A0A096LVG4_POEFO Loading...

E3 ubiquitin-protein ligase

AlphaFold DB , UniProt , Accession A0A096LVG4, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 172 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.5	Very low	38.5	Very low	246 Å²	246	134.9 Å²	134.9	100%	1.212	79%	0.793	S	S	*	*				0	95	0	-61.7	-179.1	176.4	0	0	105
2	G	38.1	Very low	38.7	Very low	72 Å²	72	133.8 Å²	133.8	74%	0.742	80%	0.795	S	S	*	*				65.4	114.7	92.5	0	0	0	0	0	108.8
3	S	39.8	Very low	39.3	Very low	121 Å²	121	131.8 Å²	131.8	85%	0.846	78%	0.779	S	S	*	*			cis	-162.5	146.7	41.6	-62.9	0	0	0	0	111.9
4	S	39.5	Very low	40	Very low	114 Å²	114	136.9 Å²	136.9	80%	0.797	78%	0.778	S	S	*	*			trans	-62.8	142.6	165.5	-32	0	0	0	0	110.8
5	H	37.2	Very low	40.7	Very low	191 Å²	191	138.4 Å²	138.4	88%	0.884	77%	0.768	S	S	*	*			trans	-130.6	107.2	153.2	-112.8	-87.5	0	0	0	110.3
6	S	36.3	Very low	40.8	Very low	85 Å²	85	138.4 Å²	138.4	59%	0.594	77%	0.765	S	S	*	*			trans	-46.4	122.6	171.9	-163.2	0	0	0	0	112	D8	S6-D8 PolarHBondContact O-N 2.95Å; S6-D8 PolarHBondContact OG-OD2 3.25Å
7	S	38.2	Very low	41.1	Very low	111 Å²	111	141.5 Å²	141.5	78%	0.776	77%	0.769	S	S	*	*			trans	-86.9	81.1	160	23.4	0	0	0	0	108.7	T9	S7-T9 VanDerWaalsContact C-N 3.31Å; S7-T9 PolarHBondContact O-N 3.12Å
8	D	35	Very low	41.4	Very low	129 Å²	129	138.1 Å²	138.1	69%	0.69	77%	0.771	S	S	*	*			trans	-70.8	88.9	171.3	-90.4	-69.1	0	0	0	109.8	S6 L10	S6-D8 PolarHBondContact O-N 2.95Å; S6-D8 PolarHBondContact OG-OD2 3.25Å; D8-L10 PolarHBondContact O-N 2.88Å
9	T	42.7	Very low	41.3	Very low	109 Å²	109	139.4 Å²	139.4	67%	0.669	77%	0.771	S	S	*	*			trans	-73.7	103.8	159.4	33.1	0	0	0	0	107.1	S7 H11	S7-T9 VanDerWaalsContact C-N 3.31Å; S7-T9 PolarHBondContact O-N 3.12Å; T9-H11 PolarHBondContact O-N 3.49Å
10	L	40.4	Very low	41.7	Very low	162 Å²	162	134.9 Å²	134.9	85%	0.848	76%	0.758	S	S	*	*			trans	-65.9	80.9	170.9	-72.3	169.6	0	0	0	109.6	D8 C12	D8-L10 PolarHBondContact O-N 2.88Å; L10-C12 PolarHBondContact O-N 3.47Å
11	H	39.3	Very low	42	Very low	144 Å²	144	134 Å²	134	67%	0.667	76%	0.758	S	S	*	*			trans	-71.2	109.6	162.7	-93.9	52.7	0	0	0	107.8	T9 N13	T9-H11 PolarHBondContact O-N 3.49Å; H11-N13 PolarHBondContact O-N 2.99Å
12	C	40.3	Very low	42.3	Very low	121 Å²	121	127.9 Å²	127.9	82%	0.818	73%	0.726	S	S	*	*			trans	-63.8	82.4	172	-76.3	0	0	0	0	110.7	L10 R14	L10-C12 PolarHBondContact O-N 3.47Å; C12-R14 PolarHBondContact O-N 3.47Å; C12-R14 VanDerWaalsContact O-N 3.09Å
13	N	46.3	Very low	42.9	Very low	108 Å²	108	127 Å²	127	58%	0.578	71%	0.708	S	S	*	*			trans	-82.2	37.9	175.9	-75	-26.4	0	0	0	112.6	H11 Y15 L16	H11-N13 PolarHBondContact O-N 2.99Å; N13-Y15 VanDerWaalsContact C-N 3.26Å; N13-Y15 PolarHBondContact O-N 2.64Å; N13-L16 HydrophobicContact CB-CD1 3.77Å; N13-L16 HydrophobicContact CB-CG 4.4Å
14	R	49.2	Very low	43.3	Very low	203 Å²	203	124.5 Å²	124.5	77%	0.766	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	-14.9	-172.3	-166.3	173.9	-72.5	177	-1.1	113.8	C12	C12-R14 PolarHBondContact O-N 3.47Å; C12-R14 VanDerWaalsContact O-N 3.09Å
15	Y	50.5	Low	43.5	Very low	160 Å²	160	122.2 Å²	122.2	63%	0.627	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-122	15.9	-171.8	-57.7	-67.1	0	0	0	116	N13 K17	N13-Y15 VanDerWaalsContact C-N 3.26Å; N13-Y15 PolarHBondContact O-N 2.64Å; Y15-K17 PolarHBondContact O-N 2.8Å; Y15-K17 VanDerWaalsContact O-N 3.16Å
16	L	43	Very low	43.7	Very low	138 Å²	138	117.8 Å²	117.8	72%	0.723	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.3	-2.9	-176.3	-72.9	176	0	0	0	115.6	N13	N13-L16 HydrophobicContact CB-CD1 3.77Å; N13-L16 HydrophobicContact CB-CG 4.4Å
17	K	46	Very low	44.3	Very low	192 Å²	192	120.5 Å²	120.5	84%	0.835	65%	0.65	S	S	*	*	T	Hydrogen-bonded Turn	trans	-110.1	16.9	-176.9	-69.3	-165.2	177.7	-176	0	115.5	Y15 Q19	Y15-K17 PolarHBondContact O-N 2.8Å; Y15-K17 VanDerWaalsContact O-N 3.16Å; K17-Q19 PolarHBondContact O-N 3.06Å
18	G	45.3	Very low	44.6	Very low	79 Å²	79	120.8 Å²	120.8	81%	0.814	65%	0.647	S	S	*	*	S	Bend	trans	63.8	9	174.1	0	0	0	0	0	115.1
19	Q	39.4	Very low	44.9	Very low	164 Å²	164	121 Å²	121	77%	0.766	65%	0.648	S	S	*	*			trans	-93.6	100	168.6	-67.4	-174	-14.3	0	0	106.9	K17	K17-Q19 PolarHBondContact O-N 3.06Å
20	G	50.1	Low	44.7	Very low	49 Å²	49	120.8 Å²	120.8	51%	0.505	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-58.4	168.1	162.5	0	0	0	0	0	110.5	Q22	G20-Q22 PolarHBondContact O-N 3.07Å
21	P	47.8	Very low	44.6	Very low	116 Å²	116	116.4 Å²	116.4	75%	0.753	64%	0.636	S	S	*	*	S	Bend	trans	-50	134.4	174.5	21	-31.3	0	0	0	110.2	S23	P21-S23 PolarHBondContact O-N 2.99Å
22	Q	44.3	Very low	44.7	Very low	117 Å²	117	115.6 Å²	115.6	55%	0.547	64%	0.635	S	S	.	*	P	Polyproline II helix	trans	-53.5	135.3	-176.2	-71.4	-175.4	-56.9	0	0	110.7	G20 R27	G20-Q22 PolarHBondContact O-N 3.07Å; Q22-R27 HydrophobicContact CB-CG 4.26Å
23	S	49.7	Very low	44.4	Very low	53 Å²	53	115.1 Å²	115.1	37%	0.371	63%	0.633	S	S	.	*	P	Polyproline II helix	trans	-61.2	147.8	177.6	64.9	0	0	0	0	110.9	P21 A25 Q26 R27	P21-S23 PolarHBondContact O-N 2.99Å; S23-A25 PolarHBondContact O-N 3.31Å; S23-A25 VanDerWaalsContact O-N 3.11Å; S23-Q26 VanDerWaalsContact N-OE1 3.08Å; S23-Q26 WeakPolarHBondContact O-CA 3.31Å; S23-Q26 WeakPolarHBondContact O-CB 3.27Å; S23-Q26 PolarHBondContact O-N 2.97Å; S23-Q26 VanDerWaalsContact OG-CD 3.31Å; S23-Q26 VanDerWaalsContact OG-CG 3.29Å; S23-Q26 WeakPolarHBondContact OG-CG 3.47Å; S23-Q26 PolarHBondContact OG-N 3.04Å; S23-Q26 PolarHBondContact OG-OE1 3.42Å; S23-R27 PolarHBondContact O-N 3.03Å; S23-R27 VanDerWaalsContact O-N 3.1Å
24	L	48.2	Very low	44.1	Very low	70 Å²	70	116.5 Å²	116.5	37%	0.366	63%	0.63	S	S	.	*	H	α-helix	trans	-55.7	-29.8	175.7	-70.3	169.1	0	0	0	112.1	R27 V28	L24-R27 PolarHBondContact O-N 2.96Å; L24-V28 VanDerWaalsContact O-CG2 3.27Å; L24-V28 WeakPolarHBondContact O-CG2 3.49Å; L24-V28 PolarHBondContact O-N 3.2Å
25	A	44.7	Very low	43.3	Very low	65 Å²	65	117.6 Å²	117.6	54%	0.537	63%	0.634	S	S	.	*	H	α-helix	trans	-67.1	-34.6	173.9	0	0	0	0	0	113.2	S23 N29	S23-A25 PolarHBondContact O-N 3.31Å; S23-A25 VanDerWaalsContact O-N 3.11Å; A25-N29 PolarHBondContact O-N 3.36Å; A25-N29 PolarHBondContact O-ND2 3.33Å
26	Q	40.1	Very low	42.6	Very low	99 Å²	99	115.1 Å²	115.1	46%	0.463	64%	0.636	S	S	.	*	H	α-helix	trans	-73.8	-38.4	175	-74.7	164.7	-48.9	0	0	111.6	S23 V28 N29 D30	S23-Q26 VanDerWaalsContact N-OE1 3.08Å; S23-Q26 WeakPolarHBondContact O-CA 3.31Å; S23-Q26 WeakPolarHBondContact O-CB 3.27Å; S23-Q26 PolarHBondContact O-N 2.97Å; S23-Q26 VanDerWaalsContact OG-CD 3.31Å; S23-Q26 VanDerWaalsContact OG-CG 3.29Å; S23-Q26 WeakPolarHBondContact OG-CG 3.47Å; S23-Q26 PolarHBondContact OG-N 3.04Å; S23-Q26 PolarHBondContact OG-OE1 3.42Å; Q26-V28 PolarHBondContact O-N 3.39Å; Q26-N29 PolarHBondContact O-N 3.21Å; Q26-N29 VanDerWaalsContact O-N 3.08Å; Q26-D30 PolarHBondContact O-N 2.93Å
27	R	49.2	Very low	42.3	Very low	141 Å²	141	114.5 Å²	114.5	53%	0.532	64%	0.638	S	S	.	*	H	α-helix	trans	-66.3	-22.6	176.1	-65.8	176.1	66.9	179	2.1	113.8	Q22 S23 L24	Q22-R27 HydrophobicContact CB-CG 4.26Å; S23-R27 PolarHBondContact O-N 3.03Å; S23-R27 VanDerWaalsContact O-N 3.1Å; L24-R27 PolarHBondContact O-N 2.96Å
28	V	44.9	Very low	42.1	Very low	117 Å²	117	110.7 Å²	110.7	71%	0.709	64%	0.635	S	S	*	*	H	α-helix	trans	-81.5	-25.9	173.6	170	0	0	0	0	111.9	L24 Q26	L24-V28 VanDerWaalsContact O-CG2 3.27Å; L24-V28 WeakPolarHBondContact O-CG2 3.49Å; L24-V28 PolarHBondContact O-N 3.2Å; Q26-V28 PolarHBondContact O-N 3.39Å
29	N	40.9	Very low	42.2	Very low	134 Å²	134	109.3 Å²	109.3	72%	0.717	61%	0.613	S	S	*	*	H	α-helix	trans	-94.8	-32.1	-176.2	-75.8	-24	0	0	0	113.8	A25 Q26 G31	A25-N29 PolarHBondContact O-N 3.36Å; A25-N29 PolarHBondContact O-ND2 3.33Å; Q26-N29 PolarHBondContact O-N 3.21Å; Q26-N29 VanDerWaalsContact O-N 3.08Å; N29-G31 PolarHBondContact O-N 3.31Å; N29-G31 VanDerWaalsContact O-N 3.08Å
30	D	39.6	Very low	43	Very low	105 Å²	105	106.5 Å²	106.5	56%	0.561	60%	0.604	S	S	*	*	S	Bend	trans	-78	93.1	171.1	-76	-20.6	0	0	0	108.2	Q26 M32	Q26-D30 PolarHBondContact O-N 2.93Å; D30-M32 PolarHBondContact O-N 2.94Å
31	G	38.6	Very low	44.1	Very low	69 Å²	69	108.4 Å²	108.4	71%	0.711	60%	0.598	S	S	*	*			trans	-44	104.7	-172.6	0	0	0	0	0	113.9	N29 S33	N29-G31 PolarHBondContact O-N 3.31Å; N29-G31 VanDerWaalsContact O-N 3.08Å; G31-S33 PolarHBondContact O-N 3.36Å
32	M	40.3	Very low	46	Very low	127 Å²	127	106 Å²	106	63%	0.626	57%	0.574	S	S	*	*			trans	-56.9	104.8	157.2	-106.1	83.4	-166.9	0	0	107.2	D30 W34	D30-M32 PolarHBondContact O-N 2.94Å; M32-W34 PolarHBondContact O-N 3.43Å
33	S	34.7	Very low	48.3	Very low	112 Å²	112	100.6 Å²	100.6	78%	0.783	55%	0.549	S	S	*	.			trans	-70.3	62.7	171.5	173.2	0	0	0	0	110.2	G31 R35	G31-S33 PolarHBondContact O-N 3.36Å; S33-R35 PolarHBondContact O-N 3.13Å
34	W	40	Very low	50.5	Low	136 Å²	136	98.2 Å²	98.2	52%	0.515	53%	0.533	S	S	.	.			trans	-75	114.3	152.3	46.2	-93.9	0	0	0	105.9	M32 T36 S39	M32-W34 PolarHBondContact O-N 3.43Å; W34-T36 HydrophobicContact CE3-CG2 4.12Å; W34-T36 HydrophobicContact CH2-CG2 3.85Å; W34-T36 HydrophobicContact CZ3-CG2 3.32Å; W34-T36 PolarHBondContact O-N 3.29Å; W34-T36 PolarHBondContact O-OG1 2.81Å; W34-S39 WeakPolarHBondContact CZ3-OG 3.43Å
35	R	32.9	Very low	52.6	Low	227 Å²	227	102.8 Å²	102.8	86%	0.857	55%	0.552	S	S	*	*			trans	-49.3	109.4	175.9	-74.5	173.2	146.3	-168.4	-6.6	108.7	S33 T37	S33-R35 PolarHBondContact O-N 3.13Å; R35-T37 PolarHBondContact O-N 2.91Å
36	T	35.7	Very low	55	Low	107 Å²	107	101.1 Å²	101.1	66%	0.656	54%	0.541	S	S	*	.			trans	-79.2	69.1	-171.9	-30.8	0	0	0	0	110.1	W34 S38	W34-T36 HydrophobicContact CE3-CG2 4.12Å; W34-T36 HydrophobicContact CH2-CG2 3.85Å; W34-T36 HydrophobicContact CZ3-CG2 3.32Å; W34-T36 PolarHBondContact O-N 3.29Å; W34-T36 PolarHBondContact O-OG1 2.81Å; T36-S38 PolarHBondContact O-N 3.22Å
37	T	36.3	Very low	57.7	Low	126 Å²	126	104 Å²	104	77%	0.773	55%	0.552	S	S	*	*	S	Bend	trans	-88.3	93.5	160.9	12.8	0	0	0	0	107.1	R35 S39	R35-T37 PolarHBondContact O-N 2.91Å; T37-S39 PolarHBondContact O-N 3.48Å
38	S	42.4	Very low	60	Low	111 Å²	111	99.4 Å²	99.4	78%	0.776	54%	0.537	S	S	*	.			trans	24.9	66.9	171.8	-71.1	0	0	0	0	114.9	T36 N40	T36-S38 PolarHBondContact O-N 3.22Å; S38-N40 PolarHBondContact O-N 3.23Å
39	S	47.2	Very low	62.5	Low	50 Å²	50	96.8 Å²	96.8	35%	0.35	52%	0.524	S	S	.	.			trans	-73.1	93.6	-179.2	56.8	0	0	0	0	109.6	W34 T37 F41	W34-S39 WeakPolarHBondContact CZ3-OG 3.43Å; T37-S39 PolarHBondContact O-N 3.48Å; S39-F41 PolarHBondContact O-N 2.97Å
40	N	56.2	Low	65.2	Low	106 Å²	106	93.9 Å²	93.9	57%	0.567	51%	0.508	S	S	*	.			trans	-64.9	106.8	167.6	-78	-34.4	0	0	0	108.2	S38 Y42 K80	S38-N40 PolarHBondContact O-N 3.23Å; N40-Y42 PolarHBondContact O-N 3.21Å; N40-K80 HydrophobicContact CB-CB 4.21Å; N40-K80 VanDerWaalsContact O-O 3.12Å
41	F	71.4	Confident	67.9	Low	89 Å²	89	93.4 Å²	93.4	39%	0.39	50%	0.502	S	S	.	.			trans	-65.4	106.6	170	-58.4	-74.5	0	0	0	108	S39 T121 A135	S39-F41 PolarHBondContact O-N 2.97Å; F41-T121 HydrophobicContact CD1-CG2 4.42Å; F41-A135 HydrophobicContact CB-CB 4.43Å; F41-A135 HydrophobicContact CD1-CB 3.82Å; F41-A135 HydrophobicContact CG-CB 4.39Å
42	Y	87.8	Confident	70.7	Confident	64 Å²	64	93.3 Å²	93.3	25%	0.251	49%	0.485	S	S	.	.			trans	-125.5	114.4	177.7	-161.6	-102.4	0	0	0	109.5	N40 K80 H81 Q117	N40-Y42 PolarHBondContact O-N 3.21Å; Y42-K80 HydrophobicContact CD1-CD 4.24Å; Y42-K80 HydrophobicContact CD2-CD 3.35Å; Y42-K80 HydrophobicContact CE2-CD 3.8Å; Y42-K80 HydrophobicContact CG-CB 4.08Å; Y42-K80 HydrophobicContact CG-CD 3.59Å; Y42-H81 AromaticContact CD1-NE2 3.58Å; Y42-H81 PolarHBondContact O-NE2 3.29Å; Y42-Q117 VanDerWaalsContact CE2-OE1 3.24Å
