	10	108.9 Å²	108.9	5%	0.052	58%	0.58	C	S	.	*	S	Bend	trans	-106.1	147.8	177.3	-53.3	175.1	0	0	0	110.3	V149 A174 L176 L195 R197	L80-V149 HydrophobicContact CD1-CG2 3.82Å; L80-V149 HydrophobicContact CD2-CG1 4.03Å; L80-V149 HydrophobicContact CD2-CG2 4.15Å; L80-A174 HydrophobicContact CD2-CB 3.6Å; L80-L176 HydrophobicContact CD2-CD1 4.07Å; L80-L176 HydrophobicContact CD2-CD2 4.41Å; L80-L176 HydrophobicContact CD2-CG 4.35Å; L80-L195 VanDerWaalsContact CB-O 3.27Å; L80-L195 WeakPolarHBondContact CB-O 3.09Å; L80-L195 HydrophobicContact CD1-CB 4.13Å; L80-L195 HydrophobicContact CD1-CD2 4.16Å; L80-L195 HydrophobicContact CG-CD2 4.29Å; L80-L195 PolarHBondContact N-O 2.85Å; L80-R197 HydrophobicContact CD1-CG 4.35Å
81	P	96.9	Very high	86.2	Confident	99 Å²	99	101.5 Å²	101.5	64%	0.643	54%	0.542	S	S	*	.			trans	-67.2	175.2	165	32.6	-35.9	0	0	0	110.6	A83 R197	P81-A83 PolarHBondContact O-N 3.26Å; P81-R197 PolarHBondContact O-NH1 2.66Å; P81-R197 PolarHBondContact O-NH2 3.16Å
82	E	96.8	Very high	88.5	Confident	185 Å²	185	96.3 Å²	96.3	86%	0.864	51%	0.509	S	S	*	.	P	Polyproline II helix	trans	-52.5	139.5	166.4	-67	-175.8	176.6	0	0	110.5
83	A	97.5	Very high	90.7	Very high	34 Å²	34	86.7 Å²	86.7	28%	0.281	47%	0.467	S	S	.	.	P	Polyproline II helix	trans	-62	143.3	179.4	0	0	0	0	0	110.4	P81	P81-A83 PolarHBondContact O-N 3.26Å
84	K	97.4	Very high	92.8	Very high	131 Å²	131	78 Å²	78	57%	0.57	43%	0.426	S	S	*	.	P	Polyproline II helix	trans	-64.1	150.6	170.8	-67.7	179.4	-180	171.4	0	109.3	Q86 D87 S88	K84-Q86 HydrophobicContact CB-CG 4.18Å; K84-Q86 PolarHBondContact O-N 3.31Å; K84-D87 CarbonylContact O-C 3.34Å; K84-D87 WeakPolarHBondContact O-CA 3.13Å; K84-D87 PolarHBondContact O-N 3.25Å; K84-S88 PolarHBondContact O-N 3.2Å
85	A	97.2	Very high	94.9	Very high	94 Å²	94	72.1 Å²	72.1	78%	0.777	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.1	-32	-178.7	0	0	0	0	0	114.1	D87 S88	A85-D87 VanDerWaalsContact C-N 3.28Å; A85-D87 PolarHBondContact O-N 3.47Å; A85-S88 PolarHBondContact O-OG 2.99Å
86	Q	97	Very high	96.3	Very high	130 Å²	130	66.8 Å²	66.8	61%	0.607	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.5	-15.5	177.6	69.3	-159.9	29.1	0	0	114.6	K84 K90	K84-Q86 HydrophobicContact CB-CG 4.18Å; K84-Q86 PolarHBondContact O-N 3.31Å; Q86-K90 WeakPolarHBondContact O-CE 3.36Å
87	D	97.9	Very high	97.4	Very high	3 Å²	3	61.6 Å²	61.6	2%	0.016	32%	0.324	C	S	.	.	T	Hydrogen-bonded Turn	trans	-114.5	-5.6	-177.3	-63.8	-49.8	0	0	0	111.5	K84 A85 D89 K90 E147 R173	K84-D87 CarbonylContact O-C 3.34Å; K84-D87 WeakPolarHBondContact O-CA 3.13Å; K84-D87 PolarHBondContact O-N 3.25Å; A85-D87 VanDerWaalsContact C-N 3.28Å; A85-D87 PolarHBondContact O-N 3.47Å; D87-D89 VanDerWaalsContact C-N 3.28Å; D87-D89 PolarHBondContact O-N 2.75Å; D87-K90 WeakPolarHBondContact O-CB 3.5Å; D87-K90 PolarHBondContact O-N 3.45Å; D87-K90 IonicContact OD1-NZ 3.49Å; D87-E147 HydrophobicContact CB-CB 4.09Å; D87-E147 HydrophobicContact CB-CG 4.13Å; D87-R173 IonicContact OD1-CZ 3.81Å; D87-R173 IonicContact OD1-NE 2.75Å; D87-R173 PolarHBondContact OD1-NE 3.13Å; D87-R173 IonicContact OD1-NH2 3.23Å; D87-R173 PolarHBondContact OD1-NH2 2.88Å; D87-R173 IonicContact OD2-CZ 2.67Å; D87-R173 IonicContact OD2-NE 2.73Å; D87-R173 PolarHBondContact OD2-NE 2.74Å
88	S	95.2	Very high	97.8	Very high	64 Å²	64	53.4 Å²	53.4	45%	0.448	29%	0.286	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	-33.6	-172.7	62.5	0	0	0	0	114.3	K84 A85	K84-S88 PolarHBondContact O-N 3.2Å; A85-S88 PolarHBondContact O-OG 2.99Å
89	D	96.1	Very high	97.9	Very high	135 Å²	135	48.9 Å²	48.9	72%	0.722	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.5	-1.8	179.9	-60.9	-21.3	0	0	0	112	D87 R201	D87-D89 VanDerWaalsContact C-N 3.28Å; D87-D89 PolarHBondContact O-N 2.75Å; D89-R201 PolarHBondContact O-NH2 3.16Å
90	K	98.5	Very high	97.9	Very high	58 Å²	58	47.1 Å²	47.1	25%	0.252	26%	0.26	S	S	.	.	S	Bend	trans	-84.5	155.6	179.3	-61.4	-172	-176.8	-176.7	0	111	Q86 D87 E144	Q86-K90 WeakPolarHBondContact O-CE 3.36Å; D87-K90 WeakPolarHBondContact O-CB 3.5Å; D87-K90 PolarHBondContact O-N 3.45Å; D87-K90 IonicContact OD1-NZ 3.49Å; K90-E144 PolarHBondContact NZ-O 2.85Å
91	I	98.8	Very high	97.9	Very high	1 Å²	1	46.6 Å²	46.6	1%	0.005	26%	0.257	C	S	.	.	P	Polyproline II helix	trans	-72.8	139	164.8	-74.2	164.3	0	0	0	108.2	V93 F146 E147 R201 L203 L244 V247 V250	I91-V93 HydrophobicContact CG2-CG2 4.25Å; I91-F146 HydrophobicContact CB-CD1 3.73Å; I91-F146 HydrophobicContact CB-CE1 3.9Å; I91-F146 HydrophobicContact CG2-CD1 3.9Å; I91-F146 HydrophobicContact CG2-CE1 3.95Å; I91-F146 WeakPolarHBondContact O-CB 3.5Å; I91-F146 WeakPolarHBondContact O-CD1 3.03Å; I91-E147 PolarHBondContact O-N 2.71Å; I91-R201 WeakPolarHBondContact CA-O 3.42Å; I91-R201 HydrophobicContact CG1-CB 4.11Å; I91-R201 WeakPolarHBondContact CG2-O 3.38Å; I91-L203 HydrophobicContact CG2-CD1 3.9Å; I91-L203 HydrophobicContact CG2-CG 3.94Å; I91-L244 WeakPolarHBondContact CD1-O 3.19Å; I91-V247 HydrophobicContact CD1-CG2 4.37Å; I91-V250 HydrophobicContact CD1-CG1 3.88Å; I91-V250 HydrophobicContact CG1-CG1 4.49Å; I91-V250 HydrophobicContact CG2-CG1 4.38Å
92	C	98.9	Very high	98	Very high	1 Å²	1	41.9 Å²	41.9	1%	0.007	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-83.2	126.5	171.6	174.5	0	0	0	0	109.4	E147 R197 R201 V202 L203	C92-E147 CarbonylContact C-O 3.59Å; C92-E147 WeakPolarHBondContact CA-O 3.33Å; C92-E147 HydrophobicContact CB-CB 4.46Å; C92-R197 HydrophobicContact CB-CB 4.47Å; C92-R197 HydrophobicContact CB-CG 3.99Å; C92-R201 PolarHBondContact N-O 3.05Å; C92-V202 HydrophobicContact CB-CG2 4.27Å; C92-V202 CarbonylContact O-C 3.56Å; C92-V202 VanDerWaalsContact O-CA 3.3Å; C92-V202 WeakPolarHBondContact O-CA 3.47Å; C92-L203 PolarHBondContact O-N 2.89Å
93	V	98.9	Very high	98	Very high	0 Å²	0	35.1 Å²	35.1	0%	0	20%	0.195	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	115	175.6	-173.1	0	0	0	0	109	I91 I95 M142 F146 E147 C148 V149 L203 F241	I91-V93 HydrophobicContact CG2-CG2 4.25Å; V93-I95 HydrophobicContact CB-CG1 4.45Å; V93-I95 HydrophobicContact CG1-CD1 4.31Å; V93-I95 HydrophobicContact CG1-CG1 3.77Å; V93-M142 HydrophobicContact CB-CE 4.19Å; V93-M142 HydrophobicContact CG1-CE 3.81Å; V93-M142 HydrophobicContact CG2-CE 4.11Å; V93-F146 HydrophobicContact CB-CB 4.34Å; V93-F146 HydrophobicContact CB-CG 4.42Å; V93-F146 HydrophobicContact CG2-CB 3.66Å; V93-F146 HydrophobicContact CG2-CD1 3.34Å; V93-F146 HydrophobicContact CG2-CD2 3.87Å; V93-F146 HydrophobicContact CG2-CE1 3.84Å; V93-F146 HydrophobicContact CG2-CE2 4.33Å; V93-F146 HydrophobicContact CG2-CG 3.34Å; V93-F146 HydrophobicContact CG2-CZ 4.29Å; V93-E147 PolarHBondContact N-O 2.84Å; V93-C148 WeakPolarHBondContact O-CA 3.38Å; V93-V149 PolarHBondContact O-N 2.66Å; V93-L203 HydrophobicContact CG1-CB 4.23Å; V93-L203 HydrophobicContact CG2-CB 4.16Å; V93-L203 HydrophobicContact CG2-CD1 4.12Å; V93-F241 HydrophobicContact CG1-CE1 4.24Å
94	V	98.9	Very high	98	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	18%	0.184	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	123	168.9	174.7	0	0	0	0	108.6	V149 F151 K190 L192 L195 L203 I204 L205	V94-V149 WeakPolarHBondContact CA-O 3.14Å; V94-F151 HydrophobicContact CG1-CB 3.36Å; V94-F151 HydrophobicContact CG1-CD1 3.87Å; V94-F151 HydrophobicContact CG1-CG 4.09Å; V94-K190 HydrophobicContact CG1-CD 4.45Å; V94-L192 HydrophobicContact CB-CD2 4.4Å; V94-L192 HydrophobicContact CG2-CD2 4.01Å; V94-L195 HydrophobicContact CG2-CD1 3.6Å; V94-L195 HydrophobicContact CG2-CD2 4.32Å; V94-L203 PolarHBondContact N-O 3.21Å; V94-I204 HydrophobicContact CB-CB 4.25Å; V94-I204 HydrophobicContact CB-CG1 4.25Å; V94-I204 HydrophobicContact CG1-CD1 4.04Å; V94-I204 HydrophobicContact CG1-CG1 4.11Å; V94-I204 CarbonylContact O-C 3.6Å; V94-I204 WeakPolarHBondContact O-CA 3.38Å; V94-L205 PolarHBondContact O-N 3.15Å
95	I	98.9	Very high	97.8	Very high	0 Å²	0	28.9 Å²	28.9	0%	0	17%	0.166	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	125.2	-177.4	-54.6	176.5	0	0	0	108.6	V93 L101 F138 M142 C148 V149 F151 F172 L205	V93-I95 HydrophobicContact CB-CG1 4.45Å; V93-I95 HydrophobicContact CG1-CD1 4.31Å; V93-I95 HydrophobicContact CG1-CG1 3.77Å; I95-L101 HydrophobicContact CG2-CD1 3.78Å; I95-L101 HydrophobicContact CG2-CD2 4.01Å; I95-L101 HydrophobicContact CG2-CG 4.06Å; I95-F138 HydrophobicContact CD1-CE1 4.49Å; I95-M142 HydrophobicContact CD1-CE 4.27Å; I95-C148 HydrophobicContact CD1-CB 4.11Å; I95-V149 PolarHBondContact N-O 2.62Å; I95-F151 PolarHBondContact O-N 3.15Å; I95-F172 HydrophobicContact CB-CE1 4.2Å; I95-F172 HydrophobicContact CD1-CE1 4.23Å; I95-L205 HydrophobicContact CG2-CD2 4.36Å
96	D	98.8	Very high	97.6	Very high	5 Å²	5	27.1 Å²	27.1	3%	0.027	14%	0.141	C	C	.	.			trans	-73.9	161.5	172.5	-174	55.1	0	0	0	112.7	T100 L101 K190 L205 D206 N207	D96-T100 HydrophobicContact CB-CG2 4.25Å; D96-T100 PolarHBondContact OD2-OG1 3.46Å; D96-L101 WeakPolarHBondContact O-CD1 3.3Å; D96-L101 WeakPolarHBondContact O-CG 3.5Å; D96-K190 VanDerWaalsContact CB-NZ 3.26Å; D96-K190 IonicContact OD1-NZ 3.46Å; D96-K190 PolarHBondContact OD1-NZ 3.31Å; D96-L205 WeakPolarHBondContact CB-O 3.45Å; D96-L205 PolarHBondContact N-O 3.04Å; D96-D206 HydrophobicContact CB-CB 4.07Å; D96-N207 PolarHBondContact OD2-OD1 2.76Å
97	L	98.7	Very high	97.4	Very high	0 Å²	0	28.6 Å²	28.6	0%	0	15%	0.145	C	C	.	.			trans	-101.5	-67.3	-177.6	-174.5	60	0	0	0	112.6	T100 L101 V102 L150 Y158 A159 V162 L166	L97-T100 PolarHBondContact O-N 3.01Å; L97-L101 HydrophobicContact CD1-CD1 4.47Å; L97-L101 PolarHBondContact O-N 3Å; L97-V102 HydrophobicContact CD1-CG2 3.79Å; L97-V102 HydrophobicContact CG-CG2 3.88Å; L97-V102 PolarHBondContact O-N 3.2Å; L97-L150 HydrophobicContact CB-CD1 4.05Å; L97-L150 HydrophobicContact CD1-CD1 4.3Å; L97-Y158 HydrophobicContact CD2-CE1 4.06Å; L97-A159 HydrophobicContact CD2-CB 3.95Å; L97-V162 HydrophobicContact CD1-CG1 3.91Å; L97-V162 HydrophobicContact CD2-CB 4.31Å; L97-V162 HydrophobicContact CD2-CG1 4.23Å; L97-L166 HydrophobicContact CD1-CD2 4.46Å
98	D	98.1	Very high	97.2	Very high	9 Å²	9	33.3 Å²	33.3	5%	0.048	18%	0.176	C	C	.	.	B	Isolated β-bridge	trans	-80.3	131.5	-166	-62	-73.6	0	0	0	110.4	I7 T100 T152 S154 Y158 N207	I7-D98 WeakPolarHBondContact CG2-OD1 3.3Å; D98-T100 PolarHBondContact O-N 3.02Å; D98-T152 PolarHBondContact OD2-OG1 2.96Å; D98-S154 WeakPolarHBondContact OD2-CB 3.46Å; D98-S154 PolarHBondContact OD2-OG 3.09Å; D98-Y158 VanDerWaalsContact OD1-CE1 3.23Å; D98-Y158 WeakPolarHBondContact OD1-CE1 3.35Å; D98-Y158 VanDerWaalsContact OD1-CZ 3.26Å; D98-Y158 PolarHBondContact OD1-OH 3.34Å; D98-N207 PolarHBondContact O-OD1 3.24Å
99	E	98.2	Very high	97.1	Very high	30 Å²	30	32.5 Å²	32.5	14%	0.14	17%	0.168	C	C	.	.	T	Hydrogen-bonded Turn	trans	60.6	1.2	-169.6	-68.7	69.8	-116.9	0	0	115.2	V102 H103 N207 S224 W225 F226	E99-V102 WeakPolarHBondContact CA-O 3.39Å; E99-V102 PolarHBondContact N-O 2.86Å; E99-H103 IonicContact OE1-CE1 3.79Å; E99-H103 PolarHBondContact OE1-CE1 2.71Å; E99-H103 IonicContact OE1-CG 3.46Å; E99-H103 IonicContact OE1-ND1 2.96Å; E99-H103 PolarHBondContact OE1-ND1 2.88Å; E99-N207 VanDerWaalsContact CB-ND2 3.28Å; E99-N207 WeakPolarHBondContact CB-ND2 3.49Å; E99-S224 WeakPolarHBondContact O-CA 3.46Å; E99-W225 WeakPolarHBondContact CA-O 3.3Å; E99-W225 PolarHBondContact O-N 3.23Å; E99-F226 HydrophobicContact CG-CD1 4.08Å; E99-F226 HydrophobicContact CG-CE1 3.56Å; E99-F226 HydrophobicContact CG-CZ 3.93Å
100	T	98.8	Very high	96.9	Very high	0 Å²	0	33 Å²	33	0%	0	17%	0.171	C	C	.	.	T	Hydrogen-bonded Turn	trans	-104.1	-57.9	174.4	-63.4	0	0	0	0	111.7	D96 L97 D98 R132 L205 N207 V222	D96-T100 HydrophobicContact CB-CG2 4.25Å; D96-T100 PolarHBondContact OD2-OG1 3.46Å; L97-T100 PolarHBondContact O-N 3.01Å; D98-T100 PolarHBondContact O-N 3.02Å; T100-R132 WeakPolarHBondContact O-CD 3.49Å; T100-R132 PolarHBondContact O-NH1 3.25Å; T100-L205 HydrophobicContact CG2-CD2 4.46Å; T100-L205 HydrophobicContact CG2-CG 4.22Å; T100-N207 PolarHBondContact OG1-N 3.47Å; T100-N207 PolarHBondContact OG1-OD1 3.04Å; T100-V222 HydrophobicContact CG2-CG1 4.08Å
101	L	98.8	Very high	96.7	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	20%	0.199	C	C	.	.	T	Hydrogen-bonded Turn	trans	-105.6	-29.8	-179.4	-60	178.9	0	0	0	112.8	I95 D96 L97 R132 V135 F138 L139 L166 F172 L234	I95-L101 HydrophobicContact CG2-CD1 3.78Å; I95-L101 HydrophobicContact CG2-CD2 4.01Å; I95-L101 HydrophobicContact CG2-CG 4.06Å; D96-L101 WeakPolarHBondContact O-CD1 3.3Å; D96-L101 WeakPolarHBondContact O-CG 3.5Å; L97-L101 HydrophobicContact CD1-CD1 4.47Å; L97-L101 PolarHBondContact O-N 3Å; L101-R132 WeakPolarHBondContact O-CB 3.48Å; L101-R132 PolarHBondContact O-N 3.24Å; L101-V135 HydrophobicContact CB-CG2 3.95Å; L101-V135 HydrophobicContact CD2-CG2 4Å; L101-V135 HydrophobicContact CG-CG2 4.46Å; L101-F138 HydrophobicContact CD2-CD1 4.07Å; L101-F138 HydrophobicContact CD2-CE1 4.11Å; L101-L139 HydrophobicContact CD1-CD2 4.08Å; L101-L139 HydrophobicContact CD2-CD2 4.37Å; L101-L166 HydrophobicContact CB-CD2 4.11Å; L101-L166 HydrophobicContact CD1-CD2 3.99Å; L101-F172 HydrophobicContact CD1-CZ 3.91Å; L101-L234 HydrophobicContact CD2-CD1 4.31Å
102	V	98.6	Very high	96.6	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	21%	0.208	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	164.7	-177.7	-61.7	0	0	0	0	110	L97 E99 V129 L130 V162 L166	L97-V102 HydrophobicContact CD1-CG2 3.79Å; L97-V102 HydrophobicContact CG-CG2 3.88Å; L97-V102 PolarHBondContact O-N 3.2Å; E99-V102 WeakPolarHBondContact CA-O 3.39Å; E99-V102 PolarHBondContact N-O 2.86Å; V102-V129 HydrophobicContact CB-CG1 3.8Å; V102-V129 HydrophobicContact CG1-CG1 4.03Å; V102-V129 HydrophobicContact CG2-CG1 4.17Å; V102-L130 CarbonylContact C-O 3.56Å; V102-L130 WeakPolarHBondContact CA-O 3.31Å; V102-L130 VanDerWaalsContact CB-O 3.28Å; V102-L130 WeakPolarHBondContact CB-O 3.12Å; V102-V162 HydrophobicContact CG1-CG1 4.33Å; V102-V162 HydrophobicContact CG2-CG1 4.22Å; V102-L166 HydrophobicContact CG1-CD1 3.96Å; V102-L166 HydrophobicContact CG1-CD2 4.22Å
103	H	97.4	Very high	96.5	Very high	43 Å²	43	42.7 Å²	42.7	20%	0.199	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	136.3	165.3	177.2	57.5	0	0	0	109.3	E99 V129 L130 W225 F226	E99-H103 IonicContact OE1-CE1 3.79Å; E99-H103 PolarHBondContact OE1-CE1 2.71Å; E99-H103 IonicContact OE1-CG 3.46Å; E99-H103 IonicContact OE1-ND1 2.96Å; E99-H103 PolarHBondContact OE1-ND1 2.88Å; H103-V129 WeakPolarHBondContact O-CA 3.4Å; H103-L130 PolarHBondContact N-O 3.27Å; H103-L130 PolarHBondContact O-N 3.09Å; H103-W225 HydrophobicContact CB-CE3 3.87Å; H103-W225 HydrophobicContact CB-CZ3 3.72Å; H103-F226 WeakPolarHBondContact CB-O 3.49Å; H103-F226 PolarHBondContact CD2-O 3.04Å; H103-F226 AromaticContact CE1-CD1 3.62Å; H103-F226 AromaticContact ND1-CD1 3.65Å
104	S	96.1	Very high	96.4	Very high	8 Å²	8	44.2 Å²	44.2	6%	0.056	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	141.4	-173.3	-71.8	0	0	0	0	112.7	Y128 V129 Y158	S104-Y128 WeakPolarHBondContact CA-O 3.49Å; S104-V129 WeakPolarHBondContact OG-CG2 3.39Å; S104-Y158 VanDerWaalsContact CB-OH 3.25Å; S104-Y158 WeakPolarHBondContact CB-OH 3.23Å; S104-Y158 PolarHBondContact OG-OH 3.18Å
105	S	93.5	Very high	96.4	Very high	26 Å²	26	48.6 Å²	48.6	18%	0.182	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	143	-177.1	-179.2	0	0	0	0	112.4	K107 Y128	S105-K107 VanDerWaalsContact C-N 3.3Å; S105-K107 WeakPolarHBondContact OG-CB 3.4Å; S105-K107 PolarHBondContact OG-N 2.86Å; S105-K107 PolarHBondContact OG-O 3.37Å; S105-Y128 PolarHBondContact N-O 3.18Å; S105-Y128 PolarHBondContact O-N 3Å
