A0A096NJ14_PAPAN Loading...

Beta-defensin

Has antibacterial activity.

AlphaFold DB , UniProt , Accession A0A096NJ14, Species PAPAN (Papio anubis, Olive baboon), Gene DEFB113, Length 82 aa.

						>A0A096NJ14_PAPAN|A0A096NJ14|DEFB113
MKMLCIFLTFVFTVSCGPSVPQKKTREVAERKRECQFVRGACKSECNTWEYVHYYCDVKPCCVVRDYQKPIINKITTKLYRK
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	59	Low	60.5	Low	227 Å²	227	127.1 Å²	127.1	100%	1.118	64%	0.642	S	S	*	*				0	71.1	0	-62.8	-170.8	-174.4	0	0	110.8
2	K	52.3	Low	60.3	Low	173 Å²	173	127.6 Å²	127.6	75%	0.752	64%	0.637	S	S	*	*			trans	-148.6	-36.5	178.4	-159.7	151.9	176.6	169	0	111.3
3	M	61.1	Low	60.1	Low	138 Å²	138	125.3 Å²	125.3	68%	0.68	63%	0.634	S	S	*	*	H	α-helix	trans	-66.6	-35.6	173.4	-67.3	-61.1	-116.5	0	0	114.2	C5 I6 F7	M3-C5 VanDerWaalsContact C-N 3.27Å; M3-C5 PolarHBondContact O-N 3.11Å; M3-I6 PolarHBondContact O-N 2.85Å; M3-I6 VanDerWaalsContact O-N 3.14Å; M3-I6 HydrophobicContact SD-CD1 4.06Å; M3-F7 PolarHBondContact O-N 2.77Å
4	L	60.7	Low	60	Low	124 Å²	124	124 Å²	124	65%	0.649	64%	0.635	S	S	*	*	H	α-helix	trans	-61.3	-36.5	179.3	-69.3	170.6	0	0	0	112.3	I6 F7 L8	L4-I6 VanDerWaalsContact C-N 3.29Å; L4-I6 PolarHBondContact O-N 2.81Å; L4-F7 PolarHBondContact O-N 2.8Å; L4-L8 WeakPolarHBondContact O-CD1 3.34Å; L4-L8 PolarHBondContact O-N 2.86Å
5	C	58.8	Low	59.8	Low	79 Å²	79	121.7 Å²	121.7	53%	0.534	63%	0.634	S	S	.	*	H	α-helix	trans	-68.7	-30	179	-55.3	0	0	0	0	112.2	M3 T9	M3-C5 VanDerWaalsContact C-N 3.27Å; M3-C5 PolarHBondContact O-N 3.11Å; C5-T9 WeakPolarHBondContact O-CG2 3.02Å; C5-T9 PolarHBondContact O-N 3.14Å; C5-T9 VanDerWaalsContact O-N 3.15Å; C5-T9 PolarHBondContact O-OG1 2.96Å
6	I	65.2	Low	59.8	Low	96 Å²	96	120.2 Å²	120.2	49%	0.492	64%	0.636	S	S	.	*	H	α-helix	trans	-72.9	-41.6	177.5	-56.2	171.3	0	0	0	110	M3 L4 T9 F10	M3-I6 PolarHBondContact O-N 2.85Å; M3-I6 VanDerWaalsContact O-N 3.14Å; M3-I6 HydrophobicContact SD-CD1 4.06Å; L4-I6 VanDerWaalsContact C-N 3.29Å; L4-I6 PolarHBondContact O-N 2.81Å; I6-T9 WeakPolarHBondContact CA-OG1 3.46Å; I6-T9 PolarHBondContact O-OG1 2.8Å; I6-F10 WeakPolarHBondContact O-CB 3.04Å; I6-F10 PolarHBondContact O-N 2.7Å
7	F	61.6	Low	59.9	Low	147 Å²	147	115.8 Å²	115.8	65%	0.645	63%	0.627	S	S	*	*	H	α-helix	trans	-64.8	-43.1	175.6	-88.6	-85	0	0	0	112.6	M3 L4 F10 V11	M3-F7 PolarHBondContact O-N 2.77Å; L4-F7 PolarHBondContact O-N 2.8Å; F7-F10 PolarHBondContact O-N 3.17Å; F7-V11 WeakPolarHBondContact O-CG2 3.24Å; F7-V11 PolarHBondContact O-N 3.21Å
8	L	61.9	Low	59.6	Low	99 Å²	99	116.1 Å²	116.1	52%	0.518	64%	0.635	S	S	.	*	H	α-helix	trans	-60.8	-49	177.8	-82.6	155	0	0	0	111.4	L4 F10 V11 F12	L4-L8 WeakPolarHBondContact O-CD1 3.34Å; L4-L8 PolarHBondContact O-N 2.86Å; L8-F10 VanDerWaalsContact C-N 3.29Å; L8-F10 PolarHBondContact O-N 3.45Å; L8-V11 PolarHBondContact O-N 2.97Å; L8-F12 HydrophobicContact CB-CE2 4.47Å; L8-F12 HydrophobicContact CD2-CE2 3.89Å; L8-F12 WeakPolarHBondContact O-CD2 3.36Å; L8-F12 PolarHBondContact O-N 3.29Å
9	T	62.6	Low	59.4	Low	87 Å²	87	116.3 Å²	116.3	53%	0.534	65%	0.646	S	S	.	*	H	α-helix	trans	-63.2	-34.5	178.6	48.6	0	0	0	0	112.7	C5 I6 T13	C5-T9 WeakPolarHBondContact O-CG2 3.02Å; C5-T9 PolarHBondContact O-N 3.14Å; C5-T9 VanDerWaalsContact O-N 3.15Å; C5-T9 PolarHBondContact O-OG1 2.96Å; I6-T9 WeakPolarHBondContact CA-OG1 3.46Å; I6-T9 PolarHBondContact O-OG1 2.8Å; T9-T13 WeakPolarHBondContact O-CB 3.45Å; T9-T13 VanDerWaalsContact O-CG2 3.27Å; T9-T13 WeakPolarHBondContact O-CG2 3.48Å; T9-T13 PolarHBondContact O-N 3.05Å; T9-T13 VanDerWaalsContact O-N 3.08Å; T9-T13 PolarHBondContact O-OG1 3.11Å
10	F	61.4	Low	59.3	Low	145 Å²	145	115.6 Å²	115.6	64%	0.636	64%	0.644	S	S	*	*	H	α-helix	trans	-64.7	-51	173.7	-146	-97.2	0	0	0	111.1	I6 F7 L8 F12 T13 V14	I6-F10 WeakPolarHBondContact O-CB 3.04Å; I6-F10 PolarHBondContact O-N 2.7Å; F7-F10 PolarHBondContact O-N 3.17Å; L8-F10 VanDerWaalsContact C-N 3.29Å; L8-F10 PolarHBondContact O-N 3.45Å; F10-F12 VanDerWaalsContact C-N 3.32Å; F10-F12 PolarHBondContact O-N 3.03Å; F10-T13 WeakPolarHBondContact CA-OG1 3.18Å; F10-T13 PolarHBondContact O-N 2.03Å; F10-T13 VanDerWaalsContact O-N 3.08Å; F10-T13 PolarHBondContact O-OG1 3.46Å; F10-V14 HydrophobicContact CD1-CG2 4.17Å; F10-V14 WeakPolarHBondContact O-CG2 3.42Å; F10-V14 PolarHBondContact O-N 3.04Å