43	Q	94.1	Very high	73.2	Confident	4 Å²	4	89.4 Å²	89.4	2%	0.019	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-75.2	128.5	176.1	179.1	174.7	-64	0	0	109.8	F72 F114 Q117 F120	Q43-F72 HydrophobicContact CG-CE1 3.92Å; Q43-F72 HydrophobicContact CG-CZ 4.37Å; Q43-F114 PolarHBondContact NE2-O 3.49Å; Q43-Q117 HydrophobicContact CB-CB 3.75Å; Q43-Q117 HydrophobicContact CB-CG 4.25Å; Q43-Q117 WeakPolarHBondContact CB-O 3.43Å; Q43-F120 WeakPolarHBondContact CA-O 3.34Å; Q43-F120 VanDerWaalsContact CB-O 3.29Å; Q43-F120 WeakPolarHBondContact CB-O 3.45Å; Q43-F120 HydrophobicContact CG-CB 4.07Å; Q43-F120 PolarHBondContact N-O 2.98Å; Q43-F120 VanDerWaalsContact OE1-N 3.17Å
44	P	94.4	Very high	75.9	Confident	4 Å²	4	92 Å²	92	3%	0.026	47%	0.466	C	S	.	.	P	Polyproline II helix	trans	-61.3	156.6	169.9	-23	34.9	0	0	0	112.2	G46 F72 Y88 I122 I132	P44-G46 PolarHBondContact O-N 3.46Å; P44-F72 HydrophobicContact CB-CD1 4.24Å; P44-F72 WeakPolarHBondContact O-CE1 3.34Å; P44-Y88 HydrophobicContact CB-CE2 4.21Å; P44-Y88 HydrophobicContact CG-CE2 4.44Å; P44-I122 HydrophobicContact CG-CD1 3.81Å; P44-I122 HydrophobicContact CG-CG1 3.73Å; P44-I132 HydrophobicContact CB-CD1 4.43Å; P44-I132 HydrophobicContact CG-CD1 4.09Å; P44-I132 HydrophobicContact CG-CG1 4.2Å
45	E	93.6	Very high	78.2	Confident	165 Å²	165	89.9 Å²	89.9	77%	0.771	46%	0.46	S	S	*	.	S	Bend	trans	-60.4	133.8	172.6	-69.3	-173.4	178.1	0	0	111
46	G	95.4	Very high	80.9	Confident	30 Å²	30	83.7 Å²	83.7	31%	0.309	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160.8	177	-176.4	0	0	0	0	0	112.1	P44 I71	P44-G46 PolarHBondContact O-N 3.46Å; G46-I71 CarbonylContact C-O 3.56Å; G46-I71 WeakPolarHBondContact CA-O 3.29Å
47	K	97.3	Very high	83.3	Confident	161 Å²	161	78.9 Å²	78.9	70%	0.7	41%	0.41	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	141.5	176.5	-63.7	-179.2	-179	178.2	0	109.6	Y70 I71	K47-Y70 CarbonylContact O-C 3.46Å; K47-Y70 WeakPolarHBondContact O-CA 3.21Å; K47-I71 PolarHBondContact N-O 3.2Å; K47-I71 PolarHBondContact O-N 3.28Å
48	M	97.3	Very high	85.8	Confident	43 Å²	43	75.6 Å²	75.6	21%	0.212	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.8	132	170.9	-179.9	-176.3	178.1	0	0	108.1	I68 T69 Y70 L110 E111 F114	M48-I68 HydrophobicContact CE-CD1 4.48Å; M48-I68 HydrophobicContact CE-CG2 3.47Å; M48-I68 VanDerWaalsContact CE-CG2 3.47Å; M48-I68 HydrophobicContact CG-CG2 3.9Å; M48-I68 HydrophobicContact SD-CG2 4.48Å; M48-T69 CarbonylContact C-O 3.5Å; M48-T69 WeakPolarHBondContact CA-O 3.49Å; M48-Y70 HydrophobicContact CB-CD1 4.08Å; M48-Y70 HydrophobicContact CB-CE1 4.25Å; M48-Y70 HydrophobicContact CE-CE1 4.06Å; M48-Y70 HydrophobicContact CG-CD1 3.91Å; M48-Y70 HydrophobicContact CG-CE1 3.65Å; M48-Y70 HydrophobicContact SD-CD1 4.49Å; M48-Y70 HydrophobicContact SD-CE1 3.75Å; M48-L110 HydrophobicContact CE-CB 3.91Å; M48-E111 HydrophobicContact CE-CB 4.33Å; M48-E111 HydrophobicContact CE-CG 3.57Å; M48-E111 HydrophobicContact SD-CB 4.38Å; M48-E111 HydrophobicContact SD-CG 3.93Å; M48-F114 HydrophobicContact CB-CD1 3.69Å; M48-F114 HydrophobicContact CB-CD2 4.29Å; M48-F114 HydrophobicContact CB-CE1 3.75Å; M48-F114 HydrophobicContact CB-CE2 4.34Å; M48-F114 HydrophobicContact CB-CG 3.97Å; M48-F114 HydrophobicContact CB-CZ 4.08Å; M48-F114 HydrophobicContact SD-CB 3.69Å; M48-F114 HydrophobicContact SD-CD1 4.3Å; M48-F114 HydrophobicContact SD-CG 3.92Å
49	S	97.3	Very high	88	Confident	62 Å²	62	72.9 Å²	72.9	43%	0.434	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.3	153.5	174.8	59.2	0	0	0	0	111.1	I68 T69	S49-I68 CarbonylContact O-C 3.59Å; S49-I68 VanDerWaalsContact O-CA 3.29Å; S49-I68 WeakPolarHBondContact O-CA 3.46Å; S49-T69 PolarHBondContact N-O 3.44Å; S49-T69 PolarHBondContact O-N 2.91Å
50	L	97.4	Very high	89.9	Confident	74 Å²	74	72.1 Å²	72.1	39%	0.387	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	133.1	179	179.9	70.9	0	0	0	109.9	L66 I68 V107	L50-L66 HydrophobicContact CD1-CB 4.08Å; L50-L66 HydrophobicContact CD1-CD2 4.02Å; L50-L66 HydrophobicContact CD2-CD2 4.41Å; L50-L66 HydrophobicContact CG-CD2 4.5Å; L50-I68 HydrophobicContact CD1-CG1 3.79Å; L50-V107 HydrophobicContact CD1-CG1 4.2Å; L50-V107 HydrophobicContact CD1-CG2 4.25Å; L50-V107 HydrophobicContact CD2-CG1 4.14Å
51	E	96.4	Very high	91.5	Very high	94 Å²	94	71.1 Å²	71.1	44%	0.439	37%	0.37	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.5	138.5	174.6	-178.2	-179	-163.9	0	0	109.4	L53 K67	E51-L53 HydrophobicContact CG-CD2 3.91Å; E51-K67 HydrophobicContact CB-CB 4.38Å; E51-K67 PolarHBondContact N-O 2.67Å; E51-K67 PolarHBondContact O-N 2.9Å; E51-K67 IonicContact OE2-NZ 2.68Å
52	I	96.2	Very high	92.4	Very high	68 Å²	68	74.2 Å²	74.2	35%	0.349	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	115.5	172.2	-56.7	173.2	0	0	0	107.8	N64 L66	I52-N64 HydrophobicContact CG2-CB 4.23Å; I52-L66 HydrophobicContact CG1-CD2 3.88Å
53	L	93.1	Very high	92.6	Very high	44 Å²	44	71.7 Å²	71.7	23%	0.23	38%	0.383	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	125.7	173.8	-54.6	-178.6	0	0	0	109.2	E51 K55 N64 T65 K67 Y96	E51-L53 HydrophobicContact CG-CD2 3.91Å; L53-K55 HydrophobicContact CB-CB 4.43Å; L53-K55 PolarHBondContact O-N 2.92Å; L53-N64 WeakPolarHBondContact O-CB 3.43Å; L53-T65 PolarHBondContact N-O 2.85Å; L53-T65 PolarHBondContact O-N 3.26Å; L53-K67 HydrophobicContact CD1-CB 3.86Å; L53-K67 HydrophobicContact CD1-CD 4.09Å; L53-K67 HydrophobicContact CD2-CD 4.44Å; L53-K67 HydrophobicContact CG-CB 3.96Å; L53-Y96 HydrophobicContact CD1-CD1 4.34Å; L53-Y96 HydrophobicContact CD1-CE1 3.93Å
54	H	92.4	Very high	92.7	Very high	167 Å²	167	73.2 Å²	73.2	77%	0.773	39%	0.391	S	S	*	.	S	Bend	trans	-73.8	49.8	172.1	-61.4	-62.9	0	0	0	112.3
55	K	87.9	Confident	92.6	Very high	92 Å²	92	73.1 Å²	73.1	40%	0.4	39%	0.391	S	S	.	.			trans	-128.9	139.9	179.8	-179.4	167.7	-178.1	152.9	0	109.4	L53 N64 T65 I149	L53-K55 HydrophobicContact CB-CB 4.43Å; L53-K55 PolarHBondContact O-N 2.92Å; K55-N64 CarbonylContact O-C 3.53Å; K55-T65 WeakPolarHBondContact O-CB 3.37Å; K55-T65 PolarHBondContact O-N 3.36Å; K55-T65 PolarHBondContact O-OG1 2.79Å; K55-I149 HydrophobicContact CD-CG2 4.1Å
56	K	88.8	Confident	92.7	Very high	97 Å²	97	65.3 Å²	65.3	42%	0.422	35%	0.354	S	S	.	.	P	Polyproline II helix	trans	-87.3	138	176.2	-52.2	-52.5	-171.7	-178	0	109.6	P61 D62 A63 N64	K56-P61 WeakPolarHBondContact CD-O 3.4Å; K56-P61 VanDerWaalsContact CE-O 3.24Å; K56-P61 WeakPolarHBondContact CE-O 3.14Å; K56-P61 WeakPolarHBondContact CG-O 3.43Å; K56-D62 PolarHBondContact NZ-O 3.45Å; K56-A63 WeakPolarHBondContact CD-O 3.36Å; K56-A63 PolarHBondContact NZ-O 3.15Å; K56-N64 PolarHBondContact NZ-OD1 3.31Å
57	M	87.3	Confident	92.7	Very high	5 Å²	5	65 Å²	65	3%	0.025	34%	0.344	C	S	.	.	B	Isolated β-bridge	trans	-102.2	150.9	176.1	63.1	-176.2	-60.7	0	0	110.9	G59 F60 T65 P98 I150 Y153	M57-G59 PolarHBondContact O-N 3.48Å; M57-F60 HydrophobicContact CE-CD2 4.16Å; M57-F60 HydrophobicContact CE-CE2 4.47Å; M57-F60 HydrophobicContact CG-CB 3.84Å; M57-F60 HydrophobicContact CG-CD2 3.86Å; M57-F60 HydrophobicContact CG-CG 4.28Å; M57-F60 PolarHBondContact O-N 3.23Å; M57-F60 HydrophobicContact SD-CD2 3.92Å; M57-T65 HydrophobicContact SD-CG2 4.43Å; M57-P98 HydrophobicContact SD-CB 3.8Å; M57-P98 HydrophobicContact SD-CG 4.29Å; M57-I150 HydrophobicContact CB-CD1 3.44Å; M57-I150 VanDerWaalsContact CB-CD1 3.44Å; M57-I150 HydrophobicContact CE-CD1 4.49Å; M57-I150 HydrophobicContact CE-CG2 4.41Å; M57-Y153 HydrophobicContact CE-CD1 3.36Å; M57-Y153 HydrophobicContact CE-CD2 3.74Å; M57-Y153 HydrophobicContact CE-CE1 3.27Å; M57-Y153 HydrophobicContact CE-CE2 3.58Å; M57-Y153 HydrophobicContact CE-CG 3.57Å
58	P	87.6	Confident	92.6	Very high	57 Å²	57	57.3 Å²	57.3	37%	0.37	31%	0.311	S	S	.	.	T	Hydrogen-bonded Turn	trans	-52.1	129.8	175.6	-26.1	34.3	0	0	0	112.2	I150	P58-I150 HydrophobicContact CG-CG2 4.33Å
59	G	88.3	Confident	92.6	Very high	54 Å²	54	55.7 Å²	55.7	56%	0.557	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	87.1	-7.3	-177.9	0	0	0	0	0	115.8	M57	M57-G59 PolarHBondContact O-N 3.48Å
60	F	88.1	Confident	92.6	Very high	35 Å²	35	52.8 Å²	52.8	15%	0.154	28%	0.283	C	S	.	.	B	Isolated β-bridge	trans	-136.3	66.5	179	-59.4	-84.6	0	0	0	111.6	M57 D62 A63 P98 Y153 L159	M57-F60 HydrophobicContact CE-CD2 4.16Å; M57-F60 HydrophobicContact CE-CE2 4.47Å; M57-F60 HydrophobicContact CG-CB 3.84Å; M57-F60 HydrophobicContact CG-CD2 3.86Å; M57-F60 HydrophobicContact CG-CG 4.28Å; M57-F60 PolarHBondContact O-N 3.23Å; M57-F60 HydrophobicContact SD-CD2 3.92Å; F60-D62 VanDerWaalsContact C-N 3.27Å; F60-D62 PolarHBondContact O-N 2.9Å; F60-A63 HydrophobicContact CB-CB 4.34Å; F60-A63 PolarHBondContact O-N 3.43Å; F60-P98 HydrophobicContact CB-CB 3.82Å; F60-P98 HydrophobicContact CD1-CB 3.69Å; F60-P98 HydrophobicContact CD1-CG 3.74Å; F60-P98 HydrophobicContact CD2-CB 3.97Å; F60-P98 HydrophobicContact CD2-CG 3.99Å; F60-P98 HydrophobicContact CE1-CB 4.23Å; F60-P98 HydrophobicContact CE1-CG 3.73Å; F60-P98 HydrophobicContact CE2-CB 4.47Å; F60-P98 HydrophobicContact CE2-CG 3.98Å; F60-P98 HydrophobicContact CG-CB 3.55Å; F60-P98 HydrophobicContact CG-CG 3.87Å; F60-P98 HydrophobicContact CZ-CG 3.85Å; F60-Y153 HydrophobicContact CE2-CD1 4.08Å; F60-Y153 HydrophobicContact CE2-CE1 4.08Å; F60-L159 HydrophobicContact CZ-CD1 4.3Å
61	P	89.2	Confident	92.5	Very high	85 Å²	85	52.5 Å²	52.5	55%	0.552	28%	0.281	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.7	-28	-174.6	27.4	-35.1	0	0	0	113.6	K56	K56-P61 WeakPolarHBondContact CD-O 3.4Å; K56-P61 VanDerWaalsContact CE-O 3.24Å; K56-P61 WeakPolarHBondContact CE-O 3.14Å; K56-P61 WeakPolarHBondContact CG-O 3.43Å
62	D	91.4	Very high	92.5	Very high	154 Å²	154	48 Å²	48	82%	0.824	26%	0.26	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.2	-12.5	-175.5	-55.8	-52.8	0	0	0	113.2	K56 F60	K56-D62 PolarHBondContact NZ-O 3.45Å; F60-D62 VanDerWaalsContact C-N 3.27Å; F60-D62 PolarHBondContact O-N 2.9Å
63	A	92.2	Very high	92.5	Very high	11 Å²	11	47.9 Å²	47.9	9%	0.091	27%	0.269	C	S	.	.	S	Bend	trans	-106.8	144.2	-177.5	0	0	0	0	0	111.4	K56 F60 P98 N100	K56-A63 WeakPolarHBondContact CD-O 3.36Å; K56-A63 PolarHBondContact NZ-O 3.15Å; F60-A63 HydrophobicContact CB-CB 4.34Å; F60-A63 PolarHBondContact O-N 3.43Å; A63-P98 HydrophobicContact CB-CB 4.04Å; A63-N100 HydrophobicContact CB-CB 4.29Å
64	N	94.8	Very high	92.6	Very high	36 Å²	36	53.7 Å²	53.7	19%	0.193	29%	0.293	C	S	.	.			trans	-71.2	-175.5	166.4	-57.8	-39.6	0	0	0	109.9	I52 L53 K55 K56 P98 E99	I52-N64 HydrophobicContact CG2-CB 4.23Å; L53-N64 WeakPolarHBondContact O-CB 3.43Å; K55-N64 CarbonylContact O-C 3.53Å; K56-N64 PolarHBondContact NZ-OD1 3.31Å; N64-P98 CarbonylContact O-C 3.57Å; N64-E99 HydrophobicContact CB-CB 3.96Å; N64-E99 VanDerWaalsContact CB-OE2 3.22Å; N64-E99 WeakPolarHBondContact CB-OE2 3.36Å; N64-E99 PolarHBondContact ND2-OE2 2.92Å; N64-E99 WeakPolarHBondContact O-CB 3.34Å; N64-E99 PolarHBondContact O-N 3.39Å
65	T	94	Very high	92.7	Very high	2 Å²	2	46.7 Å²	46.7	1%	0.012	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	127.4	179.6	-55.8	0	0	0	0	110.3	L53 K55 M57 Y96 L97	L53-T65 PolarHBondContact N-O 2.85Å; L53-T65 PolarHBondContact O-N 3.26Å; K55-T65 WeakPolarHBondContact O-CB 3.37Å; K55-T65 PolarHBondContact O-N 3.36Å; K55-T65 PolarHBondContact O-OG1 2.79Å; M57-T65 HydrophobicContact SD-CG2 4.43Å; T65-Y96 HydrophobicContact CG2-CD1 3.81Å; T65-Y96 HydrophobicContact CG2-CG 4.33Å; T65-L97 CarbonylContact C-O 3.59Å