106	F	93.4	Very high	96.2	Very high	56 Å²	56	49 Å²	49	25%	0.246	26%	0.26	C	S	.	.	S	Bend	trans	-78.6	-15.2	167.3	-70.5	-76.7	0	0	0	112.9	S3 V6 I7 I120 H125 V127	S3-F106 VanDerWaalsContact C-CE2 3.46Å; S3-F106 WeakPolarHBondContact O-CE2 3.33Å; S3-F106 WeakPolarHBondContact O-CZ 3.34Å; V6-F106 HydrophobicContact CB-CZ 4.46Å; I7-F106 HydrophobicContact CD1-CD2 3.94Å; I7-F106 HydrophobicContact CD1-CE1 4.47Å; I7-F106 HydrophobicContact CD1-CE2 3.37Å; I7-F106 HydrophobicContact CD1-CZ 3.68Å; I7-F106 HydrophobicContact CG1-CE2 3.95Å; I7-F106 HydrophobicContact CG1-CZ 4.11Å; F106-I120 HydrophobicContact CE1-CD1 3.54Å; F106-I120 HydrophobicContact CZ-CD1 3.47Å; F106-I120 VanDerWaalsContact CZ-CD1 3.47Å; F106-H125 HydrophobicContact CD1-CB 3.88Å; F106-H125 HydrophobicContact CE1-CB 3.85Å; F106-V127 HydrophobicContact CD1-CG2 3.93Å; F106-V127 HydrophobicContact CE1-CG2 3.48Å; F106-V127 VanDerWaalsContact CE1-CG2 3.48Å; F106-V127 HydrophobicContact CZ-CG2 3.98Å
107	K	93.4	Very high	96.1	Very high	162 Å²	162	52.6 Å²	52.6	70%	0.704	28%	0.283	S	S	*	.	S	Bend	trans	-81.3	134.6	173.8	-64.6	177.3	-177.4	169.2	0	108.1	S105 V109	S105-K107 VanDerWaalsContact C-N 3.3Å; S105-K107 WeakPolarHBondContact OG-CB 3.4Å; S105-K107 PolarHBondContact OG-N 2.86Å; S105-K107 PolarHBondContact OG-O 3.37Å; K107-V109 WeakPolarHBondContact O-CG2 3.43Å; K107-V109 PolarHBondContact O-N 3.26Å
108	P	94	Very high	95.9	Very high	101 Å²	101	52.6 Å²	52.6	66%	0.656	28%	0.284	S	S	*	.			trans	-52.7	129.2	175.1	-27.8	35.3	0	0	0	112.5	Y128	P108-Y128 VanDerWaalsContact CA-CE2 3.5Å; P108-Y128 HydrophobicContact CB-CE1 4.22Å; P108-Y128 HydrophobicContact CB-CE2 4.08Å; P108-Y128 HydrophobicContact CG-CE2 4.05Å
109	V	93.1	Very high	95.7	Very high	47 Å²	47	57.9 Å²	57.9	29%	0.285	31%	0.308	S	S	.	.			trans	-117.6	131.3	176.4	-176.7	0	0	0	0	108.5	K107 L130	K107-V109 WeakPolarHBondContact O-CG2 3.43Å; K107-V109 PolarHBondContact O-N 3.26Å; V109-L130 HydrophobicContact CG1-CD1 4.08Å; V109-L130 HydrophobicContact CG1-CD2 4.18Å; V109-L130 HydrophobicContact CG1-CG 4.29Å
110	N	91.8	Very high	95.4	Very high	146 Å²	146	56.6 Å²	56.6	78%	0.781	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.6	140.5	174.2	-68.4	-25.7	0	0	0	109.6	A112	N110-A112 VanDerWaalsContact C-N 3.28Å; N110-A112 PolarHBondContact O-N 2.9Å
111	N	92.8	Very high	95	Very high	157 Å²	157	62.1 Å²	62.1	84%	0.84	33%	0.332	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.3	35.2	179.2	-50.7	-32.9	0	0	0	114.2
112	A	97	Very high	94.7	Very high	24 Å²	24	64.9 Å²	64.9	20%	0.198	36%	0.36	C	S	.	.			trans	-58.1	137.8	167.9	0	0	0	0	0	110.4	N110 I115 Y128	N110-A112 VanDerWaalsContact C-N 3.28Å; N110-A112 PolarHBondContact O-N 2.9Å; A112-I115 HydrophobicContact CB-CG1 4.32Å; A112-Y128 HydrophobicContact CB-CD1 4.06Å
113	D	98.2	Very high	94.5	Very high	82 Å²	82	68.9 Å²	68.9	44%	0.439	38%	0.384	S	S	.	.	S	Bend	trans	-67.9	-42.3	176	-68	-85.1	0	0	0	110.8	V129 L130 K131	D113-V129 PolarHBondContact N-O 3.43Å; D113-L130 WeakPolarHBondContact OD2-CA 3.47Å; D113-K131 HydrophobicContact CB-CB 4.47Å; D113-K131 HydrophobicContact CB-CD 3.86Å; D113-K131 HydrophobicContact CB-CG 3.76Å; D113-K131 PolarHBondContact OD2-N 2.9Å
114	F	96.9	Very high	94.4	Very high	32 Å²	32	71 Å²	71	14%	0.14	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	150.6	177.1	-40.4	-50.5	0	0	0	111.2	I116 V129 K131 L165 L166	F114-I116 HydrophobicContact CB-CG1 4.37Å; F114-V129 HydrophobicContact CB-CB 4.09Å; F114-V129 HydrophobicContact CB-CG2 4.36Å; F114-V129 HydrophobicContact CD2-CB 4.15Å; F114-V129 HydrophobicContact CD2-CG1 4.06Å; F114-V129 PolarHBondContact N-O 3.42Å; F114-V129 PolarHBondContact O-N 3.04Å; F114-K131 HydrophobicContact CE1-CD 4.41Å; F114-K131 HydrophobicContact CE2-CD 4.14Å; F114-K131 HydrophobicContact CE2-CG 4.03Å; F114-K131 HydrophobicContact CZ-CD 3.73Å; F114-K131 HydrophobicContact CZ-CG 4.14Å; F114-L165 HydrophobicContact CB-CD1 3.9Å; F114-L165 HydrophobicContact CD1-CB 4.12Å; F114-L165 HydrophobicContact CD1-CD1 3.94Å; F114-L165 HydrophobicContact CD2-CB 4.14Å; F114-L165 HydrophobicContact CD2-CD1 4.21Å; F114-L165 HydrophobicContact CE1-CB 3.91Å; F114-L165 HydrophobicContact CE2-CB 3.89Å; F114-L165 HydrophobicContact CG-CB 4.25Å; F114-L165 HydrophobicContact CG-CD1 3.76Å; F114-L165 HydrophobicContact CZ-CB 3.77Å; F114-L166 HydrophobicContact CE2-CD1 4.18Å
115	I	97.3	Very high	94.3	Very high	93 Å²	93	73.7 Å²	73.7	48%	0.477	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	115.3	168.5	-55.1	176.3	0	0	0	107.3	A112 Q126 V127 Y128	A112-I115 HydrophobicContact CB-CG1 4.32Å; I115-Q126 HydrophobicContact CG2-CB 4.02Å; I115-Q126 HydrophobicContact CG2-CG 4.41Å; I115-V127 CarbonylContact C-O 3.58Å; I115-V127 WeakPolarHBondContact CA-O 3.43Å; I115-Y128 HydrophobicContact CD1-CD1 4.04Å; I115-Y128 HydrophobicContact CD1-CE1 3.81Å; I115-Y128 HydrophobicContact CG1-CD1 3.95Å; I115-Y128 HydrophobicContact CG1-CE1 4.17Å; I115-Y128 HydrophobicContact CG2-CE1 4.43Å
116	I	96.1	Very high	94.5	Very high	7 Å²	7	76.5 Å²	76.5	4%	0.036	42%	0.422	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	123	-172	-60	172.8	0	0	0	109.2	F114 V118 V127 V129 P161 V162 L165	F114-I116 HydrophobicContact CB-CG1 4.37Å; I116-V118 HydrophobicContact CG2-CG2 3.93Å; I116-V118 PolarHBondContact O-N 2.81Å; I116-V127 PolarHBondContact N-O 2.84Å; I116-V127 PolarHBondContact O-N 2.81Å; I116-V129 HydrophobicContact CD1-CG2 3.92Å; I116-V129 HydrophobicContact CG1-CG2 4.38Å; I116-P161 HydrophobicContact CD1-CB 4.13Å; I116-P161 HydrophobicContact CG2-CB 3.71Å; I116-P161 HydrophobicContact CG2-CG 4.24Å; I116-V162 HydrophobicContact CD1-CB 4.11Å; I116-V162 HydrophobicContact CD1-CG2 3.24Å; I116-L165 HydrophobicContact CD1-CD1 4.38Å; I116-L165 HydrophobicContact CG1-CD1 4.38Å
117	P	96.6	Very high	94.6	Very high	81 Å²	81	73.9 Å²	73.9	53%	0.526	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	121.9	172.2	29.9	-32	0	0	0	109.7	V124	P117-V124 HydrophobicContact CB-CG1 3.61Å
118	V	94.7	Very high	94.8	Very high	1 Å²	1	68.3 Å²	68.3	1%	0.006	39%	0.385	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.2	122.9	178.4	-174.5	0	0	0	0	109.8	V6 I116 I120 H125 V127 K157 Y158	V6-V118 HydrophobicContact CG1-CG1 3.87Å; I116-V118 HydrophobicContact CG2-CG2 3.93Å; I116-V118 PolarHBondContact O-N 2.81Å; V118-I120 HydrophobicContact CG1-CG1 4.33Å; V118-H125 PolarHBondContact N-O 3.23Å; V118-H125 PolarHBondContact O-N 2.85Å; V118-V127 HydrophobicContact CB-CG2 4.09Å; V118-V127 HydrophobicContact CG2-CB 4.36Å; V118-V127 HydrophobicContact CG2-CG2 3.66Å; V118-K157 HydrophobicContact CG1-CD 4.01Å; V118-K157 HydrophobicContact CG1-CG 4.02Å; V118-Y158 HydrophobicContact CG2-CD2 4.47Å
119	E	93.1	Very high	95	Very high	120 Å²	120	63.5 Å²	63.5	56%	0.561	35%	0.354	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.9	125.8	176.6	-168	-175.5	144.2	0	0	111.1	G122 V123 K157	E119-G122 WeakPolarHBondContact OE1-CA 3.43Å; E119-V123 WeakPolarHBondContact CA-O 3.49Å; E119-K157 PolarHBondContact O-NZ 3.28Å
120	I	90.9	Very high	95.2	Very high	3 Å²	3	62.3 Å²	62.3	2%	0.015	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	118.6	177.4	-47.6	-177.4	0	0	0	107.5	V6 F106 V118 G122 V123	V6-I120 HydrophobicContact CB-CD1 4.23Å; V6-I120 HydrophobicContact CG2-CD1 3.6Å; V6-I120 HydrophobicContact CG2-CG1 3.89Å; V6-I120 HydrophobicContact CG2-CG2 4.35Å; F106-I120 HydrophobicContact CE1-CD1 3.54Å; F106-I120 HydrophobicContact CZ-CD1 3.47Å; F106-I120 VanDerWaalsContact CZ-CD1 3.47Å; V118-I120 HydrophobicContact CG1-CG1 4.33Å; I120-G122 PolarHBondContact O-N 3.17Å; I120-V123 PolarHBondContact N-O 2.77Å; I120-V123 PolarHBondContact O-N 3.23Å
121	D	91.3	Very high	95.6	Very high	116 Å²	116	56.5 Å²	56.5	62%	0.62	31%	0.314	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.1	39.8	-178.3	-53.9	-37.3	0	0	0	113.4	M1 V123	M1-D121 VanDerWaalsContact N-CG 3.31Å; M1-D121 PolarHBondContact N-OD1 2.8Å; M1-D121 PolarHBondContact N-OD2 2.81Å; D121-V123 VanDerWaalsContact C-N 3.31Å; D121-V123 PolarHBondContact O-N 2.91Å
122	G	93.3	Very high	95.9	Very high	58 Å²	58	49.1 Å²	49.1	60%	0.598	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	81.9	-0.1	179.7	0	0	0	0	0	115.4	E119 I120	E119-G122 WeakPolarHBondContact OE1-CA 3.43Å; I120-G122 PolarHBondContact O-N 3.17Å
123	V	94.7	Very high	95.9	Very high	84 Å²	84	48.9 Å²	48.9	51%	0.509	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	128.8	178	-177.4	0	0	0	0	109.5	E119 I120 D121 H125	E119-V123 WeakPolarHBondContact CA-O 3.49Å; I120-V123 PolarHBondContact N-O 2.77Å; I120-V123 PolarHBondContact O-N 3.23Å; D121-V123 VanDerWaalsContact C-N 3.31Å; D121-V123 PolarHBondContact O-N 2.91Å; V123-H125 PolarHBondContact O-CD2 2.63Å; V123-H125 VanDerWaalsContact O-CD2 3.22Å; V123-H125 PolarHBondContact O-N 3.25Å
124	V	94.9	Very high	96	Very high	87 Å²	87	48.5 Å²	48.5	53%	0.527	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.2	120.5	175	-179.8	0	0	0	0	109.4	P117	P117-V124 HydrophobicContact CB-CG1 3.61Å
125	H	94.1	Very high	96.1	Very high	64 Å²	64	47.1 Å²	47.1	30%	0.296	26%	0.26	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	142.5	173.3	-64.4	-88.5	0	0	0	109.9	F106 V118 V123	F106-H125 HydrophobicContact CD1-CB 3.88Å; F106-H125 HydrophobicContact CE1-CB 3.85Å; V118-H125 PolarHBondContact N-O 3.23Å; V118-H125 PolarHBondContact O-N 2.85Å; V123-H125 PolarHBondContact O-CD2 2.63Å; V123-H125 VanDerWaalsContact O-CD2 3.22Å; V123-H125 PolarHBondContact O-N 3.25Å
126	Q	96.2	Very high	96.1	Very high	86 Å²	86	45.1 Å²	45.1	40%	0.402	25%	0.25	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85	127	173.1	-61	-62.8	-14.2	0	0	109.5	I115 Y128	I115-Q126 HydrophobicContact CG2-CB 4.02Å; I115-Q126 HydrophobicContact CG2-CG 4.41Å; Q126-Y128 HydrophobicContact CB-CE2 3.92Å
127	V	96.6	Very high	96.3	Very high	0 Å²	0	48.8 Å²	48.8	0%	0	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	121	173.4	-178.7	0	0	0	0	108.4	I7 F106 I115 I116 V118 V129 Y158	I7-V127 HydrophobicContact CD1-CB 4.47Å; I7-V127 HydrophobicContact CD1-CG1 3.54Å; I7-V127 HydrophobicContact CD1-CG2 4.04Å; F106-V127 HydrophobicContact CD1-CG2 3.93Å; F106-V127 HydrophobicContact CE1-CG2 3.48Å; F106-V127 VanDerWaalsContact CE1-CG2 3.48Å; F106-V127 HydrophobicContact CZ-CG2 3.98Å; I115-V127 CarbonylContact C-O 3.58Å; I115-V127 WeakPolarHBondContact CA-O 3.43Å; I116-V127 PolarHBondContact N-O 2.84Å; I116-V127 PolarHBondContact O-N 2.81Å; V118-V127 HydrophobicContact CB-CG2 4.09Å; V118-V127 HydrophobicContact CG2-CB 4.36Å; V118-V127 HydrophobicContact CG2-CG2 3.66Å; V127-V129 HydrophobicContact CG1-CG2 4.28Å; V127-Y158 HydrophobicContact CG1-CD2 4.15Å; V127-Y158 HydrophobicContact CG1-CE2 3.89Å
128	Y	97.5	Very high	96.4	Very high	46 Å²	46	45 Å²	45	18%	0.18	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-94	121.6	179.7	-62.5	-100.2	0	0	0	108.2	S104 S105 P108 A112 I115 Q126	S104-Y128 WeakPolarHBondContact CA-O 3.49Å; S105-Y128 PolarHBondContact N-O 3.18Å; S105-Y128 PolarHBondContact O-N 3Å; P108-Y128 VanDerWaalsContact CA-CE2 3.5Å; P108-Y128 HydrophobicContact CB-CE1 4.22Å; P108-Y128 HydrophobicContact CB-CE2 4.08Å; P108-Y128 HydrophobicContact CG-CE2 4.05Å; A112-Y128 HydrophobicContact CB-CD1 4.06Å; I115-Y128 HydrophobicContact CD1-CD1 4.04Å; I115-Y128 HydrophobicContact CD1-CE1 3.81Å; I115-Y128 HydrophobicContact CG1-CD1 3.95Å; I115-Y128 HydrophobicContact CG1-CE1 4.17Å; I115-Y128 HydrophobicContact CG2-CE1 4.43Å; Q126-Y128 HydrophobicContact CB-CE2 3.92Å
129	V	98.2	Very high	96.6	Very high	0 Å²	0	44.9 Å²	44.9	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.7	127.5	-173.8	-170.7	0	0	0	0	109.2	V102 H103 S104 D113 F114 I116 V127 V162	V102-V129 HydrophobicContact CB-CG1 3.8Å; V102-V129 HydrophobicContact CG1-CG1 4.03Å; V102-V129 HydrophobicContact CG2-CG1 4.17Å; H103-V129 WeakPolarHBondContact O-CA 3.4Å; S104-V129 WeakPolarHBondContact OG-CG2 3.39Å; D113-V129 PolarHBondContact N-O 3.43Å; F114-V129 HydrophobicContact CB-CB 4.09Å; F114-V129 HydrophobicContact CB-CG2 4.36Å; F114-V129 HydrophobicContact CD2-CB 4.15Å; F114-V129 HydrophobicContact CD2-CG1 4.06Å; F114-V129 PolarHBondContact N-O 3.42Å; F114-V129 PolarHBondContact O-N 3.04Å; I116-V129 HydrophobicContact CD1-CG2 3.92Å; I116-V129 HydrophobicContact CG1-CG2 4.38Å; V127-V129 HydrophobicContact CG1-CG2 4.28Å; V129-V162 HydrophobicContact CG1-CG1 4.47Å; V129-V162 HydrophobicContact CG2-CG2 4.27Å
130	L	98.2	Very high	96.8	Very high	22 Å²	22	43 Å²	43	12%	0.115	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	138.3	169.2	-64.1	172.1	0	0	0	109.5	V102 H103 V109 D113 W225 D227	V102-L130 CarbonylContact C-O 3.56Å; V102-L130 WeakPolarHBondContact CA-O 3.31Å; V102-L130 VanDerWaalsContact CB-O 3.28Å; V102-L130 WeakPolarHBondContact CB-O 3.12Å; H103-L130 PolarHBondContact N-O 3.27Å; H103-L130 PolarHBondContact O-N 3.09Å; V109-L130 HydrophobicContact CG1-CD1 4.08Å; V109-L130 HydrophobicContact CG1-CD2 4.18Å; V109-L130 HydrophobicContact CG1-CG 4.29Å; D113-L130 WeakPolarHBondContact OD2-CA 3.47Å; L130-W225 HydrophobicContact CB-CH2 3.69Å; L130-W225 HydrophobicContact CB-CZ3 3.97Å; L130-W225 WeakPolarHBondContact O-CZ3 3.41Å; L130-D227 HydrophobicContact CD1-CB 4.16Å
131	K	98.7	Very high	97.2	Very high	24 Å²	24	46.3 Å²	46.3	10%	0.104	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85	132.1	173.3	-69.3	176.1	69.6	177.1	0	110.1	D113 F114 V135 D136 L166 W225	D113-K131 HydrophobicContact CB-CB 4.47Å; D113-K131 HydrophobicContact CB-CD 3.86Å; D113-K131 HydrophobicContact CB-CG 3.76Å; D113-K131 PolarHBondContact OD2-N 2.9Å; F114-K131 HydrophobicContact CE1-CD 4.41Å; F114-K131 HydrophobicContact CE2-CD 4.14Å; F114-K131 HydrophobicContact CE2-CG 4.03Å; F114-K131 HydrophobicContact CZ-CD 3.73Å; F114-K131 HydrophobicContact CZ-CG 4.14Å; K131-V135 HydrophobicContact CB-CG1 3.89Å; K131-V135 HydrophobicContact CD-CG1 4.42Å; K131-V135 HydrophobicContact CG-CG1 4.29Å; K131-D136 IonicContact NZ-OD1 3.46Å; K131-D136 PolarHBondContact NZ-OD1 3.02Å; K131-D136 IonicContact NZ-OD2 3.65Å; K131-D136 PolarHBondContact NZ-OD2 3.21Å; K131-L166 HydrophobicContact CD-CD1 4.35Å; K131-L166 HydrophobicContact CG-CD1 4.08Å; K131-W225 WeakPolarHBondContact O-CH2 3.28Å
132	R	98.7	Very high	97.6	Very high	2 Å²	2	40.8 Å²	40.8	1%	0.008	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-60.9	137.1	168.4	-172.1	167.9	-173.4	163.3	11.2	109.4	T100 L101 H134 V135 A223 W225 D231 E233 L234	T100-R132 WeakPolarHBondContact O-CD 3.49Å; T100-R132 PolarHBondContact O-NH1 3.25Å; L101-R132 WeakPolarHBondContact O-CB 3.48Å; L101-R132 PolarHBondContact O-N 3.24Å; R132-H134 PolarHBondContact O-N 2.85Å; R132-V135 VanDerWaalsContact O-CB 3.29Å; R132-V135 WeakPolarHBondContact O-CB 3.42Å; R132-V135 VanDerWaalsContact O-CG1 3.27Å; R132-V135 WeakPolarHBondContact O-CG1 3.45Å; R132-V135 PolarHBondContact O-N 2.82Å; R132-A223 PolarHBondContact NH1-O 3.47Å; R132-A223 PolarHBondContact NH2-O 2.99Å; R132-W225 HydrophobicContact CB-CD2 3.77Å; R132-W225 HydrophobicContact CB-CE3 3.79Å; R132-W225 HydrophobicContact CB-CG 4.21Å; R132-W225 HydrophobicContact CB-CZ3 4.17Å; R132-W225 HydrophobicContact CG-CB 4.15Å; R132-W225 HydrophobicContact CG-CD2 3.68Å; R132-W225 HydrophobicContact CG-CE3 4.21Å; R132-W225 HydrophobicContact CG-CG 3.61Å; R132-D231 IonicContact CZ-OD1 3.18Å; R132-D231 IonicContact CZ-OD2 2.66Å; R132-D231 IonicContact NE-OD1 3.57Å; R132-D231 PolarHBondContact NE-OD1 3.26Å; R132-D231 IonicContact NE-OD2 2.89Å; R132-D231 IonicContact NH2-OD1 2.76Å; R132-D231 PolarHBondContact NH2-OD1 3.18Å; R132-D231 IonicContact NH2-OD2 3.29Å; R132-D231 PolarHBondContact NH2-OD2 2.9Å; R132-E233 IonicContact CZ-OE2 2.62Å; R132-E233 IonicContact NH1-OE2 3.21Å; R132-E233 IonicContact NH2-OE2 2.7Å; R132-E233 PolarHBondContact NH2-OE2 3.3Å; R132-L234 HydrophobicContact CB-CD1 4.04Å; R132-L234 HydrophobicContact CG-CD1 3.91Å; R132-L234 HydrophobicContact CG-CG 4.2Å
133	P	98.8	Very high	97.8	Very high	19 Å²	19	38.5 Å²	38.5	12%	0.123	19%	0.192	C	C	.	.	T	Hydrogen-bonded Turn	trans	-48.5	144.3	173.4	-30.1	36.2	0	0	0	111.9	V135 M229 D231	P133-V135 PolarHBondContact O-N 2.8Å; P133-V135 VanDerWaalsContact O-N 3.15Å; P133-M229 HydrophobicContact CG-CE 4.22Å; P133-M229 HydrophobicContact CG-SD 4.49Å; P133-D231 VanDerWaalsContact CB-O 3.24Å; P133-D231 WeakPolarHBondContact CB-O 3.41Å; P133-D231 HydrophobicContact CG-CB 4.21Å
