A0A087YQ05_POEFO Loading...

Peptidyl-tRNA hydrolase 2, mitochondrial

Peptidyl-tRNA hydrolase which releases tRNAs from the ribosome during protein synthesis. Promotes caspase-independent apoptosis by regulating the function of two transcriptional regulators, AES and TLE1.

AlphaFold DB , UniProt , Accession A0A087YQ05, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 177 aa.

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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	V	38.8	Very low	42.4	Very low	192 Å²	192	149.4 Å²	149.4	100%	1.164	82%	0.824	S	S	*	*				0	77.1	0	-171.6	0	0	0	0	106.8
2	T	33.1	Very low	43.4	Very low	120 Å²	120	156.6 Å²	156.6	74%	0.736	83%	0.832	S	S	*	*				98	102.4	85.4	-59	0	0	0	0	110.6
3	V	38.4	Very low	43.2	Very low	127 Å²	127	148.3 Å²	148.3	77%	0.77	81%	0.807	S	S	*	*			trans	60.1	122.5	133.8	-173.3	0	0	0	0	116.4
4	C	36.9	Very low	43.5	Very low	104 Å²	104	147.7 Å²	147.7	70%	0.703	81%	0.814	S	S	*	*				-164.8	119.7	75.6	-137.4	0	0	0	0	112.3
5	R	46.4	Very low	43.9	Very low	235 Å²	235	149.1 Å²	149.1	89%	0.887	82%	0.819	S	S	*	*			trans	-91.1	121.4	157	-129.9	-175.8	-174.4	-177.8	0.3	105.3
6	L	43	Very low	44.5	Very low	159 Å²	159	144.1 Å²	144.1	83%	0.832	81%	0.812	S	S	*	*			trans	-138.4	125	157.5	-85.4	173.9	0	0	0	109.4
7	N	40	Very low	44.9	Very low	132 Å²	132	143.6 Å²	143.6	71%	0.706	81%	0.813	S	S	*	*			trans	-55.8	132.2	-176.8	-76.1	-13.8	0	0	0	112.2	D9	N7-D9 VanDerWaalsContact C-N 3.3Å
8	M	49.2	Very low	45.2	Very low	181 Å²	181	140.2 Å²	140.2	89%	0.892	81%	0.805	S	S	*	*			trans	-98.6	41.1	167.8	-161.4	161.7	68.8	0	0	110.5
9	D	44.8	Very low	45.5	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	81%	0.809	S	S	*	*			trans	-108.9	13.4	-177.2	-66.2	-36.9	0	0	0	113.2	N7	N7-D9 VanDerWaalsContact C-N 3.3Å
10	A	46.7	Very low	45.8	Very low	98 Å²	98	136.3 Å²	136.3	81%	0.81	81%	0.808	S	S	*	*	S	Bend	trans	-111.3	9.9	-176.2	0	0	0	0	0	115
11	L	48.8	Very low	46.1	Very low	152 Å²	152	132.8 Å²	132.8	80%	0.796	80%	0.8	S	S	*	*	S	Bend	trans	-116.8	11.4	-176.1	-143.2	79.3	0	0	0	115.4
12	Y	54.1	Low	46.8	Very low	236 Å²	236	130.3 Å²	130.3	93%	0.925	78%	0.78	S	S	*	*			trans	-131.4	71.9	174	-90.3	-89.1	0	0	0	110.8
13	G	41.1	Very low	47.8	Very low	49 Å²	49	127 Å²	127	51%	0.505	77%	0.77	S	S	.	*			trans	-117.3	139.7	167.1	0	0	0	0	0	110.7	L15 G16	G13-L15 PolarHBondContact O-N 2.98Å; G13-G16 PolarHBondContact O-N 3Å
14	P	47.3	Very low	48.5	Very low	140 Å²	140	125.6 Å²	125.6	91%	0.909	76%	0.764	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	20.3	-171.3	30.4	-35.7	0	0	0	115.4
15	L	49.9	Very low	49.3	Very low	168 Å²	168	123.2 Å²	123.2	88%	0.88	76%	0.757	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	0.1	176.2	-90.6	142.5	0	0	0	113.4	G13	G13-L15 PolarHBondContact O-N 2.98Å
16	G	53.2	Low	49.8	Very low	69 Å²	69	118.2 Å²	118.2	71%	0.711	75%	0.747	S	S	*	*	S	Bend	trans	-94.1	-4.8	-175.9	0	0	0	0	0	117.1	G13	G13-G16 PolarHBondContact O-N 3Å
17	V	51.7	Low	50.5	Low	137 Å²	137	118 Å²	118	83%	0.83	74%	0.74	S	S	*	*	S	Bend	trans	-114.6	-4.1	-172.3	-170.9	0	0	0	0	113.5
18	A	49.4	Very low	51.2	Low	82 Å²	82	118.1 Å²	118.1	68%	0.678	74%	0.74	S	S	*	*	S	Bend	trans	-92.7	1.3	-171.7	0	0	0	0	0	116.2
19	A	51.6	Low	51.5	Low	105 Å²	105	111.5 Å²	111.5	87%	0.868	72%	0.718	S	S	*	*	S	Bend	trans	-111.8	-4.1	-171.4	0	0	0	0	0	116.5
20	A	52	Low	52	Low	97 Å²	97	114.1 Å²	114.1	80%	0.802	72%	0.717	S	S	*	*	S	Bend	trans	-114.2	-4.7	-177.9	0	0	0	0	0	115.1
21	G	51.6	Low	52.3	Low	62 Å²	62	116.2 Å²	116.2	64%	0.639	71%	0.71	S	S	*	*	S	Bend	trans	-102.7	-16.2	-170.9	0	0	0	0	0	116.8
22	L	53.8	Low	52.3	Low	141 Å²	141	115.2 Å²	115.2	74%	0.738	71%	0.705	S	S	*	*	S	Bend	trans	-103.1	-7.6	-170.1	-74.7	164.3	0	0	0	114.9
23	G	52.8	Low	52.1	Low	50 Å²	50	114 Å²	114	52%	0.515	70%	0.699	S	S	.	*	S	Bend	trans	-84.9	-35.8	179.7	0	0	0	0	0	114.7
24	C	53.9	Low	52.3	Low	97 Å²	97	116.5 Å²	116.5	66%	0.655	70%	0.704	S	S	*	*	H	α-helix	trans	-82	-23.9	-175.3	-66.9	0	0	0	0	113.8
25	G	54.2	Low	52.6	Low	54 Å²	54	120.1 Å²	120.1	56%	0.557	70%	0.7	S	S	*	*	H	α-helix	trans	-74.1	-27.7	-177.2	0	0	0	0	0	114.7
26	L	56.6	Low	52.7	Low	130 Å²	130	118.7 Å²	118.7	68%	0.681	69%	0.692	S	S	*	*	H	α-helix	trans	-90.1	-24.8	-174.5	-68.6	170.3	0	0	0	113.6	W30	L26-W30 PolarHBondContact O-N 3.28Å
27	F	57.9	Low	52.3	Low	154 Å²	154	120.9 Å²	120.9	68%	0.675	70%	0.697	S	S	*	*	H	α-helix	trans	-82.6	-33.4	177.9	-80	-83.4	0	0	0	113.7	H31	F27-H31 PolarHBondContact O-N 3.05Å
28	L	54.7	Low	51.9	Low	136 Å²	136	120 Å²	120	71%	0.712	69%	0.694	S	S	*	*	H	α-helix	trans	-75.9	-31.9	173.1	-80	153.5	0	0	0	112.3	L32	L28-L32 PolarHBondContact O-N 2.75Å
29	G	54.7	Low	51.4	Low	42 Å²	42	120.6 Å²	120.6	43%	0.433	70%	0.698	S	S	.	*	H	α-helix	trans	-69	-34.9	176.6	0	0	0	0	0	114	R33	G29-R33 WeakPolarHBondContact O-CB 3.49Å; G29-R33 PolarHBondContact O-N 2.79Å
