A0A060XJG7_ONCMY Loading...

CCHC-type zinc finger, nucleic acid binding protein a

AlphaFold DB , UniProt , Accession A0A060XJG7, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110492416, Length 167 aa.

						>A0A060XJG7_ONCMY|A0A060XJG7|LOC110492416
MEMSSSSECFRCGRPGHWIKNCPEAGSGGRGRGRGRGRGKDLFCYRCGEQGHIARDCEQTEDACYNCHRSGHISRDCKEPKKEREQCCYSCGKAGHVARDCDHANEQKCYSCGGFGHIQKLCDKVKCYRCGEIGHVAVQCSKASEVNCYKCGNTGHLAKECTIEATA
					

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.2	Very low	58.1	Low	235 Å²	235	122.7 Å²	122.7	100%	1.158	65%	0.646	S	S	*	*				0	122.8	0	-79.4	74.7	178.5	0	0	108
2	E	41.4	Very low	59.9	Low	190 Å²	190	115.9 Å²	115.9	89%	0.888	62%	0.615	S	S	*	*			trans	-75	131.9	-168.3	-53.3	-159.2	102.1	0	0	112.1	S4	E2-S4 PolarHBondContact O-N 3.21Å
3	M	48.4	Very low	60.8	Low	196 Å²	196	110.5 Å²	110.5	97%	0.966	60%	0.603	S	S	*	*			trans	-83	88.9	174.9	-78.6	-165.2	163.1	0	0	109.9	S5	M3-S5 PolarHBondContact O-N 3.47Å
4	S	46.1	Very low	61.8	Low	109 Å²	109	113.2 Å²	113.2	76%	0.762	60%	0.6	S	S	*	*			trans	-81.6	98.6	170.9	-63.9	0	0	0	0	109.8	E2 S6	E2-S4 PolarHBondContact O-N 3.21Å; S4-S6 PolarHBondContact O-N 3.27Å
5	S	53.3	Low	62.6	Low	105 Å²	105	111.9 Å²	111.9	73%	0.734	60%	0.601	S	S	*	*			trans	-62.5	96.1	168.8	178.7	0	0	0	0	109.5	M3 S7	M3-S5 PolarHBondContact O-N 3.47Å; S5-S7 VanDerWaalsContact C-N 3.32Å; S5-S7 PolarHBondContact O-N 3.45Å; S5-S7 PolarHBondContact O-OG 3.33Å
6	S	57.6	Low	63.2	Low	78 Å²	78	109.7 Å²	109.7	55%	0.545	61%	0.613	S	S	.	*			trans	-65.7	90.3	178.9	-158.3	0	0	0	0	110.2	S4 E8	S4-S6 PolarHBondContact O-N 3.27Å; S6-E8 WeakPolarHBondContact CB-OE2 3.04Å; S6-E8 PolarHBondContact O-N 3.36Å; S6-E8 VanDerWaalsContact OG-CG 3.27Å; S6-E8 WeakPolarHBondContact OG-CG 3.41Å; S6-E8 PolarHBondContact OG-OE2 2.9Å
7	S	67.5	Low	64	Low	69 Å²	69	105.5 Å²	105.5	48%	0.483	59%	0.587	S	S	.	*			trans	-82.1	62.7	176.3	-54.3	0	0	0	0	108.7	S5 P15 G16	S5-S7 VanDerWaalsContact C-N 3.32Å; S5-S7 PolarHBondContact O-N 3.45Å; S5-S7 PolarHBondContact O-OG 3.33Å; S7-P15 WeakPolarHBondContact O-CA 3.32Å; S7-G16 PolarHBondContact O-N 3.37Å
8	E	70.2	Confident	64.5	Low	92 Å²	92	107.6 Å²	107.6	43%	0.43	59%	0.585	S	S	.	*	B	Isolated β-bridge	trans	-83.4	134.7	173.9	-71.9	167.9	118.2	0	0	109.6	S6 F10 P15	S6-E8 WeakPolarHBondContact CB-OE2 3.04Å; S6-E8 PolarHBondContact O-N 3.36Å; S6-E8 VanDerWaalsContact OG-CG 3.27Å; S6-E8 WeakPolarHBondContact OG-CG 3.41Å; S6-E8 PolarHBondContact OG-OE2 2.9Å; E8-F10 PolarHBondContact O-N 3.39Å; E8-P15 HydrophobicContact CG-CB 4.12Å
9	C	72.2	Confident	64.8	Low	0 Å²	0	104.8 Å²	104.8	0%	0	57%	0.569	C	S	.	*			trans	-65.2	109.9	175.3	177.4	0	0	0	0	109.7	R11 C12 G13 R14 H17	C9-R11 PolarHBondContact O-N 2.89Å; C9-C12 PolarHBondContact O-N 2.85Å; C9-C12 VanDerWaalsContact O-N 3.07Å; C9-C12 VanDerWaalsContact SG-SG 3.63Å; C9-G13 WeakPolarHBondContact O-CA 3.34Å; C9-G13 PolarHBondContact O-N 3.2Å; C9-R14 WeakPolarHBondContact CB-O 3.19Å; C9-R14 PolarHBondContact N-O 3.43Å; C9-H17 WeakPolarHBondContact CA-O 3.49Å; C9-H17 VanDerWaalsContact CB-CD2 3.47Å; C9-H17 WeakPolarHBondContact CB-CD2 2.92Å; C9-H17 WeakPolarHBondContact CB-NE2 3.46Å; C9-H17 WeakPolarHBondContact CB-O 3.45Å; C9-H17 VanDerWaalsContact SG-CD2 3.57Å; C9-H17 PolarHBondContact SG-NE2 3Å; C9-H17 VanDerWaalsContact SG-NE2 3.36Å
10	F	72.3	Confident	64.9	Low	158 Å²	158	108.7 Å²	108.7	69%	0.693	58%	0.58	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.7	-3.1	178.5	-57.4	-93	0	0	0	115.4	E8 W18 I19	E8-F10 PolarHBondContact O-N 3.39Å; F10-W18 HydrophobicContact CD2-CH2 4.4Å; F10-W18 HydrophobicContact CE2-CE3 4.46Å; F10-W18 AromaticContact CE2-CH2 3.7Å; F10-W18 HydrophobicContact CE2-CH2 3.7Å; F10-W18 HydrophobicContact CE2-CZ2 4.34Å; F10-W18 AromaticContact CE2-CZ3 3.77Å; F10-W18 HydrophobicContact CE2-CZ3 3.77Å; F10-I19 HydrophobicContact CB-CD1 3.54Å; F10-I19 HydrophobicContact CB-CG1 3.81Å; F10-I19 HydrophobicContact CD2-CD1 3.89Å; F10-I19 HydrophobicContact CD2-CG1 4.22Å; F10-I19 HydrophobicContact CG-CD1 4.09Å
11	R	68.3	Low	64.7	Low	118 Å²	118	109.4 Å²	109.4	45%	0.445	58%	0.584	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.1	-41.9	172.8	-174.1	179.6	-67.1	177.7	4.6	112.9	C9 I19	C9-R11 PolarHBondContact O-N 2.89Å; R11-I19 HydrophobicContact CB-CG1 4.46Å
12	C	79	Confident	66.2	Low	41 Å²	41	98.5 Å²	98.5	28%	0.277	53%	0.531	S	S	.	.	T	Hydrogen-bonded Turn	trans	-122.7	-2.3	-173.1	68.9	0	0	0	0	114.2	C9 R14 H17	C9-C12 PolarHBondContact O-N 2.85Å; C9-C12 VanDerWaalsContact O-N 3.07Å; C9-C12 VanDerWaalsContact SG-SG 3.63Å; C12-R14 PolarHBondContact O-N 3.06Å; C12-H17 PolarHBondContact SG-NE2 2.75Å; C12-H17 VanDerWaalsContact SG-NE2 3.35Å
13	G	71.7	Confident	67.6	Low	45 Å²	45	94.7 Å²	94.7	46%	0.464	52%	0.523	S	S	.	.			trans	71.7	2.2	178.8	0	0	0	0	0	115.1	C9	C9-G13 WeakPolarHBondContact O-CA 3.34Å; C9-G13 PolarHBondContact O-N 3.2Å
14	R	74.4	Confident	68.4	Low	149 Å²	149	91.2 Å²	91.2	56%	0.562	50%	0.504	S	S	*	.			trans	-86.5	134.9	-179.5	-63.3	-174	-173.2	-143.2	2.9	111.4	C9 C12 E24	C9-R14 WeakPolarHBondContact CB-O 3.19Å; C9-R14 PolarHBondContact N-O 3.43Å; C12-R14 PolarHBondContact O-N 3.06Å; R14-E24 IonicContact CZ-OE2 3.98Å; R14-E24 IonicContact NE-OE2 3.54Å; R14-E24 IonicContact NH2-OE2 3.92Å
15	P	74.3	Confident	68.9	Low	93 Å²	93	88.1 Å²	88.1	60%	0.604	49%	0.485	S	S	*	.	B	Isolated β-bridge	trans	-72.5	158.7	175.2	29.9	-34.2	0	0	0	112	S7 E8	S7-P15 WeakPolarHBondContact O-CA 3.32Å; E8-P15 HydrophobicContact CG-CB 4.12Å
16	G	73	Confident	68.8	Low	77 Å²	77	86.1 Å²	86.1	79%	0.794	48%	0.481	S	S	*	.	T	Hydrogen-bonded Turn	trans	97.6	2.7	172.8	0	0	0	0	0	115.7	S7	S7-G16 PolarHBondContact O-N 3.37Å
17	H	76.5	Confident	68.6	Low	38 Å²	38	89 Å²	89	18%	0.176	50%	0.501	C	S	.	.	S	Bend	trans	-154.7	153.5	170.7	62.6	-85.7	0	0	0	112.2	C9 C12 C22	C9-H17 WeakPolarHBondContact CA-O 3.49Å; C9-H17 VanDerWaalsContact CB-CD2 3.47Å; C9-H17 WeakPolarHBondContact CB-CD2 2.92Å; C9-H17 WeakPolarHBondContact CB-NE2 3.46Å; C9-H17 WeakPolarHBondContact CB-O 3.45Å; C9-H17 VanDerWaalsContact SG-CD2 3.57Å; C9-H17 PolarHBondContact SG-NE2 3Å; C9-H17 VanDerWaalsContact SG-NE2 3.36Å; C12-H17 PolarHBondContact SG-NE2 2.75Å; C12-H17 VanDerWaalsContact SG-NE2 3.35Å; H17-C22 WeakPolarHBondContact CD2-CA 3.4Å
18	W	72.3	Confident	67.6	Low	144 Å²	144	88.5 Å²	88.5	55%	0.545	51%	0.507	S	S	.	.			trans	-86.6	160	173.6	-170.3	-99.3	0	0	0	111.3	F10 K20 N21	F10-W18 HydrophobicContact CD2-CH2 4.4Å; F10-W18 HydrophobicContact CE2-CE3 4.46Å; F10-W18 AromaticContact CE2-CH2 3.7Å; F10-W18 HydrophobicContact CE2-CH2 3.7Å; F10-W18 HydrophobicContact CE2-CZ2 4.34Å; F10-W18 AromaticContact CE2-CZ3 3.77Å; F10-W18 HydrophobicContact CE2-CZ3 3.77Å; W18-K20 PolarHBondContact O-N 2.88Å; W18-N21 PolarHBondContact O-N 3.06Å
19	I	70.6	Confident	66.4	Low	54 Å²	54	87.9 Å²	87.9	28%	0.277	53%	0.525	S	S	.	.	G	3₁₀ helix	trans	-42.3	-34.4	177.6	-71.7	166.8	0	0	0	114	F10 R11 N21	F10-I19 HydrophobicContact CB-CD1 3.54Å; F10-I19 HydrophobicContact CB-CG1 3.81Å; F10-I19 HydrophobicContact CD2-CD1 3.89Å; F10-I19 HydrophobicContact CD2-CG1 4.22Å; F10-I19 HydrophobicContact CG-CD1 4.09Å; R11-I19 HydrophobicContact CB-CG1 4.46Å; I19-N21 VanDerWaalsContact C-N 3.34Å
20	K	65.8	Low	65.3	Low	182 Å²	182	98 Å²	98	79%	0.791	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-70.9	-27	-177.8	-71.5	-176.5	176.2	-179.6	0	113.4	W18	W18-K20 PolarHBondContact O-N 2.88Å
21	N	62.2	Low	63.8	Low	124 Å²	124	93.8 Å²	93.8	66%	0.663	56%	0.564	S	S	*	*	G	3₁₀ helix	trans	-115.7	26.4	-173.8	-60.7	-40.7	0	0	0	112	W18 I19 P23	W18-N21 PolarHBondContact O-N 3.06Å; I19-N21 VanDerWaalsContact C-N 3.34Å; N21-P23 WeakPolarHBondContact O-CD 3.42Å
22	C	74	Confident	62.7	Low	7 Å²	7	100.6 Å²	100.6	5%	0.047	59%	0.59	C	S	.	*			trans	-70.8	117.8	-179.5	-175.8	0	0	0	0	110.8	H17 E24 A25	H17-C22 WeakPolarHBondContact CD2-CA 3.4Å; C22-E24 PolarHBondContact O-N 3.28Å; C22-A25 HydrophobicContact CB-CB 4.35Å; C22-A25 WeakPolarHBondContact O-CB 3.45Å; C22-A25 PolarHBondContact O-N 3.15Å