66	L	95.4	Very high	93	Very high	1 Å²	1	47.3 Å²	47.3	1%	0.005	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.9	114	167	-64.5	167.5	0	0	0	108.3	L50 I52 Y96 L97 E99 R104 V107	L50-L66 HydrophobicContact CD1-CB 4.08Å; L50-L66 HydrophobicContact CD1-CD2 4.02Å; L50-L66 HydrophobicContact CD2-CD2 4.41Å; L50-L66 HydrophobicContact CG-CD2 4.5Å; I52-L66 HydrophobicContact CG1-CD2 3.88Å; L66-Y96 WeakPolarHBondContact O-CA 3.4Å; L66-L97 HydrophobicContact CB-CB 4.33Å; L66-L97 WeakPolarHBondContact CB-O 3.14Å; L66-L97 PolarHBondContact N-O 2.82Å; L66-L97 PolarHBondContact O-N 3.07Å; L66-E99 HydrophobicContact CD1-CB 4.43Å; L66-E99 HydrophobicContact CD1-CG 4.5Å; L66-E99 HydrophobicContact CD2-CB 4.34Å; L66-E99 HydrophobicContact CD2-CG 4.04Å; L66-E99 HydrophobicContact CG-CB 3.97Å; L66-E99 HydrophobicContact CG-CG 4.17Å; L66-R104 HydrophobicContact CD1-CG 3.96Å; L66-V107 HydrophobicContact CD1-CG2 3.85Å
67	K	94.6	Very high	93.3	Very high	23 Å²	23	42.9 Å²	42.9	10%	0.1	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.7	123	170.7	176.2	-177	170.9	-163.5	0	108.5	E51 L53 C94 Y96 E144	E51-K67 HydrophobicContact CB-CB 4.38Å; E51-K67 PolarHBondContact N-O 2.67Å; E51-K67 PolarHBondContact O-N 2.9Å; E51-K67 IonicContact OE2-NZ 2.68Å; L53-K67 HydrophobicContact CD1-CB 3.86Å; L53-K67 HydrophobicContact CD1-CD 4.09Å; L53-K67 HydrophobicContact CD2-CD 4.44Å; L53-K67 HydrophobicContact CG-CB 3.96Å; K67-C94 WeakPolarHBondContact CE-SG 3.46Å; K67-C94 HydrophobicContact CG-CB 4.4Å; K67-Y96 HydrophobicContact CB-CD1 3.96Å; K67-Y96 HydrophobicContact CB-CE1 3.82Å; K67-Y96 HydrophobicContact CD-CE1 3.88Å; K67-Y96 HydrophobicContact CG-CD1 4.16Å; K67-Y96 HydrophobicContact CG-CE1 3.62Å; K67-E144 WeakPolarHBondContact CE-OE1 3.28Å; K67-E144 IonicContact NZ-OE1 2.74Å; K67-E144 PolarHBondContact NZ-OE1 3.34Å
68	I	96.3	Very high	93.5	Very high	0 Å²	0	45.4 Å²	45.4	0%	0	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	121.1	175.4	-53.3	167	0	0	0	107.3	M48 S49 L50 Y70 C94 T95 L97 V107 L110	M48-I68 HydrophobicContact CE-CD1 4.48Å; M48-I68 HydrophobicContact CE-CG2 3.47Å; M48-I68 VanDerWaalsContact CE-CG2 3.47Å; M48-I68 HydrophobicContact CG-CG2 3.9Å; M48-I68 HydrophobicContact SD-CG2 4.48Å; S49-I68 CarbonylContact O-C 3.59Å; S49-I68 VanDerWaalsContact O-CA 3.29Å; S49-I68 WeakPolarHBondContact O-CA 3.46Å; L50-I68 HydrophobicContact CD1-CG1 3.79Å; I68-Y70 HydrophobicContact CB-CE2 4.46Å; I68-Y70 HydrophobicContact CG2-CD2 4.5Å; I68-Y70 HydrophobicContact CG2-CE1 4.01Å; I68-Y70 HydrophobicContact CG2-CE2 3.84Å; I68-C94 CarbonylContact O-C 3.59Å; I68-C94 WeakPolarHBondContact O-CA 3.4Å; I68-T95 HydrophobicContact CB-CG2 3.8Å; I68-T95 HydrophobicContact CD1-CG2 3.77Å; I68-T95 HydrophobicContact CG1-CG2 4.22Å; I68-T95 HydrophobicContact CG2-CG2 4.47Å; I68-T95 PolarHBondContact N-O 3.28Å; I68-T95 PolarHBondContact O-N 2.95Å; I68-L97 HydrophobicContact CD1-CD1 3.85Å; I68-L97 HydrophobicContact CD1-CG 4.41Å; I68-V107 HydrophobicContact CD1-CG2 3.82Å; I68-V107 HydrophobicContact CG1-CG2 4.37Å; I68-L110 HydrophobicContact CD1-CD1 3.67Å
69	T	96.1	Very high	93.7	Very high	9 Å²	9	50.6 Å²	50.6	6%	0.055	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105	129.6	179.1	-53.8	0	0	0	0	109.6	M48 S49 I71 Q92	M48-T69 CarbonylContact C-O 3.5Å; M48-T69 WeakPolarHBondContact CA-O 3.49Å; S49-T69 PolarHBondContact N-O 3.44Å; S49-T69 PolarHBondContact O-N 2.91Å; T69-I71 HydrophobicContact CG2-CD1 4.21Å; T69-I71 HydrophobicContact CG2-CG1 3.84Å; T69-Q92 HydrophobicContact CG2-CG 4.11Å
70	Y	96.9	Very high	93.6	Very high	0 Å²	0	52.7 Å²	52.7	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	125.3	171.2	-52.3	-84.4	0	0	0	109.1	K47 M48 I68 Q92 V93 T95 F114 L119 F120	K47-Y70 CarbonylContact O-C 3.46Å; K47-Y70 WeakPolarHBondContact O-CA 3.21Å; M48-Y70 HydrophobicContact CB-CD1 4.08Å; M48-Y70 HydrophobicContact CB-CE1 4.25Å; M48-Y70 HydrophobicContact CE-CE1 4.06Å; M48-Y70 HydrophobicContact CG-CD1 3.91Å; M48-Y70 HydrophobicContact CG-CE1 3.65Å; M48-Y70 HydrophobicContact SD-CD1 4.49Å; M48-Y70 HydrophobicContact SD-CE1 3.75Å; I68-Y70 HydrophobicContact CB-CE2 4.46Å; I68-Y70 HydrophobicContact CG2-CD2 4.5Å; I68-Y70 HydrophobicContact CG2-CE1 4.01Å; I68-Y70 HydrophobicContact CG2-CE2 3.84Å; Y70-Q92 WeakPolarHBondContact O-CA 3.3Å; Y70-V93 HydrophobicContact CD2-CG2 4.14Å; Y70-V93 PolarHBondContact N-O 2.87Å; Y70-V93 PolarHBondContact O-N 3.32Å; Y70-T95 HydrophobicContact CE2-CG2 3.9Å; Y70-F114 AromaticContact CD1-CD2 3.63Å; Y70-F114 HydrophobicContact CD1-CD2 3.63Å; Y70-F114 AromaticContact CD1-CE2 3.63Å; Y70-F114 HydrophobicContact CD1-CE2 3.63Å; Y70-F114 AromaticContact CE1-CD2 3.78Å; Y70-F114 HydrophobicContact CE1-CD2 3.78Å; Y70-F114 HydrophobicContact CE1-CE2 4.27Å; Y70-F114 HydrophobicContact CE1-CG 4.45Å; Y70-L119 HydrophobicContact CE1-CD1 3.87Å; Y70-F120 AromaticContact CD1-CE2 3.67Å; Y70-F120 HydrophobicContact CD1-CE2 3.67Å; Y70-F120 HydrophobicContact CD1-CZ 4.21Å; Y70-F120 AromaticContact CD2-CE2 3.95Å; Y70-F120 HydrophobicContact CD2-CE2 3.95Å; Y70-F120 AromaticContact CD2-CZ 3.63Å; Y70-F120 HydrophobicContact CD2-CZ 3.63Å; Y70-F120 AromaticContact CE1-CE2 3.92Å; Y70-F120 HydrophobicContact CE1-CE2 3.92Å; Y70-F120 HydrophobicContact CE2-CE2 4.18Å; Y70-F120 AromaticContact CE2-CZ 3.96Å; Y70-F120 HydrophobicContact CE2-CZ 3.96Å; Y70-F120 AromaticContact CG-CE2 3.66Å; Y70-F120 HydrophobicContact CG-CE2 3.66Å; Y70-F120 AromaticContact CG-CZ 3.74Å; Y70-F120 HydrophobicContact CG-CZ 3.74Å
71	I	96.1	Very high	93.7	Very high	68 Å²	68	51.7 Å²	51.7	35%	0.349	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	118.8	-179.1	-53.3	178.5	0	0	0	108.7	G46 K47 T69 Q92	G46-I71 CarbonylContact C-O 3.56Å; G46-I71 WeakPolarHBondContact CA-O 3.29Å; K47-I71 PolarHBondContact N-O 3.2Å; K47-I71 PolarHBondContact O-N 3.28Å; T69-I71 HydrophobicContact CG2-CD1 4.21Å; T69-I71 HydrophobicContact CG2-CG1 3.84Å; I71-Q92 HydrophobicContact CG1-CG 4.19Å
72	F	96.3	Very high	93.8	Very high	1 Å²	1	50.5 Å²	50.5	0%	0.004	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	126	174.4	-58.2	-84	0	0	0	108.8	Q43 P44 Q90 R91 F114 F120 I132	Q43-F72 HydrophobicContact CG-CE1 3.92Å; Q43-F72 HydrophobicContact CG-CZ 4.37Å; P44-F72 HydrophobicContact CB-CD1 4.24Å; P44-F72 WeakPolarHBondContact O-CE1 3.34Å; F72-Q90 CarbonylContact O-C 3.56Å; F72-Q90 VanDerWaalsContact O-CA 3.32Å; F72-Q90 WeakPolarHBondContact O-CA 3.46Å; F72-Q90 WeakPolarHBondContact O-CB 3.29Å; F72-R91 HydrophobicContact CB-CB 4.39Å; F72-R91 HydrophobicContact CD2-CB 4.4Å; F72-R91 PolarHBondContact N-O 3.09Å; F72-R91 PolarHBondContact O-N 3.48Å; F72-F114 HydrophobicContact CE1-CE2 4.05Å; F72-F114 HydrophobicContact CE1-CZ 4.35Å; F72-F114 AromaticContact CZ-CE2 3.81Å; F72-F114 HydrophobicContact CZ-CE2 3.81Å; F72-F114 HydrophobicContact CZ-CZ 4.48Å; F72-F120 HydrophobicContact CE2-CD1 4.24Å; F72-F120 HydrophobicContact CE2-CD2 4.01Å; F72-F120 HydrophobicContact CE2-CE1 4.45Å; F72-F120 HydrophobicContact CE2-CE2 4.22Å; F72-F120 HydrophobicContact CE2-CG 4.02Å; F72-F120 HydrophobicContact CE2-CZ 4.44Å; F72-F120 HydrophobicContact CZ-CB 4.01Å; F72-F120 HydrophobicContact CZ-CD1 4.38Å; F72-F120 AromaticContact CZ-CD2 3.49Å; F72-F120 HydrophobicContact CZ-CD2 3.49Å; F72-F120 VanDerWaalsContact CZ-CD2 3.49Å; F72-F120 HydrophobicContact CZ-CE2 4.02Å; F72-F120 AromaticContact CZ-CG 3.71Å; F72-F120 HydrophobicContact CZ-CG 3.71Å; F72-I132 HydrophobicContact CB-CD1 3.3Å; F72-I132 HydrophobicContact CD1-CD1 4.23Å; F72-I132 HydrophobicContact CD2-CD1 4.07Å; F72-I132 HydrophobicContact CD2-CG2 3.89Å; F72-I132 HydrophobicContact CE2-CG2 3.89Å; F72-I132 HydrophobicContact CG-CD1 3.62Å; F72-I132 HydrophobicContact CG-CG2 4.28Å; F72-I132 HydrophobicContact CZ-CG2 4.3Å
73	A	95.9	Very high	93.8	Very high	65 Å²	65	46.4 Å²	46.4	54%	0.537	25%	0.246	S	C	.	.			trans	-71.8	158.2	172.6	0	0	0	0	0	110.2	Y88	A73-Y88 VanDerWaalsContact O-CE2 3.26Å; A73-Y88 WeakPolarHBondContact O-CE2 3.45Å
74	K	95.4	Very high	93.9	Very high	166 Å²	166	48.5 Å²	48.5	72%	0.722	26%	0.258	S	S	*	.			trans	-58.1	146.1	167	67.9	-179.7	-178.3	-179.4	0	109.6	Y88 Q90	K74-Y88 WeakPolarHBondContact CA-O 3.4Å; K74-Y88 WeakPolarHBondContact CB-O 3.42Å; K74-Q90 HydrophobicContact CB-CB 4.35Å
75	G	94.8	Very high	93.9	Very high	20 Å²	20	49.4 Å²	49.4	21%	0.206	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.6	-168.1	-179.4	0	0	0	0	0	112.6	P87 Y88	G75-P87 CarbonylContact O-C 3.53Å; G75-P87 VanDerWaalsContact O-CA 3.28Å; G75-P87 WeakPolarHBondContact O-CA 3.24Å; G75-Y88 VanDerWaalsContact CA-CZ 3.46Å; G75-Y88 PolarHBondContact N-O 2.9Å; G75-Y88 WeakPolarHBondContact O-CD1 3.32Å; G75-Y88 PolarHBondContact O-N 2.93Å
76	I	94.9	Very high	93.9	Very high	104 Å²	104	54 Å²	54	53%	0.533	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	137.3	178.3	-57.5	-59.1	0	0	0	109	P87	I76-P87 HydrophobicContact CD1-CB 4.02Å
77	Q	93.9	Very high	93.9	Very high	5 Å²	5	58.3 Å²	58.3	2%	0.023	33%	0.325	C	S	.	.			trans	-67.3	135.2	178.7	-74.4	-173.2	63.9	0	0	111.7	H81 H83 G85 Q86 Y88 I122 D130	Q77-H81 WeakPolarHBondContact CA-ND1 3.35Å; Q77-H81 HydrophobicContact CB-CB 3.83Å; Q77-H81 HydrophobicContact CG-CB 3.96Å; Q77-H83 WeakPolarHBondContact CB-O 3.24Å; Q77-H83 PolarHBondContact OE1-O 2.86Å; Q77-G85 PolarHBondContact O-N 3.19Å; Q77-Q86 WeakPolarHBondContact CB-O 3.36Å; Q77-Q86 WeakPolarHBondContact CG-O 3.39Å; Q77-Q86 PolarHBondContact N-O 2.98Å; Q77-Y88 HydrophobicContact CG-CD1 3.96Å; Q77-I122 HydrophobicContact CG-CD1 3.9Å; Q77-I122 HydrophobicContact CG-CG2 4.46Å; Q77-D130 PolarHBondContact NE2-OD2 3.07Å
78	T	91.8	Very high	93.9	Very high	58 Å²	58	58.5 Å²	58.5	36%	0.356	33%	0.325	S	S	.	.			trans	-88	173.4	176.3	72.6	0	0	0	0	110.5	K80 H81	T78-K80 PolarHBondContact O-N 2.7Å; T78-K80 PolarHBondContact OG1-N 2.69Å; T78-H81 PolarHBondContact N-ND1 3.38Å; T78-H81 VanDerWaalsContact N-ND1 3.12Å; T78-H81 WeakPolarHBondContact O-CB 3.45Å; T78-H81 PolarHBondContact O-N 3.14Å
79	E	90.9	Very high	93.8	Very high	166 Å²	166	62 Å²	62	78%	0.776	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.7	-12.4	171.9	-60.6	-56.4	138.4	0	0	114.4
80	K	87.3	Confident	93.7	Very high	98 Å²	98	68.7 Å²	68.7	43%	0.426	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.8	-3.7	176.9	-59.2	178.4	-177.9	175.8	0	113.3	N40 Y42 T78	N40-K80 HydrophobicContact CB-CB 4.21Å; N40-K80 VanDerWaalsContact O-O 3.12Å; Y42-K80 HydrophobicContact CD1-CD 4.24Å; Y42-K80 HydrophobicContact CD2-CD 3.35Å; Y42-K80 HydrophobicContact CE2-CD 3.8Å; Y42-K80 HydrophobicContact CG-CB 4.08Å; Y42-K80 HydrophobicContact CG-CD 3.59Å; T78-K80 PolarHBondContact O-N 2.7Å; T78-K80 PolarHBondContact OG1-N 2.69Å
81	H	90.4	Very high	93.5	Very high	14 Å²	14	71 Å²	71	7%	0.065	39%	0.394	C	S	.	.	S	Bend	trans	-105.4	165.8	-177.9	-60.2	156.6	0	0	0	111.4	Y42 Q77 T78 H83	Y42-H81 AromaticContact CD1-NE2 3.58Å; Y42-H81 PolarHBondContact O-NE2 3.29Å; Q77-H81 WeakPolarHBondContact CA-ND1 3.35Å; Q77-H81 HydrophobicContact CB-CB 3.83Å; Q77-H81 HydrophobicContact CG-CB 3.96Å; T78-H81 PolarHBondContact N-ND1 3.38Å; T78-H81 VanDerWaalsContact N-ND1 3.12Å; T78-H81 WeakPolarHBondContact O-CB 3.45Å; T78-H81 PolarHBondContact O-N 3.14Å; H81-H83 VanDerWaalsContact C-N 3.32Å; H81-H83 PolarHBondContact O-N 2.93Å
82	P	90.6	Very high	93.4	Very high	59 Å²	59	71.4 Å²	71.4	38%	0.383	39%	0.394	S	S	.	.	S	Bend	trans	-57.9	-38.2	-176.1	-26.4	35.2	0	0	0	114.7	I122	P82-I122 WeakPolarHBondContact CD-O 3.41Å