30	W	55.3	Low	50.6	Low	197 Å²	197	121.5 Å²	121.5	75%	0.746	70%	0.699	S	S	*	*	H	α-helix	trans	-77.3	-32.8	177.6	-155	-14.8	0	0	0	112.2	L26 T34	L26-W30 PolarHBondContact O-N 3.28Å; W30-T34 PolarHBondContact O-OG1 3.22Å
31	H	53.6	Low	49.7	Very low	143 Å²	143	126.7 Å²	126.7	66%	0.662	70%	0.703	S	S	*	*	H	α-helix	trans	-77.9	-22.4	177.8	-89	-68	0	0	0	114.9	F27 T34	F27-H31 PolarHBondContact O-N 3.05Å; H31-T34 PolarHBondContact O-OG1 3.3Å
32	L	49.6	Very low	49	Very low	130 Å²	130	129.1 Å²	129.1	68%	0.681	71%	0.71	S	S	*	*	H	α-helix	trans	-89.2	-22.7	174.7	-155.2	66.1	0	0	0	112.9	L28	L28-L32 PolarHBondContact O-N 2.75Å
33	R	49.8	Very low	48.1	Very low	212 Å²	212	128.3 Å²	128.3	80%	0.8	71%	0.713	S	S	*	*	H	α-helix	trans	-78.9	-15.2	177.7	-157.8	173.9	-174.3	-176.4	1.8	113.9	G29	G29-R33 WeakPolarHBondContact O-CB 3.49Å; G29-R33 PolarHBondContact O-N 2.79Å
34	T	44	Very low	47.1	Very low	100 Å²	100	134.3 Å²	134.3	61%	0.613	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.2	-2.4	175.7	47.7	0	0	0	0	114.1	W30 H31	W30-T34 PolarHBondContact O-OG1 3.22Å; H31-T34 PolarHBondContact O-OG1 3.3Å
35	R	53.9	Low	45.9	Very low	217 Å²	217	138.7 Å²	138.7	82%	0.819	74%	0.738	S	S	*	*	S	Bend	trans	-100.6	-5.3	176.7	-78.4	-91.1	-172.5	176.5	0.1	114.3
36	L	53.4	Low	44.8	Very low	138 Å²	138	140.7 Å²	140.7	72%	0.723	74%	0.744	S	S	*	*	S	Bend	trans	-132.3	92.9	-177.5	-71.8	165.4	0	0	0	111.7
37	S	44	Very low	43.7	Very low	115 Å²	115	142.9 Å²	142.9	80%	0.804	75%	0.75	S	S	*	*			trans	85.7	155.1	153.7	-62.8	0	0	0	0	119.4
38	P	43.9	Very low	42.6	Very low	118 Å²	118	144.9 Å²	144.9	77%	0.766	76%	0.762	S	S	*	*			cis	-138	172.2	8.5	36.1	-15.4	0	0	0	117.9
39	A	37.3	Very low	41.5	Very low	94 Å²	94	148.1 Å²	148.1	78%	0.777	77%	0.77	S	S	*	*			trans	85.9	119.2	141.8	0	0	0	0	0	121.1
40	S	35.3	Very low	40.8	Very low	125 Å²	125	150.1 Å²	150.1	87%	0.874	79%	0.791	S	S	*	*			trans	-140	122.6	133.3	-170.3	0	0	0	0	109.9
41	K	33.7	Very low	39.9	Very low	205 Å²	205	145.7 Å²	145.7	89%	0.891	79%	0.79	S	S	*	*			trans	-81.3	134.9	172.6	-69.3	171.8	174.4	176.3	0	108.1
42	S	36.2	Very low	39.5	Very low	113 Å²	113	143.7 Å²	143.7	79%	0.79	80%	0.798	S	S	*	*			trans	-123.1	145.5	160.9	66.6	0	0	0	0	110.4
43	P	35.3	Very low	38.9	Very low	124 Å²	124	146.4 Å²	146.4	81%	0.805	81%	0.807	S	S	*	*			trans	-88.5	134.5	-172.9	34.2	-31.4	0	0	0	112.6
44	M	31.7	Very low	38.4	Very low	176 Å²	176	142.9 Å²	142.9	87%	0.867	81%	0.805	S	S	*	*				29.5	117.2	130	-150.4	154.2	121.4	0	0	119.1
45	K	29.8	Very low	38	Very low	190 Å²	190	142.5 Å²	142.5	83%	0.826	81%	0.806	S	S	*	*			trans	-139.8	112.3	142	-149	178.6	-175.6	-168.9	0	109.3
46	S	30.1	Very low	37.7	Very low	96 Å²	96	138 Å²	138	67%	0.671	80%	0.802	S	S	*	*			trans	-82.6	124.1	171.3	47.8	0	0	0	0	109.2
47	E	33.5	Very low	37.6	Very low	176 Å²	176	139.4 Å²	139.4	82%	0.822	81%	0.807	S	S	*	*			trans	-129.1	116	153.9	-81.3	-172	-178.1	0	0	107.9
48	E	34.1	Very low	37.6	Very low	195 Å²	195	136.9 Å²	136.9	91%	0.911	80%	0.799	S	S	*	*			trans	-89.6	118	179.5	-166.8	176.6	-158.4	0	0	107.3
49	K	31.5	Very low	37.9	Very low	204 Å²	204	141 Å²	141	89%	0.887	81%	0.808	S	S	*	*			trans	-144.1	95.7	160	-136.2	178.4	-173.4	-179.1	0	108.7	S51	K49-S51 PolarHBondContact O-N 3.06Å
50	G	41.8	Very low	38.8	Very low	85 Å²	85	139.2 Å²	139.2	88%	0.876	80%	0.8	S	S	*	*			trans	-58.1	120.4	171.3	0	0	0	0	0	110.5
51	S	35.8	Very low	40.6	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	78%	0.779	S	S	*	*			trans	-134.1	123.2	157.3	168.2	0	0	0	0	104.7	K49 E53	K49-S51 PolarHBondContact O-N 3.06Å; S51-E53 PolarHBondContact O-N 2.66Å
52	A	44.6	Very low	43.5	Very low	100 Å²	100	131.9 Å²	131.9	83%	0.826	77%	0.766	S	S	*	*			trans	-40.1	109.7	-178.6	0	0	0	0	0	111.3	D54	A52-D54 VanDerWaalsContact C-N 3.27Å; A52-D54 PolarHBondContact O-N 2.64Å
53	E	37	Very low	46.4	Very low	188 Å²	188	127.1 Å²	127.1	88%	0.879	73%	0.731	S	S	*	*			trans	-74.3	87.1	173.3	22.2	-170.6	149.2	0	0	106.5	S51 S55	S51-E53 PolarHBondContact O-N 2.66Å; E53-S55 VanDerWaalsContact C-N 3.31Å; E53-S55 PolarHBondContact O-N 3.49Å
54	D	39.9	Very low	49.4	Very low	138 Å²	138	122.4 Å²	122.4	74%	0.738	70%	0.698	S	S	*	*			trans	-57.2	106.3	150.9	-171.1	21.5	0	0	0	105.5	A52 V56	A52-D54 VanDerWaalsContact C-N 3.27Å; A52-D54 PolarHBondContact O-N 2.64Å; D54-V56 PolarHBondContact O-N 3.01Å
55	S	36.1	Very low	52.6	Low	92 Å²	92	114 Å²	114	64%	0.643	66%	0.657	S	S	*	*			trans	-66.2	85	178.7	50	0	0	0	0	108.1	E53 M57	E53-S55 VanDerWaalsContact C-N 3.31Å; E53-S55 PolarHBondContact O-N 3.49Å; S55-M57 PolarHBondContact O-N 3.16Å
56	V	47.5	Very low	55.9	Low	121 Å²	121	105.1 Å²	105.1	73%	0.733	62%	0.618	S	S	*	*			trans	-66	84.4	166.2	-178	0	0	0	0	106.6	D54 G58	D54-V56 PolarHBondContact O-N 3.01Å; V56-G58 PolarHBondContact O-N 3.07Å
