A0A087YPE9_POEFO Loading...

Iron-sulfur cluster assembly enzyme ISCU

AlphaFold DB , UniProt , Accession A0A087YPE9, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 165 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	42.8	Very low	44	Very low	250 Å²	250	149.8 Å²	149.8	100%	1.232	84%	0.844	S	S	*	*				0	121.4	0	-69.5	-169.7	166.4	0	0	106.5
2	A	41.8	Very low	44.9	Very low	98 Å²	98	147.6 Å²	147.6	81%	0.81	84%	0.84	S	S	*	*			cis	-145.8	148.1	6.8	0	0	0	0	0	104.9
3	G	38.1	Very low	45.4	Very low	68 Å²	68	147.6 Å²	147.6	70%	0.701	84%	0.835	S	S	*	*			cis	81.9	75	45.2	0	0	0	0	0	110.1
4	Y	39.9	Very low	45.4	Very low	237 Å²	237	143.6 Å²	143.6	93%	0.929	82%	0.821	S	S	*	*			trans	-147.4	124.8	156.7	-125	-91.5	0	0	0	111.5
5	V	46.5	Very low	45.5	Very low	124 Å²	124	143.8 Å²	143.8	75%	0.752	82%	0.818	S	S	*	*			trans	-111.7	133.1	-179.4	167.8	0	0	0	0	107.6
6	A	46	Very low	45.8	Very low	88 Å²	88	145 Å²	145	73%	0.727	82%	0.82	S	S	*	*			trans	179.8	107.3	147.5	0	0	0	0	0	108.6
7	K	43.3	Very low	46	Very low	186 Å²	186	144.2 Å²	144.2	81%	0.809	82%	0.819	S	S	*	*				79.4	122.3	81.2	-83.3	-175.6	-179.9	175.7	0	114.9
8	K	42.9	Very low	46.1	Very low	194 Å²	194	148.1 Å²	148.1	84%	0.843	82%	0.819	S	S	*	*			trans	81.5	114.3	151.5	-69.5	177.3	171.8	-175.7	0	118.3
9	C	40.3	Very low	46.2	Very low	127 Å²	127	152.8 Å²	152.8	86%	0.858	82%	0.823	S	S	*	*				-158.8	120.3	102	-135.3	0	0	0	0	110.2
10	L	50.8	Low	46.5	Very low	173 Å²	173	153.4 Å²	153.4	91%	0.906	83%	0.825	S	S	*	*			trans	-71.5	133.7	161.3	-87.3	89	0	0	0	107.7
11	S	51.2	Low	47.1	Very low	103 Å²	103	151.2 Å²	151.2	72%	0.72	82%	0.821	S	S	*	*			trans	-134.6	124.4	155.5	58.8	0	0	0	0	109.3
12	P	55.8	Low	47.8	Very low	123 Å²	123	142.9 Å²	142.9	80%	0.799	79%	0.792	S	S	*	*			trans	-94.5	104.8	178.1	34.3	-25.7	0	0	0	109.4
13	L	50.9	Low	48.2	Very low	148 Å²	148	143 Å²	143	78%	0.775	79%	0.785	S	S	*	*			trans	-137.5	103.6	161.6	-99.6	98.3	0	0	0	105.2
14	S	45.5	Very low	48.9	Very low	91 Å²	91	147.9 Å²	147.9	64%	0.636	79%	0.789	S	S	*	*				36.1	105.7	90.4	83.1	0	0	0	0	109.5
15	L	46.2	Very low	49.4	Very low	147 Å²	147	145 Å²	145	77%	0.77	78%	0.782	S	S	*	*				-153.7	131.4	52.8	-79.3	114.4	0	0	0	108.3	T17	L15-T17 VanDerWaalsContact C-N 3.26Å; L15-T17 PolarHBondContact O-N 3.01Å
16	L	50.6	Low	49.9	Very low	163 Å²	163	144.4 Å²	144.4	85%	0.853	77%	0.773	S	S	*	*			trans	-48	99.7	147.9	-116.4	77.7	0	0	0	106.7	R18	L16-R18 PolarHBondContact O-N 2.85Å
17	T	49.2	Very low	50.2	Low	132 Å²	132	146.2 Å²	146.2	81%	0.81	78%	0.776	S	S	*	*			trans	-70.4	77.1	156.9	36.6	0	0	0	0	105.8	L15 R19	L15-T17 VanDerWaalsContact C-N 3.26Å; L15-T17 PolarHBondContact O-N 3.01Å; T17-R19 PolarHBondContact O-N 2.92Å
18	R	47.3	Very low	50.7	Low	214 Å²	214	143.5 Å²	143.5	81%	0.808	77%	0.766	S	S	*	*			trans	-54.2	99.2	164.5	-163.2	-179.6	-172.2	-153.7	2.2	104.2	L16 L20	L16-R18 PolarHBondContact O-N 2.85Å; R18-L20 VanDerWaalsContact C-N 3.3Å; R18-L20 PolarHBondContact O-N 2.7Å
19	R	49	Very low	51.3	Low	237 Å²	237	140.2 Å²	140.2	89%	0.894	77%	0.766	S	S	*	*			trans	-51.6	106.7	167.6	-82.9	-174.3	178.2	-139.1	1.1	104.6	T17 S21	T17-R19 PolarHBondContact O-N 2.92Å; R19-S21 PolarHBondContact O-N 3.49Å
20	L	53	Low	52.7	Low	165 Å²	165	138.3 Å²	138.3	86%	0.864	75%	0.753	S	S	*	*			trans	-61.6	92.1	161.3	-82.2	152.2	0	0	0	103.9	R18 A22	R18-L20 VanDerWaalsContact C-N 3.3Å; R18-L20 PolarHBondContact O-N 2.7Å; L20-A22 PolarHBondContact O-N 2.96Å
21	S	58.7	Low	54.2	Low	108 Å²	108	135.3 Å²	135.3	76%	0.755	73%	0.73	S	S	*	*			trans	-58.7	99.1	154.8	53	0	0	0	0	103.9	R19	R19-S21 PolarHBondContact O-N 3.49Å
22	A	56.9	Low	56	Low	74 Å²	74	133.3 Å²	133.3	61%	0.612	71%	0.71	S	S	*	*			trans	-47	132.8	167	0	0	0	0	0	106.3	L20 E24	L20-A22 PolarHBondContact O-N 2.96Å; A22-E24 PolarHBondContact O-N 3.18Å
23	P	50.9	Low	57.7	Low	102 Å²	102	136.1 Å²	136.1	66%	0.662	71%	0.709	S	S	*	*			trans	-58.6	116.9	168.4	25.9	-29.3	0	0	0	104.9	F25	P23-F25 HydrophobicContact CB-CD2 4.06Å; P23-F25 HydrophobicContact CB-CE2 4.48Å; P23-F25 HydrophobicContact CG-CD2 4.22Å; P23-F25 PolarHBondContact O-N 3.39Å
24	E	51.8	Low	59.6	Low	170 Å²	170	132.8 Å²	132.8	79%	0.794	69%	0.689	S	S	*	*			trans	-63.9	80.2	164.6	-73.6	178.7	166.5	0	0	105.9	A22 I26	A22-E24 PolarHBondContact O-N 3.18Å; E24-I26 HydrophobicContact CB-CG1 4.13Å; E24-I26 PolarHBondContact O-N 3.37Å
25	F	49.7	Very low	61.8	Low	177 Å²	177	128.7 Å²	128.7	78%	0.776	66%	0.66	S	S	*	*			trans	-68.7	77.5	156.6	-99.6	-87.5	0	0	0	105.1	P23 T27	P23-F25 HydrophobicContact CB-CD2 4.06Å; P23-F25 HydrophobicContact CB-CE2 4.48Å; P23-F25 HydrophobicContact CG-CD2 4.22Å; P23-F25 PolarHBondContact O-N 3.39Å; F25-T27 PolarHBondContact O-N 3.05Å
26	I	58.8	Low	64	Low	111 Å²	111	124.1 Å²	124.1	57%	0.569	64%	0.637	S	S	*	*			trans	-64.9	92.5	156.5	-47.8	-179.7	0	0	0	102.9	E24 Q28	E24-I26 HydrophobicContact CB-CG1 4.13Å; E24-I26 PolarHBondContact O-N 3.37Å; I26-Q28 HydrophobicContact CB-CB 4.5Å; I26-Q28 HydrophobicContact CG2-CB 3.67Å; I26-Q28 HydrophobicContact CG2-CG 4.09Å; I26-Q28 PolarHBondContact O-N 3.47Å
27	T	52	Low	66.1	Low	126 Å²	126	119.2 Å²	119.2	77%	0.773	61%	0.612	S	S	*	*			trans	-66.1	72.9	158.4	-48.7	0	0	0	0	105.2	F25 C29	F25-T27 PolarHBondContact O-N 3.05Å; T27-C29 PolarHBondContact O-N 2.8Å
28	Q	54	Low	68.3	Low	128 Å²	128	113.6 Å²	113.6	60%	0.598	58%	0.577	S	S	*	*			trans	-70.9	113.5	179.7	-157.2	158	-26.9	0	0	103.7	I26 C30	I26-Q28 HydrophobicContact CB-CB 4.5Å; I26-Q28 HydrophobicContact CG2-CB 3.67Å; I26-Q28 HydrophobicContact CG2-CG 4.09Å; I26-Q28 PolarHBondContact O-N 3.47Å; Q28-C30 WeakPolarHBondContact CB-SG 3.27Å; Q28-C30 WeakPolarHBondContact CG-SG 3.42Å; Q28-C30 PolarHBondContact O-N 2.93Å
29	C	55.8	Low	70.6	Confident	125 Å²	125	109.3 Å²	109.3	85%	0.845	56%	0.561	S	S	*	*			trans	-61.6	68.3	159.5	-95	0	0	0	0	107.4	T27 Y31	T27-C29 PolarHBondContact O-N 2.8Å; C29-Y31 PolarHBondContact O-N 2.68Å
30	C	69.8	Low	72.7	Confident	88 Å²	88	104.2 Å²	104.2	60%	0.595	55%	0.548	S	S	*	.			trans	-74.3	115.3	178.8	-79.6	0	0	0	0	106.5	Q28	Q28-C30 WeakPolarHBondContact CB-SG 3.27Å; Q28-C30 WeakPolarHBondContact CG-SG 3.42Å; Q28-C30 PolarHBondContact O-N 2.93Å
31	Y	80.9	Confident	74.7	Confident	109 Å²	109	101 Å²	101	43%	0.427	53%	0.532	S	S	.	.			trans	-52.4	147.5	156	-67.3	-85.6	0	0	0	109.2	C29 V35 K131	C29-Y31 PolarHBondContact O-N 2.68Å; Y31-V35 HydrophobicContact CD1-CG1 3.92Å; Y31-V35 HydrophobicContact CG-CG1 4.31Å; Y31-K131 HydrophobicContact CE1-CD 4.29Å; Y31-K131 PolarHBondContact OH-NZ 3.42Å
32	H	89.1	Confident	76.4	Confident	62 Å²	62	98.1 Å²	98.1	29%	0.287	51%	0.51	S	S	.	.			trans	-58.2	144.4	174.3	-170.8	-102	0	0	0	109.9	K34 V35 V36 L125 R126	H32-K34 PolarHBondContact ND1-N 3.34Å; H32-K34 PolarHBondContact O-N 3.36Å; H32-V35 HydrophobicContact CB-CG2 4.39Å; H32-V35 WeakPolarHBondContact O-CB 3.4Å; H32-V35 PolarHBondContact O-N 3.21Å; H32-V36 PolarHBondContact O-N 3.39Å; H32-L125 WeakPolarHBondContact CB-O 3.44Å; H32-R126 HydrophobicContact CB-CB 4.14Å
33	K	90.9	Very high	78.2	Confident	182 Å²	182	98 Å²	98	79%	0.791	49%	0.494	S	S	*	.	H	α-helix	trans	-51.6	-36.5	-176.9	-65.8	-175.9	178.3	-176.8	0	113	V36 D37	K33-V36 PolarHBondContact O-N 3.16Å; K33-D37 WeakPolarHBondContact O-CB 3.26Å; K33-D37 PolarHBondContact O-N 3.46Å
34	K	91.1	Very high	80.3	Confident	78 Å²	78	94.5 Å²	94.5	34%	0.339	47%	0.47	S	S	.	.	H	α-helix	trans	-62.9	-41	175.8	-65.6	-178.8	177.1	-173.8	0	112.9	H32 V36 D37 H38 E124 L125	H32-K34 PolarHBondContact ND1-N 3.34Å; H32-K34 PolarHBondContact O-N 3.36Å; K34-V36 VanDerWaalsContact C-N 3.33Å; K34-D37 PolarHBondContact O-N 3.42Å; K34-H38 PolarHBondContact O-CD2 3.44Å; K34-H38 PolarHBondContact O-N 2.9Å; K34-E124 VanDerWaalsContact CD-O 3.31Å; K34-E124 WeakPolarHBondContact CD-O 3.17Å; K34-E124 IonicContact NZ-OE1 3.15Å; K34-E124 PolarHBondContact NZ-OE1 3.45Å; K34-E124 IonicContact NZ-OE2 3.37Å; K34-E124 PolarHBondContact NZ-OE2 3.15Å; K34-L125 HydrophobicContact CB-CD2 4.16Å
35	V	93	Very high	82.4	Confident	5 Å²	5	90 Å²	90	3%	0.03	45%	0.454	C	S	.	.	H	α-helix	trans	-64.3	-43.3	177.4	174.6	0	0	0	0	110.3	Y31 H32 Y39 A96 L125 L127	Y31-V35 HydrophobicContact CD1-CG1 3.92Å; Y31-V35 HydrophobicContact CG-CG1 4.31Å; H32-V35 HydrophobicContact CB-CG2 4.39Å; H32-V35 WeakPolarHBondContact O-CB 3.4Å; H32-V35 PolarHBondContact O-N 3.21Å; V35-Y39 WeakPolarHBondContact O-CB 3.39Å; V35-Y39 PolarHBondContact O-N 3.39Å; V35-A96 HydrophobicContact CB-CB 4.4Å; V35-A96 HydrophobicContact CG1-CB 3.85Å; V35-L125 HydrophobicContact CG2-CB 3.79Å; V35-L125 HydrophobicContact CG2-CD2 4.04Å; V35-L125 HydrophobicContact CG2-CG 4.36Å; V35-L125 VanDerWaalsContact CG2-O 3.29Å; V35-L125 WeakPolarHBondContact CG2-O 3.48Å; V35-L127 HydrophobicContact CG2-CD2 3.86Å
36	V	92.8	Very high	84.6	Confident	50 Å²	50	82.6 Å²	82.6	30%	0.303	43%	0.427	S	S	.	.	H	α-helix	trans	-62.1	-46.3	177.7	-179.1	0	0	0	0	110.4	H32 K33 K34 H38 Y39 E40	H32-V36 PolarHBondContact O-N 3.39Å; K33-V36 PolarHBondContact O-N 3.16Å; K34-V36 VanDerWaalsContact C-N 3.33Å; V36-H38 PolarHBondContact O-N 3.49Å; V36-Y39 PolarHBondContact O-N 3.5Å; V36-Y39 VanDerWaalsContact O-N 3.12Å; V36-E40 HydrophobicContact CG1-CG 4.16Å; V36-E40 WeakPolarHBondContact O-CB 3.25Å; V36-E40 WeakPolarHBondContact O-CG 3.43Å; V36-E40 PolarHBondContact O-N 3.46Å
37	D	94.4	Very high	86.3	Confident	61 Å²	61	80.4 Å²	80.4	33%	0.326	42%	0.422	S	S	.	.	H	α-helix	trans	-61.5	-45.7	179.6	176.3	46.9	0	0	0	113	K33 K34 Y39 N41 R43	K33-D37 WeakPolarHBondContact O-CB 3.26Å; K33-D37 PolarHBondContact O-N 3.46Å; K34-D37 PolarHBondContact O-N 3.42Å; D37-Y39 VanDerWaalsContact C-N 3.26Å; D37-Y39 PolarHBondContact O-N 3.07Å; D37-N41 PolarHBondContact O-N 3.31Å; D37-R43 PolarHBondContact O-NH1 2.96Å; D37-R43 IonicContact OD1-CZ 3.82Å; D37-R43 IonicContact OD1-NH1 2.67Å; D37-R43 PolarHBondContact OD1-NH1 3.05Å; D37-R43 IonicContact OD1-NH2 3.35Å; D37-R43 PolarHBondContact OD1-NH2 2.81Å; D37-R43 IonicContact OD2-CZ 2.8Å; D37-R43 IonicContact OD2-NH1 3.93Å; D37-R43 PolarHBondContact OD2-NH1 3.44Å; D37-R43 IonicContact OD2-NH2 3.1Å; D37-R43 PolarHBondContact OD2-NH2 2.79Å