11	V	61.3	Low	59.2	Low	83 Å²	83	114.6 Å²	114.6	50%	0.503	64%	0.643	S	S	.	*	H	α-helix	trans	-59.6	-41.3	179.4	176.1	0	0	0	0	111.9	F7 L8 T13 S15	F7-V11 WeakPolarHBondContact O-CG2 3.24Å; F7-V11 PolarHBondContact O-N 3.21Å; L8-V11 PolarHBondContact O-N 2.97Å; V11-T13 PolarHBondContact O-N 3.07Å; V11-S15 VanDerWaalsContact O-CB 3.25Å; V11-S15 WeakPolarHBondContact O-CB 3.32Å; V11-S15 PolarHBondContact O-N 2.92Å; V11-S15 PolarHBondContact O-OG 2.86Å
12	F	57.8	Low	59.1	Low	133 Å²	133	111.2 Å²	111.2	58%	0.583	63%	0.625	S	S	*	*	H	α-helix	trans	-67	-33.3	176.8	-76.9	-66.6	0	0	0	113.2	L8 F10 C16	L8-F12 HydrophobicContact CB-CE2 4.47Å; L8-F12 HydrophobicContact CD2-CE2 3.89Å; L8-F12 WeakPolarHBondContact O-CD2 3.36Å; L8-F12 PolarHBondContact O-N 3.29Å; F10-F12 VanDerWaalsContact C-N 3.32Å; F10-F12 PolarHBondContact O-N 3.03Å; F12-C16 WeakPolarHBondContact O-CB 3.44Å; F12-C16 PolarHBondContact O-N 2.95Å; F12-C16 VanDerWaalsContact O-N 3.07Å
13	T	58.1	Low	59.5	Low	98 Å²	98	111.2 Å²	111.2	60%	0.601	63%	0.625	S	S	*	*	H	α-helix	trans	-80.5	-30.5	-179.7	50.3	0	0	0	0	113.8	T9 F10 V11	T9-T13 WeakPolarHBondContact O-CB 3.45Å; T9-T13 VanDerWaalsContact O-CG2 3.27Å; T9-T13 WeakPolarHBondContact O-CG2 3.48Å; T9-T13 PolarHBondContact O-N 3.05Å; T9-T13 VanDerWaalsContact O-N 3.08Å; T9-T13 PolarHBondContact O-OG1 3.11Å; F10-T13 WeakPolarHBondContact CA-OG1 3.18Å; F10-T13 PolarHBondContact O-N 2.03Å; F10-T13 VanDerWaalsContact O-N 3.08Å; F10-T13 PolarHBondContact O-OG1 3.46Å; V11-T13 PolarHBondContact O-N 3.07Å
14	V	57.8	Low	59.5	Low	107 Å²	107	112.4 Å²	112.4	65%	0.648	63%	0.626	S	S	*	*	H	α-helix	trans	-79.1	-25.8	169.5	-104	0	0	0	0	113.3	F10	F10-V14 HydrophobicContact CD1-CG2 4.17Å; F10-V14 WeakPolarHBondContact O-CG2 3.42Å; F10-V14 PolarHBondContact O-N 3.04Å
15	S	58	Low	59.7	Low	89 Å²	89	110.8 Å²	110.8	62%	0.622	62%	0.621	S	S	*	*	H	α-helix	trans	-79.4	-35.1	177.6	-55.1	0	0	0	0	112.2	V11 G17	V11-S15 VanDerWaalsContact O-CB 3.25Å; V11-S15 WeakPolarHBondContact O-CB 3.32Å; V11-S15 PolarHBondContact O-N 2.92Å; V11-S15 PolarHBondContact O-OG 2.86Å; S15-G17 VanDerWaalsContact C-N 3.3Å; S15-G17 PolarHBondContact O-N 3.07Å; S15-G17 VanDerWaalsContact O-N 3.14Å
16	C	59.8	Low	60.2	Low	98 Å²	98	115.1 Å²	115.1	66%	0.662	63%	0.627	S	S	*	*	S	Bend	trans	-87.1	76.1	171.7	-68.4	0	0	0	0	109.1	F12	F12-C16 WeakPolarHBondContact O-CB 3.44Å; F12-C16 PolarHBondContact O-N 2.95Å; F12-C16 VanDerWaalsContact O-N 3.07Å
17	G	61.1	Low	60.6	Low	46 Å²	46	115.1 Å²	115.1	47%	0.474	63%	0.625	S	S	.	*			trans	-50.7	157.9	172.2	0	0	0	0	0	112.2	S15 S19	S15-G17 VanDerWaalsContact C-N 3.3Å; S15-G17 PolarHBondContact O-N 3.07Å; S15-G17 VanDerWaalsContact O-N 3.14Å; G17-S19 PolarHBondContact O-N 3.22Å
18	P	53.6	Low	61.3	Low	120 Å²	120	109.6 Å²	109.6	78%	0.779	60%	0.603	S	S	*	*			trans	-51.3	121.5	-170.4	23.2	-33.2	0	0	0	108.9	V20	P18-V20 WeakPolarHBondContact O-CG2 3.13Å; P18-V20 PolarHBondContact O-N 2.87Å
19	S	56.7	Low	62.1	Low	120 Å²	120	107.2 Å²	107.2	84%	0.839	60%	0.597	S	S	*	*			trans	-66.5	78.5	172.1	35.2	0	0	0	0	108.2	G17	G17-S19 PolarHBondContact O-N 3.22Å
20	V	57.6	Low	62.9	Low	102 Å²	102	107.6 Å²	107.6	62%	0.618	59%	0.593	S	S	*	*			trans	-41.1	144.1	167.7	-178	0	0	0	0	108.2	P18 Q22	P18-V20 WeakPolarHBondContact O-CG2 3.13Å; P18-V20 PolarHBondContact O-N 2.87Å; V20-Q22 VanDerWaalsContact C-N 3.3Å; V20-Q22 WeakPolarHBondContact O-CA 3.44Å; V20-Q22 PolarHBondContact O-N 2.03Å
21	P	57.8	Low	63.7	Low	95 Å²	95	105.8 Å²	105.8	62%	0.617	58%	0.582	S	S	*	*			trans	-60.6	87.7	-163.6	-16.8	28.6	0	0	0	112.2	K23 K24 T25	P21-K23 PolarHBondContact O-N 2.67Å; P21-K23 VanDerWaalsContact O-N 3.08Å; P21-K24 PolarHBondContact O-N 2.89Å; P21-T25 PolarHBondContact O-OG1 2.77Å
22	Q	56.1	Low	64.6	Low	157 Å²	157	107 Å²	107	73%	0.734	58%	0.58	S	S	*	*	H	α-helix	trans	-65.9	-21.9	-167.1	-166.9	179.4	43.8	0	0	111.9	V20 T25 R26	V20-Q22 VanDerWaalsContact C-N 3.3Å; V20-Q22 WeakPolarHBondContact O-CA 3.44Å; V20-Q22 PolarHBondContact O-N 2.03Å; Q22-T25 PolarHBondContact O-N 2.79Å; Q22-R26 WeakPolarHBondContact O-CB 3.36Å; Q22-R26 PolarHBondContact O-N 2.03Å
