A0A087XM83_POEFO Loading...

Protein NATD1

AlphaFold DB , UniProt , Accession A0A087XM83, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 140 aa.

						>A0A087XM83_POEFO|A0A087XM83
MECFPLPRSSSSSHVAISVLAEKAQQTDNSAKMAQANSFEASSSQIQVEHDKKRRQFVIRLNGSHDRAVLLYEYVGKKTVDLQHTEVPDAYRGRGIAKHLAKAAMDFVVEEDLKAHLTCWYIQKYVKENPQPQYFEHIHQ
					

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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	51.3	Low	44.7	Very low	221 Å²	221	142.5 Å²	142.5	100%	1.089	78%	0.778	S	S	*	*				0	107.9	0	-81.2	85.3	165	0	0	105.8
2	E	38.3	Very low	44.8	Very low	158 Å²	158	139.2 Å²	139.2	74%	0.738	77%	0.773	S	S	*	*			cis	-160.2	144.2	41.4	-67.2	-67.8	69.8	0	0	111
3	C	36	Very low	44.8	Very low	116 Å²	116	136.5 Å²	136.5	78%	0.784	77%	0.77	S	S	*	*			trans	65.8	107.6	138.6	-60	0	0	0	0	123
4	F	39.7	Very low	44.7	Very low	173 Å²	173	138.5 Å²	138.5	76%	0.759	77%	0.77	S	S	*	*			trans	-50.9	154.1	136.1	-120	-116.3	0	0	0	110.8	L6	F4-L6 HydrophobicContact CD1-CG 4.43Å; F4-L6 HydrophobicContact CE1-CD1 3.93Å; F4-L6 HydrophobicContact CE1-CG 3.82Å
5	P	51	Low	44.2	Very low	124 Å²	124	138.7 Å²	138.7	81%	0.805	78%	0.775	S	S	*	*				-152.3	168.9	66.9	37.2	-14.8	0	0	0	118.4
6	L	35.3	Very low	43.9	Very low	136 Å²	136	134 Å²	134	71%	0.712	76%	0.76	S	S	*	*			trans	-72.8	-159.3	164.8	-63.8	169.3	0	0	0	111.6	F4	F4-L6 HydrophobicContact CD1-CG 4.43Å; F4-L6 HydrophobicContact CE1-CD1 3.93Å; F4-L6 HydrophobicContact CE1-CG 3.82Å
7	P	58.1	Low	43.7	Very low	109 Å²	109	136.1 Å²	136.1	71%	0.708	77%	0.766	S	S	*	*				-124	177.3	-74.9	36.6	-20.3	0	0	0	111.5
8	R	39.7	Very low	43.4	Very low	230 Å²	230	133.8 Å²	133.8	87%	0.868	76%	0.76	S	S	*	*			trans	168.6	120.5	136.8	-105.2	179.7	160.3	-143.3	-3.1	113.7
9	S	42.6	Very low	43.2	Very low	90 Å²	90	133.5 Å²	133.5	63%	0.629	76%	0.761	S	S	*	*				74.8	126.1	110.5	74.9	0	0	0	0	115.1
10	S	48.1	Very low	43.2	Very low	103 Å²	103	134.2 Å²	134.2	72%	0.72	76%	0.762	S	S	*	*				-163.4	125	84.7	-65.8	0	0	0	0	109.8
11	S	51.4	Low	43.4	Very low	107 Å²	107	131.1 Å²	131.1	75%	0.748	75%	0.753	S	S	*	*				79.8	101.2	99.7	-51.8	0	0	0	0	111.9
12	S	45.5	Very low	43.5	Very low	103 Å²	103	128.5 Å²	128.5	72%	0.72	74%	0.738	S	S	*	*				69.2	119.9	97.2	-160.1	0	0	0	0	111.6
13	S	45.6	Very low	43.6	Very low	105 Å²	105	130 Å²	130	73%	0.734	74%	0.742	S	S	*	*				-161.9	137.1	57	-65.9	0	0	0	0	113.2
14	H	42.7	Very low	44	Very low	164 Å²	164	128.2 Å²	128.2	76%	0.759	74%	0.736	S	S	*	*			trans	-12.9	142.1	143.7	-74.8	89.2	0	0	0	117
15	V	37.7	Very low	44.5	Very low	141 Å²	141	127 Å²	127	86%	0.855	73%	0.733	S	S	*	*				-142.4	117.9	103.7	-178.7	0	0	0	0	109.1
16	A	40	Very low	44.4	Very low	64 Å²	64	128.4 Å²	128.4	53%	0.529	73%	0.729	S	S	.	*			trans	-78.5	140.5	167.7	0	0	0	0	0	109.8
17	I	39.7	Very low	44.4	Very low	169 Å²	169	127.7 Å²	127.7	87%	0.867	73%	0.73	S	S	*	*			trans	-115.1	94.7	146.8	-61.2	-176	0	0	0	105.9
18	S	37.8	Very low	44	Very low	95 Å²	95	128.5 Å²	128.5	66%	0.664	73%	0.728	S	S	*	*			trans	-77.4	148.5	158.7	-60.2	0	0	0	0	108.6
19	V	39.5	Very low	44.5	Very low	128 Å²	128	124.3 Å²	124.3	78%	0.776	72%	0.724	S	S	*	*			trans	156.7	129.5	140	152.8	0	0	0	0	107.4
20	L	44.6	Very low	45	Very low	147 Å²	147	125.6 Å²	125.6	77%	0.77	73%	0.732	S	S	*	*			cis	-161.5	133.2	-8.1	-94.9	164.8	0	0	0	102.5
21	A	45.8	Very low	44.5	Very low	71 Å²	71	124.9 Å²	124.9	59%	0.587	73%	0.733	S	S	*	*				73.4	134.9	113	0	0	0	0	0	114
22	E	53.8	Low	43.9	Very low	165 Å²	165	128.9 Å²	128.9	77%	0.771	74%	0.737	S	S	*	*			cis	-169.6	137	43.7	-133	143.9	91.2	0	0	110.5
23	K	39.9	Very low	43.5	Very low	189 Å²	189	132.1 Å²	132.1	82%	0.822	74%	0.743	S	S	*	*			trans	56.3	115.4	138	-77.5	-173.1	171	-171.1	0	119.6
24	A	46	Very low	43.3	Very low	80 Å²	80	131.2 Å²	131.2	66%	0.661	74%	0.741	S	S	*	*				116.1	143.5	84.5	0	0	0	0	0	107.1
25	Q	48.7	Very low	43.5	Very low	147 Å²	147	132.9 Å²	132.9	69%	0.687	75%	0.75	S	S	*	*			cis	-166.7	144.2	28.4	-152	129.1	-70.6	0	0	106.8
26	Q	49.7	Very low	43.8	Very low	153 Å²	153	130.3 Å²	130.3	72%	0.715	74%	0.743	S	S	*	*			trans	43.6	140.5	130	-72.5	155.8	31.9	0	0	119
27	T	35.2	Very low	44.2	Very low	121 Å²	121	135.3 Å²	135.3	74%	0.742	76%	0.761	S	S	*	*			cis	178.3	150.5	32.8	15.3	0	0	0	0	107.2
28	D	49.3	Very low	44.5	Very low	126 Å²	126	131.7 Å²	131.7	67%	0.674	75%	0.75	S	S	*	*			trans	6.3	121.4	139.6	-143.5	-80.6	0	0	0	117.3
29	N	51.6	Low	45	Very low	143 Å²	143	136.5 Å²	136.5	77%	0.765	76%	0.759	S	S	*	*				169.8	120	118.3	-91.6	-65.2	0	0	0	112.9
30	S	51.6	Low	45.7	Very low	116 Å²	116	139.9 Å²	139.9	81%	0.811	77%	0.767	S	S	*	*			trans	-15.7	127.2	148.1	-57	0	0	0	0	118
31	A	38.6	Very low	45.6	Very low	89 Å²	89	137.3 Å²	137.3	74%	0.736	77%	0.767	S	S	*	*			trans	179	119.6	131.7	0	0	0	0	0	106.9
32	K	39.1	Very low	45.8	Very low	191 Å²	191	139.2 Å²	139.2	83%	0.83	78%	0.776	S	S	*	*				49.7	120.3	94.4	-90.3	-173.3	172	-166.5	0	110.2
33	M	36.6	Very low	45	Very low	171 Å²	171	136.8 Å²	136.8	84%	0.842	78%	0.777	S	S	*	*			cis	-164.9	165.7	22.1	-49.1	-174.7	57.9	0	0	103.4
34	A	42.3	Very low	45.2	Very low	85 Å²	85	132.9 Å²	132.9	70%	0.702	77%	0.774	S	S	*	*			cis	-154.6	137.6	24.2	0	0	0	0	0	108.2	A36	A34-A36 PolarHBondContact O-N 3.26Å
35	Q	46.1	Very low	45.9	Very low	200 Å²	200	137.8 Å²	137.8	94%	0.935	78%	0.783	S	S	*	*			trans	-67.5	111.3	158.1	-73.2	155.3	-40.2	0	0	107.7
36	A	43.7	Very low	47.1	Very low	86 Å²	86	133.3 Å²	133.3	71%	0.711	76%	0.763	S	S	*	*			trans	-117.3	69.6	160.5	0	0	0	0	0	108	A34 S38	A34-A36 PolarHBondContact O-N 3.26Å; A36-S38 PolarHBondContact O-N 2.86Å
37	N	48	Very low	48.6	Very low	170 Å²	170	133.1 Å²	133.1	91%	0.909	76%	0.762	S	S	*	*			trans	-81.2	77.5	170.1	-143.6	66	0	0	0	108.4
38	S	46.7	Very low	51.1	Low	92 Å²	92	129.8 Å²	129.8	64%	0.643	74%	0.741	S	S	*	*			trans	-160.4	67.2	169.6	59.4	0	0	0	0	111.1	A36	A36-S38 PolarHBondContact O-N 2.86Å
39	F	47.9	Very low	53.1	Low	196 Å²	196	127.8 Å²	127.8	86%	0.86	73%	0.728	S	S	*	*			trans	-160.9	66.6	165	-116	-76	0	0	0	112.2
40	E	54.2	Low	54.9	Low	199 Å²	199	123.7 Å²	123.7	93%	0.93	70%	0.704	S	S	*	*			trans	-123.8	70.1	169.1	-74.8	-90.8	93.5	0	0	108.9
41	A	42.4	Very low	56.7	Low	94 Å²	94	120.1 Å²	120.1	78%	0.777	68%	0.676	S	S	*	*			trans	-109.3	80.2	158.1	0	0	0	0	0	108
42	S	49.8	Very low	58.9	Low	110 Å²	110	120.8 Å²	120.8	77%	0.769	66%	0.662	S	S	*	*			trans	29	101.6	149.1	-177.7	0	0	0	0	117.3
43	S	38.6	Very low	61.2	Low	114 Å²	114	120.8 Å²	120.8	80%	0.797	66%	0.663	S	S	*	*			trans	-170.2	115.2	143.5	-82.8	0	0	0	0	109.1
44	S	44.1	Very low	63.6	Low	107 Å²	107	120.2 Å²	120.2	75%	0.748	65%	0.651	S	S	*	*			trans	29.6	108	164.4	-53.6	0	0	0	0	116.1	I46	S44-I46 VanDerWaalsContact C-N 3.28Å; S44-I46 WeakPolarHBondContact O-CG1 3.42Å; S44-I46 PolarHBondContact O-N 3.09Å
45	Q	59.7	Low	66	Low	183 Å²	183	120.6 Å²	120.6	86%	0.855	63%	0.634	S	S	*	*			trans	-53.3	75	-175	-58.9	168.9	-6.4	0	0	114.3	Q47	Q45-Q47 PolarHBondContact O-N 3.28Å; Q45-Q47 VanDerWaalsContact O-N 3.11Å
46	I	73.4	Confident	68.2	Low	53 Å²	53	111.9 Å²	111.9	27%	0.272	59%	0.593	S	S	.	*			trans	-78.8	94.1	171.4	-65.6	178.9	0	0	0	106.5	S44 I59 I96 H99	S44-I46 VanDerWaalsContact C-N 3.28Å; S44-I46 WeakPolarHBondContact O-CG1 3.42Å; S44-I46 PolarHBondContact O-N 3.09Å; I46-I59 HydrophobicContact CG2-CB 4.49Å; I46-I59 HydrophobicContact CG2-CD1 3.68Å; I46-I59 HydrophobicContact CG2-CG1 4.11Å; I46-I59 HydrophobicContact CG2-CG2 3.57Å; I46-I96 HydrophobicContact CD1-CG1 3.96Å; I46-H99 HydrophobicContact CG2-CB 4.31Å
47	Q	81.5	Confident	70.4	Confident	150 Å²	150	108 Å²	108	70%	0.701	56%	0.561	S	S	*	*			trans	-83.4	123.9	176	-66.9	-171.2	11.6	0	0	110.2	Q45	Q45-Q47 PolarHBondContact O-N 3.28Å; Q45-Q47 VanDerWaalsContact O-N 3.11Å
48	V	88.4	Confident	72.5	Confident	50 Å²	50	100.3 Å²	100.3	30%	0.303	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	115.9	171.1	-169.9	0	0	0	0	108.4	F57 I59 H99 L100 A103	V48-F57 HydrophobicContact CG1-CB 3.92Å; V48-F57 HydrophobicContact CG1-CD1 4.01Å; V48-F57 HydrophobicContact CG1-CG 4.45Å; V48-I59 HydrophobicContact CB-CG1 4.19Å; V48-I59 HydrophobicContact CG1-CG1 4.24Å; V48-I59 HydrophobicContact CG2-CD1 3.83Å; V48-I59 HydrophobicContact CG2-CG1 3.76Å; V48-H99 HydrophobicContact CG2-CB 4.34Å; V48-L100 HydrophobicContact CG1-CD2 4.09Å; V48-A103 HydrophobicContact CB-CB 4.12Å; V48-A103 HydrophobicContact CG1-CB 3.76Å; V48-A103 HydrophobicContact CG2-CB 4.14Å
49	E	89.9	Confident	74.5	Confident	84 Å²	84	96 Å²	96	39%	0.393	49%	0.489	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.9	118.2	171.9	-169.5	-176.4	96.1	0	0	108.5	F57 V58 R60	E49-F57 CarbonylContact O-C 3.46Å; E49-F57 WeakPolarHBondContact O-CA 3.42Å; E49-V58 HydrophobicContact CB-CB 4.48Å; E49-V58 WeakPolarHBondContact CB-O 3.14Å; E49-V58 PolarHBondContact N-O 3.31Å; E49-V58 PolarHBondContact O-N 2.74Å; E49-R60 IonicContact OE1-NH2 3.46Å; E49-R60 IonicContact OE2-CZ 2.74Å; E49-R60 IonicContact OE2-NE 2.84Å; E49-R60 PolarHBondContact OE2-NE 3.48Å; E49-R60 IonicContact OE2-NH2 3.41Å; E49-R60 PolarHBondContact OE2-NH2 3.37Å