38	H	95.4	Very high	88.3	Confident	13 Å²	13	76 Å²	76	6%	0.06	39%	0.393	C	S	.	.	H	α-helix	trans	-70.8	-20.9	175.4	-77.3	-76.1	0	0	0	113.7	K34 V36 P42 A96 S99 E103	K34-H38 PolarHBondContact O-CD2 3.44Å; K34-H38 PolarHBondContact O-N 2.9Å; V36-H38 PolarHBondContact O-N 3.49Å; H38-P42 WeakPolarHBondContact O-CA 3.38Å; H38-P42 WeakPolarHBondContact O-CB 3.27Å; H38-A96 HydrophobicContact CB-CB 3.85Å; H38-S99 PolarHBondContact ND1-OG 3.2Å; H38-E103 IonicContact CE1-OE2 3.23Å; H38-E103 PolarHBondContact CE1-OE2 3.29Å
39	Y	94	Very high	90.1	Very high	124 Å²	124	74.4 Å²	74.4	49%	0.486	39%	0.389	S	S	.	.	H	α-helix	trans	-81.2	-45.4	175.5	173.3	-105.3	0	0	0	112.1	V35 V36 D37 G92 I95	V35-Y39 WeakPolarHBondContact O-CB 3.39Å; V35-Y39 PolarHBondContact O-N 3.39Å; V36-Y39 PolarHBondContact O-N 3.5Å; V36-Y39 VanDerWaalsContact O-N 3.12Å; D37-Y39 VanDerWaalsContact C-N 3.26Å; D37-Y39 PolarHBondContact O-N 3.07Å; Y39-G92 VanDerWaalsContact CD2-CA 3.47Å; Y39-I95 HydrophobicContact CD2-CB 4.24Å; Y39-I95 HydrophobicContact CD2-CD1 4.11Å; Y39-I95 HydrophobicContact CD2-CG2 4.31Å; Y39-I95 HydrophobicContact CE2-CD1 3.85Å
40	E	93.8	Very high	91.5	Very high	131 Å²	131	74.8 Å²	74.8	61%	0.612	38%	0.376	S	S	*	.	H	α-helix	trans	-73.6	-39.9	-179.9	-70	-178.3	169.4	0	0	111.7	V36 P42	V36-E40 HydrophobicContact CG1-CG 4.16Å; V36-E40 WeakPolarHBondContact O-CB 3.25Å; V36-E40 WeakPolarHBondContact O-CG 3.43Å; V36-E40 PolarHBondContact O-N 3.46Å; E40-P42 VanDerWaalsContact C-CD 3.44Å; E40-P42 WeakPolarHBondContact O-CD 3.3Å
41	N	95.2	Very high	92.2	Very high	98 Å²	98	76.7 Å²	76.7	52%	0.524	38%	0.38	S	S	.	.	S	Bend	trans	-122.4	68	179.6	-58.7	-61.2	0	0	0	110.3	D37 R43	D37-N41 PolarHBondContact O-N 3.31Å; N41-R43 WeakPolarHBondContact O-CD 3.5Å; N41-R43 PolarHBondContact O-N 3.47Å; N41-R43 PolarHBondContact O-NH1 2.8Å
42	P	94.3	Very high	92.7	Very high	47 Å²	47	73.1 Å²	73.1	31%	0.305	37%	0.372	S	S	.	.			trans	-65.7	126.7	-179.8	29	-34.7	0	0	0	110	H38 E40 V45 F86 I95	H38-P42 WeakPolarHBondContact O-CA 3.38Å; H38-P42 WeakPolarHBondContact O-CB 3.27Å; E40-P42 VanDerWaalsContact C-CD 3.44Å; E40-P42 WeakPolarHBondContact O-CD 3.3Å; P42-V45 HydrophobicContact CB-CG2 3.6Å; P42-V45 HydrophobicContact CG-CG2 3.7Å; P42-F86 HydrophobicContact CB-CZ 4.12Å; P42-I95 HydrophobicContact CB-CG2 4.15Å
43	R	95.4	Very high	92.6	Very high	71 Å²	71	75.5 Å²	75.5	27%	0.268	38%	0.381	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.4	155.7	179.2	-62.5	89.4	161.4	137.4	-5.5	110.1	D37 N41 V45 F86 S99 E103	D37-R43 PolarHBondContact O-NH1 2.96Å; D37-R43 IonicContact OD1-CZ 3.82Å; D37-R43 IonicContact OD1-NH1 2.67Å; D37-R43 PolarHBondContact OD1-NH1 3.05Å; D37-R43 IonicContact OD1-NH2 3.35Å; D37-R43 PolarHBondContact OD1-NH2 2.81Å; D37-R43 IonicContact OD2-CZ 2.8Å; D37-R43 IonicContact OD2-NH1 3.93Å; D37-R43 PolarHBondContact OD2-NH1 3.44Å; D37-R43 IonicContact OD2-NH2 3.1Å; D37-R43 PolarHBondContact OD2-NH2 2.79Å; N41-R43 WeakPolarHBondContact O-CD 3.5Å; N41-R43 PolarHBondContact O-N 3.47Å; N41-R43 PolarHBondContact O-NH1 2.8Å; R43-V45 PolarHBondContact O-N 3.21Å; R43-F86 WeakPolarHBondContact O-CE1 3.32Å; R43-S99 WeakPolarHBondContact CD-OG 3.39Å; R43-S99 PolarHBondContact N-OG 2.92Å; R43-E103 HydrophobicContact CB-CG 4.12Å; R43-E103 WeakPolarHBondContact CB-OE1 3.46Å; R43-E103 WeakPolarHBondContact CD-OE1 3.34Å; R43-E103 WeakPolarHBondContact CG-OE1 3.39Å; R43-E103 IonicContact NE-OE1 3.5Å; R43-E103 PolarHBondContact NE-OE1 3.14Å; R43-E103 VanDerWaalsContact NE-OE1 3.15Å
44	N	95.1	Very high	92.7	Very high	28 Å²	28	70.3 Å²	70.3	15%	0.15	36%	0.358	C	S	.	.	T	Hydrogen-bonded Turn	trans	59.4	22	171.3	-60.1	92.3	0	0	0	115.6	G46 A84 R85 F86 T102	N44-G46 PolarHBondContact O-N 2.88Å; N44-A84 VanDerWaalsContact CB-O 3.32Å; N44-A84 WeakPolarHBondContact CB-O 3.22Å; N44-A84 PolarHBondContact ND2-O 2.88Å; N44-R85 VanDerWaalsContact O-CA 3.26Å; N44-R85 WeakPolarHBondContact O-CA 3.32Å; N44-R85 VanDerWaalsContact O-CD 3.3Å; N44-R85 WeakPolarHBondContact O-CD 3.08Å; N44-F86 PolarHBondContact O-N 2.94Å; N44-F86 VanDerWaalsContact O-N 3.12Å; N44-T102 HydrophobicContact CB-CG2 4.41Å
45	V	95.3	Very high	92.9	Very high	76 Å²	76	66.7 Å²	66.7	46%	0.461	34%	0.343	S	S	.	.	B	Isolated β-bridge	trans	-66.6	134.3	171.7	-176.1	0	0	0	0	109.2	P42 R43 F86	P42-V45 HydrophobicContact CB-CG2 3.6Å; P42-V45 HydrophobicContact CG-CG2 3.7Å; R43-V45 PolarHBondContact O-N 3.21Å; V45-F86 HydrophobicContact CG2-CE1 3.99Å; V45-F86 HydrophobicContact CG2-CE2 4.44Å; V45-F86 HydrophobicContact CG2-CZ 3.8Å
46	G	94.8	Very high	93	Very high	22 Å²	22	66.5 Å²	66.5	23%	0.227	34%	0.342	C	S	.	.	S	Bend	trans	155	-167.2	178.2	0	0	0	0	0	113.3	N44 F86 K87	N44-G46 PolarHBondContact O-N 2.88Å; G46-F86 PolarHBondContact N-O 2.89Å; G46-F86 VanDerWaalsContact N-O 3.1Å; G46-F86 CarbonylContact O-C 3.48Å; G46-K87 WeakPolarHBondContact O-CE 3.34Å; G46-K87 VanDerWaalsContact O-CG 3.26Å; G46-K87 WeakPolarHBondContact O-CG 3.46Å
47	S	94.7	Very high	93.2	Very high	65 Å²	65	65.5 Å²	65.5	46%	0.455	34%	0.336	S	S	.	.			trans	-139.7	148.4	171.9	42.9	0	0	0	0	110	Q72 K87	S47-Q72 VanDerWaalsContact CA-OE1 3.23Å; S47-Q72 VanDerWaalsContact CB-OE1 3.25Å; S47-K87 WeakPolarHBondContact OG-CE 3.26Å; S47-K87 PolarHBondContact OG-NZ 3.01Å
48	L	94.3	Very high	93.3	Very high	33 Å²	33	62.7 Å²	62.7	17%	0.173	32%	0.321	C	S	.	.			trans	-102.5	165.4	172.5	-62.8	169.1	0	0	0	109.9	K50 V55 Q72 E74 R85	L48-K50 PolarHBondContact O-N 3.03Å; L48-V55 HydrophobicContact CB-CG1 4.01Å; L48-V55 HydrophobicContact CB-CG2 4.27Å; L48-V55 HydrophobicContact CD1-CG1 4.43Å; L48-Q72 HydrophobicContact CB-CB 4.21Å; L48-Q72 HydrophobicContact CD1-CB 4.04Å; L48-Q72 HydrophobicContact CG-CB 4.37Å; L48-Q72 PolarHBondContact O-NE2 3.26Å; L48-Q72 VanDerWaalsContact O-NE2 3.15Å; L48-Q72 PolarHBondContact O-OE1 2.8Å; L48-E74 HydrophobicContact CD1-CB 4Å; L48-R85 HydrophobicContact CD1-CB 4.38Å; L48-R85 HydrophobicContact CD1-CG 4.16Å; L48-R85 HydrophobicContact CD2-CG 3.86Å; L48-R85 HydrophobicContact CG-CB 4.07Å; L48-R85 HydrophobicContact CG-CG 3.72Å
49	D	91.8	Very high	93.3	Very high	94 Å²	94	68 Å²	68	50%	0.503	35%	0.349	S	S	.	.			trans	-66.7	116.8	175.2	-175.2	11.4	0	0	0	110.5	N51 S52 V55	D49-N51 PolarHBondContact O-N 2.93Å; D49-N51 PolarHBondContact OD1-N 3.35Å; D49-S52 PolarHBondContact O-N 2.84Å; D49-V55 WeakPolarHBondContact O-CB 3.26Å
50	K	85.3	Confident	93.4	Very high	134 Å²	134	63.3 Å²	63.3	58%	0.583	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.4	-22.7	179.8	61.4	172.8	-175.7	172.2	0	113	L48 S52 K152	L48-K50 PolarHBondContact O-N 3.03Å; K50-S52 VanDerWaalsContact C-N 3.33Å; K50-K152 PolarHBondContact O-NZ 2.85Å
51	N	85.7	Confident	93.3	Very high	127 Å²	127	59.2 Å²	59.2	68%	0.679	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	-13.2	-177.3	-58.2	-33.9	0	0	0	112	D49 K53	D49-N51 PolarHBondContact O-N 2.93Å; D49-N51 PolarHBondContact OD1-N 3.35Å; N51-K53 PolarHBondContact O-N 3.14Å
52	S	90.1	Very high	93	Very high	35 Å²	35	55.6 Å²	55.6	25%	0.245	31%	0.31	C	S	.	.			trans	-68.5	131.9	175.3	179.5	0	0	0	0	110.5	D49 K50 K54 V55	D49-S52 PolarHBondContact O-N 2.84Å; K50-S52 VanDerWaalsContact C-N 3.33Å; S52-K54 PolarHBondContact O-N 3.45Å; S52-K54 PolarHBondContact OG-N 2.8Å; S52-V55 PolarHBondContact O-N 2.81Å; S52-V55 VanDerWaalsContact O-N 3.16Å
53	K	87.9	Confident	92.6	Very high	111 Å²	111	59.5 Å²	59.5	48%	0.483	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.8	-27.6	175.3	-68.2	160.5	172.3	-102.9	0	112.2	N51 V55 Q153 D156	N51-K53 PolarHBondContact O-N 3.14Å; K53-V55 PolarHBondContact O-N 2.87Å; K53-Q153 PolarHBondContact O-NE2 2.7Å; K53-D156 WeakPolarHBondContact CD-OD2 3.35Å; K53-D156 WeakPolarHBondContact CG-OD2 3.48Å; K53-D156 IonicContact NZ-OD1 2.7Å; K53-D156 PolarHBondContact NZ-OD1 3.1Å; K53-D156 IonicContact NZ-OD2 2.85Å; K53-D156 PolarHBondContact NZ-OD2 3.12Å
54	K	92.8	Very high	92.2	Very high	73 Å²	73	60.9 Å²	60.9	32%	0.317	36%	0.362	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-6.4	178.8	-62.4	-165.2	-172.1	-164.4	0	113.3	S52 E74 V75 D77	S52-K54 PolarHBondContact O-N 3.45Å; S52-K54 PolarHBondContact OG-N 2.8Å; K54-E74 WeakPolarHBondContact O-CA 3.39Å; K54-V75 WeakPolarHBondContact CB-O 3.32Å; K54-V75 PolarHBondContact O-N 3.38Å; K54-D77 VanDerWaalsContact CE-OD1 3.27Å; K54-D77 WeakPolarHBondContact CE-OD1 3.05Å; K54-D77 IonicContact NZ-OD1 2.61Å; K54-D77 PolarHBondContact NZ-OD1 3.07Å; K54-D77 IonicContact NZ-OD2 3.23Å; K54-D77 PolarHBondContact NZ-OD2 3.01Å
55	V	95.3	Very high	91.8	Very high	3 Å²	3	62.8 Å²	62.8	2%	0.018	38%	0.377	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	117.1	-174.3	176.8	0	0	0	0	111.5	L48 D49 S52 K53 Q72 I73 E74 K152	L48-V55 HydrophobicContact CB-CG1 4.01Å; L48-V55 HydrophobicContact CB-CG2 4.27Å; L48-V55 HydrophobicContact CD1-CG1 4.43Å; D49-V55 WeakPolarHBondContact O-CB 3.26Å; S52-V55 PolarHBondContact O-N 2.81Å; S52-V55 VanDerWaalsContact O-N 3.16Å; K53-V55 PolarHBondContact O-N 2.87Å; V55-Q72 HydrophobicContact CG1-CB 4.31Å; V55-I73 CarbonylContact C-O 3.55Å; V55-I73 WeakPolarHBondContact CA-O 3.13Å; V55-E74 HydrophobicContact CG2-CB 4.19Å; V55-E74 HydrophobicContact CG2-CG 4.16Å; V55-K152 PolarHBondContact O-NZ 3.26Å
56	G	95.4	Very high	91.5	Very high	0 Å²	0	61.1 Å²	61.1	0%	0	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	138.7	167.4	0	0	0	0	0	111.2	Q72 I73 A145	G56-Q72 CarbonylContact O-C 3.53Å; G56-Q72 VanDerWaalsContact O-CA 3.26Å; G56-Q72 WeakPolarHBondContact O-CA 3.43Å; G56-I73 PolarHBondContact N-O 3.11Å; G56-I73 PolarHBondContact O-N 3.26Å; G56-A145 WeakPolarHBondContact CA-O 3.26Å
57	T	96.3	Very high	91.4	Very high	30 Å²	30	60.5 Å²	60.5	18%	0.184	37%	0.366	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	118.1	177.7	-62.5	0	0	0	0	110.9	K70 L71 Q72 D148	T57-K70 HydrophobicContact CG2-CG 4.33Å; T57-L71 WeakPolarHBondContact CA-O 3.46Å; T57-Q72 HydrophobicContact CG2-CG 4.12Å; T57-Q72 PolarHBondContact OG1-NE2 3.21Å; T57-D148 PolarHBondContact N-OD2 2.95Å; T57-D148 VanDerWaalsContact O-CB 3.3Å; T57-D148 WeakPolarHBondContact O-CB 3.34Å
58	G	96.1	Very high	91.4	Very high	1 Å²	1	60.4 Å²	60.4	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	122.4	170.9	0	0	0	0	0	110.4	K70 L71	G58-K70 CarbonylContact O-C 3.49Å; G58-K70 WeakPolarHBondContact O-CA 3.49Å; G58-L71 PolarHBondContact N-O 3.31Å; G58-L71 PolarHBondContact O-N 3.4Å