57	M	50.9	Low	59.2	Low	168 Å²	168	100.9 Å²	100.9	83%	0.828	59%	0.588	S	S	*	*			trans	-52.3	121.6	155.6	-70.8	-77.5	-178.2	0	0	105.7	S55	S55-M57 PolarHBondContact O-N 3.16Å
58	G	43.5	Very low	62.3	Low	63 Å²	63	92.5 Å²	92.5	65%	0.649	55%	0.549	S	S	*	.			trans	-51.2	154.4	179.9	0	0	0	0	0	111.1	V56 G60	V56-G58 PolarHBondContact O-N 3.07Å; G58-G60 PolarHBondContact O-N 2.84Å
59	E	51	Low	65.4	Low	203 Å²	203	83.2 Å²	83.2	95%	0.949	51%	0.505	S	S	*	.	S	Bend	trans	-59.2	34.5	177.9	-64.5	176.9	122.8	0	0	114.8	G61	E59-G61 VanDerWaalsContact C-N 3.25Å; E59-G61 PolarHBondContact O-N 3.23Å
60	G	55.5	Low	68.5	Low	58 Å²	58	74.3 Å²	74.3	60%	0.598	47%	0.466	S	S	*	.			trans	-76.7	78.5	162.8	0	0	0	0	0	109.1	G58	G58-G60 PolarHBondContact O-N 2.84Å
61	G	73.7	Confident	71.1	Confident	42 Å²	42	73.1 Å²	73.1	43%	0.433	44%	0.439	S	S	.	.			trans	-54.5	158.9	171.3	0	0	0	0	0	111.7	E59 F63	E59-G61 VanDerWaalsContact C-N 3.25Å; E59-G61 PolarHBondContact O-N 3.23Å; G61-F63 WeakPolarHBondContact O-CD2 3.35Å; G61-F63 VanDerWaalsContact O-CE2 3.26Å; G61-F63 WeakPolarHBondContact O-CE2 3.44Å; G61-F63 PolarHBondContact O-N 3.01Å
62	E	93.1	Very high	74	Confident	134 Å²	134	71.2 Å²	71.2	63%	0.626	42%	0.421	S	S	*	.			trans	-59	134.8	175.4	-172.9	-177.6	-176.6	0	0	110.1	P163 A164	E62-P163 CarbonylContact O-C 3.6Å; E62-A164 HydrophobicContact CB-CB 3.83Å; E62-A164 HydrophobicContact CG-CB 3.92Å; E62-A164 VanDerWaalsContact O-CB 3.25Å; E62-A164 WeakPolarHBondContact O-CB 3.4Å; E62-A164 PolarHBondContact O-N 2.89Å
63	F	98	Very high	76.4	Confident	13 Å²	13	68 Å²	68	6%	0.057	39%	0.39	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	142.7	175	-78.3	-100.3	0	0	0	110.3	G61 L102 Q105 W106 P112 G162 P163	G61-F63 WeakPolarHBondContact O-CD2 3.35Å; G61-F63 VanDerWaalsContact O-CE2 3.26Å; G61-F63 WeakPolarHBondContact O-CE2 3.44Å; G61-F63 PolarHBondContact O-N 3.01Å; F63-L102 HydrophobicContact CD1-CG 4.32Å; F63-L102 HydrophobicContact CE1-CD1 4.38Å; F63-L102 HydrophobicContact CE1-CG 3.92Å; F63-Q105 HydrophobicContact CD1-CB 4.41Å; F63-Q105 HydrophobicContact CD2-CB 3.82Å; F63-Q105 HydrophobicContact CE1-CB 4.27Å; F63-Q105 HydrophobicContact CE2-CB 3.67Å; F63-Q105 HydrophobicContact CE2-CG 4.24Å; F63-Q105 HydrophobicContact CG-CB 4.23Å; F63-Q105 HydrophobicContact CZ-CB 3.92Å; F63-Q105 HydrophobicContact CZ-CG 4.36Å; F63-W106 HydrophobicContact CB-CB 3.92Å; F63-W106 HydrophobicContact CB-CG 4.39Å; F63-W106 HydrophobicContact CG-CB 4.5Å; F63-P112 WeakPolarHBondContact O-CG 3.3Å; F63-G162 CarbonylContact C-O 3.54Å; F63-G162 VanDerWaalsContact CA-O 3.3Å; F63-G162 WeakPolarHBondContact CA-O 3.2Å; F63-P163 HydrophobicContact CE1-CG 3.92Å; F63-P163 HydrophobicContact CZ-CG 4.22Å
64	K	98.5	Very high	79.1	Confident	25 Å²	25	66.4 Å²	66.4	11%	0.109	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-151	165.8	174.5	70.8	-166.7	-175.3	-173	0	114	P112 P161 G162 A164 V167 D168	K64-P112 HydrophobicContact CB-CG 4.08Å; K64-P161 VanDerWaalsContact O-CA 3.31Å; K64-P161 WeakPolarHBondContact O-CA 3.39Å; K64-G162 PolarHBondContact N-O 2.66Å; K64-G162 PolarHBondContact O-N 2.65Å; K64-A164 HydrophobicContact CD-CB 3.94Å; K64-A164 HydrophobicContact CG-CB 4.23Å; K64-V167 HydrophobicContact CG-CB 4.25Å; K64-V167 HydrophobicContact CG-CG1 4.1Å; K64-D168 WeakPolarHBondContact CE-OD1 3.42Å; K64-D168 IonicContact NZ-OD1 3.74Å; K64-D168 PolarHBondContact NZ-OD1 2.95Å; K64-D168 IonicContact NZ-OD2 3.78Å; K64-D168 PolarHBondContact NZ-OD2 3.08Å
65	M	98.8	Very high	81.6	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	138	167.1	177.1	-171.3	-69.7	0	0	109.1	L67 A88 A91 W106 P112 K113 V114 I159	M65-L67 HydrophobicContact CG-CD2 4.16Å; M65-L67 HydrophobicContact SD-CD2 3.82Å; M65-A88 HydrophobicContact SD-CB 3.79Å; M65-A91 HydrophobicContact CE-CB 3.62Å; M65-A91 HydrophobicContact SD-CB 4.45Å; M65-W106 HydrophobicContact CB-CZ2 3.92Å; M65-W106 HydrophobicContact CE-CH2 3.84Å; M65-W106 HydrophobicContact CE-CZ2 4.01Å; M65-W106 HydrophobicContact SD-CZ2 4.47Å; M65-P112 PolarHBondContact N-O 2.6Å; M65-K113 HydrophobicContact CB-CG 4.37Å; M65-K113 CarbonylContact O-C 3.59Å; M65-K113 VanDerWaalsContact O-CA 3.3Å; M65-K113 WeakPolarHBondContact O-CA 3.39Å; M65-K113 HydrophobicContact SD-CG 4.36Å; M65-V114 PolarHBondContact O-N 3.49Å; M65-I159 WeakPolarHBondContact CA-O 3.18Å
66	V	98.9	Very high	84.4	Confident	3 Å²	3	58.4 Å²	58.4	2%	0.018	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	133.3	173.9	175.1	0	0	0	0	109.7	V68 V114 V116 G158 I159 V167 T171	V66-V68 HydrophobicContact CG1-CG2 4.07Å; V66-V114 CarbonylContact C-O 3.29Å; V66-V114 WeakPolarHBondContact CA-O 3.36Å; V66-V114 HydrophobicContact CG2-CB 4.37Å; V66-V116 HydrophobicContact CG1-CG1 4.26Å; V66-V116 HydrophobicContact CG1-CG2 3.49Å; V66-V116 VanDerWaalsContact CG1-CG2 3.49Å; V66-G158 CarbonylContact O-C 3.51Å; V66-G158 WeakPolarHBondContact O-CA 3.06Å; V66-I159 PolarHBondContact N-O 3.2Å; V66-I159 PolarHBondContact O-N 2.93Å; V66-V167 HydrophobicContact CB-CG1 4.06Å; V66-V167 HydrophobicContact CG2-CG1 3.45Å; V66-V167 VanDerWaalsContact CG2-CG1 3.45Å; V66-T171 HydrophobicContact CB-CG2 4.32Å; V66-T171 HydrophobicContact CG1-CG2 3.99Å