23	P	70.3	Confident	61	Low	110 Å²	110	101.6 Å²	101.6	71%	0.714	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.4	-24.2	-176.6	27.2	-33.9	0	0	0	112.8	N21 A25	N21-P23 WeakPolarHBondContact O-CD 3.42Å; P23-A25 PolarHBondContact O-N 3.21Å
24	E	64.1	Low	59.8	Low	122 Å²	122	108.8 Å²	108.8	57%	0.57	62%	0.62	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81	4.2	171.6	-62.1	-167.8	95.2	0	0	113.1	R14 C22 G26	R14-E24 IonicContact CZ-OE2 3.98Å; R14-E24 IonicContact NE-OE2 3.54Å; R14-E24 IonicContact NH2-OE2 3.92Å; C22-E24 PolarHBondContact O-N 3.28Å; E24-G26 PolarHBondContact O-N 3.38Å
25	A	57.2	Low	58.3	Low	44 Å²	44	105.1 Å²	105.1	36%	0.364	63%	0.629	S	S	.	*			trans	-70.8	80	168	0	0	0	0	0	108.8	C22 P23 S27	C22-A25 HydrophobicContact CB-CB 4.35Å; C22-A25 WeakPolarHBondContact O-CB 3.45Å; C22-A25 PolarHBondContact O-N 3.15Å; P23-A25 PolarHBondContact O-N 3.21Å; A25-S27 PolarHBondContact O-N 3.37Å
26	G	52	Low	57.2	Low	64 Å²	64	108.7 Å²	108.7	66%	0.66	63%	0.63	S	S	*	*			trans	-45.9	139.9	162.4	0	0	0	0	0	109.4	E24 G28	E24-G26 PolarHBondContact O-N 3.38Å; G26-G28 PolarHBondContact O-N 3.39Å
27	S	52.7	Low	56	Low	137 Å²	137	108.1 Å²	108.1	96%	0.958	62%	0.624	S	S	*	*	S	Bend	trans	-48.2	79.7	-175.8	-48.7	0	0	0	0	112.9	A25	A25-S27 PolarHBondContact O-N 3.37Å
28	G	47.6	Very low	54.8	Low	60 Å²	60	118 Å²	118	62%	0.619	66%	0.66	S	S	*	*			trans	-137.2	65.9	-179.6	0	0	0	0	0	107.5	G26 R30	G26-G28 PolarHBondContact O-N 3.39Å; G28-R30 PolarHBondContact O-N 3.4Å
29	G	45	Very low	53.9	Low	78 Å²	78	114.2 Å²	114.2	80%	0.804	67%	0.665	S	S	*	*			trans	-50.2	116.1	179.3	0	0	0	0	0	110.1	G31	G29-G31 PolarHBondContact O-N 3.18Å
30	R	47.2	Very low	52.9	Low	214 Å²	214	119.9 Å²	119.9	81%	0.808	69%	0.688	S	S	*	*			trans	-73.2	71.5	165.2	-68.1	-171.7	-173	-165.4	1.4	108.3	G28 R32	G28-R30 PolarHBondContact O-N 3.4Å; R30-R32 PolarHBondContact O-N 2.69Å; R30-R32 VanDerWaalsContact O-N 3.13Å
31	G	42.4	Very low	52.3	Low	68 Å²	68	117.7 Å²	117.7	70%	0.701	69%	0.685	S	S	*	*			trans	-69.1	100.7	164.1	0	0	0	0	0	108.5	G29 G33	G29-G31 PolarHBondContact O-N 3.18Å; G31-G33 PolarHBondContact O-N 2.82Å
32	R	45.3	Very low	52.4	Low	262 Å²	262	114.6 Å²	114.6	99%	0.989	67%	0.668	S	S	*	*			trans	-69.9	80.7	155.9	-75.3	-170.7	175.5	-153.4	1.1	107.3	R30	R30-R32 PolarHBondContact O-N 2.69Å; R30-R32 VanDerWaalsContact O-N 3.13Å
33	G	42.2	Very low	52.1	Low	62 Å²	62	118.6 Å²	118.6	64%	0.639	69%	0.685	S	S	*	*			trans	-144	107.2	173.2	0	0	0	0	0	107.8	G31 G35	G31-G33 PolarHBondContact O-N 2.82Å; G33-G35 PolarHBondContact O-N 3.08Å
34	R	45.8	Very low	52.3	Low	196 Å²	196	113.4 Å²	113.4	74%	0.74	65%	0.651	S	S	*	*			trans	-69.4	77.5	166.8	-73.2	175.6	169.7	-160.9	-10	107.7	R36 Y110	R34-R36 PolarHBondContact O-N 2.69Å; R34-Y110 PolarHBondContact NH1-O 3.4Å; R34-Y110 PolarHBondContact NH2-O 3.47Å
35	G	44.9	Very low	52.5	Low	72 Å²	72	114 Å²	114	74%	0.742	65%	0.649	S	S	*	*			trans	-74.9	105.5	172.8	0	0	0	0	0	109.3	G33	G33-G35 PolarHBondContact O-N 3.08Å
36	R	50.9	Low	53.3	Low	167 Å²	167	115.7 Å²	115.7	63%	0.63	65%	0.646	S	S	*	*			trans	-59.3	136.6	162.1	-75.2	175.9	167.2	-174.6	-7.9	108.6	R34	R34-R36 PolarHBondContact O-N 2.69Å
37	G	47.4	Very low	54.3	Low	65 Å²	65	113 Å²	113	67%	0.67	62%	0.617	S	S	*	*			trans	84.3	108.2	162.7	0	0	0	0	0	113.9
38	R	50.4	Low	55.1	Low	247 Å²	247	107.5 Å²	107.5	93%	0.932	58%	0.582	S	S	*	*	S	Bend	trans	-56.5	143.8	151.9	-78.5	-172.6	179.5	-167.7	0.8	107.9
39	G	53.1	Low	56.4	Low	63 Å²	63	109.8 Å²	109.8	65%	0.649	58%	0.576	S	S	*	*	S	Bend	trans	-43.8	155.8	-169.3	0	0	0	0	0	117.3
40	K	51.1	Low	57.6	Low	174 Å²	174	112.4 Å²	112.4	76%	0.757	57%	0.568	S	S	*	*	S	Bend	trans	120.4	-30.8	159.6	-63.4	176.1	-176	-170.3	0	115.4
41	D	52.5	Low	58.9	Low	135 Å²	135	105.2 Å²	105.2	72%	0.722	56%	0.56	S	S	*	*	S	Bend	trans	-109.9	7.5	-176.2	-53.5	-70.2	0	0	0	115	F43	D41-F43 PolarHBondContact O-N 2.87Å
42	L	64.3	Low	60.7	Low	60 Å²	60	104.1 Å²	104.1	31%	0.314	54%	0.537	S	S	.	.	P	Polyproline II helix	trans	-86.4	116.2	-179.5	-154.4	89.2	0	0	0	110.5	G51 I53	L42-G51 PolarHBondContact O-N 3.45Å; L42-G51 VanDerWaalsContact O-N 3.09Å; L42-I53 HydrophobicContact CD2-CB 4.2Å; L42-I53 HydrophobicContact CD2-CG2 3.1Å
43	F	67.9	Low	62.1	Low	90 Å²	90	94.7 Å²	94.7	40%	0.395	51%	0.505	S	S	.	.	B	Isolated β-bridge	trans	-81.3	133.1	170.7	-61.5	-85.9	0	0	0	110.1	D41 Y45 Q50	D41-F43 PolarHBondContact O-N 2.87Å; F43-Y45 PolarHBondContact O-N 2.89Å; F43-Q50 HydrophobicContact CD1-CB 4.04Å; F43-Q50 HydrophobicContact CE1-CB 4.04Å
44	C	73.8	Confident	63.5	Low	2 Å²	2	93.1 Å²	93.1	1%	0.014	49%	0.487	C	S	.	.	P	Polyproline II helix	trans	-69.7	119.9	173.3	177.8	0	0	0	0	109.8	R46 C47 G48 E49 H52 A54 C57	C44-R46 PolarHBondContact O-N 2.95Å; C44-R46 PolarHBondContact SG-N 2.94Å; C44-R46 VanDerWaalsContact SG-N 3.42Å; C44-C47 VanDerWaalsContact CB-SG 3.56Å; C44-G48 WeakPolarHBondContact O-CA 3.33Å; C44-G48 PolarHBondContact O-N 2.76Å; C44-E49 VanDerWaalsContact CB-O 3.29Å; C44-E49 WeakPolarHBondContact CB-O 3.49Å; C44-E49 PolarHBondContact N-O 3.39Å; C44-H52 VanDerWaalsContact CB-NE2 3.31Å; C44-H52 WeakPolarHBondContact CB-NE2 3.05Å; C44-H52 WeakPolarHBondContact CB-O 3.38Å; C44-H52 VanDerWaalsContact SG-CD2 3.56Å; C44-H52 PolarHBondContact SG-NE2 2.92Å; C44-A54 VanDerWaalsContact SG-CA 3.58Å; C44-C57 VanDerWaalsContact SG-SG 3.61Å
45	Y	69.3	Low	64.8	Low	135 Å²	135	93.3 Å²	93.3	53%	0.529	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-72.2	-5.8	178.1	-66.1	-68.9	0	0	0	114.4	F43 Y65	F43-Y45 PolarHBondContact O-N 2.89Å; Y45-Y65 HydrophobicContact CD1-CE1 4.16Å; Y45-Y65 WeakPolarHBondContact O-CE1 2.86Å; Y45-Y65 VanDerWaalsContact O-CZ 3.26Å; Y45-Y65 PolarHBondContact O-OH 3.1Å; Y45-Y65 VanDerWaalsContact O-OH 3.08Å
46	R	73	Confident	66.3	Low	78 Å²	78	94.8 Å²	94.8	29%	0.294	48%	0.478	S	S	.	.	T	Hydrogen-bonded Turn	trans	-93.7	-42.7	177	-174	172.4	-68	160	-0.2	112.1	C44 A54 C57 Q59 D62 A63	C44-R46 PolarHBondContact O-N 2.95Å; C44-R46 PolarHBondContact SG-N 2.94Å; C44-R46 VanDerWaalsContact SG-N 3.42Å; R46-A54 HydrophobicContact CB-CB 4.11Å; R46-A54 PolarHBondContact NH1-O 3.24Å; R46-A54 VanDerWaalsContact NH1-O 3.15Å; R46-C57 HydrophobicContact CB-CB 4.42Å; R46-Q59 WeakPolarHBondContact CD-O 3.36Å; R46-D62 IonicContact NE-OD1 2.76Å; R46-A63 WeakPolarHBondContact O-CB 3.18Å; R46-A63 PolarHBondContact O-N 3.27Å
47	C	74.4	Confident	67.5	Low	9 Å²	9	87.5 Å²	87.5	6%	0.061	45%	0.453	C	S	.	.	T	Hydrogen-bonded Turn	trans	-115	-13.7	-178.2	67.1	0	0	0	0	115.4	C44 E49 H52 Q59	C44-C47 VanDerWaalsContact CB-SG 3.56Å; C47-E49 VanDerWaalsContact C-N 3.3Å; C47-E49 PolarHBondContact O-N 3.39Å; C47-E49 PolarHBondContact SG-N 3.36Å; C47-E49 VanDerWaalsContact SG-N 3.43Å; C47-H52 PolarHBondContact SG-CE1 3.24Å; C47-H52 PolarHBondContact SG-NE2 3.31Å; C47-Q59 HydrophobicContact CB-CB 4.33Å; C47-Q59 VanDerWaalsContact CB-CD 3.41Å; C47-Q59 HydrophobicContact CB-CG 4.24Å
48	G	69.6	Low	69	Low	20 Å²	20	93 Å²	93	21%	0.206	46%	0.461	C	S	.	.			trans	83	-5.6	-176.7	0	0	0	0	0	115.9	C44	C44-G48 WeakPolarHBondContact O-CA 3.33Å; C44-G48 PolarHBondContact O-N 2.76Å
49	E	73.6	Confident	70	Confident	108 Å²	108	84.8 Å²	84.8	51%	0.505	43%	0.433	S	S	.	.			trans	-78.2	150.1	179.3	-62.4	-170.2	99.6	0	0	112.2	C44 C47	C44-E49 VanDerWaalsContact CB-O 3.29Å; C44-E49 WeakPolarHBondContact CB-O 3.49Å; C44-E49 PolarHBondContact N-O 3.39Å; C47-E49 VanDerWaalsContact C-N 3.3Å; C47-E49 PolarHBondContact O-N 3.39Å; C47-E49 PolarHBondContact SG-N 3.36Å; C47-E49 VanDerWaalsContact SG-N 3.43Å
50	Q	70.3	Confident	70.7	Confident	133 Å²	133	87.2 Å²	87.2	62%	0.621	44%	0.436	S	S	*	.	B	Isolated β-bridge	trans	-85.7	154.2	177.5	62.6	-174.5	81.3	0	0	111.9	F43	F43-Q50 HydrophobicContact CD1-CB 4.04Å; F43-Q50 HydrophobicContact CE1-CB 4.04Å
51	G	74.3	Confident	71.6	Confident	64 Å²	64	84.2 Å²	84.2	66%	0.66	42%	0.424	S	S	*	.	S	Bend	trans	100.6	-4.4	170.7	0	0	0	0	0	115.2	L42	L42-G51 PolarHBondContact O-N 3.45Å; L42-G51 VanDerWaalsContact O-N 3.09Å