59	L	95.6	Very high	91.5	Very high	124 Å²	124	58.9 Å²	58.9	65%	0.649	36%	0.355	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-114.4	115.3	169.4	-178.8	67.9	0	0	0	108.6	V68 K70	L59-V68 HydrophobicContact CD1-CG1 4Å; L59-K70 HydrophobicContact CD1-CB 3.95Å; L59-K70 HydrophobicContact CD1-CG 4.43Å
60	V	95.6	Very high	91.7	Very high	27 Å²	27	57.5 Å²	57.5	16%	0.164	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	153.9	-179	-63.5	0	0	0	0	110.1	V68 M69 L137 D140 A141 A144	V60-V68 WeakPolarHBondContact O-CA 3.48Å; V60-M69 HydrophobicContact CG2-CB 4.1Å; V60-M69 PolarHBondContact N-O 3.14Å; V60-M69 PolarHBondContact O-N 2.79Å; V60-L137 HydrophobicContact CB-CD1 4.25Å; V60-L137 HydrophobicContact CG2-CD1 3.65Å; V60-L137 HydrophobicContact CG2-CG 4.21Å; V60-D140 HydrophobicContact CG1-CB 4.27Å; V60-A141 HydrophobicContact CG2-CB 3.57Å; V60-A144 HydrophobicContact CG1-CB 3.86Å
61	G	93.1	Very high	92.2	Very high	44 Å²	44	51.1 Å²	51.1	45%	0.454	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.4	147.1	177.4	0	0	0	0	0	112	P63 D67	G61-P63 WeakPolarHBondContact O-CD 3.2Å; G61-D67 CarbonylContact C-O 3.59Å; G61-D67 WeakPolarHBondContact CA-O 3.4Å
62	A	89.1	Confident	92.8	Very high	22 Å²	22	45.2 Å²	45.2	18%	0.182	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	95.6	176.3	0	0	0	0	0	109.1	A64 C65 G66 D67 L137	A62-A64 PolarHBondContact O-N 3.03Å; A62-A64 VanDerWaalsContact O-N 3.11Å; A62-C65 PolarHBondContact O-N 3.37Å; A62-C65 VanDerWaalsContact O-N 3.1Å; A62-G66 PolarHBondContact O-N 2.76Å; A62-D67 PolarHBondContact N-O 3.1Å; A62-L137 HydrophobicContact CB-CD1 4.49Å
63	P	85.9	Confident	93.1	Very high	130 Å²	130	43.7 Å²	43.7	84%	0.844	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.1	-24.8	-172.8	23.6	-33.9	0	0	0	113.6	G61 C65	G61-P63 WeakPolarHBondContact O-CD 3.2Å; P63-C65 VanDerWaalsContact C-N 3.34Å
64	A	87	Confident	93.5	Very high	100 Å²	100	41.4 Å²	41.4	83%	0.826	27%	0.265	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.6	-31.2	178.1	0	0	0	0	0	113.4	A62	A62-A64 PolarHBondContact O-N 3.03Å; A62-A64 VanDerWaalsContact O-N 3.11Å
65	C	85.5	Confident	93.6	Very high	68 Å²	68	37.9 Å²	37.9	46%	0.459	25%	0.25	S	C	.	.	T	Hydrogen-bonded Turn	trans	-112.9	-13.5	-175.4	-59	0	0	0	0	112.7	A62 P63 D67	A62-C65 PolarHBondContact O-N 3.37Å; A62-C65 VanDerWaalsContact O-N 3.1Å; P63-C65 VanDerWaalsContact C-N 3.34Å; C65-D67 VanDerWaalsContact C-N 3.27Å
66	G	88.8	Confident	93.5	Very high	41 Å²	41	39.4 Å²	39.4	42%	0.423	26%	0.258	S	S	.	.	T	Hydrogen-bonded Turn	trans	78.9	7.5	-177.5	0	0	0	0	0	114.1	A62	A62-G66 PolarHBondContact O-N 2.76Å
67	D	93.4	Very high	93.2	Very high	8 Å²	8	46 Å²	46	4%	0.043	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	135.2	177.4	-69.3	-15.8	0	0	0	109.9	G61 A62 C65 F89 G90 C91 H133 L137	G61-D67 CarbonylContact C-O 3.59Å; G61-D67 WeakPolarHBondContact CA-O 3.4Å; A62-D67 PolarHBondContact N-O 3.1Å; C65-D67 VanDerWaalsContact C-N 3.27Å; D67-F89 CarbonylContact C-O 3.54Å; D67-F89 WeakPolarHBondContact CA-O 3.33Å; D67-G90 WeakPolarHBondContact OD1-CA 3.36Å; D67-C91 PolarHBondContact OD1-N 3.44Å; D67-C91 VanDerWaalsContact OD1-N 3.09Å; D67-H133 IonicContact OD2-CD2 2.6Å; D67-H133 IonicContact OD2-NE2 3.85Å; D67-L137 HydrophobicContact CB-CD2 3.8Å
68	V	94.7	Very high	92.8	Very high	64 Å²	64	52.5 Å²	52.5	39%	0.388	32%	0.321	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.9	133	177.2	-177.2	0	0	0	0	108.7	L59 V60 T88 F89	L59-V68 HydrophobicContact CD1-CG1 4Å; V60-V68 WeakPolarHBondContact O-CA 3.48Å; V68-T88 CarbonylContact O-C 3.54Å; V68-T88 VanDerWaalsContact O-CA 3.26Å; V68-T88 WeakPolarHBondContact O-CA 3.26Å; V68-T88 PolarHBondContact O-OG1 3.29Å; V68-F89 PolarHBondContact N-O 3.18Å; V68-F89 PolarHBondContact O-N 2.81Å
69	M	95.4	Very high	92.4	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	33%	0.332	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.9	127.8	179.8	-178.3	176.8	176.3	0	0	110.3	V60 L71 F86 S98 L137 A138 A141	V60-M69 HydrophobicContact CG2-CB 4.1Å; V60-M69 PolarHBondContact N-O 3.14Å; V60-M69 PolarHBondContact O-N 2.79Å; M69-L71 HydrophobicContact CE-CB 4.18Å; M69-L71 HydrophobicContact CE-CD1 4.24Å; M69-F86 HydrophobicContact CE-CB 4.3Å; M69-S98 PolarHBondContact SD-OG 3.02Å; M69-L137 HydrophobicContact CB-CD1 4.41Å; M69-L137 HydrophobicContact CB-CD2 3.84Å; M69-L137 HydrophobicContact CB-CG 3.94Å; M69-A138 HydrophobicContact SD-CB 4.46Å; M69-A141 HydrophobicContact CE-CB 3.92Å; M69-A141 HydrophobicContact CG-CB 4.09Å; M69-A141 HydrophobicContact SD-CB 3.65Å
70	K	96.2	Very high	92.4	Very high	66 Å²	66	51.7 Å²	51.7	29%	0.287	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	114.9	166.6	-173.5	179.6	-179.7	-179.3	0	108.6	T57 G58 L59 Q72 F86 K87	T57-K70 HydrophobicContact CG2-CG 4.33Å; G58-K70 CarbonylContact O-C 3.49Å; G58-K70 WeakPolarHBondContact O-CA 3.49Å; L59-K70 HydrophobicContact CD1-CB 3.95Å; L59-K70 HydrophobicContact CD1-CG 4.43Å; K70-Q72 HydrophobicContact CG-CG 4.48Å; K70-F86 CarbonylContact O-C 3.56Å; K70-F86 VanDerWaalsContact O-CA 3.31Å; K70-F86 WeakPolarHBondContact O-CA 3.31Å; K70-K87 PolarHBondContact N-O 2.93Å; K70-K87 PolarHBondContact O-N 2.93Å
71	L	96.9	Very high	92.4	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.5	133.9	173.2	-177.5	65.5	0	0	0	109.3	T57 G58 M69 I73 F86 T102 A141 I142 A145	T57-L71 WeakPolarHBondContact CA-O 3.46Å; G58-L71 PolarHBondContact N-O 3.31Å; G58-L71 PolarHBondContact O-N 3.4Å; M69-L71 HydrophobicContact CE-CB 4.18Å; M69-L71 HydrophobicContact CE-CD1 4.24Å; L71-I73 HydrophobicContact CD2-CG2 4.44Å; L71-I73 HydrophobicContact CG-CG2 4.31Å; L71-F86 HydrophobicContact CD1-CB 4.14Å; L71-T102 HydrophobicContact CD1-CG2 3.45Å; L71-T102 VanDerWaalsContact CD1-CG2 3.45Å; L71-A141 HydrophobicContact CB-CB 3.94Å; L71-A141 HydrophobicContact CD2-CB 4.17Å; L71-I142 HydrophobicContact CD2-CB 4.3Å; L71-I142 HydrophobicContact CD2-CG1 3.71Å; L71-A145 HydrophobicContact CD2-CB 4.27Å; L71-A145 HydrophobicContact CG-CB 4.38Å
72	Q	96.9	Very high	92.5	Very high	3 Å²	3	51.5 Å²	51.5	1%	0.014	31%	0.309	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	131.7	173.2	-60.9	-176.3	-77.8	0	0	108.8	S47 L48 V55 G56 T57 K70 A84 R85	S47-Q72 VanDerWaalsContact CA-OE1 3.23Å; S47-Q72 VanDerWaalsContact CB-OE1 3.25Å; L48-Q72 HydrophobicContact CB-CB 4.21Å; L48-Q72 HydrophobicContact CD1-CB 4.04Å; L48-Q72 HydrophobicContact CG-CB 4.37Å; L48-Q72 PolarHBondContact O-NE2 3.26Å; L48-Q72 VanDerWaalsContact O-NE2 3.15Å; L48-Q72 PolarHBondContact O-OE1 2.8Å; V55-Q72 HydrophobicContact CG1-CB 4.31Å; G56-Q72 CarbonylContact O-C 3.53Å; G56-Q72 VanDerWaalsContact O-CA 3.26Å; G56-Q72 WeakPolarHBondContact O-CA 3.43Å; T57-Q72 HydrophobicContact CG2-CG 4.12Å; T57-Q72 PolarHBondContact OG1-NE2 3.21Å; K70-Q72 HydrophobicContact CG-CG 4.48Å; Q72-A84 CarbonylContact O-C 3.49Å; Q72-A84 WeakPolarHBondContact O-CA 3.42Å; Q72-R85 PolarHBondContact N-O 3.43Å; Q72-R85 PolarHBondContact O-N 3.31Å
73	I	96.8	Very high	92.8	Very high	2 Å²	2	51.4 Å²	51.4	1%	0.01	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.2	139.5	177.9	61.7	179	0	0	0	108.7	V55 G56 L71 I81 A84 V105 A145 L146	V55-I73 CarbonylContact C-O 3.55Å; V55-I73 WeakPolarHBondContact CA-O 3.13Å; G56-I73 PolarHBondContact N-O 3.11Å; G56-I73 PolarHBondContact O-N 3.26Å; L71-I73 HydrophobicContact CD2-CG2 4.44Å; L71-I73 HydrophobicContact CG-CG2 4.31Å; I73-I81 HydrophobicContact CB-CG2 4.11Å; I73-I81 HydrophobicContact CD1-CD1 4.42Å; I73-I81 HydrophobicContact CG2-CG2 4.42Å; I73-A84 HydrophobicContact CG2-CB 4.28Å; I73-V105 HydrophobicContact CG2-CG1 4.11Å; I73-A145 HydrophobicContact CD1-CB 4.03Å; I73-A145 HydrophobicContact CG1-CB 4.11Å; I73-A145 HydrophobicContact CG2-CB 4.41Å; I73-L146 HydrophobicContact CD1-CD2 3.52Å; I73-L146 HydrophobicContact CD1-CG 4.06Å
74	E	96	Very high	93.3	Very high	63 Å²	63	45.2 Å²	45.2	29%	0.294	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.3	129.7	172	-173.4	173.8	-167.8	0	0	108.9	L48 K54 V55 I81 V82 D83	L48-E74 HydrophobicContact CD1-CB 4Å; K54-E74 WeakPolarHBondContact O-CA 3.39Å; V55-E74 HydrophobicContact CG2-CB 4.19Å; V55-E74 HydrophobicContact CG2-CG 4.16Å; E74-I81 CarbonylContact O-C 3.58Å; E74-I81 WeakPolarHBondContact O-CA 3.41Å; E74-V82 HydrophobicContact CB-CG2 3.88Å; E74-V82 HydrophobicContact CG-CG2 3.63Å; E74-V82 WeakPolarHBondContact O-CG2 3.5Å; E74-V82 PolarHBondContact O-N 3.03Å; E74-D83 HydrophobicContact CB-CB 4.43Å; E74-D83 PolarHBondContact N-O 3.47Å
75	V	95.4	Very high	93.8	Very high	0 Å²	0	44.2 Å²	44.2	0%	0	24%	0.24	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	136.8	-175.8	-169.4	0	0	0	0	109.2	K54 K80 I81 L110 Y149	K54-V75 WeakPolarHBondContact CB-O 3.32Å; K54-V75 PolarHBondContact O-N 3.38Å; V75-K80 CarbonylContact C-O 3.57Å; V75-K80 WeakPolarHBondContact CA-O 3.5Å; V75-I81 HydrophobicContact CG2-CG1 4.4Å; V75-L110 HydrophobicContact CG1-CD2 4.23Å; V75-L110 HydrophobicContact CG2-CD2 3.94Å; V75-Y149 HydrophobicContact CB-CD2 4.29Å; V75-Y149 HydrophobicContact CB-CE1 4.15Å; V75-Y149 HydrophobicContact CB-CE2 3.66Å; V75-Y149 HydrophobicContact CG1-CE1 4.06Å; V75-Y149 HydrophobicContact CG1-CE2 4.38Å; V75-Y149 HydrophobicContact CG2-CD1 4.13Å; V75-Y149 HydrophobicContact CG2-CD2 3.85Å; V75-Y149 HydrophobicContact CG2-CE1 4.04Å; V75-Y149 HydrophobicContact CG2-CE2 3.74Å; V75-Y149 HydrophobicContact CG2-CG 4.04Å
76	D	93.6	Very high	94.4	Very high	35 Å²	35	41.2 Å²	41.2	19%	0.187	22%	0.219	C	C	.	.			trans	-79.5	176.2	172.9	66.9	18.5	0	0	0	112.8	Q78 G79 K80 V82	D76-Q78 PolarHBondContact O-N 3.19Å; D76-Q78 VanDerWaalsContact OD1-C 3.23Å; D76-Q78 VanDerWaalsContact OD1-CA 3.27Å; D76-Q78 WeakPolarHBondContact OD1-CA 3.04Å; D76-Q78 WeakPolarHBondContact OD1-CB 3.49Å; D76-Q78 PolarHBondContact OD1-N 2.67Å; D76-G79 PolarHBondContact O-N 3.5Å; D76-G79 VanDerWaalsContact O-N 3.14Å; D76-G79 PolarHBondContact OD1-N 3.2Å; D76-K80 PolarHBondContact N-O 3.23Å; D76-K80 PolarHBondContact OD1-N 2.75Å; D76-V82 HydrophobicContact CB-CG1 3.68Å
77	D	88.6	Confident	94.7	Very high	139 Å²	139	44.2 Å²	44.2	74%	0.743	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-69.7	-11.1	177.9	-55.5	-45.7	0	0	0	112.8	K54	K54-D77 VanDerWaalsContact CE-OD1 3.27Å; K54-D77 WeakPolarHBondContact CE-OD1 3.05Å; K54-D77 IonicContact NZ-OD1 2.61Å; K54-D77 PolarHBondContact NZ-OD1 3.07Å; K54-D77 IonicContact NZ-OD2 3.23Å; K54-D77 PolarHBondContact NZ-OD2 3.01Å