50	H	90.8	Very high	76.3	Confident	58 Å²	58	95.3 Å²	95.3	27%	0.269	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	110.3	175.5	-178.4	-161	0	0	0	110.6	K52 F57 Y72 F107	H50-K52 WeakPolarHBondContact CE1-CG 3.41Å; H50-F57 HydrophobicContact CB-CD1 3.78Å; H50-F57 HydrophobicContact CB-CE1 3.67Å; H50-F57 AromaticContact CD2-CD1 3.64Å; H50-F57 AromaticContact CD2-CE1 3.24Å; H50-F57 WeakPolarHBondContact CD2-CE1 3.26Å; H50-F57 AromaticContact CD2-CE2 3.95Å; H50-F57 AromaticContact CD2-CZ 3.4Å; H50-F57 VanDerWaalsContact CD2-CZ 3.4Å; H50-F57 WeakPolarHBondContact CD2-CZ 3.44Å; H50-F57 AromaticContact CE1-CE1 3.83Å; H50-F57 AromaticContact CE1-CZ 3.65Å; H50-F57 AromaticContact CG-CD1 3.79Å; H50-F57 AromaticContact CG-CE1 3.29Å; H50-F57 AromaticContact CG-CZ 3.84Å; H50-F57 AromaticContact ND1-CE1 3.72Å; H50-F57 AromaticContact NE2-CE1 3.62Å; H50-F57 AromaticContact NE2-CE2 3.87Å; H50-F57 AromaticContact NE2-CZ 3.3Å; H50-F57 VanDerWaalsContact NE2-CZ 3.3Å; H50-F57 WeakPolarHBondContact NE2-CZ 3.47Å; H50-Y72 AromaticContact NE2-CE1 3.57Å; H50-Y72 AromaticContact NE2-CZ 3.58Å; H50-Y72 PolarHBondContact NE2-OH 2.75Å; H50-F107 AromaticContact CE1-CD1 3.98Å; H50-F107 AromaticContact CE1-CD2 3.44Å; H50-F107 VanDerWaalsContact CE1-CD2 3.44Å; H50-F107 WeakPolarHBondContact CE1-CD2 3.47Å; H50-F107 AromaticContact CE1-CE2 3.56Å; H50-F107 AromaticContact CE1-CG 3.66Å; H50-F107 AromaticContact CE1-CZ 3.87Å; H50-F107 AromaticContact ND1-CD2 3.99Å
51	D	88.2	Confident	77.6	Confident	41 Å²	41	86.9 Å²	86.9	22%	0.219	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	90	173.5	-165.9	-37.1	0	0	0	109.9	K53 R54 R55 Q56	D51-K53 PolarHBondContact O-N 3.07Å; D51-K53 WeakPolarHBondContact OD1-CB 3.33Å; D51-K53 PolarHBondContact OD1-N 3.2Å; D51-K53 VanDerWaalsContact OD1-N 3.09Å; D51-R54 HydrophobicContact CB-CB 4.18Å; D51-R54 PolarHBondContact O-N 3.36Å; D51-R54 PolarHBondContact OD1-N 3.24Å; D51-R54 VanDerWaalsContact OD2-CD 3.26Å; D51-R54 WeakPolarHBondContact OD2-CD 3.36Å; D51-R54 WeakPolarHBondContact OD2-CG 3.49Å; D51-R55 WeakPolarHBondContact O-CA 3.26Å; D51-R55 PolarHBondContact O-N 3.3Å; D51-Q56 HydrophobicContact CB-CG 4.06Å; D51-Q56 PolarHBondContact N-O 3.07Å; D51-Q56 PolarHBondContact O-N 3.41Å; D51-Q56 VanDerWaalsContact O-N 3.08Å
52	K	85.9	Confident	79	Confident	102 Å²	102	90.8 Å²	90.8	44%	0.443	45%	0.45	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.6	177.1	-69.8	-175.3	-177.1	-169.1	0	112.8	H50 F107 E111	H50-K52 WeakPolarHBondContact CE1-CG 3.41Å; K52-F107 HydrophobicContact CD-CE2 4.4Å; K52-E111 IonicContact NZ-OE1 3.52Å; K52-E111 PolarHBondContact NZ-OE1 3.21Å
53	K	87.3	Confident	79.5	Confident	192 Å²	192	86.6 Å²	86.6	84%	0.835	42%	0.424	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.7	-44.1	-178.6	-65.3	-178.5	178.8	178.5	0	111	D51 R55	D51-K53 PolarHBondContact O-N 3.07Å; D51-K53 WeakPolarHBondContact OD1-CB 3.33Å; D51-K53 PolarHBondContact OD1-N 3.2Å; D51-K53 VanDerWaalsContact OD1-N 3.09Å; K53-R55 VanDerWaalsContact C-N 3.29Å
54	R	87.4	Confident	80.5	Confident	159 Å²	159	87.1 Å²	87.1	60%	0.6	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-85.1	-6.3	177.1	-63.6	-175.4	67.5	-170.9	0.5	113.2	D51 Q56	D51-R54 HydrophobicContact CB-CB 4.18Å; D51-R54 PolarHBondContact O-N 3.36Å; D51-R54 PolarHBondContact OD1-N 3.24Å; D51-R54 VanDerWaalsContact OD2-CD 3.26Å; D51-R54 WeakPolarHBondContact OD2-CD 3.36Å; D51-R54 WeakPolarHBondContact OD2-CG 3.49Å; R54-Q56 VanDerWaalsContact C-N 3.33Å; R54-Q56 HydrophobicContact CB-CG 3.7Å; R54-Q56 VanDerWaalsContact CZ-NE2 3.26Å; R54-Q56 PolarHBondContact O-N 2.78Å
55	R	91.3	Very high	81.7	Confident	93 Å²	93	90.1 Å²	90.1	35%	0.351	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	53.2	51.3	-177.8	-53.1	-176.5	-67	-98.9	9.2	111.7	D51 K53 Y72 E73 Y74	D51-R55 WeakPolarHBondContact O-CA 3.26Å; D51-R55 PolarHBondContact O-N 3.3Å; K53-R55 VanDerWaalsContact C-N 3.29Å; R55-Y72 VanDerWaalsContact CA-CE1 3.46Å; R55-Y72 VanDerWaalsContact CA-CZ 3.45Å; R55-Y72 HydrophobicContact CB-CD1 4.32Å; R55-Y72 HydrophobicContact CB-CD2 4.03Å; R55-Y72 HydrophobicContact CB-CE1 4.08Å; R55-Y72 HydrophobicContact CB-CE2 3.76Å; R55-Y72 HydrophobicContact CB-CG 4.3Å; R55-Y72 WeakPolarHBondContact CB-O 3.47Å; R55-Y72 HydrophobicContact CG-CE2 4.15Å; R55-Y72 WeakPolarHBondContact O-CD1 3.3Å; R55-Y72 WeakPolarHBondContact O-CE1 3.27Å; R55-Y72 PolarHBondContact O-N 2.78Å; R55-Y72 VanDerWaalsContact O-O 3.08Å; R55-E73 IonicContact CZ-OE1 3.74Å; R55-E73 IonicContact NE-OE1 3.84Å; R55-E73 IonicContact NH2-OE1 3.31Å; R55-E73 PolarHBondContact NH2-OE1 2.83Å; R55-Y74 HydrophobicContact CG-CD2 4.37Å; R55-Y74 HydrophobicContact CG-CE2 4.08Å
56	Q	92.1	Very high	82.8	Confident	16 Å²	16	84.4 Å²	84.4	8%	0.075	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.2	148.5	-178.7	63.6	-179	42.7	0	0	111.4	D51 R54 V58 L70 L71	D51-Q56 HydrophobicContact CB-CG 4.06Å; D51-Q56 PolarHBondContact N-O 3.07Å; D51-Q56 PolarHBondContact O-N 3.41Å; D51-Q56 VanDerWaalsContact O-N 3.08Å; R54-Q56 VanDerWaalsContact C-N 3.33Å; R54-Q56 HydrophobicContact CB-CG 3.7Å; R54-Q56 VanDerWaalsContact CZ-NE2 3.26Å; R54-Q56 PolarHBondContact O-N 2.78Å; Q56-V58 HydrophobicContact CG-CG2 4.01Å; Q56-V58 VanDerWaalsContact NE2-CG2 3.31Å; Q56-L70 CarbonylContact C-O 3.49Å; Q56-L70 WeakPolarHBondContact CA-O 3.42Å; Q56-L71 HydrophobicContact CB-CD2 3.67Å
57	F	91.2	Very high	83.4	Confident	5 Å²	5	88.2 Å²	88.2	2%	0.022	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.8	131.2	167.5	-63.2	-92.9	0	0	0	108.1	V48 E49 H50 V69 L70 Y72 L100 A103 A104 F107	V48-F57 HydrophobicContact CG1-CB 3.92Å; V48-F57 HydrophobicContact CG1-CD1 4.01Å; V48-F57 HydrophobicContact CG1-CG 4.45Å; E49-F57 CarbonylContact O-C 3.46Å; E49-F57 WeakPolarHBondContact O-CA 3.42Å; H50-F57 HydrophobicContact CB-CD1 3.78Å; H50-F57 HydrophobicContact CB-CE1 3.67Å; H50-F57 AromaticContact CD2-CD1 3.64Å; H50-F57 AromaticContact CD2-CE1 3.24Å; H50-F57 WeakPolarHBondContact CD2-CE1 3.26Å; H50-F57 AromaticContact CD2-CE2 3.95Å; H50-F57 AromaticContact CD2-CZ 3.4Å; H50-F57 VanDerWaalsContact CD2-CZ 3.4Å; H50-F57 WeakPolarHBondContact CD2-CZ 3.44Å; H50-F57 AromaticContact CE1-CE1 3.83Å; H50-F57 AromaticContact CE1-CZ 3.65Å; H50-F57 AromaticContact CG-CD1 3.79Å; H50-F57 AromaticContact CG-CE1 3.29Å; H50-F57 AromaticContact CG-CZ 3.84Å; H50-F57 AromaticContact ND1-CE1 3.72Å; H50-F57 AromaticContact NE2-CE1 3.62Å; H50-F57 AromaticContact NE2-CE2 3.87Å; H50-F57 AromaticContact NE2-CZ 3.3Å; H50-F57 VanDerWaalsContact NE2-CZ 3.3Å; H50-F57 WeakPolarHBondContact NE2-CZ 3.47Å; F57-V69 CarbonylContact O-C 3.5Å; F57-V69 WeakPolarHBondContact O-CA 3.45Å; F57-L70 HydrophobicContact CB-CB 4.27Å; F57-L70 HydrophobicContact CD2-CD2 4.09Å; F57-L70 PolarHBondContact N-O 2.84Å; F57-L70 PolarHBondContact O-N 3.08Å; F57-Y72 AromaticContact CD2-CD1 3.81Å; F57-Y72 HydrophobicContact CD2-CD1 3.81Å; F57-Y72 AromaticContact CD2-CE1 3.91Å; F57-Y72 HydrophobicContact CD2-CE1 3.91Å; F57-Y72 AromaticContact CE2-CD1 3.49Å; F57-Y72 HydrophobicContact CE2-CD1 3.49Å; F57-Y72 VanDerWaalsContact CE2-CD1 3.49Å; F57-Y72 AromaticContact CE2-CE1 3.42Å; F57-Y72 HydrophobicContact CE2-CE1 3.42Å; F57-Y72 VanDerWaalsContact CE2-CE1 3.42Å; F57-Y72 HydrophobicContact CZ-CE1 4.16Å; F57-L100 HydrophobicContact CB-CD2 3.83Å; F57-A103 HydrophobicContact CD1-CB 4.16Å; F57-A103 HydrophobicContact CE1-CB 4.39Å; F57-A104 HydrophobicContact CD2-CB 3.94Å; F57-A104 HydrophobicContact CE2-CB 3.7Å; F57-A104 HydrophobicContact CZ-CB 4.22Å; F57-F107 HydrophobicContact CE1-CB 4.34Å; F57-F107 HydrophobicContact CZ-CB 3.85Å; F57-F107 HydrophobicContact CZ-CD1 4.08Å; F57-F107 HydrophobicContact CZ-CG 4.06Å
58	V	91.1	Very high	83.8	Confident	9 Å²	9	81 Å²	81	6%	0.055	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	132.2	-176	-175.7	0	0	0	0	109	E49 Q56 R67 A68 V69	E49-V58 HydrophobicContact CB-CB 4.48Å; E49-V58 WeakPolarHBondContact CB-O 3.14Å; E49-V58 PolarHBondContact N-O 3.31Å; E49-V58 PolarHBondContact O-N 2.74Å; Q56-V58 HydrophobicContact CG-CG2 4.01Å; Q56-V58 VanDerWaalsContact NE2-CG2 3.31Å; V58-R67 HydrophobicContact CG1-CB 4.21Å; V58-A68 CarbonylContact C-O 3.56Å; V58-A68 WeakPolarHBondContact CA-O 3.24Å; V58-V69 HydrophobicContact CB-CG1 4.31Å; V58-V69 HydrophobicContact CG1-CG1 4.02Å; V58-V69 HydrophobicContact CG2-CG1 3.9Å