134	H	98.7	Very high	98	Very high	74 Å²	74	39.2 Å²	39.2	34%	0.343	19%	0.19	S	C	.	.	T	Hydrogen-bonded Turn	trans	65.9	3.6	-179.4	-51.2	-87.1	0	0	0	116.7	R132 D136 E137 F138 L234 H235	R132-H134 PolarHBondContact O-N 2.85Å; H134-D136 VanDerWaalsContact C-N 3.27Å; H134-D136 PolarHBondContact O-N 3.24Å; H134-E137 IonicContact ND1-OE2 3.6Å; H134-E137 PolarHBondContact ND1-OE2 2.76Å; H134-E137 PolarHBondContact O-N 3.43Å; H134-F138 WeakPolarHBondContact O-CB 3.45Å; H134-F138 PolarHBondContact O-N 2.87Å; H134-L234 HydrophobicContact CB-CB 4.46Å; H134-H235 HydrophobicContact CB-CB 3.93Å; H134-H235 AromaticContact ND1-ND1 3.99Å
135	V	98.8	Very high	98.2	Very high	2 Å²	2	36.4 Å²	36.4	1%	0.012	17%	0.172	C	C	.	.	H	α-helix	trans	-59.2	-34	-178.2	71	0	0	0	0	114.2	L101 K131 R132 P133 F138 L139 L166 L234	L101-V135 HydrophobicContact CB-CG2 3.95Å; L101-V135 HydrophobicContact CD2-CG2 4Å; L101-V135 HydrophobicContact CG-CG2 4.46Å; K131-V135 HydrophobicContact CB-CG1 3.89Å; K131-V135 HydrophobicContact CD-CG1 4.42Å; K131-V135 HydrophobicContact CG-CG1 4.29Å; R132-V135 VanDerWaalsContact O-CB 3.29Å; R132-V135 WeakPolarHBondContact O-CB 3.42Å; R132-V135 VanDerWaalsContact O-CG1 3.27Å; R132-V135 WeakPolarHBondContact O-CG1 3.45Å; R132-V135 PolarHBondContact O-N 2.82Å; P133-V135 PolarHBondContact O-N 2.8Å; P133-V135 VanDerWaalsContact O-N 3.15Å; V135-F138 PolarHBondContact O-N 3.32Å; V135-L139 HydrophobicContact CG2-CD1 4.08Å; V135-L139 HydrophobicContact CG2-CG 4.21Å; V135-L139 WeakPolarHBondContact O-CB 3.29Å; V135-L139 WeakPolarHBondContact O-CG 3.11Å; V135-L139 PolarHBondContact O-N 2.91Å; V135-L166 HydrophobicContact CG1-CD1 4.02Å; V135-L166 HydrophobicContact CG2-CD1 4.14Å; V135-L166 HydrophobicContact CG2-CD2 4.15Å; V135-L166 HydrophobicContact CG2-CG 4.37Å; V135-L234 HydrophobicContact CB-CD1 3.9Å; V135-L234 HydrophobicContact CG2-CD1 4.15Å
136	D	98.8	Very high	98.4	Very high	52 Å²	52	33.3 Å²	33.3	28%	0.278	16%	0.158	S	C	.	.	H	α-helix	trans	-64	-51.6	176.4	-79.9	-35.3	0	0	0	111.1	K131 H134 F138 Q140 K168 W169	K131-D136 IonicContact NZ-OD1 3.46Å; K131-D136 PolarHBondContact NZ-OD1 3.02Å; K131-D136 IonicContact NZ-OD2 3.65Å; K131-D136 PolarHBondContact NZ-OD2 3.21Å; H134-D136 VanDerWaalsContact C-N 3.27Å; H134-D136 PolarHBondContact O-N 3.24Å; D136-F138 VanDerWaalsContact C-N 3.3Å; D136-F138 PolarHBondContact O-N 2.88Å; D136-Q140 WeakPolarHBondContact O-CB 3.35Å; D136-Q140 PolarHBondContact O-N 3.16Å; D136-Q140 VanDerWaalsContact O-N 3.1Å; D136-K168 IonicContact OD1-NZ 2.66Å; D136-K168 PolarHBondContact OD1-NZ 3.47Å; D136-K168 IonicContact OD2-NZ 3.67Å; D136-K168 PolarHBondContact OD2-NZ 3.48Å; D136-W169 HydrophobicContact CB-CH2 3.75Å; D136-W169 WeakPolarHBondContact O-CH2 3.45Å; D136-W169 WeakPolarHBondContact O-CZ3 3.39Å
137	E	98.7	Very high	98.5	Very high	84 Å²	84	29.7 Å²	29.7	39%	0.393	14%	0.141	S	C	.	.	H	α-helix	trans	-59.1	-44.6	176	178.8	-174.3	-160	0	0	110.6	H134 R141 H235 L238	H134-E137 IonicContact ND1-OE2 3.6Å; H134-E137 PolarHBondContact ND1-OE2 2.76Å; H134-E137 PolarHBondContact O-N 3.43Å; E137-R141 WeakPolarHBondContact O-CB 3.46Å; E137-R141 PolarHBondContact O-N 3.2Å; E137-H235 IonicContact OE1-CE1 3.64Å; E137-H235 IonicContact OE1-ND1 3.54Å; E137-H235 PolarHBondContact OE1-ND1 2.81Å; E137-H235 IonicContact OE2-CE1 3.64Å; E137-H235 IonicContact OE2-ND1 2.82Å; E137-H235 PolarHBondContact OE2-ND1 3.03Å; E137-L238 HydrophobicContact CG-CD1 4.02Å
138	F	98.9	Very high	98.6	Very high	0 Å²	0	29.7 Å²	29.7	0%	0	14%	0.141	C	C	.	.	H	α-helix	trans	-60.1	-55.1	-179.5	-178.3	-99.4	0	0	0	112	I95 L101 H134 V135 D136 Q140 R141 M142 L205 L234 L238 F241	I95-F138 HydrophobicContact CD1-CE1 4.49Å; L101-F138 HydrophobicContact CD2-CD1 4.07Å; L101-F138 HydrophobicContact CD2-CE1 4.11Å; H134-F138 WeakPolarHBondContact O-CB 3.45Å; H134-F138 PolarHBondContact O-N 2.87Å; V135-F138 PolarHBondContact O-N 3.32Å; D136-F138 VanDerWaalsContact C-N 3.3Å; D136-F138 PolarHBondContact O-N 2.88Å; F138-Q140 PolarHBondContact O-N 3.08Å; F138-R141 PolarHBondContact O-N 3.02Å; F138-M142 HydrophobicContact CD1-CG 4.05Å; F138-M142 HydrophobicContact CD2-CG 4.13Å; F138-M142 HydrophobicContact CE1-CG 3.68Å; F138-M142 HydrophobicContact CE2-CG 3.78Å; F138-M142 HydrophobicContact CE2-SD 4.04Å; F138-M142 HydrophobicContact CG-CG 4.25Å; F138-M142 HydrophobicContact CZ-CE 4.15Å; F138-M142 HydrophobicContact CZ-CG 3.52Å; F138-M142 HydrophobicContact CZ-SD 3.94Å; F138-M142 WeakPolarHBondContact O-CB 3.34Å; F138-M142 WeakPolarHBondContact O-CG 3.08Å; F138-M142 PolarHBondContact O-N 2.87Å; F138-L205 HydrophobicContact CE1-CD2 3.86Å; F138-L205 HydrophobicContact CE2-CD2 4.45Å; F138-L205 HydrophobicContact CZ-CD2 3.44Å; F138-L205 VanDerWaalsContact CZ-CD2 3.44Å; F138-L234 HydrophobicContact CB-CB 4.08Å; F138-L234 HydrophobicContact CB-CD1 4.38Å; F138-L234 HydrophobicContact CD1-CD1 4.47Å; F138-L234 HydrophobicContact CD1-CD2 4.36Å; F138-L234 HydrophobicContact CD2-CB 4.04Å; F138-L234 HydrophobicContact CD2-CD2 4.46Å; F138-L234 VanDerWaalsContact CD2-O 3.26Å; F138-L234 WeakPolarHBondContact CD2-O 3.27Å; F138-L234 HydrophobicContact CE1-CD2 4.42Å; F138-L234 HydrophobicContact CG-CB 4.04Å; F138-L234 HydrophobicContact CG-CD1 4.41Å; F138-L234 HydrophobicContact CG-CD2 4.39Å; F138-L238 HydrophobicContact CD2-CD2 3.64Å; F138-L238 HydrophobicContact CD2-CG 4.02Å; F138-L238 HydrophobicContact CE2-CD2 4.11Å; F138-F241 AromaticContact CE2-CD2 3.96Å; F138-F241 HydrophobicContact CE2-CD2 3.96Å; F138-F241 AromaticContact CE2-CE2 4Å; F138-F241 HydrophobicContact CE2-CE2 4Å; F138-F241 HydrophobicContact CZ-CD2 4.3Å; F138-F241 AromaticContact CZ-CE2 3.99Å; F138-F241 HydrophobicContact CZ-CE2 3.99Å
139	L	98.9	Very high	98.7	Very high	0 Å²	0	27.5 Å²	27.5	0%	0	13%	0.132	C	C	.	.	H	α-helix	trans	-65.8	-38.8	-177.5	-72.4	-179.7	0	0	0	112.6	L101 V135 R141 M142 G143 L166 W169 A171 F172	L101-L139 HydrophobicContact CD1-CD2 4.08Å; L101-L139 HydrophobicContact CD2-CD2 4.37Å; V135-L139 HydrophobicContact CG2-CD1 4.08Å; V135-L139 HydrophobicContact CG2-CG 4.21Å; V135-L139 WeakPolarHBondContact O-CB 3.29Å; V135-L139 WeakPolarHBondContact O-CG 3.11Å; V135-L139 PolarHBondContact O-N 2.91Å; L139-R141 VanDerWaalsContact C-N 3.33Å; L139-R141 PolarHBondContact O-N 2.97Å; L139-M142 PolarHBondContact O-N 2.92Å; L139-G143 PolarHBondContact O-N 2.93Å; L139-L166 HydrophobicContact CD1-CB 4.49Å; L139-L166 HydrophobicContact CD1-CD2 3.55Å; L139-L166 HydrophobicContact CD1-CG 3.61Å; L139-W169 HydrophobicContact CB-CE3 4.48Å; L139-W169 HydrophobicContact CB-CZ3 4.3Å; L139-A171 WeakPolarHBondContact O-CB 3.41Å; L139-F172 HydrophobicContact CD1-CE2 4.32Å; L139-F172 HydrophobicContact CD1-CZ 4.37Å; L139-F172 HydrophobicContact CD2-CE1 4.19Å; L139-F172 HydrophobicContact CD2-CE2 4.34Å; L139-F172 HydrophobicContact CD2-CZ 3.68Å
140	Q	98.8	Very high	98.7	Very high	80 Å²	80	27.5 Å²	27.5	37%	0.374	13%	0.132	S	C	.	.	H	α-helix	trans	-56.4	-51.2	173.8	-176.4	177.3	1.9	0	0	110.3	D136 F138 G143 E144 W169	D136-Q140 WeakPolarHBondContact O-CB 3.35Å; D136-Q140 PolarHBondContact O-N 3.16Å; D136-Q140 VanDerWaalsContact O-N 3.1Å; F138-Q140 PolarHBondContact O-N 3.08Å; Q140-G143 PolarHBondContact O-N 2.64Å; Q140-E144 PolarHBondContact O-N 2.83Å; Q140-W169 HydrophobicContact CB-CD2 3.73Å; Q140-W169 HydrophobicContact CB-CE3 4.01Å; Q140-W169 HydrophobicContact CB-CG 4.23Å; Q140-W169 HydrophobicContact CB-CH2 4.21Å; Q140-W169 HydrophobicContact CB-CZ2 3.92Å; Q140-W169 HydrophobicContact CB-CZ3 4.25Å; Q140-W169 HydrophobicContact CG-CD2 4.01Å; Q140-W169 HydrophobicContact CG-CG 4.06Å; Q140-W169 HydrophobicContact CG-CZ2 4.37Å
141	R	98.8	Very high	98.8	Very high	73 Å²	73	26.5 Å²	26.5	28%	0.275	13%	0.127	S	C	.	.	H	α-helix	trans	-68.6	-40.7	-176.8	-173.3	55.8	179	154.6	0.8	112.5	E137 F138 L139 G143 E144 L145 L238 E242	E137-R141 WeakPolarHBondContact O-CB 3.46Å; E137-R141 PolarHBondContact O-N 3.2Å; F138-R141 PolarHBondContact O-N 3.02Å; L139-R141 VanDerWaalsContact C-N 3.33Å; L139-R141 PolarHBondContact O-N 2.97Å; R141-G143 PolarHBondContact O-N 2.96Å; R141-E144 IonicContact CZ-OE2 3.94Å; R141-E144 IonicContact NH1-OE2 3.31Å; R141-E144 PolarHBondContact NH1-OE2 3.23Å; R141-E144 PolarHBondContact O-N 2.85Å; R141-L145 HydrophobicContact CG-CD1 4Å; R141-L145 WeakPolarHBondContact O-CG 3.21Å; R141-L145 PolarHBondContact O-N 3.34Å; R141-L238 HydrophobicContact CB-CD2 3.85Å; R141-L238 HydrophobicContact CG-CD2 3.89Å; R141-E242 IonicContact CZ-OE1 3.02Å; R141-E242 IonicContact NE-OE1 2.78Å; R141-E242 PolarHBondContact NE-OE1 3.15Å; R141-E242 IonicContact NH2-OE1 2.7Å; R141-E242 PolarHBondContact NH2-OE1 3.19Å; R141-E242 IonicContact NH2-OE2 2.89Å; R141-E242 PolarHBondContact NH2-OE2 2.96Å
142	M	98.8	Very high	98.8	Very high	0 Å²	0	25.4 Å²	25.4	0%	0	12%	0.122	C	C	.	.	H	α-helix	trans	-62.4	-42.4	178	-71	-62.7	-72.1	0	0	111.8	V93 I95 F138 L139 E144 L145 F146 C148 F241	V93-M142 HydrophobicContact CB-CE 4.19Å; V93-M142 HydrophobicContact CG1-CE 3.81Å; V93-M142 HydrophobicContact CG2-CE 4.11Å; I95-M142 HydrophobicContact CD1-CE 4.27Å; F138-M142 HydrophobicContact CD1-CG 4.05Å; F138-M142 HydrophobicContact CD2-CG 4.13Å; F138-M142 HydrophobicContact CE1-CG 3.68Å; F138-M142 HydrophobicContact CE2-CG 3.78Å; F138-M142 HydrophobicContact CE2-SD 4.04Å; F138-M142 HydrophobicContact CG-CG 4.25Å; F138-M142 HydrophobicContact CZ-CE 4.15Å; F138-M142 HydrophobicContact CZ-CG 3.52Å; F138-M142 HydrophobicContact CZ-SD 3.94Å; F138-M142 WeakPolarHBondContact O-CB 3.34Å; F138-M142 WeakPolarHBondContact O-CG 3.08Å; F138-M142 PolarHBondContact O-N 2.87Å; L139-M142 PolarHBondContact O-N 2.92Å; M142-E144 PolarHBondContact O-N 3.02Å; M142-L145 PolarHBondContact O-N 2.84Å; M142-F146 HydrophobicContact CE-CD2 3.6Å; M142-F146 HydrophobicContact CE-CE2 3.78Å; M142-F146 HydrophobicContact CE-CG 4.49Å; M142-F146 PolarHBondContact O-N 3.25Å; M142-F146 HydrophobicContact SD-CD2 3.81Å; M142-F146 HydrophobicContact SD-CE2 3.74Å; M142-C148 VanDerWaalsContact C-SG 3.5Å; M142-C148 PolarHBondContact O-SG 2.72Å; M142-C148 VanDerWaalsContact O-SG 3.36Å; M142-F241 HydrophobicContact CE-CB 4.49Å; M142-F241 HydrophobicContact CE-CD1 3.58Å; M142-F241 HydrophobicContact CE-CD2 4.2Å; M142-F241 HydrophobicContact CE-CE1 3.73Å; M142-F241 HydrophobicContact CE-CE2 4.33Å; M142-F241 HydrophobicContact CE-CG 3.84Å; M142-F241 HydrophobicContact CE-CZ 4.11Å; M142-F241 HydrophobicContact SD-CB 3.76Å; M142-F241 HydrophobicContact SD-CD1 3.97Å; M142-F241 HydrophobicContact SD-CD2 3.91Å; M142-F241 HydrophobicContact SD-CG 3.61Å
143	G	98.6	Very high	98.7	Very high	9 Å²	9	25.4 Å²	25.4	9%	0.093	12%	0.123	C	C	.	.	H	α-helix	trans	-65	-23.7	179.2	0	0	0	0	0	114.8	L139 Q140 R141 R173	L139-G143 PolarHBondContact O-N 2.93Å; Q140-G143 PolarHBondContact O-N 2.64Å; R141-G143 PolarHBondContact O-N 2.96Å; G143-R173 PolarHBondContact O-NH2 3.2Å
144	E	98.5	Very high	98.6	Very high	99 Å²	99	24.5 Å²	24.5	46%	0.463	12%	0.117	S	C	.	.	H	α-helix	trans	-76.3	-47.9	171.2	-66.6	171	176.7	0	0	111.3	K90 Q140 R141 M142	K90-E144 PolarHBondContact NZ-O 2.85Å; Q140-E144 PolarHBondContact O-N 2.83Å; R141-E144 IonicContact CZ-OE2 3.94Å; R141-E144 IonicContact NH1-OE2 3.31Å; R141-E144 PolarHBondContact NH1-OE2 3.23Å; R141-E144 PolarHBondContact O-N 2.85Å; M142-E144 PolarHBondContact O-N 3.02Å
145	L	98.5	Very high	98.5	Very high	28 Å²	28	22.1 Å²	22.1	15%	0.147	11%	0.106	C	C	.	.	H	α-helix	trans	-75.2	-32.1	-172.3	-68.9	176.9	0	0	0	113.7	R141 M142 E242	R141-L145 HydrophobicContact CG-CD1 4Å; R141-L145 WeakPolarHBondContact O-CG 3.21Å; R141-L145 PolarHBondContact O-N 3.34Å; M142-L145 PolarHBondContact O-N 2.84Å; L145-E242 HydrophobicContact CD1-CG 4.08Å
146	F	98.9	Very high	98.4	Very high	0 Å²	0	23.4 Å²	23.4	0%	0	12%	0.117	C	C	.	.	S	Bend	trans	-131.9	167	-165.7	-61.8	-76.3	0	0	0	113.9	I91 V93 M142 C148 L203 F241	I91-F146 HydrophobicContact CB-CD1 3.73Å; I91-F146 HydrophobicContact CB-CE1 3.9Å; I91-F146 HydrophobicContact CG2-CD1 3.9Å; I91-F146 HydrophobicContact CG2-CE1 3.95Å; I91-F146 WeakPolarHBondContact O-CB 3.5Å; I91-F146 WeakPolarHBondContact O-CD1 3.03Å; V93-F146 HydrophobicContact CB-CB 4.34Å; V93-F146 HydrophobicContact CB-CG 4.42Å; V93-F146 HydrophobicContact CG2-CB 3.66Å; V93-F146 HydrophobicContact CG2-CD1 3.34Å; V93-F146 HydrophobicContact CG2-CD2 3.87Å; V93-F146 HydrophobicContact CG2-CE1 3.84Å; V93-F146 HydrophobicContact CG2-CE2 4.33Å; V93-F146 HydrophobicContact CG2-CG 3.34Å; V93-F146 HydrophobicContact CG2-CZ 4.29Å; M142-F146 HydrophobicContact CE-CD2 3.6Å; M142-F146 HydrophobicContact CE-CE2 3.78Å; M142-F146 HydrophobicContact CE-CG 4.49Å; M142-F146 PolarHBondContact O-N 3.25Å; M142-F146 HydrophobicContact SD-CD2 3.81Å; M142-F146 HydrophobicContact SD-CE2 3.74Å; F146-C148 PolarHBondContact O-N 3.34Å; F146-L203 HydrophobicContact CE1-CD1 4.3Å; F146-F241 HydrophobicContact CE2-CB 3.95Å; F146-F241 AromaticContact CE2-CD1 3.99Å; F146-F241 HydrophobicContact CE2-CD1 3.99Å; F146-F241 HydrophobicContact CE2-CG 4.35Å; F146-F241 HydrophobicContact CZ-CB 4.26Å; F146-F241 HydrophobicContact CZ-CD1 4.01Å; F146-F241 VanDerWaalsContact CZ-O 3.24Å; F146-F241 WeakPolarHBondContact CZ-O 3.34Å
147	E	98.8	Very high	98.3	Very high	10 Å²	10	24.8 Å²	24.8	5%	0.047	12%	0.121	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-82.8	92	156.5	-175	-170.6	-158.1	0	0	108	D87 I91 C92 V93 R173 R197	D87-E147 HydrophobicContact CB-CB 4.09Å; D87-E147 HydrophobicContact CB-CG 4.13Å; I91-E147 PolarHBondContact O-N 2.71Å; C92-E147 CarbonylContact C-O 3.59Å; C92-E147 WeakPolarHBondContact CA-O 3.33Å; C92-E147 HydrophobicContact CB-CB 4.46Å; V93-E147 PolarHBondContact N-O 2.84Å; E147-R173 HydrophobicContact CG-CB 4.24Å; E147-R173 HydrophobicContact CG-CG 3.9Å; E147-R197 IonicContact OE1-CZ 3.11Å; E147-R197 IonicContact OE1-NE 3.17Å; E147-R197 PolarHBondContact OE1-NE 2.65Å; E147-R197 IonicContact OE1-NH2 2.7Å; E147-R197 PolarHBondContact OE1-NH2 3.45Å; E147-R197 IonicContact OE2-CZ 3.59Å; E147-R197 IonicContact OE2-NE 2.75Å; E147-R197 PolarHBondContact OE2-NE 3.49Å; E147-R197 IonicContact OE2-NH2 3.59Å
148	C	98.9	Very high	98.2	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.5	136.4	-179.5	-59	0	0	0	0	111.5	V93 I95 M142 F146 A171 F172 R173	V93-C148 WeakPolarHBondContact O-CA 3.38Å; I95-C148 HydrophobicContact CD1-CB 4.11Å; M142-C148 VanDerWaalsContact C-SG 3.5Å; M142-C148 PolarHBondContact O-SG 2.72Å; M142-C148 VanDerWaalsContact O-SG 3.36Å; F146-C148 PolarHBondContact O-N 3.34Å; C148-A171 WeakPolarHBondContact CB-O 3.47Å; C148-F172 HydrophobicContact CB-CD1 4.15Å; C148-F172 CarbonylContact O-C 3.59Å; C148-F172 WeakPolarHBondContact O-CA 3.44Å; C148-R173 PolarHBondContact O-N 2.93Å
149	V	98.9	Very high	98.1	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.9	119.3	175.2	177.1	0	0	0	0	108.1	L80 V93 V94 I95 F151 A174 L176	L80-V149 HydrophobicContact CD1-CG2 3.82Å; L80-V149 HydrophobicContact CD2-CG1 4.03Å; L80-V149 HydrophobicContact CD2-CG2 4.15Å; V93-V149 PolarHBondContact O-N 2.66Å; V94-V149 WeakPolarHBondContact CA-O 3.14Å; I95-V149 PolarHBondContact N-O 2.62Å; V149-F151 PolarHBondContact O-N 3.09Å; V149-A174 HydrophobicContact CG1-CB 4.35Å; V149-A174 HydrophobicContact CG2-CB 4.47Å; V149-L176 HydrophobicContact CG1-CD1 3.92Å; V149-L176 HydrophobicContact CG1-CG 4.1Å
150	L	98.9	Very high	98.1	Very high	0 Å²	0	23.2 Å²	23.2	0%	0	12%	0.115	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.4	121.6	167.9	179.6	68.4	0	0	0	107.2	L97 A163 F172 A174 R175 L176	L97-L150 HydrophobicContact CB-CD1 4.05Å; L97-L150 HydrophobicContact CD1-CD1 4.3Å; L150-A163 HydrophobicContact CD2-CB 3.71Å; L150-F172 HydrophobicContact CB-CB 4.48Å; L150-F172 HydrophobicContact CB-CD1 3.72Å; L150-F172 HydrophobicContact CB-CD2 4.25Å; L150-F172 HydrophobicContact CB-CE1 3.92Å; L150-F172 HydrophobicContact CB-CE2 4.42Å; L150-F172 HydrophobicContact CB-CG 3.9Å; L150-F172 HydrophobicContact CB-CZ 4.26Å; L150-F172 HydrophobicContact CD1-CE1 4.24Å; L150-F172 HydrophobicContact CD1-CE2 4.33Å; L150-F172 HydrophobicContact CD1-CZ 3.96Å; L150-A174 PolarHBondContact N-O 3.03Å; L150-R175 HydrophobicContact CB-CB 4.42Å; L150-R175 HydrophobicContact CB-CG 4.18Å; L150-R175 HydrophobicContact CD2-CB 4.38Å; L150-R175 HydrophobicContact CD2-CG 4.1Å; L150-R175 CarbonylContact O-C 3.59Å; L150-R175 WeakPolarHBondContact O-CA 3.47Å; L150-L176 PolarHBondContact O-N 2.89Å