83	H	92.3	Very high	93.3	Very high	69 Å²	69	71.4 Å²	71.4	32%	0.319	39%	0.394	S	S	.	.	S	Bend	trans	-130.2	79.9	-177.2	-56.9	125.8	0	0	0	111.5	Q77 H81 G85 Q86 T124 D130	Q77-H83 WeakPolarHBondContact CB-O 3.24Å; Q77-H83 PolarHBondContact OE1-O 2.86Å; H81-H83 VanDerWaalsContact C-N 3.32Å; H81-H83 PolarHBondContact O-N 2.93Å; H83-G85 PolarHBondContact O-N 3.39Å; H83-Q86 HydrophobicContact CB-CB 4.11Å; H83-Q86 HydrophobicContact CB-CG 3.87Å; H83-Q86 WeakPolarHBondContact O-CB 3.18Å; H83-Q86 PolarHBondContact O-N 2.81Å; H83-Q86 VanDerWaalsContact O-N 3.13Å; H83-T124 PolarHBondContact CE1-OG1 2.82Å; H83-D130 IonicContact CE1-OD1 3.55Å; H83-D130 IonicContact CE1-OD2 3.76Å; H83-D130 IonicContact CG-OD2 3.81Å; H83-D130 VanDerWaalsContact ND1-CG 3.29Å; H83-D130 IonicContact ND1-OD1 3.6Å; H83-D130 PolarHBondContact ND1-OD1 2.95Å; H83-D130 VanDerWaalsContact ND1-OD1 3.14Å; H83-D130 IonicContact ND1-OD2 2.66Å; H83-D130 PolarHBondContact ND1-OD2 2.94Å
84	P	93.8	Very high	93.1	Very high	54 Å²	54	68.3 Å²	68.3	35%	0.351	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-53.6	138.9	-179.1	-25.7	35	0	0	0	112.9	Q86	P84-Q86 PolarHBondContact O-N 2.99Å
85	G	94.4	Very high	93	Very high	55 Å²	55	60.4 Å²	60.4	57%	0.567	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	80.2	-12.3	-178	0	0	0	0	0	115.2	Q77 H83	Q77-G85 PolarHBondContact O-N 3.19Å; H83-G85 PolarHBondContact O-N 3.39Å
86	Q	94.5	Very high	92.9	Very high	98 Å²	98	60.8 Å²	60.8	46%	0.458	33%	0.33	S	S	.	.			trans	-80.9	147.7	175	-63.1	-164.3	19.2	0	0	112	Q77 H83 P84	Q77-Q86 WeakPolarHBondContact CB-O 3.36Å; Q77-Q86 WeakPolarHBondContact CG-O 3.39Å; Q77-Q86 PolarHBondContact N-O 2.98Å; H83-Q86 HydrophobicContact CB-CB 4.11Å; H83-Q86 HydrophobicContact CB-CG 3.87Å; H83-Q86 WeakPolarHBondContact O-CB 3.18Å; H83-Q86 PolarHBondContact O-N 2.81Å; H83-Q86 VanDerWaalsContact O-N 3.13Å; P84-Q86 PolarHBondContact O-N 2.99Å
87	P	95.1	Very high	92.8	Very high	92 Å²	92	55.9 Å²	55.9	60%	0.597	30%	0.304	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	154.1	174.7	31.5	-34.9	0	0	0	111.6	G75 I76	G75-P87 CarbonylContact O-C 3.53Å; G75-P87 VanDerWaalsContact O-CA 3.28Å; G75-P87 WeakPolarHBondContact O-CA 3.24Å; I76-P87 HydrophobicContact CD1-CB 4.02Å
88	Y	94.1	Very high	92.9	Very high	27 Å²	27	55.6 Å²	55.6	11%	0.106	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.7	148.8	164.6	63.6	-92.6	0	0	0	109.9	P44 A73 K74 G75 Q77 I122 I132	P44-Y88 HydrophobicContact CB-CE2 4.21Å; P44-Y88 HydrophobicContact CG-CE2 4.44Å; A73-Y88 VanDerWaalsContact O-CE2 3.26Å; A73-Y88 WeakPolarHBondContact O-CE2 3.45Å; K74-Y88 WeakPolarHBondContact CA-O 3.4Å; K74-Y88 WeakPolarHBondContact CB-O 3.42Å; G75-Y88 VanDerWaalsContact CA-CZ 3.46Å; G75-Y88 PolarHBondContact N-O 2.9Å; G75-Y88 WeakPolarHBondContact O-CD1 3.32Å; G75-Y88 PolarHBondContact O-N 2.93Å; Q77-Y88 HydrophobicContact CG-CD1 3.96Å; Y88-I122 HydrophobicContact CD1-CD1 3.31Å; Y88-I122 HydrophobicContact CD2-CD1 4.07Å; Y88-I122 HydrophobicContact CE1-CD1 3.72Å; Y88-I122 HydrophobicContact CE2-CD1 4.43Å; Y88-I122 HydrophobicContact CG-CD1 3.51Å; Y88-I132 HydrophobicContact CD2-CD1 3.9Å; Y88-I132 HydrophobicContact CD2-CG1 4.25Å; Y88-I132 HydrophobicContact CE2-CD1 3.86Å
89	A	93.3	Very high	93.1	Very high	73 Å²	73	55.2 Å²	55.2	60%	0.603	30%	0.297	S	S	*	.			trans	-73.5	155.5	-177.3	0	0	0	0	0	112.1
90	Q	94.4	Very high	93.2	Very high	151 Å²	151	49.5 Å²	49.5	71%	0.706	27%	0.272	S	S	*	.			trans	-60	150.3	168	66.7	179.4	-17.7	0	0	110.3	F72 K74	F72-Q90 CarbonylContact O-C 3.56Å; F72-Q90 VanDerWaalsContact O-CA 3.32Å; F72-Q90 WeakPolarHBondContact O-CA 3.46Å; F72-Q90 WeakPolarHBondContact O-CB 3.29Å; K74-Q90 HydrophobicContact CB-CB 4.35Å
91	R	93.4	Very high	93.6	Very high	48 Å²	48	53 Å²	53	18%	0.181	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.5	131.2	-179.1	-168.5	69.7	173.1	103.3	1.1	111.1	F72 V93 I132 H143	F72-R91 HydrophobicContact CB-CB 4.39Å; F72-R91 HydrophobicContact CD2-CB 4.4Å; F72-R91 PolarHBondContact N-O 3.09Å; F72-R91 PolarHBondContact O-N 3.48Å; R91-V93 HydrophobicContact CG-CG1 4.21Å; R91-V93 VanDerWaalsContact NH1-CG1 3.26Å; R91-I132 HydrophobicContact CB-CB 4.17Å; R91-I132 HydrophobicContact CB-CD1 3.99Å; R91-I132 HydrophobicContact CB-CG1 4.46Å; R91-I132 HydrophobicContact CG-CB 4.23Å; R91-H143 PolarHBondContact NH1-CE1 3.46Å; R91-H143 PolarHBondContact NH1-ND1 3.19Å; R91-H143 PolarHBondContact NH2-CD2 2.94Å; R91-H143 PolarHBondContact NH2-CE1 3.1Å; R91-H143 PolarHBondContact NH2-NE2 3.49Å
92	Q	94.4	Very high	93.8	Very high	76 Å²	76	55.3 Å²	55.3	36%	0.355	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	123.8	170.7	-178.8	157	-23.8	0	0	109.2	T69 Y70 I71 E144	T69-Q92 HydrophobicContact CG2-CG 4.11Å; Y70-Q92 WeakPolarHBondContact O-CA 3.3Å; I71-Q92 HydrophobicContact CG1-CG 4.19Å; Q92-E144 PolarHBondContact NE2-OE2 3.3Å
93	V	93	Very high	94	Very high	2 Å²	2	52.5 Å²	52.5	1%	0.012	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.9	148.7	178.7	-70	0	0	0	0	110.3	Y70 R91 F120 I141	Y70-V93 HydrophobicContact CD2-CG2 4.14Å; Y70-V93 PolarHBondContact N-O 2.87Å; Y70-V93 PolarHBondContact O-N 3.32Å; R91-V93 HydrophobicContact CG-CG1 4.21Å; R91-V93 VanDerWaalsContact NH1-CG1 3.26Å; V93-F120 HydrophobicContact CG2-CE1 4.01Å; V93-F120 HydrophobicContact CG2-CZ 4.1Å; V93-I141 HydrophobicContact CB-CB 4.24Å; V93-I141 HydrophobicContact CB-CG2 4.46Å; V93-I141 HydrophobicContact CG1-CB 4.49Å; V93-I141 HydrophobicContact CG1-CD1 4.29Å; V93-I141 HydrophobicContact CG2-CG2 4.34Å
94	C	92.9	Very high	94.2	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	150.5	176.2	-59.4	0	0	0	0	110.6	K67 I68 Y96 I141 Q142	K67-C94 WeakPolarHBondContact CE-SG 3.46Å; K67-C94 HydrophobicContact CG-CB 4.4Å; I68-C94 CarbonylContact O-C 3.59Å; I68-C94 WeakPolarHBondContact O-CA 3.4Å; C94-Y96 HydrophobicContact CB-CE2 3.98Å; C94-I141 CarbonylContact O-C 3.59Å; C94-I141 VanDerWaalsContact O-CA 3.32Å; C94-I141 WeakPolarHBondContact O-CA 3.48Å; C94-Q142 PolarHBondContact N-O 2.96Å; C94-Q142 PolarHBondContact O-N 2.93Å
95	T	92.8	Very high	94.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	149.6	161.3	-166.2	0	0	0	0	109.8	I68 Y70 K140	I68-T95 HydrophobicContact CB-CG2 3.8Å; I68-T95 HydrophobicContact CD1-CG2 3.77Å; I68-T95 HydrophobicContact CG1-CG2 4.22Å; I68-T95 HydrophobicContact CG2-CG2 4.47Å; I68-T95 PolarHBondContact N-O 3.28Å; I68-T95 PolarHBondContact O-N 2.95Å; Y70-T95 HydrophobicContact CE2-CG2 3.9Å; T95-K140 WeakPolarHBondContact CA-O 3.43Å; T95-K140 VanDerWaalsContact CB-O 3.24Å; T95-K140 WeakPolarHBondContact CB-O 3.45Å; T95-K140 PolarHBondContact OG1-O 2.89Å
96	Y	92.5	Very high	94.4	Very high	28 Å²	28	52.1 Å²	52.1	11%	0.11	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	128.3	-174	-60	-85.3	0	0	0	109.9	L53 T65 L66 K67 C94 Q142 I150 Y153	L53-Y96 HydrophobicContact CD1-CD1 4.34Å; L53-Y96 HydrophobicContact CD1-CE1 3.93Å; T65-Y96 HydrophobicContact CG2-CD1 3.81Å; T65-Y96 HydrophobicContact CG2-CG 4.33Å; L66-Y96 WeakPolarHBondContact O-CA 3.4Å; K67-Y96 HydrophobicContact CB-CD1 3.96Å; K67-Y96 HydrophobicContact CB-CE1 3.82Å; K67-Y96 HydrophobicContact CD-CE1 3.88Å; K67-Y96 HydrophobicContact CG-CD1 4.16Å; K67-Y96 HydrophobicContact CG-CE1 3.62Å; C94-Y96 HydrophobicContact CB-CE2 3.98Å; Y96-Q142 HydrophobicContact CE2-CB 4.15Å; Y96-Q142 HydrophobicContact CE2-CG 4.47Å; Y96-I150 HydrophobicContact CG-CG1 4.43Å; Y96-Y153 PolarHBondContact O-OH 3.17Å
97	L	93.9	Very high	94.5	Very high	0 Å²	0	47.8 Å²	47.8	0%	0	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.3	153.6	177.5	-53.5	178	0	0	0	109.3	T65 L66 I68 V106 V107 L110 Y158 L159	T65-L97 CarbonylContact C-O 3.59Å; L66-L97 HydrophobicContact CB-CB 4.33Å; L66-L97 WeakPolarHBondContact CB-O 3.14Å; L66-L97 PolarHBondContact N-O 2.82Å; L66-L97 PolarHBondContact O-N 3.07Å; I68-L97 HydrophobicContact CD1-CD1 3.85Å; I68-L97 HydrophobicContact CD1-CG 4.41Å; L97-V106 HydrophobicContact CD1-CB 4.06Å; L97-V106 HydrophobicContact CD1-CG1 3.56Å; L97-V106 HydrophobicContact CD2-CG1 4.44Å; L97-V107 HydrophobicContact CD1-CG2 3.84Å; L97-L110 HydrophobicContact CD1-CD1 4.07Å; L97-Y158 HydrophobicContact CD2-CD1 4.41Å; L97-Y158 HydrophobicContact CD2-CE1 3.68Å; L97-L159 HydrophobicContact CB-CD2 4.49Å; L97-L159 HydrophobicContact CD2-CD2 3.62Å
98	P	94.7	Very high	94.6	Very high	0 Å²	0	46.3 Å²	46.3	0%	0	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	142.6	173.4	29.4	-34.9	0	0	0	110.9	M57 F60 A63 N64 N100 G103 L159	M57-P98 HydrophobicContact SD-CB 3.8Å; M57-P98 HydrophobicContact SD-CG 4.29Å; F60-P98 HydrophobicContact CB-CB 3.82Å; F60-P98 HydrophobicContact CD1-CB 3.69Å; F60-P98 HydrophobicContact CD1-CG 3.74Å; F60-P98 HydrophobicContact CD2-CB 3.97Å; F60-P98 HydrophobicContact CD2-CG 3.99Å; F60-P98 HydrophobicContact CE1-CB 4.23Å; F60-P98 HydrophobicContact CE1-CG 3.73Å; F60-P98 HydrophobicContact CE2-CB 4.47Å; F60-P98 HydrophobicContact CE2-CG 3.98Å; F60-P98 HydrophobicContact CG-CB 3.55Å; F60-P98 HydrophobicContact CG-CG 3.87Å; F60-P98 HydrophobicContact CZ-CG 3.85Å; A63-P98 HydrophobicContact CB-CB 4.04Å; N64-P98 CarbonylContact O-C 3.57Å; P98-N100 PolarHBondContact O-N 3.19Å; P98-G103 WeakPolarHBondContact O-CA 3.4Å; P98-L159 HydrophobicContact CG-CD1 3.62Å
99	E	95.8	Very high	94.7	Very high	49 Å²	49	45 Å²	45	23%	0.229	22%	0.223	C	C	.	.	S	Bend	trans	-76.8	62.1	171	-164.9	-157.8	179.6	0	0	110.7	N64 L66 R104	N64-E99 HydrophobicContact CB-CB 3.96Å; N64-E99 VanDerWaalsContact CB-OE2 3.22Å; N64-E99 WeakPolarHBondContact CB-OE2 3.36Å; N64-E99 PolarHBondContact ND2-OE2 2.92Å; N64-E99 WeakPolarHBondContact O-CB 3.34Å; N64-E99 PolarHBondContact O-N 3.39Å; L66-E99 HydrophobicContact CD1-CB 4.43Å; L66-E99 HydrophobicContact CD1-CG 4.5Å; L66-E99 HydrophobicContact CD2-CB 4.34Å; L66-E99 HydrophobicContact CD2-CG 4.04Å; L66-E99 HydrophobicContact CG-CB 3.97Å; L66-E99 HydrophobicContact CG-CG 4.17Å; E99-R104 IonicContact OE1-CZ 2.69Å; E99-R104 IonicContact OE1-NE 3.14Å; E99-R104 IonicContact OE1-NH2 3.51Å; E99-R104 PolarHBondContact OE1-NH2 3.47Å
100	N	94.4	Very high	94.9	Very high	47 Å²	47	41.6 Å²	41.6	25%	0.251	19%	0.194	S	C	.	.	S	Bend	trans	-121.9	-179.5	171.2	67.4	19.9	0	0	0	110	A63 P98 E102 G103 R104	A63-N100 HydrophobicContact CB-CB 4.29Å; P98-N100 PolarHBondContact O-N 3.19Å; N100-E102 VanDerWaalsContact C-N 3.34Å; N100-E102 PolarHBondContact O-N 2.81Å; N100-E102 PolarHBondContact OD1-N 3.15Å; N100-G103 PolarHBondContact O-N 3.5Å; N100-G103 PolarHBondContact OD1-N 2.9Å; N100-R104 WeakPolarHBondContact O-CB 3.32Å; N100-R104 WeakPolarHBondContact O-CG 3.29Å; N100-R104 PolarHBondContact O-N 3.34Å
101	H	95.1	Very high	94.9	Very high	172 Å²	172	38.1 Å²	38.1	80%	0.796	18%	0.178	S	C	*	.	H	α-helix	trans	-57.7	-44.2	-178.5	179.2	-89.1	0	0	0	112.6	N105	H101-N105 WeakPolarHBondContact O-CB 3.38Å; H101-N105 PolarHBondContact O-N 3.16Å; H101-N105 VanDerWaalsContact O-N 3.11Å
102	E	94.3	Very high	95.1	Very high	62 Å²	62	39.5 Å²	39.5	29%	0.29	19%	0.185	S	C	.	.	H	α-helix	trans	-67.3	-45.7	-179.6	-167.7	-178.6	-175.3	0	0	111.6	N100 R104 N105 V106 L159 T160	N100-E102 VanDerWaalsContact C-N 3.34Å; N100-E102 PolarHBondContact O-N 2.81Å; N100-E102 PolarHBondContact OD1-N 3.15Å; E102-R104 PolarHBondContact O-N 3.37Å; E102-N105 PolarHBondContact O-N 3.26Å; E102-V106 WeakPolarHBondContact O-CG2 3.26Å; E102-V106 PolarHBondContact O-N 2.84Å; E102-L159 HydrophobicContact CB-CD1 4.08Å; E102-L159 HydrophobicContact CG-CB 3.8Å; E102-L159 HydrophobicContact CG-CD1 3.98Å; E102-L159 VanDerWaalsContact OE1-CB 3.22Å; E102-L159 WeakPolarHBondContact OE1-CB 3.49Å; E102-T160 WeakPolarHBondContact OE1-CA 3.33Å; E102-T160 PolarHBondContact OE1-N 3.49Å; E102-T160 PolarHBondContact OE1-OG1 3.3Å