59	I	88.9	Confident	84	Confident	1 Å²	1	79.2 Å²	79.2	1%	0.005	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.1	122.5	167.4	-68.4	167.6	0	0	0	107.1	I46 V48 L61 R67 A68 I96 H99 L100	I46-I59 HydrophobicContact CG2-CB 4.49Å; I46-I59 HydrophobicContact CG2-CD1 3.68Å; I46-I59 HydrophobicContact CG2-CG1 4.11Å; I46-I59 HydrophobicContact CG2-CG2 3.57Å; V48-I59 HydrophobicContact CB-CG1 4.19Å; V48-I59 HydrophobicContact CG1-CG1 4.24Å; V48-I59 HydrophobicContact CG2-CD1 3.83Å; V48-I59 HydrophobicContact CG2-CG1 3.76Å; I59-L61 HydrophobicContact CG2-CD2 3.77Å; I59-L61 HydrophobicContact CG2-CG 4.42Å; I59-R67 VanDerWaalsContact O-CA 3.26Å; I59-R67 WeakPolarHBondContact O-CA 3.14Å; I59-R67 WeakPolarHBondContact O-CB 3.4Å; I59-A68 HydrophobicContact CB-CB 4.31Å; I59-A68 PolarHBondContact N-O 2.92Å; I59-A68 PolarHBondContact O-N 2.83Å; I59-I96 HydrophobicContact CD1-CG2 3.82Å; I59-I96 HydrophobicContact CG2-CG2 4.36Å; I59-H99 HydrophobicContact CD1-CB 4.04Å; I59-L100 HydrophobicContact CB-CD2 4.47Å; I59-L100 HydrophobicContact CD1-CD1 4.41Å; I59-L100 HydrophobicContact CD1-CD2 3.58Å; I59-L100 HydrophobicContact CD1-CG 3.52Å; I59-L100 HydrophobicContact CG1-CD2 3.65Å; I59-L100 HydrophobicContact CG1-CG 4.16Å
60	R	85.8	Confident	84.1	Confident	181 Å²	181	75.2 Å²	75.2	68%	0.683	35%	0.352	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.5	123.8	172.1	-59	-177.1	-172.4	-152.6	3.2	108.3	E49	E49-R60 IonicContact OE1-NH2 3.46Å; E49-R60 IonicContact OE2-CZ 2.74Å; E49-R60 IonicContact OE2-NE 2.84Å; E49-R60 PolarHBondContact OE2-NE 3.48Å; E49-R60 IonicContact OE2-NH2 3.41Å; E49-R60 PolarHBondContact OE2-NH2 3.37Å
61	L	82.3	Confident	84.2	Confident	22 Å²	22	75.6 Å²	75.6	12%	0.115	36%	0.356	C	S	.	.			trans	-98.4	157.3	179.6	-56.3	167.3	0	0	0	109.2	I59 G63 D66 A68 P88 Y91 I96	I59-L61 HydrophobicContact CG2-CD2 3.77Å; I59-L61 HydrophobicContact CG2-CG 4.42Å; L61-G63 PolarHBondContact O-N 2.92Å; L61-D66 HydrophobicContact CB-CB 4.25Å; L61-D66 WeakPolarHBondContact CB-O 3.09Å; L61-D66 HydrophobicContact CD1-CB 4.23Å; L61-D66 PolarHBondContact N-O 2.8Å; L61-A68 HydrophobicContact CD1-CB 4.42Å; L61-P88 HydrophobicContact CD1-CG 3.72Å; L61-Y91 HydrophobicContact CB-CD1 4.23Å; L61-Y91 HydrophobicContact CB-CE1 3.82Å; L61-Y91 HydrophobicContact CB-CE2 4.37Å; L61-Y91 HydrophobicContact CD1-CD1 3.89Å; L61-Y91 HydrophobicContact CD1-CD2 3.74Å; L61-Y91 HydrophobicContact CD1-CE1 4.26Å; L61-Y91 HydrophobicContact CD1-CE2 4.12Å; L61-Y91 HydrophobicContact CD1-CG 3.6Å; L61-Y91 HydrophobicContact CD2-CD1 4.15Å; L61-Y91 HydrophobicContact CD2-CE1 4.48Å; L61-Y91 HydrophobicContact CG-CD1 4.31Å; L61-Y91 HydrophobicContact CG-CE1 4.4Å; L61-Y91 HydrophobicContact CG-CG 4.5Å; L61-I96 HydrophobicContact CD1-CD1 4.4Å; L61-I96 HydrophobicContact CD2-CD1 3.48Å; L61-I96 VanDerWaalsContact CD2-CD1 3.48Å; L61-I96 HydrophobicContact CD2-CG1 4.11Å; L61-I96 HydrophobicContact CD2-CG2 4.29Å
62	N	71.1	Confident	84.4	Confident	177 Å²	177	73.9 Å²	73.9	95%	0.947	35%	0.347	S	S	*	.	S	Bend	trans	-66.8	17.3	-176.5	-89.2	41.6	0	0	0	115.2
63	G	61.5	Low	84.7	Confident	21 Å²	21	72.9 Å²	72.9	22%	0.216	34%	0.344	C	S	.	.	S	Bend	trans	-115.3	128.3	167.7	0	0	0	0	0	108.7	L61 H65 D66 Y91	L61-G63 PolarHBondContact O-N 2.92Å; G63-H65 PolarHBondContact O-N 2.75Å; G63-D66 PolarHBondContact O-N 2.86Å; G63-Y91 PolarHBondContact N-OH 2.82Å
64	S	59.1	Low	84.8	Confident	125 Å²	125	68.7 Å²	68.7	87%	0.874	32%	0.323	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.1	-14.2	-168.7	-61.3	0	0	0	0	116.7
65	H	69.2	Low	84.9	Confident	171 Å²	171	65.3 Å²	65.3	79%	0.792	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-121.8	-11.7	178.4	-57.3	136.9	0	0	0	114.6	G63	G63-H65 PolarHBondContact O-N 2.75Å
66	D	81.7	Confident	84.7	Confident	63 Å²	63	62.6 Å²	62.6	34%	0.337	32%	0.321	S	S	.	.			trans	-86.5	125.2	-177.9	-76.3	-73.2	0	0	0	110.4	L61 G63 P88 Y91	L61-D66 HydrophobicContact CB-CB 4.25Å; L61-D66 WeakPolarHBondContact CB-O 3.09Å; L61-D66 HydrophobicContact CD1-CB 4.23Å; L61-D66 PolarHBondContact N-O 2.8Å; G63-D66 PolarHBondContact O-N 2.86Å; D66-P88 HydrophobicContact CB-CG 4.18Å; D66-P88 WeakPolarHBondContact OD1-CB 3.38Å; D66-Y91 HydrophobicContact CB-CD2 4.17Å; D66-Y91 HydrophobicContact CB-CE2 3.48Å; D66-Y91 VanDerWaalsContact CB-CE2 3.48Å
67	R	87.1	Confident	84.4	Confident	132 Å²	132	72.2 Å²	72.2	50%	0.498	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	145.9	173.6	64	-178.5	-175.4	-75.6	-6	108.9	V58 I59 V69 P88	V58-R67 HydrophobicContact CG1-CB 4.21Å; I59-R67 VanDerWaalsContact O-CA 3.26Å; I59-R67 WeakPolarHBondContact O-CA 3.14Å; I59-R67 WeakPolarHBondContact O-CB 3.4Å; R67-V69 HydrophobicContact CG-CG1 4.07Å; R67-P88 WeakPolarHBondContact O-CD 3.42Å
68	A	89.6	Confident	84.3	Confident	0 Å²	0	77.6 Å²	77.6	0%	0	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	134.5	168.6	0	0	0	0	0	108.1	V58 I59 L61 E86 V87 I96 L100	V58-A68 CarbonylContact C-O 3.56Å; V58-A68 WeakPolarHBondContact CA-O 3.24Å; I59-A68 HydrophobicContact CB-CB 4.31Å; I59-A68 PolarHBondContact N-O 2.92Å; I59-A68 PolarHBondContact O-N 2.83Å; L61-A68 HydrophobicContact CD1-CB 4.42Å; A68-E86 CarbonylContact C-O 3.37Å; A68-E86 VanDerWaalsContact CA-O 3.28Å; A68-E86 WeakPolarHBondContact CA-O 3.37Å; A68-V87 HydrophobicContact CB-CB 4.31Å; A68-V87 HydrophobicContact CB-CG1 4.12Å; A68-V87 HydrophobicContact CB-CG2 3.88Å; A68-I96 HydrophobicContact CB-CG2 3.36Å; A68-L100 HydrophobicContact CB-CD1 3.71Å
69	V	91.9	Very high	84.2	Confident	11 Å²	11	78.7 Å²	78.7	7%	0.067	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	142.3	179.4	-57.9	0	0	0	0	111.3	F57 V58 R67 T85 E86	F57-V69 CarbonylContact O-C 3.5Å; F57-V69 WeakPolarHBondContact O-CA 3.45Å; V58-V69 HydrophobicContact CB-CG1 4.31Å; V58-V69 HydrophobicContact CG1-CG1 4.02Å; V58-V69 HydrophobicContact CG2-CG1 3.9Å; R67-V69 HydrophobicContact CG-CG1 4.07Å; V69-T85 CarbonylContact O-C 3.11Å; V69-T85 WeakPolarHBondContact O-CA 3.26Å; V69-E86 HydrophobicContact CG2-CB 3.8Å; V69-E86 PolarHBondContact N-O 3.01Å; V69-E86 PolarHBondContact O-N 2.79Å
70	L	93	Very high	84.4	Confident	0 Å²	0	78.7 Å²	78.7	0%	0	39%	0.393	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	121.2	168.7	-174.1	161.5	0	0	0	107.8	Q56 F57 L82 H84 T85 L100 A104 I122	Q56-L70 CarbonylContact C-O 3.49Å; Q56-L70 WeakPolarHBondContact CA-O 3.42Å; F57-L70 HydrophobicContact CB-CB 4.27Å; F57-L70 HydrophobicContact CD2-CD2 4.09Å; F57-L70 PolarHBondContact N-O 2.84Å; F57-L70 PolarHBondContact O-N 3.08Å; L70-L82 HydrophobicContact CD2-CD2 4.02Å; L70-H84 CarbonylContact C-O 3.41Å; L70-H84 WeakPolarHBondContact CA-O 3.45Å; L70-T85 HydrophobicContact CB-CG2 4.41Å; L70-L100 HydrophobicContact CB-CB 3.99Å; L70-L100 HydrophobicContact CB-CD1 4.2Å; L70-L100 HydrophobicContact CB-CD2 4.33Å; L70-L100 HydrophobicContact CB-CG 4.4Å; L70-L100 HydrophobicContact CD1-CB 3.94Å; L70-A104 HydrophobicContact CD1-CB 3.91Å; L70-A104 HydrophobicContact CD2-CB 3.96Å; L70-I122 HydrophobicContact CD1-CD1 3.6Å
71	L	92.2	Very high	84.7	Confident	67 Å²	67	70.5 Å²	70.5	35%	0.351	36%	0.363	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.5	135.6	179.7	-58.9	176.6	0	0	0	109.6	Q56 Q83 H84	Q56-L71 HydrophobicContact CB-CD2 3.67Å; L71-Q83 PolarHBondContact O-N 3.29Å; L71-H84 HydrophobicContact CB-CB 4.5Å; L71-H84 PolarHBondContact N-O 3.38Å; L71-H84 PolarHBondContact O-N 3.11Å
72	Y	92.7	Very high	85.1	Confident	4 Å²	4	69.6 Å²	69.6	2%	0.016	36%	0.358	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.9	159.6	172.6	72.2	-90.4	0	0	0	111	H50 R55 F57 Y74 V80 D81 L82 F107	H50-Y72 AromaticContact NE2-CE1 3.57Å; H50-Y72 AromaticContact NE2-CZ 3.58Å; H50-Y72 PolarHBondContact NE2-OH 2.75Å; R55-Y72 VanDerWaalsContact CA-CE1 3.46Å; R55-Y72 VanDerWaalsContact CA-CZ 3.45Å; R55-Y72 HydrophobicContact CB-CD1 4.32Å; R55-Y72 HydrophobicContact CB-CD2 4.03Å; R55-Y72 HydrophobicContact CB-CE1 4.08Å; R55-Y72 HydrophobicContact CB-CE2 3.76Å; R55-Y72 HydrophobicContact CB-CG 4.3Å; R55-Y72 WeakPolarHBondContact CB-O 3.47Å; R55-Y72 HydrophobicContact CG-CE2 4.15Å; R55-Y72 WeakPolarHBondContact O-CD1 3.3Å; R55-Y72 WeakPolarHBondContact O-CE1 3.27Å; R55-Y72 PolarHBondContact O-N 2.78Å; R55-Y72 VanDerWaalsContact O-O 3.08Å; F57-Y72 AromaticContact CD2-CD1 3.81Å; F57-Y72 HydrophobicContact CD2-CD1 3.81Å; F57-Y72 AromaticContact CD2-CE1 3.91Å; F57-Y72 HydrophobicContact CD2-CE1 3.91Å; F57-Y72 AromaticContact CE2-CD1 3.49Å; F57-Y72 HydrophobicContact CE2-CD1 3.49Å; F57-Y72 VanDerWaalsContact CE2-CD1 3.49Å; F57-Y72 AromaticContact CE2-CE1 3.42Å; F57-Y72 HydrophobicContact CE2-CE1 3.42Å; F57-Y72 VanDerWaalsContact CE2-CE1 3.42Å; F57-Y72 HydrophobicContact CZ-CE1 4.16Å; Y72-Y74 AromaticContact CE2-CE2 3.85Å; Y72-Y74 HydrophobicContact CE2-CE2 3.85Å; Y72-Y74 AromaticContact CE2-CZ 3.91Å; Y72-V80 HydrophobicContact CD2-CB 4.28Å; Y72-V80 HydrophobicContact CD2-CG1 4.18Å; Y72-V80 HydrophobicContact CE2-CG1 4.41Å; Y72-D81 CarbonylContact C-O 3.54Å; Y72-D81 WeakPolarHBondContact CA-O 3Å; Y72-D81 WeakPolarHBondContact CB-O 3.16Å; Y72-L82 HydrophobicContact CG-CD2 4.4Å; Y72-F107 HydrophobicContact CE2-CE1 4.42Å