78	Q	87.7	Confident	94.8	Very high	165 Å²	165	45.3 Å²	45.3	77%	0.771	23%	0.228	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.1	-1.7	176	-52.3	-168.2	-63.9	0	0	112.4	D76	D76-Q78 PolarHBondContact O-N 3.19Å; D76-Q78 VanDerWaalsContact OD1-C 3.23Å; D76-Q78 VanDerWaalsContact OD1-CA 3.27Å; D76-Q78 WeakPolarHBondContact OD1-CA 3.04Å; D76-Q78 WeakPolarHBondContact OD1-CB 3.49Å; D76-Q78 PolarHBondContact OD1-N 2.67Å
79	G	87.8	Confident	94.7	Very high	23 Å²	23	49.9 Å²	49.9	24%	0.237	24%	0.243	C	C	.	.	S	Bend	trans	80.3	19	-179.2	0	0	0	0	0	114.6	D76	D76-G79 PolarHBondContact O-N 3.5Å; D76-G79 VanDerWaalsContact O-N 3.14Å; D76-G79 PolarHBondContact OD1-N 3.2Å
80	K	95.1	Very high	94.4	Very high	86 Å²	86	51.2 Å²	51.2	37%	0.374	26%	0.256	S	S	.	.	B	Isolated β-bridge	trans	-101.5	146.4	174.3	-75.1	175.4	174.2	-74.4	0	111.4	V75 D76 V82 T109	V75-K80 CarbonylContact C-O 3.57Å; V75-K80 WeakPolarHBondContact CA-O 3.5Å; D76-K80 PolarHBondContact N-O 3.23Å; D76-K80 PolarHBondContact OD1-N 2.75Å; K80-V82 PolarHBondContact O-N 3.15Å; K80-T109 HydrophobicContact CG-CG2 4.06Å
81	I	95.9	Very high	94.2	Very high	1 Å²	1	50.4 Å²	50.4	1%	0.005	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.6	109.2	179.9	-57.5	170.3	0	0	0	109	I73 E74 V75 D83 V105 G107 K108 L110 A113 L146	I73-I81 HydrophobicContact CB-CG2 4.11Å; I73-I81 HydrophobicContact CD1-CD1 4.42Å; I73-I81 HydrophobicContact CG2-CG2 4.42Å; E74-I81 CarbonylContact O-C 3.58Å; E74-I81 WeakPolarHBondContact O-CA 3.41Å; V75-I81 HydrophobicContact CG2-CG1 4.4Å; I81-D83 WeakPolarHBondContact CG2-O 3.37Å; I81-V105 HydrophobicContact CD1-CG1 3.35Å; I81-V105 HydrophobicContact CG1-CG1 4.49Å; I81-V105 HydrophobicContact CG2-CG1 4.11Å; I81-G107 WeakPolarHBondContact O-CA 3.32Å; I81-G107 PolarHBondContact O-N 3.37Å; I81-K108 PolarHBondContact N-O 3.42Å; I81-L110 HydrophobicContact CG1-CD2 4.35Å; I81-A113 HydrophobicContact CD1-CB 3.79Å; I81-L146 HydrophobicContact CD1-CD2 4.29Å
82	V	95.8	Very high	94	Very high	66 Å²	66	51.4 Å²	51.4	40%	0.4	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84	-37.8	-176.9	-69.7	0	0	0	0	112.7	E74 D76 K80 K106	E74-V82 HydrophobicContact CB-CG2 3.88Å; E74-V82 HydrophobicContact CG-CG2 3.63Å; E74-V82 WeakPolarHBondContact O-CG2 3.5Å; E74-V82 PolarHBondContact O-N 3.03Å; D76-V82 HydrophobicContact CB-CG1 3.68Å; K80-V82 PolarHBondContact O-N 3.15Å; V82-K106 VanDerWaalsContact O-CE 3.25Å; V82-K106 WeakPolarHBondContact O-CE 3.14Å
83	D	95.7	Very high	93.7	Very high	19 Å²	19	51.3 Å²	51.3	10%	0.102	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.4	149.2	173.4	-152.2	25.3	0	0	0	110.9	E74 I81 R85 K106	E74-D83 HydrophobicContact CB-CB 4.43Å; E74-D83 PolarHBondContact N-O 3.47Å; I81-D83 WeakPolarHBondContact CG2-O 3.37Å; D83-R85 IonicContact OD1-NE 2.93Å; D83-R85 IonicContact OD1-NH2 3.86Å; D83-R85 IonicContact OD2-CZ 3.38Å; D83-R85 IonicContact OD2-NE 3.4Å; D83-R85 PolarHBondContact OD2-NE 3.42Å; D83-R85 IonicContact OD2-NH2 3.05Å; D83-R85 PolarHBondContact OD2-NH2 3.26Å; D83-K106 IonicContact OD1-NZ 2.8Å; D83-K106 PolarHBondContact OD1-NZ 3.05Å
84	A	96.5	Very high	93.6	Very high	0 Å²	0	51.2 Å²	51.2	0%	0	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-134	132.9	173.5	0	0	0	0	0	107	N44 Q72 I73 T102	N44-A84 VanDerWaalsContact CB-O 3.32Å; N44-A84 WeakPolarHBondContact CB-O 3.22Å; N44-A84 PolarHBondContact ND2-O 2.88Å; Q72-A84 CarbonylContact O-C 3.49Å; Q72-A84 WeakPolarHBondContact O-CA 3.42Å; I73-A84 HydrophobicContact CG2-CB 4.28Å; A84-T102 HydrophobicContact CB-CG2 4.15Å
85	R	97	Very high	93.5	Very high	79 Å²	79	50 Å²	50	30%	0.298	26%	0.263	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.3	142.2	178.9	-63	-64.2	175.5	164	-4.1	110.4	N44 L48 Q72 D83	N44-R85 VanDerWaalsContact O-CA 3.26Å; N44-R85 WeakPolarHBondContact O-CA 3.32Å; N44-R85 VanDerWaalsContact O-CD 3.3Å; N44-R85 WeakPolarHBondContact O-CD 3.08Å; L48-R85 HydrophobicContact CD1-CB 4.38Å; L48-R85 HydrophobicContact CD1-CG 4.16Å; L48-R85 HydrophobicContact CD2-CG 3.86Å; L48-R85 HydrophobicContact CG-CB 4.07Å; L48-R85 HydrophobicContact CG-CG 3.72Å; Q72-R85 PolarHBondContact N-O 3.43Å; Q72-R85 PolarHBondContact O-N 3.31Å; D83-R85 IonicContact OD1-NE 2.93Å; D83-R85 IonicContact OD1-NH2 3.86Å; D83-R85 IonicContact OD2-CZ 3.38Å; D83-R85 IonicContact OD2-NE 3.4Å; D83-R85 PolarHBondContact OD2-NE 3.42Å; D83-R85 IonicContact OD2-NH2 3.05Å; D83-R85 PolarHBondContact OD2-NH2 3.26Å
86	F	97.3	Very high	93.6	Very high	5 Å²	5	50 Å²	50	2%	0.022	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	153.8	176.5	81.9	-89.2	0	0	0	113	P42 R43 N44 V45 G46 M69 K70 L71 T88 S98 S99 T102	P42-F86 HydrophobicContact CB-CZ 4.12Å; R43-F86 WeakPolarHBondContact O-CE1 3.32Å; N44-F86 PolarHBondContact O-N 2.94Å; N44-F86 VanDerWaalsContact O-N 3.12Å; V45-F86 HydrophobicContact CG2-CE1 3.99Å; V45-F86 HydrophobicContact CG2-CE2 4.44Å; V45-F86 HydrophobicContact CG2-CZ 3.8Å; G46-F86 PolarHBondContact N-O 2.89Å; G46-F86 VanDerWaalsContact N-O 3.1Å; G46-F86 CarbonylContact O-C 3.48Å; M69-F86 HydrophobicContact CE-CB 4.3Å; K70-F86 CarbonylContact O-C 3.56Å; K70-F86 VanDerWaalsContact O-CA 3.31Å; K70-F86 WeakPolarHBondContact O-CA 3.31Å; L71-F86 HydrophobicContact CD1-CB 4.14Å; F86-T88 HydrophobicContact CD2-CG2 3.93Å; F86-T88 HydrophobicContact CE2-CG2 3.64Å; F86-S98 VanDerWaalsContact CD2-CB 3.49Å; F86-S99 VanDerWaalsContact CE1-CA 3.48Å; F86-T102 HydrophobicContact CB-CG2 3.94Å; F86-T102 HydrophobicContact CD1-CG2 3.71Å; F86-T102 HydrophobicContact CG-CG2 4.26Å
87	K	95.8	Very high	93.6	Very high	105 Å²	105	48.4 Å²	48.4	46%	0.457	25%	0.254	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.5	160.6	-62.8	-173.7	-179.6	173.5	0	107.4	G46 S47 K70	G46-K87 WeakPolarHBondContact O-CE 3.34Å; G46-K87 VanDerWaalsContact O-CG 3.26Å; G46-K87 WeakPolarHBondContact O-CG 3.46Å; S47-K87 WeakPolarHBondContact OG-CE 3.26Å; S47-K87 PolarHBondContact OG-NZ 3.01Å; K70-K87 PolarHBondContact N-O 2.93Å; K70-K87 PolarHBondContact O-N 2.93Å
88	T	94.8	Very high	94	Very high	31 Å²	31	41.8 Å²	41.8	19%	0.19	22%	0.219	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	146.6	177.1	-170.6	0	0	0	0	110.1	V68 F86 I95	V68-T88 CarbonylContact O-C 3.54Å; V68-T88 VanDerWaalsContact O-CA 3.26Å; V68-T88 WeakPolarHBondContact O-CA 3.26Å; V68-T88 PolarHBondContact O-OG1 3.29Å; F86-T88 HydrophobicContact CD2-CG2 3.93Å; F86-T88 HydrophobicContact CE2-CG2 3.64Å; T88-I95 HydrophobicContact CG2-CB 4.26Å; T88-I95 HydrophobicContact CG2-CG1 3.63Å
89	F	93.3	Very high	94.4	Very high	160 Å²	160	34 Å²	34	70%	0.702	18%	0.182	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-116.9	123.7	167.4	-179.7	-95.6	0	0	0	106.7	D67 V68	D67-F89 CarbonylContact C-O 3.54Å; D67-F89 WeakPolarHBondContact CA-O 3.33Å; V68-F89 PolarHBondContact N-O 3.18Å; V68-F89 PolarHBondContact O-N 2.81Å
90	G	89.9	Confident	94.8	Very high	27 Å²	27	33.1 Å²	33.1	28%	0.278	17%	0.172	S	C	.	.	S	Bend	trans	165.4	-169	-178	0	0	0	0	0	113.2	D67	D67-G90 WeakPolarHBondContact OD1-CA 3.36Å
91	C	92	Very high	94.8	Very high	49 Å²	49	29 Å²	29	33%	0.331	16%	0.155	S	C	.	.			trans	-66.9	161	177.8	72	0	0	0	0	112.4	D67 S93 A94 I95 C134	D67-C91 PolarHBondContact OD1-N 3.44Å; D67-C91 VanDerWaalsContact OD1-N 3.09Å; C91-S93 PolarHBondContact O-N 2.81Å; C91-A94 WeakPolarHBondContact O-CA 3.5Å; C91-A94 WeakPolarHBondContact O-CB 3.3Å; C91-A94 PolarHBondContact O-N 2.87Å; C91-I95 PolarHBondContact O-N 3.36Å; C91-C134 PolarHBondContact SG-SG 3.01Å
92	G	91.3	Very high	94.9	Very high	22 Å²	22	29 Å²	29	23%	0.227	15%	0.154	C	C	.	.	H	α-helix	trans	-57.2	-27.9	-180	0	0	0	0	0	114	Y39 I95 A96	Y39-G92 VanDerWaalsContact CD2-CA 3.47Å; G92-I95 PolarHBondContact O-N 3.21Å; G92-A96 WeakPolarHBondContact O-CB 3.04Å; G92-A96 PolarHBondContact O-N 3.28Å
93	S	91.9	Very high	94.9	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-71.2	-32.6	174	-59.3	0	0	0	0	113.1	C91 S97 K131	C91-S93 PolarHBondContact O-N 2.81Å; S93-S97 VanDerWaalsContact O-CB 3.31Å; S93-S97 WeakPolarHBondContact O-CB 3.37Å; S93-S97 PolarHBondContact O-N 3.22Å; S93-S97 PolarHBondContact O-OG 2.77Å; S93-K131 WeakPolarHBondContact OG-CD 3.35Å
94	A	94	Very high	94.9	Very high	0 Å²	0	31.8 Å²	31.8	0%	0	16%	0.159	C	C	.	.	H	α-helix	trans	-68.1	-42.4	173.3	0	0	0	0	0	111.1	C91 S97 S98 C134	C91-A94 WeakPolarHBondContact O-CA 3.5Å; C91-A94 WeakPolarHBondContact O-CB 3.3Å; C91-A94 PolarHBondContact O-N 2.87Å; A94-S97 PolarHBondContact O-N 2.81Å; A94-S98 WeakPolarHBondContact O-CB 3.42Å; A94-S98 PolarHBondContact O-N 2.84Å; A94-S98 PolarHBondContact O-OG 2.95Å; A94-C134 HydrophobicContact CB-CB 4.35Å
95	I	95.3	Very high	94.8	Very high	39 Å²	39	31.8 Å²	31.8	20%	0.2	16%	0.16	C	C	.	.	H	α-helix	trans	-60.6	-47.7	174.5	-64.3	164.2	0	0	0	110.8	Y39 P42 T88 C91 G92 S97 S98 S99	Y39-I95 HydrophobicContact CD2-CB 4.24Å; Y39-I95 HydrophobicContact CD2-CD1 4.11Å; Y39-I95 HydrophobicContact CD2-CG2 4.31Å; Y39-I95 HydrophobicContact CE2-CD1 3.85Å; P42-I95 HydrophobicContact CB-CG2 4.15Å; T88-I95 HydrophobicContact CG2-CB 4.26Å; T88-I95 HydrophobicContact CG2-CG1 3.63Å; C91-I95 PolarHBondContact O-N 3.36Å; G92-I95 PolarHBondContact O-N 3.21Å; I95-S97 PolarHBondContact O-N 2.96Å; I95-S98 PolarHBondContact O-N 3.42Å; I95-S99 PolarHBondContact O-N 3.44Å
96	A	95.8	Very high	94.7	Very high	0 Å²	0	32.5 Å²	32.5	0%	0	17%	0.165	C	C	.	.	H	α-helix	trans	-62.2	-43	178.5	0	0	0	0	0	112.5	V35 H38 G92 S98 S99 L100 L125	V35-A96 HydrophobicContact CB-CB 4.4Å; V35-A96 HydrophobicContact CG1-CB 3.85Å; H38-A96 HydrophobicContact CB-CB 3.85Å; G92-A96 WeakPolarHBondContact O-CB 3.04Å; G92-A96 PolarHBondContact O-N 3.28Å; A96-S98 VanDerWaalsContact C-N 3.34Å; A96-S98 PolarHBondContact O-N 3.07Å; A96-S99 PolarHBondContact O-N 3.37Å; A96-L100 PolarHBondContact O-N 2.99Å; A96-L125 HydrophobicContact CB-CD1 4.44Å
97	S	95.3	Very high	94.6	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-64.6	-39.6	177.8	-56.3	0	0	0	0	111.6	S93 A94 I95 A101	S93-S97 VanDerWaalsContact O-CB 3.31Å; S93-S97 WeakPolarHBondContact O-CB 3.37Å; S93-S97 PolarHBondContact O-N 3.22Å; S93-S97 PolarHBondContact O-OG 2.77Å; A94-S97 PolarHBondContact O-N 2.81Å; I95-S97 PolarHBondContact O-N 2.96Å; S97-A101 WeakPolarHBondContact O-CB 3.03Å; S97-A101 PolarHBondContact O-N 3.4Å