103	G	95.1	Very high	95.1	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-61.8	-43.5	178.3	0	0	0	0	0	112.5	P98 N100 N105 V106 V107	P98-G103 WeakPolarHBondContact O-CA 3.4Å; N100-G103 PolarHBondContact O-N 3.5Å; N100-G103 PolarHBondContact OD1-N 2.9Å; G103-N105 PolarHBondContact O-N 2.87Å; G103-V106 WeakPolarHBondContact O-CB 3.46Å; G103-V106 PolarHBondContact O-N 2.63Å; G103-V107 WeakPolarHBondContact O-CG2 3.49Å; G103-V107 PolarHBondContact O-N 3.4Å
104	R	96.3	Very high	95.2	Very high	114 Å²	114	36.4 Å²	36.4	43%	0.43	17%	0.171	S	C	.	.	H	α-helix	trans	-62.5	-40.9	174.7	-74.9	-176.8	170.8	-88.2	3	112.5	L66 E99 N100 E102 V106 V107 T108	L66-R104 HydrophobicContact CD1-CG 3.96Å; E99-R104 IonicContact OE1-CZ 2.69Å; E99-R104 IonicContact OE1-NE 3.14Å; E99-R104 IonicContact OE1-NH2 3.51Å; E99-R104 PolarHBondContact OE1-NH2 3.47Å; N100-R104 WeakPolarHBondContact O-CB 3.32Å; N100-R104 WeakPolarHBondContact O-CG 3.29Å; N100-R104 PolarHBondContact O-N 3.34Å; E102-R104 PolarHBondContact O-N 3.37Å; R104-V106 VanDerWaalsContact C-N 3.34Å; R104-V106 PolarHBondContact O-N 3.4Å; R104-V107 WeakPolarHBondContact O-CB 3.48Å; R104-V107 PolarHBondContact O-N 3.44Å; R104-T108 PolarHBondContact O-N 2.88Å; R104-T108 VanDerWaalsContact O-N 3.15Å; R104-T108 PolarHBondContact O-OG1 2.88Å
105	N	95.9	Very high	95.2	Very high	55 Å²	55	42.6 Å²	42.6	29%	0.294	20%	0.203	S	C	.	.	H	α-helix	trans	-62.9	-40.9	174.1	169.7	69.7	0	0	0	111.7	H101 E102 G103 T108 L109	H101-N105 WeakPolarHBondContact O-CB 3.38Å; H101-N105 PolarHBondContact O-N 3.16Å; H101-N105 VanDerWaalsContact O-N 3.11Å; E102-N105 PolarHBondContact O-N 3.26Å; G103-N105 PolarHBondContact O-N 2.87Å; N105-T108 PolarHBondContact O-N 3.33Å; N105-L109 WeakPolarHBondContact O-CG 3.49Å; N105-L109 PolarHBondContact O-N 2.91Å; N105-L109 VanDerWaalsContact O-N 3.16Å
106	V	96.3	Very high	95.2	Very high	0 Å²	0	47.5 Å²	47.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-61.7	-43.1	173.6	170.8	0	0	0	0	111.3	L97 E102 G103 R104 T108 L109 L110 L159 L162 S163	L97-V106 HydrophobicContact CD1-CB 4.06Å; L97-V106 HydrophobicContact CD1-CG1 3.56Å; L97-V106 HydrophobicContact CD2-CG1 4.44Å; E102-V106 WeakPolarHBondContact O-CG2 3.26Å; E102-V106 PolarHBondContact O-N 2.84Å; G103-V106 WeakPolarHBondContact O-CB 3.46Å; G103-V106 PolarHBondContact O-N 2.63Å; R104-V106 VanDerWaalsContact C-N 3.34Å; R104-V106 PolarHBondContact O-N 3.4Å; V106-T108 VanDerWaalsContact C-N 3.32Å; V106-T108 PolarHBondContact O-N 2.82Å; V106-L109 WeakPolarHBondContact O-CB 3.3Å; V106-L109 PolarHBondContact O-N 2.84Å; V106-L109 VanDerWaalsContact O-N 3.09Å; V106-L110 HydrophobicContact CG1-CD1 3.94Å; V106-L110 HydrophobicContact CG1-CG 4.14Å; V106-L110 WeakPolarHBondContact O-CG 3.47Å; V106-L110 PolarHBondContact O-N 2.88Å; V106-L159 HydrophobicContact CG2-CB 4.31Å; V106-L159 HydrophobicContact CG2-CD2 4.27Å; V106-L162 HydrophobicContact CG1-CD2 3.53Å; V106-L162 HydrophobicContact CG1-CG 4.1Å; V106-S163 WeakPolarHBondContact CG2-OG 3.38Å
107	V	96.9	Very high	95.2	Very high	7 Å²	7	49.1 Å²	49.1	4%	0.042	24%	0.235	C	C	.	.	H	α-helix	trans	-54.7	-48.2	175.6	172.8	0	0	0	0	111	L50 L66 I68 L97 G103 R104 L109 L110 E111	L50-V107 HydrophobicContact CD1-CG1 4.2Å; L50-V107 HydrophobicContact CD1-CG2 4.25Å; L50-V107 HydrophobicContact CD2-CG1 4.14Å; L66-V107 HydrophobicContact CD1-CG2 3.85Å; I68-V107 HydrophobicContact CD1-CG2 3.82Å; I68-V107 HydrophobicContact CG1-CG2 4.37Å; L97-V107 HydrophobicContact CD1-CG2 3.84Å; G103-V107 WeakPolarHBondContact O-CG2 3.49Å; G103-V107 PolarHBondContact O-N 3.4Å; R104-V107 WeakPolarHBondContact O-CB 3.48Å; R104-V107 PolarHBondContact O-N 3.44Å; V107-L109 VanDerWaalsContact C-N 3.28Å; V107-L109 PolarHBondContact O-N 3.04Å; V107-L110 WeakPolarHBondContact O-CB 3.48Å; V107-L110 PolarHBondContact O-N 3.08Å; V107-L110 VanDerWaalsContact O-N 3.07Å; V107-E111 HydrophobicContact CG1-CG 4.32Å; V107-E111 WeakPolarHBondContact O-CG 3.49Å; V107-E111 PolarHBondContact O-N 3.08Å
108	T	96.7	Very high	95.1	Very high	61 Å²	61	51.7 Å²	51.7	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-59.8	-38.5	178	-56.5	0	0	0	0	112.4	R104 N105 V106 K112	R104-T108 PolarHBondContact O-N 2.88Å; R104-T108 VanDerWaalsContact O-N 3.15Å; R104-T108 PolarHBondContact O-OG1 2.88Å; N105-T108 PolarHBondContact O-N 3.33Å; V106-T108 VanDerWaalsContact C-N 3.32Å; V106-T108 PolarHBondContact O-N 2.82Å; T108-K112 WeakPolarHBondContact O-CG 3.41Å; T108-K112 PolarHBondContact O-N 2.94Å; T108-K112 VanDerWaalsContact O-N 3.15Å
109	L	96.6	Very high	95	Very high	1 Å²	1	51.7 Å²	51.7	1%	0.005	25%	0.248	C	C	.	.	H	α-helix	trans	-67.6	-39.7	175	-64.9	173.6	0	0	0	111.6	N105 V106 V107 K112 A113 L166 I171	N105-L109 WeakPolarHBondContact O-CG 3.49Å; N105-L109 PolarHBondContact O-N 2.91Å; N105-L109 VanDerWaalsContact O-N 3.16Å; V106-L109 WeakPolarHBondContact O-CB 3.3Å; V106-L109 PolarHBondContact O-N 2.84Å; V106-L109 VanDerWaalsContact O-N 3.09Å; V107-L109 VanDerWaalsContact C-N 3.28Å; V107-L109 PolarHBondContact O-N 3.04Å; L109-K112 PolarHBondContact O-N 3.25Å; L109-A113 VanDerWaalsContact O-CB 3.29Å; L109-A113 WeakPolarHBondContact O-CB 3.49Å; L109-A113 PolarHBondContact O-N 3.39Å; L109-L166 HydrophobicContact CB-CB 4.27Å; L109-L166 HydrophobicContact CB-CD1 3.68Å; L109-L166 HydrophobicContact CD1-CB 4.41Å; L109-L166 HydrophobicContact CD1-CD1 4.41Å; L109-I171 HydrophobicContact CB-CG2 4.38Å; L109-I171 HydrophobicContact CD2-CG2 4.05Å; L109-I171 WeakPolarHBondContact O-CG2 3.5Å
110	L	96.8	Very high	94.9	Very high	0 Å²	0	49.4 Å²	49.4	0%	0	24%	0.238	C	C	.	.	H	α-helix	trans	-65.1	-42.2	176.3	-68	176.6	0	0	0	111.7	M48 I68 L97 V106 V107 K112 A113 F114 L119 L139 L166	M48-L110 HydrophobicContact CE-CB 3.91Å; I68-L110 HydrophobicContact CD1-CD1 3.67Å; L97-L110 HydrophobicContact CD1-CD1 4.07Å; V106-L110 HydrophobicContact CG1-CD1 3.94Å; V106-L110 HydrophobicContact CG1-CG 4.14Å; V106-L110 WeakPolarHBondContact O-CG 3.47Å; V106-L110 PolarHBondContact O-N 2.88Å; V107-L110 WeakPolarHBondContact O-CB 3.48Å; V107-L110 PolarHBondContact O-N 3.08Å; V107-L110 VanDerWaalsContact O-N 3.07Å; L110-K112 VanDerWaalsContact C-N 3.35Å; L110-K112 PolarHBondContact O-N 3.49Å; L110-A113 PolarHBondContact O-N 3.21Å; L110-F114 VanDerWaalsContact O-CB 3.32Å; L110-F114 WeakPolarHBondContact O-CB 3.36Å; L110-F114 PolarHBondContact O-N 3.47Å; L110-L119 HydrophobicContact CB-CD1 4.31Å; L110-L119 HydrophobicContact CD2-CD1 4.09Å; L110-L119 HydrophobicContact CD2-CD2 3.81Å; L110-L119 WeakPolarHBondContact O-CD1 3.48Å; L110-L139 HydrophobicContact CD1-CD2 4.36Å; L110-L139 HydrophobicContact CD2-CD2 3.65Å; L110-L166 HydrophobicContact CD2-CD1 3.75Å; L110-L166 HydrophobicContact CD2-CD2 4.15Å; L110-L166 HydrophobicContact CG-CD1 4.2Å
111	E	96.3	Very high	94.9	Very high	79 Å²	79	47.9 Å²	47.9	37%	0.369	23%	0.23	S	C	.	.	H	α-helix	trans	-59	-46.9	175.4	-73.8	175.7	-179	0	0	111.2	M48 V107 A113 F114 N115	M48-E111 HydrophobicContact CE-CB 4.33Å; M48-E111 HydrophobicContact CE-CG 3.57Å; M48-E111 HydrophobicContact SD-CB 4.38Å; M48-E111 HydrophobicContact SD-CG 3.93Å; V107-E111 HydrophobicContact CG1-CG 4.32Å; V107-E111 WeakPolarHBondContact O-CG 3.49Å; V107-E111 PolarHBondContact O-N 3.08Å; E111-A113 PolarHBondContact O-N 3.11Å; E111-F114 PolarHBondContact O-N 2.93Å; E111-N115 WeakPolarHBondContact O-CB 3.36Å; E111-N115 PolarHBondContact O-N 3.26Å; E111-N115 PolarHBondContact O-ND2 2.94Å
112	K	95.8	Very high	94.8	Very high	76 Å²	76	39.9 Å²	39.9	33%	0.33	19%	0.193	S	C	.	.	H	α-helix	trans	-61.4	-44.6	175.7	-70.8	175	-176.7	-178.2	0	111.8	T108 L109 L110 F114 N115 Q116 I171 K172	T108-K112 WeakPolarHBondContact O-CG 3.41Å; T108-K112 PolarHBondContact O-N 2.94Å; T108-K112 VanDerWaalsContact O-N 3.15Å; L109-K112 PolarHBondContact O-N 3.25Å; L110-K112 VanDerWaalsContact C-N 3.35Å; L110-K112 PolarHBondContact O-N 3.49Å; K112-F114 VanDerWaalsContact C-N 3.34Å; K112-N115 PolarHBondContact O-N 3.4Å; K112-Q116 WeakPolarHBondContact O-CB 3.43Å; K112-Q116 VanDerWaalsContact O-CG 3.27Å; K112-Q116 WeakPolarHBondContact O-CG 3.38Å; K112-Q116 PolarHBondContact O-N 3.04Å; K112-I171 HydrophobicContact CB-CG2 3.67Å; K112-I171 HydrophobicContact CD-CG2 4.41Å; K112-K172 VanDerWaalsContact CD-O 3.31Å; K112-K172 WeakPolarHBondContact CD-O 3.33Å; K112-K172 WeakPolarHBondContact CE-O 3.47Å; K112-K172 PolarHBondContact NZ-O 3.35Å; K112-K172 PolarHBondContact NZ-OXT 2.81Å
113	A	94.8	Very high	94.7	Very high	0 Å²	0	38.6 Å²	38.6	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-40.1	178.7	0	0	0	0	0	112.3	L109 L110 E111 Q116 Q117 L118 L119 L166 I171	L109-A113 VanDerWaalsContact O-CB 3.29Å; L109-A113 WeakPolarHBondContact O-CB 3.49Å; L109-A113 PolarHBondContact O-N 3.39Å; L110-A113 PolarHBondContact O-N 3.21Å; E111-A113 PolarHBondContact O-N 3.11Å; A113-Q116 CarbonylContact O-C 3.57Å; A113-Q116 PolarHBondContact O-N 2.87Å; A113-Q117 PolarHBondContact O-N 2.97Å; A113-L118 PolarHBondContact O-N 2.82Å; A113-L119 HydrophobicContact CB-CD1 4.31Å; A113-L119 HydrophobicContact CB-CD2 3.43Å; A113-L119 VanDerWaalsContact CB-CD2 3.43Å; A113-L119 HydrophobicContact CB-CG 3.64Å; A113-L166 HydrophobicContact CB-CD2 3.87Å; A113-I171 HydrophobicContact CB-CD1 3.45Å; A113-I171 VanDerWaalsContact CB-CD1 3.45Å; A113-I171 HydrophobicContact CB-CG1 4.25Å
114	F	95.3	Very high	94.4	Very high	14 Å²	14	41.4 Å²	41.4	6%	0.061	21%	0.211	C	C	.	.	H	α-helix	trans	-65.4	-45.8	177.5	-172.4	-95.3	0	0	0	110.9	Q43 M48 Y70 F72 L110 E111 K112 Q116 Q117 L119	Q43-F114 PolarHBondContact NE2-O 3.49Å; M48-F114 HydrophobicContact CB-CD1 3.69Å; M48-F114 HydrophobicContact CB-CD2 4.29Å; M48-F114 HydrophobicContact CB-CE1 3.75Å; M48-F114 HydrophobicContact CB-CE2 4.34Å; M48-F114 HydrophobicContact CB-CG 3.97Å; M48-F114 HydrophobicContact CB-CZ 4.08Å; M48-F114 HydrophobicContact SD-CB 3.69Å; M48-F114 HydrophobicContact SD-CD1 4.3Å; M48-F114 HydrophobicContact SD-CG 3.92Å; Y70-F114 AromaticContact CD1-CD2 3.63Å; Y70-F114 HydrophobicContact CD1-CD2 3.63Å; Y70-F114 AromaticContact CD1-CE2 3.63Å; Y70-F114 HydrophobicContact CD1-CE2 3.63Å; Y70-F114 AromaticContact CE1-CD2 3.78Å; Y70-F114 HydrophobicContact CE1-CD2 3.78Å; Y70-F114 HydrophobicContact CE1-CE2 4.27Å; Y70-F114 HydrophobicContact CE1-CG 4.45Å; F72-F114 HydrophobicContact CE1-CE2 4.05Å; F72-F114 HydrophobicContact CE1-CZ 4.35Å; F72-F114 AromaticContact CZ-CE2 3.81Å; F72-F114 HydrophobicContact CZ-CE2 3.81Å; F72-F114 HydrophobicContact CZ-CZ 4.48Å; L110-F114 VanDerWaalsContact O-CB 3.32Å; L110-F114 WeakPolarHBondContact O-CB 3.36Å; L110-F114 PolarHBondContact O-N 3.47Å; E111-F114 PolarHBondContact O-N 2.93Å; K112-F114 VanDerWaalsContact C-N 3.34Å; F114-Q116 PolarHBondContact O-N 2.88Å; F114-Q117 PolarHBondContact O-N 3.4Å; F114-L119 HydrophobicContact CB-CD1 3.85Å; F114-L119 HydrophobicContact CB-CG 4.42Å; F114-L119 HydrophobicContact CD2-CD1 4.24Å
115	N	93.8	Very high	94	Very high	129 Å²	129	38.5 Å²	38.5	69%	0.69	20%	0.204	S	C	*	.	H	α-helix	trans	-63.4	-28.6	176.6	-69.9	-21.2	0	0	0	112.6	E111 K112 Q117	E111-N115 WeakPolarHBondContact O-CB 3.36Å; E111-N115 PolarHBondContact O-N 3.26Å; E111-N115 PolarHBondContact O-ND2 2.94Å; K112-N115 PolarHBondContact O-N 3.4Å; N115-Q117 VanDerWaalsContact C-N 3.3Å