151	F	98.7	Very high	98.1	Very high	0 Å²	0	21.5 Å²	21.5	0%	0	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132	107.9	171.9	-163.2	169.3	0	0	0	107.8	L79 V94 I95 V149 L176 C181 K190 L195	L79-F151 HydrophobicContact CD1-CE1 4.26Å; L79-F151 HydrophobicContact CD1-CZ 4.27Å; V94-F151 HydrophobicContact CG1-CB 3.36Å; V94-F151 HydrophobicContact CG1-CD1 3.87Å; V94-F151 HydrophobicContact CG1-CG 4.09Å; I95-F151 PolarHBondContact O-N 3.15Å; V149-F151 PolarHBondContact O-N 3.09Å; F151-L176 CarbonylContact C-O 3.27Å; F151-L176 VanDerWaalsContact CA-O 3.29Å; F151-L176 WeakPolarHBondContact CA-O 3.25Å; F151-L176 HydrophobicContact CB-CB 4.16Å; F151-L176 HydrophobicContact CD1-CB 4.32Å; F151-L176 HydrophobicContact CD1-CD1 3.86Å; F151-L176 HydrophobicContact CD2-CB 3.49Å; F151-L176 VanDerWaalsContact CD2-CB 3.49Å; F151-L176 HydrophobicContact CD2-CD1 4.49Å; F151-L176 HydrophobicContact CE1-CD1 4.05Å; F151-L176 HydrophobicContact CE2-CB 3.89Å; F151-L176 HydrophobicContact CG-CB 3.74Å; F151-L176 HydrophobicContact CG-CD1 4.09Å; F151-L176 HydrophobicContact CZ-CB 4.46Å; F151-L176 HydrophobicContact CZ-CD1 4.45Å; F151-C181 VanDerWaalsContact CE2-SG 3.5Å; F151-K190 HydrophobicContact CB-CD 4.24Å; F151-K190 HydrophobicContact CD1-CB 3.9Å; F151-K190 HydrophobicContact CD1-CD 4.16Å; F151-K190 HydrophobicContact CD1-CG 3.98Å; F151-K190 HydrophobicContact CD2-CD 4.32Å; F151-K190 HydrophobicContact CD2-CG 4.15Å; F151-K190 HydrophobicContact CE1-CB 3.71Å; F151-K190 HydrophobicContact CE1-CG 3.99Å; F151-K190 HydrophobicContact CE2-CG 4.16Å; F151-K190 HydrophobicContact CG-CB 4.49Å; F151-K190 HydrophobicContact CG-CD 3.98Å; F151-K190 HydrophobicContact CG-CG 4.06Å; F151-K190 HydrophobicContact CZ-CB 4.16Å; F151-K190 HydrophobicContact CZ-CG 4.08Å; F151-K190 WeakPolarHBondContact O-CE 3.24Å; F151-K190 PolarHBondContact O-NZ 2.83Å; F151-L195 HydrophobicContact CD1-CD2 4.49Å
152	T	98.5	Very high	98.1	Very high	2 Å²	2	18 Å²	18	1%	0.012	10%	0.098	C	C	.	.			trans	-119.9	152.9	179.3	179.1	0	0	0	0	110.7	D98 S154 A159 L176 F177 R178	D98-T152 PolarHBondContact OD2-OG1 2.96Å; T152-S154 VanDerWaalsContact C-N 3.26Å; T152-S154 VanDerWaalsContact CG2-OG 3.25Å; T152-S154 WeakPolarHBondContact CG2-OG 3.46Å; T152-S154 PolarHBondContact OG1-N 2.96Å; T152-S154 PolarHBondContact OG1-OG 3.18Å; T152-A159 HydrophobicContact CG2-CB 3.74Å; T152-L176 PolarHBondContact N-O 3.32Å; T152-F177 HydrophobicContact CG2-CD1 4.01Å; T152-F177 CarbonylContact O-C 3.56Å; T152-F177 VanDerWaalsContact O-CA 3.27Å; T152-F177 WeakPolarHBondContact O-CA 3.49Å; T152-R178 PolarHBondContact O-N 3.36Å
153	A	97.5	Very high	98	Very high	2 Å²	2	18 Å²	18	2%	0.017	10%	0.098	C	C	.	.	S	Bend	trans	-88	6.5	169.2	0	0	0	0	0	112.6	Q9 R178 Y188	Q9-A153 HydrophobicContact CG-CB 3.35Å; Q9-A153 VanDerWaalsContact NE2-CB 3.35Å; A153-R178 PolarHBondContact O-NE 2.75Å; A153-R178 PolarHBondContact O-NH2 3.02Å; A153-Y188 HydrophobicContact CB-CD2 4.33Å; A153-Y188 HydrophobicContact CB-CG 4.14Å
154	S	97	Very high	98	Very high	0 Å²	0	22.5 Å²	22.5	0%	0	12%	0.119	C	C	.	.	S	Bend	trans	-83.2	168.5	170.4	69.9	0	0	0	0	111.6	V6 I7 D98 T152 R178	V6-S154 WeakPolarHBondContact O-CB 3.48Å; I7-S154 VanDerWaalsContact O-CB 3.23Å; I7-S154 WeakPolarHBondContact O-CB 3.44Å; D98-S154 WeakPolarHBondContact OD2-CB 3.46Å; D98-S154 PolarHBondContact OD2-OG 3.09Å; T152-S154 VanDerWaalsContact C-N 3.26Å; T152-S154 VanDerWaalsContact CG2-OG 3.25Å; T152-S154 WeakPolarHBondContact CG2-OG 3.46Å; T152-S154 PolarHBondContact OG1-N 2.96Å; T152-S154 PolarHBondContact OG1-OG 3.18Å; S154-R178 PolarHBondContact O-N 2.71Å; S154-R178 VanDerWaalsContact O-N 3.08Å
155	L	96.4	Very high	98	Very high	24 Å²	24	21.6 Å²	21.6	13%	0.126	12%	0.117	C	C	.	.			trans	-84.5	144.6	179.9	-62.8	176.6	0	0	0	111	V6 K157 Y158 A159 R178 E179	V6-L155 HydrophobicContact CG1-CD1 4.48Å; V6-L155 HydrophobicContact CG2-CD1 4.26Å; V6-L155 PolarHBondContact O-N 3.46Å; V6-L155 VanDerWaalsContact O-N 3.16Å; L155-K157 HydrophobicContact CB-CG 4.06Å; L155-K157 PolarHBondContact O-N 3.32Å; L155-K157 VanDerWaalsContact O-N 3.13Å; L155-Y158 PolarHBondContact O-N 3.5Å; L155-A159 PolarHBondContact O-N 3.4Å; L155-R178 HydrophobicContact CD2-CB 4.1Å; L155-E179 WeakPolarHBondContact CD2-OE1 3.38Å
156	A	97.1	Very high	98	Very high	28 Å²	28	20.3 Å²	20.3	23%	0.231	11%	0.11	C	C	.	.	H	α-helix	trans	-51.7	-39.4	179.5	0	0	0	0	0	113.7	Y158 A159 D160 F177	A156-Y158 CarbonylContact O-C 3.05Å; A156-Y158 PolarHBondContact O-N 3.06Å; A156-A159 PolarHBondContact O-N 3.47Å; A156-D160 WeakPolarHBondContact O-CB 3.39Å; A156-D160 PolarHBondContact O-N 2.92Å; A156-F177 HydrophobicContact CB-CD1 3.97Å; A156-F177 HydrophobicContact CB-CD2 3.67Å; A156-F177 HydrophobicContact CB-CE1 4.06Å; A156-F177 HydrophobicContact CB-CE2 3.77Å; A156-F177 HydrophobicContact CB-CG 3.77Å; A156-F177 HydrophobicContact CB-CZ 3.96Å
157	K	95.9	Very high	98	Very high	82 Å²	82	21.2 Å²	21.2	36%	0.357	12%	0.115	S	C	.	.	H	α-helix	trans	-55.5	-19.9	178.6	68	176.1	-177.6	177	0	115.1	V6 V118 E119 L155	V6-K157 HydrophobicContact CG1-CG 4.32Å; V118-K157 HydrophobicContact CG1-CD 4.01Å; V118-K157 HydrophobicContact CG1-CG 4.02Å; E119-K157 PolarHBondContact O-NZ 3.28Å; L155-K157 HydrophobicContact CB-CG 4.06Å; L155-K157 PolarHBondContact O-N 3.32Å; L155-K157 VanDerWaalsContact O-N 3.13Å
158	Y	96.9	Very high	98	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-105.8	-49.8	172.9	154.4	-104	0	0	0	110.6	I7 L97 D98 S104 V118 V127 L155 A156 D160 P161 V162	I7-Y158 HydrophobicContact CB-CE1 4.45Å; I7-Y158 HydrophobicContact CG1-CD1 4.31Å; I7-Y158 HydrophobicContact CG1-CD2 4.27Å; I7-Y158 HydrophobicContact CG1-CE1 4.38Å; I7-Y158 HydrophobicContact CG1-CE2 4.36Å; I7-Y158 HydrophobicContact CG1-CG 4.25Å; I7-Y158 HydrophobicContact CG2-CE1 4Å; L97-Y158 HydrophobicContact CD2-CE1 4.06Å; D98-Y158 VanDerWaalsContact OD1-CE1 3.23Å; D98-Y158 WeakPolarHBondContact OD1-CE1 3.35Å; D98-Y158 VanDerWaalsContact OD1-CZ 3.26Å; D98-Y158 PolarHBondContact OD1-OH 3.34Å; S104-Y158 VanDerWaalsContact CB-OH 3.25Å; S104-Y158 WeakPolarHBondContact CB-OH 3.23Å; S104-Y158 PolarHBondContact OG-OH 3.18Å; V118-Y158 HydrophobicContact CG2-CD2 4.47Å; V127-Y158 HydrophobicContact CG1-CD2 4.15Å; V127-Y158 HydrophobicContact CG1-CE2 3.89Å; L155-Y158 PolarHBondContact O-N 3.5Å; A156-Y158 CarbonylContact O-C 3.05Å; A156-Y158 PolarHBondContact O-N 3.06Å; Y158-D160 PolarHBondContact O-N 3.13Å; Y158-P161 WeakPolarHBondContact O-CD 3.46Å; Y158-V162 HydrophobicContact CD2-CG2 3.94Å; Y158-V162 HydrophobicContact CE2-CG2 3.4Å; Y158-V162 WeakPolarHBondContact O-CG2 3.46Å; Y158-V162 PolarHBondContact O-N 3.22Å
159	A	98	Very high	98	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.156	C	C	.	.	H	α-helix	trans	-67.2	-36.9	-171.8	0	0	0	0	0	114	L97 T152 L155 A156 V162 A163 F177	L97-A159 HydrophobicContact CD2-CB 3.95Å; T152-A159 HydrophobicContact CG2-CB 3.74Å; L155-A159 PolarHBondContact O-N 3.4Å; A156-A159 PolarHBondContact O-N 3.47Å; A159-V162 PolarHBondContact O-N 3.18Å; A159-A163 VanDerWaalsContact O-CB 3.28Å; A159-A163 WeakPolarHBondContact O-CB 3.38Å; A159-A163 PolarHBondContact O-N 2.73Å; A159-F177 HydrophobicContact CB-CD1 3.77Å; A159-F177 HydrophobicContact CB-CE1 3.71Å
160	D	98.2	Very high	97.9	Very high	51 Å²	51	33.2 Å²	33.2	27%	0.273	18%	0.176	S	C	.	.	H	α-helix	trans	-62.9	-52.8	178.7	-90.7	-39.9	0	0	0	111.8	A156 Y158 V162 A163 D164 R175 F177	A156-D160 WeakPolarHBondContact O-CB 3.39Å; A156-D160 PolarHBondContact O-N 2.92Å; Y158-D160 PolarHBondContact O-N 3.13Å; D160-V162 VanDerWaalsContact C-N 3.28Å; D160-V162 PolarHBondContact O-N 2.91Å; D160-A163 PolarHBondContact O-N 2.74Å; D160-A163 VanDerWaalsContact O-N 3.12Å; D160-D164 VanDerWaalsContact O-CG 3.29Å; D160-D164 PolarHBondContact O-N 3.49Å; D160-R175 PolarHBondContact O-NH1 3.29Å; D160-R175 WeakPolarHBondContact OD1-CD 3.5Å; D160-R175 IonicContact OD1-CZ 3.48Å; D160-R175 IonicContact OD1-NE 3.83Å; D160-R175 IonicContact OD1-NH1 2.71Å; D160-R175 PolarHBondContact OD1-NH1 2.89Å; D160-F177 VanDerWaalsContact OD1-CZ 3.31Å; D160-F177 WeakPolarHBondContact OD1-CZ 3.34Å; D160-F177 WeakPolarHBondContact OD2-CZ 3.37Å
161	P	98.1	Very high	97.9	Very high	44 Å²	44	33.3 Å²	33.3	29%	0.286	18%	0.177	S	C	.	.	H	α-helix	trans	-56.6	-37.6	174.8	-28.3	34.1	0	0	0	114.2	I116 Y158 L165	I116-P161 HydrophobicContact CD1-CB 4.13Å; I116-P161 HydrophobicContact CG2-CB 3.71Å; I116-P161 HydrophobicContact CG2-CG 4.24Å; Y158-P161 WeakPolarHBondContact O-CD 3.46Å; P161-L165 WeakPolarHBondContact O-CG 3.28Å; P161-L165 PolarHBondContact O-N 3.12Å
162	V	98.3	Very high	97.9	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-64.2	-49.8	174.8	177.2	0	0	0	0	110.3	L97 V102 I116 V129 Y158 A159 D160 D164 L165 L166	L97-V162 HydrophobicContact CD1-CG1 3.91Å; L97-V162 HydrophobicContact CD2-CB 4.31Å; L97-V162 HydrophobicContact CD2-CG1 4.23Å; V102-V162 HydrophobicContact CG1-CG1 4.33Å; V102-V162 HydrophobicContact CG2-CG1 4.22Å; I116-V162 HydrophobicContact CD1-CB 4.11Å; I116-V162 HydrophobicContact CD1-CG2 3.24Å; V129-V162 HydrophobicContact CG1-CG1 4.47Å; V129-V162 HydrophobicContact CG2-CG2 4.27Å; Y158-V162 HydrophobicContact CD2-CG2 3.94Å; Y158-V162 HydrophobicContact CE2-CG2 3.4Å; Y158-V162 WeakPolarHBondContact O-CG2 3.46Å; Y158-V162 PolarHBondContact O-N 3.22Å; A159-V162 PolarHBondContact O-N 3.18Å; D160-V162 VanDerWaalsContact C-N 3.28Å; D160-V162 PolarHBondContact O-N 2.91Å; V162-D164 VanDerWaalsContact C-N 3.3Å; V162-D164 PolarHBondContact O-N 2.7Å; V162-L165 PolarHBondContact O-N 2.76Å; V162-L165 VanDerWaalsContact O-N 3.16Å; V162-L166 VanDerWaalsContact O-CB 3.31Å; V162-L166 WeakPolarHBondContact O-CB 3.4Å; V162-L166 PolarHBondContact O-N 2.93Å
163	A	98.6	Very high	97.9	Very high	0 Å²	0	37.3 Å²	37.3	0%	0	19%	0.192	C	C	.	.	H	α-helix	trans	-61.8	-38	-177.9	0	0	0	0	0	112.1	L150 A159 D160 L165 L166 D167	L150-A163 HydrophobicContact CD2-CB 3.71Å; A159-A163 VanDerWaalsContact O-CB 3.28Å; A159-A163 WeakPolarHBondContact O-CB 3.38Å; A159-A163 PolarHBondContact O-N 2.73Å; D160-A163 PolarHBondContact O-N 2.74Å; D160-A163 VanDerWaalsContact O-N 3.12Å; A163-L165 VanDerWaalsContact C-N 3.31Å; A163-L165 PolarHBondContact O-N 2.85Å; A163-L166 PolarHBondContact O-N 2.82Å; A163-D167 WeakPolarHBondContact O-CB 3.4Å; A163-D167 PolarHBondContact O-N 3.47Å
164	D	98.4	Very high	98	Very high	102 Å²	102	38.4 Å²	38.4	55%	0.545	20%	0.201	S	C	.	.	H	α-helix	trans	-62.5	-35.8	175.9	-70.4	-18.2	0	0	0	112.8	D160 V162 R175	D160-D164 VanDerWaalsContact O-CG 3.29Å; D160-D164 PolarHBondContact O-N 3.49Å; V162-D164 VanDerWaalsContact C-N 3.3Å; V162-D164 PolarHBondContact O-N 2.7Å; D164-R175 IonicContact OD1-CZ 3.01Å; D164-R175 IonicContact OD1-NH1 3.73Å; D164-R175 PolarHBondContact OD1-NH1 3.47Å; D164-R175 IonicContact OD1-NH2 2.85Å; D164-R175 PolarHBondContact OD1-NH2 3.39Å
165	L	98.3	Very high	98.1	Very high	81 Å²	81	41.9 Å²	41.9	42%	0.424	21%	0.214	S	C	.	.	H	α-helix	trans	-81.7	-29	178.3	-67.1	171.1	0	0	0	112.8	F114 I116 P161 V162 A163	F114-L165 HydrophobicContact CB-CD1 3.9Å; F114-L165 HydrophobicContact CD1-CB 4.12Å; F114-L165 HydrophobicContact CD1-CD1 3.94Å; F114-L165 HydrophobicContact CD2-CB 4.14Å; F114-L165 HydrophobicContact CD2-CD1 4.21Å; F114-L165 HydrophobicContact CE1-CB 3.91Å; F114-L165 HydrophobicContact CE2-CB 3.89Å; F114-L165 HydrophobicContact CG-CB 4.25Å; F114-L165 HydrophobicContact CG-CD1 3.76Å; F114-L165 HydrophobicContact CZ-CB 3.77Å; I116-L165 HydrophobicContact CD1-CD1 4.38Å; I116-L165 HydrophobicContact CG1-CD1 4.38Å; P161-L165 WeakPolarHBondContact O-CG 3.28Å; P161-L165 PolarHBondContact O-N 3.12Å; V162-L165 PolarHBondContact O-N 2.76Å; V162-L165 VanDerWaalsContact O-N 3.16Å; A163-L165 VanDerWaalsContact C-N 3.31Å; A163-L165 PolarHBondContact O-N 2.85Å
166	L	98.3	Very high	98.2	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	21%	0.211	C	C	.	.	H	α-helix	trans	-84.1	-47.1	-176.1	-160.4	75.7	0	0	0	112.1	L97 L101 V102 F114 K131 V135 L139 V162 A163 K168	L97-L166 HydrophobicContact CD1-CD2 4.46Å; L101-L166 HydrophobicContact CB-CD2 4.11Å; L101-L166 HydrophobicContact CD1-CD2 3.99Å; V102-L166 HydrophobicContact CG1-CD1 3.96Å; V102-L166 HydrophobicContact CG1-CD2 4.22Å; F114-L166 HydrophobicContact CE2-CD1 4.18Å; K131-L166 HydrophobicContact CD-CD1 4.35Å; K131-L166 HydrophobicContact CG-CD1 4.08Å; V135-L166 HydrophobicContact CG1-CD1 4.02Å; V135-L166 HydrophobicContact CG2-CD1 4.14Å; V135-L166 HydrophobicContact CG2-CD2 4.15Å; V135-L166 HydrophobicContact CG2-CG 4.37Å; L139-L166 HydrophobicContact CD1-CB 4.49Å; L139-L166 HydrophobicContact CD1-CD2 3.55Å; L139-L166 HydrophobicContact CD1-CG 3.61Å; V162-L166 VanDerWaalsContact O-CB 3.31Å; V162-L166 WeakPolarHBondContact O-CB 3.4Å; V162-L166 PolarHBondContact O-N 2.93Å; A163-L166 PolarHBondContact O-N 2.82Å; L166-K168 PolarHBondContact O-N 2.98Å
167	D	98.5	Very high	98.2	Very high	19 Å²	19	41.4 Å²	41.4	10%	0.102	21%	0.206	C	C	.	.			trans	-89.3	85	-173.3	-176	11.4	0	0	0	112.5	A163 W169 G170 A171 F172	A163-D167 WeakPolarHBondContact O-CB 3.4Å; A163-D167 PolarHBondContact O-N 3.47Å; D167-W169 VanDerWaalsContact C-N 3.26Å; D167-W169 PolarHBondContact O-N 3.18Å; D167-W169 PolarHBondContact OD1-N 3.2Å; D167-G170 WeakPolarHBondContact OD1-CA 3.17Å; D167-G170 PolarHBondContact OD1-N 3.44Å; D167-G170 VanDerWaalsContact OD2-C 3.32Å; D167-G170 WeakPolarHBondContact OD2-CA 3.35Å; D167-A171 VanDerWaalsContact CG-N 3.25Å; D167-A171 WeakPolarHBondContact OD1-CB 3.43Å; D167-A171 PolarHBondContact OD1-N 3.18Å; D167-A171 PolarHBondContact OD2-N 2.84Å; D167-F172 HydrophobicContact CB-CD2 3.75Å; D167-F172 HydrophobicContact CB-CE2 4.12Å; D167-F172 PolarHBondContact OD2-N 2.75Å
168	K	98.3	Very high	98.3	Very high	124 Å²	124	39 Å²	39	54%	0.539	20%	0.195	S	C	.	.	S	Bend	trans	-76.6	-10.8	179.2	-61	165.3	-173.9	154.7	0	113.9	D136 L166	D136-K168 IonicContact OD1-NZ 2.66Å; D136-K168 PolarHBondContact OD1-NZ 3.47Å; D136-K168 IonicContact OD2-NZ 3.67Å; D136-K168 PolarHBondContact OD2-NZ 3.48Å; L166-K168 PolarHBondContact O-N 2.98Å
169	W	98.4	Very high	98.3	Very high	99 Å²	99	45.2 Å²	45.2	38%	0.375	22%	0.224	S	C	.	.	S	Bend	trans	-116.4	-2.8	-169.8	-54.5	-88.9	0	0	0	113.4	D136 L139 Q140 D167 A171	D136-W169 HydrophobicContact CB-CH2 3.75Å; D136-W169 WeakPolarHBondContact O-CH2 3.45Å; D136-W169 WeakPolarHBondContact O-CZ3 3.39Å; L139-W169 HydrophobicContact CB-CE3 4.48Å; L139-W169 HydrophobicContact CB-CZ3 4.3Å; Q140-W169 HydrophobicContact CB-CD2 3.73Å; Q140-W169 HydrophobicContact CB-CE3 4.01Å; Q140-W169 HydrophobicContact CB-CG 4.23Å; Q140-W169 HydrophobicContact CB-CH2 4.21Å; Q140-W169 HydrophobicContact CB-CZ2 3.92Å; Q140-W169 HydrophobicContact CB-CZ3 4.25Å; Q140-W169 HydrophobicContact CG-CD2 4.01Å; Q140-W169 HydrophobicContact CG-CG 4.06Å; Q140-W169 HydrophobicContact CG-CZ2 4.37Å; D167-W169 VanDerWaalsContact C-N 3.26Å; D167-W169 PolarHBondContact O-N 3.18Å; D167-W169 PolarHBondContact OD1-N 3.2Å; W169-A171 VanDerWaalsContact C-N 3.29Å
170	G	98.2	Very high	98.3	Very high	40 Å²	40	46.3 Å²	46.3	41%	0.412	23%	0.232	S	C	.	.			trans	66.9	33.4	-172.5	0	0	0	0	0	112	D167 F172 R173	D167-G170 WeakPolarHBondContact OD1-CA 3.17Å; D167-G170 PolarHBondContact OD1-N 3.44Å; D167-G170 VanDerWaalsContact OD2-C 3.32Å; D167-G170 WeakPolarHBondContact OD2-CA 3.35Å; G170-F172 VanDerWaalsContact C-N 3.31Å; G170-F172 PolarHBondContact O-N 3.28Å; G170-R173 PolarHBondContact O-NH1 3.32Å