67	L	98.9	Very high	86.7	Confident	6 Å²	6	61.7 Å²	61.7	3%	0.031	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	106	177.5	-56.7	178.1	0	0	0	108	M65 C84 A87 A88 V114 V115 V116 V156	M65-L67 HydrophobicContact CG-CD2 4.16Å; M65-L67 HydrophobicContact SD-CD2 3.82Å; L67-C84 HydrophobicContact CD1-CB 3.71Å; L67-A87 HydrophobicContact CD2-CB 3.92Å; L67-A88 HydrophobicContact CD1-CB 4.5Å; L67-A88 HydrophobicContact CD2-CB 4.42Å; L67-V114 PolarHBondContact N-O 3.22Å; L67-V115 HydrophobicContact CB-CG1 4.48Å; L67-V115 HydrophobicContact CB-CG2 4.4Å; L67-V115 HydrophobicContact CD1-CG2 4.41Å; L67-V115 WeakPolarHBondContact O-CA 3.25Å; L67-V116 PolarHBondContact O-N 2.88Å; L67-V156 HydrophobicContact CB-CG1 4.41Å
68	V	98.8	Very high	88.8	Confident	0 Å²	0	56.5 Å²	56.5	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.2	113.7	-178.6	-171.5	0	0	0	0	109.1	V66 V116 A118 L124 L127 V156 L157 I159 T171 L174	V66-V68 HydrophobicContact CG1-CG2 4.07Å; V68-V116 HydrophobicContact CB-CG2 4.14Å; V68-V116 HydrophobicContact CG1-CG2 4.22Å; V68-V116 HydrophobicContact CG2-CG2 3.73Å; V68-A118 HydrophobicContact CG1-CB 3.63Å; V68-L124 HydrophobicContact CB-CD1 4.03Å; V68-L124 HydrophobicContact CG1-CD1 3.81Å; V68-L127 HydrophobicContact CG1-CD1 3.9Å; V68-L127 HydrophobicContact CG2-CD1 4.4Å; V68-V156 CarbonylContact O-C 3.56Å; V68-V156 VanDerWaalsContact O-CA 3.29Å; V68-V156 WeakPolarHBondContact O-CA 3.42Å; V68-L157 HydrophobicContact CB-CB 4.3Å; V68-L157 PolarHBondContact N-O 2.8Å; V68-L157 PolarHBondContact O-N 3.29Å; V68-I159 HydrophobicContact CG2-CD1 4.16Å; V68-T171 HydrophobicContact CG2-CG2 4.36Å; V68-L174 HydrophobicContact CG1-CD1 4.04Å; V68-L174 HydrophobicContact CG2-CD1 4.03Å
69	V	98.6	Very high	91.2	Very high	0 Å²	0	55.3 Å²	55.3	0%	0	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	133	-177.8	-175	0	0	0	0	110.3	N71 M75 V80 V115 V116 K117 A118 V156 Y177	V69-N71 PolarHBondContact O-N 3.39Å; V69-M75 HydrophobicContact CG1-CE 3.58Å; V69-V80 HydrophobicContact CG1-CG1 4.05Å; V69-V80 HydrophobicContact CG1-CG2 4.37Å; V69-V80 HydrophobicContact CG2-CG1 4.02Å; V69-V115 HydrophobicContact CG2-CG1 3.55Å; V69-V116 PolarHBondContact N-O 3.41Å; V69-K117 CarbonylContact O-C 3.51Å; V69-K117 VanDerWaalsContact O-CA 3.3Å; V69-K117 WeakPolarHBondContact O-CA 3.3Å; V69-A118 PolarHBondContact O-N 2.83Å; V69-V156 HydrophobicContact CB-CG2 4.47Å; V69-V156 HydrophobicContact CG1-CG2 4.31Å; V69-V156 HydrophobicContact CG2-CG2 4.11Å; V69-Y177 HydrophobicContact CB-CD2 3.68Å; V69-Y177 HydrophobicContact CB-CE2 3.9Å; V69-Y177 HydrophobicContact CG1-CD2 3.91Å; V69-Y177 HydrophobicContact CG1-CE2 3.56Å; V69-Y177 HydrophobicContact CG2-CD2 4.12Å
70	R	98.1	Very high	93.3	Very high	18 Å²	18	46 Å²	46	7%	0.068	27%	0.27	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	123.7	170	-92.7	178.7	67.8	175.8	15.3	112.3	D72 L73 E121 L124 R154 T155	R70-D72 WeakPolarHBondContact CB-OD1 3.16Å; R70-D72 IonicContact CZ-OD1 2.75Å; R70-D72 IonicContact CZ-OD2 2.98Å; R70-D72 IonicContact NE-OD1 2.78Å; R70-D72 PolarHBondContact NE-OD1 3.43Å; R70-D72 IonicContact NE-OD2 3.79Å; R70-D72 PolarHBondContact NE-OD2 3.27Å; R70-D72 IonicContact NH2-OD1 3.53Å; R70-D72 IonicContact NH2-OD2 3.61Å; R70-D72 PolarHBondContact NH2-OD2 3.44Å; R70-L73 HydrophobicContact CB-CD1 3.95Å; R70-L73 HydrophobicContact CB-CG 4.09Å; R70-E121 IonicContact CZ-OE2 3.67Å; R70-E121 IonicContact NH1-OE2 3.71Å; R70-E121 PolarHBondContact NH1-OE2 2.83Å; R70-E121 IonicContact NH2-OE2 2.73Å; R70-L124 HydrophobicContact CG-CB 4.42Å; R70-L124 HydrophobicContact CG-CD2 4.13Å; R70-R154 WeakPolarHBondContact CD-O 3.01Å; R70-R154 PolarHBondContact NH1-O 3.4Å; R70-T155 PolarHBondContact N-O 3.24Å
71	N	96.7	Very high	95.4	Very high	59 Å²	59	46 Å²	46	32%	0.316	26%	0.263	S	S	.	.	S	Bend	trans	-94.6	-18	-175.3	-171.9	46.1	0	0	0	114.1	V69 L73 K74 K117 A118	V69-N71 PolarHBondContact O-N 3.39Å; N71-L73 VanDerWaalsContact C-N 3.28Å; N71-K74 WeakPolarHBondContact O-CD 3.3Å; N71-K74 WeakPolarHBondContact O-CE 3.26Å; N71-K74 PolarHBondContact O-NZ 3.23Å; N71-K117 HydrophobicContact CB-CB 4.26Å; N71-A118 WeakPolarHBondContact CB-O 3.43Å; N71-A118 PolarHBondContact N-O 2.77Å