23	K	60.1	Low	65.8	Low	172 Å²	172	109.6 Å²	109.6	75%	0.748	59%	0.586	S	S	*	*	H	α-helix	trans	-58.2	-49.5	174.8	-80.3	-173.6	171	-175.2	0	112.3	P21 T25 R26 E27	P21-K23 PolarHBondContact O-N 2.67Å; P21-K23 VanDerWaalsContact O-N 3.08Å; K23-T25 VanDerWaalsContact C-N 3.33Å; K23-T25 PolarHBondContact O-N 3.17Å; K23-R26 PolarHBondContact O-N 3.34Å; K23-E27 PolarHBondContact O-N 3.4Å; K23-E27 VanDerWaalsContact O-N 3.1Å
24	K	61.4	Low	67.1	Low	163 Å²	163	110.2 Å²	110.2	71%	0.709	58%	0.582	S	S	*	*	H	α-helix	trans	-65.7	-38.7	179.5	-76.7	-165.4	174	-172.7	0	111.7	P21 R26 V28	P21-K24 PolarHBondContact O-N 2.89Å; K24-R26 VanDerWaalsContact C-N 3.31Å; K24-R26 PolarHBondContact O-N 3.5Å; K24-V28 VanDerWaalsContact O-CG2 3.3Å; K24-V28 WeakPolarHBondContact O-CG2 3.25Å; K24-V28 PolarHBondContact O-N 2.6Å; K24-V28 VanDerWaalsContact O-N 3.13Å
25	T	64.2	Low	68.6	Low	90 Å²	90	105.1 Å²	105.1	55%	0.552	55%	0.551	S	S	*	*	H	α-helix	trans	-66.5	-35.5	179.3	-27.3	0	0	0	0	112	P21 Q22 K23 A29	P21-T25 PolarHBondContact O-OG1 2.77Å; Q22-T25 PolarHBondContact O-N 2.79Å; K23-T25 VanDerWaalsContact C-N 3.33Å; K23-T25 PolarHBondContact O-N 3.17Å; T25-A29 WeakPolarHBondContact O-CB 3.35Å; T25-A29 PolarHBondContact O-N 3.29Å; T25-A29 VanDerWaalsContact O-N 3.14Å
26	R	70.4	Confident	70	Confident	171 Å²	171	107.7 Å²	107.7	65%	0.645	55%	0.554	S	S	*	*	H	α-helix	trans	-70.9	-44.8	178.1	-170.9	175.6	172.7	167	-0.1	112	Q22 K23 K24 V28 A29 E30	Q22-R26 WeakPolarHBondContact O-CB 3.36Å; Q22-R26 PolarHBondContact O-N 2.03Å; K23-R26 PolarHBondContact O-N 3.34Å; K24-R26 VanDerWaalsContact C-N 3.31Å; K24-R26 PolarHBondContact O-N 3.5Å; R26-V28 VanDerWaalsContact C-N 3.34Å; R26-V28 PolarHBondContact O-N 3.18Å; R26-A29 WeakPolarHBondContact O-CB 3.04Å; R26-A29 PolarHBondContact O-N 3.22Å; R26-A29 VanDerWaalsContact O-N 3.15Å; R26-E30 IonicContact NE-OE1 3.07Å; R26-E30 PolarHBondContact NE-OE1 3.31Å; R26-E30 WeakPolarHBondContact O-CG 3.49Å; R26-E30 PolarHBondContact O-N 3.08Å
27	E	72.9	Confident	71.3	Confident	96 Å²	96	111.8 Å²	111.8	45%	0.449	56%	0.561	S	S	.	*	H	α-helix	trans	-61.5	-40.8	176.3	-72.9	175.6	-165	0	0	112.3	K23 A29 E30 R31	K23-E27 PolarHBondContact O-N 3.4Å; K23-E27 VanDerWaalsContact O-N 3.1Å; E27-A29 VanDerWaalsContact C-N 3.32Å; E27-A29 PolarHBondContact O-N 3.07Å; E27-E30 PolarHBondContact O-N 3.41Å; E27-R31 WeakPolarHBondContact O-CG 3.15Å; E27-R31 PolarHBondContact O-N 2.56Å
28	V	75.9	Confident	72.6	Confident	31 Å²	31	112 Å²	112	19%	0.188	55%	0.553	C	S	.	*	H	α-helix	trans	-66	-35.5	175.7	171.8	0	0	0	0	111.5	K24 R26 K32 D57	K24-V28 VanDerWaalsContact O-CG2 3.3Å; K24-V28 WeakPolarHBondContact O-CG2 3.25Å; K24-V28 PolarHBondContact O-N 2.6Å; K24-V28 VanDerWaalsContact O-N 3.13Å; R26-V28 VanDerWaalsContact C-N 3.34Å; R26-V28 PolarHBondContact O-N 3.18Å; V28-K32 HydrophobicContact CG1-CD 4.44Å; V28-K32 WeakPolarHBondContact O-CB 3.24Å; V28-K32 VanDerWaalsContact O-CG 3.3Å; V28-K32 WeakPolarHBondContact O-CG 3.11Å; V28-K32 PolarHBondContact O-N 3.13Å; V28-D57 HydrophobicContact CG1-CB 4.13Å; V28-D57 HydrophobicContact CG2-CB 4.16Å
29	A	79.1	Confident	74.2	Confident	49 Å²	49	117.1 Å²	117.1	41%	0.405	56%	0.556	S	S	.	*	H	α-helix	trans	-69.4	-38.5	175.8	0	0	0	0	0	112.1	T25 R26 E27 K32 R33	T25-A29 WeakPolarHBondContact O-CB 3.35Å; T25-A29 PolarHBondContact O-N 3.29Å; T25-A29 VanDerWaalsContact O-N 3.14Å; R26-A29 WeakPolarHBondContact O-CB 3.04Å; R26-A29 PolarHBondContact O-N 3.22Å; R26-A29 VanDerWaalsContact O-N 3.15Å; E27-A29 VanDerWaalsContact C-N 3.32Å; E27-A29 PolarHBondContact O-N 3.07Å; A29-K32 PolarHBondContact O-N 3.44Å; A29-R33 WeakPolarHBondContact O-CG 3.48Å; A29-R33 PolarHBondContact O-N 3.17Å; A29-R33 VanDerWaalsContact O-N 3.11Å
30	E	80.1	Confident	75.8	Confident	94 Å²	94	111.9 Å²	111.9	44%	0.439	52%	0.521	S	S	.	.	H	α-helix	trans	-64	-48.6	174.9	-74.8	171.1	-174.8	0	0	110.9	R26 E27 K32 R33 E34	R26-E30 IonicContact NE-OE1 3.07Å; R26-E30 PolarHBondContact NE-OE1 3.31Å; R26-E30 WeakPolarHBondContact O-CG 3.49Å; R26-E30 PolarHBondContact O-N 3.08Å; E27-E30 PolarHBondContact O-N 3.41Å; E30-K32 VanDerWaalsContact C-N 3.26Å; E30-K32 PolarHBondContact O-N 3.45Å; E30-R33 WeakPolarHBondContact O-CB 3.05Å; E30-R33 PolarHBondContact O-N 3.5Å; E30-E34 PolarHBondContact O-N 3.26Å; E30-E34 VanDerWaalsContact O-N 3.07Å