73	E	91.9	Very high	86.1	Confident	81 Å²	81	64.6 Å²	64.6	38%	0.379	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.2	157.3	173.8	-71.2	-161.6	109.4	0	0	112.5	R55 V80 D81 Q83	R55-E73 IonicContact CZ-OE1 3.74Å; R55-E73 IonicContact NE-OE1 3.84Å; R55-E73 IonicContact NH2-OE1 3.31Å; R55-E73 PolarHBondContact NH2-OE1 2.83Å; E73-V80 CarbonylContact O-C 3.45Å; E73-V80 WeakPolarHBondContact O-CA 3.44Å; E73-D81 PolarHBondContact N-O 3.2Å; E73-D81 PolarHBondContact O-N 3.03Å; E73-Q83 VanDerWaalsContact CB-NE2 3.3Å; E73-Q83 PolarHBondContact OE2-NE2 3.04Å
74	Y	90.4	Very high	87.4	Confident	105 Å²	105	68.1 Å²	68.1	41%	0.412	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	112.7	173.5	-65.9	-84.8	0	0	0	108.9	R55 Y72 T79 V80 L113	R55-Y74 HydrophobicContact CG-CD2 4.37Å; R55-Y74 HydrophobicContact CG-CE2 4.08Å; Y72-Y74 AromaticContact CE2-CE2 3.85Å; Y72-Y74 HydrophobicContact CE2-CE2 3.85Å; Y72-Y74 AromaticContact CE2-CZ 3.91Å; Y74-T79 WeakPolarHBondContact CA-O 3.39Å; Y74-V80 HydrophobicContact CD1-CG1 3.4Å; Y74-V80 HydrophobicContact CE1-CG1 3.31Å; Y74-V80 HydrophobicContact CG-CG1 4.22Å; Y74-L113 HydrophobicContact CE1-CD1 4.45Å
75	V	89.8	Confident	88.9	Confident	87 Å²	87	63.2 Å²	63.2	53%	0.527	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.6	-3	179.3	-64.9	0	0	0	0	112.6	T79 D81	V75-T79 HydrophobicContact CG2-CG2 3.58Å; V75-T79 PolarHBondContact N-O 3.23Å; V75-D81 HydrophobicContact CB-CB 4.49Å; V75-D81 HydrophobicContact CG1-CB 3.58Å; V75-D81 HydrophobicContact CG2-CB 4.08Å
76	G	85.8	Confident	89.8	Confident	37 Å²	37	59.9 Å²	59.9	38%	0.381	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-162	-172.5	177.5	0	0	0	0	0	112.7	K78 T79	G76-K78 VanDerWaalsContact C-N 3.32Å; G76-K78 PolarHBondContact O-N 2.79Å; G76-T79 PolarHBondContact N-O 3.5Å
77	K	85.3	Confident	90	Very high	217 Å²	217	57.5 Å²	57.5	94%	0.943	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.9	-36.1	-178.1	-68.2	-173.6	179.1	-177.7	0	113.5
78	K	89.1	Confident	89.9	Confident	118 Å²	118	52.5 Å²	52.5	51%	0.513	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-138.9	33.8	177	-70.7	-169.1	163.7	-155.5	0	110.4	G76 D112 L113 K114	G76-K78 VanDerWaalsContact C-N 3.32Å; G76-K78 PolarHBondContact O-N 2.79Å; K78-D112 IonicContact NZ-OD1 3.54Å; K78-D112 PolarHBondContact NZ-OD1 2.77Å; K78-L113 HydrophobicContact CB-CD2 4.18Å; K78-K114 PolarHBondContact O-N 3.04Å
79	T	90.3	Very high	89.6	Confident	32 Å²	32	57.7 Å²	57.7	20%	0.196	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	124.9	-177.4	-48.2	0	0	0	0	109.1	Y74 V75 G76 K114	Y74-T79 WeakPolarHBondContact CA-O 3.39Å; V75-T79 HydrophobicContact CG2-CG2 3.58Å; V75-T79 PolarHBondContact N-O 3.23Å; G76-T79 PolarHBondContact N-O 3.5Å; T79-K114 CarbonylContact C-O 3.55Å; T79-K114 VanDerWaalsContact CA-O 3.27Å; T79-K114 WeakPolarHBondContact CA-O 3.38Å; T79-K114 HydrophobicContact CG2-CB 4.04Å
80	V	92.1	Very high	89.1	Confident	1 Å²	1	60.7 Å²	60.7	1%	0.006	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.7	142.2	171.5	-64.5	0	0	0	0	109.6	Y72 E73 Y74 V108 L113 K114 A115 H116	Y72-V80 HydrophobicContact CD2-CB 4.28Å; Y72-V80 HydrophobicContact CD2-CG1 4.18Å; Y72-V80 HydrophobicContact CE2-CG1 4.41Å; E73-V80 CarbonylContact O-C 3.45Å; E73-V80 WeakPolarHBondContact O-CA 3.44Å; Y74-V80 HydrophobicContact CD1-CG1 3.4Å; Y74-V80 HydrophobicContact CE1-CG1 3.31Å; Y74-V80 HydrophobicContact CG-CG1 4.22Å; V80-V108 HydrophobicContact CG2-CG2 3.51Å; V80-L113 HydrophobicContact CG1-CD1 4.11Å; V80-K114 PolarHBondContact N-O 3.23Å; V80-A115 CarbonylContact O-C 3.59Å; V80-A115 WeakPolarHBondContact O-CA 3.43Å; V80-H116 PolarHBondContact O-N 3.48Å
81	D	92.5	Very high	88.4	Confident	10 Å²	10	62.4 Å²	62.4	5%	0.053	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107	121.8	171.9	-176.5	-149.4	0	0	0	110.5	Y72 E73 V75 Q83 H116 T118	Y72-D81 CarbonylContact C-O 3.54Å; Y72-D81 WeakPolarHBondContact CA-O 3Å; Y72-D81 WeakPolarHBondContact CB-O 3.16Å; E73-D81 PolarHBondContact N-O 3.2Å; E73-D81 PolarHBondContact O-N 3.03Å; V75-D81 HydrophobicContact CB-CB 4.49Å; V75-D81 HydrophobicContact CG1-CB 3.58Å; V75-D81 HydrophobicContact CG2-CB 4.08Å; D81-Q83 HydrophobicContact CB-CG 4.24Å; D81-Q83 PolarHBondContact O-N 3.13Å; D81-Q83 WeakPolarHBondContact OD1-CG 3.34Å; D81-H116 CarbonylContact C-O 3.5Å; D81-H116 WeakPolarHBondContact CA-O 3.24Å; D81-H116 HydrophobicContact CB-CB 4.02Å; D81-H116 VanDerWaalsContact OD2-C 3.31Å; D81-H116 IonicContact OD2-CD2 2.92Å; D81-H116 PolarHBondContact OD2-CD2 3.25Å; D81-H116 VanDerWaalsContact OD2-CD2 3.22Å; D81-H116 IonicContact OD2-CG 3.97Å; D81-T118 WeakPolarHBondContact OD1-CB 3.48Å; D81-T118 PolarHBondContact OD1-OG1 3.3Å; D81-T118 WeakPolarHBondContact OD2-CB 3.31Å; D81-T118 PolarHBondContact OD2-N 3.13Å; D81-T118 VanDerWaalsContact OD2-N 3.13Å; D81-T118 PolarHBondContact OD2-OG1 2.9Å
82	L	91.6	Very high	87.7	Confident	3 Å²	3	66.2 Å²	66.2	2%	0.016	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	91.9	174.8	-56.6	-173.2	0	0	0	108.5	L70 Y72 A104 M105 H116 L117 T118 C119 I122	L70-L82 HydrophobicContact CD2-CD2 4.02Å; Y72-L82 HydrophobicContact CG-CD2 4.4Å; L82-A104 HydrophobicContact CD1-CB 4.04Å; L82-A104 HydrophobicContact CD2-CB 4.08Å; L82-M105 HydrophobicContact CD1-SD 3.74Å; L82-H116 PolarHBondContact N-O 2.78Å; L82-L117 HydrophobicContact CB-CD2 4.16Å; L82-L117 HydrophobicContact CD1-CD2 3.74Å; L82-L117 HydrophobicContact CG-CD2 4.13Å; L82-T118 PolarHBondContact O-N 2.91Å; L82-C119 VanDerWaalsContact O-CB 3.27Å; L82-C119 WeakPolarHBondContact O-CB 3.41Å; L82-C119 PolarHBondContact O-N 2.74Å; L82-I122 HydrophobicContact CB-CG1 4.4Å; L82-I122 HydrophobicContact CD1-CG2 3.9Å
83	Q	90.4	Very high	87	Confident	71 Å²	71	70.2 Å²	70.2	33%	0.332	37%	0.374	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	-46	-166.7	-74.8	-176.4	80.9	0	0	114.3	L71 E73 D81 C119	L71-Q83 PolarHBondContact O-N 3.29Å; E73-Q83 VanDerWaalsContact CB-NE2 3.3Å; E73-Q83 PolarHBondContact OE2-NE2 3.04Å; D81-Q83 HydrophobicContact CB-CG 4.24Å; D81-Q83 PolarHBondContact O-N 3.13Å; D81-Q83 WeakPolarHBondContact OD1-CG 3.34Å; Q83-C119 WeakPolarHBondContact O-CB 3.43Å
84	H	88.8	Confident	86.4	Confident	96 Å²	96	74.3 Å²	74.3	44%	0.444	39%	0.386	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.1	140.8	-169.6	-163.7	70.6	0	0	0	111.8	L70 L71	L70-H84 CarbonylContact C-O 3.41Å; L70-H84 WeakPolarHBondContact CA-O 3.45Å; L71-H84 HydrophobicContact CB-CB 4.5Å; L71-H84 PolarHBondContact N-O 3.38Å; L71-H84 PolarHBondContact O-N 3.11Å
85	T	90.5	Very high	86	Confident	22 Å²	22	70.7 Å²	70.7	14%	0.135	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	118.8	171.3	-53.8	0	0	0	0	108.1	V69 L70 V87 A97 L100	V69-T85 CarbonylContact O-C 3.11Å; V69-T85 WeakPolarHBondContact O-CA 3.26Å; L70-T85 HydrophobicContact CB-CG2 4.41Å; T85-V87 HydrophobicContact CG2-CG2 4.06Å; T85-A97 HydrophobicContact CG2-CB 4.27Å; T85-L100 HydrophobicContact CG2-CD1 3.95Å
86	E	88.4	Confident	85.9	Confident	100 Å²	100	66.8 Å²	66.8	47%	0.467	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.7	117.1	177.5	-176.4	175.6	94.3	0	0	108.6	A68 V69	A68-E86 CarbonylContact C-O 3.37Å; A68-E86 VanDerWaalsContact CA-O 3.28Å; A68-E86 WeakPolarHBondContact CA-O 3.37Å; V69-E86 HydrophobicContact CG2-CB 3.8Å; V69-E86 PolarHBondContact N-O 3.01Å; V69-E86 PolarHBondContact O-N 2.79Å
87	V	86.8	Confident	85.9	Confident	13 Å²	13	65.7 Å²	65.7	8%	0.079	34%	0.344	C	S	.	.			trans	-128.7	126.3	172.9	-175.3	0	0	0	0	108.5	A68 T85 R92 I96 A97 L100	A68-V87 HydrophobicContact CB-CB 4.31Å; A68-V87 HydrophobicContact CB-CG1 4.12Å; A68-V87 HydrophobicContact CB-CG2 3.88Å; T85-V87 HydrophobicContact CG2-CG2 4.06Å; V87-R92 HydrophobicContact CG1-CG 4.46Å; V87-R92 PolarHBondContact O-NE 2.77Å; V87-I96 HydrophobicContact CG1-CB 4.31Å; V87-I96 HydrophobicContact CG1-CG2 4.19Å; V87-A97 HydrophobicContact CG2-CB 3.7Å; V87-L100 HydrophobicContact CG2-CD1 4.31Å
88	P	84.8	Confident	86	Confident	27 Å²	27	59.7 Å²	59.7	18%	0.175	32%	0.318	C	S	.	.			trans	-59.1	138.1	178.2	18.2	-27.7	0	0	0	111.1	L61 D66 R67 A90 Y91 R92	L61-P88 HydrophobicContact CD1-CG 3.72Å; D66-P88 HydrophobicContact CB-CG 4.18Å; D66-P88 WeakPolarHBondContact OD1-CB 3.38Å; R67-P88 WeakPolarHBondContact O-CD 3.42Å; P88-A90 PolarHBondContact O-N 2.99Å; P88-Y91 HydrophobicContact CB-CD2 4.16Å; P88-Y91 HydrophobicContact CG-CD2 3.74Å; P88-Y91 HydrophobicContact CG-CG 4.41Å; P88-Y91 PolarHBondContact O-N 2.81Å; P88-R92 PolarHBondContact O-N 3.18Å
89	D	82.9	Confident	86	Confident	110 Å²	110	58 Å²	58	59%	0.588	31%	0.312	S	S	*	.	G	3₁₀ helix	trans	-55.4	-37.5	-174.5	-95.1	-83.5	0	0	0	113.3	Y91 R92	D89-Y91 PolarHBondContact O-N 2.8Å; D89-R92 WeakPolarHBondContact O-CB 3.39Å; D89-R92 PolarHBondContact O-N 2.98Å; D89-R92 WeakPolarHBondContact OD1-CD 3.18Å; D89-R92 IonicContact OD1-CZ 3.22Å; D89-R92 VanDerWaalsContact OD1-CZ 3.31Å; D89-R92 IonicContact OD1-NE 2.91Å; D89-R92 IonicContact OD1-NH1 3.31Å; D89-R92 PolarHBondContact OD1-NH1 3.2Å; D89-R92 IonicContact OD2-CZ 2.78Å; D89-R92 IonicContact OD2-NE 3.19Å; D89-R92 IonicContact OD2-NH1 2.95Å; D89-R92 PolarHBondContact OD2-NH1 2.83Å; D89-R92 IonicContact OD2-NH2 3.73Å; D89-R92 PolarHBondContact OD2-NH2 2.92Å