52	H	80.3	Confident	72.4	Confident	44 Å²	44	82.4 Å²	82.4	20%	0.204	41%	0.414	C	S	.	.	S	Bend	trans	-144.3	162.5	173.2	67.1	-90.3	0	0	0	112.2	C44 C47 C57	C44-H52 VanDerWaalsContact CB-NE2 3.31Å; C44-H52 WeakPolarHBondContact CB-NE2 3.05Å; C44-H52 WeakPolarHBondContact CB-O 3.38Å; C44-H52 VanDerWaalsContact SG-CD2 3.56Å; C44-H52 PolarHBondContact SG-NE2 2.92Å; C47-H52 PolarHBondContact SG-CE1 3.24Å; C47-H52 PolarHBondContact SG-NE2 3.31Å; H52-C57 PolarHBondContact NE2-SG 3.21Å
53	I	74.6	Confident	73	Confident	64 Å²	64	79.8 Å²	79.8	33%	0.328	40%	0.402	S	S	.	.			trans	-95.4	158.5	175.1	58.1	164.5	0	0	0	109.8	L42 R55 D56 C57	L42-I53 HydrophobicContact CD2-CB 4.2Å; L42-I53 HydrophobicContact CD2-CG2 3.1Å; I53-R55 HydrophobicContact CD1-CB 3.78Å; I53-R55 HydrophobicContact CG1-CB 4.14Å; I53-R55 PolarHBondContact O-N 3.04Å; I53-D56 WeakPolarHBondContact CD1-OD2 3.37Å; I53-D56 HydrophobicContact CG1-CB 4.17Å; I53-D56 WeakPolarHBondContact CG1-OD2 3.09Å; I53-D56 CarbonylContact O-C 3.48Å; I53-D56 PolarHBondContact O-N 2.99Å; I53-C57 PolarHBondContact O-N 3.29Å
54	A	71.4	Confident	73.6	Confident	30 Å²	30	75.5 Å²	75.5	25%	0.248	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.2	-20.3	178.8	0	0	0	0	0	114.9	C44 R46	C44-A54 VanDerWaalsContact SG-CA 3.58Å; R46-A54 HydrophobicContact CB-CB 4.11Å; R46-A54 PolarHBondContact NH1-O 3.24Å; R46-A54 VanDerWaalsContact NH1-O 3.15Å
55	R	74.1	Confident	73.5	Confident	200 Å²	200	81.6 Å²	81.6	76%	0.755	41%	0.407	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.4	-28.3	176.8	-158.7	-172.4	68.6	-173.6	-0.1	113.6	I53	I53-R55 HydrophobicContact CD1-CB 3.78Å; I53-R55 HydrophobicContact CG1-CB 4.14Å; I53-R55 PolarHBondContact O-N 3.04Å
56	D	75.1	Confident	73.9	Confident	102 Å²	102	76.2 Å²	76.2	55%	0.545	39%	0.387	S	S	.	.	S	Bend	trans	-103.4	15.6	179.6	-54.8	-43.4	0	0	0	110.6	I53	I53-D56 WeakPolarHBondContact CD1-OD2 3.37Å; I53-D56 HydrophobicContact CG1-CB 4.17Å; I53-D56 WeakPolarHBondContact CG1-OD2 3.09Å; I53-D56 CarbonylContact O-C 3.48Å; I53-D56 PolarHBondContact O-N 2.99Å
57	C	77.9	Confident	74.1	Confident	15 Å²	15	73.1 Å²	73.1	10%	0.101	38%	0.377	C	S	.	.			trans	-82.3	125.7	178.6	-170.1	0	0	0	0	110	C44 R46 H52 I53 Q59	C44-C57 VanDerWaalsContact SG-SG 3.61Å; R46-C57 HydrophobicContact CB-CB 4.42Å; H52-C57 PolarHBondContact NE2-SG 3.21Å; I53-C57 PolarHBondContact O-N 3.29Å; C57-Q59 PolarHBondContact O-N 3.5Å
58	E	79	Confident	74.1	Confident	179 Å²	179	76.2 Å²	76.2	84%	0.836	39%	0.391	S	S	*	.	S	Bend	trans	-69.6	-20.2	175.2	58.9	-173.4	79.4	0	0	113.2
59	Q	69.6	Low	74.4	Confident	76 Å²	76	81.5 Å²	81.5	36%	0.355	40%	0.404	S	S	.	.			trans	-77.5	126.3	175.2	-63.2	-178.3	51.1	0	0	109.9	R46 C47 C57	R46-Q59 WeakPolarHBondContact CD-O 3.36Å; C47-Q59 HydrophobicContact CB-CB 4.33Å; C47-Q59 VanDerWaalsContact CB-CD 3.41Å; C47-Q59 HydrophobicContact CB-CG 4.24Å; C57-Q59 PolarHBondContact O-N 3.5Å
60	T	68.9	Low	74.5	Confident	114 Å²	114	79.9 Å²	79.9	70%	0.699	41%	0.405	S	S	*	.			trans	-84.8	-25.6	176.9	57.2	0	0	0	0	112.6
61	E	69.9	Low	75	Confident	111 Å²	111	77.1 Å²	77.1	52%	0.519	41%	0.412	S	S	.	.	S	Bend	trans	-87.6	133	-176.4	-60.3	-59.3	103.3	0	0	110.8	A63	E61-A63 PolarHBondContact O-N 3.44Å
62	D	69.8	Low	75.5	Confident	96 Å²	96	76.3 Å²	76.3	51%	0.513	39%	0.391	S	S	.	.	P	Polyproline II helix	trans	-68.3	119.3	171.1	-66.5	-61.4	0	0	0	109.4	R46	R46-D62 IonicContact NE-OD1 2.76Å
63	A	76.9	Confident	75.5	Confident	6 Å²	6	78.5 Å²	78.5	5%	0.05	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-81.7	142.4	172.5	0	0	0	0	0	110.3	R46 E61 Y65	R46-A63 WeakPolarHBondContact O-CB 3.18Å; R46-A63 PolarHBondContact O-N 3.27Å; E61-A63 PolarHBondContact O-N 3.44Å; A63-Y65 PolarHBondContact O-N 2.82Å
64	C	79	Confident	75.6	Confident	0 Å²	0	77.7 Å²	77.7	0%	0	40%	0.403	C	S	.	.	P	Polyproline II helix	trans	-57.1	123.9	171.5	171.7	0	0	0	0	110.9	N66 C67 H68 R69 H72 C77	C64-N66 PolarHBondContact O-N 3.44Å; C64-N66 PolarHBondContact SG-N 3.14Å; C64-N66 VanDerWaalsContact SG-N 3.39Å; C64-C67 PolarHBondContact O-N 2.9Å; C64-C67 VanDerWaalsContact SG-SG 3.67Å; C64-H68 WeakPolarHBondContact O-CA 3.17Å; C64-H68 PolarHBondContact O-N 3.05Å; C64-R69 VanDerWaalsContact CB-O 3.31Å; C64-R69 WeakPolarHBondContact CB-O 3.31Å; C64-R69 PolarHBondContact N-O 2.97Å; C64-H72 WeakPolarHBondContact CB-NE2 3.38Å; C64-H72 WeakPolarHBondContact CB-O 3.33Å; C64-H72 PolarHBondContact N-O 3.5Å; C64-H72 PolarHBondContact SG-NE2 2.76Å; C64-H72 VanDerWaalsContact SG-NE2 3.36Å; C64-C77 VanDerWaalsContact SG-CB 3.54Å
65	Y	73.3	Confident	76	Confident	130 Å²	130	86.4 Å²	86.4	51%	0.51	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	-10.7	178.9	-56.5	-91.6	0	0	0	114.9	Y45 A63 S74	Y45-Y65 HydrophobicContact CD1-CE1 4.16Å; Y45-Y65 WeakPolarHBondContact O-CE1 2.86Å; Y45-Y65 VanDerWaalsContact O-CZ 3.26Å; Y45-Y65 PolarHBondContact O-OH 3.1Å; Y45-Y65 VanDerWaalsContact O-OH 3.08Å; A63-Y65 PolarHBondContact O-N 2.82Å; Y65-S74 WeakPolarHBondContact CA-OG 3.32Å; Y65-S74 WeakPolarHBondContact CB-OG 3.36Å; Y65-S74 WeakPolarHBondContact CD2-OG 3.48Å; Y65-S74 PolarHBondContact N-OG 3Å
66	N	76.1	Confident	76.3	Confident	22 Å²	22	81.4 Å²	81.4	12%	0.118	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.4	-57.2	176.7	-174.8	38.4	0	0	0	111.3	C64 C77 E79 P80 K81 K82	C64-N66 PolarHBondContact O-N 3.44Å; C64-N66 PolarHBondContact SG-N 3.14Å; C64-N66 VanDerWaalsContact SG-N 3.39Å; N66-C77 HydrophobicContact CB-CB 4.33Å; N66-C77 PolarHBondContact ND2-SG 2.89Å; N66-C77 VanDerWaalsContact ND2-SG 3.45Å; N66-E79 PolarHBondContact ND2-O 3.21Å; N66-P80 PolarHBondContact ND2-O 3.46Å; N66-K81 WeakPolarHBondContact OD1-CA 3.38Å; N66-K82 PolarHBondContact OD1-N 3.42Å
67	C	78.5	Confident	76.7	Confident	12 Å²	12	77.6 Å²	77.6	8%	0.081	40%	0.399	C	S	.	.	T	Hydrogen-bonded Turn	trans	-104.5	-4.1	-172.9	71	0	0	0	0	114.9	C64 R69 H72 E79	C64-C67 PolarHBondContact O-N 2.9Å; C64-C67 VanDerWaalsContact SG-SG 3.67Å; C67-R69 PolarHBondContact O-N 3.28Å; C67-R69 VanDerWaalsContact O-N 3.13Å; C67-H72 PolarHBondContact SG-CE1 3.39Å; C67-H72 PolarHBondContact SG-NE2 2.82Å; C67-E79 HydrophobicContact CB-CG 4.38Å; C67-E79 WeakPolarHBondContact CB-OE2 3.11Å
68	H	73	Confident	77	Confident	75 Å²	75	86.9 Å²	86.9	35%	0.347	44%	0.438	S	S	.	.			trans	55.9	23.8	-177	-51.4	82.7	0	0	0	114.1	C64 R84	C64-H68 WeakPolarHBondContact O-CA 3.17Å; C64-H68 PolarHBondContact O-N 3.05Å; H68-R84 PolarHBondContact CE1-NH2 3.43Å; H68-R84 PolarHBondContact NE2-NH2 3.38Å; H68-R84 VanDerWaalsContact NE2-NH2 3.1Å
69	R	76.5	Confident	76.9	Confident	131 Å²	131	81.2 Å²	81.2	49%	0.494	41%	0.411	S	S	.	.			trans	-97.3	140.5	171.3	-63.4	-165.9	-71.4	-102.5	7.9	109.5	C64 C67 E79	C64-R69 VanDerWaalsContact CB-O 3.31Å; C64-R69 WeakPolarHBondContact CB-O 3.31Å; C64-R69 PolarHBondContact N-O 2.97Å; C67-R69 PolarHBondContact O-N 3.28Å; C67-R69 VanDerWaalsContact O-N 3.13Å; R69-E79 IonicContact CZ-OE1 3.36Å; R69-E79 VanDerWaalsContact CZ-OE1 3.28Å; R69-E79 IonicContact CZ-OE2 2.88Å; R69-E79 IonicContact NH1-OE1 3.79Å; R69-E79 PolarHBondContact NH1-OE1 3.37Å; R69-E79 IonicContact NH1-OE2 3.93Å; R69-E79 PolarHBondContact NH1-OE2 2.76Å; R69-E79 VanDerWaalsContact NH2-CG 3.33Å; R69-E79 IonicContact NH2-OE1 2.87Å; R69-E79 PolarHBondContact NH2-OE1 3.16Å; R69-E79 IonicContact NH2-OE2 3.28Å
70	S	76.8	Confident	77.2	Confident	73 Å²	73	82.8 Å²	82.8	51%	0.51	43%	0.428	S	S	.	.	S	Bend	trans	-72.9	168.6	173.1	51.9	0	0	0	0	111.6
71	G	80.6	Confident	77.2	Confident	75 Å²	75	86 Å²	86	77%	0.773	43%	0.432	S	S	*	.	S	Bend	trans	88.6	-0.8	176.9	0	0	0	0	0	115.6
72	H	84.4	Confident	76.9	Confident	47 Å²	47	87.2 Å²	87.2	22%	0.218	44%	0.436	C	S	.	.	S	Bend	trans	-156.9	155.9	170.6	65.7	-74.5	0	0	0	111.5	C64 C67 D76 C77	C64-H72 WeakPolarHBondContact CB-NE2 3.38Å; C64-H72 WeakPolarHBondContact CB-O 3.33Å; C64-H72 PolarHBondContact N-O 3.5Å; C64-H72 PolarHBondContact SG-NE2 2.76Å; C64-H72 VanDerWaalsContact SG-NE2 3.36Å; C67-H72 PolarHBondContact SG-CE1 3.39Å; C67-H72 PolarHBondContact SG-NE2 2.82Å; H72-D76 HydrophobicContact CB-CB 4.21Å; H72-C77 VanDerWaalsContact CD2-CA 3.41Å; H72-C77 WeakPolarHBondContact CD2-CA 2.95Å; H72-C77 PolarHBondContact NE2-SG 3.13Å; H72-C77 VanDerWaalsContact NE2-SG 3.37Å