116	Q	92.4	Very high	93.5	Very high	104 Å²	104	45.8 Å²	45.8	49%	0.486	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	-86.7	4.7	174	-67.8	175.2	23.1	0	0	113.4	K112 A113 F114 L118	K112-Q116 WeakPolarHBondContact O-CB 3.43Å; K112-Q116 VanDerWaalsContact O-CG 3.27Å; K112-Q116 WeakPolarHBondContact O-CG 3.38Å; K112-Q116 PolarHBondContact O-N 3.04Å; A113-Q116 CarbonylContact O-C 3.57Å; A113-Q116 PolarHBondContact O-N 2.87Å; F114-Q116 PolarHBondContact O-N 2.88Å; Q116-L118 VanDerWaalsContact C-N 3.31Å; Q116-L118 HydrophobicContact CB-CD1 3.94Å; Q116-L118 HydrophobicContact CB-CG 3.98Å; Q116-L118 WeakPolarHBondContact O-CG 3.49Å; Q116-L118 PolarHBondContact O-N 2.97Å
117	Q	92	Very high	93.1	Very high	62 Å²	62	50.6 Å²	50.6	29%	0.29	27%	0.27	S	S	.	.	T	Hydrogen-bonded Turn	trans	61.1	33.1	179.7	-66.4	177.8	-17.9	0	0	114.3	Y42 Q43 A113 F114 N115	Y42-Q117 VanDerWaalsContact CE2-OE1 3.24Å; Q43-Q117 HydrophobicContact CB-CB 3.75Å; Q43-Q117 HydrophobicContact CB-CG 4.25Å; Q43-Q117 WeakPolarHBondContact CB-O 3.43Å; A113-Q117 PolarHBondContact O-N 2.97Å; F114-Q117 PolarHBondContact O-N 3.4Å; N115-Q117 VanDerWaalsContact C-N 3.3Å
118	L	91.2	Very high	92.7	Very high	53 Å²	53	52.8 Å²	52.8	28%	0.277	29%	0.293	S	S	.	.			trans	-105.9	-7.2	-174	-63.5	177.5	0	0	0	114.9	A113 Q116 I171	A113-L118 PolarHBondContact O-N 2.82Å; Q116-L118 VanDerWaalsContact C-N 3.31Å; Q116-L118 HydrophobicContact CB-CD1 3.94Å; Q116-L118 HydrophobicContact CB-CG 3.98Å; Q116-L118 WeakPolarHBondContact O-CG 3.49Å; Q116-L118 PolarHBondContact O-N 2.97Å; L118-I171 HydrophobicContact CD1-CD1 4.09Å; L118-I171 HydrophobicContact CD1-CG1 4.18Å
119	L	93.1	Very high	92.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	30%	0.302	C	S	.	.	S	Bend	trans	-84.6	-39.6	-174	-72.3	-171	0	0	0	113.2	Y70 L110 A113 F114 P134 A135 V137 L139 L166	Y70-L119 HydrophobicContact CE1-CD1 3.87Å; L110-L119 HydrophobicContact CB-CD1 4.31Å; L110-L119 HydrophobicContact CD2-CD1 4.09Å; L110-L119 HydrophobicContact CD2-CD2 3.81Å; L110-L119 WeakPolarHBondContact O-CD1 3.48Å; A113-L119 HydrophobicContact CB-CD1 4.31Å; A113-L119 HydrophobicContact CB-CD2 3.43Å; A113-L119 VanDerWaalsContact CB-CD2 3.43Å; A113-L119 HydrophobicContact CB-CG 3.64Å; F114-L119 HydrophobicContact CB-CD1 3.85Å; F114-L119 HydrophobicContact CB-CG 4.42Å; F114-L119 HydrophobicContact CD2-CD1 4.24Å; L119-P134 WeakPolarHBondContact O-CA 3.46Å; L119-A135 PolarHBondContact O-N 3.07Å; L119-V137 HydrophobicContact CD2-CB 4.18Å; L119-V137 HydrophobicContact CD2-CG1 4.16Å; L119-V137 HydrophobicContact CD2-CG2 3.93Å; L119-L139 HydrophobicContact CB-CD1 4.44Å; L119-L139 HydrophobicContact CD2-CD1 4.45Å; L119-L166 HydrophobicContact CD2-CD2 4.02Å
120	F	94.8	Very high	92.1	Very high	1 Å²	1	56.6 Å²	56.6	0%	0.004	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	162.8	-174.6	-61.5	-93.7	0	0	0	112.1	Q43 Y70 F72 V93 I132 T133 P134 L139 I141	Q43-F120 WeakPolarHBondContact CA-O 3.34Å; Q43-F120 VanDerWaalsContact CB-O 3.29Å; Q43-F120 WeakPolarHBondContact CB-O 3.45Å; Q43-F120 HydrophobicContact CG-CB 4.07Å; Q43-F120 PolarHBondContact N-O 2.98Å; Q43-F120 VanDerWaalsContact OE1-N 3.17Å; Y70-F120 AromaticContact CD1-CE2 3.67Å; Y70-F120 HydrophobicContact CD1-CE2 3.67Å; Y70-F120 HydrophobicContact CD1-CZ 4.21Å; Y70-F120 AromaticContact CD2-CE2 3.95Å; Y70-F120 HydrophobicContact CD2-CE2 3.95Å; Y70-F120 AromaticContact CD2-CZ 3.63Å; Y70-F120 HydrophobicContact CD2-CZ 3.63Å; Y70-F120 AromaticContact CE1-CE2 3.92Å; Y70-F120 HydrophobicContact CE1-CE2 3.92Å; Y70-F120 HydrophobicContact CE2-CE2 4.18Å; Y70-F120 AromaticContact CE2-CZ 3.96Å; Y70-F120 HydrophobicContact CE2-CZ 3.96Å; Y70-F120 AromaticContact CG-CE2 3.66Å; Y70-F120 HydrophobicContact CG-CE2 3.66Å; Y70-F120 AromaticContact CG-CZ 3.74Å; Y70-F120 HydrophobicContact CG-CZ 3.74Å; F72-F120 HydrophobicContact CE2-CD1 4.24Å; F72-F120 HydrophobicContact CE2-CD2 4.01Å; F72-F120 HydrophobicContact CE2-CE1 4.45Å; F72-F120 HydrophobicContact CE2-CE2 4.22Å; F72-F120 HydrophobicContact CE2-CG 4.02Å; F72-F120 HydrophobicContact CE2-CZ 4.44Å; F72-F120 HydrophobicContact CZ-CB 4.01Å; F72-F120 HydrophobicContact CZ-CD1 4.38Å; F72-F120 AromaticContact CZ-CD2 3.49Å; F72-F120 HydrophobicContact CZ-CD2 3.49Å; F72-F120 VanDerWaalsContact CZ-CD2 3.49Å; F72-F120 HydrophobicContact CZ-CE2 4.02Å; F72-F120 AromaticContact CZ-CG 3.71Å; F72-F120 HydrophobicContact CZ-CG 3.71Å; V93-F120 HydrophobicContact CG2-CE1 4.01Å; V93-F120 HydrophobicContact CG2-CZ 4.1Å; F120-I132 HydrophobicContact CB-CG2 3.95Å; F120-I132 HydrophobicContact CD1-CG2 4.08Å; F120-I132 HydrophobicContact CG-CG2 4.29Å; F120-T133 CarbonylContact C-O 3.54Å; F120-T133 VanDerWaalsContact CA-O 3.3Å; F120-T133 WeakPolarHBondContact CA-O 3.31Å; F120-P134 HydrophobicContact CD1-CG 4.48Å; F120-P134 HydrophobicContact CE1-CG 4.18Å; F120-L139 HydrophobicContact CE1-CD1 4.33Å; F120-L139 HydrophobicContact CE2-CD1 4.12Å; F120-L139 HydrophobicContact CZ-CD1 3.77Å; F120-I141 HydrophobicContact CE1-CG2 4.33Å
121	T	94	Very high	91.8	Very high	16 Å²	16	59 Å²	59	10%	0.098	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.1	168.8	171.1	-169.2	0	0	0	0	108.7	F41 I132 T133 A135	F41-T121 HydrophobicContact CD1-CG2 4.42Å; T121-I132 WeakPolarHBondContact O-CA 3.27Å; T121-T133 HydrophobicContact CG2-CG2 3.99Å; T121-T133 PolarHBondContact N-O 3.17Å; T121-T133 PolarHBondContact O-N 2.97Å; T121-A135 HydrophobicContact CG2-CB 4.03Å
122	I	93.2	Very high	91.7	Very high	4 Å²	4	55.6 Å²	55.6	2%	0.021	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	132.1	163.1	-63.9	178.3	0	0	0	108.4	P44 Q77 P82 Y88 D130 V131 I132	P44-I122 HydrophobicContact CG-CD1 3.81Å; P44-I122 HydrophobicContact CG-CG1 3.73Å; Q77-I122 HydrophobicContact CG-CD1 3.9Å; Q77-I122 HydrophobicContact CG-CG2 4.46Å; P82-I122 WeakPolarHBondContact CD-O 3.41Å; Y88-I122 HydrophobicContact CD1-CD1 3.31Å; Y88-I122 HydrophobicContact CD2-CD1 4.07Å; Y88-I122 HydrophobicContact CE1-CD1 3.72Å; Y88-I122 HydrophobicContact CE2-CD1 4.43Å; Y88-I122 HydrophobicContact CG-CD1 3.51Å; I122-D130 HydrophobicContact CG2-CB 3.84Å; I122-V131 WeakPolarHBondContact CA-O 3.22Å; I122-I132 HydrophobicContact CG1-CG1 4.12Å
123	A	91.1	Very high	91.5	Very high	34 Å²	34	54.2 Å²	54.2	28%	0.281	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	149	173.1	0	0	0	0	0	110.1	V131 T133	A123-V131 PolarHBondContact N-O 2.66Å; A123-V131 PolarHBondContact O-N 2.87Å; A123-T133 HydrophobicContact CB-CG2 3.59Å
124	T	89.1	Confident	91.3	Very high	60 Å²	60	55.3 Å²	55.3	37%	0.368	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	124.3	174.3	-44.7	0	0	0	0	109.5	H83 G128 E129 D130	H83-T124 PolarHBondContact CE1-OG1 2.82Å; T124-G128 VanDerWaalsContact CG2-C 3.48Å; T124-E129 CarbonylContact C-O 3.49Å; T124-E129 WeakPolarHBondContact CA-O 3.21Å; T124-D130 WeakPolarHBondContact CB-OD1 3.22Å; T124-D130 PolarHBondContact OG1-OD1 2.92Å
125	N	87.6	Confident	91	Very high	53 Å²	53	55.8 Å²	55.8	28%	0.283	32%	0.318	S	S	.	.			trans	-77.7	177.2	176.9	72	14.2	0	0	0	111.7	S127 G128 E129 V131	N125-S127 PolarHBondContact O-N 2.88Å; N125-S127 WeakPolarHBondContact OD1-CA 3.47Å; N125-S127 WeakPolarHBondContact OD1-CB 3.3Å; N125-S127 PolarHBondContact OD1-N 3.3Å; N125-G128 PolarHBondContact O-N 2.82Å; N125-G128 PolarHBondContact OD1-N 3.07Å; N125-G128 VanDerWaalsContact OD1-N 3.07Å; N125-E129 PolarHBondContact N-O 2.72Å; N125-E129 PolarHBondContact ND2-OE2 2.95Å; N125-E129 PolarHBondContact OD1-N 2.8Å; N125-E129 PolarHBondContact OD1-O 2.89Å; N125-V131 HydrophobicContact CB-CG2 4.14Å
126	E	86.4	Confident	90.4	Very high	207 Å²	207	51.8 Å²	51.8	97%	0.967	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.3	-23.9	179.3	-63.5	-178.4	173.3	0	0	113.4	G128	E126-G128 VanDerWaalsContact C-N 3.29Å
127	S	87.9	Confident	90.2	Very high	102 Å²	102	47 Å²	47	71%	0.713	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.6	-0.5	176.5	-53	0	0	0	0	113.3	N125	N125-S127 PolarHBondContact O-N 2.88Å; N125-S127 WeakPolarHBondContact OD1-CA 3.47Å; N125-S127 WeakPolarHBondContact OD1-CB 3.3Å; N125-S127 PolarHBondContact OD1-N 3.3Å
128	G	87.3	Confident	89.9	Confident	52 Å²	52	46 Å²	46	54%	0.536	28%	0.277	S	S	.	.	S	Bend	trans	83.1	10.5	-179.4	0	0	0	0	0	114.4	T124 N125 E126	T124-G128 VanDerWaalsContact CG2-C 3.48Å; N125-G128 PolarHBondContact O-N 2.82Å; N125-G128 PolarHBondContact OD1-N 3.07Å; N125-G128 VanDerWaalsContact OD1-N 3.07Å; E126-G128 VanDerWaalsContact C-N 3.29Å
129	E	89	Confident	89.8	Confident	122 Å²	122	44.2 Å²	44.2	57%	0.57	27%	0.268	S	S	*	.			trans	-94.6	137.3	179.8	-53.9	178.4	137.5	0	0	111.3	T124 N125 V131	T124-E129 CarbonylContact C-O 3.49Å; T124-E129 WeakPolarHBondContact CA-O 3.21Å; N125-E129 PolarHBondContact N-O 2.72Å; N125-E129 PolarHBondContact ND2-OE2 2.95Å; N125-E129 PolarHBondContact OD1-N 2.8Å; N125-E129 PolarHBondContact OD1-O 2.89Å; E129-V131 HydrophobicContact CB-CG1 4.33Å; E129-V131 PolarHBondContact O-N 2.77Å
130	D	91.6	Very high	89.7	Confident	20 Å²	20	45 Å²	45	11%	0.107	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.4	111.7	176	-67.4	-33.1	0	0	0	111.3	Q77 H83 I122 T124	Q77-D130 PolarHBondContact NE2-OD2 3.07Å; H83-D130 IonicContact CE1-OD1 3.55Å; H83-D130 IonicContact CE1-OD2 3.76Å; H83-D130 IonicContact CG-OD2 3.81Å; H83-D130 VanDerWaalsContact ND1-CG 3.29Å; H83-D130 IonicContact ND1-OD1 3.6Å; H83-D130 PolarHBondContact ND1-OD1 2.95Å; H83-D130 VanDerWaalsContact ND1-OD1 3.14Å; H83-D130 IonicContact ND1-OD2 2.66Å; H83-D130 PolarHBondContact ND1-OD2 2.94Å; I122-D130 HydrophobicContact CG2-CB 3.84Å; T124-D130 WeakPolarHBondContact CB-OD1 3.22Å; T124-D130 PolarHBondContact OG1-OD1 2.92Å
131	V	91.8	Very high	89.4	Confident	50 Å²	50	47.2 Å²	47.2	30%	0.303	28%	0.282	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	148.5	-174.4	-61.3	0	0	0	0	111.3	I122 A123 N125 E129 T133	I122-V131 WeakPolarHBondContact CA-O 3.22Å; A123-V131 PolarHBondContact N-O 2.66Å; A123-V131 PolarHBondContact O-N 2.87Å; N125-V131 HydrophobicContact CB-CG2 4.14Å; E129-V131 HydrophobicContact CB-CG1 4.33Å; E129-V131 PolarHBondContact O-N 2.77Å; V131-T133 PolarHBondContact O-N 3.49Å
132	I	93.1	Very high	89	Confident	8 Å²	8	47.4 Å²	47.4	4%	0.041	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	120.7	171.4	-58.3	174.8	0	0	0	108.1	P44 F72 Y88 R91 F120 T121 I122	P44-I132 HydrophobicContact CB-CD1 4.43Å; P44-I132 HydrophobicContact CG-CD1 4.09Å; P44-I132 HydrophobicContact CG-CG1 4.2Å; F72-I132 HydrophobicContact CB-CD1 3.3Å; F72-I132 HydrophobicContact CD1-CD1 4.23Å; F72-I132 HydrophobicContact CD2-CD1 4.07Å; F72-I132 HydrophobicContact CD2-CG2 3.89Å; F72-I132 HydrophobicContact CE2-CG2 3.89Å; F72-I132 HydrophobicContact CG-CD1 3.62Å; F72-I132 HydrophobicContact CG-CG2 4.28Å; F72-I132 HydrophobicContact CZ-CG2 4.3Å; Y88-I132 HydrophobicContact CD2-CD1 3.9Å; Y88-I132 HydrophobicContact CD2-CG1 4.25Å; Y88-I132 HydrophobicContact CE2-CD1 3.86Å; R91-I132 HydrophobicContact CB-CB 4.17Å; R91-I132 HydrophobicContact CB-CD1 3.99Å; R91-I132 HydrophobicContact CB-CG1 4.46Å; R91-I132 HydrophobicContact CG-CB 4.23Å; F120-I132 HydrophobicContact CB-CG2 3.95Å; F120-I132 HydrophobicContact CD1-CG2 4.08Å; F120-I132 HydrophobicContact CG-CG2 4.29Å; T121-I132 WeakPolarHBondContact O-CA 3.27Å; I122-I132 HydrophobicContact CG1-CG1 4.12Å
133	T	91.6	Very high	88.4	Confident	48 Å²	48	50.8 Å²	50.8	29%	0.294	30%	0.297	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.4	153.5	-175.3	-170.3	0	0	0	0	110.5	F120 T121 A123 V131 A135	F120-T133 CarbonylContact C-O 3.54Å; F120-T133 VanDerWaalsContact CA-O 3.3Å; F120-T133 WeakPolarHBondContact CA-O 3.31Å; T121-T133 HydrophobicContact CG2-CG2 3.99Å; T121-T133 PolarHBondContact N-O 3.17Å; T121-T133 PolarHBondContact O-N 2.97Å; A123-T133 HydrophobicContact CB-CG2 3.59Å; V131-T133 PolarHBondContact O-N 3.49Å; T133-A135 PolarHBondContact O-N 2.63Å