90	A	82.3	Confident	86	Confident	74 Å²	74	56.4 Å²	56.4	61%	0.612	30%	0.302	S	S	*	.	G	3₁₀ helix	trans	-57.8	-20.2	177.2	0	0	0	0	0	114	P88	P88-A90 PolarHBondContact O-N 2.99Å
91	Y	78.4	Confident	85.9	Confident	35 Å²	35	56.4 Å²	56.4	14%	0.137	30%	0.302	C	S	.	.	G	3₁₀ helix	trans	-114.6	-1.5	-176.4	-67.8	-87.8	0	0	0	112.9	L61 G63 D66 P88 D89 R94 I96	L61-Y91 HydrophobicContact CB-CD1 4.23Å; L61-Y91 HydrophobicContact CB-CE1 3.82Å; L61-Y91 HydrophobicContact CB-CE2 4.37Å; L61-Y91 HydrophobicContact CD1-CD1 3.89Å; L61-Y91 HydrophobicContact CD1-CD2 3.74Å; L61-Y91 HydrophobicContact CD1-CE1 4.26Å; L61-Y91 HydrophobicContact CD1-CE2 4.12Å; L61-Y91 HydrophobicContact CD1-CG 3.6Å; L61-Y91 HydrophobicContact CD2-CD1 4.15Å; L61-Y91 HydrophobicContact CD2-CE1 4.48Å; L61-Y91 HydrophobicContact CG-CD1 4.31Å; L61-Y91 HydrophobicContact CG-CE1 4.4Å; L61-Y91 HydrophobicContact CG-CG 4.5Å; G63-Y91 PolarHBondContact N-OH 2.82Å; D66-Y91 HydrophobicContact CB-CD2 4.17Å; D66-Y91 HydrophobicContact CB-CE2 3.48Å; D66-Y91 VanDerWaalsContact CB-CE2 3.48Å; P88-Y91 HydrophobicContact CB-CD2 4.16Å; P88-Y91 HydrophobicContact CG-CD2 3.74Å; P88-Y91 HydrophobicContact CG-CG 4.41Å; P88-Y91 PolarHBondContact O-N 2.81Å; D89-Y91 PolarHBondContact O-N 2.8Å; Y91-R94 PolarHBondContact O-N 2.8Å; Y91-I96 HydrophobicContact CD1-CD1 4.01Å; Y91-I96 HydrophobicContact CG-CD1 4.22Å
92	R	77.6	Confident	85.8	Confident	148 Å²	148	60.4 Å²	60.4	56%	0.558	32%	0.319	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	152.8	170	-69.1	-178.9	-172.9	171.4	-2.8	110.1	V87 P88 D89 R94	V87-R92 HydrophobicContact CG1-CG 4.46Å; V87-R92 PolarHBondContact O-NE 2.77Å; P88-R92 PolarHBondContact O-N 3.18Å; D89-R92 WeakPolarHBondContact O-CB 3.39Å; D89-R92 PolarHBondContact O-N 2.98Å; D89-R92 WeakPolarHBondContact OD1-CD 3.18Å; D89-R92 IonicContact OD1-CZ 3.22Å; D89-R92 VanDerWaalsContact OD1-CZ 3.31Å; D89-R92 IonicContact OD1-NE 2.91Å; D89-R92 IonicContact OD1-NH1 3.31Å; D89-R92 PolarHBondContact OD1-NH1 3.2Å; D89-R92 IonicContact OD2-CZ 2.78Å; D89-R92 IonicContact OD2-NE 3.19Å; D89-R92 IonicContact OD2-NH1 2.95Å; D89-R92 PolarHBondContact OD2-NH1 2.83Å; D89-R92 IonicContact OD2-NH2 3.73Å; D89-R92 PolarHBondContact OD2-NH2 2.92Å; R92-R94 PolarHBondContact O-N 3.48Å
93	G	77.8	Confident	85.7	Confident	88 Å²	88	61.5 Å²	61.5	91%	0.907	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.4	-7.3	-175.8	0	0	0	0	0	115.4
94	R	78.6	Confident	85.7	Confident	167 Å²	167	58.1 Å²	58.1	63%	0.63	31%	0.313	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.1	5.8	175.1	-55.6	-173.9	-173.7	-155.2	2.1	114.3	Y91 R92 I96	Y91-R94 PolarHBondContact O-N 2.8Å; R92-R94 PolarHBondContact O-N 3.48Å; R94-I96 VanDerWaalsContact C-N 3.3Å; R94-I96 HydrophobicContact CB-CD1 4.1Å; R94-I96 HydrophobicContact CB-CG1 4.37Å; R94-I96 PolarHBondContact O-N 3.31Å
95	G	83	Confident	85.8	Confident	29 Å²	29	53.5 Å²	53.5	30%	0.299	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.2	14.5	-178.3	0	0	0	0	0	115.1	A97 K98 H99	G95-A97 PolarHBondContact O-N 3.45Å; G95-K98 WeakPolarHBondContact O-CA 3.11Å; G95-K98 WeakPolarHBondContact O-CB 3.38Å; G95-K98 PolarHBondContact O-N 2.91Å; G95-K98 VanDerWaalsContact O-N 3.1Å; G95-H99 PolarHBondContact O-N 2.66Å; G95-H99 PolarHBondContact O-ND1 2.79Å
96	I	86.3	Confident	85.7	Confident	5 Å²	5	55 Å²	55	3%	0.026	30%	0.299	C	S	.	.	H	α-helix	trans	-62.9	-44.2	-179.3	-71.2	155.8	0	0	0	112	I46 I59 L61 A68 V87 Y91 R94 K98 H99 L100	I46-I96 HydrophobicContact CD1-CG1 3.96Å; I59-I96 HydrophobicContact CD1-CG2 3.82Å; I59-I96 HydrophobicContact CG2-CG2 4.36Å; L61-I96 HydrophobicContact CD1-CD1 4.4Å; L61-I96 HydrophobicContact CD2-CD1 3.48Å; L61-I96 VanDerWaalsContact CD2-CD1 3.48Å; L61-I96 HydrophobicContact CD2-CG1 4.11Å; L61-I96 HydrophobicContact CD2-CG2 4.29Å; A68-I96 HydrophobicContact CB-CG2 3.36Å; V87-I96 HydrophobicContact CG1-CB 4.31Å; V87-I96 HydrophobicContact CG1-CG2 4.19Å; Y91-I96 HydrophobicContact CD1-CD1 4.01Å; Y91-I96 HydrophobicContact CG-CD1 4.22Å; R94-I96 VanDerWaalsContact C-N 3.3Å; R94-I96 HydrophobicContact CB-CD1 4.1Å; R94-I96 HydrophobicContact CB-CG1 4.37Å; R94-I96 PolarHBondContact O-N 3.31Å; I96-K98 PolarHBondContact O-N 2.94Å; I96-H99 WeakPolarHBondContact O-CB 3.15Å; I96-H99 PolarHBondContact O-N 2.7Å; I96-L100 PolarHBondContact O-N 3.27Å; I96-L100 VanDerWaalsContact O-N 3.11Å
97	A	86.3	Confident	85.8	Confident	14 Å²	14	50.7 Å²	50.7	12%	0.116	28%	0.279	C	S	.	.	H	α-helix	trans	-60.3	-31.7	175.2	0	0	0	0	0	112.1	T85 V87 G95 H99 L100 A101 Y121	T85-A97 HydrophobicContact CG2-CB 4.27Å; V87-A97 HydrophobicContact CG2-CB 3.7Å; G95-A97 PolarHBondContact O-N 3.45Å; A97-H99 VanDerWaalsContact C-N 3.34Å; A97-L100 PolarHBondContact O-N 3.25Å; A97-A101 VanDerWaalsContact O-CB 3.31Å; A97-A101 WeakPolarHBondContact O-CB 3.39Å; A97-A101 PolarHBondContact O-N 3.44Å; A97-Y121 HydrophobicContact CB-CD1 4.17Å; A97-Y121 HydrophobicContact CB-CE1 3.36Å; A97-Y121 HydrophobicContact CB-CE2 4.18Å; A97-Y121 WeakPolarHBondContact CB-OH 3.43Å
98	K	88.1	Confident	85.9	Confident	90 Å²	90	50.1 Å²	50.1	39%	0.391	28%	0.275	S	S	.	.	H	α-helix	trans	-62	-42.2	173.7	-159.3	-173.2	179.6	173.7	0	111.4	G95 I96 A101 K102 Y121 Y125 N129	G95-K98 WeakPolarHBondContact O-CA 3.11Å; G95-K98 WeakPolarHBondContact O-CB 3.38Å; G95-K98 PolarHBondContact O-N 2.91Å; G95-K98 VanDerWaalsContact O-N 3.1Å; I96-K98 PolarHBondContact O-N 2.94Å; K98-A101 PolarHBondContact O-N 2.87Å; K98-K102 WeakPolarHBondContact O-CB 3.28Å; K98-K102 PolarHBondContact O-N 3.47Å; K98-Y121 PolarHBondContact N-OH 2.83Å; K98-Y125 HydrophobicContact CB-CE2 4.4Å; K98-Y125 HydrophobicContact CD-CE2 4.11Å; K98-Y125 HydrophobicContact CG-CD2 3.76Å; K98-Y125 HydrophobicContact CG-CE2 3.26Å; K98-N129 VanDerWaalsContact CE-OD1 3.23Å; K98-N129 WeakPolarHBondContact CE-OD1 3.35Å; K98-N129 PolarHBondContact NZ-OD1 2.72Å
99	H	88.7	Confident	86.1	Confident	82 Å²	82	50.5 Å²	50.5	38%	0.38	28%	0.277	S	S	.	.	H	α-helix	trans	-68.4	-42	179.2	-68.9	76.4	0	0	0	111.5	I46 V48 I59 G95 I96 A97 K102 A103	I46-H99 HydrophobicContact CG2-CB 4.31Å; V48-H99 HydrophobicContact CG2-CB 4.34Å; I59-H99 HydrophobicContact CD1-CB 4.04Å; G95-H99 PolarHBondContact O-N 2.66Å; G95-H99 PolarHBondContact O-ND1 2.79Å; I96-H99 WeakPolarHBondContact O-CB 3.15Å; I96-H99 PolarHBondContact O-N 2.7Å; A97-H99 VanDerWaalsContact C-N 3.34Å; H99-K102 PolarHBondContact O-N 2.91Å; H99-A103 WeakPolarHBondContact O-CB 3.47Å; H99-A103 PolarHBondContact O-N 3.43Å
100	L	90.5	Very high	86.4	Confident	0 Å²	0	52.2 Å²	52.2	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-59.3	-50	172.7	-71.8	173	0	0	0	111.6	V48 F57 I59 A68 L70 T85 V87 I96 A97 K102 A103 A104	V48-L100 HydrophobicContact CG1-CD2 4.09Å; F57-L100 HydrophobicContact CB-CD2 3.83Å; I59-L100 HydrophobicContact CB-CD2 4.47Å; I59-L100 HydrophobicContact CD1-CD1 4.41Å; I59-L100 HydrophobicContact CD1-CD2 3.58Å; I59-L100 HydrophobicContact CD1-CG 3.52Å; I59-L100 HydrophobicContact CG1-CD2 3.65Å; I59-L100 HydrophobicContact CG1-CG 4.16Å; A68-L100 HydrophobicContact CB-CD1 3.71Å; L70-L100 HydrophobicContact CB-CB 3.99Å; L70-L100 HydrophobicContact CB-CD1 4.2Å; L70-L100 HydrophobicContact CB-CD2 4.33Å; L70-L100 HydrophobicContact CB-CG 4.4Å; L70-L100 HydrophobicContact CD1-CB 3.94Å; T85-L100 HydrophobicContact CG2-CD1 3.95Å; V87-L100 HydrophobicContact CG2-CD1 4.31Å; I96-L100 PolarHBondContact O-N 3.27Å; I96-L100 VanDerWaalsContact O-N 3.11Å; A97-L100 PolarHBondContact O-N 3.25Å; L100-K102 VanDerWaalsContact C-N 3.34Å; L100-K102 PolarHBondContact O-N 2.96Å; L100-A103 PolarHBondContact O-N 3.17Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 3.35Å
101	A	90.6	Very high	86.6	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.274	C	S	.	.	H	α-helix	trans	-61.1	-43.7	-179.8	0	0	0	0	0	111.4	A97 K98 A104 M105 I122 Y125	A97-A101 VanDerWaalsContact O-CB 3.31Å; A97-A101 WeakPolarHBondContact O-CB 3.39Å; A97-A101 PolarHBondContact O-N 3.44Å; K98-A101 PolarHBondContact O-N 2.87Å; A101-A104 PolarHBondContact O-N 3.38Å; A101-M105 WeakPolarHBondContact O-CB 3.14Å; A101-M105 VanDerWaalsContact O-CG 3.28Å; A101-M105 WeakPolarHBondContact O-CG 3.34Å; A101-M105 PolarHBondContact O-N 2.79Å; A101-I122 HydrophobicContact CB-CD1 3.41Å; A101-I122 VanDerWaalsContact CB-CD1 3.41Å; A101-Y125 HydrophobicContact CB-CD1 3.55Å; A101-Y125 HydrophobicContact CB-CD2 4.33Å; A101-Y125 HydrophobicContact CB-CE1 3.85Å; A101-Y125 HydrophobicContact CB-CG 3.79Å