171	A	98.6	Very high	98.2	Very high	1 Å²	1	44.5 Å²	44.5	1%	0.008	22%	0.223	C	C	.	.			trans	-56.4	-45.7	175.6	0	0	0	0	0	110.9	L139 C148 D167 W169 R173	L139-A171 WeakPolarHBondContact O-CB 3.41Å; C148-A171 WeakPolarHBondContact CB-O 3.47Å; D167-A171 VanDerWaalsContact CG-N 3.25Å; D167-A171 WeakPolarHBondContact OD1-CB 3.43Å; D167-A171 PolarHBondContact OD1-N 3.18Å; D167-A171 PolarHBondContact OD2-N 2.84Å; W169-A171 VanDerWaalsContact C-N 3.29Å; A171-R173 PolarHBondContact O-N 3Å
172	F	98.7	Very high	98.2	Very high	17 Å²	17	44.4 Å²	44.4	8%	0.075	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	110.4	178.6	-61.6	-54.2	0	0	0	111.5	I95 L101 L139 C148 L150 D167 G170 A174	I95-F172 HydrophobicContact CB-CE1 4.2Å; I95-F172 HydrophobicContact CD1-CE1 4.23Å; L101-F172 HydrophobicContact CD1-CZ 3.91Å; L139-F172 HydrophobicContact CD1-CE2 4.32Å; L139-F172 HydrophobicContact CD1-CZ 4.37Å; L139-F172 HydrophobicContact CD2-CE1 4.19Å; L139-F172 HydrophobicContact CD2-CE2 4.34Å; L139-F172 HydrophobicContact CD2-CZ 3.68Å; C148-F172 HydrophobicContact CB-CD1 4.15Å; C148-F172 CarbonylContact O-C 3.59Å; C148-F172 WeakPolarHBondContact O-CA 3.44Å; L150-F172 HydrophobicContact CB-CB 4.48Å; L150-F172 HydrophobicContact CB-CD1 3.72Å; L150-F172 HydrophobicContact CB-CD2 4.25Å; L150-F172 HydrophobicContact CB-CE1 3.92Å; L150-F172 HydrophobicContact CB-CE2 4.42Å; L150-F172 HydrophobicContact CB-CG 3.9Å; L150-F172 HydrophobicContact CB-CZ 4.26Å; L150-F172 HydrophobicContact CD1-CE1 4.24Å; L150-F172 HydrophobicContact CD1-CE2 4.33Å; L150-F172 HydrophobicContact CD1-CZ 3.96Å; D167-F172 HydrophobicContact CB-CD2 3.75Å; D167-F172 HydrophobicContact CB-CE2 4.12Å; D167-F172 PolarHBondContact OD2-N 2.75Å; G170-F172 VanDerWaalsContact C-N 3.31Å; G170-F172 PolarHBondContact O-N 3.28Å; F172-A174 VanDerWaalsContact C-N 3.35Å
173	R	98.4	Very high	98.1	Very high	70 Å²	70	50.7 Å²	50.7	26%	0.264	25%	0.249	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.9	-26.8	176.6	-52	-49.4	-160.5	-125.8	-19.2	112.5	D87 G143 E147 C148 G170 A171	D87-R173 IonicContact OD1-CZ 3.81Å; D87-R173 IonicContact OD1-NE 2.75Å; D87-R173 PolarHBondContact OD1-NE 3.13Å; D87-R173 IonicContact OD1-NH2 3.23Å; D87-R173 PolarHBondContact OD1-NH2 2.88Å; D87-R173 IonicContact OD2-CZ 2.67Å; D87-R173 IonicContact OD2-NE 2.73Å; D87-R173 PolarHBondContact OD2-NE 2.74Å; G143-R173 PolarHBondContact O-NH2 3.2Å; E147-R173 HydrophobicContact CG-CB 4.24Å; E147-R173 HydrophobicContact CG-CG 3.9Å; C148-R173 PolarHBondContact O-N 2.93Å; G170-R173 PolarHBondContact O-NH1 3.32Å; A171-R173 PolarHBondContact O-N 3Å
174	A	98.7	Very high	97.9	Very high	25 Å²	25	53.6 Å²	53.6	21%	0.207	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	159.2	176	0	0	0	0	0	110.5	L80 V149 L150 F172	L80-A174 HydrophobicContact CD2-CB 3.6Å; V149-A174 HydrophobicContact CG1-CB 4.35Å; V149-A174 HydrophobicContact CG2-CB 4.47Å; L150-A174 PolarHBondContact N-O 3.03Å; F172-A174 VanDerWaalsContact C-N 3.35Å
175	R	98.8	Very high	97.7	Very high	72 Å²	72	59.3 Å²	59.3	27%	0.272	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	126.7	176.1	-56.6	178.9	-176.4	171.8	-0.2	109.2	L150 D160 D164 F177	L150-R175 HydrophobicContact CB-CB 4.42Å; L150-R175 HydrophobicContact CB-CG 4.18Å; L150-R175 HydrophobicContact CD2-CB 4.38Å; L150-R175 HydrophobicContact CD2-CG 4.1Å; L150-R175 CarbonylContact O-C 3.59Å; L150-R175 WeakPolarHBondContact O-CA 3.47Å; D160-R175 PolarHBondContact O-NH1 3.29Å; D160-R175 WeakPolarHBondContact OD1-CD 3.5Å; D160-R175 IonicContact OD1-CZ 3.48Å; D160-R175 IonicContact OD1-NE 3.83Å; D160-R175 IonicContact OD1-NH1 2.71Å; D160-R175 PolarHBondContact OD1-NH1 2.89Å; D164-R175 IonicContact OD1-CZ 3.01Å; D164-R175 IonicContact OD1-NH1 3.73Å; D164-R175 PolarHBondContact OD1-NH1 3.47Å; D164-R175 IonicContact OD1-NH2 2.85Å; D164-R175 PolarHBondContact OD1-NH2 3.39Å; R175-F177 HydrophobicContact CB-CE1 4.09Å; R175-F177 HydrophobicContact CB-CE2 4.12Å; R175-F177 HydrophobicContact CB-CZ 3.54Å
176	L	98.7	Very high	97.4	Very high	12 Å²	12	56.8 Å²	56.8	6%	0.063	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.7	132.4	178.3	-61.3	177	0	0	0	108.1	L79 L80 V149 L150 F151 T152 L195	L79-L176 HydrophobicContact CB-CD1 4.05Å; L79-L176 HydrophobicContact CB-CD2 4.13Å; L79-L176 HydrophobicContact CD1-CD1 4.17Å; L80-L176 HydrophobicContact CD2-CD1 4.07Å; L80-L176 HydrophobicContact CD2-CD2 4.41Å; L80-L176 HydrophobicContact CD2-CG 4.35Å; V149-L176 HydrophobicContact CG1-CD1 3.92Å; V149-L176 HydrophobicContact CG1-CG 4.1Å; L150-L176 PolarHBondContact O-N 2.89Å; F151-L176 CarbonylContact C-O 3.27Å; F151-L176 VanDerWaalsContact CA-O 3.29Å; F151-L176 WeakPolarHBondContact CA-O 3.25Å; F151-L176 HydrophobicContact CB-CB 4.16Å; F151-L176 HydrophobicContact CD1-CB 4.32Å; F151-L176 HydrophobicContact CD1-CD1 3.86Å; F151-L176 HydrophobicContact CD2-CB 3.49Å; F151-L176 VanDerWaalsContact CD2-CB 3.49Å; F151-L176 HydrophobicContact CD2-CD1 4.49Å; F151-L176 HydrophobicContact CE1-CD1 4.05Å; F151-L176 HydrophobicContact CE2-CB 3.89Å; F151-L176 HydrophobicContact CG-CB 3.74Å; F151-L176 HydrophobicContact CG-CD1 4.09Å; F151-L176 HydrophobicContact CZ-CB 4.46Å; F151-L176 HydrophobicContact CZ-CD1 4.45Å; T152-L176 PolarHBondContact N-O 3.32Å; L176-L195 HydrophobicContact CD1-CD2 3.8Å
177	F	98.2	Very high	97.2	Very high	30 Å²	30	59.4 Å²	59.4	13%	0.132	28%	0.284	C	S	.	.			trans	-115	-172.5	-175.2	-49.4	-73.5	0	0	0	110.5	T152 A156 A159 D160 R175 E179 S180	T152-F177 HydrophobicContact CG2-CD1 4.01Å; T152-F177 CarbonylContact O-C 3.56Å; T152-F177 VanDerWaalsContact O-CA 3.27Å; T152-F177 WeakPolarHBondContact O-CA 3.49Å; A156-F177 HydrophobicContact CB-CD1 3.97Å; A156-F177 HydrophobicContact CB-CD2 3.67Å; A156-F177 HydrophobicContact CB-CE1 4.06Å; A156-F177 HydrophobicContact CB-CE2 3.77Å; A156-F177 HydrophobicContact CB-CG 3.77Å; A156-F177 HydrophobicContact CB-CZ 3.96Å; A159-F177 HydrophobicContact CB-CD1 3.77Å; A159-F177 HydrophobicContact CB-CE1 3.71Å; D160-F177 VanDerWaalsContact OD1-CZ 3.31Å; D160-F177 WeakPolarHBondContact OD1-CZ 3.34Å; D160-F177 WeakPolarHBondContact OD2-CZ 3.37Å; R175-F177 HydrophobicContact CB-CE1 4.09Å; R175-F177 HydrophobicContact CB-CE2 4.12Å; R175-F177 HydrophobicContact CB-CZ 3.54Å; F177-E179 PolarHBondContact O-N 2.95Å; F177-S180 WeakPolarHBondContact O-CA 3.4Å; F177-S180 VanDerWaalsContact O-CB 3.3Å; F177-S180 WeakPolarHBondContact O-CB 3.23Å; F177-S180 PolarHBondContact O-N 3.32Å
178	R	97.2	Very high	97.1	Very high	31 Å²	31	61.1 Å²	61.1	12%	0.117	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-44.8	-41.4	179.8	-178	171.7	-67.6	162.8	4.7	114.8	A5 T8 T152 A153 S154 L155 S180 C181 Y188	A5-R178 PolarHBondContact O-NH1 2.83Å; A5-R178 PolarHBondContact O-NH2 2.62Å; T8-R178 PolarHBondContact O-NH2 3.18Å; T152-R178 PolarHBondContact O-N 3.36Å; A153-R178 PolarHBondContact O-NE 2.75Å; A153-R178 PolarHBondContact O-NH2 3.02Å; S154-R178 PolarHBondContact O-N 2.71Å; S154-R178 VanDerWaalsContact O-N 3.08Å; L155-R178 HydrophobicContact CD2-CB 4.1Å; R178-S180 PolarHBondContact O-N 3.41Å; R178-C181 VanDerWaalsContact O-CB 3.3Å; R178-C181 WeakPolarHBondContact O-CB 3.48Å; R178-C181 PolarHBondContact O-N 3.21Å; R178-Y188 HydrophobicContact CG-CD1 4.08Å; R178-Y188 HydrophobicContact CG-CE1 3.56Å
179	E	96.3	Very high	97.1	Very high	131 Å²	131	55.3 Å²	55.3	61%	0.612	26%	0.264	S	S	*	.	G	3₁₀ helix	trans	-65.4	-20.3	-177.2	-59.7	72.4	-155.4	0	0	112.4	L155 F177	L155-E179 WeakPolarHBondContact CD2-OE1 3.38Å; F177-E179 PolarHBondContact O-N 2.95Å
180	S	98	Very high	97.2	Very high	23 Å²	23	50.6 Å²	50.6	16%	0.161	25%	0.247	C	C	.	.	G	3₁₀ helix	trans	-84.6	-20.6	174.9	-58.9	0	0	0	0	112.7	F177 R178 R194	F177-S180 WeakPolarHBondContact O-CA 3.4Å; F177-S180 VanDerWaalsContact O-CB 3.3Å; F177-S180 WeakPolarHBondContact O-CB 3.23Å; F177-S180 PolarHBondContact O-N 3.32Å; R178-S180 PolarHBondContact O-N 3.41Å; S180-R194 PolarHBondContact O-NH1 2.94Å
181	C	97.7	Very high	97.2	Very high	14 Å²	14	50 Å²	50	10%	0.095	23%	0.234	C	C	.	.	S	Bend	trans	-68.3	155.6	175.1	-59.9	0	0	0	0	111.7	F151 R178 Y188 V189	F151-C181 VanDerWaalsContact CE2-SG 3.5Å; R178-C181 VanDerWaalsContact O-CB 3.3Å; R178-C181 WeakPolarHBondContact O-CB 3.48Å; R178-C181 PolarHBondContact O-N 3.21Å; C181-Y188 HydrophobicContact CB-CD1 3.83Å; C181-Y188 HydrophobicContact CB-CG 4.35Å; C181-V189 WeakPolarHBondContact CA-O 3.24Å
182	V	97.2	Very high	97.2	Very high	41 Å²	41	49.9 Å²	49.9	25%	0.248	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.9	123.3	168.4	179	0	0	0	0	108.3	H184 V189 D191	V182-H184 HydrophobicContact CG1-CB 4.49Å; V182-H184 PolarHBondContact O-N 3.19Å; V182-V189 PolarHBondContact N-O 2.95Å; V182-V189 PolarHBondContact O-N 3.38Å; V182-D191 HydrophobicContact CG2-CB 3.96Å
183	F	95.7	Very high	97.1	Very high	133 Å²	133	52 Å²	52	58%	0.583	25%	0.25	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.2	105.1	173.6	-167.7	-110.8	0	0	0	109.9	G186 N187 Y188	F183-G186 WeakPolarHBondContact CE2-O 3.41Å; F183-N187 WeakPolarHBondContact CA-O 3.21Å; F183-Y188 HydrophobicContact CD2-CD1 4.09Å; F183-Y188 AromaticContact CD2-CE1 3.9Å; F183-Y188 HydrophobicContact CD2-CE1 3.9Å; F183-Y188 HydrophobicContact CD2-CE2 4.37Å; F183-Y188 HydrophobicContact CD2-CG 4.41Å; F183-Y188 HydrophobicContact CE2-CE2 4.41Å
184	H	94.9	Very high	97.1	Very high	61 Å²	61	52.9 Å²	52.9	28%	0.282	25%	0.253	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	120.5	-174.9	-176.8	79.4	0	0	0	110.8	V182 G186 N187 V189 F214	V182-H184 HydrophobicContact CG1-CB 4.49Å; V182-H184 PolarHBondContact O-N 3.19Å; H184-G186 PolarHBondContact O-N 2.83Å; H184-N187 PolarHBondContact N-O 3.2Å; H184-N187 PolarHBondContact O-N 3.22Å; H184-V189 HydrophobicContact CB-CG2 3.79Å; H184-F214 HydrophobicContact CB-CZ 4.08Å; H184-F214 AromaticContact CD2-CE1 3.86Å; H184-F214 AromaticContact CD2-CZ 3.88Å; H184-F214 AromaticContact CG-CZ 3.65Å; H184-F214 AromaticContact ND1-CZ 3.77Å; H184-F214 AromaticContact NE2-CE1 3.89Å
185	R	94.5	Very high	97.1	Very high	221 Å²	221	51.7 Å²	51.7	83%	0.834	24%	0.244	S	C	*	.	T	Hydrogen-bonded Turn	trans	49.1	43.3	177.4	-63.1	179.7	175.6	-174.5	-0	113.4	N187	R185-N187 VanDerWaalsContact C-N 3.32Å; R185-N187 PolarHBondContact O-N 3Å; R185-N187 PolarHBondContact O-ND2 3.16Å
186	G	92.7	Very high	97.1	Very high	29 Å²	29	49.4 Å²	49.4	30%	0.299	24%	0.243	S	C	.	.	T	Hydrogen-bonded Turn	trans	86.4	-7.2	178.1	0	0	0	0	0	115.5	F183 H184	F183-G186 WeakPolarHBondContact CE2-O 3.41Å; H184-G186 PolarHBondContact O-N 2.83Å
187	N	93.6	Very high	97	Very high	54 Å²	54	51 Å²	51	29%	0.289	25%	0.248	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.8	153.3	-177.8	-58.5	-70.1	0	0	0	111.5	F183 H184 R185 A210	F183-N187 WeakPolarHBondContact CA-O 3.21Å; H184-N187 PolarHBondContact N-O 3.2Å; H184-N187 PolarHBondContact O-N 3.22Å; R185-N187 VanDerWaalsContact C-N 3.32Å; R185-N187 PolarHBondContact O-N 3Å; R185-N187 PolarHBondContact O-ND2 3.16Å; N187-A210 HydrophobicContact CB-CB 4.23Å
188	Y	97.4	Very high	97	Very high	56 Å²	56	53 Å²	53	22%	0.22	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	114.5	168.6	-71.5	-76.8	0	0	0	109.4	Q9 A153 R178 C181 F183	Q9-Y188 HydrophobicContact CG-CD2 4.47Å; A153-Y188 HydrophobicContact CB-CD2 4.33Å; A153-Y188 HydrophobicContact CB-CG 4.14Å; R178-Y188 HydrophobicContact CG-CD1 4.08Å; R178-Y188 HydrophobicContact CG-CE1 3.56Å; C181-Y188 HydrophobicContact CB-CD1 3.83Å; C181-Y188 HydrophobicContact CB-CG 4.35Å; F183-Y188 HydrophobicContact CD2-CD1 4.09Å; F183-Y188 AromaticContact CD2-CE1 3.9Å; F183-Y188 HydrophobicContact CD2-CE1 3.9Å; F183-Y188 HydrophobicContact CD2-CE2 4.37Å; F183-Y188 HydrophobicContact CD2-CG 4.41Å; F183-Y188 HydrophobicContact CE2-CE2 4.41Å
189	V	98.2	Very high	97.1	Very high	1 Å²	1	53.8 Å²	53.8	1%	0.006	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	131.5	-178.1	-178.3	0	0	0	0	110	C181 V182 H184 D191 S211 V213 F214	C181-V189 WeakPolarHBondContact CA-O 3.24Å; V182-V189 PolarHBondContact N-O 2.95Å; V182-V189 PolarHBondContact O-N 3.38Å; H184-V189 HydrophobicContact CB-CG2 3.79Å; V189-D191 PolarHBondContact O-N 2.95Å; V189-S211 CarbonylContact C-O 3.59Å; V189-S211 WeakPolarHBondContact CA-O 3.48Å; V189-V213 HydrophobicContact CB-CG1 4.47Å; V189-V213 HydrophobicContact CG1-CG1 3.86Å; V189-V213 HydrophobicContact CG2-CG1 3.69Å; V189-F214 HydrophobicContact CB-CE2 4.36Å; V189-F214 HydrophobicContact CG1-CD2 3.6Å; V189-F214 HydrophobicContact CG1-CE2 3.79Å; V189-F214 HydrophobicContact CG1-CG 4.03Å; V189-F214 HydrophobicContact CG1-CZ 4.37Å
190	K	98.6	Very high	97.2	Very high	0 Å²	0	53.7 Å²	53.7	0%	0	26%	0.26	C	S	.	.			trans	-89.1	83.2	174.9	-61	176.5	-172.3	176	0	108.4	V94 D96 F151 L192 I204 D206 S211	V94-K190 HydrophobicContact CG1-CD 4.45Å; D96-K190 VanDerWaalsContact CB-NZ 3.26Å; D96-K190 IonicContact OD1-NZ 3.46Å; D96-K190 PolarHBondContact OD1-NZ 3.31Å; F151-K190 HydrophobicContact CB-CD 4.24Å; F151-K190 HydrophobicContact CD1-CB 3.9Å; F151-K190 HydrophobicContact CD1-CD 4.16Å; F151-K190 HydrophobicContact CD1-CG 3.98Å; F151-K190 HydrophobicContact CD2-CD 4.32Å; F151-K190 HydrophobicContact CD2-CG 4.15Å; F151-K190 HydrophobicContact CE1-CB 3.71Å; F151-K190 HydrophobicContact CE1-CG 3.99Å; F151-K190 HydrophobicContact CE2-CG 4.16Å; F151-K190 HydrophobicContact CG-CB 4.49Å; F151-K190 HydrophobicContact CG-CD 3.98Å; F151-K190 HydrophobicContact CG-CG 4.06Å; F151-K190 HydrophobicContact CZ-CB 4.16Å; F151-K190 HydrophobicContact CZ-CG 4.08Å; F151-K190 WeakPolarHBondContact O-CE 3.24Å; F151-K190 PolarHBondContact O-NZ 2.83Å; K190-L192 PolarHBondContact O-N 3.02Å; K190-I204 HydrophobicContact CB-CD1 3.96Å; K190-I204 HydrophobicContact CD-CD1 3.8Å; K190-D206 WeakPolarHBondContact CD-OD2 3.06Å; K190-D206 WeakPolarHBondContact CE-OD2 3.24Å; K190-D206 IonicContact NZ-OD2 3.97Å; K190-D206 PolarHBondContact NZ-OD2 3.18Å; K190-S211 PolarHBondContact N-O 2.9Å
191	D	98.3	Very high	97.2	Very high	27 Å²	27	55.4 Å²	55.4	14%	0.144	26%	0.263	C	S	.	.			trans	-70	98.6	179.8	-176.8	2.6	0	0	0	111.1	V182 V189 S193 R194 F214 H215	V182-D191 HydrophobicContact CG2-CB 3.96Å; V189-D191 PolarHBondContact O-N 2.95Å; D191-S193 VanDerWaalsContact CG-OG 3.24Å; D191-S193 PolarHBondContact O-N 2.98Å; D191-S193 WeakPolarHBondContact OD1-CB 3.45Å; D191-S193 PolarHBondContact OD1-N 3.12Å; D191-S193 VanDerWaalsContact OD1-N 3.16Å; D191-S193 PolarHBondContact OD1-OG 3.32Å; D191-S193 PolarHBondContact OD2-OG 3.5Å; D191-R194 HydrophobicContact CB-CG 4.16Å; D191-R194 WeakPolarHBondContact O-CB 3.49Å; D191-R194 PolarHBondContact O-N 3.28Å; D191-R194 VanDerWaalsContact O-N 3.09Å; D191-F214 HydrophobicContact CB-CD2 4.09Å; D191-H215 IonicContact OD1-CD2 3.84Å; D191-H215 IonicContact OD1-CE1 2.76Å; D191-H215 IonicContact OD1-NE2 3.09Å; D191-H215 PolarHBondContact OD1-NE2 2.73Å
192	L	98.7	Very high	97.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	26%	0.259	C	S	.	.	G	3₁₀ helix	trans	-62.7	-23.8	-175.9	-52.1	-176.3	0	0	0	112.9	V94 K190 R194 L195 L199 V202 I204 H215 N218	V94-L192 HydrophobicContact CB-CD2 4.4Å; V94-L192 HydrophobicContact CG2-CD2 4.01Å; K190-L192 PolarHBondContact O-N 3.02Å; L192-R194 PolarHBondContact O-N 2.99Å; L192-R194 VanDerWaalsContact O-N 3.15Å; L192-L195 HydrophobicContact CB-CD1 4.08Å; L192-L195 HydrophobicContact CD2-CD1 3.98Å; L192-L195 WeakPolarHBondContact O-CB 3.28Å; L192-L195 VanDerWaalsContact O-CG 3.3Å; L192-L195 WeakPolarHBondContact O-CG 3.44Å; L192-L195 PolarHBondContact O-N 3.35Å; L192-L195 VanDerWaalsContact O-N 3.11Å; L192-L199 HydrophobicContact CB-CD2 3.78Å; L192-V202 HydrophobicContact CB-CG1 4.26Å; L192-V202 HydrophobicContact CD1-CG1 3.93Å; L192-V202 HydrophobicContact CD2-CG1 4.45Å; L192-V202 HydrophobicContact CG-CG1 4.45Å; L192-I204 HydrophobicContact CD1-CB 4.17Å; L192-I204 HydrophobicContact CD1-CG2 3.92Å; L192-I204 HydrophobicContact CD2-CB 4.27Å; L192-I204 HydrophobicContact CD2-CD1 4.08Å; L192-H215 HydrophobicContact CB-CB 4.44Å; L192-H215 HydrophobicContact CD1-CB 3.55Å; L192-H215 HydrophobicContact CG-CB 3.99Å; L192-H215 PolarHBondContact N-CD2 2.98Å; L192-H215 VanDerWaalsContact N-CD2 3.31Å; L192-H215 PolarHBondContact N-NE2 2.64Å; L192-N218 HydrophobicContact CD1-CB 3.68Å