72	D	96.5	Very high	96.4	Very high	65 Å²	65	46 Å²	46	35%	0.348	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.2	-32.9	172	58.5	-33.2	0	0	0	112.3	R70 K74 P119	R70-D72 WeakPolarHBondContact CB-OD1 3.16Å; R70-D72 IonicContact CZ-OD1 2.75Å; R70-D72 IonicContact CZ-OD2 2.98Å; R70-D72 IonicContact NE-OD1 2.78Å; R70-D72 PolarHBondContact NE-OD1 3.43Å; R70-D72 IonicContact NE-OD2 3.79Å; R70-D72 PolarHBondContact NE-OD2 3.27Å; R70-D72 IonicContact NH2-OD1 3.53Å; R70-D72 IonicContact NH2-OD2 3.61Å; R70-D72 PolarHBondContact NH2-OD2 3.44Å; D72-K74 PolarHBondContact O-N 3.03Å; D72-K74 VanDerWaalsContact O-N 3.16Å; D72-P119 WeakPolarHBondContact CB-O 3.42Å; D72-P119 PolarHBondContact N-O 2.73Å
73	L	94.4	Very high	96.6	Very high	33 Å²	33	40.3 Å²	40.3	17%	0.173	23%	0.233	C	C	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-9.5	-179.1	-70.9	-172.9	0	0	0	115.5	R70 N71 M75 I149 T155	R70-L73 HydrophobicContact CB-CD1 3.95Å; R70-L73 HydrophobicContact CB-CG 4.09Å; N71-L73 VanDerWaalsContact C-N 3.28Å; L73-M75 HydrophobicContact CB-CG 4.08Å; L73-M75 HydrophobicContact CD1-CE 4.46Å; L73-M75 PolarHBondContact O-N 2.79Å; L73-I149 HydrophobicContact CB-CD1 3.75Å; L73-I149 HydrophobicContact CD1-CD1 4.04Å; L73-I149 HydrophobicContact CD1-CG2 4.47Å; L73-I149 HydrophobicContact CD2-CD1 4.25Å; L73-I149 HydrophobicContact CD2-CG2 4.01Å; L73-I149 HydrophobicContact CG-CD1 4.22Å; L73-T155 HydrophobicContact CD1-CG2 3.99Å
74	K	92.9	Very high	96.6	Very high	153 Å²	153	40.2 Å²	40.2	67%	0.665	23%	0.234	S	C	*	.			trans	44.3	42	-179.7	-54.1	-55.1	172.2	-155.9	0	114	N71 D72 G76	N71-K74 WeakPolarHBondContact O-CD 3.3Å; N71-K74 WeakPolarHBondContact O-CE 3.26Å; N71-K74 PolarHBondContact O-NZ 3.23Å; D72-K74 PolarHBondContact O-N 3.03Å; D72-K74 VanDerWaalsContact O-N 3.16Å; K74-G76 PolarHBondContact O-N 3.36Å
75	M	94	Very high	96.6	Very high	12 Å²	12	42.3 Å²	42.3	6%	0.059	25%	0.252	C	S	.	.			trans	-62.9	134.6	-179.7	-71	-173.7	-70.7	0	0	111.5	V69 L73 K79 V80 Q83 I149 T155	V69-M75 HydrophobicContact CG1-CE 3.58Å; L73-M75 HydrophobicContact CB-CG 4.08Å; L73-M75 HydrophobicContact CD1-CE 4.46Å; L73-M75 PolarHBondContact O-N 2.79Å; M75-K79 HydrophobicContact CB-CB 4.45Å; M75-K79 HydrophobicContact CB-CD 4.47Å; M75-K79 HydrophobicContact CG-CD 4.03Å; M75-K79 HydrophobicContact CG-CG 4.45Å; M75-K79 HydrophobicContact SD-CD 4.07Å; M75-K79 HydrophobicContact SD-CG 4.16Å; M75-V80 HydrophobicContact CB-CG2 3.51Å; M75-V80 HydrophobicContact CE-CG2 4.36Å; M75-Q83 HydrophobicContact SD-CG 4.32Å; M75-I149 HydrophobicContact CG-CD1 3.46Å; M75-I149 VanDerWaalsContact CG-CD1 3.46Å; M75-I149 HydrophobicContact SD-CD1 4.08Å; M75-T155 HydrophobicContact SD-CG2 3.94Å
76	G	94.3	Very high	96.6	Very high	50 Å²	50	47.4 Å²	47.4	52%	0.515	28%	0.275	S	S	.	.			trans	-63.9	153	170.3	0	0	0	0	0	112	K74 G78 K79 V80	K74-G76 PolarHBondContact O-N 3.36Å; G76-G78 VanDerWaalsContact C-N 3.29Å; G76-G78 PolarHBondContact O-N 3.45Å; G76-G78 VanDerWaalsContact O-N 3.15Å; G76-K79 WeakPolarHBondContact O-CB 3.42Å; G76-K79 PolarHBondContact O-N 3.17Å; G76-V80 PolarHBondContact O-N 3Å
77	K	96.1	Very high	96.5	Very high	190 Å²	190	47.2 Å²	47.2	83%	0.826	27%	0.274	S	S	*	.	H	α-helix	trans	-49.7	-44.7	-174.6	-61.7	-179.2	-178.4	-179.9	0	113.6	K79 V80 A81	K77-K79 PolarHBondContact O-N 2.96Å; K77-V80 PolarHBondContact O-N 2.89Å; K77-A81 PolarHBondContact O-N 3.37Å
78	G	95.3	Very high	96.5	Very high	59 Å²	59	47.5 Å²	47.5	61%	0.608	28%	0.278	S	S	*	.	H	α-helix	trans	-64.2	-39.3	178.9	0	0	0	0	0	113.2	G76 A81 A82	G76-G78 VanDerWaalsContact C-N 3.29Å; G76-G78 PolarHBondContact O-N 3.45Å; G76-G78 VanDerWaalsContact O-N 3.15Å; G78-A81 PolarHBondContact O-N 3.44Å; G78-A82 PolarHBondContact O-N 2.78Å; G78-A82 VanDerWaalsContact O-N 3.08Å
79	K	92.7	Very high	96.5	Very high	39 Å²	39	51.3 Å²	51.3	17%	0.17	30%	0.301	C	S	.	.	H	α-helix	trans	-67.2	-42.9	176.1	-171.5	175.6	-178	-172.2	0	111	M75 G76 K77 A81 A82 Q83 D143 T147 I149	M75-K79 HydrophobicContact CB-CB 4.45Å; M75-K79 HydrophobicContact CB-CD 4.47Å; M75-K79 HydrophobicContact CG-CD 4.03Å; M75-K79 HydrophobicContact CG-CG 4.45Å; M75-K79 HydrophobicContact SD-CD 4.07Å; M75-K79 HydrophobicContact SD-CG 4.16Å; G76-K79 WeakPolarHBondContact O-CB 3.42Å; G76-K79 PolarHBondContact O-N 3.17Å; K77-K79 PolarHBondContact O-N 2.96Å; K79-A81 VanDerWaalsContact C-N 3.34Å; K79-A81 PolarHBondContact O-N 3.14Å; K79-A82 PolarHBondContact O-N 3.29Å; K79-Q83 HydrophobicContact CG-CG 4.14Å; K79-Q83 WeakPolarHBondContact O-CB 3.49Å; K79-Q83 WeakPolarHBondContact O-CG 3.46Å; K79-Q83 PolarHBondContact O-N 3.5Å; K79-D143 VanDerWaalsContact NZ-CG 3.31Å; K79-D143 IonicContact NZ-OD1 3.42Å; K79-D143 IonicContact NZ-OD2 2.7Å; K79-D143 PolarHBondContact NZ-OD2 2.89Å; K79-T147 HydrophobicContact CD-CG2 4.14Å; K79-T147 PolarHBondContact NZ-OG1 3.16Å; K79-I149 VanDerWaalsContact NZ-CD1 3.25Å; K79-I149 VanDerWaalsContact NZ-CG1 3.3Å