98	S	95.7	Very high	94.6	Very high	1 Å²	1	32.6 Å²	32.6	1%	0.007	18%	0.179	C	C	.	.	H	α-helix	trans	-65.1	-44	177	-58.3	0	0	0	0	111.8	M69 F86 A94 I95 A96 A101 T102	M69-S98 PolarHBondContact SD-OG 3.02Å; F86-S98 VanDerWaalsContact CD2-CB 3.49Å; A94-S98 WeakPolarHBondContact O-CB 3.42Å; A94-S98 PolarHBondContact O-N 2.84Å; A94-S98 PolarHBondContact O-OG 2.95Å; I95-S98 PolarHBondContact O-N 3.42Å; A96-S98 VanDerWaalsContact C-N 3.34Å; A96-S98 PolarHBondContact O-N 3.07Å; S98-A101 PolarHBondContact O-N 3.36Å; S98-T102 PolarHBondContact O-N 3.2Å; S98-T102 PolarHBondContact O-OG1 3.27Å
99	S	96.6	Very high	94.6	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.181	C	C	.	.	H	α-helix	trans	-62.6	-46.5	177.6	176	0	0	0	0	112.1	H38 R43 F86 I95 A96 T102 E103	H38-S99 PolarHBondContact ND1-OG 3.2Å; R43-S99 WeakPolarHBondContact CD-OG 3.39Å; R43-S99 PolarHBondContact N-OG 2.92Å; F86-S99 VanDerWaalsContact CE1-CA 3.48Å; I95-S99 PolarHBondContact O-N 3.44Å; A96-S99 PolarHBondContact O-N 3.37Å; S99-T102 PolarHBondContact O-N 3.43Å; S99-T102 PolarHBondContact O-OG1 3.05Å; S99-E103 PolarHBondContact O-N 3.31Å
100	L	96.3	Very high	94.6	Very high	5 Å²	5	26.6 Å²	26.6	3%	0.026	15%	0.154	C	C	.	.	H	α-helix	trans	-64.1	-43.1	178.3	-177.7	66.4	0	0	0	111.3	A96 T102 E103 W104 I121 E124 L125	A96-L100 PolarHBondContact O-N 2.99Å; L100-T102 VanDerWaalsContact C-N 3.33Å; L100-T102 PolarHBondContact O-N 2.94Å; L100-E103 PolarHBondContact O-N 2.84Å; L100-W104 HydrophobicContact CD1-CZ2 4.37Å; L100-W104 HydrophobicContact CD2-CZ2 4.16Å; L100-W104 HydrophobicContact CG-CD2 4.4Å; L100-W104 HydrophobicContact CG-CZ2 4.37Å; L100-W104 PolarHBondContact O-N 2.97Å; L100-I121 HydrophobicContact CD2-CG2 4.35Å; L100-E124 HydrophobicContact CD1-CG 4.4Å; L100-E124 HydrophobicContact CD2-CB 3.97Å; L100-E124 HydrophobicContact CD2-CG 3.68Å; L100-L125 HydrophobicContact CD2-CD1 4.1Å; L100-L125 HydrophobicContact CD2-CD2 3.93Å; L100-L125 HydrophobicContact CD2-CG 3.66Å
101	A	95.6	Very high	94.8	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-58.2	-44	178.2	0	0	0	0	0	112	S97 S98 E103 W104 V105 I121 A138 I142	S97-A101 WeakPolarHBondContact O-CB 3.03Å; S97-A101 PolarHBondContact O-N 3.4Å; S98-A101 PolarHBondContact O-N 3.36Å; A101-E103 VanDerWaalsContact C-N 3.34Å; A101-E103 PolarHBondContact O-N 3.39Å; A101-W104 PolarHBondContact O-N 3.48Å; A101-V105 WeakPolarHBondContact O-CB 3.35Å; A101-V105 WeakPolarHBondContact O-CG2 3.26Å; A101-V105 PolarHBondContact O-N 3.39Å; A101-I121 HydrophobicContact CB-CD1 4.35Å; A101-A138 HydrophobicContact CB-CB 4.02Å; A101-I142 HydrophobicContact CB-CD1 4.22Å
102	T	96.3	Very high	94.9	Very high	0 Å²	0	32 Å²	32	0%	0	17%	0.171	C	C	.	.	H	α-helix	trans	-65.1	-35	177.9	44.9	0	0	0	0	113.9	N44 L71 A84 F86 S98 S99 L100 K106	N44-T102 HydrophobicContact CB-CG2 4.41Å; L71-T102 HydrophobicContact CD1-CG2 3.45Å; L71-T102 VanDerWaalsContact CD1-CG2 3.45Å; A84-T102 HydrophobicContact CB-CG2 4.15Å; F86-T102 HydrophobicContact CB-CG2 3.94Å; F86-T102 HydrophobicContact CD1-CG2 3.71Å; F86-T102 HydrophobicContact CG-CG2 4.26Å; S98-T102 PolarHBondContact O-N 3.2Å; S98-T102 PolarHBondContact O-OG1 3.27Å; S99-T102 PolarHBondContact O-N 3.43Å; S99-T102 PolarHBondContact O-OG1 3.05Å; L100-T102 VanDerWaalsContact C-N 3.33Å; L100-T102 PolarHBondContact O-N 2.94Å; T102-K106 WeakPolarHBondContact O-CB 3.21Å; T102-K106 PolarHBondContact O-N 3.5Å
103	E	96.1	Very high	95	Very high	72 Å²	72	31 Å²	31	34%	0.336	16%	0.16	S	C	.	.	H	α-helix	trans	-66.9	-41.4	174.9	-71.9	-174.2	158.9	0	0	111.2	H38 R43 S99 L100 A101 K106	H38-E103 IonicContact CE1-OE2 3.23Å; H38-E103 PolarHBondContact CE1-OE2 3.29Å; R43-E103 HydrophobicContact CB-CG 4.12Å; R43-E103 WeakPolarHBondContact CB-OE1 3.46Å; R43-E103 WeakPolarHBondContact CD-OE1 3.34Å; R43-E103 WeakPolarHBondContact CG-OE1 3.39Å; R43-E103 IonicContact NE-OE1 3.5Å; R43-E103 PolarHBondContact NE-OE1 3.14Å; R43-E103 VanDerWaalsContact NE-OE1 3.15Å; S99-E103 PolarHBondContact O-N 3.31Å; L100-E103 PolarHBondContact O-N 2.84Å; A101-E103 VanDerWaalsContact C-N 3.34Å; A101-E103 PolarHBondContact O-N 3.39Å; E103-K106 PolarHBondContact O-N 3.12Å
104	W	95.4	Very high	95.1	Very high	72 Å²	72	34.6 Å²	34.6	27%	0.273	18%	0.179	S	C	.	.	H	α-helix	trans	-69.7	-33.8	-179	-76.4	13.2	0	0	0	113.4	L100 A101 K108 I116 D120 I121 E124	L100-W104 HydrophobicContact CD1-CZ2 4.37Å; L100-W104 HydrophobicContact CD2-CZ2 4.16Å; L100-W104 HydrophobicContact CG-CD2 4.4Å; L100-W104 HydrophobicContact CG-CZ2 4.37Å; L100-W104 PolarHBondContact O-N 2.97Å; A101-W104 PolarHBondContact O-N 3.48Å; W104-K108 WeakPolarHBondContact O-CD 3.34Å; W104-K108 WeakPolarHBondContact O-CE 3.22Å; W104-K108 WeakPolarHBondContact O-CG 3.35Å; W104-I116 HydrophobicContact CB-CD1 4.06Å; W104-I116 HydrophobicContact CE3-CG2 4Å; W104-I116 HydrophobicContact CZ3-CG2 4.43Å; W104-D120 HydrophobicContact CH2-CB 4.23Å; W104-D120 HydrophobicContact CZ3-CB 3.99Å; W104-I121 HydrophobicContact CE3-CG1 4.17Å; W104-I121 HydrophobicContact CZ3-CG1 3.88Å; W104-E124 HydrophobicContact CH2-CB 3.95Å; W104-E124 HydrophobicContact CH2-CG 4.31Å; W104-E124 HydrophobicContact CZ2-CB 3.9Å; W104-E124 HydrophobicContact CZ2-CG 3.73Å
105	V	95.9	Very high	95.2	Very high	1 Å²	1	41.6 Å²	41.6	1%	0.006	21%	0.212	C	C	.	.	H	α-helix	trans	-76.4	-28.2	-179.2	172.2	0	0	0	0	111.2	I73 I81 A101 G107 K108 A113 I116 I142	I73-V105 HydrophobicContact CG2-CG1 4.11Å; I81-V105 HydrophobicContact CD1-CG1 3.35Å; I81-V105 HydrophobicContact CG1-CG1 4.49Å; I81-V105 HydrophobicContact CG2-CG1 4.11Å; A101-V105 WeakPolarHBondContact O-CB 3.35Å; A101-V105 WeakPolarHBondContact O-CG2 3.26Å; A101-V105 PolarHBondContact O-N 3.39Å; V105-G107 PolarHBondContact O-N 3.4Å; V105-K108 PolarHBondContact O-N 2.96Å; V105-A113 HydrophobicContact CG1-CB 4.38Å; V105-I116 HydrophobicContact CG2-CD1 3.7Å; V105-I142 HydrophobicContact CG2-CD1 3.56Å; V105-I142 HydrophobicContact CG2-CG1 3.81Å; V105-I142 HydrophobicContact CG2-CG2 4.32Å
106	K	94.9	Very high	95.1	Very high	93 Å²	93	40.2 Å²	40.2	40%	0.404	20%	0.204	S	C	.	.	T	Hydrogen-bonded Turn	trans	-66.2	130	-179.4	-170.3	167.4	-178.6	152.4	0	111.3	V82 D83 T102 E103 K108	V82-K106 VanDerWaalsContact O-CE 3.25Å; V82-K106 WeakPolarHBondContact O-CE 3.14Å; D83-K106 IonicContact OD1-NZ 2.8Å; D83-K106 PolarHBondContact OD1-NZ 3.05Å; T102-K106 WeakPolarHBondContact O-CB 3.21Å; T102-K106 PolarHBondContact O-N 3.5Å; E103-K106 PolarHBondContact O-N 3.12Å; K106-K108 VanDerWaalsContact C-N 3.26Å; K106-K108 PolarHBondContact O-N 3.39Å
107	G	94.4	Very high	95.1	Very high	47 Å²	47	45.8 Å²	45.8	49%	0.485	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	82.7	-7.3	-179.8	0	0	0	0	0	115.2	I81 V105	I81-G107 WeakPolarHBondContact O-CA 3.32Å; I81-G107 PolarHBondContact O-N 3.37Å; V105-G107 PolarHBondContact O-N 3.4Å
108	K	95.5	Very high	95	Very high	66 Å²	66	47.5 Å²	47.5	29%	0.287	24%	0.238	S	C	.	.			trans	-83.6	158.5	175.9	-70.3	-168	177	-171.5	0	112.1	I81 W104 V105 K106 E112 I116	I81-K108 PolarHBondContact N-O 3.42Å; W104-K108 WeakPolarHBondContact O-CD 3.34Å; W104-K108 WeakPolarHBondContact O-CE 3.22Å; W104-K108 WeakPolarHBondContact O-CG 3.35Å; V105-K108 PolarHBondContact O-N 2.96Å; K106-K108 VanDerWaalsContact C-N 3.26Å; K106-K108 PolarHBondContact O-N 3.39Å; K108-E112 VanDerWaalsContact CA-OE2 3.32Å; K108-E112 WeakPolarHBondContact CA-OE2 3.42Å; K108-E112 HydrophobicContact CB-CB 3.97Å; K108-E112 HydrophobicContact CD-CB 4.06Å; K108-E112 HydrophobicContact CG-CB 4.28Å; K108-I116 HydrophobicContact CD-CD1 4.2Å
109	T	95.8	Very high	94.9	Very high	38 Å²	38	50.4 Å²	50.4	23%	0.233	26%	0.256	C	S	.	.	B	Isolated β-bridge	trans	-76.6	167.3	166.9	67	0	0	0	0	110.9	K80 D111 E112 A113	K80-T109 HydrophobicContact CG-CG2 4.06Å; T109-D111 PolarHBondContact O-N 3.05Å; T109-E112 PolarHBondContact N-OE2 3Å; T109-E112 PolarHBondContact O-N 2.94Å; T109-E112 VanDerWaalsContact OG1-CG 3.26Å; T109-E112 WeakPolarHBondContact OG1-CG 3.28Å; T109-E112 PolarHBondContact OG1-N 3.22Å; T109-A113 WeakPolarHBondContact O-CB 3.35Å; T109-A113 PolarHBondContact O-N 3.37Å
110	L	92.8	Very high	94.8	Very high	27 Å²	27	53.4 Å²	53.4	14%	0.141	27%	0.272	C	S	.	.	H	α-helix	trans	-58.9	-36	177.4	-57.7	175.9	0	0	0	112.7	V75 I81 L114 L146 Y149	V75-L110 HydrophobicContact CG1-CD2 4.23Å; V75-L110 HydrophobicContact CG2-CD2 3.94Å; I81-L110 HydrophobicContact CG1-CD2 4.35Å; L110-L114 PolarHBondContact O-N 3.31Å; L110-L146 HydrophobicContact CB-CD2 4.21Å; L110-L146 HydrophobicContact CD2-CD2 3.42Å; L110-L146 VanDerWaalsContact CD2-CD2 3.42Å; L110-L146 HydrophobicContact CG-CD2 4.41Å; L110-Y149 HydrophobicContact CD1-CD1 3.98Å; L110-Y149 HydrophobicContact CD1-CE1 3.79Å; L110-Y149 HydrophobicContact CD2-CD1 4.17Å; L110-Y149 HydrophobicContact CD2-CE1 4.39Å
111	D	93.2	Very high	94.7	Very high	106 Å²	106	53.1 Å²	53.1	57%	0.567	27%	0.27	S	S	*	.	H	α-helix	trans	-76.2	-42.3	-178.7	-60.7	-38.6	0	0	0	111.2	T109 A113 L114 E115 R150	T109-D111 PolarHBondContact O-N 3.05Å; D111-A113 VanDerWaalsContact C-N 3.27Å; D111-A113 PolarHBondContact O-N 3.39Å; D111-L114 WeakPolarHBondContact O-CB 3.33Å; D111-L114 PolarHBondContact O-N 3.4Å; D111-E115 PolarHBondContact O-N 2.99Å; D111-R150 IonicContact OD1-NH2 3.68Å; D111-R150 PolarHBondContact OD1-NH2 3.07Å
112	E	94.3	Very high	94.6	Very high	84 Å²	84	53.5 Å²	53.5	39%	0.393	27%	0.274	S	S	.	.	H	α-helix	trans	-63.5	-33.3	173.8	-70.3	171.8	166.1	0	0	112.4	K108 T109 L114 E115	K108-E112 VanDerWaalsContact CA-OE2 3.32Å; K108-E112 WeakPolarHBondContact CA-OE2 3.42Å; K108-E112 HydrophobicContact CB-CB 3.97Å; K108-E112 HydrophobicContact CD-CB 4.06Å; K108-E112 HydrophobicContact CG-CB 4.28Å; T109-E112 PolarHBondContact N-OE2 3Å; T109-E112 PolarHBondContact O-N 2.94Å; T109-E112 VanDerWaalsContact OG1-CG 3.26Å; T109-E112 WeakPolarHBondContact OG1-CG 3.28Å; T109-E112 PolarHBondContact OG1-N 3.22Å; E112-L114 VanDerWaalsContact C-N 3.31Å; E112-E115 PolarHBondContact O-N 3.5Å