31	R	77.4	Confident	77.4	Confident	108 Å²	108	109.1 Å²	109.1	41%	0.408	51%	0.509	S	S	.	.	H	α-helix	trans	-61.6	-31.5	174.4	-70.1	-172.7	-146.9	-171.2	6.3	113.3	E27 Y54	E27-R31 WeakPolarHBondContact O-CG 3.15Å; E27-R31 PolarHBondContact O-N 2.56Å; R31-Y54 HydrophobicContact CB-CE2 4.32Å; R31-Y54 PolarHBondContact O-OH 3Å
32	K	80.9	Confident	79.1	Confident	107 Å²	107	106.6 Å²	106.6	47%	0.465	49%	0.493	S	S	.	.	H	α-helix	trans	-67.8	-36.8	172.9	-79.5	175.6	-178.6	178.4	0	112.2	V28 A29 E30 C35 Q36 C56	V28-K32 HydrophobicContact CG1-CD 4.44Å; V28-K32 WeakPolarHBondContact O-CB 3.24Å; V28-K32 VanDerWaalsContact O-CG 3.3Å; V28-K32 WeakPolarHBondContact O-CG 3.11Å; V28-K32 PolarHBondContact O-N 3.13Å; A29-K32 PolarHBondContact O-N 3.44Å; E30-K32 VanDerWaalsContact C-N 3.26Å; E30-K32 PolarHBondContact O-N 3.45Å; K32-C35 WeakPolarHBondContact O-CB 3.5Å; K32-C35 PolarHBondContact O-N 3.03Å; K32-Q36 PolarHBondContact O-N 2.96Å; K32-C56 HydrophobicContact CG-CB 4.17Å
33	R	82.3	Confident	80.8	Confident	188 Å²	188	103 Å²	103	71%	0.709	48%	0.475	S	S	*	.	H	α-helix	trans	-68	-40.4	178	-75.4	-177.7	179.7	-126.8	1.5	112.1	A29 E30 C35 Q36 F37	A29-R33 WeakPolarHBondContact O-CG 3.48Å; A29-R33 PolarHBondContact O-N 3.17Å; A29-R33 VanDerWaalsContact O-N 3.11Å; E30-R33 WeakPolarHBondContact O-CB 3.05Å; E30-R33 PolarHBondContact O-N 3.5Å; R33-C35 PolarHBondContact O-N 3.15Å; R33-Q36 PolarHBondContact O-N 3.34Å; R33-F37 PolarHBondContact O-N 3.1Å
34	E	86.1	Confident	82.3	Confident	111 Å²	111	99.3 Å²	99.3	52%	0.519	47%	0.471	S	S	.	.	H	α-helix	trans	-56	-32.2	173.8	-72.3	171.3	174.8	0	0	111.6	E30 F37 V38 Y54	E30-E34 PolarHBondContact O-N 3.26Å; E30-E34 VanDerWaalsContact O-N 3.07Å; E34-F37 WeakPolarHBondContact O-CB 3.03Å; E34-F37 PolarHBondContact O-N 3.35Å; E34-V38 PolarHBondContact O-N 3.14Å; E34-Y54 HydrophobicContact CB-CE1 4.5Å; E34-Y54 WeakPolarHBondContact CB-OH 3.46Å
35	C	89	Confident	83.7	Confident	0 Å²	0	99.1 Å²	99.1	0%	0	47%	0.473	C	S	.	.	H	α-helix	trans	-77.9	-41.6	-171.6	-176.3	0	0	0	0	108.1	K32 R33 F37 V38 G40 A41 Y54 C61	K32-C35 WeakPolarHBondContact O-CB 3.5Å; K32-C35 PolarHBondContact O-N 3.03Å; R33-C35 PolarHBondContact O-N 3.15Å; C35-F37 PolarHBondContact O-N 3.47Å; C35-V38 WeakPolarHBondContact O-CG2 3.19Å; C35-V38 PolarHBondContact O-N 3.26Å; C35-G40 CarbonylContact C-O 3.54Å; C35-G40 CarbonylContact O-C 3.47Å; C35-G40 VanDerWaalsContact O-CA 3.24Å; C35-G40 WeakPolarHBondContact O-CA 3.45Å; C35-G40 PolarHBondContact O-N 3.18Å; C35-A41 VanDerWaalsContact SG-C 3.6Å; C35-A41 PolarHBondContact SG-N 3.45Å; C35-Y54 WeakPolarHBondContact CA-OH 3.34Å; C35-Y54 HydrophobicContact CB-CE1 4.33Å; C35-Y54 WeakPolarHBondContact CB-OH 3.09Å; C35-Y54 PolarHBondContact N-OH 2.84Å; C35-C61 WeakPolarHBondContact CA-SG 3.47Å; C35-C61 HydrophobicContact CB-CB 3.95Å; C35-C61 WeakPolarHBondContact CB-SG 3.36Å; C35-C61 VanDerWaalsContact SG-CA 3.58Å; C35-C61 WeakPolarHBondContact SG-CB 3.27Å; C35-C61 CovalentContact SG-SG 2.03Å; C35-C61 PolarHBondContact SG-SG 2.99Å
36	Q	86.8	Confident	85	Confident	143 Å²	143	96.6 Å²	96.6	67%	0.668	46%	0.459	S	S	*	.	H	α-helix	trans	-62.3	-34.4	172.2	-66.4	176.6	-15.6	0	0	111.7	K32 R33 V38 R39	K32-Q36 PolarHBondContact O-N 2.96Å; R33-Q36 PolarHBondContact O-N 3.34Å; Q36-V38 PolarHBondContact O-N 3Å; Q36-R39 PolarHBondContact O-N 2.93Å; Q36-R39 VanDerWaalsContact O-N 3.08Å
37	F	88.4	Confident	86	Confident	185 Å²	185	93 Å²	93	81%	0.811	45%	0.452	S	S	*	.	H	α-helix	trans	-63.7	-41.4	179.4	-168.5	-96.1	0	0	0	112.3	R33 E34 C35 R39	R33-F37 PolarHBondContact O-N 3.1Å; E34-F37 WeakPolarHBondContact O-CB 3.03Å; E34-F37 PolarHBondContact O-N 3.35Å; C35-F37 PolarHBondContact O-N 3.47Å; F37-R39 PolarHBondContact O-N 3.11Å