134	P	91.3	Very high	87.3	Confident	23 Å²	23	53.1 Å²	53.1	15%	0.149	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.6	132.3	170	-23.8	35.5	0	0	0	109.7	L119 F120 L139 I141	L119-P134 WeakPolarHBondContact O-CA 3.46Å; F120-P134 HydrophobicContact CD1-CG 4.48Å; F120-P134 HydrophobicContact CE1-CG 4.18Å; P134-L139 HydrophobicContact CB-CB 4.23Å; P134-L139 HydrophobicContact CB-CD1 4.44Å; P134-L139 HydrophobicContact CG-CB 4.13Å; P134-I141 HydrophobicContact CG-CD1 3.84Å; P134-I141 HydrophobicContact CG-CG1 4.17Å; P134-I141 HydrophobicContact CG-CG2 3.93Å
135	A	88.8	Confident	86.1	Confident	23 Å²	23	59.4 Å²	59.4	19%	0.19	33%	0.328	C	S	.	.			trans	-71.8	-85.8	-175.4	0	0	0	0	0	110.8	F41 L119 T121 T133	F41-A135 HydrophobicContact CB-CB 4.43Å; F41-A135 HydrophobicContact CD1-CB 3.82Å; F41-A135 HydrophobicContact CG-CB 4.39Å; L119-A135 PolarHBondContact O-N 3.07Å; T121-A135 HydrophobicContact CG2-CB 4.03Å; T133-A135 PolarHBondContact O-N 2.63Å
136	S	81.9	Confident	84.8	Confident	45 Å²	45	63 Å²	63	32%	0.315	34%	0.343	S	S	.	.	S	Bend	trans	-128.8	14.1	-176.4	47.6	0	0	0	0	112.2	V165 K169	S136-V165 WeakPolarHBondContact O-CG1 3.46Å; S136-K169 VanDerWaalsContact O-CE 3.24Å; S136-K169 WeakPolarHBondContact O-CE 3.01Å; S136-K169 WeakPolarHBondContact OG-CE 3.24Å; S136-K169 PolarHBondContact OG-NZ 2.73Å
137	V	86.5	Confident	83.2	Confident	3 Å²	3	56 Å²	56	2%	0.018	33%	0.327	C	S	.	.	S	Bend	trans	-105.4	124.5	173.4	-179.2	0	0	0	0	106.9	L119 L139 L162 L166 K169	L119-V137 HydrophobicContact CD2-CB 4.18Å; L119-V137 HydrophobicContact CD2-CG1 4.16Å; L119-V137 HydrophobicContact CD2-CG2 3.93Å; V137-L139 HydrophobicContact CB-CG 4.42Å; V137-L139 HydrophobicContact CG1-CD2 3.98Å; V137-L139 HydrophobicContact CG1-CG 3.97Å; V137-L139 PolarHBondContact O-N 2.68Å; V137-L162 HydrophobicContact CG1-CD1 3.26Å; V137-L166 HydrophobicContact CG1-CD2 3.91Å; V137-L166 HydrophobicContact CG1-CG 4.3Å; V137-L166 HydrophobicContact CG2-CD2 3.87Å; V137-K169 HydrophobicContact CG2-CD 4Å
138	P	87	Confident	81.6	Confident	43 Å²	43	53.4 Å²	53.4	28%	0.279	31%	0.309	S	S	.	.			trans	-77.2	69.8	-175.3	32.9	-36.6	0	0	0	110.4	Y158 L162 V165	P138-Y158 VanDerWaalsContact O-CE2 3.3Å; P138-Y158 WeakPolarHBondContact O-CE2 3.47Å; P138-L162 HydrophobicContact CG-CD1 4.45Å; P138-V165 HydrophobicContact CG-CG2 4.46Å
139	L	89.3	Confident	80.2	Confident	15 Å²	15	55.3 Å²	55.3	8%	0.079	31%	0.305	C	S	.	.			trans	-75.5	129.6	178.7	-67.2	176.2	0	0	0	110.8	L110 L119 F120 P134 V137 I141 L162	L110-L139 HydrophobicContact CD1-CD2 4.36Å; L110-L139 HydrophobicContact CD2-CD2 3.65Å; L119-L139 HydrophobicContact CB-CD1 4.44Å; L119-L139 HydrophobicContact CD2-CD1 4.45Å; F120-L139 HydrophobicContact CE1-CD1 4.33Å; F120-L139 HydrophobicContact CE2-CD1 4.12Å; F120-L139 HydrophobicContact CZ-CD1 3.77Å; P134-L139 HydrophobicContact CB-CB 4.23Å; P134-L139 HydrophobicContact CB-CD1 4.44Å; P134-L139 HydrophobicContact CG-CB 4.13Å; V137-L139 HydrophobicContact CB-CG 4.42Å; V137-L139 HydrophobicContact CG1-CD2 3.98Å; V137-L139 HydrophobicContact CG1-CG 3.97Å; V137-L139 PolarHBondContact O-N 2.68Å; L139-I141 VanDerWaalsContact C-N 3.33Å; L139-I141 HydrophobicContact CB-CG2 3.85Å; L139-I141 PolarHBondContact O-N 3.34Å; L139-I141 VanDerWaalsContact O-N 3.07Å; L139-L162 HydrophobicContact CD2-CD1 4.2Å; L139-L162 HydrophobicContact CD2-CD2 4.43Å
140	K	89.6	Confident	79	Confident	17 Å²	17	49.8 Å²	49.8	7%	0.074	28%	0.28	C	S	.	.			trans	-75.9	87.4	163.4	-70.5	177.1	178.1	-173	0	108.9	T95 D152 Y153 D155 Y158	T95-K140 WeakPolarHBondContact CA-O 3.43Å; T95-K140 VanDerWaalsContact CB-O 3.24Å; T95-K140 WeakPolarHBondContact CB-O 3.45Å; T95-K140 PolarHBondContact OG1-O 2.89Å; K140-D152 HydrophobicContact CD-CB 3.75Å; K140-D152 HydrophobicContact CG-CB 4.26Å; K140-D152 PolarHBondContact NZ-O 3.33Å; K140-Y153 HydrophobicContact CD-CD2 4.21Å; K140-Y153 HydrophobicContact CD-CE2 3.72Å; K140-D155 WeakPolarHBondContact CE-OD2 3.24Å; K140-D155 VanDerWaalsContact NZ-CG 3.34Å; K140-D155 IonicContact NZ-OD2 3.62Å; K140-D155 PolarHBondContact NZ-OD2 3.3Å; K140-Y158 HydrophobicContact CB-CE2 4.35Å; K140-Y158 HydrophobicContact CD-CD1 4.23Å; K140-Y158 HydrophobicContact CD-CD2 3.86Å; K140-Y158 HydrophobicContact CD-CE1 4.09Å; K140-Y158 HydrophobicContact CD-CE2 3.71Å; K140-Y158 HydrophobicContact CD-CG 4.11Å; K140-Y158 VanDerWaalsContact CE-CD2 3.49Å; K140-Y158 HydrophobicContact CG-CD2 4.22Å; K140-Y158 HydrophobicContact CG-CE1 4.45Å; K140-Y158 HydrophobicContact CG-CE2 3.61Å; K140-Y158 PolarHBondContact N-OH 3.25Å
141	I	89.1	Confident	77.6	Confident	47 Å²	47	55 Å²	55	24%	0.241	31%	0.308	C	S	.	.			trans	-90.3	142.6	176.8	58.4	164	0	0	0	110.6	V93 C94 F120 P134 L139	V93-I141 HydrophobicContact CB-CB 4.24Å; V93-I141 HydrophobicContact CB-CG2 4.46Å; V93-I141 HydrophobicContact CG1-CB 4.49Å; V93-I141 HydrophobicContact CG1-CD1 4.29Å; V93-I141 HydrophobicContact CG2-CG2 4.34Å; C94-I141 CarbonylContact O-C 3.59Å; C94-I141 VanDerWaalsContact O-CA 3.32Å; C94-I141 WeakPolarHBondContact O-CA 3.48Å; F120-I141 HydrophobicContact CE1-CG2 4.33Å; P134-I141 HydrophobicContact CG-CD1 3.84Å; P134-I141 HydrophobicContact CG-CG1 4.17Å; P134-I141 HydrophobicContact CG-CG2 3.93Å; L139-I141 VanDerWaalsContact C-N 3.33Å; L139-I141 HydrophobicContact CB-CG2 3.85Å; L139-I141 PolarHBondContact O-N 3.34Å; L139-I141 VanDerWaalsContact O-N 3.07Å
142	Q	85.7	Confident	76.8	Confident	19 Å²	19	56.8 Å²	56.8	9%	0.089	32%	0.315	C	S	.	.	B	Isolated β-bridge	trans	-131.4	143.7	175.2	-68.6	176.1	5.1	0	0	109.2	C94 Y96 S148	C94-Q142 PolarHBondContact N-O 2.96Å; C94-Q142 PolarHBondContact O-N 2.93Å; Y96-Q142 HydrophobicContact CE2-CB 4.15Å; Y96-Q142 HydrophobicContact CE2-CG 4.47Å; Q142-S148 PolarHBondContact OE1-O 2.82Å; Q142-S148 VanDerWaalsContact OE1-O 3.09Å
143	H	81.2	Confident	76.1	Confident	75 Å²	75	57 Å²	57	35%	0.347	32%	0.316	S	S	.	.			trans	-75.4	133.4	170.6	-67.7	-119.5	0	0	0	108.7	R91 E145 E146	R91-H143 PolarHBondContact NH1-CE1 3.46Å; R91-H143 PolarHBondContact NH1-ND1 3.19Å; R91-H143 PolarHBondContact NH2-CD2 2.94Å; R91-H143 PolarHBondContact NH2-CE1 3.1Å; R91-H143 PolarHBondContact NH2-NE2 3.49Å; H143-E145 PolarHBondContact O-N 2.78Å; H143-E146 HydrophobicContact CB-CB 4.26Å; H143-E146 HydrophobicContact CB-CG 3.82Å; H143-E146 IonicContact CD2-OE1 3.68Å; H143-E146 IonicContact CD2-OE2 3.79Å; H143-E146 IonicContact CG-OE1 3.79Å; H143-E146 PolarHBondContact O-N 3.11Å; H143-E146 VanDerWaalsContact O-N 3.17Å
144	E	68	Low	75.8	Confident	84 Å²	84	59.6 Å²	59.6	39%	0.393	33%	0.333	S	S	.	.	G	3₁₀ helix	trans	-64.8	-27.2	-179	-147.3	178.3	-151.1	0	0	112.1	K67 Q92 E146	K67-E144 WeakPolarHBondContact CE-OE1 3.28Å; K67-E144 IonicContact NZ-OE1 2.74Å; K67-E144 PolarHBondContact NZ-OE1 3.34Å; Q92-E144 PolarHBondContact NE2-OE2 3.3Å; E144-E146 VanDerWaalsContact C-N 3.33Å; E144-E146 PolarHBondContact O-N 2.74Å
145	E	63.8	Low	75.4	Confident	192 Å²	192	60.6 Å²	60.6	90%	0.897	34%	0.337	S	S	*	.	G	3₁₀ helix	trans	-72.2	-22.2	177.5	-62.1	-177.4	170.2	0	0	113.7	H143 G147	H143-E145 PolarHBondContact O-N 2.78Å; E145-G147 VanDerWaalsContact C-N 3.26Å; E145-G147 PolarHBondContact O-N 2.74Å
146	E	60.3	Low	75.2	Confident	127 Å²	127	63.4 Å²	63.4	59%	0.593	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-79.5	-8.5	-172.3	-75.6	174.3	-179.8	0	0	113	H143 E144 S148	H143-E146 HydrophobicContact CB-CB 4.26Å; H143-E146 HydrophobicContact CB-CG 3.82Å; H143-E146 IonicContact CD2-OE1 3.68Å; H143-E146 IonicContact CD2-OE2 3.79Å; H143-E146 IonicContact CG-OE1 3.79Å; H143-E146 PolarHBondContact O-N 3.11Å; H143-E146 VanDerWaalsContact O-N 3.17Å; E144-E146 VanDerWaalsContact C-N 3.33Å; E144-E146 PolarHBondContact O-N 2.74Å; E146-S148 PolarHBondContact O-N 2.88Å
147	G	52.5	Low	75.5	Confident	62 Å²	62	66.8 Å²	66.8	64%	0.639	38%	0.376	S	S	*	.			trans	59.2	-3.9	170.6	0	0	0	0	0	115.9	E145 I149	E145-G147 VanDerWaalsContact C-N 3.26Å; E145-G147 PolarHBondContact O-N 2.74Å; G147-I149 WeakPolarHBondContact O-CG1 3.46Å; G147-I149 PolarHBondContact O-N 2.71Å
148	S	55.1	Low	75.7	Confident	47 Å²	47	66.9 Å²	66.9	33%	0.329	38%	0.376	S	S	.	.			trans	-84.4	113.3	-175.2	-161.7	0	0	0	0	109.1	Q142 E146 I150 D151	Q142-S148 PolarHBondContact OE1-O 2.82Å; Q142-S148 VanDerWaalsContact OE1-O 3.09Å; E146-S148 PolarHBondContact O-N 2.88Å; S148-I150 VanDerWaalsContact C-N 3.29Å; S148-I150 PolarHBondContact O-N 2.8Å; S148-D151 WeakPolarHBondContact CB-OD2 3.29Å; S148-D151 VanDerWaalsContact OG-CG 3.23Å; S148-D151 PolarHBondContact OG-OD1 2.75Å; S148-D151 PolarHBondContact OG-OD2 2.72Å
149	I	57.3	Low	75.9	Confident	91 Å²	91	64.9 Å²	64.9	47%	0.467	36%	0.363	S	S	.	.			trans	-89	84.2	-173.5	-13.4	174	0	0	0	103.6	K55 G147	K55-I149 HydrophobicContact CD-CG2 4.1Å; G147-I149 WeakPolarHBondContact O-CG1 3.46Å; G147-I149 PolarHBondContact O-N 2.71Å
150	I	62.9	Low	76.1	Confident	7 Å²	7	68 Å²	68	4%	0.036	38%	0.383	C	S	.	.			trans	81	58.4	155.4	-53.5	169.2	0	0	0	114.4	M57 P58 Y96 S148 D152 Y153	M57-I150 HydrophobicContact CB-CD1 3.44Å; M57-I150 VanDerWaalsContact CB-CD1 3.44Å; M57-I150 HydrophobicContact CE-CD1 4.49Å; M57-I150 HydrophobicContact CE-CG2 4.41Å; P58-I150 HydrophobicContact CG-CG2 4.33Å; Y96-I150 HydrophobicContact CG-CG1 4.43Å; S148-I150 VanDerWaalsContact C-N 3.29Å; S148-I150 PolarHBondContact O-N 2.8Å; I150-D152 PolarHBondContact O-N 2.71Å; I150-Y153 HydrophobicContact CG2-CD2 3.34Å; I150-Y153 HydrophobicContact CG2-CE2 4.28Å; I150-Y153 HydrophobicContact CG2-CG 3.68Å
151	D	63.3	Low	76.2	Confident	130 Å²	130	70.2 Å²	70.2	70%	0.695	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-24.7	173.3	-71.7	-36	0	0	0	113.4	S148	S148-D151 WeakPolarHBondContact CB-OD2 3.29Å; S148-D151 VanDerWaalsContact OG-CG 3.23Å; S148-D151 PolarHBondContact OG-OD1 2.75Å; S148-D151 PolarHBondContact OG-OD2 2.72Å
152	D	74	Confident	76.4	Confident	86 Å²	86	68 Å²	68	46%	0.46	39%	0.386	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.5	7.1	-176.5	-65.6	-48	0	0	0	114.6	K140 I150	K140-D152 HydrophobicContact CD-CB 3.75Å; K140-D152 HydrophobicContact CG-CB 4.26Å; K140-D152 PolarHBondContact NZ-O 3.33Å; I150-D152 PolarHBondContact O-N 2.71Å
153	Y	79.7	Confident	76.8	Confident	14 Å²	14	67.6 Å²	67.6	6%	0.055	39%	0.385	C	S	.	.			trans	-124	154.3	173.5	-68.5	-105.8	0	0	0	111.2	M57 F60 Y96 K140 I150 D155 Y158	M57-Y153 HydrophobicContact CE-CD1 3.36Å; M57-Y153 HydrophobicContact CE-CD2 3.74Å; M57-Y153 HydrophobicContact CE-CE1 3.27Å; M57-Y153 HydrophobicContact CE-CE2 3.58Å; M57-Y153 HydrophobicContact CE-CG 3.57Å; F60-Y153 HydrophobicContact CE2-CD1 4.08Å; F60-Y153 HydrophobicContact CE2-CE1 4.08Å; Y96-Y153 PolarHBondContact O-OH 3.17Å; K140-Y153 HydrophobicContact CD-CD2 4.21Å; K140-Y153 HydrophobicContact CD-CE2 3.72Å; I150-Y153 HydrophobicContact CG2-CD2 3.34Å; I150-Y153 HydrophobicContact CG2-CE2 4.28Å; I150-Y153 HydrophobicContact CG2-CG 3.68Å; Y153-D155 HydrophobicContact CD1-CB 4.46Å; Y153-Y158 HydrophobicContact CE1-CD1 4.15Å; Y153-Y158 AromaticContact CZ-CD1 3.82Å; Y153-Y158 WeakPolarHBondContact OH-CD1 3.36Å; Y153-Y158 VanDerWaalsContact OH-CE1 3.23Å; Y153-Y158 WeakPolarHBondContact OH-CE1 3.34Å
154	P	84.4	Confident	77.3	Confident	101 Å²	101	71.7 Å²	71.7	66%	0.656	40%	0.402	S	S	*	.			cis	-73	139.6	9	30.4	-35.6	0	0	0	114