113	A	94.3	Very high	94.5	Very high	1 Å²	1	60.5 Å²	60.5	1%	0.008	30%	0.304	C	S	.	.	H	α-helix	trans	-68.5	-32.2	174.4	0	0	0	0	0	111.7	I81 V105 T109 D111 E115 I116 I142 L146	I81-A113 HydrophobicContact CD1-CB 3.79Å; V105-A113 HydrophobicContact CG1-CB 4.38Å; T109-A113 WeakPolarHBondContact O-CB 3.35Å; T109-A113 PolarHBondContact O-N 3.37Å; D111-A113 VanDerWaalsContact C-N 3.27Å; D111-A113 PolarHBondContact O-N 3.39Å; A113-E115 VanDerWaalsContact C-N 3.32Å; A113-I116 WeakPolarHBondContact O-CB 3.48Å; A113-I116 PolarHBondContact O-N 3.46Å; A113-I142 HydrophobicContact CB-CG2 4.45Å; A113-L146 HydrophobicContact CB-CD1 4.03Å; A113-L146 HydrophobicContact CB-CD2 4.36Å
114	L	93.8	Very high	94.3	Very high	75 Å²	75	60.4 Å²	60.4	39%	0.393	30%	0.304	S	S	.	.	H	α-helix	trans	-72.3	-26.5	177.6	-161.9	73.7	0	0	0	112.7	L110 D111 E112 I116 K143 L146	L110-L114 PolarHBondContact O-N 3.31Å; D111-L114 WeakPolarHBondContact O-CB 3.33Å; D111-L114 PolarHBondContact O-N 3.4Å; E112-L114 VanDerWaalsContact C-N 3.31Å; L114-I116 PolarHBondContact O-N 2.95Å; L114-K143 HydrophobicContact CD1-CG 4.09Å; L114-L146 HydrophobicContact CB-CD1 4.38Å; L114-L146 HydrophobicContact CD1-CD1 4.07Å
115	E	95.4	Very high	94.1	Very high	147 Å²	147	57 Å²	57	69%	0.687	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-13.9	176.8	-69.4	-173.6	165.4	0	0	113.5	D111 E112 A113 K117	D111-E115 PolarHBondContact O-N 2.99Å; E112-E115 PolarHBondContact O-N 3.5Å; A113-E115 VanDerWaalsContact C-N 3.32Å; E115-K117 PolarHBondContact O-N 3.3Å
116	I	94.2	Very high	93.9	Very high	9 Å²	9	65.6 Å²	65.6	5%	0.046	32%	0.323	C	S	.	.			trans	-67.8	119.4	178.3	-61.2	171.8	0	0	0	109.5	W104 V105 K108 A113 L114 I121 I142	W104-I116 HydrophobicContact CB-CD1 4.06Å; W104-I116 HydrophobicContact CE3-CG2 4Å; W104-I116 HydrophobicContact CZ3-CG2 4.43Å; V105-I116 HydrophobicContact CG2-CD1 3.7Å; K108-I116 HydrophobicContact CD-CD1 4.2Å; A113-I116 WeakPolarHBondContact O-CB 3.48Å; A113-I116 PolarHBondContact O-N 3.46Å; L114-I116 PolarHBondContact O-N 2.95Å; I116-I121 HydrophobicContact CG2-CD1 4.02Å; I116-I121 HydrophobicContact CG2-CG1 4.25Å; I116-I142 HydrophobicContact CB-CD1 4.44Å; I116-I142 HydrophobicContact CD1-CD1 4.43Å; I116-I142 HydrophobicContact CG2-CD1 4.17Å
117	K	94.8	Very high	93.6	Very high	117 Å²	117	62.1 Å²	62.1	51%	0.509	31%	0.308	S	S	.	.			trans	-107.6	150.4	179.8	-64.9	175.6	-174.3	177.9	0	112	E115 T119 D120 I121	E115-K117 PolarHBondContact O-N 3.3Å; K117-T119 PolarHBondContact O-N 3.19Å; K117-T119 VanDerWaalsContact O-N 3.11Å; K117-D120 PolarHBondContact O-N 2.89Å; K117-I121 PolarHBondContact O-N 3.42Å
118	N	93.5	Very high	93.4	Very high	37 Å²	37	62.6 Å²	62.6	20%	0.198	30%	0.303	C	S	.	.	H	α-helix	trans	-53.6	-32.3	172.7	69.4	82.7	0	0	0	112.6	D120 A122 S135 M136 E139	N118-D120 VanDerWaalsContact C-N 3.27Å; N118-D120 PolarHBondContact O-N 3.22Å; N118-A122 VanDerWaalsContact O-CB 3.25Å; N118-A122 WeakPolarHBondContact O-CB 3.3Å; N118-A122 PolarHBondContact O-N 3.14Å; N118-S135 WeakPolarHBondContact CB-O 3.34Å; N118-S135 WeakPolarHBondContact O-CB 3.5Å; N118-S135 PolarHBondContact O-OG 3.39Å; N118-M136 HydrophobicContact CB-CG 4.08Å; N118-E139 HydrophobicContact CB-CB 4.29Å; N118-E139 WeakPolarHBondContact CB-OE2 2.95Å; N118-E139 PolarHBondContact N-OE2 3.37Å; N118-E139 PolarHBondContact ND2-OE2 2.73Å
119	T	93.8	Very high	93	Very high	62 Å²	62	64.5 Å²	64.5	38%	0.38	32%	0.322	S	S	.	.	H	α-helix	trans	-65.6	-33.7	-179.1	52.6	0	0	0	0	111.8	K117 K123	K117-T119 PolarHBondContact O-N 3.19Å; K117-T119 VanDerWaalsContact O-N 3.11Å; T119-K123 WeakPolarHBondContact O-CB 3.34Å; T119-K123 WeakPolarHBondContact O-CD 3.36Å; T119-K123 WeakPolarHBondContact O-CG 3.33Å; T119-K123 PolarHBondContact O-N 3.23Å
120	D	94.8	Very high	92.6	Very high	62 Å²	62	68.5 Å²	68.5	33%	0.332	35%	0.346	S	S	.	.	H	α-helix	trans	-79.5	-40.5	-176.6	-56.6	-34.5	0	0	0	110	W104 K117 N118 A122 K123 E124	W104-D120 HydrophobicContact CH2-CB 4.23Å; W104-D120 HydrophobicContact CZ3-CB 3.99Å; K117-D120 PolarHBondContact O-N 2.89Å; N118-D120 VanDerWaalsContact C-N 3.27Å; N118-D120 PolarHBondContact O-N 3.22Å; D120-A122 PolarHBondContact O-N 3.4Å; D120-K123 PolarHBondContact O-N 2.96Å; D120-K123 IonicContact OD1-NZ 3.36Å; D120-E124 WeakPolarHBondContact O-CB 3.5Å; D120-E124 PolarHBondContact O-N 2.89Å
121	I	94.3	Very high	92.4	Very high	0 Å²	0	69.8 Å²	69.8	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-59	-47.5	170.7	-62.6	171.4	0	0	0	110.4	L100 A101 W104 I116 K117 K123 E124 L125 A138	L100-I121 HydrophobicContact CD2-CG2 4.35Å; A101-I121 HydrophobicContact CB-CD1 4.35Å; W104-I121 HydrophobicContact CE3-CG1 4.17Å; W104-I121 HydrophobicContact CZ3-CG1 3.88Å; I116-I121 HydrophobicContact CG2-CD1 4.02Å; I116-I121 HydrophobicContact CG2-CG1 4.25Å; K117-I121 PolarHBondContact O-N 3.42Å; I121-K123 PolarHBondContact O-N 3.17Å; I121-E124 PolarHBondContact O-N 2.95Å; I121-L125 HydrophobicContact CG2-CD1 4.14Å; I121-L125 WeakPolarHBondContact O-CB 3.21Å; I121-L125 PolarHBondContact O-N 3.48Å; I121-A138 HydrophobicContact CD1-CB 4.08Å
122	A	93.3	Very high	92.3	Very high	8 Å²	8	67.9 Å²	67.9	7%	0.066	34%	0.34	C	S	.	.	H	α-helix	trans	-64.3	-40.5	-179.8	0	0	0	0	0	112.8	N118 D120 R126 L127 L132	N118-A122 VanDerWaalsContact O-CB 3.25Å; N118-A122 WeakPolarHBondContact O-CB 3.3Å; N118-A122 PolarHBondContact O-N 3.14Å; D120-A122 PolarHBondContact O-N 3.4Å; A122-R126 WeakPolarHBondContact O-CA 3.31Å; A122-R126 PolarHBondContact O-N 2.9Å; A122-L127 HydrophobicContact CB-CD1 4.44Å; A122-L127 PolarHBondContact O-N 3.4Å; A122-L132 HydrophobicContact CB-CD2 3.43Å; A122-L132 VanDerWaalsContact CB-CD2 3.43Å
123	K	93.4	Very high	92	Very high	146 Å²	146	66.5 Å²	66.5	64%	0.635	33%	0.334	S	S	*	.	H	α-helix	trans	-65.2	-44	175.7	-76.8	167.7	-171.3	170.8	0	111.3	T119 D120 I121 L125 R126	T119-K123 WeakPolarHBondContact O-CB 3.34Å; T119-K123 WeakPolarHBondContact O-CD 3.36Å; T119-K123 WeakPolarHBondContact O-CG 3.33Å; T119-K123 PolarHBondContact O-N 3.23Å; D120-K123 PolarHBondContact O-N 2.96Å; D120-K123 IonicContact OD1-NZ 3.36Å; I121-K123 PolarHBondContact O-N 3.17Å; K123-L125 PolarHBondContact O-N 3.5Å; K123-R126 WeakPolarHBondContact O-CG 3.41Å; K123-R126 PolarHBondContact O-N 3.09Å; K123-R126 VanDerWaalsContact O-N 3.15Å
124	E	93.3	Very high	91.8	Very high	71 Å²	71	66.5 Å²	66.5	33%	0.332	33%	0.334	S	S	.	.	H	α-helix	trans	-63.7	-44.1	-178.2	-179.9	64.6	-174.5	0	0	111.6	K34 L100 W104 D120 I121 R126	K34-E124 VanDerWaalsContact CD-O 3.31Å; K34-E124 WeakPolarHBondContact CD-O 3.17Å; K34-E124 IonicContact NZ-OE1 3.15Å; K34-E124 PolarHBondContact NZ-OE1 3.45Å; K34-E124 IonicContact NZ-OE2 3.37Å; K34-E124 PolarHBondContact NZ-OE2 3.15Å; L100-E124 HydrophobicContact CD1-CG 4.4Å; L100-E124 HydrophobicContact CD2-CB 3.97Å; L100-E124 HydrophobicContact CD2-CG 3.68Å; W104-E124 HydrophobicContact CH2-CB 3.95Å; W104-E124 HydrophobicContact CH2-CG 4.31Å; W104-E124 HydrophobicContact CZ2-CB 3.9Å; W104-E124 HydrophobicContact CZ2-CG 3.73Å; D120-E124 WeakPolarHBondContact O-CB 3.5Å; D120-E124 PolarHBondContact O-N 2.89Å; I121-E124 PolarHBondContact O-N 2.95Å; E124-R126 VanDerWaalsContact C-N 3.28Å; E124-R126 PolarHBondContact O-N 3.38Å
125	L	91.4	Very high	91.7	Very high	0 Å²	0	63 Å²	63	0%	0	32%	0.315	C	S	.	.	H	α-helix	trans	-79.8	-8.3	176.5	-69.3	178.8	0	0	0	113.6	H32 K34 V35 A96 L100 I121 K123 L127	H32-L125 WeakPolarHBondContact CB-O 3.44Å; K34-L125 HydrophobicContact CB-CD2 4.16Å; V35-L125 HydrophobicContact CG2-CB 3.79Å; V35-L125 HydrophobicContact CG2-CD2 4.04Å; V35-L125 HydrophobicContact CG2-CG 4.36Å; V35-L125 VanDerWaalsContact CG2-O 3.29Å; V35-L125 WeakPolarHBondContact CG2-O 3.48Å; A96-L125 HydrophobicContact CB-CD1 4.44Å; L100-L125 HydrophobicContact CD2-CD1 4.1Å; L100-L125 HydrophobicContact CD2-CD2 3.93Å; L100-L125 HydrophobicContact CD2-CG 3.66Å; I121-L125 HydrophobicContact CG2-CD1 4.14Å; I121-L125 WeakPolarHBondContact O-CB 3.21Å; I121-L125 PolarHBondContact O-N 3.48Å; K123-L125 PolarHBondContact O-N 3.5Å; L125-L127 VanDerWaalsContact C-N 3.29Å; L125-L127 HydrophobicContact CB-CD1 4.46Å; L125-L127 HydrophobicContact CB-CD2 3.98Å; L125-L127 HydrophobicContact CB-CG 3.81Å; L125-L127 HydrophobicContact CD1-CD1 4.48Å; L125-L127 PolarHBondContact O-N 3.05Å
126	R	91.3	Very high	91.7	Very high	182 Å²	182	60.5 Å²	60.5	69%	0.687	31%	0.305	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.3	49.4	-172.8	-56.2	-164.4	-176.7	-149.7	-2.6	112.2	H32 A122 K123 E124	H32-R126 HydrophobicContact CB-CB 4.14Å; A122-R126 WeakPolarHBondContact O-CA 3.31Å; A122-R126 PolarHBondContact O-N 2.9Å; K123-R126 WeakPolarHBondContact O-CG 3.41Å; K123-R126 PolarHBondContact O-N 3.09Å; K123-R126 VanDerWaalsContact O-N 3.15Å; E124-R126 VanDerWaalsContact C-N 3.28Å; E124-R126 PolarHBondContact O-N 3.38Å
127	L	88.5	Confident	91.7	Very high	19 Å²	19	60.4 Å²	60.4	10%	0.099	30%	0.304	C	S	.	.			trans	-68.4	139	-179.6	-63.6	178.3	0	0	0	110.6	V35 A122 L125	V35-L127 HydrophobicContact CG2-CD2 3.86Å; A122-L127 HydrophobicContact CB-CD1 4.44Å; A122-L127 PolarHBondContact O-N 3.4Å; L125-L127 VanDerWaalsContact C-N 3.29Å; L125-L127 HydrophobicContact CB-CD1 4.46Å; L125-L127 HydrophobicContact CB-CD2 3.98Å; L125-L127 HydrophobicContact CB-CG 3.81Å; L125-L127 HydrophobicContact CD1-CD1 4.48Å; L125-L127 PolarHBondContact O-N 3.05Å
128	P	89	Confident	91.7	Very high	57 Å²	57	54.9 Å²	54.9	37%	0.37	28%	0.28	S	S	.	.			trans	-66.6	154.5	170.3	29.6	-34.5	0	0	0	110.2	V130 K131	P128-V130 PolarHBondContact O-N 2.92Å; P128-K131 HydrophobicContact CG-CB 4.28Å; P128-K131 HydrophobicContact CG-CD 4.14Å; P128-K131 HydrophobicContact CG-CG 4.16Å; P128-K131 PolarHBondContact O-N 2.8Å
129	P	87.2	Confident	91.8	Very high	106 Å²	106	54 Å²	54	69%	0.688	28%	0.275	S	S	*	.	G	3₁₀ helix	trans	-57.3	-29.7	-174.2	21.1	-33.1	0	0	0	113.7	K131 L132	P129-K131 PolarHBondContact O-N 2.82Å; P129-L132 HydrophobicContact CB-CD1 4.38Å; P129-L132 WeakPolarHBondContact O-CG 3.29Å; P129-L132 PolarHBondContact O-N 2.61Å
130	V	88.3	Confident	91.9	Very high	123 Å²	123	54.8 Å²	54.8	75%	0.745	28%	0.277	S	S	*	.	G	3₁₀ helix	trans	-65.1	-25.1	178.7	-173.6	0	0	0	0	112.6	P128 H133	P128-V130 PolarHBondContact O-N 2.92Å; V130-H133 PolarHBondContact O-ND1 3.37Å