73	I	80.7	Confident	76.2	Confident	91 Å²	91	91.8 Å²	91.8	47%	0.467	45%	0.454	S	S	.	.			trans	-89.6	165.4	171.4	60.2	168.4	0	0	0	110.6	R75 D76 C77	I73-R75 HydrophobicContact CD1-CB 3.92Å; I73-R75 HydrophobicContact CG1-CB 4.1Å; I73-R75 PolarHBondContact O-N 3.18Å; I73-D76 WeakPolarHBondContact CG1-OD2 3.32Å; I73-D76 PolarHBondContact O-N 3.08Å; I73-C77 PolarHBondContact O-N 3.27Å
74	S	77.1	Confident	75.2	Confident	46 Å²	46	97.8 Å²	97.8	32%	0.322	48%	0.475	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.5	-22.4	-179.8	-56.2	0	0	0	0	115.2	Y65	Y65-S74 WeakPolarHBondContact CA-OG 3.32Å; Y65-S74 WeakPolarHBondContact CB-OG 3.36Å; Y65-S74 WeakPolarHBondContact CD2-OG 3.48Å; Y65-S74 PolarHBondContact N-OG 3Å
75	R	79.2	Confident	74.2	Confident	214 Å²	214	104.8 Å²	104.8	81%	0.808	51%	0.508	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.9	-29.5	177.3	-158.4	174	69.1	167	3.4	112.8	I73	I73-R75 HydrophobicContact CD1-CB 3.92Å; I73-R75 HydrophobicContact CG1-CB 4.1Å; I73-R75 PolarHBondContact O-N 3.18Å
76	D	80.7	Confident	73.6	Confident	95 Å²	95	104.7 Å²	104.7	51%	0.508	51%	0.512	S	S	.	.	S	Bend	trans	-102.7	10.3	-177.6	-59.2	-72.6	0	0	0	111.8	H72 I73 K78	H72-D76 HydrophobicContact CB-CB 4.21Å; I73-D76 WeakPolarHBondContact CG1-OD2 3.32Å; I73-D76 PolarHBondContact O-N 3.08Å; D76-K78 PolarHBondContact O-N 2.88Å
77	C	82.8	Confident	73	Confident	22 Å²	22	106.7 Å²	106.7	15%	0.149	53%	0.527	C	S	.	.			trans	-75	117.7	179.3	-166.8	0	0	0	0	110.8	C64 N66 H72 I73 E79	C64-C77 VanDerWaalsContact SG-CB 3.54Å; N66-C77 HydrophobicContact CB-CB 4.33Å; N66-C77 PolarHBondContact ND2-SG 2.89Å; N66-C77 VanDerWaalsContact ND2-SG 3.45Å; H72-C77 VanDerWaalsContact CD2-CA 3.41Å; H72-C77 WeakPolarHBondContact CD2-CA 2.95Å; H72-C77 PolarHBondContact NE2-SG 3.13Å; H72-C77 VanDerWaalsContact NE2-SG 3.37Å; I73-C77 PolarHBondContact O-N 3.27Å; C77-E79 VanDerWaalsContact C-N 3.28Å
78	K	84.8	Confident	72.4	Confident	210 Å²	210	106.1 Å²	106.1	91%	0.913	52%	0.524	S	S	*	.			trans	-78.8	-10.6	176.3	-62.5	-176.3	-179.5	179.7	0	113.4	D76	D76-K78 PolarHBondContact O-N 2.88Å
79	E	77.4	Confident	71.9	Confident	60 Å²	60	111.2 Å²	111.2	28%	0.28	54%	0.541	S	S	.	.	S	Bend	trans	-76.9	145.2	175.1	-64.9	-158.2	144.3	0	0	110.6	N66 C67 R69 C77 K81	N66-E79 PolarHBondContact ND2-O 3.21Å; C67-E79 HydrophobicContact CB-CG 4.38Å; C67-E79 WeakPolarHBondContact CB-OE2 3.11Å; R69-E79 IonicContact CZ-OE1 3.36Å; R69-E79 VanDerWaalsContact CZ-OE1 3.28Å; R69-E79 IonicContact CZ-OE2 2.88Å; R69-E79 IonicContact NH1-OE1 3.79Å; R69-E79 PolarHBondContact NH1-OE1 3.37Å; R69-E79 IonicContact NH1-OE2 3.93Å; R69-E79 PolarHBondContact NH1-OE2 2.76Å; R69-E79 VanDerWaalsContact NH2-CG 3.33Å; R69-E79 IonicContact NH2-OE1 2.87Å; R69-E79 PolarHBondContact NH2-OE1 3.16Å; R69-E79 IonicContact NH2-OE2 3.28Å; C77-E79 VanDerWaalsContact C-N 3.28Å; E79-K81 PolarHBondContact O-N 2.99Å
80	P	75.3	Confident	71.1	Confident	109 Å²	109	107.1 Å²	107.1	71%	0.708	53%	0.532	S	S	*	.			trans	-53.9	144.4	170.9	25	-33.7	0	0	0	109	N66 K82	N66-P80 PolarHBondContact ND2-O 3.46Å; P80-K82 PolarHBondContact O-N 3.21Å
81	K	67.7	Low	70.4	Confident	182 Å²	182	105.6 Å²	105.6	79%	0.791	52%	0.521	S	S	*	.			trans	-57.7	109.7	175.7	-70	-179.7	-178	174.7	0	107.1	N66 E79 E83	N66-K81 WeakPolarHBondContact OD1-CA 3.38Å; E79-K81 PolarHBondContact O-N 2.99Å; K81-E83 PolarHBondContact O-N 3.46Å
82	K	63.5	Low	69.4	Low	135 Å²	135	104.6 Å²	104.6	59%	0.587	51%	0.511	S	S	*	.			trans	-59.6	128.8	170.7	-76.8	-173.7	177.5	179.9	0	105	N66 P80 R84	N66-K82 PolarHBondContact OD1-N 3.42Å; P80-K82 PolarHBondContact O-N 3.21Å; K82-R84 PolarHBondContact O-N 3.36Å
83	E	56.4	Low	68.4	Low	193 Å²	193	107.1 Å²	107.1	90%	0.902	52%	0.521	S	S	*	.			trans	-69.3	61	172.4	-55.4	-172.8	101.5	0	0	108	K81 E85	K81-E83 PolarHBondContact O-N 3.46Å; E83-E85 PolarHBondContact O-N 2.1Å
84	R	56.3	Low	67.7	Low	131 Å²	131	104.7 Å²	104.7	49%	0.494	52%	0.515	S	S	.	.			trans	-63.1	102.8	156	-177.6	-171.8	-85.4	-104.8	11.1	102.1	H68 K82 Q86	H68-R84 PolarHBondContact CE1-NH2 3.43Å; H68-R84 PolarHBondContact NE2-NH2 3.38Å; H68-R84 VanDerWaalsContact NE2-NH2 3.1Å; K82-R84 PolarHBondContact O-N 3.36Å; R84-Q86 WeakPolarHBondContact O-CA 3.26Å; R84-Q86 PolarHBondContact O-N 3.27Å
85	E	56.5	Low	67.5	Low	147 Å²	147	106 Å²	106	69%	0.687	54%	0.536	S	S	*	.			trans	-25.5	102.9	171.5	-73	177.8	91.2	0	0	108.4	E83 C87 A94	E83-E85 PolarHBondContact O-N 2.1Å; E85-C87 PolarHBondContact O-N 3.33Å; E85-C87 PolarHBondContact O-SG 3.4Å; E85-C87 VanDerWaalsContact O-SG 3.39Å; E85-A94 HydrophobicContact CB-CB 3.7Å; E85-A94 HydrophobicContact CG-CB 4.34Å
86	Q	61.1	Low	67.2	Low	128 Å²	128	97.6 Å²	97.6	60%	0.598	51%	0.506	S	S	*	.			trans	-64.9	95.1	-173.2	-81.3	-172.9	-40.1	0	0	106.5	R84 C88 A94 G95	R84-Q86 WeakPolarHBondContact O-CA 3.26Å; R84-Q86 PolarHBondContact O-N 3.27Å; Q86-C88 PolarHBondContact O-N 3.04Å; Q86-A94 WeakPolarHBondContact O-CA 3.48Å; Q86-G95 PolarHBondContact O-N 3.22Å
87	C	63.9	Low	66.7	Low	64 Å²	64	95.5 Å²	95.5	43%	0.432	50%	0.496	S	S	.	.			trans	-73.7	122.8	175.9	-67.8	0	0	0	0	107.1	E85 Y89 K93	E85-C87 PolarHBondContact O-N 3.33Å; E85-C87 PolarHBondContact O-SG 3.4Å; E85-C87 VanDerWaalsContact O-SG 3.39Å; C87-Y89 PolarHBondContact O-N 2.79Å; C87-Y89 VanDerWaalsContact O-N 3.14Å; C87-K93 CarbonylContact C-O 3.54Å; C87-K93 WeakPolarHBondContact CA-O 3.16Å
88	C	65.8	Low	65.9	Low	1 Å²	1	96.3 Å²	96.3	1%	0.007	50%	0.504	C	S	.	.			trans	-54.8	120.7	175.9	171.1	0	0	0	0	110.2	Q86 S90 C91 G92 K93 H96	Q86-C88 PolarHBondContact O-N 3.04Å; C88-S90 PolarHBondContact O-N 2.76Å; C88-S90 PolarHBondContact SG-N 3.37Å; C88-S90 VanDerWaalsContact SG-N 3.44Å; C88-C91 WeakPolarHBondContact CB-SG 3.33Å; C88-C91 PolarHBondContact O-N 3.29Å; C88-C91 PolarHBondContact SG-N 2.77Å; C88-G92 WeakPolarHBondContact O-CA 3.14Å; C88-G92 PolarHBondContact O-N 3.34Å; C88-K93 WeakPolarHBondContact CB-O 3.39Å; C88-K93 PolarHBondContact N-O 3.06Å; C88-H96 WeakPolarHBondContact CA-O 3.2Å; C88-H96 WeakPolarHBondContact CB-NE2 3.38Å; C88-H96 WeakPolarHBondContact CB-O 3.35Å; C88-H96 PolarHBondContact N-O 3.41Å; C88-H96 PolarHBondContact SG-NE2 3.43Å; C88-H96 VanDerWaalsContact SG-NE2 3.38Å
89	Y	63.5	Low	65	Low	181 Å²	181	97.5 Å²	97.5	71%	0.71	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.4	-14	179.2	-64.4	-81.7	0	0	0	114	C87	C87-Y89 PolarHBondContact O-N 2.79Å; C87-Y89 VanDerWaalsContact O-N 3.14Å
90	S	59.4	Low	64.3	Low	45 Å²	45	99.7 Å²	99.7	32%	0.315	52%	0.517	S	S	.	.	T	Hydrogen-bonded Turn	trans	-92.5	-43.2	177.7	-62.9	0	0	0	0	113.7	C88 Q107	C88-S90 PolarHBondContact O-N 2.76Å; C88-S90 PolarHBondContact SG-N 3.37Å; C88-S90 VanDerWaalsContact SG-N 3.44Å; S90-Q107 PolarHBondContact OG-NE2 3.29Å
91	C	62.4	Low	63.9	Low	41 Å²	41	95 Å²	95	28%	0.277	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-116	-9	-174.2	74.6	0	0	0	0	114.8	C88 K93 H96 H103	C88-C91 WeakPolarHBondContact CB-SG 3.33Å; C88-C91 PolarHBondContact O-N 3.29Å; C88-C91 PolarHBondContact SG-N 2.77Å; C91-K93 PolarHBondContact O-N 3.22Å; C91-H96 VanDerWaalsContact SG-CE1 3.58Å; C91-H96 PolarHBondContact SG-NE2 3.07Å; C91-H96 VanDerWaalsContact SG-NE2 3.37Å; C91-H103 HydrophobicContact CB-CB 4.44Å
92	G	59.4	Low	63.9	Low	54 Å²	54	94 Å²	94	56%	0.557	49%	0.49	S	S	*	.			trans	75.5	-2.8	179.6	0	0	0	0	0	115.4	C88	C88-G92 WeakPolarHBondContact O-CA 3.14Å; C88-G92 PolarHBondContact O-N 3.34Å
93	K	63.1	Low	63.7	Low	101 Å²	101	90.8 Å²	90.8	44%	0.439	48%	0.477	S	S	.	.			trans	-83.7	140.6	177.5	-62.7	-179.5	-175.4	170.6	0	111.4	C87 C88 C91 H103	C87-K93 CarbonylContact C-O 3.54Å; C87-K93 WeakPolarHBondContact CA-O 3.16Å; C88-K93 WeakPolarHBondContact CB-O 3.39Å; C88-K93 PolarHBondContact N-O 3.06Å; C91-K93 PolarHBondContact O-N 3.22Å; K93-H103 PolarHBondContact NZ-NE2 3.28Å