155	D	83.7	Confident	78.4	Confident	44 Å²	44	69.3 Å²	69.3	24%	0.235	39%	0.393	C	S	.	.			trans	-143.4	93.4	170.6	-178.3	-9.4	0	0	0	108.7	K140 Y153 N157 Y158	K140-D155 WeakPolarHBondContact CE-OD2 3.24Å; K140-D155 VanDerWaalsContact NZ-CG 3.34Å; K140-D155 IonicContact NZ-OD2 3.62Å; K140-D155 PolarHBondContact NZ-OD2 3.3Å; Y153-D155 HydrophobicContact CD1-CB 4.46Å; D155-N157 PolarHBondContact O-N 3.04Å; D155-N157 PolarHBondContact OD1-N 3.09Å; D155-Y158 WeakPolarHBondContact O-CB 3.47Å; D155-Y158 PolarHBondContact O-N 2.77Å; D155-Y158 PolarHBondContact OD1-N 3.17Å
156	A	84.2	Confident	79.8	Confident	83 Å²	83	60.1 Å²	60.1	69%	0.686	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-25.6	-172.2	0	0	0	0	0	113.3
157	N	88	Confident	81.2	Confident	116 Å²	116	60.4 Å²	60.4	62%	0.62	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96.5	-3.9	-175.2	-68.9	-33.3	0	0	0	113.1	D155 T161	D155-N157 PolarHBondContact O-N 3.04Å; D155-N157 PolarHBondContact OD1-N 3.09Å; N157-T161 VanDerWaalsContact O-CB 3.31Å; N157-T161 WeakPolarHBondContact O-CB 3.44Å; N157-T161 PolarHBondContact O-N 3.39Å; N157-T161 PolarHBondContact O-OG1 2.77Å
158	Y	91.1	Very high	83	Confident	5 Å²	5	62 Å²	62	2%	0.02	35%	0.348	C	S	.	.	H	α-helix	trans	-59	-53.6	-174.4	176.9	-115.8	0	0	0	112.6	L97 P138 K140 Y153 D155 T160 T161 L162	L97-Y158 HydrophobicContact CD2-CD1 4.41Å; L97-Y158 HydrophobicContact CD2-CE1 3.68Å; P138-Y158 VanDerWaalsContact O-CE2 3.3Å; P138-Y158 WeakPolarHBondContact O-CE2 3.47Å; K140-Y158 HydrophobicContact CB-CE2 4.35Å; K140-Y158 HydrophobicContact CD-CD1 4.23Å; K140-Y158 HydrophobicContact CD-CD2 3.86Å; K140-Y158 HydrophobicContact CD-CE1 4.09Å; K140-Y158 HydrophobicContact CD-CE2 3.71Å; K140-Y158 HydrophobicContact CD-CG 4.11Å; K140-Y158 VanDerWaalsContact CE-CD2 3.49Å; K140-Y158 HydrophobicContact CG-CD2 4.22Å; K140-Y158 HydrophobicContact CG-CE1 4.45Å; K140-Y158 HydrophobicContact CG-CE2 3.61Å; K140-Y158 PolarHBondContact N-OH 3.25Å; Y153-Y158 HydrophobicContact CE1-CD1 4.15Å; Y153-Y158 AromaticContact CZ-CD1 3.82Å; Y153-Y158 WeakPolarHBondContact OH-CD1 3.36Å; Y153-Y158 VanDerWaalsContact OH-CE1 3.23Å; Y153-Y158 WeakPolarHBondContact OH-CE1 3.34Å; D155-Y158 WeakPolarHBondContact O-CB 3.47Å; D155-Y158 PolarHBondContact O-N 2.77Å; D155-Y158 PolarHBondContact OD1-N 3.17Å; Y158-T160 VanDerWaalsContact C-N 3.34Å; Y158-T160 PolarHBondContact O-N 2.81Å; Y158-T161 PolarHBondContact O-N 3.29Å; Y158-L162 HydrophobicContact CE1-CD2 3.95Å; Y158-L162 HydrophobicContact CE2-CD2 4.42Å; Y158-L162 WeakPolarHBondContact O-CB 3.32Å; Y158-L162 PolarHBondContact O-N 3.31Å
159	L	91.6	Very high	84.5	Confident	1 Å²	1	63.4 Å²	63.4	1%	0.005	35%	0.348	C	S	.	.	H	α-helix	trans	-63.7	-40	-175.5	-62.3	-178.4	0	0	0	112.4	F60 L97 P98 E102 V106 S163	F60-L159 HydrophobicContact CZ-CD1 4.3Å; L97-L159 HydrophobicContact CB-CD2 4.49Å; L97-L159 HydrophobicContact CD2-CD2 3.62Å; P98-L159 HydrophobicContact CG-CD1 3.62Å; E102-L159 HydrophobicContact CB-CD1 4.08Å; E102-L159 HydrophobicContact CG-CB 3.8Å; E102-L159 HydrophobicContact CG-CD1 3.98Å; E102-L159 VanDerWaalsContact OE1-CB 3.22Å; E102-L159 WeakPolarHBondContact OE1-CB 3.49Å; V106-L159 HydrophobicContact CG2-CB 4.31Å; V106-L159 HydrophobicContact CG2-CD2 4.27Å; L159-S163 VanDerWaalsContact O-CB 3.29Å; L159-S163 WeakPolarHBondContact O-CB 3.21Å; L159-S163 PolarHBondContact O-N 3.04Å; L159-S163 PolarHBondContact O-OG 3.41Å
160	T	92.3	Very high	85.9	Confident	81 Å²	81	61.5 Å²	61.5	50%	0.497	35%	0.35	S	S	.	.	H	α-helix	trans	-67.1	-44	177	-63.5	0	0	0	0	111	E102 Y158 S163 K164	E102-T160 WeakPolarHBondContact OE1-CA 3.33Å; E102-T160 PolarHBondContact OE1-N 3.49Å; E102-T160 PolarHBondContact OE1-OG1 3.3Å; Y158-T160 VanDerWaalsContact C-N 3.34Å; Y158-T160 PolarHBondContact O-N 2.81Å; T160-S163 PolarHBondContact O-N 3.26Å; T160-K164 WeakPolarHBondContact O-CB 3.49Å; T160-K164 PolarHBondContact O-N 3.4Å
161	T	92.6	Very high	87.1	Confident	62 Å²	62	61.1 Å²	61.1	38%	0.38	35%	0.348	S	S	.	.	H	α-helix	trans	-63.1	-46.7	176.6	-58.3	0	0	0	0	111	N157 Y158 K164 V165	N157-T161 VanDerWaalsContact O-CB 3.31Å; N157-T161 WeakPolarHBondContact O-CB 3.44Å; N157-T161 PolarHBondContact O-N 3.39Å; N157-T161 PolarHBondContact O-OG1 2.77Å; Y158-T161 PolarHBondContact O-N 3.29Å; T161-K164 WeakPolarHBondContact O-CB 3.18Å; T161-K164 PolarHBondContact O-N 3.49Å; T161-V165 WeakPolarHBondContact O-CG2 3.23Å; T161-V165 PolarHBondContact O-N 3.06Å
162	L	93.1	Very high	87.8	Confident	0 Å²	0	63.9 Å²	63.9	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-61.3	-46.5	179.1	-176.6	58.3	0	0	0	111.3	V106 V137 P138 L139 Y158 K164 V165 L166	V106-L162 HydrophobicContact CG1-CD2 3.53Å; V106-L162 HydrophobicContact CG1-CG 4.1Å; V137-L162 HydrophobicContact CG1-CD1 3.26Å; P138-L162 HydrophobicContact CG-CD1 4.45Å; L139-L162 HydrophobicContact CD2-CD1 4.2Å; L139-L162 HydrophobicContact CD2-CD2 4.43Å; Y158-L162 HydrophobicContact CE1-CD2 3.95Å; Y158-L162 HydrophobicContact CE2-CD2 4.42Å; Y158-L162 WeakPolarHBondContact O-CB 3.32Å; Y158-L162 PolarHBondContact O-N 3.31Å; L162-K164 VanDerWaalsContact C-N 3.32Å; L162-K164 PolarHBondContact O-N 2.95Å; L162-V165 PolarHBondContact O-N 3.37Å; L162-L166 HydrophobicContact CD1-CD1 4.18Å; L162-L166 HydrophobicContact CD1-CG 4.41Å; L162-L166 HydrophobicContact CG-CD1 4Å; L162-L166 VanDerWaalsContact O-CG 3.3Å; L162-L166 WeakPolarHBondContact O-CG 3.44Å; L162-L166 PolarHBondContact O-N 2.69Å
163	S	92.6	Very high	88.5	Confident	12 Å²	12	62.8 Å²	62.8	8%	0.084	35%	0.349	C	S	.	.	H	α-helix	trans	-57.1	-43.7	173.7	-66.8	0	0	0	0	112.2	V106 L159 T160 L166 R167	V106-S163 WeakPolarHBondContact CG2-OG 3.38Å; L159-S163 VanDerWaalsContact O-CB 3.29Å; L159-S163 WeakPolarHBondContact O-CB 3.21Å; L159-S163 PolarHBondContact O-N 3.04Å; L159-S163 PolarHBondContact O-OG 3.41Å; T160-S163 PolarHBondContact O-N 3.26Å; S163-L166 PolarHBondContact O-N 3.34Å; S163-R167 WeakPolarHBondContact O-CB 3.49Å; S163-R167 VanDerWaalsContact O-CG 3.24Å; S163-R167 WeakPolarHBondContact O-CG 3.39Å; S163-R167 PolarHBondContact O-N 3.33Å
164	K	92.8	Very high	89	Confident	160 Å²	160	65.4 Å²	65.4	70%	0.696	36%	0.364	S	S	*	.	H	α-helix	trans	-64.6	-43	179.1	-173.8	179	179.3	-178.6	0	111.8	T160 T161 L162 R167 S168	T160-K164 WeakPolarHBondContact O-CB 3.49Å; T160-K164 PolarHBondContact O-N 3.4Å; T161-K164 WeakPolarHBondContact O-CB 3.18Å; T161-K164 PolarHBondContact O-N 3.49Å; L162-K164 VanDerWaalsContact C-N 3.32Å; L162-K164 PolarHBondContact O-N 2.95Å; K164-R167 PolarHBondContact O-N 3.31Å; K164-S168 WeakPolarHBondContact O-CB 3.29Å; K164-S168 PolarHBondContact O-N 2.95Å; K164-S168 PolarHBondContact O-OG 3.09Å
165	V	91.8	Very high	89.2	Confident	34 Å²	34	63.4 Å²	63.4	21%	0.206	35%	0.348	C	S	.	.	H	α-helix	trans	-66.6	-41.7	177.7	173.3	0	0	0	0	111.6	S136 P138 T161 L162 S168 K169	S136-V165 WeakPolarHBondContact O-CG1 3.46Å; P138-V165 HydrophobicContact CG-CG2 4.46Å; T161-V165 WeakPolarHBondContact O-CG2 3.23Å; T161-V165 PolarHBondContact O-N 3.06Å; L162-V165 PolarHBondContact O-N 3.37Å; V165-S168 PolarHBondContact O-N 3.27Å; V165-S168 PolarHBondContact O-OG 2.78Å; V165-K169 HydrophobicContact CG1-CD 4.49Å; V165-K169 WeakPolarHBondContact O-CG 3.46Å; V165-K169 PolarHBondContact O-N 3.3Å
166	L	91.6	Very high	89.6	Confident	0 Å²	0	64.5 Å²	64.5	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-63.7	-44	176.5	-69.8	165	0	0	0	110.8	L109 L110 A113 L119 V137 L162 S163 K169 I171	L109-L166 HydrophobicContact CB-CB 4.27Å; L109-L166 HydrophobicContact CB-CD1 3.68Å; L109-L166 HydrophobicContact CD1-CB 4.41Å; L109-L166 HydrophobicContact CD1-CD1 4.41Å; L110-L166 HydrophobicContact CD2-CD1 3.75Å; L110-L166 HydrophobicContact CD2-CD2 4.15Å; L110-L166 HydrophobicContact CG-CD1 4.2Å; A113-L166 HydrophobicContact CB-CD2 3.87Å; L119-L166 HydrophobicContact CD2-CD2 4.02Å; V137-L166 HydrophobicContact CG1-CD2 3.91Å; V137-L166 HydrophobicContact CG1-CG 4.3Å; V137-L166 HydrophobicContact CG2-CD2 3.87Å; L162-L166 HydrophobicContact CD1-CD1 4.18Å; L162-L166 HydrophobicContact CD1-CG 4.41Å; L162-L166 HydrophobicContact CG-CD1 4Å; L162-L166 VanDerWaalsContact O-CG 3.3Å; L162-L166 WeakPolarHBondContact O-CG 3.44Å; L162-L166 PolarHBondContact O-N 2.69Å; S163-L166 PolarHBondContact O-N 3.34Å; L166-K169 WeakPolarHBondContact O-CB 3.45Å; L166-K169 PolarHBondContact O-N 2.75Å; L166-I171 HydrophobicContact CB-CD1 4.31Å; L166-I171 HydrophobicContact CD2-CD1 3.8Å; L166-I171 WeakPolarHBondContact O-CB 3.22Å; L166-I171 PolarHBondContact O-N 2.94Å
167	R	91.6	Very high	89.9	Confident	132 Å²	132	63.4 Å²	63.4	50%	0.498	33%	0.334	S	S	.	.	H	α-helix	trans	-66.5	-37.3	177.7	-72.3	172.8	-177.9	-112	-1.4	113.3	S163 K164 K169 G170 I171	S163-R167 WeakPolarHBondContact O-CB 3.49Å; S163-R167 VanDerWaalsContact O-CG 3.24Å; S163-R167 WeakPolarHBondContact O-CG 3.39Å; S163-R167 PolarHBondContact O-N 3.33Å; K164-R167 PolarHBondContact O-N 3.31Å; R167-K169 PolarHBondContact O-N 2.72Å; R167-G170 PolarHBondContact O-N 3.28Å; R167-I171 WeakPolarHBondContact CA-O 3.17Å
168	S	89.9	Confident	90	Very high	97 Å²	97	59.9 Å²	59.9	68%	0.678	32%	0.315	S	S	*	.	H	α-helix	trans	-66.2	-21.9	176.3	71.3	0	0	0	0	112.6	K164 V165 G170	K164-S168 WeakPolarHBondContact O-CB 3.29Å; K164-S168 PolarHBondContact O-N 2.95Å; K164-S168 PolarHBondContact O-OG 3.09Å; V165-S168 PolarHBondContact O-N 3.27Å; V165-S168 PolarHBondContact O-OG 2.78Å; S168-G170 PolarHBondContact O-N 3.16Å
169	K	85.9	Confident	89.9	Confident	76 Å²	76	63.8 Å²	63.8	33%	0.33	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.8	6.3	171	-67.5	177.1	-174.1	-60.5	0	113.8	S136 V137 V165 L166 R167 I171	S136-K169 VanDerWaalsContact O-CE 3.24Å; S136-K169 WeakPolarHBondContact O-CE 3.01Å; S136-K169 WeakPolarHBondContact OG-CE 3.24Å; S136-K169 PolarHBondContact OG-NZ 2.73Å; V137-K169 HydrophobicContact CG2-CD 4Å; V165-K169 HydrophobicContact CG1-CD 4.49Å; V165-K169 WeakPolarHBondContact O-CG 3.46Å; V165-K169 PolarHBondContact O-N 3.3Å; L166-K169 WeakPolarHBondContact O-CB 3.45Å; L166-K169 PolarHBondContact O-N 2.75Å; R167-K169 PolarHBondContact O-N 2.72Å; K169-I171 HydrophobicContact CB-CD1 4.07Å
170	G	87.6	Confident	89.8	Confident	50 Å²	50	68.6 Å²	68.6	52%	0.515	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	85.5	4.9	178	0	0	0	0	0	114.8	R167 S168 K172	R167-G170 PolarHBondContact O-N 3.28Å; S168-G170 PolarHBondContact O-N 3.16Å; G170-K172 PolarHBondContact O-N 3.29Å
171	I	87.9	Confident	89.6	Confident	0 Å²	0	67.6 Å²	67.6	0%	0	35%	0.35	C	S	.	.			trans	-81.5	118.6	179.6	-57.3	147.3	0	0	0	109.1	L109 K112 A113 L118 L166 R167 K169	L109-I171 HydrophobicContact CB-CG2 4.38Å; L109-I171 HydrophobicContact CD2-CG2 4.05Å; L109-I171 WeakPolarHBondContact O-CG2 3.5Å; K112-I171 HydrophobicContact CB-CG2 3.67Å; K112-I171 HydrophobicContact CD-CG2 4.41Å; A113-I171 HydrophobicContact CB-CD1 3.45Å; A113-I171 VanDerWaalsContact CB-CD1 3.45Å; A113-I171 HydrophobicContact CB-CG1 4.25Å; L118-I171 HydrophobicContact CD1-CD1 4.09Å; L118-I171 HydrophobicContact CD1-CG1 4.18Å; L166-I171 HydrophobicContact CB-CD1 4.31Å; L166-I171 HydrophobicContact CD2-CD1 3.8Å; L166-I171 WeakPolarHBondContact O-CB 3.22Å; L166-I171 PolarHBondContact O-N 2.94Å; R167-I171 WeakPolarHBondContact CA-O 3.17Å; K169-I171 HydrophobicContact CB-CD1 4.07Å
172	K	77.9	Confident	89.3	Confident	188 Å²	188	68.1 Å²	68.1	82%	0.817	35%	0.348	S	S	*	.			trans	-133.3	0	-177.6	-61.8	178.3	-174.7	175.2	0	109.8	K112 G170	K112-K172 VanDerWaalsContact CD-O 3.31Å; K112-K172 WeakPolarHBondContact CD-O 3.33Å; K112-K172 WeakPolarHBondContact CE-O 3.47Å; K112-K172 PolarHBondContact NZ-O 3.35Å; K112-K172 PolarHBondContact NZ-OXT 2.81Å; G170-K172 PolarHBondContact O-N 3.29Å

Retrieved 172 of 172 residues in 1315.1 ms (Link to these results)

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