102	K	89.7	Confident	87.2	Confident	94 Å²	94	56.6 Å²	56.6	41%	0.409	29%	0.293	S	S	.	.	H	α-helix	trans	-57.9	-53.7	174.3	-170.5	-168.2	176.6	-62.2	0	110.5	K98 H99 L100 A104 M105 D106	K98-K102 WeakPolarHBondContact O-CB 3.28Å; K98-K102 PolarHBondContact O-N 3.47Å; H99-K102 PolarHBondContact O-N 2.91Å; L100-K102 VanDerWaalsContact C-N 3.34Å; L100-K102 PolarHBondContact O-N 2.96Å; K102-A104 VanDerWaalsContact C-N 3.3Å; K102-A104 PolarHBondContact O-N 3.43Å; K102-M105 PolarHBondContact O-N 2.98Å; K102-M105 VanDerWaalsContact O-N 3.17Å; K102-D106 IonicContact NZ-OD2 3.65Å; K102-D106 PolarHBondContact NZ-OD2 3.3Å; K102-D106 WeakPolarHBondContact O-CB 3.34Å; K102-D106 PolarHBondContact O-N 3.37Å
103	A	90.1	Very high	87.8	Confident	26 Å²	26	50.4 Å²	50.4	22%	0.215	27%	0.271	C	S	.	.	H	α-helix	trans	-60.1	-39.2	-177.9	0	0	0	0	0	112.7	V48 F57 H99 L100 D106 F107	V48-A103 HydrophobicContact CB-CB 4.12Å; V48-A103 HydrophobicContact CG1-CB 3.76Å; V48-A103 HydrophobicContact CG2-CB 4.14Å; F57-A103 HydrophobicContact CD1-CB 4.16Å; F57-A103 HydrophobicContact CE1-CB 4.39Å; H99-A103 WeakPolarHBondContact O-CB 3.47Å; H99-A103 PolarHBondContact O-N 3.43Å; L100-A103 PolarHBondContact O-N 3.17Å; A103-D106 PolarHBondContact O-N 3.03Å; A103-F107 WeakPolarHBondContact O-CB 3.28Å; A103-F107 PolarHBondContact O-N 3.09Å
104	A	90.6	Very high	88.4	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-64.6	-43.2	175.7	0	0	0	0	0	112.3	F57 L70 L82 L100 A101 K102 V108	F57-A104 HydrophobicContact CD2-CB 3.94Å; F57-A104 HydrophobicContact CE2-CB 3.7Å; F57-A104 HydrophobicContact CZ-CB 4.22Å; L70-A104 HydrophobicContact CD1-CB 3.91Å; L70-A104 HydrophobicContact CD2-CB 3.96Å; L82-A104 HydrophobicContact CD1-CB 4.04Å; L82-A104 HydrophobicContact CD2-CB 4.08Å; L100-A104 WeakPolarHBondContact O-CB 3.49Å; L100-A104 PolarHBondContact O-N 3.35Å; A101-A104 PolarHBondContact O-N 3.38Å; K102-A104 VanDerWaalsContact C-N 3.3Å; K102-A104 PolarHBondContact O-N 3.43Å; A104-V108 VanDerWaalsContact O-CG2 3.24Å; A104-V108 WeakPolarHBondContact O-CG2 3.28Å; A104-V108 PolarHBondContact O-N 2.86Å
105	M	89.2	Confident	89	Confident	0 Å²	0	42.9 Å²	42.9	0%	0	22%	0.218	C	C	.	.	H	α-helix	trans	-71.4	-36.5	177.1	-67.2	-58.1	-64	0	0	112.6	L82 A101 K102 F107 V108 V109 A115 L117 I122 V126 Y134 I138	L82-M105 HydrophobicContact CD1-SD 3.74Å; A101-M105 WeakPolarHBondContact O-CB 3.14Å; A101-M105 VanDerWaalsContact O-CG 3.28Å; A101-M105 WeakPolarHBondContact O-CG 3.34Å; A101-M105 PolarHBondContact O-N 2.79Å; K102-M105 PolarHBondContact O-N 2.98Å; K102-M105 VanDerWaalsContact O-N 3.17Å; M105-F107 VanDerWaalsContact C-N 3.35Å; M105-V108 WeakPolarHBondContact O-CB 3.28Å; M105-V108 PolarHBondContact O-N 3.45Å; M105-V109 WeakPolarHBondContact O-CG2 3.12Å; M105-V109 PolarHBondContact O-N 3.13Å; M105-A115 HydrophobicContact CE-CB 4.36Å; M105-A115 HydrophobicContact SD-CB 4.19Å; M105-L117 HydrophobicContact SD-CD2 4.17Å; M105-I122 HydrophobicContact SD-CG2 4.5Å; M105-V126 HydrophobicContact CE-CG2 4.31Å; M105-Y134 HydrophobicContact CB-CD1 3.79Å; M105-Y134 HydrophobicContact CB-CE1 3.66Å; M105-Y134 HydrophobicContact CB-CG 4.32Å; M105-Y134 HydrophobicContact CE-CD1 3.99Å; M105-Y134 HydrophobicContact CE-CG 3.89Å; M105-I138 HydrophobicContact CE-CD1 3.88Å; M105-I138 HydrophobicContact CE-CG1 3.84Å
106	D	89.3	Confident	89.4	Confident	53 Å²	53	44.3 Å²	44.3	28%	0.283	22%	0.217	S	C	.	.	H	α-helix	trans	-56.2	-51.9	172.9	-133	-115	0	0	0	109.4	K102 A103 V108 V109 E110	K102-D106 IonicContact NZ-OD2 3.65Å; K102-D106 PolarHBondContact NZ-OD2 3.3Å; K102-D106 WeakPolarHBondContact O-CB 3.34Å; K102-D106 PolarHBondContact O-N 3.37Å; A103-D106 PolarHBondContact O-N 3.03Å; D106-V108 VanDerWaalsContact C-N 3.26Å; D106-V108 PolarHBondContact O-N 3.21Å; D106-V109 PolarHBondContact O-N 3.4Å; D106-E110 WeakPolarHBondContact O-CB 3.43Å; D106-E110 WeakPolarHBondContact O-CG 2.97Å; D106-E110 PolarHBondContact O-N 3.37Å
107	F	89.4	Confident	89.7	Confident	10 Å²	10	44.7 Å²	44.7	4%	0.044	22%	0.219	C	C	.	.	H	α-helix	trans	-56.6	-39.7	177.5	170.1	-108.3	0	0	0	112.8	H50 K52 F57 Y72 A103 M105 E111 L113	H50-F107 AromaticContact CE1-CD1 3.98Å; H50-F107 AromaticContact CE1-CD2 3.44Å; H50-F107 VanDerWaalsContact CE1-CD2 3.44Å; H50-F107 WeakPolarHBondContact CE1-CD2 3.47Å; H50-F107 AromaticContact CE1-CE2 3.56Å; H50-F107 AromaticContact CE1-CG 3.66Å; H50-F107 AromaticContact CE1-CZ 3.87Å; H50-F107 AromaticContact ND1-CD2 3.99Å; K52-F107 HydrophobicContact CD-CE2 4.4Å; F57-F107 HydrophobicContact CE1-CB 4.34Å; F57-F107 HydrophobicContact CZ-CB 3.85Å; F57-F107 HydrophobicContact CZ-CD1 4.08Å; F57-F107 HydrophobicContact CZ-CG 4.06Å; Y72-F107 HydrophobicContact CE2-CE1 4.42Å; A103-F107 WeakPolarHBondContact O-CB 3.28Å; A103-F107 PolarHBondContact O-N 3.09Å; M105-F107 VanDerWaalsContact C-N 3.35Å; F107-E111 HydrophobicContact CD2-CG 3.82Å; F107-E111 HydrophobicContact CE2-CB 4.3Å; F107-E111 HydrophobicContact CE2-CG 3.52Å; F107-E111 HydrophobicContact CZ-CG 4.28Å; F107-E111 WeakPolarHBondContact O-CB 3.32Å; F107-E111 WeakPolarHBondContact O-CG 3.47Å; F107-E111 PolarHBondContact O-N 3.35Å; F107-E111 VanDerWaalsContact O-N 3.07Å; F107-L113 HydrophobicContact CD1-CD1 4.4Å; F107-L113 HydrophobicContact CE1-CD1 3.66Å; F107-L113 HydrophobicContact CZ-CD1 3.83Å
108	V	90.5	Very high	89.9	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-63.5	-44.7	177.2	169.3	0	0	0	0	111	V80 A104 M105 D106 D112 L113 A115 H137	V80-V108 HydrophobicContact CG2-CG2 3.51Å; A104-V108 VanDerWaalsContact O-CG2 3.24Å; A104-V108 WeakPolarHBondContact O-CG2 3.28Å; A104-V108 PolarHBondContact O-N 2.86Å; M105-V108 WeakPolarHBondContact O-CB 3.28Å; M105-V108 PolarHBondContact O-N 3.45Å; D106-V108 VanDerWaalsContact C-N 3.26Å; D106-V108 PolarHBondContact O-N 3.21Å; V108-D112 PolarHBondContact O-N 3.43Å; V108-L113 HydrophobicContact CG1-CB 4.25Å; V108-L113 WeakPolarHBondContact CG1-O 3.36Å; V108-L113 PolarHBondContact O-N 2.75Å; V108-A115 HydrophobicContact CB-CB 4.46Å; V108-A115 HydrophobicContact CG1-CB 3.79Å; V108-A115 HydrophobicContact CG2-CB 4.02Å; V108-H137 HydrophobicContact CG1-CB 3.79Å
109	V	88.8	Confident	89.9	Confident	36 Å²	36	43.7 Å²	43.7	22%	0.218	22%	0.22	C	C	.	.	H	α-helix	trans	-71.2	-45.1	179.9	175.2	0	0	0	0	111.2	M105 D106 E111 D112 Q133 Y134	M105-V109 WeakPolarHBondContact O-CG2 3.12Å; M105-V109 PolarHBondContact O-N 3.13Å; D106-V109 PolarHBondContact O-N 3.4Å; V109-E111 VanDerWaalsContact C-N 3.27Å; V109-E111 PolarHBondContact O-N 3.13Å; V109-D112 PolarHBondContact O-N 2.83Å; V109-Q133 HydrophobicContact CG1-CB 4.4Å; V109-Q133 HydrophobicContact CG2-CB 4.33Å; V109-Y134 HydrophobicContact CG2-CD1 3.85Å; V109-Y134 HydrophobicContact CG2-CE1 4.18Å
110	E	88.6	Confident	89.9	Confident	146 Å²	146	48.3 Å²	48.3	68%	0.682	23%	0.234	S	C	*	.	H	α-helix	trans	-61.2	-36.5	-179.9	-73.7	-175.9	102.2	0	0	112.2	D106	D106-E110 WeakPolarHBondContact O-CB 3.43Å; D106-E110 WeakPolarHBondContact O-CG 2.97Å; D106-E110 PolarHBondContact O-N 3.37Å
111	E	87.4	Confident	89.7	Confident	99 Å²	99	51.1 Å²	51.1	46%	0.463	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	-98.1	8.5	-178.2	-60.2	-118.5	-174.9	0	0	113.2	K52 F107 V109 L113	K52-E111 IonicContact NZ-OE1 3.52Å; K52-E111 PolarHBondContact NZ-OE1 3.21Å; F107-E111 HydrophobicContact CD2-CG 3.82Å; F107-E111 HydrophobicContact CE2-CB 4.3Å; F107-E111 HydrophobicContact CE2-CG 3.52Å; F107-E111 HydrophobicContact CZ-CG 4.28Å; F107-E111 WeakPolarHBondContact O-CB 3.32Å; F107-E111 WeakPolarHBondContact O-CG 3.47Å; F107-E111 PolarHBondContact O-N 3.35Å; F107-E111 VanDerWaalsContact O-N 3.07Å; V109-E111 VanDerWaalsContact C-N 3.27Å; V109-E111 PolarHBondContact O-N 3.13Å; E111-L113 HydrophobicContact CB-CD1 3.88Å; E111-L113 HydrophobicContact CB-CG 3.86Å; E111-L113 PolarHBondContact O-N 3.41Å
112	D	89.1	Confident	89.6	Confident	101 Å²	101	51.1 Å²	51.1	54%	0.54	25%	0.245	S	C	.	.	T	Hydrogen-bonded Turn	trans	53.2	44.2	179.2	-170.6	-109.4	0	0	0	111.6	K78 V108 V109	K78-D112 IonicContact NZ-OD1 3.54Å; K78-D112 PolarHBondContact NZ-OD1 2.77Å; V108-D112 PolarHBondContact O-N 3.43Å; V109-D112 PolarHBondContact O-N 2.83Å
113	L	90.6	Very high	89.6	Confident	18 Å²	18	51.6 Å²	51.6	9%	0.094	25%	0.248	C	C	.	.	P	Polyproline II helix	trans	-99.2	157.8	179.4	-60.8	174.4	0	0	0	110.2	Y74 K78 V80 F107 V108 E111 H137	Y74-L113 HydrophobicContact CE1-CD1 4.45Å; K78-L113 HydrophobicContact CB-CD2 4.18Å; V80-L113 HydrophobicContact CG1-CD1 4.11Å; F107-L113 HydrophobicContact CD1-CD1 4.4Å; F107-L113 HydrophobicContact CE1-CD1 3.66Å; F107-L113 HydrophobicContact CZ-CD1 3.83Å; V108-L113 HydrophobicContact CG1-CB 4.25Å; V108-L113 WeakPolarHBondContact CG1-O 3.36Å; V108-L113 PolarHBondContact O-N 2.75Å; E111-L113 HydrophobicContact CB-CD1 3.88Å; E111-L113 HydrophobicContact CB-CG 3.86Å; E111-L113 PolarHBondContact O-N 3.41Å; L113-H137 WeakPolarHBondContact O-CB 3.36Å; L113-H137 PolarHBondContact O-CD2 2.87Å