94	A	65.8	Low	63.6	Low	40 Å²	40	84.4 Å²	84.4	33%	0.331	46%	0.457	S	S	.	.	S	Bend	trans	-67.2	160.4	174.1	0	0	0	0	0	113	E85 Q86	E85-A94 HydrophobicContact CB-CB 3.7Å; E85-A94 HydrophobicContact CG-CB 4.34Å; Q86-A94 WeakPolarHBondContact O-CA 3.48Å
95	G	71.8	Confident	63.4	Low	74 Å²	74	84 Å²	84	76%	0.763	46%	0.464	S	S	*	.	S	Bend	trans	96.7	0.6	168.2	0	0	0	0	0	115.8	Q86	Q86-G95 PolarHBondContact O-N 3.22Å
96	H	73.8	Confident	63.4	Low	37 Å²	37	81.7 Å²	81.7	17%	0.171	45%	0.454	C	S	.	.	S	Bend	trans	-157.5	156.4	173.6	62.9	-78.8	0	0	0	111.7	C88 C91 D100 C101	C88-H96 WeakPolarHBondContact CA-O 3.2Å; C88-H96 WeakPolarHBondContact CB-NE2 3.38Å; C88-H96 WeakPolarHBondContact CB-O 3.35Å; C88-H96 PolarHBondContact N-O 3.41Å; C88-H96 PolarHBondContact SG-NE2 3.43Å; C88-H96 VanDerWaalsContact SG-NE2 3.38Å; C91-H96 VanDerWaalsContact SG-CE1 3.58Å; C91-H96 PolarHBondContact SG-NE2 3.07Å; C91-H96 VanDerWaalsContact SG-NE2 3.37Å; H96-D100 HydrophobicContact CB-CB 4.5Å; H96-C101 WeakPolarHBondContact CD2-CA 3.42Å; H96-C101 PolarHBondContact NE2-SG 3.34Å
97	V	69.4	Low	63.3	Low	51 Å²	51	77.5 Å²	77.5	31%	0.309	43%	0.434	S	S	.	.			trans	-89.1	163.3	173.2	-64.8	0	0	0	0	111	R99 D100 C101	V97-R99 HydrophobicContact CG2-CB 4.36Å; V97-R99 PolarHBondContact O-N 2.84Å; V97-D100 HydrophobicContact CG2-CB 4.31Å; V97-D100 WeakPolarHBondContact CG2-OD2 3.36Å; V97-D100 CarbonylContact O-C 3.54Å; V97-D100 PolarHBondContact O-N 3.15Å; V97-C101 PolarHBondContact O-N 3.09Å
98	A	65.7	Low	63.2	Low	39 Å²	39	80.6 Å²	80.6	32%	0.322	44%	0.44	S	S	.	.	G	3₁₀ helix	trans	-56.2	-24.7	-177.1	0	0	0	0	0	114.8
99	R	66	Low	63.2	Low	234 Å²	234	80.7 Å²	80.7	88%	0.883	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-74.1	-30.4	174.9	-90.1	177.1	56.2	-179.3	-4.2	113.8	V97	V97-R99 HydrophobicContact CG2-CB 4.36Å; V97-R99 PolarHBondContact O-N 2.84Å
100	D	62.9	Low	63.4	Low	107 Å²	107	77.6 Å²	77.6	57%	0.572	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-106.1	25.7	-175.4	-59	-79.5	0	0	0	110.5	H96 V97 D102	H96-D100 HydrophobicContact CB-CB 4.5Å; V97-D100 HydrophobicContact CG2-CB 4.31Å; V97-D100 WeakPolarHBondContact CG2-OD2 3.36Å; V97-D100 CarbonylContact O-C 3.54Å; V97-D100 PolarHBondContact O-N 3.15Å; D100-D102 PolarHBondContact O-N 3.12Å
101	C	67.8	Low	63.6	Low	11 Å²	11	77.7 Å²	77.7	7%	0.074	43%	0.43	C	S	.	.			trans	-83	100.8	-178.5	-170.3	0	0	0	0	111	H96 V97 H103 A104	H96-C101 WeakPolarHBondContact CD2-CA 3.42Å; H96-C101 PolarHBondContact NE2-SG 3.34Å; V97-C101 PolarHBondContact O-N 3.09Å; C101-H103 PolarHBondContact O-N 3.29Å; C101-H103 VanDerWaalsContact O-N 3.15Å; C101-A104 WeakPolarHBondContact O-CB 3.34Å; C101-A104 PolarHBondContact O-N 2.75Å
102	D	66.8	Low	63.5	Low	160 Å²	160	77.8 Å²	77.8	86%	0.856	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-60	-20.9	172.2	-126	-96.6	0	0	0	112.7	D100 A104	D100-D102 PolarHBondContact O-N 3.12Å; D102-A104 PolarHBondContact O-N 3.29Å
103	H	59.3	Low	63.7	Low	68 Å²	68	77.2 Å²	77.2	32%	0.315	42%	0.424	S	S	.	.	G	3₁₀ helix	trans	-86.2	24.5	174.2	-56.3	87.7	0	0	0	113.1	C91 K93 C101 N105 E106	C91-H103 HydrophobicContact CB-CB 4.44Å; K93-H103 PolarHBondContact NZ-NE2 3.28Å; C101-H103 PolarHBondContact O-N 3.29Å; C101-H103 VanDerWaalsContact O-N 3.15Å; H103-N105 PolarHBondContact O-N 3.27Å; H103-E106 HydrophobicContact CB-CB 4.44Å; H103-E106 HydrophobicContact CB-CG 4.4Å; H103-E106 WeakPolarHBondContact CB-OE2 3.25Å; H103-E106 IonicContact CD2-OE2 3.73Å; H103-E106 PolarHBondContact CD2-OE2 3.25Å; H103-E106 IonicContact CG-OE2 3.43Å; H103-E106 IonicContact NE2-OE2 3.51Å; H103-E106 PolarHBondContact O-N 2.88Å
104	A	53.9	Low	63.5	Low	58 Å²	58	73.4 Å²	73.4	48%	0.479	41%	0.414	S	S	.	.	G	3₁₀ helix	trans	-55.5	-22.2	173.1	0	0	0	0	0	112.8	C101 D102 E106 Q107	C101-A104 WeakPolarHBondContact O-CB 3.34Å; C101-A104 PolarHBondContact O-N 2.75Å; D102-A104 PolarHBondContact O-N 3.29Å; A104-E106 VanDerWaalsContact C-N 3.34Å; A104-Q107 WeakPolarHBondContact O-CB 3.48Å; A104-Q107 WeakPolarHBondContact O-CG 3.29Å; A104-Q107 PolarHBondContact O-N 2.83Å
105	N	52.2	Low	63.2	Low	122 Å²	122	77.2 Å²	77.2	65%	0.652	42%	0.423	S	S	*	.	G	3₁₀ helix	trans	-78.6	-17.1	176.1	-146	-11.4	0	0	0	113.4	H103 Q107 G116	H103-N105 PolarHBondContact O-N 3.27Å; N105-Q107 VanDerWaalsContact C-N 3.25Å; N105-G116 WeakPolarHBondContact O-CA 3.44Å; N105-G116 PolarHBondContact O-N 2.89Å; N105-G116 WeakPolarHBondContact OD1-CA 2.99Å
106	E	57.7	Low	62.9	Low	99 Å²	99	75.8 Å²	75.8	46%	0.463	41%	0.408	S	S	.	.	G	3₁₀ helix	trans	-86.8	6.4	169.5	-60.5	-173	98	0	0	112.4	H103 A104 K108 F115	H103-E106 HydrophobicContact CB-CB 4.44Å; H103-E106 HydrophobicContact CB-CG 4.4Å; H103-E106 WeakPolarHBondContact CB-OE2 3.25Å; H103-E106 IonicContact CD2-OE2 3.73Å; H103-E106 PolarHBondContact CD2-OE2 3.25Å; H103-E106 IonicContact CG-OE2 3.43Å; H103-E106 IonicContact NE2-OE2 3.51Å; H103-E106 PolarHBondContact O-N 2.88Å; A104-E106 VanDerWaalsContact C-N 3.34Å; E106-K108 PolarHBondContact O-N 2.97Å; E106-F115 WeakPolarHBondContact O-CD1 3.25Å
107	Q	59.7	Low	62.7	Low	40 Å²	40	75.6 Å²	75.6	19%	0.187	41%	0.407	C	S	.	.			trans	-57.1	111.8	172.9	-71.3	-97.7	-29.6	0	0	109.1	S90 A104 N105 C109	S90-Q107 PolarHBondContact OG-NE2 3.29Å; A104-Q107 WeakPolarHBondContact O-CB 3.48Å; A104-Q107 WeakPolarHBondContact O-CG 3.29Å; A104-Q107 PolarHBondContact O-N 2.83Å; N105-Q107 VanDerWaalsContact C-N 3.25Å; Q107-C109 PolarHBondContact O-N 3.44Å
108	K	60.5	Low	62.6	Low	129 Å²	129	77 Å²	77	56%	0.561	41%	0.412	S	S	*	.			trans	-70.7	122.7	169.4	-65.3	-170.9	-147.5	-159.4	0	108.5	E106 Y110 G114 F115	E106-K108 PolarHBondContact O-N 2.97Å; K108-Y110 PolarHBondContact O-N 2.82Å; K108-Y110 VanDerWaalsContact O-N 3.16Å; K108-G114 CarbonylContact C-O 3.58Å; K108-G114 WeakPolarHBondContact CA-O 3.49Å; K108-F115 HydrophobicContact CD-CD1 4.49Å; K108-F115 HydrophobicContact CD-CE1 3.74Å; K108-F115 HydrophobicContact CD-CE2 4.24Å; K108-F115 HydrophobicContact CD-CZ 3.59Å; K108-F115 HydrophobicContact CG-CD1 3.61Å; K108-F115 HydrophobicContact CG-CD2 4.48Å; K108-F115 HydrophobicContact CG-CE1 3.29Å; K108-F115 HydrophobicContact CG-CE2 4.19Å; K108-F115 HydrophobicContact CG-CG 4.23Å; K108-F115 HydrophobicContact CG-CZ 3.62Å
109	C	66.2	Low	62.5	Low	4 Å²	4	80.1 Å²	80.1	3%	0.027	42%	0.42	C	S	.	.			trans	-57.3	121.8	173	174.5	0	0	0	0	110.6	Q107 S111 C112 G113 G114 H117 C122	Q107-C109 PolarHBondContact O-N 3.44Å; C109-S111 PolarHBondContact O-N 2.83Å; C109-S111 PolarHBondContact SG-N 2.98Å; C109-C112 VanDerWaalsContact CB-SG 3.5Å; C109-C112 PolarHBondContact O-N 3.23Å; C109-C112 PolarHBondContact SG-SG 3.34Å; C109-G113 WeakPolarHBondContact O-CA 3.31Å; C109-G113 PolarHBondContact O-N 3.21Å; C109-G114 PolarHBondContact N-O 3.37Å; C109-H117 WeakPolarHBondContact CB-NE2 3.05Å; C109-H117 WeakPolarHBondContact CB-O 3.12Å; C109-C122 WeakPolarHBondContact SG-CB 3.35Å
110	Y	67.1	Low	62.4	Low	115 Å²	115	78.1 Å²	78.1	45%	0.451	42%	0.418	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	-15.7	178.7	-67.5	-85.7	0	0	0	114.5	R34 K108	R34-Y110 PolarHBondContact NH1-O 3.4Å; R34-Y110 PolarHBondContact NH2-O 3.47Å; K108-Y110 PolarHBondContact O-N 2.82Å; K108-Y110 VanDerWaalsContact O-N 3.16Å
111	S	63.2	Low	62.5	Low	48 Å²	48	78.9 Å²	78.9	34%	0.336	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-45.8	176.3	-70.1	0	0	0	0	112.9	C109 Q119	C109-S111 PolarHBondContact O-N 2.83Å; C109-S111 PolarHBondContact SG-N 2.98Å; S111-Q119 WeakPolarHBondContact OG-CG 3.47Å; S111-Q119 PolarHBondContact OG-NE2 3.45Å
112	C	61.4	Low	62.5	Low	42 Å²	42	78.8 Å²	78.8	28%	0.284	42%	0.42	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.1	-5.6	-166.6	50.8	0	0	0	0	114	C109 G114 H117 C122 K124	C109-C112 VanDerWaalsContact CB-SG 3.5Å; C109-C112 PolarHBondContact O-N 3.23Å; C109-C112 PolarHBondContact SG-SG 3.34Å; C112-G114 PolarHBondContact O-N 3.43Å; C112-G114 VanDerWaalsContact O-N 3.07Å; C112-H117 PolarHBondContact SG-NE2 3.46Å; C112-C122 WeakPolarHBondContact CB-SG 3.37Å; C112-C122 WeakPolarHBondContact SG-CB 3.32Å; C112-C122 CovalentContact SG-SG 2.1Å; C112-C122 PolarHBondContact SG-SG 2.76Å; C112-K124 HydrophobicContact CB-CB 3.78Å