38	V	87.5	Confident	86.8	Confident	50 Å²	50	94 Å²	94	30%	0.303	47%	0.465	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.3	16.3	174.7	-60	0	0	0	0	113.4	E34 C35 Q36 G40 V63	E34-V38 PolarHBondContact O-N 3.14Å; C35-V38 WeakPolarHBondContact O-CG2 3.19Å; C35-V38 PolarHBondContact O-N 3.26Å; Q36-V38 PolarHBondContact O-N 3Å; V38-G40 PolarHBondContact O-N 3.08Å; V38-G40 VanDerWaalsContact O-N 3.17Å; V38-V63 HydrophobicContact CG2-CG2 3.73Å; V38-V63 WeakPolarHBondContact O-CG1 3.02Å
39	R	88.4	Confident	87.3	Confident	228 Å²	228	100.9 Å²	100.9	86%	0.86	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	55.7	26.1	-173.7	-55.2	-179.4	177.5	-177.5	-1	113.4	Q36 F37	Q36-R39 PolarHBondContact O-N 2.93Å; Q36-R39 VanDerWaalsContact O-N 3.08Å; F37-R39 PolarHBondContact O-N 3.11Å
40	G	89.9	Confident	88	Confident	10 Å²	10	99.8 Å²	99.8	10%	0.103	47%	0.474	C	S	.	.			trans	-92.2	166.6	174.7	0	0	0	0	0	112.9	C35 V38 C62	C35-G40 CarbonylContact C-O 3.54Å; C35-G40 CarbonylContact O-C 3.47Å; C35-G40 VanDerWaalsContact O-CA 3.24Å; C35-G40 WeakPolarHBondContact O-CA 3.45Å; C35-G40 PolarHBondContact O-N 3.18Å; V38-G40 PolarHBondContact O-N 3.08Å; V38-G40 VanDerWaalsContact O-N 3.17Å; G40-C62 CarbonylContact C-O 3.48Å; G40-C62 WeakPolarHBondContact CA-O 3.48Å
41	A	91.4	Very high	88.4	Confident	44 Å²	44	99.8 Å²	99.8	36%	0.364	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.7	135.2	174.9	0	0	0	0	0	111	C35 K43 C62	C35-A41 VanDerWaalsContact SG-C 3.6Å; C35-A41 PolarHBondContact SG-N 3.45Å; A41-K43 HydrophobicContact CB-CG 4.39Å; A41-K43 PolarHBondContact O-N 3.31Å; A41-C62 PolarHBondContact N-O 2.65Å; A41-C62 PolarHBondContact O-N 2.96Å
42	C	91.8	Very high	89.1	Confident	42 Å²	42	98.1 Å²	98.1	28%	0.284	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	106.7	174.2	-49.4	0	0	0	0	109.5	C56 P60	C42-C56 HydrophobicContact CB-CB 3.84Å; C42-C56 WeakPolarHBondContact CB-SG 2.97Å; C42-C56 WeakPolarHBondContact SG-CB 2.92Å; C42-C56 CovalentContact SG-SG 2.03Å; C42-C56 PolarHBondContact SG-SG 3.08Å; C42-P60 WeakPolarHBondContact CA-O 3.49Å
43	K	92	Very high	89.4	Confident	81 Å²	81	97.9 Å²	97.9	35%	0.352	47%	0.472	S	S	.	.			trans	-118.2	164.8	179.5	-62.9	176.3	-178.2	172.7	0	109.7	A41 E45 E50 K59 P60 C62	A41-K43 HydrophobicContact CB-CG 4.39Å; A41-K43 PolarHBondContact O-N 3.31Å; K43-E45 VanDerWaalsContact C-N 3.3Å; K43-E45 WeakPolarHBondContact CB-O 3.3Å; K43-E50 VanDerWaalsContact NZ-CD 3.29Å; K43-E50 IonicContact NZ-OE1 3.4Å; K43-E50 PolarHBondContact NZ-OE1 3.05Å; K43-E50 IonicContact NZ-OE2 2.67Å; K43-E50 PolarHBondContact NZ-OE2 3.14Å; K43-E50 VanDerWaalsContact NZ-OE2 3.07Å; K43-K59 WeakPolarHBondContact O-CB 3.11Å; K43-P60 PolarHBondContact N-O 3.48Å; K43-P60 WeakPolarHBondContact O-CD 3.25Å; K43-P60 WeakPolarHBondContact O-CG 3.46Å; K43-C62 HydrophobicContact CD-CB 4.36Å
44	S	91.4	Very high	89.8	Confident	95 Å²	95	91.1 Å²	91.1	66%	0.664	45%	0.447	S	S	*	.	S	Bend	trans	-65.5	-39.2	172.3	44	0	0	0	0	111.3	P60	S44-P60 WeakPolarHBondContact O-CD 3.36Å
45	E	91.5	Very high	89.8	Confident	159 Å²	159	92.1 Å²	92.1	74%	0.743	45%	0.447	S	S	*	.	S	Bend	trans	-141.9	149.8	177.2	-67.3	179.5	177.5	0	0	109.1	K43	K43-E45 VanDerWaalsContact C-N 3.3Å; K43-E45 WeakPolarHBondContact CB-O 3.3Å
46	C	91.7	Very high	89.6	Confident	37 Å²	37	92.2 Å²	92.2	25%	0.25	45%	0.448	C	S	.	.			trans	-90.5	146	178.4	-57.8	0	0	0	0	111	E50 V52 C62	C46-E50 HydrophobicContact CB-CB 4.13Å; C46-V52 HydrophobicContact CB-CG2 4.42Å; C46-V52 VanDerWaalsContact SG-CG2 3.59Å; C46-C62 WeakPolarHBondContact CA-SG 3.3Å; C46-C62 HydrophobicContact CB-CB 3.71Å; C46-C62 WeakPolarHBondContact CB-SG 3.49Å; C46-C62 WeakPolarHBondContact SG-CA 3.48Å; C46-C62 WeakPolarHBondContact SG-CB 3.41Å; C46-C62 CovalentContact SG-SG 2.03Å; C46-C62 PolarHBondContact SG-SG 3.39Å
47	N	91.3	Very high	89.5	Confident	96 Å²	96	90 Å²	90	51%	0.513	44%	0.44	S	S	.	.			trans	-70.8	165.1	174.6	-162.8	11.1	0	0	0	111.3	W49 E50	N47-W49 PolarHBondContact O-N 2.71Å; N47-E50 HydrophobicContact CB-CG 4.2Å; N47-E50 PolarHBondContact N-OE2 3.44Å; N47-E50 PolarHBondContact O-N 3.4Å
48	T	89.4	Confident	89.4	Confident	115 Å²	115	87.1 Å²	87.1	71%	0.706	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61	-27.9	178.7	52.2	0	0	0	0	113.8	E50	T48-E50 VanDerWaalsContact C-N 3.34Å