80	V	96.5	Very high	96.5	Very high	8 Å²	8	53.4 Å²	53.4	5%	0.048	32%	0.316	C	S	.	.	H	α-helix	trans	-58.8	-47.3	176.6	176.7	0	0	0	0	111	V69 M75 G76 K77 A82 Q83 C84 Y177	V69-V80 HydrophobicContact CG1-CG1 4.05Å; V69-V80 HydrophobicContact CG1-CG2 4.37Å; V69-V80 HydrophobicContact CG2-CG1 4.02Å; M75-V80 HydrophobicContact CB-CG2 3.51Å; M75-V80 HydrophobicContact CE-CG2 4.36Å; G76-V80 PolarHBondContact O-N 3Å; K77-V80 PolarHBondContact O-N 2.89Å; V80-A82 VanDerWaalsContact C-N 3.34Å; V80-A82 PolarHBondContact O-N 3.35Å; V80-Q83 PolarHBondContact O-N 3.03Å; V80-C84 VanDerWaalsContact O-CB 3.29Å; V80-C84 WeakPolarHBondContact O-CB 3.4Å; V80-C84 PolarHBondContact O-N 3.39Å; V80-C84 PolarHBondContact O-SG 2.86Å; V80-Y177 HydrophobicContact CB-CE1 4.44Å; V80-Y177 HydrophobicContact CG1-CD1 4.3Å; V80-Y177 HydrophobicContact CG1-CE1 3.83Å; V80-Y177 HydrophobicContact CG1-CE2 4.48Å; V80-Y177 HydrophobicContact CG2-CE1 4.23Å; V80-Y177 VanDerWaalsContact CG2-OH 3.31Å; V80-Y177 WeakPolarHBondContact CG2-OH 3.5Å
81	A	97.6	Very high	96.5	Very high	56 Å²	56	52.6 Å²	52.6	46%	0.463	31%	0.312	S	S	.	.	H	α-helix	trans	-58.4	-44.6	177.4	0	0	0	0	0	112.2	K77 G78 K79 S85	K77-A81 PolarHBondContact O-N 3.37Å; G78-A81 PolarHBondContact O-N 3.44Å; K79-A81 VanDerWaalsContact C-N 3.34Å; K79-A81 PolarHBondContact O-N 3.14Å; A81-S85 WeakPolarHBondContact O-CB 3.49Å; A81-S85 PolarHBondContact O-N 2.93Å; A81-S85 PolarHBondContact O-OG 3.02Å
82	A	96.2	Very high	96.6	Very high	44 Å²	44	53.2 Å²	53.2	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-63.6	-45.7	177.6	0	0	0	0	0	112.1	G78 K79 V80 S85 H86	G78-A82 PolarHBondContact O-N 2.78Å; G78-A82 VanDerWaalsContact O-N 3.08Å; K79-A82 PolarHBondContact O-N 3.29Å; V80-A82 VanDerWaalsContact C-N 3.34Å; V80-A82 PolarHBondContact O-N 3.35Å; A82-S85 WeakPolarHBondContact O-CB 3.49Å; A82-S85 PolarHBondContact O-N 3.06Å; A82-H86 PolarHBondContact O-CD2 3.28Å; A82-H86 VanDerWaalsContact O-CD2 3.24Å; A82-H86 PolarHBondContact O-N 2.95Å
83	Q	96.7	Very high	96.7	Very high	14 Å²	14	55.1 Å²	55.1	7%	0.065	32%	0.316	C	S	.	.	H	α-helix	trans	-66.9	-40.8	-179.5	-63.6	-71.1	-37.9	0	0	112	M75 K79 V80 S85 H86 A87 T155 V156	M75-Q83 HydrophobicContact SD-CG 4.32Å; K79-Q83 HydrophobicContact CG-CG 4.14Å; K79-Q83 WeakPolarHBondContact O-CB 3.49Å; K79-Q83 WeakPolarHBondContact O-CG 3.46Å; K79-Q83 PolarHBondContact O-N 3.5Å; V80-Q83 PolarHBondContact O-N 3.03Å; Q83-S85 VanDerWaalsContact C-N 3.32Å; Q83-S85 PolarHBondContact O-N 3.04Å; Q83-H86 PolarHBondContact O-N 3.39Å; Q83-A87 PolarHBondContact O-N 3.46Å; Q83-T155 PolarHBondContact OE1-OG1 3.26Å; Q83-V156 HydrophobicContact CB-CB 4.4Å; Q83-V156 HydrophobicContact CB-CG2 3.59Å
84	C	98.4	Very high	96.9	Very high	11 Å²	11	55.3 Å²	55.3	7%	0.074	32%	0.316	C	S	.	.	H	α-helix	trans	-59.6	-42.3	170.7	-73.9	0	0	0	0	111.9	L67 V80 A87 A88	L67-C84 HydrophobicContact CD1-CB 3.71Å; V80-C84 VanDerWaalsContact O-CB 3.29Å; V80-C84 WeakPolarHBondContact O-CB 3.4Å; V80-C84 PolarHBondContact O-N 3.39Å; V80-C84 PolarHBondContact O-SG 2.86Å; C84-A87 PolarHBondContact O-N 3.39Å; C84-A88 WeakPolarHBondContact O-CB 3.34Å; C84-A88 PolarHBondContact O-N 2.89Å
85	S	98.5	Very high	97.2	Very high	68 Å²	68	48.1 Å²	48.1	48%	0.476	29%	0.285	S	S	.	.	H	α-helix	trans	-63.8	-41.7	176.8	-57.5	0	0	0	0	111.6	A81 A82 Q83 A88 V89	A81-S85 WeakPolarHBondContact O-CB 3.49Å; A81-S85 PolarHBondContact O-N 2.93Å; A81-S85 PolarHBondContact O-OG 3.02Å; A82-S85 WeakPolarHBondContact O-CB 3.49Å; A82-S85 PolarHBondContact O-N 3.06Å; Q83-S85 VanDerWaalsContact C-N 3.32Å; Q83-S85 PolarHBondContact O-N 3.04Å; S85-A88 PolarHBondContact O-N 2.86Å; S85-V89 WeakPolarHBondContact O-CB 3.49Å; S85-V89 WeakPolarHBondContact O-CG2 3.47Å; S85-V89 PolarHBondContact O-N 3.08Å
86	H	97.7	Very high	97.4	Very high	107 Å²	107	52.1 Å²	52.1	50%	0.495	30%	0.304	S	S	.	.	H	α-helix	trans	-61	-45.5	174.3	-70.1	-43.6	0	0	0	112.3	A82 Q83 S90 I141	A82-H86 PolarHBondContact O-CD2 3.28Å; A82-H86 VanDerWaalsContact O-CD2 3.24Å; A82-H86 PolarHBondContact O-N 2.95Å; Q83-H86 PolarHBondContact O-N 3.39Å; H86-S90 WeakPolarHBondContact O-CB 3.24Å; H86-S90 PolarHBondContact O-N 3.4Å; H86-I141 HydrophobicContact CB-CD1 4.03Å; H86-I141 HydrophobicContact CB-CG1 4.19Å; H86-I141 HydrophobicContact CB-CG2 4.2Å
87	A	98.4	Very high	97.6	Very high	0 Å²	0	58.5 Å²	58.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-59.6	-48.2	176.7	0	0	0	0	0	111.4	L67 Q83 C84 S90 A91 S139 I141 V156	L67-A87 HydrophobicContact CD2-CB 3.92Å; Q83-A87 PolarHBondContact O-N 3.46Å; C84-A87 PolarHBondContact O-N 3.39Å; A87-S90 PolarHBondContact O-N 3.31Å; A87-A91 WeakPolarHBondContact O-CB 3.33Å; A87-A91 PolarHBondContact O-N 3.21Å; A87-S139 PolarHBondContact O-OG 3.38Å; A87-I141 HydrophobicContact CB-CD1 4.37Å; A87-I141 HydrophobicContact CB-CG1 3.66Å; A87-V156 HydrophobicContact CB-CB 4.46Å; A87-V156 HydrophobicContact CB-CG1 3.78Å