193	S	98	Very high	97.4	Very high	61 Å²	61	52.8 Å²	52.8	43%	0.427	25%	0.247	S	C	.	.	G	3₁₀ helix	trans	-63.7	-20.4	176.7	73	0	0	0	0	112.7	D191 L195 H215	D191-S193 VanDerWaalsContact CG-OG 3.24Å; D191-S193 PolarHBondContact O-N 2.98Å; D191-S193 WeakPolarHBondContact OD1-CB 3.45Å; D191-S193 PolarHBondContact OD1-N 3.12Å; D191-S193 VanDerWaalsContact OD1-N 3.16Å; D191-S193 PolarHBondContact OD1-OG 3.32Å; D191-S193 PolarHBondContact OD2-OG 3.5Å; S193-L195 VanDerWaalsContact C-N 3.35Å; S193-H215 PolarHBondContact N-NE2 2.54Å
194	R	98.2	Very high	97.5	Very high	88 Å²	88	46.4 Å²	46.4	33%	0.332	22%	0.219	S	C	.	.	G	3₁₀ helix	trans	-85	-5.7	179.1	-59	179.4	64.3	-158.5	-3.8	113.3	Y78 L79 S180 D191 L192 G196	Y78-R194 CarbonylContact C-O 3.6Å; Y78-R194 WeakPolarHBondContact CA-O 3.41Å; L79-R194 HydrophobicContact CD1-CB 3.76Å; L79-R194 HydrophobicContact CG-CB 3.96Å; L79-R194 WeakPolarHBondContact CG-O 3.4Å; L79-R194 PolarHBondContact N-O 2.88Å; S180-R194 PolarHBondContact O-NH1 2.94Å; D191-R194 HydrophobicContact CB-CG 4.16Å; D191-R194 WeakPolarHBondContact O-CB 3.49Å; D191-R194 PolarHBondContact O-N 3.28Å; D191-R194 VanDerWaalsContact O-N 3.09Å; L192-R194 PolarHBondContact O-N 2.99Å; L192-R194 VanDerWaalsContact O-N 3.15Å; R194-G196 VanDerWaalsContact C-N 3.34Å; R194-G196 PolarHBondContact O-N 3.08Å
195	L	98.5	Very high	97.7	Very high	0 Å²	0	43.5 Å²	43.5	0%	0	21%	0.206	C	C	.	.	G	3₁₀ helix	trans	-71.7	-27	-176.7	-63.7	172	0	0	0	113.4	L79 L80 V94 F151 L176 L192 S193 R197 V202	L79-L195 HydrophobicContact CD1-CD2 4.41Å; L80-L195 VanDerWaalsContact CB-O 3.27Å; L80-L195 WeakPolarHBondContact CB-O 3.09Å; L80-L195 HydrophobicContact CD1-CB 4.13Å; L80-L195 HydrophobicContact CD1-CD2 4.16Å; L80-L195 HydrophobicContact CG-CD2 4.29Å; L80-L195 PolarHBondContact N-O 2.85Å; V94-L195 HydrophobicContact CG2-CD1 3.6Å; V94-L195 HydrophobicContact CG2-CD2 4.32Å; F151-L195 HydrophobicContact CD1-CD2 4.49Å; L176-L195 HydrophobicContact CD1-CD2 3.8Å; L192-L195 HydrophobicContact CB-CD1 4.08Å; L192-L195 HydrophobicContact CD2-CD1 3.98Å; L192-L195 WeakPolarHBondContact O-CB 3.28Å; L192-L195 VanDerWaalsContact O-CG 3.3Å; L192-L195 WeakPolarHBondContact O-CG 3.44Å; L192-L195 PolarHBondContact O-N 3.35Å; L192-L195 VanDerWaalsContact O-N 3.11Å; S193-L195 VanDerWaalsContact C-N 3.35Å; L195-R197 HydrophobicContact CB-CG 4.38Å; L195-V202 HydrophobicContact CD1-CG1 3.87Å
196	G	97.8	Very high	97.9	Very high	25 Å²	25	33 Å²	33	26%	0.258	17%	0.166	S	C	.	.	S	Bend	trans	75.3	38.9	-170.6	0	0	0	0	0	112.1	Y78 R194	Y78-G196 VanDerWaalsContact CD1-N 3.25Å; R194-G196 VanDerWaalsContact C-N 3.34Å; R194-G196 PolarHBondContact O-N 3.08Å
197	R	98.3	Very high	98.2	Very high	46 Å²	46	33 Å²	33	17%	0.174	16%	0.159	C	C	.	.	S	Bend	trans	-130.8	152.2	174.6	-62.8	-65	179.4	-86.9	0.2	108.9	L80 P81 C92 E147 L195 L199 V202	L80-R197 HydrophobicContact CD1-CG 4.35Å; P81-R197 PolarHBondContact O-NH1 2.66Å; P81-R197 PolarHBondContact O-NH2 3.16Å; C92-R197 HydrophobicContact CB-CB 4.47Å; C92-R197 HydrophobicContact CB-CG 3.99Å; E147-R197 IonicContact OE1-CZ 3.11Å; E147-R197 IonicContact OE1-NE 3.17Å; E147-R197 PolarHBondContact OE1-NE 2.65Å; E147-R197 IonicContact OE1-NH2 2.7Å; E147-R197 PolarHBondContact OE1-NH2 3.45Å; E147-R197 IonicContact OE2-CZ 3.59Å; E147-R197 IonicContact OE2-NE 2.75Å; E147-R197 PolarHBondContact OE2-NE 3.49Å; E147-R197 IonicContact OE2-NH2 3.59Å; L195-R197 HydrophobicContact CB-CG 4.38Å; R197-L199 PolarHBondContact O-N 3.18Å; R197-V202 HydrophobicContact CB-CG2 3.49Å; R197-V202 VanDerWaalsContact CB-CG2 3.49Å; R197-V202 HydrophobicContact CG-CG2 4.46Å
198	D	98.1	Very high	98.4	Very high	72 Å²	72	31.8 Å²	31.8	39%	0.385	16%	0.155	S	C	.	.			trans	-66.5	122.4	172.9	-174.5	-24	0	0	0	109.5	R200 R201 V202	D198-R200 PolarHBondContact O-N 3.46Å; D198-R200 VanDerWaalsContact O-N 3.13Å; D198-R200 WeakPolarHBondContact OD1-CB 3.49Å; D198-R200 IonicContact OD1-CZ 4Å; D198-R200 PolarHBondContact OD1-N 3.41Å; D198-R200 IonicContact OD1-NE 3.61Å; D198-R200 PolarHBondContact OD1-NE 3.23Å; D198-R200 VanDerWaalsContact OD1-NE 3.11Å; D198-R200 IonicContact OD1-NH2 4Å; D198-R200 IonicContact OD2-CZ 3.26Å; D198-R200 VanDerWaalsContact OD2-CZ 3.26Å; D198-R200 IonicContact OD2-NE 2.75Å; D198-R200 PolarHBondContact OD2-NE 3.35Å; D198-R200 VanDerWaalsContact OD2-NE 3.09Å; D198-R200 IonicContact OD2-NH2 2.66Å; D198-R200 PolarHBondContact OD2-NH2 2.95Å; D198-R201 CarbonylContact O-C 3.58Å; D198-R201 WeakPolarHBondContact O-CA 3.46Å; D198-R201 PolarHBondContact O-N 3.19Å; D198-V202 WeakPolarHBondContact O-CG2 3.31Å; D198-V202 PolarHBondContact O-N 2.92Å
199	L	98.5	Very high	98.4	Very high	47 Å²	47	33.2 Å²	33.2	25%	0.246	17%	0.171	C	C	.	.	G	3₁₀ helix	trans	-61.7	-21.6	-177.5	-67.9	179.6	0	0	0	113.7	L192 R197 R201 V202 N218 Y251	L192-L199 HydrophobicContact CB-CD2 3.78Å; R197-L199 PolarHBondContact O-N 3.18Å; L199-R201 PolarHBondContact O-N 3.43Å; L199-V202 HydrophobicContact CD2-CB 4.47Å; L199-V202 PolarHBondContact O-N 3.39Å; L199-N218 PolarHBondContact O-ND2 3.15Å; L199-Y251 PolarHBondContact O-OH 2.87Å
200	R	98.4	Very high	98.3	Very high	129 Å²	129	34.6 Å²	34.6	49%	0.487	18%	0.182	S	C	.	.	G	3₁₀ helix	trans	-66.7	-16.6	170.6	-62.9	174.5	-67.4	174.4	1.8	112.7	D198 D249 V250 Y251	D198-R200 PolarHBondContact O-N 3.46Å; D198-R200 VanDerWaalsContact O-N 3.13Å; D198-R200 WeakPolarHBondContact OD1-CB 3.49Å; D198-R200 IonicContact OD1-CZ 4Å; D198-R200 PolarHBondContact OD1-N 3.41Å; D198-R200 IonicContact OD1-NE 3.61Å; D198-R200 PolarHBondContact OD1-NE 3.23Å; D198-R200 VanDerWaalsContact OD1-NE 3.11Å; D198-R200 IonicContact OD1-NH2 4Å; D198-R200 IonicContact OD2-CZ 3.26Å; D198-R200 VanDerWaalsContact OD2-CZ 3.26Å; D198-R200 IonicContact OD2-NE 2.75Å; D198-R200 PolarHBondContact OD2-NE 3.35Å; D198-R200 VanDerWaalsContact OD2-NE 3.09Å; D198-R200 IonicContact OD2-NH2 2.66Å; D198-R200 PolarHBondContact OD2-NH2 2.95Å; R200-D249 HydrophobicContact CB-CB 4.3Å; R200-D249 WeakPolarHBondContact O-CA 3.37Å; R200-V250 WeakPolarHBondContact O-CG1 3.31Å; R200-V250 WeakPolarHBondContact O-CG2 3.34Å; R200-V250 PolarHBondContact O-N 3.34Å; R200-Y251 HydrophobicContact CG-CD2 4.13Å; R200-Y251 HydrophobicContact CG-CE2 4Å
201	R	98.6	Very high	98.3	Very high	58 Å²	58	34.6 Å²	34.6	22%	0.219	18%	0.182	C	C	.	.	G	3₁₀ helix	trans	-122.7	30.1	179.7	-54.8	-166	65.6	67.8	-5.1	112	D89 I91 C92 D198 L199 V247 D248	D89-R201 PolarHBondContact O-NH2 3.16Å; I91-R201 WeakPolarHBondContact CA-O 3.42Å; I91-R201 HydrophobicContact CG1-CB 4.11Å; I91-R201 WeakPolarHBondContact CG2-O 3.38Å; C92-R201 PolarHBondContact N-O 3.05Å; D198-R201 CarbonylContact O-C 3.58Å; D198-R201 WeakPolarHBondContact O-CA 3.46Å; D198-R201 PolarHBondContact O-N 3.19Å; L199-R201 PolarHBondContact O-N 3.43Å; R201-V247 PolarHBondContact NH1-O 2.82Å; R201-D248 PolarHBondContact NH1-O 3.41Å
202	V	98.8	Very high	98.3	Very high	0 Å²	0	34.1 Å²	34.1	0%	0	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	135.3	173.6	176.9	0	0	0	0	110	C92 L192 L195 R197 D198 L199 N218	C92-V202 HydrophobicContact CB-CG2 4.27Å; C92-V202 CarbonylContact O-C 3.56Å; C92-V202 VanDerWaalsContact O-CA 3.3Å; C92-V202 WeakPolarHBondContact O-CA 3.47Å; L192-V202 HydrophobicContact CB-CG1 4.26Å; L192-V202 HydrophobicContact CD1-CG1 3.93Å; L192-V202 HydrophobicContact CD2-CG1 4.45Å; L192-V202 HydrophobicContact CG-CG1 4.45Å; L195-V202 HydrophobicContact CD1-CG1 3.87Å; R197-V202 HydrophobicContact CB-CG2 3.49Å; R197-V202 VanDerWaalsContact CB-CG2 3.49Å; R197-V202 HydrophobicContact CG-CG2 4.46Å; D198-V202 WeakPolarHBondContact O-CG2 3.31Å; D198-V202 PolarHBondContact O-N 2.92Å; L199-V202 HydrophobicContact CD2-CB 4.47Å; L199-V202 PolarHBondContact O-N 3.39Å; V202-N218 PolarHBondContact O-ND2 3.06Å
203	L	98.9	Very high	98.3	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	156.1	168.9	-63.9	169.4	0	0	0	110	I91 C92 V93 V94 F146 N218 V220 F241 L244 V250 L254	I91-L203 HydrophobicContact CG2-CD1 3.9Å; I91-L203 HydrophobicContact CG2-CG 3.94Å; C92-L203 PolarHBondContact O-N 2.89Å; V93-L203 HydrophobicContact CG1-CB 4.23Å; V93-L203 HydrophobicContact CG2-CB 4.16Å; V93-L203 HydrophobicContact CG2-CD1 4.12Å; V94-L203 PolarHBondContact N-O 3.21Å; F146-L203 HydrophobicContact CE1-CD1 4.3Å; L203-N218 CarbonylContact C-O 3.54Å; L203-N218 WeakPolarHBondContact CA-O 3.26Å; L203-V220 HydrophobicContact CD2-CG2 4.4Å; L203-F241 HydrophobicContact CD1-CD1 4.38Å; L203-F241 HydrophobicContact CD1-CE1 4.24Å; L203-L244 HydrophobicContact CD1-CB 4.03Å; L203-L244 HydrophobicContact CD1-CD1 3.82Å; L203-L244 HydrophobicContact CD1-CG 4.42Å; L203-L244 HydrophobicContact CD2-CD1 4.26Å; L203-V250 HydrophobicContact CD1-CG1 4.37Å; L203-V250 HydrophobicContact CD2-CB 3.8Å; L203-V250 HydrophobicContact CD2-CG1 3.64Å; L203-V250 HydrophobicContact CD2-CG2 4.23Å; L203-V250 HydrophobicContact CG-CG1 3.88Å; L203-L254 HydrophobicContact CD2-CD1 3.57Å; L203-L254 HydrophobicContact CD2-CG 4.49Å
204	I	98.9	Very high	98.3	Very high	0 Å²	0	38.8 Å²	38.8	0%	0	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	129.9	167.2	179.7	159.9	0	0	0	110.5	V94 K190 L192 D206 Y212 N218 A219 V220	V94-I204 HydrophobicContact CB-CB 4.25Å; V94-I204 HydrophobicContact CB-CG1 4.25Å; V94-I204 HydrophobicContact CG1-CD1 4.04Å; V94-I204 HydrophobicContact CG1-CG1 4.11Å; V94-I204 CarbonylContact O-C 3.6Å; V94-I204 WeakPolarHBondContact O-CA 3.38Å; K190-I204 HydrophobicContact CB-CD1 3.96Å; K190-I204 HydrophobicContact CD-CD1 3.8Å; L192-I204 HydrophobicContact CD1-CB 4.17Å; L192-I204 HydrophobicContact CD1-CG2 3.92Å; L192-I204 HydrophobicContact CD2-CB 4.27Å; L192-I204 HydrophobicContact CD2-CD1 4.08Å; I204-D206 HydrophobicContact CD1-CB 4.28Å; I204-D206 HydrophobicContact CG1-CB 3.98Å; I204-Y212 HydrophobicContact CD1-CD1 4.43Å; I204-Y212 HydrophobicContact CG1-CD1 4.48Å; I204-Y212 HydrophobicContact CG2-CD1 4.3Å; I204-Y212 HydrophobicContact CG2-CG 4.18Å; I204-N218 HydrophobicContact CG2-CB 4.49Å; I204-N218 PolarHBondContact N-O 2.89Å; I204-A219 HydrophobicContact CG2-CB 3.86Å; I204-A219 CarbonylContact O-C 3.58Å; I204-A219 WeakPolarHBondContact O-CA 3.41Å; I204-V220 PolarHBondContact O-N 3.08Å
205	L	98.9	Very high	98.3	Very high	0 Å²	0	35.6 Å²	35.6	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	110.6	170.4	179.4	65.6	0	0	0	108.2	V94 I95 D96 T100 F138 V220 V222 L237 F241	V94-L205 PolarHBondContact O-N 3.15Å; I95-L205 HydrophobicContact CG2-CD2 4.36Å; D96-L205 WeakPolarHBondContact CB-O 3.45Å; D96-L205 PolarHBondContact N-O 3.04Å; T100-L205 HydrophobicContact CG2-CD2 4.46Å; T100-L205 HydrophobicContact CG2-CG 4.22Å; F138-L205 HydrophobicContact CE1-CD2 3.86Å; F138-L205 HydrophobicContact CE2-CD2 4.45Å; F138-L205 HydrophobicContact CZ-CD2 3.44Å; F138-L205 VanDerWaalsContact CZ-CD2 3.44Å; L205-V220 HydrophobicContact CD1-CB 4.39Å; L205-V220 HydrophobicContact CD1-CG1 4.31Å; L205-V220 VanDerWaalsContact CD1-O 3.28Å; L205-V220 WeakPolarHBondContact CD1-O 3.44Å; L205-V222 HydrophobicContact CD1-CB 3.65Å; L205-V222 HydrophobicContact CD1-CG1 3.66Å; L205-V222 HydrophobicContact CD1-CG2 4.39Å; L205-V222 HydrophobicContact CG-CG1 4.17Å; L205-L237 HydrophobicContact CD1-CD1 4.07Å; L205-F241 HydrophobicContact CB-CZ 4.21Å; L205-F241 HydrophobicContact CD1-CE2 4.36Å; L205-F241 HydrophobicContact CD1-CZ 4.16Å; L205-F241 HydrophobicContact CD2-CE2 4.12Å; L205-F241 HydrophobicContact CD2-CZ 4.08Å; L205-F241 HydrophobicContact CG-CZ 4.4Å
206	D	98.8	Very high	98.2	Very high	0 Å²	0	39.3 Å²	39.3	0%	0	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	137.6	-173.7	-165.1	-57.1	0	0	0	109	D96 K190 I204 S208 S211 Y212	D96-D206 HydrophobicContact CB-CB 4.07Å; K190-D206 WeakPolarHBondContact CD-OD2 3.06Å; K190-D206 WeakPolarHBondContact CE-OD2 3.24Å; K190-D206 IonicContact NZ-OD2 3.97Å; K190-D206 PolarHBondContact NZ-OD2 3.18Å; I204-D206 HydrophobicContact CD1-CB 4.28Å; I204-D206 HydrophobicContact CG1-CB 3.98Å; D206-S208 VanDerWaalsContact C-N 3.28Å; D206-S208 PolarHBondContact O-N 3.22Å; D206-S208 WeakPolarHBondContact OD1-CB 3.34Å; D206-S208 PolarHBondContact OD1-N 3.1Å; D206-S211 VanDerWaalsContact CG-CB 3.42Å; D206-S211 WeakPolarHBondContact OD1-CB 3.43Å; D206-S211 PolarHBondContact OD1-OG 3.45Å; D206-S211 VanDerWaalsContact OD1-OG 3.08Å; D206-S211 WeakPolarHBondContact OD2-CB 3.2Å; D206-S211 PolarHBondContact OD2-OG 3.49Å; D206-Y212 HydrophobicContact CB-CD1 3.85Å; D206-Y212 HydrophobicContact CB-CE1 3.97Å
207	N	98.4	Very high	98.3	Very high	28 Å²	28	41.3 Å²	41.3	15%	0.15	22%	0.215	C	C	.	.	S	Bend	trans	-76.9	-15.2	-179.4	70.3	-52.5	0	0	0	113.3	D96 D98 E99 T100 P209 V222 S224	D96-N207 PolarHBondContact OD2-OD1 2.76Å; D98-N207 PolarHBondContact O-OD1 3.24Å; E99-N207 VanDerWaalsContact CB-ND2 3.28Å; E99-N207 WeakPolarHBondContact CB-ND2 3.49Å; T100-N207 PolarHBondContact OG1-N 3.47Å; T100-N207 PolarHBondContact OG1-OD1 3.04Å; N207-P209 WeakPolarHBondContact O-CD 3.25Å; N207-V222 VanDerWaalsContact CA-O 3.31Å; N207-V222 WeakPolarHBondContact CA-O 3.17Å; N207-V222 HydrophobicContact CB-CG1 4.2Å; N207-S224 PolarHBondContact ND2-OG 2.71Å
208	S	97.5	Very high	98.3	Very high	30 Å²	30	39.2 Å²	39.2	21%	0.21	21%	0.208	C	C	.	.			trans	-108.5	109.8	-177.1	178	0	0	0	0	111.6	D206 A210 S211 Y212	D206-S208 VanDerWaalsContact C-N 3.28Å; D206-S208 PolarHBondContact O-N 3.22Å; D206-S208 WeakPolarHBondContact OD1-CB 3.34Å; D206-S208 PolarHBondContact OD1-N 3.1Å; S208-A210 PolarHBondContact O-N 3.48Å; S208-S211 VanDerWaalsContact O-CB 3.24Å; S208-S211 WeakPolarHBondContact O-CB 3.23Å; S208-S211 PolarHBondContact O-N 3.45Å; S208-S211 PolarHBondContact O-OG 2.87Å; S208-Y212 WeakPolarHBondContact O-CE1 3.49Å
209	P	97.8	Very high	98.3	Very high	85 Å²	85	36.3 Å²	36.3	55%	0.552	19%	0.194	S	C	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-23.7	175	-26.1	34.1	0	0	0	115.5	N207 S211 Y212 V213	N207-P209 WeakPolarHBondContact O-CD 3.25Å; P209-S211 VanDerWaalsContact C-N 3.28Å; P209-S211 PolarHBondContact O-N 2.83Å; P209-Y212 HydrophobicContact CB-CE2 4.07Å; P209-Y212 PolarHBondContact O-N 3.44Å; P209-V213 PolarHBondContact O-N 2.92Å
210	A	97.2	Very high	98.3	Very high	30 Å²	30	34.2 Å²	34.2	25%	0.248	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-31.6	174.6	0	0	0	0	0	112.1	N187 S208 Y212 V213	N187-A210 HydrophobicContact CB-CB 4.23Å; S208-A210 PolarHBondContact O-N 3.48Å; A210-Y212 VanDerWaalsContact C-N 3.26Å; A210-Y212 PolarHBondContact O-N 2.98Å; A210-V213 PolarHBondContact O-N 2.86Å
211	S	98	Very high	98.3	Very high	0 Å²	0	31 Å²	31	0%	0	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.5	-31.9	-179.5	-61.7	0	0	0	0	112.5	Q9 V189 K190 D206 S208 P209	Q9-S211 PolarHBondContact NE2-OG 3.46Å; Q9-S211 VanDerWaalsContact NE2-OG 3.09Å; V189-S211 CarbonylContact C-O 3.59Å; V189-S211 WeakPolarHBondContact CA-O 3.48Å; K190-S211 PolarHBondContact N-O 2.9Å; D206-S211 VanDerWaalsContact CG-CB 3.42Å; D206-S211 WeakPolarHBondContact OD1-CB 3.43Å; D206-S211 PolarHBondContact OD1-OG 3.45Å; D206-S211 VanDerWaalsContact OD1-OG 3.08Å; D206-S211 WeakPolarHBondContact OD2-CB 3.2Å; D206-S211 PolarHBondContact OD2-OG 3.49Å; S208-S211 VanDerWaalsContact O-CB 3.24Å; S208-S211 WeakPolarHBondContact O-CB 3.23Å; S208-S211 PolarHBondContact O-N 3.45Å; S208-S211 PolarHBondContact O-OG 2.87Å; P209-S211 VanDerWaalsContact C-N 3.28Å; P209-S211 PolarHBondContact O-N 2.83Å