114	K	91.8	Very high	89.6	Confident	98 Å²	98	55.2 Å²	55.2	43%	0.426	26%	0.259	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.7	132.1	170.4	-65.6	-175.1	173.8	-172.4	0	110.1	K78 T79 V80 H137 H139	K78-K114 PolarHBondContact O-N 3.04Å; T79-K114 CarbonylContact C-O 3.55Å; T79-K114 VanDerWaalsContact CA-O 3.27Å; T79-K114 WeakPolarHBondContact CA-O 3.38Å; T79-K114 HydrophobicContact CG2-CB 4.04Å; V80-K114 PolarHBondContact N-O 3.23Å; K114-H137 CarbonylContact C-O 3.48Å; K114-H137 WeakPolarHBondContact CA-O 3.27Å; K114-H139 HydrophobicContact CB-CB 4.23Å; K114-H139 HydrophobicContact CD-CB 4.4Å
115	A	90.5	Very high	89.5	Confident	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.1	117.6	174	0	0	0	0	0	111	V80 M105 V108 L117 H137 I138 H139	V80-A115 CarbonylContact O-C 3.59Å; V80-A115 WeakPolarHBondContact O-CA 3.43Å; M105-A115 HydrophobicContact CE-CB 4.36Å; M105-A115 HydrophobicContact SD-CB 4.19Å; V108-A115 HydrophobicContact CB-CB 4.46Å; V108-A115 HydrophobicContact CG1-CB 3.79Å; V108-A115 HydrophobicContact CG2-CB 4.02Å; A115-L117 HydrophobicContact CB-CD2 4.13Å; A115-H137 PolarHBondContact N-O 3.15Å; A115-I138 HydrophobicContact CB-CG1 4.44Å; A115-I138 CarbonylContact O-C 3.58Å; A115-I138 VanDerWaalsContact O-CA 3.28Å; A115-I138 WeakPolarHBondContact O-CA 3.37Å; A115-H139 PolarHBondContact O-N 2.91Å
116	H	91.9	Very high	89.4	Confident	58 Å²	58	55.9 Å²	55.9	27%	0.269	26%	0.262	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.5	136	158.2	-163.9	70.1	0	0	0	108.3	V80 D81 L82 T118 H139 Q140	V80-H116 PolarHBondContact O-N 3.48Å; D81-H116 CarbonylContact C-O 3.5Å; D81-H116 WeakPolarHBondContact CA-O 3.24Å; D81-H116 HydrophobicContact CB-CB 4.02Å; D81-H116 VanDerWaalsContact OD2-C 3.31Å; D81-H116 IonicContact OD2-CD2 2.92Å; D81-H116 PolarHBondContact OD2-CD2 3.25Å; D81-H116 VanDerWaalsContact OD2-CD2 3.22Å; D81-H116 IonicContact OD2-CG 3.97Å; L82-H116 PolarHBondContact N-O 2.78Å; H116-T118 PolarHBondContact CD2-OG1 3.22Å; H116-H139 PolarHBondContact ND1-O 3.03Å; H116-Q140 PolarHBondContact CE1-OXT 3.11Å; H116-Q140 VanDerWaalsContact CE1-OXT 3.3Å
117	L	91.1	Very high	89.3	Confident	14 Å²	14	61.8 Å²	61.8	7%	0.073	29%	0.285	C	S	.	.			trans	-113.4	79.5	-175.4	-58.4	-172.9	0	0	0	109.7	L82 M105 A115 I122 Q123 V126 I138	L82-L117 HydrophobicContact CB-CD2 4.16Å; L82-L117 HydrophobicContact CD1-CD2 3.74Å; L82-L117 HydrophobicContact CG-CD2 4.13Å; M105-L117 HydrophobicContact SD-CD2 4.17Å; A115-L117 HydrophobicContact CB-CD2 4.13Å; L117-I122 HydrophobicContact CD1-CG2 4.23Å; L117-I122 HydrophobicContact CD2-CB 4.33Å; L117-I122 HydrophobicContact CD2-CG2 3.56Å; L117-I122 HydrophobicContact CG-CG2 4.44Å; L117-Q123 HydrophobicContact CB-CG 3.65Å; L117-Q123 HydrophobicContact CD1-CG 4.34Å; L117-Q123 WeakPolarHBondContact O-CG 3.11Å; L117-Q123 PolarHBondContact O-NE2 3.34Å; L117-V126 HydrophobicContact CD1-CG2 4.04Å; L117-I138 HydrophobicContact CD1-CD1 3.79Å; L117-I138 HydrophobicContact CD1-CG1 3.97Å; L117-I138 HydrophobicContact CD1-CG2 4.12Å; L117-I138 HydrophobicContact CG-CG1 4.28Å; L117-I138 HydrophobicContact CG-CG2 4.24Å
118	T	91.1	Very high	89.2	Confident	75 Å²	75	66.9 Å²	66.9	46%	0.46	31%	0.309	S	S	.	.			trans	-70.7	-33	172.7	-66.1	0	0	0	0	112.1	D81 L82 H116 W120	D81-T118 WeakPolarHBondContact OD1-CB 3.48Å; D81-T118 PolarHBondContact OD1-OG1 3.3Å; D81-T118 WeakPolarHBondContact OD2-CB 3.31Å; D81-T118 PolarHBondContact OD2-N 3.13Å; D81-T118 VanDerWaalsContact OD2-N 3.13Å; D81-T118 PolarHBondContact OD2-OG1 2.9Å; L82-T118 PolarHBondContact O-N 2.91Å; H116-T118 PolarHBondContact CD2-OG1 3.22Å; T118-W120 PolarHBondContact O-N 3.47Å
119	C	87.6	Confident	88.9	Confident	8 Å²	8	68.9 Å²	68.9	5%	0.054	32%	0.32	C	S	.	.	S	Bend	trans	-73.6	118.8	-179.9	-168.9	0	0	0	0	112.2	L82 Q83 Y121 I122 Q123	L82-C119 VanDerWaalsContact O-CB 3.27Å; L82-C119 WeakPolarHBondContact O-CB 3.41Å; L82-C119 PolarHBondContact O-N 2.74Å; Q83-C119 WeakPolarHBondContact O-CB 3.43Å; C119-Y121 PolarHBondContact O-N 3.14Å; C119-Y121 VanDerWaalsContact O-N 3.11Å; C119-I122 HydrophobicContact CB-CB 4.38Å; C119-I122 HydrophobicContact CB-CG1 3.85Å; C119-I122 PolarHBondContact O-N 3.37Å; C119-Q123 PolarHBondContact O-N 3.1Å; C119-Q123 VanDerWaalsContact O-N 3.16Å
120	W	88.8	Confident	88.5	Confident	179 Å²	179	71.3 Å²	71.3	68%	0.678	34%	0.337	S	S	*	.	H	α-helix	trans	-53.7	-34	176.5	71.5	-95	0	0	0	113.2	T118 K124	T118-W120 PolarHBondContact O-N 3.47Å; W120-K124 HydrophobicContact CZ3-CD 4.31Å; W120-K124 WeakPolarHBondContact O-CB 3.42Å; W120-K124 PolarHBondContact O-N 2.96Å
121	Y	87.8	Confident	88.3	Confident	58 Å²	58	68.2 Å²	68.2	23%	0.227	32%	0.322	C	S	.	.	H	α-helix	trans	-67.4	-41.5	-179.4	-179.2	-93.4	0	0	0	111.4	A97 K98 C119 K124 Y125	A97-Y121 HydrophobicContact CB-CD1 4.17Å; A97-Y121 HydrophobicContact CB-CE1 3.36Å; A97-Y121 HydrophobicContact CB-CE2 4.18Å; A97-Y121 WeakPolarHBondContact CB-OH 3.43Å; K98-Y121 PolarHBondContact N-OH 2.83Å; C119-Y121 PolarHBondContact O-N 3.14Å; C119-Y121 VanDerWaalsContact O-N 3.11Å; Y121-K124 PolarHBondContact O-N 3.49Å; Y121-Y125 WeakPolarHBondContact O-CB 3.38Å; Y121-Y125 PolarHBondContact O-N 3.31Å
122	I	87.4	Confident	88.1	Confident	1 Å²	1	68.1 Å²	68.1	1%	0.005	33%	0.33	C	S	.	.	H	α-helix	trans	-70.4	-40.7	179.6	-52.9	-66	0	0	0	110.5	L70 L82 A101 M105 L117 C119 K124 Y125 V126	L70-I122 HydrophobicContact CD1-CD1 3.6Å; L82-I122 HydrophobicContact CB-CG1 4.4Å; L82-I122 HydrophobicContact CD1-CG2 3.9Å; A101-I122 HydrophobicContact CB-CD1 3.41Å; A101-I122 VanDerWaalsContact CB-CD1 3.41Å; M105-I122 HydrophobicContact SD-CG2 4.5Å; L117-I122 HydrophobicContact CD1-CG2 4.23Å; L117-I122 HydrophobicContact CD2-CB 4.33Å; L117-I122 HydrophobicContact CD2-CG2 3.56Å; L117-I122 HydrophobicContact CG-CG2 4.44Å; C119-I122 HydrophobicContact CB-CB 4.38Å; C119-I122 HydrophobicContact CB-CG1 3.85Å; C119-I122 PolarHBondContact O-N 3.37Å; I122-K124 VanDerWaalsContact C-N 3.29Å; I122-K124 PolarHBondContact O-N 3.38Å; I122-Y125 WeakPolarHBondContact O-CB 3.38Å; I122-Y125 PolarHBondContact O-N 2.97Å; I122-Y125 VanDerWaalsContact O-N 3.14Å; I122-V126 WeakPolarHBondContact O-CG2 3.44Å; I122-V126 PolarHBondContact O-N 3.01Å
123	Q	89.6	Confident	87.9	Confident	104 Å²	104	68 Å²	68	49%	0.486	33%	0.327	S	S	.	.	H	α-helix	trans	-55.4	-46.7	172	-66.5	-179.8	-23.3	0	0	111.2	L117 C119 K127	L117-Q123 HydrophobicContact CB-CG 3.65Å; L117-Q123 HydrophobicContact CD1-CG 4.34Å; L117-Q123 WeakPolarHBondContact O-CG 3.11Å; L117-Q123 PolarHBondContact O-NE2 3.34Å; C119-Q123 PolarHBondContact O-N 3.1Å; C119-Q123 VanDerWaalsContact O-N 3.16Å; Q123-K127 WeakPolarHBondContact O-CB 3.23Å; Q123-K127 PolarHBondContact O-N 3.27Å; Q123-K127 VanDerWaalsContact O-N 3.15Å
124	K	89.8	Confident	87.7	Confident	102 Å²	102	67.5 Å²	67.5	44%	0.443	32%	0.323	S	S	.	.	H	α-helix	trans	-61.8	-45.7	175.2	-176.7	-179	172.2	-178.8	0	111.5	W120 Y121 I122 V126 K127 E128	W120-K124 HydrophobicContact CZ3-CD 4.31Å; W120-K124 WeakPolarHBondContact O-CB 3.42Å; W120-K124 PolarHBondContact O-N 2.96Å; Y121-K124 PolarHBondContact O-N 3.49Å; I122-K124 VanDerWaalsContact C-N 3.29Å; I122-K124 PolarHBondContact O-N 3.38Å; K124-V126 PolarHBondContact O-N 2.84Å; K124-K127 WeakPolarHBondContact O-CB 3.47Å; K124-K127 PolarHBondContact O-N 2.94Å; K124-K127 VanDerWaalsContact O-N 3.15Å; K124-E128 WeakPolarHBondContact CE-OE1 3.49Å; K124-E128 WeakPolarHBondContact CE-OE2 3.46Å; K124-E128 HydrophobicContact CG-CG 4.28Å; K124-E128 IonicContact NZ-OE1 2.73Å; K124-E128 WeakPolarHBondContact O-CG 3.42Å; K124-E128 PolarHBondContact O-N 3.27Å
125	Y	89.1	Confident	87.3	Confident	10 Å²	10	67.9 Å²	67.9	4%	0.039	33%	0.325	C	S	.	.	H	α-helix	trans	-57.1	-47.8	-179.7	168.9	-104.6	0	0	0	112.6	K98 A101 Y121 I122 K127 E128 N129	K98-Y125 HydrophobicContact CB-CE2 4.4Å; K98-Y125 HydrophobicContact CD-CE2 4.11Å; K98-Y125 HydrophobicContact CG-CD2 3.76Å; K98-Y125 HydrophobicContact CG-CE2 3.26Å; A101-Y125 HydrophobicContact CB-CD1 3.55Å; A101-Y125 HydrophobicContact CB-CD2 4.33Å; A101-Y125 HydrophobicContact CB-CE1 3.85Å; A101-Y125 HydrophobicContact CB-CG 3.79Å; Y121-Y125 WeakPolarHBondContact O-CB 3.38Å; Y121-Y125 PolarHBondContact O-N 3.31Å; I122-Y125 WeakPolarHBondContact O-CB 3.38Å; I122-Y125 PolarHBondContact O-N 2.97Å; I122-Y125 VanDerWaalsContact O-N 3.14Å; Y125-K127 VanDerWaalsContact C-N 3.31Å; Y125-K127 PolarHBondContact O-N 3.44Å; Y125-E128 PolarHBondContact O-N 3.3Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.42Å; Y125-N129 HydrophobicContact CE2-CB 4.21Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.48Å; Y125-N129 WeakPolarHBondContact O-CB 3.39Å; Y125-N129 PolarHBondContact O-N 3.48Å; Y125-N129 PolarHBondContact O-ND2 3.26Å