88	A	98.8	Very high	97.6	Very high	12 Å²	12	57.6 Å²	57.6	10%	0.099	30%	0.303	C	S	.	.	H	α-helix	trans	-62.9	-47.5	-179.3	0	0	0	0	0	112.7	M65 L67 C84 S85 S90 A91 Y92 K113	M65-A88 HydrophobicContact SD-CB 3.79Å; L67-A88 HydrophobicContact CD1-CB 4.5Å; L67-A88 HydrophobicContact CD2-CB 4.42Å; C84-A88 WeakPolarHBondContact O-CB 3.34Å; C84-A88 PolarHBondContact O-N 2.89Å; S85-A88 PolarHBondContact O-N 2.86Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.06Å; A88-A91 PolarHBondContact O-N 2.91Å; A88-Y92 WeakPolarHBondContact O-CB 2.99Å; A88-Y92 PolarHBondContact O-N 3.24Å; A88-K113 HydrophobicContact CB-CD 4.4Å
89	V	98.7	Very high	97.7	Very high	79 Å²	79	56.7 Å²	56.7	48%	0.479	29%	0.288	S	S	.	.	H	α-helix	trans	-65.8	-38.2	179	172.2	0	0	0	0	111.4	S85 K93	S85-V89 WeakPolarHBondContact O-CB 3.49Å; S85-V89 WeakPolarHBondContact O-CG2 3.47Å; S85-V89 PolarHBondContact O-N 3.08Å; V89-K93 HydrophobicContact CG1-CD 4.41Å; V89-K93 WeakPolarHBondContact O-CG 3.33Å; V89-K93 PolarHBondContact O-N 3.28Å
90	S	98.6	Very high	97.9	Very high	45 Å²	45	57.1 Å²	57.1	32%	0.315	29%	0.294	S	S	.	.	H	α-helix	trans	-66.9	-44.3	176.9	173	0	0	0	0	111.5	H86 A87 A88 K93 Q94 S139	H86-S90 WeakPolarHBondContact O-CB 3.24Å; H86-S90 PolarHBondContact O-N 3.4Å; A87-S90 PolarHBondContact O-N 3.31Å; A88-S90 VanDerWaalsContact C-N 3.33Å; A88-S90 PolarHBondContact O-N 3.06Å; S90-K93 PolarHBondContact O-N 3.05Å; S90-Q94 WeakPolarHBondContact O-CG 3.49Å; S90-Q94 PolarHBondContact O-N 3.49Å; S90-Q94 VanDerWaalsContact O-N 3.11Å; S90-S139 WeakPolarHBondContact CB-OG 3.46Å; S90-S139 PolarHBondContact OG-OG 2.98Å
91	A	98.5	Very high	98	Very high	0 Å²	0	62 Å²	62	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-61.6	-46.2	173.8	0	0	0	0	0	112	M65 A87 A88 K93 Q94 V95	M65-A91 HydrophobicContact CE-CB 3.62Å; M65-A91 HydrophobicContact SD-CB 4.45Å; A87-A91 WeakPolarHBondContact O-CB 3.33Å; A87-A91 PolarHBondContact O-N 3.21Å; A88-A91 PolarHBondContact O-N 2.91Å; A91-K93 PolarHBondContact O-N 3.01Å; A91-Q94 WeakPolarHBondContact O-CB 3.27Å; A91-Q94 PolarHBondContact O-N 3.4Å; A91-Q94 VanDerWaalsContact O-N 3.1Å; A91-V95 PolarHBondContact O-N 3.39Å
92	Y	98.7	Very high	97.9	Very high	72 Å²	72	61.1 Å²	61.1	28%	0.282	30%	0.304	S	S	.	.	H	α-helix	trans	-52.6	-52.7	174.7	176.8	-84.5	0	0	0	111.6	A88 Q94 V95 Q96 L103 W106 E107	A88-Y92 WeakPolarHBondContact O-CB 2.99Å; A88-Y92 PolarHBondContact O-N 3.24Å; Y92-Q94 PolarHBondContact O-N 3.27Å; Y92-V95 PolarHBondContact O-N 2.89Å; Y92-Q96 HydrophobicContact CE1-CB 4.42Å; Y92-Q96 VanDerWaalsContact O-CB 3.29Å; Y92-Q96 WeakPolarHBondContact O-CB 3.31Å; Y92-Q96 PolarHBondContact O-N 3.02Å; Y92-L103 HydrophobicContact CD2-CD1 3.64Å; Y92-L103 HydrophobicContact CD2-CD2 4.32Å; Y92-L103 HydrophobicContact CE1-CD2 4.48Å; Y92-L103 HydrophobicContact CE2-CD1 3.68Å; Y92-L103 HydrophobicContact CE2-CD2 3.78Å; Y92-L103 HydrophobicContact CE2-CG 4.18Å; Y92-W106 HydrophobicContact CD2-CZ3 4.12Å; Y92-E107 WeakPolarHBondContact CE2-OE1 3.12Å; Y92-E107 PolarHBondContact OH-OE1 2.82Å
93	K	98.7	Very high	98	Very high	105 Å²	105	59.4 Å²	59.4	46%	0.457	29%	0.289	S	S	.	.	H	α-helix	trans	-62.9	-30.2	180	-74.2	-178.8	179.3	-176.4	0	112.9	V89 S90 A91 R97	V89-K93 HydrophobicContact CG1-CD 4.41Å; V89-K93 WeakPolarHBondContact O-CG 3.33Å; V89-K93 PolarHBondContact O-N 3.28Å; S90-K93 PolarHBondContact O-N 3.05Å; A91-K93 PolarHBondContact O-N 3.01Å; K93-R97 WeakPolarHBondContact O-CG 3.42Å; K93-R97 PolarHBondContact O-NH1 3.06Å
94	Q	98.4	Very high	98.1	Very high	38 Å²	38	66 Å²	66	18%	0.178	31%	0.313	C	S	.	.	H	α-helix	trans	-71.2	-49.6	175.4	-74.2	-177.3	82.6	0	0	111	S90 A91 Y92 R97 R98 T137 V138	S90-Q94 WeakPolarHBondContact O-CG 3.49Å; S90-Q94 PolarHBondContact O-N 3.49Å; S90-Q94 VanDerWaalsContact O-N 3.11Å; A91-Q94 WeakPolarHBondContact O-CB 3.27Å; A91-Q94 PolarHBondContact O-N 3.4Å; A91-Q94 VanDerWaalsContact O-N 3.1Å; Y92-Q94 PolarHBondContact O-N 3.27Å; Q94-R97 PolarHBondContact O-N 3.03Å; Q94-R98 WeakPolarHBondContact O-CG 3.25Å; Q94-R98 PolarHBondContact O-N 3.47Å; Q94-R98 VanDerWaalsContact O-N 3.11Å; Q94-T137 HydrophobicContact CB-CG2 3.77Å; Q94-V138 PolarHBondContact NE2-O 3.11Å; Q94-V138 PolarHBondContact OE1-O 3.44Å
95	V	98.1	Very high	98	Very high	2 Å²	2	69.4 Å²	69.4	1%	0.012	33%	0.328	C	S	.	.	H	α-helix	trans	-66.1	-40.9	-179.9	-179.1	0	0	0	0	111.2	A91 Y92 R97 R98 S99 L102 L103 T137 P161	A91-V95 PolarHBondContact O-N 3.39Å; Y92-V95 PolarHBondContact O-N 2.89Å; V95-R97 PolarHBondContact O-N 3.44Å; V95-R98 PolarHBondContact O-N 3.3Å; V95-S99 WeakPolarHBondContact CG1-O 3.39Å; V95-S99 CarbonylContact O-C 3.59Å; V95-S99 VanDerWaalsContact O-C 3.29Å; V95-S99 PolarHBondContact O-N 3.49Å; V95-L102 HydrophobicContact CG1-CB 4.41Å; V95-L102 HydrophobicContact CG1-CD2 3.62Å; V95-L103 HydrophobicContact CG1-CB 3.92Å; V95-T137 HydrophobicContact CG2-CG2 3.79Å; V95-T137 WeakPolarHBondContact CG2-OG1 3.45Å; V95-P161 HydrophobicContact CB-CG 4.28Å; V95-P161 HydrophobicContact CG1-CG 4.22Å; V95-P161 HydrophobicContact CG2-CG 3.92Å