131	K	88.3	Confident	91.9	Very high	54 Å²	54	51.9 Å²	51.9	24%	0.235	26%	0.261	C	S	.	.	G	3₁₀ helix	trans	-107.1	15.3	-174.9	-62.3	-174.2	-178.2	169.8	0	113.8	Y31 S93 P128 P129 H133 C134	Y31-K131 HydrophobicContact CE1-CD 4.29Å; Y31-K131 PolarHBondContact OH-NZ 3.42Å; S93-K131 WeakPolarHBondContact OG-CD 3.35Å; P128-K131 HydrophobicContact CG-CB 4.28Å; P128-K131 HydrophobicContact CG-CD 4.14Å; P128-K131 HydrophobicContact CG-CG 4.16Å; P128-K131 PolarHBondContact O-N 2.8Å; P129-K131 PolarHBondContact O-N 2.82Å; K131-H133 PolarHBondContact O-N 2.8Å; K131-C134 WeakPolarHBondContact O-CB 3.46Å; K131-C134 PolarHBondContact O-N 3.23Å
132	L	90.6	Very high	92	Very high	65 Å²	65	52 Å²	52	34%	0.34	26%	0.262	S	S	.	.	H	α-helix	trans	-65.4	-22.3	177.4	-67.3	173.9	0	0	0	113	A122 P129 C134 S135 M136	A122-L132 HydrophobicContact CB-CD2 3.43Å; A122-L132 VanDerWaalsContact CB-CD2 3.43Å; P129-L132 HydrophobicContact CB-CD1 4.38Å; P129-L132 WeakPolarHBondContact O-CG 3.29Å; P129-L132 PolarHBondContact O-N 2.61Å; L132-C134 PolarHBondContact O-N 3.05Å; L132-S135 PolarHBondContact O-N 3.21Å; L132-S135 VanDerWaalsContact O-N 3.13Å; L132-S135 PolarHBondContact O-OG 3.47Å; L132-M136 WeakPolarHBondContact O-CG 3.43Å; L132-M136 PolarHBondContact O-N 3.22Å; L132-M136 VanDerWaalsContact O-N 3.16Å
133	H	88.7	Confident	92.1	Very high	56 Å²	56	55.6 Å²	55.6	26%	0.259	28%	0.276	S	S	.	.	H	α-helix	trans	-61.1	-28.3	174.5	67.7	-89.5	0	0	0	112.7	D67 V130 K131 S135 M136 L137	D67-H133 IonicContact OD2-CD2 2.6Å; D67-H133 IonicContact OD2-NE2 3.85Å; V130-H133 PolarHBondContact O-ND1 3.37Å; K131-H133 PolarHBondContact O-N 2.8Å; H133-S135 VanDerWaalsContact C-N 3.34Å; H133-S135 PolarHBondContact O-N 2.86Å; H133-M136 PolarHBondContact O-N 2.71Å; H133-L137 PolarHBondContact O-N 3.07Å
134	C	90.4	Very high	92.3	Very high	1 Å²	1	50.2 Å²	50.2	1%	0.007	26%	0.259	C	S	.	.	H	α-helix	trans	-67.6	-33.6	177	-54.8	0	0	0	0	112.4	C91 A94 K131 L132 A138	C91-C134 PolarHBondContact SG-SG 3.01Å; A94-C134 HydrophobicContact CB-CB 4.35Å; K131-C134 WeakPolarHBondContact O-CB 3.46Å; K131-C134 PolarHBondContact O-N 3.23Å; L132-C134 PolarHBondContact O-N 3.05Å; C134-A138 PolarHBondContact O-N 3.35Å
135	S	92.3	Very high	92.4	Very high	0 Å²	0	46.8 Å²	46.8	0%	0	24%	0.243	C	C	.	.	H	α-helix	trans	-79.8	-29.9	175.7	59.7	0	0	0	0	112.1	N118 L132 H133 A138 E139	N118-S135 WeakPolarHBondContact CB-O 3.34Å; N118-S135 WeakPolarHBondContact O-CB 3.5Å; N118-S135 PolarHBondContact O-OG 3.39Å; L132-S135 PolarHBondContact O-N 3.21Å; L132-S135 VanDerWaalsContact O-N 3.13Å; L132-S135 PolarHBondContact O-OG 3.47Å; H133-S135 VanDerWaalsContact C-N 3.34Å; H133-S135 PolarHBondContact O-N 2.86Å; S135-A138 PolarHBondContact O-N 3.42Å; S135-E139 PolarHBondContact O-N 3.49Å; S135-E139 VanDerWaalsContact O-N 3.16Å
136	M	94.1	Very high	92.6	Very high	96 Å²	96	47 Å²	47	47%	0.473	24%	0.243	S	C	.	.	H	α-helix	trans	-63.9	-44	171.1	-63.8	176.3	78.6	0	0	111.2	N118 L132 H133 A138 E139 D140	N118-M136 HydrophobicContact CB-CG 4.08Å; L132-M136 WeakPolarHBondContact O-CG 3.43Å; L132-M136 PolarHBondContact O-N 3.22Å; L132-M136 VanDerWaalsContact O-N 3.16Å; H133-M136 PolarHBondContact O-N 2.71Å; M136-A138 VanDerWaalsContact C-N 3.26Å; M136-A138 PolarHBondContact O-N 2.95Å; M136-E139 PolarHBondContact O-N 3.13Å; M136-E139 VanDerWaalsContact O-N 3.17Å; M136-D140 WeakPolarHBondContact O-CB 3.31Å; M136-D140 PolarHBondContact O-N 3.17Å
137	L	94.5	Very high	92.7	Very high	7 Å²	7	40.6 Å²	40.6	4%	0.037	23%	0.23	C	C	.	.	H	α-helix	trans	-55.1	-42.3	175.3	-174.7	72.5	0	0	0	112.1	V60 A62 D67 M69 H133 A141	V60-L137 HydrophobicContact CB-CD1 4.25Å; V60-L137 HydrophobicContact CG2-CD1 3.65Å; V60-L137 HydrophobicContact CG2-CG 4.21Å; A62-L137 HydrophobicContact CB-CD1 4.49Å; D67-L137 HydrophobicContact CB-CD2 3.8Å; M69-L137 HydrophobicContact CB-CD1 4.41Å; M69-L137 HydrophobicContact CB-CD2 3.84Å; M69-L137 HydrophobicContact CB-CG 3.94Å; H133-L137 PolarHBondContact O-N 3.07Å; L137-A141 WeakPolarHBondContact O-CB 3.49Å; L137-A141 PolarHBondContact O-N 3.39Å
138	A	94.8	Very high	93	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	24%	0.237	C	C	.	.	H	α-helix	trans	-67.2	-42.2	178.9	0	0	0	0	0	112.5	M69 A101 I121 C134 S135 M136 A141 I142	M69-A138 HydrophobicContact SD-CB 4.46Å; A101-A138 HydrophobicContact CB-CB 4.02Å; I121-A138 HydrophobicContact CD1-CB 4.08Å; C134-A138 PolarHBondContact O-N 3.35Å; S135-A138 PolarHBondContact O-N 3.42Å; M136-A138 VanDerWaalsContact C-N 3.26Å; M136-A138 PolarHBondContact O-N 2.95Å; A138-A141 PolarHBondContact O-N 2.89Å; A138-I142 WeakPolarHBondContact O-CG1 3.43Å; A138-I142 PolarHBondContact O-N 2.69Å; A138-I142 VanDerWaalsContact O-N 3.14Å
139	E	95.4	Very high	93.2	Very high	20 Å²	20	40.2 Å²	40.2	9%	0.093	22%	0.223	C	C	.	.	H	α-helix	trans	-62.1	-47.4	174.4	179.6	-175.8	162.5	0	0	111.6	N118 S135 M136 A141 I142 K143	N118-E139 HydrophobicContact CB-CB 4.29Å; N118-E139 WeakPolarHBondContact CB-OE2 2.95Å; N118-E139 PolarHBondContact N-OE2 3.37Å; N118-E139 PolarHBondContact ND2-OE2 2.73Å; S135-E139 PolarHBondContact O-N 3.49Å; S135-E139 VanDerWaalsContact O-N 3.16Å; M136-E139 PolarHBondContact O-N 3.13Å; M136-E139 VanDerWaalsContact O-N 3.17Å; E139-A141 VanDerWaalsContact C-N 3.27Å; E139-A141 PolarHBondContact O-N 3.43Å; E139-I142 PolarHBondContact O-N 3.47Å; E139-K143 HydrophobicContact CG-CD 4.28Å; E139-K143 PolarHBondContact O-N 3.1Å; E139-K143 WeakPolarHBondContact OE1-CE 3.49Å; E139-K143 IonicContact OE1-NZ 4Å; E139-K143 PolarHBondContact OE1-NZ 3.16Å
140	D	95.7	Very high	93.4	Very high	78 Å²	78	39.9 Å²	39.9	42%	0.417	21%	0.208	S	C	.	.	H	α-helix	trans	-62.3	-38	179.4	-69.1	-22.4	0	0	0	111.1	V60 M136 I142 K143 A144	V60-D140 HydrophobicContact CG1-CB 4.27Å; M136-D140 WeakPolarHBondContact O-CB 3.31Å; M136-D140 PolarHBondContact O-N 3.17Å; D140-I142 PolarHBondContact O-N 2.9Å; D140-K143 PolarHBondContact O-N 3.11Å; D140-A144 VanDerWaalsContact O-CB 3.3Å; D140-A144 WeakPolarHBondContact O-CB 3.34Å; D140-A144 PolarHBondContact O-N 3.47Å
141	A	96	Very high	93.6	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-62	-42.4	175.3	0	0	0	0	0	112.2	V60 M69 L71 L137 A138 E139 A144 A145	V60-A141 HydrophobicContact CG2-CB 3.57Å; M69-A141 HydrophobicContact CE-CB 3.92Å; M69-A141 HydrophobicContact CG-CB 4.09Å; M69-A141 HydrophobicContact SD-CB 3.65Å; L71-A141 HydrophobicContact CB-CB 3.94Å; L71-A141 HydrophobicContact CD2-CB 4.17Å; L137-A141 WeakPolarHBondContact O-CB 3.49Å; L137-A141 PolarHBondContact O-N 3.39Å; A138-A141 PolarHBondContact O-N 2.89Å; E139-A141 VanDerWaalsContact C-N 3.27Å; E139-A141 PolarHBondContact O-N 3.43Å; A141-A144 PolarHBondContact O-N 3.35Å; A141-A145 WeakPolarHBondContact O-CB 3.47Å; A141-A145 PolarHBondContact O-N 3.5Å
142	I	95.9	Very high	93.6	Very high	4 Å²	4	38.8 Å²	38.8	2%	0.021	20%	0.198	C	C	.	.	H	α-helix	trans	-61.7	-50.7	176.9	-67	166.3	0	0	0	109.8	L71 A101 V105 A113 I116 A138 E139 D140 A144 A145 L146	L71-I142 HydrophobicContact CD2-CB 4.3Å; L71-I142 HydrophobicContact CD2-CG1 3.71Å; A101-I142 HydrophobicContact CB-CD1 4.22Å; V105-I142 HydrophobicContact CG2-CD1 3.56Å; V105-I142 HydrophobicContact CG2-CG1 3.81Å; V105-I142 HydrophobicContact CG2-CG2 4.32Å; A113-I142 HydrophobicContact CB-CG2 4.45Å; I116-I142 HydrophobicContact CB-CD1 4.44Å; I116-I142 HydrophobicContact CD1-CD1 4.43Å; I116-I142 HydrophobicContact CG2-CD1 4.17Å; A138-I142 WeakPolarHBondContact O-CG1 3.43Å; A138-I142 PolarHBondContact O-N 2.69Å; A138-I142 VanDerWaalsContact O-N 3.14Å; E139-I142 PolarHBondContact O-N 3.47Å; D140-I142 PolarHBondContact O-N 2.9Å; I142-A144 VanDerWaalsContact C-N 3.33Å; I142-A144 PolarHBondContact O-N 3.27Å; I142-A145 PolarHBondContact O-N 2.98Å; I142-L146 HydrophobicContact CG2-CD1 3.76Å; I142-L146 HydrophobicContact CG2-CG 4.32Å; I142-L146 VanDerWaalsContact O-CG 3.28Å; I142-L146 WeakPolarHBondContact O-CG 3.35Å; I142-L146 PolarHBondContact O-N 2.9Å
143	K	95.9	Very high	93.5	Very high	83 Å²	83	38.5 Å²	38.5	36%	0.361	20%	0.195	S	C	.	.	H	α-helix	trans	-59.2	-44.6	179.3	-71.9	172.5	173.1	173.6	0	112	L114 E139 D140 L146 A147	L114-K143 HydrophobicContact CD1-CG 4.09Å; E139-K143 HydrophobicContact CG-CD 4.28Å; E139-K143 PolarHBondContact O-N 3.1Å; E139-K143 WeakPolarHBondContact OE1-CE 3.49Å; E139-K143 IonicContact OE1-NZ 4Å; E139-K143 PolarHBondContact OE1-NZ 3.16Å; D140-K143 PolarHBondContact O-N 3.11Å; K143-L146 PolarHBondContact O-N 3.26Å; K143-A147 WeakPolarHBondContact O-CB 3.29Å; K143-A147 PolarHBondContact O-N 3.41Å
144	A	96.3	Very high	93.3	Very high	32 Å²	32	41.3 Å²	41.3	26%	0.264	21%	0.208	S	C	.	.	H	α-helix	trans	-62.8	-43.1	177.6	0	0	0	0	0	112	V60 D140 A141 I142 A147 D148	V60-A144 HydrophobicContact CG1-CB 3.86Å; D140-A144 VanDerWaalsContact O-CB 3.3Å; D140-A144 WeakPolarHBondContact O-CB 3.34Å; D140-A144 PolarHBondContact O-N 3.47Å; A141-A144 PolarHBondContact O-N 3.35Å; I142-A144 VanDerWaalsContact C-N 3.33Å; I142-A144 PolarHBondContact O-N 3.27Å; A144-A147 PolarHBondContact O-N 2.92Å; A144-D148 WeakPolarHBondContact O-CB 3.34Å; A144-D148 PolarHBondContact O-N 3.15Å
145	A	95.9	Very high	92.9	Very high	0 Å²	0	45.6 Å²	45.6	0%	0	23%	0.231	C	C	.	.	H	α-helix	trans	-66.2	-39.7	178.8	0	0	0	0	0	112.5	G56 L71 I73 A141 I142 Y149	G56-A145 WeakPolarHBondContact CA-O 3.26Å; L71-A145 HydrophobicContact CD2-CB 4.27Å; L71-A145 HydrophobicContact CG-CB 4.38Å; I73-A145 HydrophobicContact CD1-CB 4.03Å; I73-A145 HydrophobicContact CG1-CB 4.11Å; I73-A145 HydrophobicContact CG2-CB 4.41Å; A141-A145 WeakPolarHBondContact O-CB 3.47Å; A141-A145 PolarHBondContact O-N 3.5Å; I142-A145 PolarHBondContact O-N 2.98Å; A145-Y149 PolarHBondContact O-N 3.49Å; A145-Y149 VanDerWaalsContact O-N 3.07Å
146	L	94.8	Very high	92	Very high	3 Å²	3	47.6 Å²	47.6	2%	0.016	24%	0.242	C	C	.	.	H	α-helix	trans	-66.8	-39.9	174.9	-67.2	170.8	0	0	0	111.9	I73 I81 L110 A113 L114 I142 K143 Y149 R150	I73-L146 HydrophobicContact CD1-CD2 3.52Å; I73-L146 HydrophobicContact CD1-CG 4.06Å; I81-L146 HydrophobicContact CD1-CD2 4.29Å; L110-L146 HydrophobicContact CB-CD2 4.21Å; L110-L146 HydrophobicContact CD2-CD2 3.42Å; L110-L146 VanDerWaalsContact CD2-CD2 3.42Å; L110-L146 HydrophobicContact CG-CD2 4.41Å; A113-L146 HydrophobicContact CB-CD1 4.03Å; A113-L146 HydrophobicContact CB-CD2 4.36Å; L114-L146 HydrophobicContact CB-CD1 4.38Å; L114-L146 HydrophobicContact CD1-CD1 4.07Å; I142-L146 HydrophobicContact CG2-CD1 3.76Å; I142-L146 HydrophobicContact CG2-CG 4.32Å; I142-L146 VanDerWaalsContact O-CG 3.28Å; I142-L146 WeakPolarHBondContact O-CG 3.35Å; I142-L146 PolarHBondContact O-N 2.9Å; K143-L146 PolarHBondContact O-N 3.26Å; L146-Y149 PolarHBondContact O-N 3.38Å; L146-R150 WeakPolarHBondContact O-CG 3.33Å; L146-R150 PolarHBondContact O-N 2.67Å