113	G	62.4	Low	62.5	Low	42 Å²	42	75.7 Å²	75.7	43%	0.433	40%	0.404	S	S	.	.			trans	70.4	-3.6	178.4	0	0	0	0	0	115	C109	C109-G113 WeakPolarHBondContact O-CA 3.31Å; C109-G113 PolarHBondContact O-N 3.21Å
114	G	59	Low	62.9	Low	21 Å²	21	78.8 Å²	78.8	22%	0.216	42%	0.416	C	S	.	.			trans	-71.8	154.2	174.9	0	0	0	0	0	112.2	K108 C109 C112	K108-G114 CarbonylContact C-O 3.58Å; K108-G114 WeakPolarHBondContact CA-O 3.49Å; C109-G114 PolarHBondContact N-O 3.37Å; C112-G114 PolarHBondContact O-N 3.43Å; C112-G114 VanDerWaalsContact O-N 3.07Å
115	F	60.1	Low	63.8	Low	121 Å²	121	77.5 Å²	77.5	53%	0.531	40%	0.403	S	S	.	.	S	Bend	trans	-94.6	163.6	178.8	-59.9	-100.2	0	0	0	110.3	E106 K108	E106-F115 WeakPolarHBondContact O-CD1 3.25Å; K108-F115 HydrophobicContact CD-CD1 4.49Å; K108-F115 HydrophobicContact CD-CE1 3.74Å; K108-F115 HydrophobicContact CD-CE2 4.24Å; K108-F115 HydrophobicContact CD-CZ 3.59Å; K108-F115 HydrophobicContact CG-CD1 3.61Å; K108-F115 HydrophobicContact CG-CD2 4.48Å; K108-F115 HydrophobicContact CG-CE1 3.29Å; K108-F115 HydrophobicContact CG-CE2 4.19Å; K108-F115 HydrophobicContact CG-CG 4.23Å; K108-F115 HydrophobicContact CG-CZ 3.62Å
116	G	66.6	Low	64.7	Low	43 Å²	43	78.6 Å²	78.6	44%	0.443	40%	0.402	S	S	.	.	S	Bend	trans	87.3	2.1	174.5	0	0	0	0	0	116.5	N105	N105-G116 WeakPolarHBondContact O-CA 3.44Å; N105-G116 PolarHBondContact O-N 2.89Å; N105-G116 WeakPolarHBondContact OD1-CA 2.99Å
117	H	69.6	Low	65.3	Low	34 Å²	34	74 Å²	74	16%	0.157	38%	0.38	C	S	.	.	S	Bend	trans	-156.5	155.9	175.4	65.5	-90.3	0	0	0	112.7	C109 C112 L121 C122	C109-H117 WeakPolarHBondContact CB-NE2 3.05Å; C109-H117 WeakPolarHBondContact CB-O 3.12Å; C112-H117 PolarHBondContact SG-NE2 3.46Å; H117-L121 HydrophobicContact CB-CB 4.38Å; H117-C122 WeakPolarHBondContact CD2-CA 3.46Å; H117-C122 WeakPolarHBondContact CD2-CB 3.4Å; H117-C122 WeakPolarHBondContact NE2-CA 3.46Å; H117-C122 WeakPolarHBondContact NE2-CB 3.18Å; H117-C122 PolarHBondContact NE2-SG 3.32Å; H117-C122 VanDerWaalsContact NE2-SG 3.38Å
118	I	66.9	Low	65.9	Low	79 Å²	79	80.4 Å²	80.4	41%	0.405	40%	0.404	S	S	.	.			trans	-91.1	163.6	175.6	59.6	167.9	0	0	0	111.7	K120 L121 C122	I118-K120 HydrophobicContact CD1-CB 4.18Å; I118-K120 HydrophobicContact CG1-CB 4.37Å; I118-K120 PolarHBondContact O-N 3.41Å; I118-L121 HydrophobicContact CD1-CD1 4.43Å; I118-L121 HydrophobicContact CG1-CB 4.34Å; I118-L121 HydrophobicContact CG1-CD1 4Å; I118-L121 HydrophobicContact CG1-CG 4.14Å; I118-L121 CarbonylContact O-C 3.58Å; I118-L121 WeakPolarHBondContact O-CA 3.31Å; I118-L121 PolarHBondContact O-N 3.17Å; I118-C122 PolarHBondContact O-N 3.46Å
119	Q	64.2	Low	66.3	Low	105 Å²	105	78.6 Å²	78.6	49%	0.491	39%	0.393	S	S	.	.	G	3₁₀ helix	trans	-50.1	-34.4	-179.1	171.3	169.1	78.4	0	0	114.3	S111 L121	S111-Q119 WeakPolarHBondContact OG-CG 3.47Å; S111-Q119 PolarHBondContact OG-NE2 3.45Å; Q119-L121 PolarHBondContact O-N 3.25Å
120	K	63.5	Low	66.5	Low	193 Å²	193	80.5 Å²	80.5	84%	0.839	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-69.5	-20.5	178.5	-65.9	-174.9	178.3	-177.5	0	113.9	I118	I118-K120 HydrophobicContact CD1-CB 4.18Å; I118-K120 HydrophobicContact CG1-CB 4.37Å; I118-K120 PolarHBondContact O-N 3.41Å
121	L	63.9	Low	66.6	Low	123 Å²	123	76.7 Å²	76.7	64%	0.644	40%	0.402	S	S	*	.	G	3₁₀ helix	trans	-117.7	13	-176.2	-61.7	170.8	0	0	0	111.6	H117 I118 Q119 D123	H117-L121 HydrophobicContact CB-CB 4.38Å; I118-L121 HydrophobicContact CD1-CD1 4.43Å; I118-L121 HydrophobicContact CG1-CB 4.34Å; I118-L121 HydrophobicContact CG1-CD1 4Å; I118-L121 HydrophobicContact CG1-CG 4.14Å; I118-L121 CarbonylContact O-C 3.58Å; I118-L121 WeakPolarHBondContact O-CA 3.31Å; I118-L121 PolarHBondContact O-N 3.17Å; Q119-L121 PolarHBondContact O-N 3.25Å; L121-D123 PolarHBondContact O-N 2.8Å
122	C	68.1	Low	67.2	Low	8 Å²	8	78.6 Å²	78.6	5%	0.054	41%	0.405	C	S	.	.			trans	-76.8	106.6	178.9	175.7	0	0	0	0	111.1	C109 C112 H117 I118 K124 V125	C109-C122 WeakPolarHBondContact SG-CB 3.35Å; C112-C122 WeakPolarHBondContact CB-SG 3.37Å; C112-C122 WeakPolarHBondContact SG-CB 3.32Å; C112-C122 CovalentContact SG-SG 2.1Å; C112-C122 PolarHBondContact SG-SG 2.76Å; H117-C122 WeakPolarHBondContact CD2-CA 3.46Å; H117-C122 WeakPolarHBondContact CD2-CB 3.4Å; H117-C122 WeakPolarHBondContact NE2-CA 3.46Å; H117-C122 WeakPolarHBondContact NE2-CB 3.18Å; H117-C122 PolarHBondContact NE2-SG 3.32Å; H117-C122 VanDerWaalsContact NE2-SG 3.38Å; I118-C122 PolarHBondContact O-N 3.46Å; C122-K124 PolarHBondContact O-N 3.26Å; C122-K124 PolarHBondContact SG-N 2.83Å; C122-K124 VanDerWaalsContact SG-N 3.36Å; C122-V125 WeakPolarHBondContact O-CB 3.48Å; C122-V125 VanDerWaalsContact O-CG1 3.25Å; C122-V125 WeakPolarHBondContact O-CG1 3.45Å; C122-V125 PolarHBondContact O-N 2.78Å; C122-V125 PolarHBondContact SG-N 2.91Å; C122-V125 VanDerWaalsContact SG-N 3.4Å
123	D	67.6	Low	67.9	Low	96 Å²	96	82.3 Å²	82.3	51%	0.513	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-24.4	168.1	46.1	-83.1	0	0	0	112.9	L121 V125 G134	L121-D123 PolarHBondContact O-N 2.8Å; D123-V125 VanDerWaalsContact C-N 3.25Å; D123-V125 PolarHBondContact O-N 3.22Å; D123-G134 WeakPolarHBondContact O-CA 3.44Å; D123-G134 PolarHBondContact O-N 3.47Å; D123-G134 VanDerWaalsContact O-N 3.12Å
124	K	66.6	Low	68.4	Low	132 Å²	132	82.9 Å²	82.9	57%	0.574	43%	0.427	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.3	16.1	174.4	-57.2	-170.6	-176.5	-175.8	0	114.1	C112 C122 K126	C112-K124 HydrophobicContact CB-CB 3.78Å; C122-K124 PolarHBondContact O-N 3.26Å; C122-K124 PolarHBondContact SG-N 2.83Å; C122-K124 VanDerWaalsContact SG-N 3.36Å; K124-K126 PolarHBondContact O-N 3.36Å
125	V	73.4	Confident	69.1	Low	32 Å²	32	83.9 Å²	83.9	19%	0.194	43%	0.426	C	S	.	.	P	Polyproline II helix	trans	-66.2	121.8	174.1	66.8	0	0	0	0	109.3	C122 D123 I133 G134 V136	C122-V125 WeakPolarHBondContact O-CB 3.48Å; C122-V125 VanDerWaalsContact O-CG1 3.25Å; C122-V125 WeakPolarHBondContact O-CG1 3.45Å; C122-V125 PolarHBondContact O-N 2.78Å; C122-V125 PolarHBondContact SG-N 2.91Å; C122-V125 VanDerWaalsContact SG-N 3.4Å; D123-V125 VanDerWaalsContact C-N 3.25Å; D123-V125 PolarHBondContact O-N 3.22Å; V125-I133 WeakPolarHBondContact O-CA 3.38Å; V125-G134 PolarHBondContact O-N 2.96Å; V125-V136 HydrophobicContact CG1-CG1 3.95Å
126	K	70.8	Confident	69.6	Low	145 Å²	145	81.2 Å²	81.2	63%	0.63	42%	0.419	S	S	*	.	B	Isolated β-bridge	trans	-78.5	118.4	173.7	-170.5	176.7	-176.4	176.3	0	108.6	K124 Y128 G131 I133	K124-K126 PolarHBondContact O-N 3.36Å; K126-Y128 PolarHBondContact O-N 2.83Å; K126-Y128 VanDerWaalsContact O-N 3.17Å; K126-G131 WeakPolarHBondContact CE-O 3.26Å; K126-G131 WeakPolarHBondContact CG-O 3.35Å; K126-I133 HydrophobicContact CB-CG2 4.22Å; K126-I133 HydrophobicContact CG-CG2 4.42Å
127	C	71.3	Confident	69.6	Low	1 Å²	1	79.3 Å²	79.3	1%	0.007	40%	0.399	C	S	.	.	P	Polyproline II helix	trans	-58.7	118.2	171.8	176	0	0	0	0	109.3	R129 C130 G131 E132 H135 A137	C127-R129 PolarHBondContact O-N 3.14Å; C127-R129 PolarHBondContact SG-N 2.76Å; C127-R129 VanDerWaalsContact SG-N 3.45Å; C127-C130 VanDerWaalsContact CB-SG 3.58Å; C127-C130 PolarHBondContact SG-N 3.13Å; C127-G131 WeakPolarHBondContact O-CA 3.02Å; C127-G131 PolarHBondContact O-N 3.48Å; C127-E132 VanDerWaalsContact CB-O 3.32Å; C127-E132 WeakPolarHBondContact CB-O 3.33Å; C127-E132 PolarHBondContact N-O 3.07Å; C127-H135 WeakPolarHBondContact CB-NE2 3.37Å; C127-H135 PolarHBondContact SG-NE2 3.2Å; C127-A137 VanDerWaalsContact SG-CA 3.51Å
128	Y	71.6	Confident	69.7	Low	175 Å²	175	83.4 Å²	83.4	69%	0.686	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-7.9	-179.4	63	-98.7	0	0	0	113.2	K126 A137	K126-Y128 PolarHBondContact O-N 2.83Å; K126-Y128 VanDerWaalsContact O-N 3.17Å; Y128-A137 HydrophobicContact CD1-CB 3.52Å; Y128-A137 HydrophobicContact CD2-CB 4.12Å; Y128-A137 HydrophobicContact CE1-CB 3.09Å; Y128-A137 HydrophobicContact CE2-CB 3.74Å; Y128-A137 HydrophobicContact CG-CB 4.01Å