212	Y	98.2	Very high	98.3	Very high	18 Å²	18	28.8 Å²	28.8	7%	0.071	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-116	26.2	-177.8	52	-103.6	0	0	0	113.3	I204 D206 S208 P209 A210 F214 H215 A219	I204-Y212 HydrophobicContact CD1-CD1 4.43Å; I204-Y212 HydrophobicContact CG1-CD1 4.48Å; I204-Y212 HydrophobicContact CG2-CD1 4.3Å; I204-Y212 HydrophobicContact CG2-CG 4.18Å; D206-Y212 HydrophobicContact CB-CD1 3.85Å; D206-Y212 HydrophobicContact CB-CE1 3.97Å; S208-Y212 WeakPolarHBondContact O-CE1 3.49Å; P209-Y212 HydrophobicContact CB-CE2 4.07Å; P209-Y212 PolarHBondContact O-N 3.44Å; A210-Y212 VanDerWaalsContact C-N 3.26Å; A210-Y212 PolarHBondContact O-N 2.98Å; Y212-F214 PolarHBondContact O-N 3.17Å; Y212-H215 CarbonylContact O-C 3.54Å; Y212-H215 VanDerWaalsContact O-C 3.27Å; Y212-H215 PolarHBondContact O-N 2.67Å; Y212-A219 HydrophobicContact CD1-CB 4.07Å; Y212-A219 HydrophobicContact CD2-CB 3.53Å; Y212-A219 HydrophobicContact CE1-CB 4.01Å; Y212-A219 HydrophobicContact CE2-CB 3.45Å; Y212-A219 VanDerWaalsContact CE2-CB 3.45Å; Y212-A219 HydrophobicContact CG-CB 3.82Å
213	V	97.9	Very high	98.2	Very high	77 Å²	77	31.2 Å²	31.2	47%	0.467	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	-55.1	-26.2	-177.2	68.2	0	0	0	0	114.3	V189 P209 A210	V189-V213 HydrophobicContact CB-CG1 4.47Å; V189-V213 HydrophobicContact CG1-CG1 3.86Å; V189-V213 HydrophobicContact CG2-CG1 3.69Å; P209-V213 PolarHBondContact O-N 2.92Å; A210-V213 PolarHBondContact O-N 2.86Å
214	F	98.3	Very high	98.2	Very high	81 Å²	81	33.9 Å²	33.9	36%	0.355	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-19.1	175.8	-62	-23	0	0	0	114.2	H184 V189 D191 Y212	H184-F214 HydrophobicContact CB-CZ 4.08Å; H184-F214 AromaticContact CD2-CE1 3.86Å; H184-F214 AromaticContact CD2-CZ 3.88Å; H184-F214 AromaticContact CG-CZ 3.65Å; H184-F214 AromaticContact ND1-CZ 3.77Å; H184-F214 AromaticContact NE2-CE1 3.89Å; V189-F214 HydrophobicContact CB-CE2 4.36Å; V189-F214 HydrophobicContact CG1-CD2 3.6Å; V189-F214 HydrophobicContact CG1-CE2 3.79Å; V189-F214 HydrophobicContact CG1-CG 4.03Å; V189-F214 HydrophobicContact CG1-CZ 4.37Å; D191-F214 HydrophobicContact CB-CD2 4.09Å; Y212-F214 PolarHBondContact O-N 3.17Å
215	H	98.4	Very high	98.2	Very high	21 Å²	21	34 Å²	34	10%	0.097	21%	0.211	C	C	.	.			trans	-136.6	53.4	-173.6	-55.4	-80.5	0	0	0	111.8	D191 L192 S193 Y212 D217 N218	D191-H215 IonicContact OD1-CD2 3.84Å; D191-H215 IonicContact OD1-CE1 2.76Å; D191-H215 IonicContact OD1-NE2 3.09Å; D191-H215 PolarHBondContact OD1-NE2 2.73Å; L192-H215 HydrophobicContact CB-CB 4.44Å; L192-H215 HydrophobicContact CD1-CB 3.55Å; L192-H215 HydrophobicContact CG-CB 3.99Å; L192-H215 PolarHBondContact N-CD2 2.98Å; L192-H215 VanDerWaalsContact N-CD2 3.31Å; L192-H215 PolarHBondContact N-NE2 2.64Å; S193-H215 PolarHBondContact N-NE2 2.54Å; Y212-H215 CarbonylContact O-C 3.54Å; Y212-H215 VanDerWaalsContact O-C 3.27Å; Y212-H215 PolarHBondContact O-N 2.67Å; H215-D217 PolarHBondContact O-N 2.77Å; H215-N218 HydrophobicContact CB-CB 4.18Å; H215-N218 PolarHBondContact O-N 3.2Å; H215-N218 VanDerWaalsContact O-N 3.09Å
216	P	97.8	Very high	98.1	Very high	79 Å²	79	39 Å²	39	51%	0.513	23%	0.233	S	C	.	.	G	3₁₀ helix	trans	-61.6	-31.4	-176.4	26.5	-35.4	0	0	0	112.8	N218 A219	P216-N218 PolarHBondContact O-N 3.39Å; P216-A219 WeakPolarHBondContact O-CB 3.47Å; P216-A219 PolarHBondContact O-N 3.25Å
217	D	97.9	Very high	97.9	Very high	66 Å²	66	44.6 Å²	44.6	35%	0.353	26%	0.263	S	S	.	.	G	3₁₀ helix	trans	-75.4	-4.3	179.8	-65.7	-20.2	0	0	0	113.8	H215 Y251 L254 R255	H215-D217 PolarHBondContact O-N 2.77Å; D217-Y251 HydrophobicContact CB-CD1 3.9Å; D217-Y251 HydrophobicContact CB-CE1 3.7Å; D217-Y251 WeakPolarHBondContact O-CD1 3.4Å; D217-Y251 WeakPolarHBondContact O-CE1 3.47Å; D217-L254 WeakPolarHBondContact O-CB 3.44Å; D217-L254 WeakPolarHBondContact O-CD1 3.24Å; D217-R255 HydrophobicContact CB-CG 4.44Å; D217-R255 IonicContact OD2-CZ 3.11Å; D217-R255 VanDerWaalsContact OD2-CZ 3.23Å; D217-R255 IonicContact OD2-NE 3.87Å; D217-R255 PolarHBondContact OD2-NE 3.33Å; D217-R255 IonicContact OD2-NH2 2.88Å; D217-R255 PolarHBondContact OD2-NH2 3.02Å
218	N	98.6	Very high	97.9	Very high	2 Å²	2	47.2 Å²	47.2	1%	0.011	28%	0.277	C	S	.	.	G	3₁₀ helix	trans	-100.4	-5.9	174	-69	85.3	0	0	0	112.2	L192 L199 V202 L203 I204 H215 P216 Y251	L192-N218 HydrophobicContact CD1-CB 3.68Å; L199-N218 PolarHBondContact O-ND2 3.15Å; V202-N218 PolarHBondContact O-ND2 3.06Å; L203-N218 CarbonylContact C-O 3.54Å; L203-N218 WeakPolarHBondContact CA-O 3.26Å; I204-N218 HydrophobicContact CG2-CB 4.49Å; I204-N218 PolarHBondContact N-O 2.89Å; H215-N218 HydrophobicContact CB-CB 4.18Å; H215-N218 PolarHBondContact O-N 3.2Å; H215-N218 VanDerWaalsContact O-N 3.09Å; P216-N218 PolarHBondContact O-N 3.39Å; N218-Y251 PolarHBondContact ND2-OH 2.65Å; N218-Y251 WeakPolarHBondContact OD1-CE1 3.44Å; N218-Y251 PolarHBondContact OD1-OH 3.21Å
219	A	98.5	Very high	97.9	Very high	11 Å²	11	51.9 Å²	51.9	9%	0.091	30%	0.297	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	135.3	-170.7	0	0	0	0	0	112.6	I204 Y212 P216 P221	I204-A219 HydrophobicContact CG2-CB 3.86Å; I204-A219 CarbonylContact O-C 3.58Å; I204-A219 WeakPolarHBondContact O-CA 3.41Å; Y212-A219 HydrophobicContact CD1-CB 4.07Å; Y212-A219 HydrophobicContact CD2-CB 3.53Å; Y212-A219 HydrophobicContact CE1-CB 4.01Å; Y212-A219 HydrophobicContact CE2-CB 3.45Å; Y212-A219 VanDerWaalsContact CE2-CB 3.45Å; Y212-A219 HydrophobicContact CG-CB 3.82Å; P216-A219 WeakPolarHBondContact O-CB 3.47Å; P216-A219 PolarHBondContact O-N 3.25Å; A219-P221 WeakPolarHBondContact O-CD 3.44Å
220	V	98.6	Very high	97.9	Very high	4 Å²	4	52.8 Å²	52.8	2%	0.024	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	101.2	158.9	-178.4	0	0	0	0	105.9	L203 I204 L205 L237 F240 F241 L244 L254	L203-V220 HydrophobicContact CD2-CG2 4.4Å; I204-V220 PolarHBondContact O-N 3.08Å; L205-V220 HydrophobicContact CD1-CB 4.39Å; L205-V220 HydrophobicContact CD1-CG1 4.31Å; L205-V220 VanDerWaalsContact CD1-O 3.28Å; L205-V220 WeakPolarHBondContact CD1-O 3.44Å; V220-L237 HydrophobicContact CG1-CD2 3.89Å; V220-F240 HydrophobicContact CG1-CD1 4.1Å; V220-F240 HydrophobicContact CG1-CE1 4.12Å; V220-F240 HydrophobicContact CG2-CE1 4.05Å; V220-F241 HydrophobicContact CB-CE1 4.47Å; V220-F241 HydrophobicContact CB-CZ 4Å; V220-F241 HydrophobicContact CG1-CE2 4.24Å; V220-F241 HydrophobicContact CG1-CZ 3.94Å; V220-F241 HydrophobicContact CG2-CE1 4.08Å; V220-F241 HydrophobicContact CG2-CZ 4.11Å; V220-L244 HydrophobicContact CG2-CD1 3.92Å; V220-L254 HydrophobicContact CG2-CD2 4.33Å
221	P	97.9	Very high	98	Very high	62 Å²	62	52.4 Å²	52.4	40%	0.403	30%	0.299	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.9	147.7	179.9	-19.7	32.9	0	0	0	111.1	A219	A219-P221 WeakPolarHBondContact O-CD 3.44Å
222	V	98.3	Very high	98	Very high	10 Å²	10	55.3 Å²	55.3	6%	0.061	32%	0.317	C	S	.	.			trans	-139.5	144.9	175.1	62	0	0	0	0	108.8	T100 L205 N207 E233 L237	T100-V222 HydrophobicContact CG2-CG1 4.08Å; L205-V222 HydrophobicContact CD1-CB 3.65Å; L205-V222 HydrophobicContact CD1-CG1 3.66Å; L205-V222 HydrophobicContact CD1-CG2 4.39Å; L205-V222 HydrophobicContact CG-CG1 4.17Å; N207-V222 VanDerWaalsContact CA-O 3.31Å; N207-V222 WeakPolarHBondContact CA-O 3.17Å; N207-V222 HydrophobicContact CB-CG1 4.2Å; V222-E233 WeakPolarHBondContact CA-OE1 3.45Å; V222-E233 VanDerWaalsContact CG2-CD 3.49Å; V222-E233 HydrophobicContact CG2-CG 4.03Å; V222-E233 WeakPolarHBondContact CG2-OE2 3.46Å; V222-L237 HydrophobicContact CB-CD1 4.23Å; V222-L237 HydrophobicContact CG2-CD1 3.94Å
223	A	98.2	Very high	98	Very high	52 Å²	52	56.7 Å²	56.7	43%	0.43	32%	0.324	S	S	.	.			trans	-69.5	144.8	176.5	0	0	0	0	0	111	R132 W225 E233	R132-A223 PolarHBondContact NH1-O 3.47Å; R132-A223 PolarHBondContact NH2-O 2.99Å; A223-W225 PolarHBondContact O-N 3Å; A223-E233 WeakPolarHBondContact CA-OE2 3Å; A223-E233 WeakPolarHBondContact CB-OE2 3.48Å; A223-E233 PolarHBondContact N-OE1 3.43Å; A223-E233 PolarHBondContact N-OE2 3.48Å
224	S	98.4	Very high	98.1	Very high	56 Å²	56	53 Å²	53	39%	0.392	30%	0.302	S	S	.	.			trans	-61.4	129.9	169.3	-56.9	0	0	0	0	110.2	E99 N207	E99-S224 WeakPolarHBondContact O-CA 3.46Å; N207-S224 PolarHBondContact ND2-OG 2.71Å
225	W	98.5	Very high	98.1	Very high	3 Å²	3	52.9 Å²	52.9	1%	0.011	30%	0.302	C	S	.	.			trans	-113.6	143	178.3	-178.2	87.8	0	0	0	111.7	E99 H103 L130 K131 R132 A223 N228 M229	E99-W225 WeakPolarHBondContact CA-O 3.3Å; E99-W225 PolarHBondContact O-N 3.23Å; H103-W225 HydrophobicContact CB-CE3 3.87Å; H103-W225 HydrophobicContact CB-CZ3 3.72Å; L130-W225 HydrophobicContact CB-CH2 3.69Å; L130-W225 HydrophobicContact CB-CZ3 3.97Å; L130-W225 WeakPolarHBondContact O-CZ3 3.41Å; K131-W225 WeakPolarHBondContact O-CH2 3.28Å; R132-W225 HydrophobicContact CB-CD2 3.77Å; R132-W225 HydrophobicContact CB-CE3 3.79Å; R132-W225 HydrophobicContact CB-CG 4.21Å; R132-W225 HydrophobicContact CB-CZ3 4.17Å; R132-W225 HydrophobicContact CG-CB 4.15Å; R132-W225 HydrophobicContact CG-CD2 3.68Å; R132-W225 HydrophobicContact CG-CE3 4.21Å; R132-W225 HydrophobicContact CG-CG 3.61Å; A223-W225 PolarHBondContact O-N 3Å; W225-N228 PolarHBondContact NE1-O 2.89Å; W225-M229 HydrophobicContact CZ2-SD 4.15Å
226	F	96.6	Very high	98.1	Very high	104 Å²	104	56.5 Å²	56.5	46%	0.456	32%	0.322	S	S	.	.	S	Bend	trans	-128.5	-63.6	-177.3	-60.6	-84.7	0	0	0	111.8	E99 H103	E99-F226 HydrophobicContact CG-CD1 4.08Å; E99-F226 HydrophobicContact CG-CE1 3.56Å; E99-F226 HydrophobicContact CG-CZ 3.93Å; H103-F226 WeakPolarHBondContact CB-O 3.49Å; H103-F226 PolarHBondContact CD2-O 3.04Å; H103-F226 AromaticContact CE1-CD1 3.62Å; H103-F226 AromaticContact ND1-CD1 3.65Å
227	D	96.1	Very high	98.1	Very high	118 Å²	118	53.9 Å²	53.9	63%	0.631	30%	0.303	S	S	*	.	S	Bend	trans	-151.1	6.5	-175	60.7	3.9	0	0	0	114	L130 M229	L130-D227 HydrophobicContact CD1-CB 4.16Å; D227-M229 PolarHBondContact O-N 3.2Å
228	N	97.3	Very high	98.2	Very high	82 Å²	82	51.4 Å²	51.4	44%	0.439	29%	0.29	S	S	.	.			trans	-72.9	100.3	-179.6	179	21	0	0	0	110.6	W225 S230 D231	W225-N228 PolarHBondContact NE1-O 2.89Å; N228-S230 PolarHBondContact O-N 2.86Å; N228-S230 WeakPolarHBondContact OD1-CB 3.06Å; N228-S230 PolarHBondContact OD1-N 2.66Å; N228-D231 WeakPolarHBondContact O-CB 3.44Å; N228-D231 PolarHBondContact O-N 2.91Å; N228-D231 VanDerWaalsContact O-N 3.14Å
229	M	97.1	Very high	98.2	Very high	129 Å²	129	55.6 Å²	55.6	64%	0.635	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.5	-8.3	178.7	-60.3	-52.5	-62.5	0	0	114.3	P133 W225 D227 D231	P133-M229 HydrophobicContact CG-CE 4.22Å; P133-M229 HydrophobicContact CG-SD 4.49Å; W225-M229 HydrophobicContact CZ2-SD 4.15Å; D227-M229 PolarHBondContact O-N 3.2Å; M229-D231 VanDerWaalsContact C-N 3.34Å
230	S	98.2	Very high	98.1	Very high	103 Å²	103	58.2 Å²	58.2	72%	0.72	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.4	4.3	171.6	-54.2	0	0	0	0	112.8	N228	N228-S230 PolarHBondContact O-N 2.86Å; N228-S230 WeakPolarHBondContact OD1-CB 3.06Å; N228-S230 PolarHBondContact OD1-N 2.66Å
231	D	98.7	Very high	98.1	Very high	22 Å²	22	58 Å²	58	12%	0.118	33%	0.326	C	S	.	.			trans	-63.1	138.2	173.5	-175.6	-82.9	0	0	0	110.9	R132 P133 N228 M229 E233	R132-D231 IonicContact CZ-OD1 3.18Å; R132-D231 IonicContact CZ-OD2 2.66Å; R132-D231 IonicContact NE-OD1 3.57Å; R132-D231 PolarHBondContact NE-OD1 3.26Å; R132-D231 IonicContact NE-OD2 2.89Å; R132-D231 IonicContact NH2-OD1 2.76Å; R132-D231 PolarHBondContact NH2-OD1 3.18Å; R132-D231 IonicContact NH2-OD2 3.29Å; R132-D231 PolarHBondContact NH2-OD2 2.9Å; P133-D231 VanDerWaalsContact CB-O 3.24Å; P133-D231 WeakPolarHBondContact CB-O 3.41Å; P133-D231 HydrophobicContact CG-CB 4.21Å; N228-D231 WeakPolarHBondContact O-CB 3.44Å; N228-D231 PolarHBondContact O-N 2.91Å; N228-D231 VanDerWaalsContact O-N 3.14Å; M229-D231 VanDerWaalsContact C-N 3.34Å; D231-E233 PolarHBondContact OD1-N 2.87Å; D231-E233 VanDerWaalsContact OD1-N 3.1Å
232	T	98.7	Very high	98.2	Very high	61 Å²	61	57.1 Å²	57.1	37%	0.374	32%	0.316	S	S	.	.			trans	-128.3	6.1	177.9	54.5	0	0	0	0	112.1	L234 H235 D236	T232-L234 VanDerWaalsContact C-N 3.32Å; T232-L234 PolarHBondContact O-N 3.31Å; T232-H235 WeakPolarHBondContact O-CA 3.23Å; T232-H235 WeakPolarHBondContact O-CB 3.34Å; T232-H235 PolarHBondContact O-N 2.89Å; T232-D236 WeakPolarHBondContact CB-OD2 3.4Å; T232-D236 VanDerWaalsContact O-CG 3.25Å; T232-D236 PolarHBondContact O-N 2.89Å; T232-D236 PolarHBondContact OG1-OD2 3.45Å
233	E	98.7	Very high	98.2	Very high	48 Å²	48	61.5 Å²	61.5	22%	0.224	34%	0.336	C	S	.	.	H	α-helix	trans	-64.3	-37.6	-163.3	-164.8	175.3	-170.5	0	0	112.2	R132 V222 A223 D231 H235 D236 L237	R132-E233 IonicContact CZ-OE2 2.62Å; R132-E233 IonicContact NH1-OE2 3.21Å; R132-E233 IonicContact NH2-OE2 2.7Å; R132-E233 PolarHBondContact NH2-OE2 3.3Å; V222-E233 WeakPolarHBondContact CA-OE1 3.45Å; V222-E233 VanDerWaalsContact CG2-CD 3.49Å; V222-E233 HydrophobicContact CG2-CG 4.03Å; V222-E233 WeakPolarHBondContact CG2-OE2 3.46Å; A223-E233 WeakPolarHBondContact CA-OE2 3Å; A223-E233 WeakPolarHBondContact CB-OE2 3.48Å; A223-E233 PolarHBondContact N-OE1 3.43Å; A223-E233 PolarHBondContact N-OE2 3.48Å; D231-E233 PolarHBondContact OD1-N 2.87Å; D231-E233 VanDerWaalsContact OD1-N 3.1Å; E233-H235 VanDerWaalsContact C-N 3.31Å; E233-H235 PolarHBondContact O-N 2.7Å; E233-D236 PolarHBondContact O-N 3.46Å; E233-L237 HydrophobicContact CG-CD1 4.21Å; E233-L237 HydrophobicContact CG-CG 4.43Å; E233-L237 WeakPolarHBondContact O-CB 3.4Å; E233-L237 VanDerWaalsContact O-CG 3.23Å; E233-L237 WeakPolarHBondContact O-CG 3.36Å; E233-L237 PolarHBondContact O-N 2.88Å
234	L	98.8	Very high	98.2	Very high	0 Å²	0	59 Å²	59	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-62	-39.9	174.4	-64.4	-173.2	0	0	0	112	L101 R132 H134 V135 F138 T232	L101-L234 HydrophobicContact CD2-CD1 4.31Å; R132-L234 HydrophobicContact CB-CD1 4.04Å; R132-L234 HydrophobicContact CG-CD1 3.91Å; R132-L234 HydrophobicContact CG-CG 4.2Å; H134-L234 HydrophobicContact CB-CB 4.46Å; V135-L234 HydrophobicContact CB-CD1 3.9Å; V135-L234 HydrophobicContact CG2-CD1 4.15Å; F138-L234 HydrophobicContact CB-CB 4.08Å; F138-L234 HydrophobicContact CB-CD1 4.38Å; F138-L234 HydrophobicContact CD1-CD1 4.47Å; F138-L234 HydrophobicContact CD1-CD2 4.36Å; F138-L234 HydrophobicContact CD2-CB 4.04Å; F138-L234 HydrophobicContact CD2-CD2 4.46Å; F138-L234 VanDerWaalsContact CD2-O 3.26Å; F138-L234 WeakPolarHBondContact CD2-O 3.27Å; F138-L234 HydrophobicContact CE1-CD2 4.42Å; F138-L234 HydrophobicContact CG-CB 4.04Å; F138-L234 HydrophobicContact CG-CD1 4.41Å; F138-L234 HydrophobicContact CG-CD2 4.39Å; T232-L234 VanDerWaalsContact C-N 3.32Å; T232-L234 PolarHBondContact O-N 3.31Å
235	H	98.7	Very high	98.2	Very high	78 Å²	78	57.6 Å²	57.6	36%	0.361	31%	0.305	S	S	.	.	H	α-helix	trans	-67.3	-45.6	175.6	-178.4	81.1	0	0	0	111	H134 E137 T232 E233 L237 L238	H134-H235 HydrophobicContact CB-CB 3.93Å; H134-H235 AromaticContact ND1-ND1 3.99Å; E137-H235 IonicContact OE1-CE1 3.64Å; E137-H235 IonicContact OE1-ND1 3.54Å; E137-H235 PolarHBondContact OE1-ND1 2.81Å; E137-H235 IonicContact OE2-CE1 3.64Å; E137-H235 IonicContact OE2-ND1 2.82Å; E137-H235 PolarHBondContact OE2-ND1 3.03Å; T232-H235 WeakPolarHBondContact O-CA 3.23Å; T232-H235 WeakPolarHBondContact O-CB 3.34Å; T232-H235 PolarHBondContact O-N 2.89Å; E233-H235 VanDerWaalsContact C-N 3.31Å; E233-H235 PolarHBondContact O-N 2.7Å; H235-L237 PolarHBondContact O-N 2.78Å; H235-L238 WeakPolarHBondContact O-CB 3.44Å; H235-L238 PolarHBondContact O-N 2.91Å; H235-L238 VanDerWaalsContact O-N 3.15Å
236	D	98.5	Very high	98.1	Very high	97 Å²	97	65.3 Å²	65.3	52%	0.519	34%	0.335	S	S	.	.	H	α-helix	trans	-66.6	-25	-178.5	-61.5	-27.9	0	0	0	112.7	T232 E233 P239	T232-D236 WeakPolarHBondContact CB-OD2 3.4Å; T232-D236 VanDerWaalsContact O-CG 3.25Å; T232-D236 PolarHBondContact O-N 2.89Å; T232-D236 PolarHBondContact OG1-OD2 3.45Å; E233-D236 PolarHBondContact O-N 3.46Å; D236-P239 WeakPolarHBondContact O-CD 3.27Å