126	V	87.8	Confident	87.2	Confident	4 Å²	4	75.2 Å²	75.2	2%	0.024	36%	0.36	C	S	.	.	H	α-helix	trans	-64.7	-38.4	177.8	175.1	0	0	0	0	110.9	M105 L117 I122 K124 E128 N129 P130 F135 I138	M105-V126 HydrophobicContact CE-CG2 4.31Å; L117-V126 HydrophobicContact CD1-CG2 4.04Å; I122-V126 WeakPolarHBondContact O-CG2 3.44Å; I122-V126 PolarHBondContact O-N 3.01Å; K124-V126 PolarHBondContact O-N 2.84Å; V126-E128 VanDerWaalsContact C-N 3.33Å; V126-E128 PolarHBondContact O-N 2.98Å; V126-N129 CarbonylContact O-C 3.58Å; V126-N129 PolarHBondContact O-N 3.19Å; V126-P130 WeakPolarHBondContact O-CA 3.43Å; V126-F135 HydrophobicContact CG1-CD1 4.13Å; V126-F135 HydrophobicContact CG1-CE1 3.57Å; V126-F135 HydrophobicContact CG1-CE2 4.37Å; V126-F135 HydrophobicContact CG1-CZ 3.7Å; V126-I138 HydrophobicContact CB-CD1 4.22Å; V126-I138 HydrophobicContact CG1-CD1 3.54Å; V126-I138 HydrophobicContact CG2-CD1 3.93Å
127	K	87.2	Confident	86.9	Confident	176 Å²	176	74 Å²	74	77%	0.765	35%	0.354	S	S	*	.	H	α-helix	trans	-65.8	-36.8	177.1	-157.7	176.4	-173.2	178.2	0	112.4	Q123 K124 Y125	Q123-K127 WeakPolarHBondContact O-CB 3.23Å; Q123-K127 PolarHBondContact O-N 3.27Å; Q123-K127 VanDerWaalsContact O-N 3.15Å; K124-K127 WeakPolarHBondContact O-CB 3.47Å; K124-K127 PolarHBondContact O-N 2.94Å; K124-K127 VanDerWaalsContact O-N 3.15Å; Y125-K127 VanDerWaalsContact C-N 3.31Å; Y125-K127 PolarHBondContact O-N 3.44Å
128	E	86.6	Confident	86.7	Confident	117 Å²	117	75.2 Å²	75.2	55%	0.547	36%	0.36	S	S	.	.	H	α-helix	trans	-79.5	-22.7	176.1	-70.9	179.7	146.8	0	0	113.1	K124 Y125 V126 P130	K124-E128 WeakPolarHBondContact CE-OE1 3.49Å; K124-E128 WeakPolarHBondContact CE-OE2 3.46Å; K124-E128 HydrophobicContact CG-CG 4.28Å; K124-E128 IonicContact NZ-OE1 2.73Å; K124-E128 WeakPolarHBondContact O-CG 3.42Å; K124-E128 PolarHBondContact O-N 3.27Å; Y125-E128 PolarHBondContact O-N 3.3Å; V126-E128 VanDerWaalsContact C-N 3.33Å; V126-E128 PolarHBondContact O-N 2.98Å; E128-P130 VanDerWaalsContact C-CD 3.45Å; E128-P130 WeakPolarHBondContact O-CD 3.42Å
129	N	83.7	Confident	86.1	Confident	42 Å²	42	76.1 Å²	76.1	23%	0.225	36%	0.359	C	S	.	.	S	Bend	trans	-126.9	69.1	179.2	-57.4	-100.2	0	0	0	108.9	K98 Y125 V126 Q131	K98-N129 VanDerWaalsContact CE-OD1 3.23Å; K98-N129 WeakPolarHBondContact CE-OD1 3.35Å; K98-N129 PolarHBondContact NZ-OD1 2.72Å; Y125-N129 WeakPolarHBondContact CD2-ND2 3.42Å; Y125-N129 HydrophobicContact CE2-CB 4.21Å; Y125-N129 WeakPolarHBondContact CE2-ND2 3.48Å; Y125-N129 WeakPolarHBondContact O-CB 3.39Å; Y125-N129 PolarHBondContact O-N 3.48Å; Y125-N129 PolarHBondContact O-ND2 3.26Å; V126-N129 CarbonylContact O-C 3.58Å; V126-N129 PolarHBondContact O-N 3.19Å; N129-Q131 PolarHBondContact O-N 3.06Å
130	P	81.4	Confident	84.8	Confident	88 Å²	88	86.3 Å²	86.3	57%	0.571	41%	0.406	S	S	*	.			trans	-68.4	105.1	-175.2	27.6	-34.2	0	0	0	109.8	V126 E128 F135	V126-P130 WeakPolarHBondContact O-CA 3.43Å; E128-P130 VanDerWaalsContact C-CD 3.45Å; E128-P130 WeakPolarHBondContact O-CD 3.42Å; P130-F135 VanDerWaalsContact CA-CE2 3.48Å; P130-F135 HydrophobicContact CB-CE2 3.59Å; P130-F135 HydrophobicContact CB-CZ 3.93Å
131	Q	83.8	Confident	84.6	Confident	81 Å²	81	81.7 Å²	81.7	38%	0.379	39%	0.392	S	S	.	.			trans	-111.8	131.9	170.4	-60.4	-146.1	-30.9	0	0	109.7	N129 Q133 Y134 F135	N129-Q131 PolarHBondContact O-N 3.06Å; Q131-Q133 PolarHBondContact O-N 3.46Å; Q131-Y134 HydrophobicContact CB-CD2 3.57Å; Q131-Y134 HydrophobicContact CB-CE2 3.78Å; Q131-Y134 HydrophobicContact CB-CG 4.06Å; Q131-Y134 HydrophobicContact CG-CD2 3.96Å; Q131-Y134 HydrophobicContact CG-CE2 3.71Å; Q131-Y134 PolarHBondContact O-N 3Å; Q131-Y134 VanDerWaalsContact O-N 3.09Å; Q131-Y134 PolarHBondContact OE1-OH 2.78Å; Q131-F135 WeakPolarHBondContact O-CD2 3.45Å; Q131-F135 PolarHBondContact O-N 2.83Å
132	P	83.3	Confident	84.5	Confident	97 Å²	97	82.9 Å²	82.9	63%	0.63	40%	0.401	S	S	*	.	H	α-helix	trans	-52.9	-44.5	-177.4	-24.5	31.5	0	0	0	112.3	Y134 F135 E136	P132-Y134 VanDerWaalsContact C-N 3.3Å; P132-Y134 PolarHBondContact O-N 3.11Å; P132-F135 PolarHBondContact O-N 3.33Å; P132-F135 VanDerWaalsContact O-N 3.13Å; P132-E136 PolarHBondContact O-N 2.99Å; P132-E136 VanDerWaalsContact O-N 3.13Å
133	Q	85.1	Confident	84.3	Confident	99 Å²	99	87.5 Å²	87.5	46%	0.463	42%	0.423	S	S	.	.	H	α-helix	trans	-58.2	-40.7	-178.4	-56.3	159.5	38	0	0	111.9	V109 Q131 H137	V109-Q133 HydrophobicContact CG1-CB 4.4Å; V109-Q133 HydrophobicContact CG2-CB 4.33Å; Q131-Q133 PolarHBondContact O-N 3.46Å; Q133-H137 PolarHBondContact O-ND1 3.15Å
134	Y	85.8	Confident	84	Confident	6 Å²	6	86.5 Å²	86.5	2%	0.024	42%	0.419	C	S	.	.	H	α-helix	trans	-66.8	-43.7	179	-63.5	-22.1	0	0	0	111.2	M105 V109 Q131 P132 E136 H137 I138	M105-Y134 HydrophobicContact CB-CD1 3.79Å; M105-Y134 HydrophobicContact CB-CE1 3.66Å; M105-Y134 HydrophobicContact CB-CG 4.32Å; M105-Y134 HydrophobicContact CE-CD1 3.99Å; M105-Y134 HydrophobicContact CE-CG 3.89Å; V109-Y134 HydrophobicContact CG2-CD1 3.85Å; V109-Y134 HydrophobicContact CG2-CE1 4.18Å; Q131-Y134 HydrophobicContact CB-CD2 3.57Å; Q131-Y134 HydrophobicContact CB-CE2 3.78Å; Q131-Y134 HydrophobicContact CB-CG 4.06Å; Q131-Y134 HydrophobicContact CG-CD2 3.96Å; Q131-Y134 HydrophobicContact CG-CE2 3.71Å; Q131-Y134 PolarHBondContact O-N 3Å; Q131-Y134 VanDerWaalsContact O-N 3.09Å; Q131-Y134 PolarHBondContact OE1-OH 2.78Å; P132-Y134 VanDerWaalsContact C-N 3.3Å; P132-Y134 PolarHBondContact O-N 3.11Å; Y134-E136 VanDerWaalsContact C-N 3.32Å; Y134-E136 PolarHBondContact O-N 3.33Å; Y134-H137 PolarHBondContact O-N 3.16Å; Y134-I138 VanDerWaalsContact O-CD1 3.28Å; Y134-I138 WeakPolarHBondContact O-CD1 3.44Å; Y134-I138 WeakPolarHBondContact O-CG1 2.9Å; Y134-I138 PolarHBondContact O-N 3.06Å
135	F	84.6	Confident	83.6	Confident	107 Å²	107	85.6 Å²	85.6	47%	0.469	42%	0.418	S	S	.	.	H	α-helix	trans	-65.4	-33.6	-179.8	-67.3	-70.4	0	0	0	113.3	V126 P130 Q131 P132 H137 I138	V126-F135 HydrophobicContact CG1-CD1 4.13Å; V126-F135 HydrophobicContact CG1-CE1 3.57Å; V126-F135 HydrophobicContact CG1-CE2 4.37Å; V126-F135 HydrophobicContact CG1-CZ 3.7Å; P130-F135 VanDerWaalsContact CA-CE2 3.48Å; P130-F135 HydrophobicContact CB-CE2 3.59Å; P130-F135 HydrophobicContact CB-CZ 3.93Å; Q131-F135 WeakPolarHBondContact O-CD2 3.45Å; Q131-F135 PolarHBondContact O-N 2.83Å; P132-F135 PolarHBondContact O-N 3.33Å; P132-F135 VanDerWaalsContact O-N 3.13Å; F135-H137 PolarHBondContact O-N 2.88Å; F135-I138 HydrophobicContact CD1-CD1 4.45Å; F135-I138 PolarHBondContact O-N 3.19Å
136	E	87.3	Confident	83.3	Confident	154 Å²	154	90.6 Å²	90.6	72%	0.72	44%	0.443	S	S	*	.	H	α-helix	trans	-63.7	-30.8	176.6	-71.3	-177.2	100.4	0	0	112.8	P132 Y134	P132-E136 PolarHBondContact O-N 2.99Å; P132-E136 VanDerWaalsContact O-N 3.13Å; Y134-E136 VanDerWaalsContact C-N 3.32Å; Y134-E136 PolarHBondContact O-N 3.33Å
137	H	86.1	Confident	83	Confident	31 Å²	31	96.8 Å²	96.8	14%	0.144	47%	0.473	C	S	.	.	H	α-helix	trans	-95.2	-15.4	-179.1	-63.5	82.8	0	0	0	112.7	V108 L113 K114 A115 Q133 Y134 F135 H139	V108-H137 HydrophobicContact CG1-CB 3.79Å; L113-H137 WeakPolarHBondContact O-CB 3.36Å; L113-H137 PolarHBondContact O-CD2 2.87Å; K114-H137 CarbonylContact C-O 3.48Å; K114-H137 WeakPolarHBondContact CA-O 3.27Å; A115-H137 PolarHBondContact N-O 3.15Å; Q133-H137 PolarHBondContact O-ND1 3.15Å; Y134-H137 PolarHBondContact O-N 3.16Å; F135-H137 PolarHBondContact O-N 2.88Å; H137-H139 PolarHBondContact O-N 2.73Å
138	I	87.4	Confident	82.6	Confident	41 Å²	41	90.7 Å²	90.7	21%	0.21	45%	0.45	C	S	.	.	B	Isolated β-bridge	trans	-75	123.1	179.5	-71	158	0	0	0	110.4	M105 A115 L117 V126 Y134 F135	M105-I138 HydrophobicContact CE-CD1 3.88Å; M105-I138 HydrophobicContact CE-CG1 3.84Å; A115-I138 HydrophobicContact CB-CG1 4.44Å; A115-I138 CarbonylContact O-C 3.58Å; A115-I138 VanDerWaalsContact O-CA 3.28Å; A115-I138 WeakPolarHBondContact O-CA 3.37Å; L117-I138 HydrophobicContact CD1-CD1 3.79Å; L117-I138 HydrophobicContact CD1-CG1 3.97Å; L117-I138 HydrophobicContact CD1-CG2 4.12Å; L117-I138 HydrophobicContact CG-CG1 4.28Å; L117-I138 HydrophobicContact CG-CG2 4.24Å; V126-I138 HydrophobicContact CB-CD1 4.22Å; V126-I138 HydrophobicContact CG1-CD1 3.54Å; V126-I138 HydrophobicContact CG2-CD1 3.93Å; Y134-I138 VanDerWaalsContact O-CD1 3.28Å; Y134-I138 WeakPolarHBondContact O-CD1 3.44Å; Y134-I138 WeakPolarHBondContact O-CG1 2.9Å; Y134-I138 PolarHBondContact O-N 3.06Å; F135-I138 HydrophobicContact CD1-CD1 4.45Å; F135-I138 PolarHBondContact O-N 3.19Å
139	H	77.9	Confident	82.3	Confident	94 Å²	94	88.5 Å²	88.5	44%	0.435	44%	0.442	S	S	.	.			trans	-114	119	177.4	-161.9	-76.7	0	0	0	109.9	K114 A115 H116 H137	K114-H139 HydrophobicContact CB-CB 4.23Å; K114-H139 HydrophobicContact CD-CB 4.4Å; A115-H139 PolarHBondContact O-N 2.91Å; H116-H139 PolarHBondContact ND1-O 3.03Å; H137-H139 PolarHBondContact O-N 2.73Å
140	Q	61.4	Low	82.2	Confident	222 Å²	222	92.7 Å²	92.7	100%	1.037	46%	0.462	S	S	*	.			trans	-78.7	0	172.9	-67.9	-167.5	-98.1	0	0	112	H116	H116-Q140 PolarHBondContact CE1-OXT 3.11Å; H116-Q140 VanDerWaalsContact CE1-OXT 3.3Å

Retrieved 140 of 140 residues in 35.9 ms (Link to these results)

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