129	R	68.5	Low	69.6	Low	92 Å²	92	86.4 Å²	86.4	35%	0.347	44%	0.439	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-45.2	176	-69.9	178.1	-177.3	169.7	-10.5	112.6	C127 A137 A143	C127-R129 PolarHBondContact O-N 3.14Å; C127-R129 PolarHBondContact SG-N 2.76Å; C127-R129 VanDerWaalsContact SG-N 3.45Å; R129-A137 HydrophobicContact CB-CB 4.36Å; R129-A137 HydrophobicContact CG-CB 3.85Å; R129-A137 PolarHBondContact NH1-O 3.48Å; R129-A143 HydrophobicContact CB-CB 4.15Å; R129-A143 HydrophobicContact CG-CB 4.45Å
130	C	71.1	Confident	69.9	Low	44 Å²	44	82 Å²	82	30%	0.297	42%	0.419	S	S	.	.	T	Hydrogen-bonded Turn	trans	-111.4	-9.4	-177.9	71.5	0	0	0	0	114.7	C127 E132 H135 C140 K142	C127-C130 VanDerWaalsContact CB-SG 3.58Å; C127-C130 PolarHBondContact SG-N 3.13Å; C130-E132 PolarHBondContact O-N 3.31Å; C130-E132 PolarHBondContact SG-N 3.47Å; C130-H135 VanDerWaalsContact SG-CE1 3.53Å; C130-H135 PolarHBondContact SG-NE2 2.8Å; C130-H135 VanDerWaalsContact SG-NE2 3.41Å; C130-C140 PolarHBondContact SG-SG 2.96Å; C130-K142 HydrophobicContact CB-CB 4.14Å; C130-K142 HydrophobicContact CB-CD 4.27Å
131	G	69.4	Low	70.3	Confident	34 Å²	34	78.7 Å²	78.7	35%	0.351	42%	0.42	S	S	.	.			trans	77.3	-0.7	-179.5	0	0	0	0	0	115.3	K126 C127	K126-G131 WeakPolarHBondContact CE-O 3.26Å; K126-G131 WeakPolarHBondContact CG-O 3.35Å; C127-G131 WeakPolarHBondContact O-CA 3.02Å; C127-G131 PolarHBondContact O-N 3.48Å
132	E	75.1	Confident	70.3	Confident	88 Å²	88	79.1 Å²	79.1	41%	0.411	42%	0.417	S	S	.	.			trans	-83.7	148.6	177.1	-65.4	-177.4	137.5	0	0	111.8	C127 C130 K142	C127-E132 VanDerWaalsContact CB-O 3.32Å; C127-E132 WeakPolarHBondContact CB-O 3.33Å; C127-E132 PolarHBondContact N-O 3.07Å; C130-E132 PolarHBondContact O-N 3.31Å; C130-E132 PolarHBondContact SG-N 3.47Å; E132-K142 IonicContact OE1-NZ 2.75Å; E132-K142 PolarHBondContact OE1-NZ 2.66Å; E132-K142 WeakPolarHBondContact OE2-CE 3.09Å; E132-K142 IonicContact OE2-NZ 2.76Å; E132-K142 PolarHBondContact OE2-NZ 3.4Å
133	I	75.2	Confident	69.9	Low	121 Å²	121	80.1 Å²	80.1	62%	0.621	43%	0.426	S	S	*	.	B	Isolated β-bridge	trans	-88.3	156.6	175.4	60.5	172.6	0	0	0	109.9	V125 K126	V125-I133 WeakPolarHBondContact O-CA 3.38Å; K126-I133 HydrophobicContact CB-CG2 4.22Å; K126-I133 HydrophobicContact CG-CG2 4.42Å
134	G	74.8	Confident	69.4	Low	53 Å²	53	80.9 Å²	80.9	55%	0.546	44%	0.439	S	S	.	.	S	Bend	trans	107.6	-7.2	176.1	0	0	0	0	0	115.5	D123 V125	D123-G134 WeakPolarHBondContact O-CA 3.44Å; D123-G134 PolarHBondContact O-N 3.47Å; D123-G134 VanDerWaalsContact O-N 3.12Å; V125-G134 PolarHBondContact O-N 2.96Å
135	H	73.4	Confident	69.1	Low	43 Å²	43	79.8 Å²	79.8	20%	0.199	44%	0.436	C	S	.	.	S	Bend	trans	-154.5	153.1	179	64.8	-83.8	0	0	0	112.6	C127 C130 C140	C127-H135 WeakPolarHBondContact CB-NE2 3.37Å; C127-H135 PolarHBondContact SG-NE2 3.2Å; C130-H135 VanDerWaalsContact SG-CE1 3.53Å; C130-H135 PolarHBondContact SG-NE2 2.8Å; C130-H135 VanDerWaalsContact SG-NE2 3.41Å; H135-C140 WeakPolarHBondContact NE2-CB 3.33Å; H135-C140 PolarHBondContact NE2-SG 3.13Å
136	V	69.9	Low	68.9	Low	65 Å²	65	80.5 Å²	80.5	39%	0.394	44%	0.44	S	S	.	.			trans	-79.1	149.9	170.9	-64.5	0	0	0	0	110.3	V125 V138 Q139 C140	V125-V136 HydrophobicContact CG1-CG1 3.95Å; V136-V138 HydrophobicContact CG2-CB 4.29Å; V136-V138 PolarHBondContact O-N 2.85Å; V136-Q139 HydrophobicContact CG2-CB 4.29Å; V136-Q139 HydrophobicContact CG2-CG 4.01Å; V136-Q139 CarbonylContact O-C 3.57Å; V136-Q139 WeakPolarHBondContact O-CA 3.37Å; V136-Q139 PolarHBondContact O-N 3.43Å; V136-C140 PolarHBondContact O-N 2.81Å
137	A	67.3	Low	68.7	Low	2 Å²	2	78.2 Å²	78.2	2%	0.017	44%	0.435	C	S	.	.	G	3₁₀ helix	trans	-57.8	-22.3	-176.4	0	0	0	0	0	115.5	C127 Y128 R129 Q139 C140	C127-A137 VanDerWaalsContact SG-CA 3.51Å; Y128-A137 HydrophobicContact CD1-CB 3.52Å; Y128-A137 HydrophobicContact CD2-CB 4.12Å; Y128-A137 HydrophobicContact CE1-CB 3.09Å; Y128-A137 HydrophobicContact CE2-CB 3.74Å; Y128-A137 HydrophobicContact CG-CB 4.01Å; R129-A137 HydrophobicContact CB-CB 4.36Å; R129-A137 HydrophobicContact CG-CB 3.85Å; R129-A137 PolarHBondContact NH1-O 3.48Å; A137-Q139 VanDerWaalsContact C-N 3.27Å; A137-C140 VanDerWaalsContact O-CB 3.31Å; A137-C140 WeakPolarHBondContact O-CB 3.16Å; A137-C140 PolarHBondContact O-N 3.42Å
138	V	70.5	Confident	68.8	Low	121 Å²	121	78.2 Å²	78.2	73%	0.733	44%	0.435	S	S	*	.	G	3₁₀ helix	trans	-66.5	-31.6	174.2	-178.9	0	0	0	0	111.5	V136	V136-V138 HydrophobicContact CG2-CB 4.29Å; V136-V138 PolarHBondContact O-N 2.85Å
139	Q	65.9	Low	68.9	Low	142 Å²	142	78.8 Å²	78.8	66%	0.664	44%	0.437	S	S	*	.	G	3₁₀ helix	trans	-102.6	20.5	179.8	-61.9	176.2	-59.6	0	0	111.7	V136 A137 S141	V136-Q139 HydrophobicContact CG2-CB 4.29Å; V136-Q139 HydrophobicContact CG2-CG 4.01Å; V136-Q139 CarbonylContact O-C 3.57Å; V136-Q139 WeakPolarHBondContact O-CA 3.37Å; V136-Q139 PolarHBondContact O-N 3.43Å; A137-Q139 VanDerWaalsContact C-N 3.27Å; Q139-S141 PolarHBondContact O-N 3.06Å
140	C	70.8	Confident	68.9	Low	12 Å²	12	79.2 Å²	79.2	8%	0.081	44%	0.441	C	S	.	.			trans	-83.3	106.7	-179.3	-175	0	0	0	0	110.9	C130 H135 V136 A137 K142 A143	C130-C140 PolarHBondContact SG-SG 2.96Å; H135-C140 WeakPolarHBondContact NE2-CB 3.33Å; H135-C140 PolarHBondContact NE2-SG 3.13Å; V136-C140 PolarHBondContact O-N 2.81Å; A137-C140 VanDerWaalsContact O-CB 3.31Å; A137-C140 WeakPolarHBondContact O-CB 3.16Å; A137-C140 PolarHBondContact O-N 3.42Å; C140-K142 PolarHBondContact O-N 3.15Å; C140-A143 HydrophobicContact CB-CB 4.2Å; C140-A143 PolarHBondContact O-N 3.4Å
141	S	70.4	Confident	69	Low	124 Å²	124	78.8 Å²	78.8	87%	0.867	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.8	-15.6	178.6	-42.5	0	0	0	0	114.1	Q139	Q139-S141 PolarHBondContact O-N 3.06Å
142	K	64.3	Low	68.9	Low	132 Å²	132	79.8 Å²	79.8	57%	0.574	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88	-12.6	178.1	-68.7	179.4	176.7	173.5	0	113.4	C130 E132 C140 S144	C130-K142 HydrophobicContact CB-CB 4.14Å; C130-K142 HydrophobicContact CB-CD 4.27Å; E132-K142 IonicContact OE1-NZ 2.75Å; E132-K142 PolarHBondContact OE1-NZ 2.66Å; E132-K142 WeakPolarHBondContact OE2-CE 3.09Å; E132-K142 IonicContact OE2-NZ 2.76Å; E132-K142 PolarHBondContact OE2-NZ 3.4Å; C140-K142 PolarHBondContact O-N 3.15Å; K142-S144 VanDerWaalsContact C-N 3.32Å; K142-S144 PolarHBondContact O-N 3.18Å; K142-S144 VanDerWaalsContact O-N 3.14Å
143	A	59.5	Low	68.7	Low	28 Å²	28	80 Å²	80	23%	0.231	45%	0.453	C	S	.	.			trans	-87.7	76.3	177.3	0	0	0	0	0	109.1	R129 C140 E145	R129-A143 HydrophobicContact CB-CB 4.15Å; R129-A143 HydrophobicContact CG-CB 4.45Å; C140-A143 HydrophobicContact CB-CB 4.2Å; C140-A143 PolarHBondContact O-N 3.4Å; A143-E145 PolarHBondContact O-N 3.09Å
144	S	57.8	Low	68.5	Low	113 Å²	113	77.3 Å²	77.3	79%	0.79	44%	0.442	S	S	*	.			trans	-66.5	-1.7	179.3	47.8	0	0	0	0	114.1	K142	K142-S144 VanDerWaalsContact C-N 3.32Å; K142-S144 PolarHBondContact O-N 3.18Å; K142-S144 VanDerWaalsContact O-N 3.14Å
145	E	60.7	Low	68.5	Low	109 Å²	109	78 Å²	78	51%	0.509	45%	0.449	S	S	.	.			trans	-138.7	106.2	178	-65.2	-170.3	93.3	0	0	111.7	A143 N147 T154	A143-E145 PolarHBondContact O-N 3.09Å; E145-N147 PolarHBondContact O-N 3.44Å; E145-N147 VanDerWaalsContact O-N 3.13Å; E145-N147 PolarHBondContact O-ND2 3.06Å; E145-T154 HydrophobicContact CB-CG2 3.87Å; E145-T154 HydrophobicContact CG-CG2 4.48Å; E145-T154 WeakPolarHBondContact OE1-CB 3.21Å; E145-T154 PolarHBondContact OE1-OG1 3.41Å; E145-T154 VanDerWaalsContact OE1-OG1 3.09Å
146	V	67.9	Low	68.6	Low	47 Å²	47	78.1 Å²	78.1	29%	0.285	45%	0.45	S	S	.	.			trans	-67.5	109.8	168.5	176.3	0	0	0	0	107.6	T154 G155 H156 L157	V146-T154 CarbonylContact O-C 3.45Å; V146-T154 WeakPolarHBondContact O-CA 3.42Å; V146-G155 PolarHBondContact O-N 2.91Å; V146-H156 WeakPolarHBondContact CG1-O 3.39Å; V146-L157 HydrophobicContact CG1-CD2 4.03Å; V146-L157 HydrophobicContact CG1-CG 3.98Å