147	A	94.4	Very high	91	Very high	48 Å²	48	48.9 Å²	48.9	40%	0.397	25%	0.246	S	C	.	.	H	α-helix	trans	-64.3	-46.3	176.5	0	0	0	0	0	111.6	K143 A144 Y149 R150 L151	K143-A147 WeakPolarHBondContact O-CB 3.29Å; K143-A147 PolarHBondContact O-N 3.41Å; A144-A147 PolarHBondContact O-N 2.92Å; A147-Y149 VanDerWaalsContact C-N 3.32Å; A147-Y149 PolarHBondContact O-N 3Å; A147-R150 PolarHBondContact O-N 2.97Å; A147-L151 WeakPolarHBondContact O-CG 3.44Å; A147-L151 PolarHBondContact O-N 2.94Å
148	D	94.6	Very high	90	Very high	46 Å²	46	53.6 Å²	53.6	25%	0.246	27%	0.268	C	S	.	.	H	α-helix	trans	-58.6	-43.4	175.4	-178.2	72.1	0	0	0	111.7	T57 A144 L151 K152	T57-D148 PolarHBondContact N-OD2 2.95Å; T57-D148 VanDerWaalsContact O-CB 3.3Å; T57-D148 WeakPolarHBondContact O-CB 3.34Å; A144-D148 WeakPolarHBondContact O-CB 3.34Å; A144-D148 PolarHBondContact O-N 3.15Å; D148-L151 PolarHBondContact O-N 3.03Å; D148-K152 WeakPolarHBondContact O-CG 3.12Å; D148-K152 PolarHBondContact O-N 3.03Å; D148-K152 VanDerWaalsContact O-N 3.11Å; D148-K152 WeakPolarHBondContact OD2-CE 3.25Å; D148-K152 IonicContact OD2-NZ 2.68Å; D148-K152 PolarHBondContact OD2-NZ 3.19Å; D148-K152 VanDerWaalsContact OD2-NZ 3.1Å
149	Y	93.9	Very high	89	Confident	22 Å²	22	59.5 Å²	59.5	9%	0.086	30%	0.296	C	S	.	.	H	α-helix	trans	-59.1	-49	174.9	177.7	-103.3	0	0	0	112.1	V75 L110 A145 L146 A147 L151 K152 Q153	V75-Y149 HydrophobicContact CB-CD2 4.29Å; V75-Y149 HydrophobicContact CB-CE1 4.15Å; V75-Y149 HydrophobicContact CB-CE2 3.66Å; V75-Y149 HydrophobicContact CG1-CE1 4.06Å; V75-Y149 HydrophobicContact CG1-CE2 4.38Å; V75-Y149 HydrophobicContact CG2-CD1 4.13Å; V75-Y149 HydrophobicContact CG2-CD2 3.85Å; V75-Y149 HydrophobicContact CG2-CE1 4.04Å; V75-Y149 HydrophobicContact CG2-CE2 3.74Å; V75-Y149 HydrophobicContact CG2-CG 4.04Å; L110-Y149 HydrophobicContact CD1-CD1 3.98Å; L110-Y149 HydrophobicContact CD1-CE1 3.79Å; L110-Y149 HydrophobicContact CD2-CD1 4.17Å; L110-Y149 HydrophobicContact CD2-CE1 4.39Å; A145-Y149 PolarHBondContact O-N 3.49Å; A145-Y149 VanDerWaalsContact O-N 3.07Å; L146-Y149 PolarHBondContact O-N 3.38Å; A147-Y149 VanDerWaalsContact C-N 3.32Å; A147-Y149 PolarHBondContact O-N 3Å; Y149-L151 VanDerWaalsContact C-N 3.31Å; Y149-L151 PolarHBondContact O-N 3.49Å; Y149-K152 PolarHBondContact O-N 3.4Å; Y149-Q153 HydrophobicContact CD1-CG 4.34Å; Y149-Q153 HydrophobicContact CE1-CG 3.86Å; Y149-Q153 HydrophobicContact CE2-CG 4.06Å; Y149-Q153 WeakPolarHBondContact O-CG 3.4Å; Y149-Q153 PolarHBondContact O-N 3.29Å; Y149-Q153 VanDerWaalsContact O-N 3.14Å
150	R	91.6	Very high	88	Confident	100 Å²	100	61.3 Å²	61.3	38%	0.377	31%	0.314	S	S	.	.	H	α-helix	trans	-60.6	-39.9	179.8	-73.1	173.9	178.6	-177.5	-2	112	D111 L146 A147 Q153 H154	D111-R150 IonicContact OD1-NH2 3.68Å; D111-R150 PolarHBondContact OD1-NH2 3.07Å; L146-R150 WeakPolarHBondContact O-CG 3.33Å; L146-R150 PolarHBondContact O-N 2.67Å; A147-R150 PolarHBondContact O-N 2.97Å; R150-Q153 PolarHBondContact O-N 2.85Å; R150-H154 PolarHBondContact O-CD2 2.9Å; R150-H154 PolarHBondContact O-N 2.77Å
151	L	91.4	Very high	87	Confident	107 Å²	107	62 Å²	62	56%	0.56	32%	0.321	S	S	*	.	H	α-helix	trans	-62.2	-47.1	176.6	-70.7	171.4	0	0	0	111.7	A147 D148 Y149 Q153 H154 D155	A147-L151 WeakPolarHBondContact O-CG 3.44Å; A147-L151 PolarHBondContact O-N 2.94Å; D148-L151 PolarHBondContact O-N 3.03Å; Y149-L151 VanDerWaalsContact C-N 3.31Å; Y149-L151 PolarHBondContact O-N 3.49Å; L151-Q153 VanDerWaalsContact C-N 3.29Å; L151-Q153 PolarHBondContact O-N 3.27Å; L151-H154 PolarHBondContact O-N 2.6Å; L151-H154 VanDerWaalsContact O-N 3.07Å; L151-D155 PolarHBondContact O-N 3.37Å
152	K	89	Confident	86	Confident	47 Å²	47	70.6 Å²	70.6	20%	0.204	35%	0.353	C	S	.	.	H	α-helix	trans	-59.3	-38.2	177.7	-71.1	176.2	-176.7	178.9	0	113.2	K50 V55 D148 Y149 H154 D156	K50-K152 PolarHBondContact O-NZ 2.85Å; V55-K152 PolarHBondContact O-NZ 3.26Å; D148-K152 WeakPolarHBondContact O-CG 3.12Å; D148-K152 PolarHBondContact O-N 3.03Å; D148-K152 VanDerWaalsContact O-N 3.11Å; D148-K152 WeakPolarHBondContact OD2-CE 3.25Å; D148-K152 IonicContact OD2-NZ 2.68Å; D148-K152 PolarHBondContact OD2-NZ 3.19Å; D148-K152 VanDerWaalsContact OD2-NZ 3.1Å; Y149-K152 PolarHBondContact O-N 3.4Å; K152-H154 VanDerWaalsContact C-N 3.34Å; K152-D156 PolarHBondContact O-N 3.11Å
153	Q	87.7	Confident	84.9	Confident	59 Å²	59	74.5 Å²	74.5	28%	0.276	39%	0.386	S	S	.	.	H	α-helix	trans	-68.5	-32.8	177.2	-64	-57.4	-49.3	0	0	112.4	K53 Y149 R150 L151 Q157	K53-Q153 PolarHBondContact O-NE2 2.7Å; Y149-Q153 HydrophobicContact CD1-CG 4.34Å; Y149-Q153 HydrophobicContact CE1-CG 3.86Å; Y149-Q153 HydrophobicContact CE2-CG 4.06Å; Y149-Q153 WeakPolarHBondContact O-CG 3.4Å; Y149-Q153 PolarHBondContact O-N 3.29Å; Y149-Q153 VanDerWaalsContact O-N 3.14Å; R150-Q153 PolarHBondContact O-N 2.85Å; L151-Q153 VanDerWaalsContact C-N 3.29Å; L151-Q153 PolarHBondContact O-N 3.27Å; Q153-Q157 WeakPolarHBondContact O-CG 3.42Å; Q153-Q157 PolarHBondContact O-N 2.71Å
154	H	84.9	Confident	83.7	Confident	114 Å²	114	75.4 Å²	75.4	53%	0.528	40%	0.403	S	S	.	.	H	α-helix	trans	-74.1	-40.7	176.2	-82.5	-65	0	0	0	113	R150 L151 K152 D156 Q157 Q158	R150-H154 PolarHBondContact O-CD2 2.9Å; R150-H154 PolarHBondContact O-N 2.77Å; L151-H154 PolarHBondContact O-N 2.6Å; L151-H154 VanDerWaalsContact O-N 3.07Å; K152-H154 VanDerWaalsContact C-N 3.34Å; H154-D156 VanDerWaalsContact C-N 3.32Å; H154-D156 PolarHBondContact O-N 3.16Å; H154-Q157 PolarHBondContact O-N 2.86Å; H154-Q158 PolarHBondContact O-N 3.33Å
155	D	81	Confident	81.7	Confident	92 Å²	92	83.2 Å²	83.2	49%	0.492	44%	0.441	S	S	.	.	H	α-helix	trans	-62.5	-41.4	178.1	-70.5	-14.6	0	0	0	111	L151 Q157 Q158 E159	L151-D155 PolarHBondContact O-N 3.37Å; D155-Q157 VanDerWaalsContact C-N 3.34Å; D155-Q157 PolarHBondContact O-N 2.71Å; D155-Q158 PolarHBondContact O-N 3.47Å; D155-Q158 VanDerWaalsContact O-N 3.14Å; D155-E159 PolarHBondContact O-N 3.36Å
156	D	74.6	Confident	81	Confident	42 Å²	42	87.4 Å²	87.4	23%	0.225	46%	0.463	C	S	.	.	H	α-helix	trans	-59.3	-41.4	175.8	-85.9	1.8	0	0	0	113	K53 K152 H154 Q158 E159 A160	K53-D156 WeakPolarHBondContact CD-OD2 3.35Å; K53-D156 WeakPolarHBondContact CG-OD2 3.48Å; K53-D156 IonicContact NZ-OD1 2.7Å; K53-D156 PolarHBondContact NZ-OD1 3.1Å; K53-D156 IonicContact NZ-OD2 2.85Å; K53-D156 PolarHBondContact NZ-OD2 3.12Å; K152-D156 PolarHBondContact O-N 3.11Å; H154-D156 VanDerWaalsContact C-N 3.32Å; H154-D156 PolarHBondContact O-N 3.16Å; D156-Q158 VanDerWaalsContact C-N 3.32Å; D156-Q158 PolarHBondContact O-N 3.22Å; D156-E159 PolarHBondContact O-N 2.94Å; D156-A160 WeakPolarHBondContact O-CB 3.15Å; D156-A160 PolarHBondContact O-N 2.82Å
157	Q	72.5	Confident	80.2	Confident	122 Å²	122	91.8 Å²	91.8	57%	0.57	49%	0.486	S	S	*	.	H	α-helix	trans	-66.4	-35.9	177.3	-71.2	177.3	4.4	0	0	111.6	Q153 H154 D155 V161	Q153-Q157 WeakPolarHBondContact O-CG 3.42Å; Q153-Q157 PolarHBondContact O-N 2.71Å; H154-Q157 PolarHBondContact O-N 2.86Å; D155-Q157 VanDerWaalsContact C-N 3.34Å; D155-Q157 PolarHBondContact O-N 2.71Å; Q157-V161 VanDerWaalsContact O-CG2 3.26Å; Q157-V161 WeakPolarHBondContact O-CG2 3.36Å; Q157-V161 PolarHBondContact O-N 3.05Å
158	Q	73.1	Confident	79.4	Confident	107 Å²	107	94.3 Å²	94.3	50%	0.5	49%	0.491	S	S	.	.	H	α-helix	trans	-72.7	-38	176.9	-70.7	-175.3	16.2	0	0	112.6	H154 D155 D156 V161 R162	H154-Q158 PolarHBondContact O-N 3.33Å; D155-Q158 PolarHBondContact O-N 3.47Å; D155-Q158 VanDerWaalsContact O-N 3.14Å; D156-Q158 VanDerWaalsContact C-N 3.32Å; D156-Q158 PolarHBondContact O-N 3.22Å; Q158-V161 PolarHBondContact O-N 2.85Å; Q158-R162 WeakPolarHBondContact O-CG 3.37Å; Q158-R162 PolarHBondContact O-N 2.82Å
159	E	74.4	Confident	78.5	Confident	123 Å²	123	97.1 Å²	97.1	58%	0.575	51%	0.506	S	S	*	.	H	α-helix	trans	-64.5	-43	175.4	-74	-173.9	169.9	0	0	112	D155 D156 V161 R162 A163	D155-E159 PolarHBondContact O-N 3.36Å; D156-E159 PolarHBondContact O-N 2.94Å; E159-V161 VanDerWaalsContact C-N 3.3Å; E159-V161 PolarHBondContact O-N 2.93Å; E159-R162 PolarHBondContact O-N 3.04Å; E159-A163 PolarHBondContact O-N 2.82Å
160	A	74.1	Confident	77.6	Confident	58 Å²	58	101.8 Å²	101.8	48%	0.479	53%	0.532	S	S	.	.	H	α-helix	trans	-60.9	-38.4	177.1	0	0	0	0	0	112.7	D156 S164	D156-A160 WeakPolarHBondContact O-CB 3.15Å; D156-A160 PolarHBondContact O-N 2.82Å; A160-S164 PolarHBondContact O-N 3.28Å; A160-S164 PolarHBondContact O-OG 2.8Å
161	V	75.8	Confident	76.6	Confident	94 Å²	94	101.9 Å²	101.9	57%	0.57	54%	0.542	S	S	*	.	H	α-helix	trans	-69.1	-39	175.8	174.1	0	0	0	0	111.4	Q157 Q158 E159 S164	Q157-V161 VanDerWaalsContact O-CG2 3.26Å; Q157-V161 WeakPolarHBondContact O-CG2 3.36Å; Q157-V161 PolarHBondContact O-N 3.05Å; Q158-V161 PolarHBondContact O-N 2.85Å; E159-V161 VanDerWaalsContact C-N 3.3Å; E159-V161 PolarHBondContact O-N 2.93Å; V161-S164 PolarHBondContact O-N 2.82Å
162	R	73.9	Confident	75.6	Confident	179 Å²	179	101.6 Å²	101.6	68%	0.675	54%	0.541	S	S	*	.	H	α-helix	trans	-70.6	-30.9	177.7	-73.8	177.3	-175.2	169	6.3	113.6	Q158 E159 S164	Q158-R162 WeakPolarHBondContact O-CG 3.37Å; Q158-R162 PolarHBondContact O-N 2.82Å; E159-R162 PolarHBondContact O-N 3.04Å; R162-S164 PolarHBondContact O-N 2.9Å
163	A	72.1	Confident	74.6	Confident	86 Å²	86	105.8 Å²	105.8	71%	0.711	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.5	-11.4	177	0	0	0	0	0	113.7	E159	E159-A163 PolarHBondContact O-N 2.82Å
164	S	71.4	Confident	73.5	Confident	102 Å²	102	109.7 Å²	109.7	71%	0.713	59%	0.591	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.8	-1.2	-178.4	-56.9	0	0	0	0	113.8	A160 V161 R162	A160-S164 PolarHBondContact O-N 3.28Å; A160-S164 PolarHBondContact O-OG 2.8Å; V161-S164 PolarHBondContact O-N 2.82Å; R162-S164 PolarHBondContact O-N 2.9Å
165	N	53.8	Low	72.4	Confident	197 Å²	197	109.3 Å²	109.3	100%	1.053	60%	0.597	S	S	*	*			trans	-113.7	0	174.9	-76	-23.3	0	0	0	110.5

Retrieved 165 of 165 residues in 206 ms (Link to these results)

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