49	W	87.8	Confident	89.5	Confident	176 Å²	176	90.1 Å²	90.1	67%	0.667	45%	0.447	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.9	0.1	175.9	-69.2	101.2	0	0	0	114.2	N47 R65	N47-W49 PolarHBondContact O-N 2.71Å; W49-R65 WeakPolarHBondContact O-CG 3.5Å; W49-R65 PolarHBondContact O-N 2.63Å; W49-R65 VanDerWaalsContact O-N 3.11Å
50	E	92.1	Very high	89.8	Confident	26 Å²	26	79.9 Å²	79.9	12%	0.121	41%	0.41	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	159	177.9	-64	173.3	155.5	0	0	109.5	K43 C46 N47 T48 C62 V63 V64	K43-E50 VanDerWaalsContact NZ-CD 3.29Å; K43-E50 IonicContact NZ-OE1 3.4Å; K43-E50 PolarHBondContact NZ-OE1 3.05Å; K43-E50 IonicContact NZ-OE2 2.67Å; K43-E50 PolarHBondContact NZ-OE2 3.14Å; K43-E50 VanDerWaalsContact NZ-OE2 3.07Å; C46-E50 HydrophobicContact CB-CB 4.13Å; N47-E50 HydrophobicContact CB-CG 4.2Å; N47-E50 PolarHBondContact N-OE2 3.44Å; N47-E50 PolarHBondContact O-N 3.4Å; T48-E50 VanDerWaalsContact C-N 3.34Å; E50-C62 HydrophobicContact CB-CB 4.13Å; E50-C62 WeakPolarHBondContact OE2-CB 3.34Å; E50-V63 CarbonylContact C-O 3.51Å; E50-V63 WeakPolarHBondContact CA-O 3.46Å; E50-V63 WeakPolarHBondContact CB-O 3.48Å; E50-V64 HydrophobicContact CG-CG2 4.35Å
51	Y	89.3	Confident	90	Very high	95 Å²	95	79.4 Å²	79.4	37%	0.373	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	152	168.3	70.2	-85.2	0	0	0	110	H53 V63 R65	Y51-H53 HydrophobicContact CE2-CB 4.01Å; Y51-H53 PolarHBondContact O-N 3.02Å; Y51-V63 HydrophobicContact CD1-CB 4.21Å; Y51-V63 WeakPolarHBondContact CD1-O 3.34Å; Y51-V63 HydrophobicContact CE1-CB 3.68Å; Y51-V63 HydrophobicContact CE1-CG1 3.73Å; Y51-V63 HydrophobicContact CE2-CB 4.2Å; Y51-V63 PolarHBondContact N-O 3.02Å; Y51-V63 PolarHBondContact O-N 3.07Å; Y51-R65 HydrophobicContact CD1-CG 3.84Å
52	V	92.4	Very high	90.1	Very high	73 Å²	73	77.4 Å²	77.4	44%	0.442	39%	0.388	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.7	117	175.6	-178.1	0	0	0	0	107.9	C46 Y55 P60	C46-V52 HydrophobicContact CB-CG2 4.42Å; C46-V52 VanDerWaalsContact SG-CG2 3.59Å; V52-Y55 HydrophobicContact CG1-CE2 4.41Å; V52-P60 HydrophobicContact CG1-CB 3.93Å; V52-P60 HydrophobicContact CG2-CB 4.23Å
53	H	87.8	Confident	90.1	Very high	101 Å²	101	75.8 Å²	75.8	47%	0.468	38%	0.377	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	-51.5	176.1	-172.7	45.8	0	0	0	111.6	Y51 C61 V63	Y51-H53 HydrophobicContact CE2-CB 4.01Å; Y51-H53 PolarHBondContact O-N 3.02Å; H53-C61 PolarHBondContact N-O 2.91Å; H53-V63 HydrophobicContact CB-CG2 3.66Å
54	Y	88.9	Confident	90.1	Very high	47 Å²	47	76.1 Å²	76.1	18%	0.184	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.9	-172.2	174.5	69.6	-83.9	0	0	0	110	R31 E34 C35 C61	R31-Y54 HydrophobicContact CB-CE2 4.32Å; R31-Y54 PolarHBondContact O-OH 3Å; E34-Y54 HydrophobicContact CB-CE1 4.5Å; E34-Y54 WeakPolarHBondContact CB-OH 3.46Å; C35-Y54 WeakPolarHBondContact CA-OH 3.34Å; C35-Y54 HydrophobicContact CB-CE1 4.33Å; C35-Y54 WeakPolarHBondContact CB-OH 3.09Å; C35-Y54 PolarHBondContact N-OH 2.84Å; Y54-C61 HydrophobicContact CD1-CB 4.08Å; Y54-C61 HydrophobicContact CE1-CB 3.91Å; Y54-C61 HydrophobicContact CE2-CB 4.38Å; Y54-C61 HydrophobicContact CG-CB 4.4Å; Y54-C61 VanDerWaalsContact O-CB 3.25Å; Y54-C61 WeakPolarHBondContact O-CB 3.4Å; Y54-C61 PolarHBondContact O-N 3.32Å
55	Y	87.6	Confident	89.8	Confident	132 Å²	132	78.6 Å²	78.6	52%	0.518	38%	0.381	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.6	127.4	179.5	-69.8	-93.3	0	0	0	113	V52 D57 P60	V52-Y55 HydrophobicContact CG1-CE2 4.41Å; Y55-D57 VanDerWaalsContact C-N 3.32Å; Y55-P60 HydrophobicContact CD1-CB 4.25Å; Y55-P60 HydrophobicContact CE1-CB 4Å
56	C	84.6	Confident	89.4	Confident	2 Å²	2	78.3 Å²	78.3	1%	0.014	38%	0.384	C	S	.	.	S	Bend	trans	-73	-28.6	177.6	-53.1	0	0	0	0	112.4	K32 C42 K59	K32-C56 HydrophobicContact CG-CB 4.17Å; C42-C56 HydrophobicContact CB-CB 3.84Å; C42-C56 WeakPolarHBondContact CB-SG 2.97Å; C42-C56 WeakPolarHBondContact SG-CB 2.92Å; C42-C56 CovalentContact SG-SG 2.03Å; C42-C56 PolarHBondContact SG-SG 3.08Å; C56-K59 PolarHBondContact N-O 3.08Å