147	N	67.4	Low	68.7	Low	97 Å²	97	79.5 Å²	79.5	52%	0.519	46%	0.455	S	S	.	.	B	Isolated β-bridge	trans	-87.2	126.6	176	-73.5	-93.6	0	0	0	109.9	E145 Y149 T154	E145-N147 PolarHBondContact O-N 3.44Å; E145-N147 VanDerWaalsContact O-N 3.13Å; E145-N147 PolarHBondContact O-ND2 3.06Å; N147-Y149 PolarHBondContact O-N 2.85Å; N147-T154 WeakPolarHBondContact OD1-CG2 3.47Å
148	C	73.8	Confident	69	Low	1 Å²	1	79.6 Å²	79.6	1%	0.007	46%	0.455	C	S	.	.			trans	-78.2	113.7	174.4	178.3	0	0	0	0	110	K150 C151 G152 N153 H156 C161	C148-K150 PolarHBondContact O-N 2.83Å; C148-K150 VanDerWaalsContact O-N 3.15Å; C148-C151 VanDerWaalsContact CB-SG 3.51Å; C148-C151 PolarHBondContact O-N 2.8Å; C148-C151 PolarHBondContact SG-SG 3.36Å; C148-G152 WeakPolarHBondContact O-CA 3.38Å; C148-G152 PolarHBondContact O-N 2.94Å; C148-N153 WeakPolarHBondContact CB-O 3.48Å; C148-N153 PolarHBondContact N-O 2.79Å; C148-H156 VanDerWaalsContact CB-NE2 3.26Å; C148-H156 WeakPolarHBondContact CB-NE2 3.46Å; C148-H156 PolarHBondContact SG-NE2 3.2Å; C148-C161 VanDerWaalsContact SG-CB 3.51Å
149	Y	72.4	Confident	69	Low	187 Å²	187	83.1 Å²	83.1	73%	0.733	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-8.1	-179.8	63.6	-102.1	0	0	0	114.3	N147 A158	N147-Y149 PolarHBondContact O-N 2.85Å; Y149-A158 HydrophobicContact CD1-CB 3.47Å; Y149-A158 VanDerWaalsContact CD1-CB 3.47Å; Y149-A158 HydrophobicContact CD2-CB 4.04Å; Y149-A158 HydrophobicContact CE1-CB 3.04Å; Y149-A158 HydrophobicContact CE2-CB 3.64Å; Y149-A158 HydrophobicContact CG-CB 3.96Å; Y149-A158 WeakPolarHBondContact OH-CB 3.37Å
150	K	68.9	Low	69.2	Low	101 Å²	101	82.9 Å²	82.9	44%	0.439	46%	0.459	S	S	.	.	T	Hydrogen-bonded Turn	trans	-86.7	-37.8	176.1	-73.7	-178.7	176.5	-172.8	0	112.7	C148 A158 C161	C148-K150 PolarHBondContact O-N 2.83Å; C148-K150 VanDerWaalsContact O-N 3.15Å; K150-A158 HydrophobicContact CD-CB 4.16Å; K150-A158 WeakPolarHBondContact CD-O 3.41Å; K150-A158 WeakPolarHBondContact CE-O 3.47Å; K150-A158 HydrophobicContact CG-CB 4.01Å; K150-A158 PolarHBondContact NZ-O 3.2Å; K150-C161 HydrophobicContact CB-CB 4.44Å; K150-C161 HydrophobicContact CD-CB 4.14Å
151	C	73.8	Confident	69.4	Low	34 Å²	34	83.1 Å²	83.1	23%	0.23	46%	0.461	C	S	.	.	T	Hydrogen-bonded Turn	trans	-122.8	-4.4	-173.5	66.3	0	0	0	0	114.3	C148 N153 H156 I163	C148-C151 VanDerWaalsContact CB-SG 3.51Å; C148-C151 PolarHBondContact O-N 2.8Å; C148-C151 PolarHBondContact SG-SG 3.36Å; C151-N153 PolarHBondContact O-N 3.31Å; C151-H156 VanDerWaalsContact SG-CE1 3.52Å; C151-H156 PolarHBondContact SG-NE2 2.75Å; C151-I163 HydrophobicContact CB-CB 4.19Å; C151-I163 HydrophobicContact CB-CD1 3.49Å; C151-I163 VanDerWaalsContact CB-CD1 3.49Å; C151-I163 HydrophobicContact CB-CG1 4.32Å
152	G	67.8	Low	69.7	Low	56 Å²	56	83.7 Å²	83.7	58%	0.577	46%	0.46	S	S	*	.			trans	75.6	-7.5	-179.7	0	0	0	0	0	115	C148	C148-G152 WeakPolarHBondContact O-CA 3.38Å; C148-G152 PolarHBondContact O-N 2.94Å
153	N	69.7	Low	70	Confident	92 Å²	92	81.3 Å²	81.3	49%	0.492	45%	0.452	S	S	.	.			trans	-80.3	148.1	-178.6	-66.3	-37.5	0	0	0	112.6	C148 C151	C148-N153 WeakPolarHBondContact CB-O 3.48Å; C148-N153 PolarHBondContact N-O 2.79Å; C151-N153 PolarHBondContact O-N 3.31Å
154	T	71.7	Confident	70.2	Confident	64 Å²	64	88.4 Å²	88.4	39%	0.393	48%	0.481	S	S	.	.	B	Isolated β-bridge	trans	-84.2	158	175.3	56.9	0	0	0	0	111.5	E145 V146 N147	E145-T154 HydrophobicContact CB-CG2 3.87Å; E145-T154 HydrophobicContact CG-CG2 4.48Å; E145-T154 WeakPolarHBondContact OE1-CB 3.21Å; E145-T154 PolarHBondContact OE1-OG1 3.41Å; E145-T154 VanDerWaalsContact OE1-OG1 3.09Å; V146-T154 CarbonylContact O-C 3.45Å; V146-T154 WeakPolarHBondContact O-CA 3.42Å; N147-T154 WeakPolarHBondContact OD1-CG2 3.47Å
155	G	74.9	Confident	70	Confident	68 Å²	68	86.3 Å²	86.3	70%	0.701	47%	0.47	S	S	*	.	S	Bend	trans	103.5	-5.5	170.8	0	0	0	0	0	116.6	V146	V146-G155 PolarHBondContact O-N 2.91Å
156	H	74.9	Confident	69.8	Low	45 Å²	45	87.9 Å²	87.9	21%	0.208	49%	0.487	C	S	.	.	S	Bend	trans	-149.7	155.2	178.9	66	-79.5	0	0	0	113.4	V146 C148 C151	V146-H156 WeakPolarHBondContact CG1-O 3.39Å; C148-H156 VanDerWaalsContact CB-NE2 3.26Å; C148-H156 WeakPolarHBondContact CB-NE2 3.46Å; C148-H156 PolarHBondContact SG-NE2 3.2Å; C151-H156 VanDerWaalsContact SG-CE1 3.52Å; C151-H156 PolarHBondContact SG-NE2 2.75Å
157	L	72.9	Confident	68.6	Low	95 Å²	95	94 Å²	94	50%	0.497	54%	0.543	S	S	.	.			trans	-77.9	148.5	172.6	-75	153.6	0	0	0	110.2	V146 K159 E160 C161	V146-L157 HydrophobicContact CG1-CD2 4.03Å; V146-L157 HydrophobicContact CG1-CG 3.98Å; L157-K159 PolarHBondContact O-N 3.07Å; L157-E160 CarbonylContact O-C 3.58Å; L157-E160 WeakPolarHBondContact O-CA 3.27Å; L157-E160 PolarHBondContact O-N 3.35Å; L157-C161 PolarHBondContact O-N 3.27Å
158	A	72.1	Confident	68.7	Low	3 Å²	3	93.8 Å²	93.8	3%	0.025	54%	0.544	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-12.6	177.8	0	0	0	0	0	115.6	Y149 K150 E160	Y149-A158 HydrophobicContact CD1-CB 3.47Å; Y149-A158 VanDerWaalsContact CD1-CB 3.47Å; Y149-A158 HydrophobicContact CD2-CB 4.04Å; Y149-A158 HydrophobicContact CE1-CB 3.04Å; Y149-A158 HydrophobicContact CE2-CB 3.64Å; Y149-A158 HydrophobicContact CG-CB 3.96Å; Y149-A158 WeakPolarHBondContact OH-CB 3.37Å; K150-A158 HydrophobicContact CD-CB 4.16Å; K150-A158 WeakPolarHBondContact CD-O 3.41Å; K150-A158 WeakPolarHBondContact CE-O 3.47Å; K150-A158 HydrophobicContact CG-CB 4.01Å; K150-A158 PolarHBondContact NZ-O 3.2Å; A158-E160 VanDerWaalsContact C-N 3.32Å
159	K	72.5	Confident	68.4	Low	195 Å²	195	98.7 Å²	98.7	85%	0.848	57%	0.572	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.1	-27.4	170.3	-71.9	-172.3	172.5	-173.2	0	112.4	L157	L157-K159 PolarHBondContact O-N 3.07Å
160	E	68.3	Low	68.2	Low	137 Å²	137	93.8 Å²	93.8	64%	0.64	56%	0.563	S	S	*	*	S	Bend	trans	-105.7	8.5	-179	-58.3	-177.6	109.1	0	0	111.4	L157 A158 T162	L157-E160 CarbonylContact O-C 3.58Å; L157-E160 WeakPolarHBondContact O-CA 3.27Å; L157-E160 PolarHBondContact O-N 3.35Å; A158-E160 VanDerWaalsContact C-N 3.32Å; E160-T162 PolarHBondContact O-N 2.93Å
161	C	75.8	Confident	68.2	Low	17 Å²	17	93.4 Å²	93.4	12%	0.115	57%	0.57	C	S	.	*			trans	-72.5	111.8	175.5	-176.2	0	0	0	0	109.3	C148 K150 L157 I163	C148-C161 VanDerWaalsContact SG-CB 3.51Å; K150-C161 HydrophobicContact CB-CB 4.44Å; K150-C161 HydrophobicContact CD-CB 4.14Å; L157-C161 PolarHBondContact O-N 3.27Å; C161-I163 PolarHBondContact O-N 2.96Å; C161-I163 PolarHBondContact SG-O 3.32Å; C161-I163 VanDerWaalsContact SG-O 3.4Å
162	T	77.2	Confident	67.8	Low	137 Å²	137	97.1 Å²	97.1	84%	0.84	59%	0.592	S	S	*	*			trans	-77.8	-7.8	175.4	51.4	0	0	0	0	113.1	E160	E160-T162 PolarHBondContact O-N 2.93Å
163	I	69.6	Low	67.8	Low	82 Å²	82	99.8 Å²	99.8	42%	0.421	59%	0.593	S	S	.	*	S	Bend	trans	-85.9	114.5	176.7	-43.2	173.4	0	0	0	107.4	C151 C161 A165	C151-I163 HydrophobicContact CB-CB 4.19Å; C151-I163 HydrophobicContact CB-CD1 3.49Å; C151-I163 VanDerWaalsContact CB-CD1 3.49Å; C151-I163 HydrophobicContact CB-CG1 4.32Å; C161-I163 PolarHBondContact O-N 2.96Å; C161-I163 PolarHBondContact SG-O 3.32Å; C161-I163 VanDerWaalsContact SG-O 3.4Å; I163-A165 PolarHBondContact O-N 2.83Å
164	E	63.9	Low	67.7	Low	177 Å²	177	100.4 Å²	100.4	83%	0.827	60%	0.6	S	S	*	*			trans	-64.1	131.6	172.9	-62	-157.6	99.2	0	0	108.9	T166	E164-T166 PolarHBondContact O-N 3.25Å
165	A	53.2	Low	67.4	Low	69 Å²	69	103.2 Å²	103.2	57%	0.57	62%	0.616	S	S	*	*			trans	-63.5	106.9	-176.3	0	0	0	0	0	109.2	I163 A167	I163-A165 PolarHBondContact O-N 2.83Å; A165-A167 PolarHBondContact O-N 2.58Å
166	T	56.6	Low	66.7	Low	141 Å²	141	106.1 Å²	106.1	87%	0.865	61%	0.609	S	S	*	*			trans	-66.9	115.1	166.2	45.8	0	0	0	0	107.6	E164	E164-T166 PolarHBondContact O-N 3.25Å
167	A	44.1	Very low	66	Low	175 Å²	175	111.6 Å²	111.6	100%	1.446	65%	0.645	S	S	*	*			trans	-57.9	0	-178.3	0	0	0	0	0	113.5	A165	A165-A167 PolarHBondContact O-N 2.58Å

Retrieved 167 of 167 residues in 476.5 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).