237	L	98.6	Very high	98.2	Very high	23 Å²	23	61.7 Å²	61.7	12%	0.12	32%	0.321	C	S	.	.	H	α-helix	trans	-78.2	-22	175.4	-77.9	172.2	0	0	0	113.7	L205 V220 V222 E233 H235 F240 F241	L205-L237 HydrophobicContact CD1-CD1 4.07Å; V220-L237 HydrophobicContact CG1-CD2 3.89Å; V222-L237 HydrophobicContact CB-CD1 4.23Å; V222-L237 HydrophobicContact CG2-CD1 3.94Å; E233-L237 HydrophobicContact CG-CD1 4.21Å; E233-L237 HydrophobicContact CG-CG 4.43Å; E233-L237 WeakPolarHBondContact O-CB 3.4Å; E233-L237 VanDerWaalsContact O-CG 3.23Å; E233-L237 WeakPolarHBondContact O-CG 3.36Å; E233-L237 PolarHBondContact O-N 2.88Å; H235-L237 PolarHBondContact O-N 2.78Å; L237-F240 WeakPolarHBondContact O-CB 3.15Å; L237-F240 PolarHBondContact O-N 2.88Å; L237-F241 HydrophobicContact CB-CD2 4.03Å; L237-F241 HydrophobicContact CB-CE2 4.04Å; L237-F241 HydrophobicContact CD1-CE2 4.44Å; L237-F241 WeakPolarHBondContact O-CD2 3.29Å; L237-F241 PolarHBondContact O-N 3.49Å
238	L	98.7	Very high	98.2	Very high	15 Å²	15	62.7 Å²	62.7	8%	0.079	33%	0.327	C	S	.	.	H	α-helix	trans	-57.1	-46	-176.6	-76	175.6	0	0	0	113.6	E137 F138 R141 H235 F240 F241 E242	E137-L238 HydrophobicContact CG-CD1 4.02Å; F138-L238 HydrophobicContact CD2-CD2 3.64Å; F138-L238 HydrophobicContact CD2-CG 4.02Å; F138-L238 HydrophobicContact CE2-CD2 4.11Å; R141-L238 HydrophobicContact CB-CD2 3.85Å; R141-L238 HydrophobicContact CG-CD2 3.89Å; H235-L238 WeakPolarHBondContact O-CB 3.44Å; H235-L238 PolarHBondContact O-N 2.91Å; H235-L238 VanDerWaalsContact O-N 3.15Å; L238-F240 PolarHBondContact O-N 3.2Å; L238-F241 PolarHBondContact O-N 2.87Å; L238-E242 WeakPolarHBondContact O-CB 3.49Å; L238-E242 WeakPolarHBondContact O-CG 3.48Å; L238-E242 PolarHBondContact O-N 3.19Å
239	P	98.4	Very high	98.3	Very high	89 Å²	89	61.2 Å²	61.2	58%	0.578	32%	0.319	S	S	*	.	H	α-helix	trans	-58.9	-32.7	175.8	-25.6	35.4	0	0	0	113.8	D236 E242 Q243	D236-P239 WeakPolarHBondContact O-CD 3.27Å; P239-E242 WeakPolarHBondContact O-CB 3.33Å; P239-Q243 PolarHBondContact O-N 3.46Å; P239-Q243 VanDerWaalsContact O-N 3.16Å
240	F	98.1	Very high	98.3	Very high	67 Å²	67	55.1 Å²	55.1	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-74.1	-41.8	177.6	-174.1	-123.7	0	0	0	111.7	V220 L237 L238 E242 Q243 L244 V253 L254	V220-F240 HydrophobicContact CG1-CD1 4.1Å; V220-F240 HydrophobicContact CG1-CE1 4.12Å; V220-F240 HydrophobicContact CG2-CE1 4.05Å; L237-F240 WeakPolarHBondContact O-CB 3.15Å; L237-F240 PolarHBondContact O-N 2.88Å; L238-F240 PolarHBondContact O-N 3.2Å; F240-E242 VanDerWaalsContact C-N 3.35Å; F240-Q243 WeakPolarHBondContact O-CB 3.28Å; F240-Q243 PolarHBondContact O-N 3.46Å; F240-L244 HydrophobicContact CD1-CD1 3.89Å; F240-L244 HydrophobicContact CE1-CD1 3.59Å; F240-L244 HydrophobicContact CE1-CG 4.41Å; F240-L244 HydrophobicContact CG-CD1 4.49Å; F240-L244 HydrophobicContact CZ-CD1 3.93Å; F240-L244 HydrophobicContact CZ-CG 4.31Å; F240-L244 PolarHBondContact O-N 2.93Å; F240-V253 HydrophobicContact CE2-CG1 3.73Å; F240-V253 HydrophobicContact CZ-CG1 4.01Å; F240-L254 HydrophobicContact CE1-CD2 4.14Å; F240-L254 HydrophobicContact CZ-CD2 3.91Å
241	F	98.6	Very high	98.3	Very high	0 Å²	0	52 Å²	52	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.9	-38.6	172.3	-83.2	-64.4	0	0	0	112.4	V93 F138 M142 F146 L203 L205 V220 L237 L238 Q243 L244 S245	V93-F241 HydrophobicContact CG1-CE1 4.24Å; F138-F241 AromaticContact CE2-CD2 3.96Å; F138-F241 HydrophobicContact CE2-CD2 3.96Å; F138-F241 AromaticContact CE2-CE2 4Å; F138-F241 HydrophobicContact CE2-CE2 4Å; F138-F241 HydrophobicContact CZ-CD2 4.3Å; F138-F241 AromaticContact CZ-CE2 3.99Å; F138-F241 HydrophobicContact CZ-CE2 3.99Å; M142-F241 HydrophobicContact CE-CB 4.49Å; M142-F241 HydrophobicContact CE-CD1 3.58Å; M142-F241 HydrophobicContact CE-CD2 4.2Å; M142-F241 HydrophobicContact CE-CE1 3.73Å; M142-F241 HydrophobicContact CE-CE2 4.33Å; M142-F241 HydrophobicContact CE-CG 3.84Å; M142-F241 HydrophobicContact CE-CZ 4.11Å; M142-F241 HydrophobicContact SD-CB 3.76Å; M142-F241 HydrophobicContact SD-CD1 3.97Å; M142-F241 HydrophobicContact SD-CD2 3.91Å; M142-F241 HydrophobicContact SD-CG 3.61Å; F146-F241 HydrophobicContact CE2-CB 3.95Å; F146-F241 AromaticContact CE2-CD1 3.99Å; F146-F241 HydrophobicContact CE2-CD1 3.99Å; F146-F241 HydrophobicContact CE2-CG 4.35Å; F146-F241 HydrophobicContact CZ-CB 4.26Å; F146-F241 HydrophobicContact CZ-CD1 4.01Å; F146-F241 VanDerWaalsContact CZ-O 3.24Å; F146-F241 WeakPolarHBondContact CZ-O 3.34Å; L203-F241 HydrophobicContact CD1-CD1 4.38Å; L203-F241 HydrophobicContact CD1-CE1 4.24Å; L205-F241 HydrophobicContact CB-CZ 4.21Å; L205-F241 HydrophobicContact CD1-CE2 4.36Å; L205-F241 HydrophobicContact CD1-CZ 4.16Å; L205-F241 HydrophobicContact CD2-CE2 4.12Å; L205-F241 HydrophobicContact CD2-CZ 4.08Å; L205-F241 HydrophobicContact CG-CZ 4.4Å; V220-F241 HydrophobicContact CB-CE1 4.47Å; V220-F241 HydrophobicContact CB-CZ 4Å; V220-F241 HydrophobicContact CG1-CE2 4.24Å; V220-F241 HydrophobicContact CG1-CZ 3.94Å; V220-F241 HydrophobicContact CG2-CE1 4.08Å; V220-F241 HydrophobicContact CG2-CZ 4.11Å; L237-F241 HydrophobicContact CB-CD2 4.03Å; L237-F241 HydrophobicContact CB-CE2 4.04Å; L237-F241 HydrophobicContact CD1-CE2 4.44Å; L237-F241 WeakPolarHBondContact O-CD2 3.29Å; L237-F241 PolarHBondContact O-N 3.49Å; L238-F241 PolarHBondContact O-N 2.87Å; F241-Q243 VanDerWaalsContact C-N 3.3Å; F241-Q243 PolarHBondContact O-N 2.86Å; F241-L244 HydrophobicContact CD1-CD1 4.44Å; F241-L244 PolarHBondContact O-N 2.85Å; F241-S245 WeakPolarHBondContact O-CB 3.18Å; F241-S245 PolarHBondContact O-N 3.49Å
242	E	98.5	Very high	98.2	Very high	43 Å²	43	53.9 Å²	53.9	20%	0.201	28%	0.276	C	S	.	.	H	α-helix	trans	-55	-45.5	170.3	-75.1	-102.6	-174.7	0	0	111.6	R141 L145 L238 P239 F240 S245 R246	R141-E242 IonicContact CZ-OE1 3.02Å; R141-E242 IonicContact NE-OE1 2.78Å; R141-E242 PolarHBondContact NE-OE1 3.15Å; R141-E242 IonicContact NH2-OE1 2.7Å; R141-E242 PolarHBondContact NH2-OE1 3.19Å; R141-E242 IonicContact NH2-OE2 2.89Å; R141-E242 PolarHBondContact NH2-OE2 2.96Å; L145-E242 HydrophobicContact CD1-CG 4.08Å; L238-E242 WeakPolarHBondContact O-CB 3.49Å; L238-E242 WeakPolarHBondContact O-CG 3.48Å; L238-E242 PolarHBondContact O-N 3.19Å; P239-E242 WeakPolarHBondContact O-CB 3.33Å; F240-E242 VanDerWaalsContact C-N 3.35Å; E242-S245 PolarHBondContact O-OG 3.43Å; E242-R246 PolarHBondContact O-NH1 3.02Å; E242-R246 IonicContact OE2-CZ 2.82Å; E242-R246 IonicContact OE2-NH1 3.57Å; E242-R246 IonicContact OE2-NH2 3.85Å; E242-R246 PolarHBondContact OE2-NH2 3.33Å
243	Q	98	Very high	98.1	Very high	101 Å²	101	52.1 Å²	52.1	47%	0.472	27%	0.265	S	S	.	.	H	α-helix	trans	-62	-49.9	175.1	179.3	-176.1	-16.6	0	0	111.3	P239 F240 F241 S245 R246	P239-Q243 PolarHBondContact O-N 3.46Å; P239-Q243 VanDerWaalsContact O-N 3.16Å; F240-Q243 WeakPolarHBondContact O-CB 3.28Å; F240-Q243 PolarHBondContact O-N 3.46Å; F241-Q243 VanDerWaalsContact C-N 3.3Å; F241-Q243 PolarHBondContact O-N 2.86Å; Q243-S245 VanDerWaalsContact C-N 3.28Å; Q243-S245 PolarHBondContact O-N 2.99Å; Q243-R246 PolarHBondContact O-N 2.94Å
244	L	98.4	Very high	97.9	Very high	0 Å²	0	51.7 Å²	51.7	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-62	-33.5	-179.2	-74.1	169.5	0	0	0	112.6	I91 L203 V220 F240 F241 R246 V247 V253 L254	I91-L244 WeakPolarHBondContact CD1-O 3.19Å; L203-L244 HydrophobicContact CD1-CB 4.03Å; L203-L244 HydrophobicContact CD1-CD1 3.82Å; L203-L244 HydrophobicContact CD1-CG 4.42Å; L203-L244 HydrophobicContact CD2-CD1 4.26Å; V220-L244 HydrophobicContact CG2-CD1 3.92Å; F240-L244 HydrophobicContact CD1-CD1 3.89Å; F240-L244 HydrophobicContact CE1-CD1 3.59Å; F240-L244 HydrophobicContact CE1-CG 4.41Å; F240-L244 HydrophobicContact CG-CD1 4.49Å; F240-L244 HydrophobicContact CZ-CD1 3.93Å; F240-L244 HydrophobicContact CZ-CG 4.31Å; F240-L244 PolarHBondContact O-N 2.93Å; F241-L244 HydrophobicContact CD1-CD1 4.44Å; F241-L244 PolarHBondContact O-N 2.85Å; L244-R246 PolarHBondContact O-N 3.29Å; L244-V247 WeakPolarHBondContact O-CG2 3.33Å; L244-V247 PolarHBondContact O-N 2.97Å; L244-V253 HydrophobicContact CD2-CB 3.82Å; L244-V253 HydrophobicContact CD2-CG1 3.91Å; L244-V253 HydrophobicContact CD2-CG2 4.18Å; L244-L254 HydrophobicContact CD1-CD2 4.46Å; L244-L254 HydrophobicContact CD2-CD2 4.42Å
245	S	98.3	Very high	97.5	Very high	26 Å²	26	58.7 Å²	58.7	18%	0.182	29%	0.291	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.4	-18.3	179.4	73.5	0	0	0	0	114.2	F241 E242 Q243	F241-S245 WeakPolarHBondContact O-CB 3.18Å; F241-S245 PolarHBondContact O-N 3.49Å; E242-S245 PolarHBondContact O-OG 3.43Å; Q243-S245 VanDerWaalsContact C-N 3.28Å; Q243-S245 PolarHBondContact O-N 2.99Å
246	R	97.9	Very high	96.6	Very high	165 Å²	165	61.1 Å²	61.1	62%	0.623	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	-102.9	-5.4	-174.2	-59.6	178.2	-177.3	101.3	2.5	113.8	E242 Q243 L244	E242-R246 PolarHBondContact O-NH1 3.02Å; E242-R246 IonicContact OE2-CZ 2.82Å; E242-R246 IonicContact OE2-NH1 3.57Å; E242-R246 IonicContact OE2-NH2 3.85Å; E242-R246 PolarHBondContact OE2-NH2 3.33Å; Q243-R246 PolarHBondContact O-N 2.94Å; L244-R246 PolarHBondContact O-N 3.29Å
247	V	97.8	Very high	95	Very high	28 Å²	28	61.9 Å²	61.9	17%	0.17	31%	0.312	C	S	.	.			trans	-90.7	150.1	-179.1	-56	0	0	0	0	111.8	I91 R201 L244 V253	I91-V247 HydrophobicContact CD1-CG2 4.37Å; R201-V247 PolarHBondContact NH1-O 2.82Å; L244-V247 WeakPolarHBondContact O-CG2 3.33Å; L244-V247 PolarHBondContact O-N 2.97Å; V247-V253 HydrophobicContact CG1-CG2 3.9Å; V247-V253 HydrophobicContact CG2-CG2 4.48Å
248	D	97	Very high	93	Very high	140 Å²	140	69.1 Å²	69.1	75%	0.749	34%	0.338	S	S	*	.	S	Bend	trans	-77.3	-34.1	175.4	-65.6	-40.1	0	0	0	111.9	R201	R201-D248 PolarHBondContact NH1-O 3.41Å
249	D	98	Very high	90.1	Very high	51 Å²	51	75 Å²	75	27%	0.273	38%	0.377	S	S	.	.			trans	-133.8	116.7	-179.3	-173.6	-17	0	0	0	110.5	R200 Y251 S252	R200-D249 HydrophobicContact CB-CB 4.3Å; R200-D249 WeakPolarHBondContact O-CA 3.37Å; D249-Y251 PolarHBondContact O-N 2.89Å; D249-Y251 WeakPolarHBondContact OD1-CB 3.49Å; D249-Y251 WeakPolarHBondContact OD1-CD2 3.09Å; D249-Y251 PolarHBondContact OD1-N 3.23Å; D249-S252 WeakPolarHBondContact O-CB 3.43Å; D249-S252 PolarHBondContact O-N 2.93Å; D249-S252 PolarHBondContact O-OG 3.36Å
250	V	98.3	Very high	87.7	Confident	0 Å²	0	74.9 Å²	74.9	0%	0	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	-28.6	-179.4	-60.7	0	0	0	0	112.9	I91 R200 L203 S252 V253 L254	I91-V250 HydrophobicContact CD1-CG1 3.88Å; I91-V250 HydrophobicContact CG1-CG1 4.49Å; I91-V250 HydrophobicContact CG2-CG1 4.38Å; R200-V250 WeakPolarHBondContact O-CG1 3.31Å; R200-V250 WeakPolarHBondContact O-CG2 3.34Å; R200-V250 PolarHBondContact O-N 3.34Å; L203-V250 HydrophobicContact CD1-CG1 4.37Å; L203-V250 HydrophobicContact CD2-CB 3.8Å; L203-V250 HydrophobicContact CD2-CG1 3.64Å; L203-V250 HydrophobicContact CD2-CG2 4.23Å; L203-V250 HydrophobicContact CG-CG1 3.88Å; V250-S252 PolarHBondContact O-N 3.38Å; V250-V253 PolarHBondContact O-N 2.66Å; V250-V253 VanDerWaalsContact O-N 3.09Å; V250-L254 HydrophobicContact CB-CD1 4.33Å; V250-L254 HydrophobicContact CG2-CD1 4.42Å; V250-L254 PolarHBondContact O-N 3.29Å
251	Y	97.7	Very high	84.9	Confident	39 Å²	39	79 Å²	79	15%	0.153	43%	0.429	C	S	.	.	H	α-helix	trans	-67.1	-22.2	-179.5	-59.4	-51.4	0	0	0	112.5	L199 R200 D217 N218 D249 V253 R255	L199-Y251 PolarHBondContact O-OH 2.87Å; R200-Y251 HydrophobicContact CG-CD2 4.13Å; R200-Y251 HydrophobicContact CG-CE2 4Å; D217-Y251 HydrophobicContact CB-CD1 3.9Å; D217-Y251 HydrophobicContact CB-CE1 3.7Å; D217-Y251 WeakPolarHBondContact O-CD1 3.4Å; D217-Y251 WeakPolarHBondContact O-CE1 3.47Å; N218-Y251 PolarHBondContact ND2-OH 2.65Å; N218-Y251 WeakPolarHBondContact OD1-CE1 3.44Å; N218-Y251 PolarHBondContact OD1-OH 3.21Å; D249-Y251 PolarHBondContact O-N 2.89Å; D249-Y251 WeakPolarHBondContact OD1-CB 3.49Å; D249-Y251 WeakPolarHBondContact OD1-CD2 3.09Å; D249-Y251 PolarHBondContact OD1-N 3.23Å; Y251-V253 PolarHBondContact O-N 3.31Å; Y251-R255 WeakPolarHBondContact O-CB 3.17Å; Y251-R255 PolarHBondContact O-N 3.1Å
252	S	96.4	Very high	84.2	Confident	61 Å²	61	83 Å²	83	43%	0.427	45%	0.451	S	S	.	.	H	α-helix	trans	-62.2	-24.3	174.2	68.9	0	0	0	0	113.1	D249 V250 Q256	D249-S252 WeakPolarHBondContact O-CB 3.43Å; D249-S252 PolarHBondContact O-N 2.93Å; D249-S252 PolarHBondContact O-OG 3.36Å; V250-S252 PolarHBondContact O-N 3.38Å; S252-Q256 VanDerWaalsContact O-CG 3.23Å; S252-Q256 WeakPolarHBondContact O-CG 3.18Å; S252-Q256 PolarHBondContact O-NE2 3.26Å
253	V	95.8	Very high	83.5	Confident	23 Å²	23	85.1 Å²	85.1	14%	0.139	46%	0.464	C	S	.	.	H	α-helix	trans	-104.8	-50.4	178.8	-178.3	0	0	0	0	110.7	F240 L244 V247 V250 Y251 R255 Q256	F240-V253 HydrophobicContact CE2-CG1 3.73Å; F240-V253 HydrophobicContact CZ-CG1 4.01Å; L244-V253 HydrophobicContact CD2-CB 3.82Å; L244-V253 HydrophobicContact CD2-CG1 3.91Å; L244-V253 HydrophobicContact CD2-CG2 4.18Å; V247-V253 HydrophobicContact CG1-CG2 3.9Å; V247-V253 HydrophobicContact CG2-CG2 4.48Å; V250-V253 PolarHBondContact O-N 2.66Å; V250-V253 VanDerWaalsContact O-N 3.09Å; Y251-V253 PolarHBondContact O-N 3.31Å; V253-R255 VanDerWaalsContact C-N 3.33Å; V253-R255 PolarHBondContact O-N 3.29Å; V253-Q256 WeakPolarHBondContact O-CB 3.41Å; V253-Q256 WeakPolarHBondContact O-CG 3.14Å; V253-Q256 PolarHBondContact O-N 2.78Å
254	L	95.1	Very high	82.6	Confident	40 Å²	40	84.2 Å²	84.2	21%	0.209	46%	0.463	C	S	.	.	H	α-helix	trans	-69.9	-26.2	-170.7	-64.9	-176.5	0	0	0	114.2	L203 D217 V220 F240 L244 V250	L203-L254 HydrophobicContact CD2-CD1 3.57Å; L203-L254 HydrophobicContact CD2-CG 4.49Å; D217-L254 WeakPolarHBondContact O-CB 3.44Å; D217-L254 WeakPolarHBondContact O-CD1 3.24Å; V220-L254 HydrophobicContact CG2-CD2 4.33Å; F240-L254 HydrophobicContact CE1-CD2 4.14Å; F240-L254 HydrophobicContact CZ-CD2 3.91Å; L244-L254 HydrophobicContact CD1-CD2 4.46Å; L244-L254 HydrophobicContact CD2-CD2 4.42Å; V250-L254 HydrophobicContact CB-CD1 4.33Å; V250-L254 HydrophobicContact CG2-CD1 4.42Å; V250-L254 PolarHBondContact O-N 3.29Å
255	R	90.9	Very high	81.7	Confident	147 Å²	147	89.2 Å²	89.2	56%	0.555	49%	0.491	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.6	-0.5	176.3	-65.5	-175.3	170.7	153.3	0.9	113.9	D217 Y251 V253	D217-R255 HydrophobicContact CB-CG 4.44Å; D217-R255 IonicContact OD2-CZ 3.11Å; D217-R255 VanDerWaalsContact OD2-CZ 3.23Å; D217-R255 IonicContact OD2-NE 3.87Å; D217-R255 PolarHBondContact OD2-NE 3.33Å; D217-R255 IonicContact OD2-NH2 2.88Å; D217-R255 PolarHBondContact OD2-NH2 3.02Å; Y251-R255 WeakPolarHBondContact O-CB 3.17Å; Y251-R255 PolarHBondContact O-N 3.1Å; V253-R255 VanDerWaalsContact C-N 3.33Å; V253-R255 PolarHBondContact O-N 3.29Å
256	Q	79	Confident	80.7	Confident	129 Å²	129	93.1 Å²	93.1	60%	0.603	51%	0.51	S	S	*	.	S	Bend	trans	-66.2	131.8	174.3	-66.5	-87	-21	0	0	108.7	S252 V253 R258	S252-Q256 VanDerWaalsContact O-CG 3.23Å; S252-Q256 WeakPolarHBondContact O-CG 3.18Å; S252-Q256 PolarHBondContact O-NE2 3.26Å; V253-Q256 WeakPolarHBondContact O-CB 3.41Å; V253-Q256 WeakPolarHBondContact O-CG 3.14Å; V253-Q256 PolarHBondContact O-N 2.78Å; Q256-R258 PolarHBondContact O-N 2.86Å; Q256-R258 VanDerWaalsContact O-N 3.13Å
257	P	65.2	Low	79.5	Confident	113 Å²	113	88.3 Å²	88.3	73%	0.734	50%	0.502	S	S	*	.	P	Polyproline II helix	trans	-55.4	122.1	168.9	-19.3	30	0	0	0	108.6	P259	P257-P259 WeakPolarHBondContact O-CD 3.43Å
258	R	56.7	Low	78.2	Confident	174 Å²	174	92.6 Å²	92.6	66%	0.657	53%	0.526	S	S	*	.	P	Polyproline II helix	trans	-61.7	129.5	173.7	-63.9	-179.2	-165.1	167.8	2.8	107.5	Q256 G260 S261	Q256-R258 PolarHBondContact O-N 2.86Å; Q256-R258 VanDerWaalsContact O-N 3.13Å; R258-G260 PolarHBondContact O-N 3.14Å; R258-S261 PolarHBondContact O-N 3.06Å
259	P	37.6	Very low	76.8	Confident	140 Å²	140	89 Å²	89	91%	0.909	51%	0.509	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	109.4	173.6	-19.2	29.8	0	0	0	109	P257	P257-P259 WeakPolarHBondContact O-CD 3.43Å
260	G	49.2	Very low	75	Confident	85 Å²	85	92.2 Å²	92.2	88%	0.876	53%	0.529	S	S	*	.	T	Hydrogen-bonded Turn	trans	102.6	14.1	178.8	0	0	0	0	0	117.1	R258	R258-G260 PolarHBondContact O-N 3.14Å
261	S	38.6	Very low	72.9	Confident	155 Å²	155	100.5 Å²	100.5	100%	1.084	58%	0.577	S	S	*	*			trans	-87.4	0	160.9	-59.6	0	0	0	0	112.4	R258	R258-S261 PolarHBondContact O-N 3.06Å

Retrieved 261 of 261 residues in 168.6 ms (Link to these results)

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