57	D	85.3	Confident	88.8	Confident	95 Å²	95	84.8 Å²	84.8	51%	0.508	41%	0.405	S	S	.	.	S	Bend	trans	-170.9	-108.8	173.9	-176.8	29.4	0	0	0	106.5	V28 Y55 K59	V28-D57 HydrophobicContact CG1-CB 4.13Å; V28-D57 HydrophobicContact CG2-CB 4.16Å; Y55-D57 VanDerWaalsContact C-N 3.32Å; D57-K59 VanDerWaalsContact C-N 3.34Å
58	V	86.1	Confident	88.1	Confident	126 Å²	126	88.8 Å²	88.8	76%	0.764	42%	0.42	S	S	*	.	S	Bend	trans	-78.8	-14.2	164.6	-84	0	0	0	0	114
59	K	89.4	Confident	87.7	Confident	113 Å²	113	91.2 Å²	91.2	49%	0.491	42%	0.421	S	S	.	.	S	Bend	trans	-99.8	134.6	-176.7	-71.3	-175.1	-175.5	-175.9	0	111.8	K43 C56 D57	K43-K59 WeakPolarHBondContact O-CB 3.11Å; C56-K59 PolarHBondContact N-O 3.08Å; D57-K59 VanDerWaalsContact C-N 3.34Å
60	P	93.3	Very high	87.5	Confident	13 Å²	13	87.1 Å²	87.1	8%	0.084	42%	0.417	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	144.1	172.4	27.1	-35.9	0	0	0	112.6	C42 K43 S44 V52 Y55	C42-P60 WeakPolarHBondContact CA-O 3.49Å; K43-P60 PolarHBondContact N-O 3.48Å; K43-P60 WeakPolarHBondContact O-CD 3.25Å; K43-P60 WeakPolarHBondContact O-CG 3.46Å; S44-P60 WeakPolarHBondContact O-CD 3.36Å; V52-P60 HydrophobicContact CG1-CB 3.93Å; V52-P60 HydrophobicContact CG2-CB 4.23Å; Y55-P60 HydrophobicContact CD1-CB 4.25Å; Y55-P60 HydrophobicContact CE1-CB 4Å
61	C	94.3	Very high	87	Confident	0 Å²	0	92.9 Å²	92.9	0%	0	45%	0.447	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	111.7	165.4	179.8	0	0	0	0	109	C35 H53 Y54	C35-C61 WeakPolarHBondContact CA-SG 3.47Å; C35-C61 HydrophobicContact CB-CB 3.95Å; C35-C61 WeakPolarHBondContact CB-SG 3.36Å; C35-C61 VanDerWaalsContact SG-CA 3.58Å; C35-C61 WeakPolarHBondContact SG-CB 3.27Å; C35-C61 CovalentContact SG-SG 2.03Å; C35-C61 PolarHBondContact SG-SG 2.99Å; H53-C61 PolarHBondContact N-O 2.91Å; Y54-C61 HydrophobicContact CD1-CB 4.08Å; Y54-C61 HydrophobicContact CE1-CB 3.91Å; Y54-C61 HydrophobicContact CE2-CB 4.38Å; Y54-C61 HydrophobicContact CG-CB 4.4Å; Y54-C61 VanDerWaalsContact O-CB 3.25Å; Y54-C61 WeakPolarHBondContact O-CB 3.4Å; Y54-C61 PolarHBondContact O-N 3.32Å
62	C	94.2	Very high	86.6	Confident	1 Å²	1	95.1 Å²	95.1	1%	0.007	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	118.9	-177.5	-54	0	0	0	0	109.8	G40 A41 K43 C46 E50	G40-C62 CarbonylContact C-O 3.48Å; G40-C62 WeakPolarHBondContact CA-O 3.48Å; A41-C62 PolarHBondContact N-O 2.65Å; A41-C62 PolarHBondContact O-N 2.96Å; K43-C62 HydrophobicContact CD-CB 4.36Å; C46-C62 WeakPolarHBondContact CA-SG 3.3Å; C46-C62 HydrophobicContact CB-CB 3.71Å; C46-C62 WeakPolarHBondContact CB-SG 3.49Å; C46-C62 WeakPolarHBondContact SG-CA 3.48Å; C46-C62 WeakPolarHBondContact SG-CB 3.41Å; C46-C62 CovalentContact SG-SG 2.03Å; C46-C62 PolarHBondContact SG-SG 3.39Å; E50-C62 HydrophobicContact CB-CB 4.13Å; E50-C62 WeakPolarHBondContact OE2-CB 3.34Å
63	V	92.6	Very high	85.7	Confident	9 Å²	9	97.8 Å²	97.8	6%	0.055	48%	0.476	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.4	134.9	-179.4	-174.8	0	0	0	0	109.3	V38 E50 Y51 H53	V38-V63 HydrophobicContact CG2-CG2 3.73Å; V38-V63 WeakPolarHBondContact O-CG1 3.02Å; E50-V63 CarbonylContact C-O 3.51Å; E50-V63 WeakPolarHBondContact CA-O 3.46Å; E50-V63 WeakPolarHBondContact CB-O 3.48Å; Y51-V63 HydrophobicContact CD1-CB 4.21Å; Y51-V63 WeakPolarHBondContact CD1-O 3.34Å; Y51-V63 HydrophobicContact CE1-CB 3.68Å; Y51-V63 HydrophobicContact CE1-CG1 3.73Å; Y51-V63 HydrophobicContact CE2-CB 4.2Å; Y51-V63 PolarHBondContact N-O 3.02Å; Y51-V63 PolarHBondContact O-N 3.07Å; H53-V63 HydrophobicContact CB-CG2 3.66Å
64	V	90.9	Very high	84.7	Confident	88 Å²	88	101.5 Å²	101.5	53%	0.533	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-68.2	134	179.1	-178.9	0	0	0	0	109.5	E50	E50-V64 HydrophobicContact CG-CG2 4.35Å
65	R	84.6	Confident	83.5	Confident	147 Å²	147	106.1 Å²	106.1	56%	0.555	52%	0.517	S	S	*	.	P	Polyproline II helix	trans	-72.3	128.9	173.4	-66.7	177.1	-175.6	-134.5	1.7	109.8	W49 Y51 Y67	W49-R65 WeakPolarHBondContact O-CG 3.5Å; W49-R65 PolarHBondContact O-N 2.63Å; W49-R65 VanDerWaalsContact O-N 3.11Å; Y51-R65 HydrophobicContact CD1-CG 3.84Å; R65-Y67 PolarHBondContact O-N 3.05Å
66	D	83.1	Confident	82.1	Confident	152 Å²	152	105.6 Å²	105.6	81%	0.813	53%	0.528	S	S	*	.	P	Polyproline II helix	trans	-66.9	121.8	167.5	-74.3	-34.8	0	0	0	109.1	Q68	D66-Q68 PolarHBondContact O-N 2.96Å
67	Y	79.1	Confident	80.7	Confident	174 Å²	174	110.8 Å²	110.8	68%	0.682	56%	0.559	S	S	*	*			trans	-66.3	106.6	177.6	176.1	-99.4	0	0	0	109.8	R65 K69	R65-Y67 PolarHBondContact O-N 3.05Å; Y67-K69 HydrophobicContact CE1-CB 4.03Å; Y67-K69 HydrophobicContact CE1-CG 4.33Å; Y67-K69 PolarHBondContact O-N 3.01Å
68	Q	76.9	Confident	79.1	Confident	179 Å²	179	115.4 Å²	115.4	84%	0.836	58%	0.575	S	S	*	*			trans	-82.4	112.4	168.1	-75.4	-172.8	-4.6	0	0	109.4	D66	D66-Q68 PolarHBondContact O-N 2.96Å
69	K	82.3	Confident	77.6	Confident	167 Å²	167	116.4 Å²	116.4	73%	0.726	58%	0.575	S	S	*	*			trans	-62.2	127.4	173.7	-166.6	178.6	-163.2	179.5	0	108.7	Y67 I71	Y67-K69 HydrophobicContact CE1-CB 4.03Å; Y67-K69 HydrophobicContact CE1-CG 4.33Å; Y67-K69 PolarHBondContact O-N 3.01Å; K69-I71 PolarHBondContact O-N 3.27Å
70	P	83.1	Confident	75.9	Confident	90 Å²	90	121.5 Å²	121.5	58%	0.584	59%	0.593	S	S	*	*			trans	-59.2	124.4	176.7	22.1	-31.2	0	0	0	109.6	I72	P70-I72 PolarHBondContact O-N 3.37Å; P70-I72 VanDerWaalsContact O-N 3.14Å
71	I	82.3	Confident	73.8	Confident	146 Å²	146	132.5 Å²	132.5	75%	0.749	63%	0.633	S	S	*	*			trans	-75.5	103.4	174.4	-55.3	175.5	0	0	0	106.6	K69 N73	K69-I71 PolarHBondContact O-N 3.27Å; I71-N73 VanDerWaalsContact C-N 3.29Å; I71-N73 WeakPolarHBondContact CG2-OD1 3.48Å; I71-N73 PolarHBondContact O-N 3.33Å
72	I	79.7	Confident	71.2	Confident	142 Å²	142	144.8 Å²	144.8	73%	0.728	69%	0.686	S	S	*	*			trans	-74	90.9	170.9	-57.3	176.2	0	0	0	106.7	P70 K74	P70-I72 PolarHBondContact O-N 3.37Å; P70-I72 VanDerWaalsContact O-N 3.14Å; I72-K74 HydrophobicContact CG2-CG 4.27Å; I72-K74 PolarHBondContact O-N 2.87Å
73	N	73.4	Confident	70.1	Confident	130 Å²	130	152 Å²	152	70%	0.695	72%	0.72	S	S	*	*			trans	-66.2	92	166.2	-73.8	-20.2	0	0	0	107	I71 I75	I71-N73 VanDerWaalsContact C-N 3.29Å; I71-N73 WeakPolarHBondContact CG2-OD1 3.48Å; I71-N73 PolarHBondContact O-N 3.33Å; N73-I75 PolarHBondContact O-N 3.15Å
74	K	66.9	Low	68.9	Low	179 Å²	179	159.5 Å²	159.5	78%	0.778	76%	0.755	S	S	*	*			trans	-61.9	93	164.4	-72.2	-175.2	179.7	-177.4	0	105.8	I72 T76	I72-K74 HydrophobicContact CG2-CG 4.27Å; I72-K74 PolarHBondContact O-N 2.87Å; K74-T76 PolarHBondContact O-N 3.21Å
75	I	63.8	Low	67.7	Low	143 Å²	143	163.4 Å²	163.4	73%	0.733	77%	0.767	S	S	*	*			trans	-60.7	93.3	164.7	-58.4	171.8	0	0	0	103.8	N73 T77	N73-I75 PolarHBondContact O-N 3.15Å; I75-T77 HydrophobicContact CG2-CG2 4.13Å; I75-T77 PolarHBondContact O-N 3.39Å
76	T	58.3	Low	66.7	Low	121 Å²	121	164.4 Å²	164.4	74%	0.742	78%	0.78	S	S	*	*			trans	-64.6	89.8	161.3	31.8	0	0	0	0	104.4	K74 K78	K74-T76 PolarHBondContact O-N 3.21Å; T76-K78 PolarHBondContact O-N 3.32Å
77	T	54.8	Low	65.7	Low	111 Å²	111	165.2 Å²	165.2	68%	0.681	78%	0.778	S	S	*	*			trans	-56.1	83.8	155.8	44.8	0	0	0	0	105.6	I75 L79	I75-T77 HydrophobicContact CG2-CG2 4.13Å; I75-T77 PolarHBondContact O-N 3.39Å; T77-L79 PolarHBondContact O-N 3.14Å
78	K	52.9	Low	64.8	Low	192 Å²	192	164.6 Å²	164.6	84%	0.835	78%	0.784	S	S	*	*			trans	-58.5	95	154.4	-83.7	-169.8	176.6	-178	0	103.5	T76 Y80	T76-K78 PolarHBondContact O-N 3.32Å; K78-Y80 PolarHBondContact O-N 3.07Å; K78-Y80 VanDerWaalsContact O-N 3.11Å
79	L	53.8	Low	63.9	Low	148 Å²	148	163.6 Å²	163.6	78%	0.775	78%	0.781	S	S	*	*			trans	-33.2	118.8	163.4	-122.3	100.9	0	0	0	107	T77 R81	T77-L79 PolarHBondContact O-N 3.14Å; L79-R81 VanDerWaalsContact C-N 3.31Å; L79-R81 PolarHBondContact O-N 3.43Å
80	Y	54.1	Low	62.5	Low	219 Å²	219	163.3 Å²	163.3	86%	0.859	79%	0.785	S	S	*	*			trans	-46.4	103.2	159.5	-104.6	-101.4	0	0	0	107.3	K78	K78-Y80 PolarHBondContact O-N 3.07Å; K78-Y80 VanDerWaalsContact O-N 3.11Å
81	R	49.7	Very low	60.8	Low	245 Å²	245	169.4 Å²	169.4	93%	0.925	80%	0.801	S	S	*	*			trans	-99.1	87.4	161.9	-131.5	-177.5	-167.8	-177.6	3.4	104.5	L79	L79-R81 VanDerWaalsContact C-N 3.31Å; L79-R81 PolarHBondContact O-N 3.43Å
82	K	40	Very low	58.8	Low	257 Å²	257	171.5 Å²	171.5	100%	1.117	81%	0.806	S	S	*	*			trans	-90	0	165.2	-164.9	178.7	-168.5	-179.3	0	107.9

Retrieved 82 of 82 residues in 57.3 ms (Link to these results)

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