96	Q	98.4	Very high	98	Very high	96 Å²	96	66.4 Å²	66.4	45%	0.449	31%	0.306	S	S	.	.	H	α-helix	trans	-52.9	-33.4	176.2	-169.7	-179.4	27.9	0	0	112.9	Y92 L103	Y92-Q96 HydrophobicContact CE1-CB 4.42Å; Y92-Q96 VanDerWaalsContact O-CB 3.29Å; Y92-Q96 WeakPolarHBondContact O-CB 3.31Å; Y92-Q96 PolarHBondContact O-N 3.02Å; Q96-L103 HydrophobicContact CB-CD2 3.7Å; Q96-L103 HydrophobicContact CG-CD2 3.91Å
97	R	97.8	Very high	98	Very high	183 Å²	183	64.9 Å²	64.9	69%	0.691	30%	0.299	S	S	*	.	H	α-helix	trans	-87.3	-31.5	178.4	-64.3	-177.5	-160.1	114.6	-9	113.5	K93 Q94 V95	K93-R97 WeakPolarHBondContact O-CG 3.42Å; K93-R97 PolarHBondContact O-NH1 3.06Å; Q94-R97 PolarHBondContact O-N 3.03Å; V95-R97 PolarHBondContact O-N 3.44Å
98	R	97.3	Very high	98	Very high	171 Å²	171	75 Å²	75	65%	0.645	34%	0.339	S	S	*	.	H	α-helix	trans	-95.8	-35.7	-171.2	-69	179.8	-179.1	161	3.4	113.6	Q94 V95	Q94-R98 WeakPolarHBondContact O-CG 3.25Å; Q94-R98 PolarHBondContact O-N 3.47Å; Q94-R98 VanDerWaalsContact O-N 3.11Å; V95-R98 PolarHBondContact O-N 3.3Å
99	S	96.9	Very high	97.8	Very high	40 Å²	40	77 Å²	77	28%	0.28	35%	0.352	S	S	.	.			trans	-153.2	79.7	-177.6	-171.1	0	0	0	0	110.5	V95 E101 L102 L103	V95-S99 WeakPolarHBondContact CG1-O 3.39Å; V95-S99 CarbonylContact O-C 3.59Å; V95-S99 VanDerWaalsContact O-C 3.29Å; V95-S99 PolarHBondContact O-N 3.49Å; S99-E101 PolarHBondContact O-N 3.47Å; S99-L102 PolarHBondContact O-N 3.38Å; S99-L102 VanDerWaalsContact OG-CB 3.24Å; S99-L102 WeakPolarHBondContact OG-CB 3.24Å; S99-L103 PolarHBondContact O-N 3.16Å; S99-L103 VanDerWaalsContact O-N 3.16Å
100	P	97.6	Very high	97.8	Very high	48 Å²	48	76 Å²	76	31%	0.312	36%	0.357	S	S	.	.	H	α-helix	trans	-57.8	-31.7	176.5	-22.4	32.2	0	0	0	113.4	L103 R104	P100-L103 WeakPolarHBondContact O-CB 3.39Å; P100-L103 PolarHBondContact O-N 3.31Å; P100-R104 WeakPolarHBondContact O-CG 3.43Å; P100-R104 PolarHBondContact O-N 3.29Å
101	E	97.2	Very high	97.7	Very high	110 Å²	110	78.2 Å²	78.2	51%	0.514	36%	0.362	S	S	.	.	H	α-helix	trans	-66.5	-46.3	178.8	-64.3	66.9	-142.4	0	0	111.2	S99 L103 R104 Q105	S99-E101 PolarHBondContact O-N 3.47Å; E101-L103 VanDerWaalsContact C-N 3.27Å; E101-L103 PolarHBondContact O-N 2.84Å; E101-R104 PolarHBondContact O-N 3Å; E101-Q105 WeakPolarHBondContact O-CG 3.46Å; E101-Q105 PolarHBondContact O-N 2.79Å
102	L	97	Very high	97.7	Very high	38 Å²	38	80.1 Å²	80.1	20%	0.199	38%	0.375	C	S	.	.	H	α-helix	trans	-60.3	-41	174.6	-175.2	152.7	0	0	0	110.9	F63 V95 S99 R104 Q105 W106 P161	F63-L102 HydrophobicContact CD1-CG 4.32Å; F63-L102 HydrophobicContact CE1-CD1 4.38Å; F63-L102 HydrophobicContact CE1-CG 3.92Å; V95-L102 HydrophobicContact CG1-CB 4.41Å; V95-L102 HydrophobicContact CG1-CD2 3.62Å; S99-L102 PolarHBondContact O-N 3.38Å; S99-L102 VanDerWaalsContact OG-CB 3.24Å; S99-L102 WeakPolarHBondContact OG-CB 3.24Å; L102-R104 PolarHBondContact O-N 3.13Å; L102-Q105 PolarHBondContact O-N 2.98Å; L102-W106 PolarHBondContact O-N 3.08Å; L102-W106 VanDerWaalsContact O-N 3.08Å; L102-P161 HydrophobicContact CD2-CB 4.19Å; L102-P161 HydrophobicContact CD2-CG 3.95Å; L102-P161 VanDerWaalsContact CD2-O 3.24Å; L102-P161 WeakPolarHBondContact CD2-O 3.26Å
103	L	98.2	Very high	97.7	Very high	8 Å²	8	80.8 Å²	80.8	4%	0.042	38%	0.379	C	S	.	.	H	α-helix	trans	-60	-47	177.1	-177.6	63.2	0	0	0	111.2	Y92 V95 Q96 S99 P100 E101 Q105 W106 E107	Y92-L103 HydrophobicContact CD2-CD1 3.64Å; Y92-L103 HydrophobicContact CD2-CD2 4.32Å; Y92-L103 HydrophobicContact CE1-CD2 4.48Å; Y92-L103 HydrophobicContact CE2-CD1 3.68Å; Y92-L103 HydrophobicContact CE2-CD2 3.78Å; Y92-L103 HydrophobicContact CE2-CG 4.18Å; V95-L103 HydrophobicContact CG1-CB 3.92Å; Q96-L103 HydrophobicContact CB-CD2 3.7Å; Q96-L103 HydrophobicContact CG-CD2 3.91Å; S99-L103 PolarHBondContact O-N 3.16Å; S99-L103 VanDerWaalsContact O-N 3.16Å; P100-L103 WeakPolarHBondContact O-CB 3.39Å; P100-L103 PolarHBondContact O-N 3.31Å; E101-L103 VanDerWaalsContact C-N 3.27Å; E101-L103 PolarHBondContact O-N 2.84Å; L103-Q105 VanDerWaalsContact C-N 3.31Å; L103-Q105 PolarHBondContact O-N 2.78Å; L103-W106 HydrophobicContact CD1-CE3 3.82Å; L103-W106 HydrophobicContact CD1-CZ3 4.14Å; L103-W106 PolarHBondContact O-N 2.87Å; L103-E107 HydrophobicContact CD1-CG 4.45Å; L103-E107 HydrophobicContact CG-CG 4.41Å; L103-E107 WeakPolarHBondContact O-CG 3.24Å; L103-E107 PolarHBondContact O-N 2.88Å
104	R	97.9	Very high	97.7	Very high	152 Å²	152	78.3 Å²	78.3	57%	0.574	37%	0.373	S	S	*	.	H	α-helix	trans	-60.6	-38.9	177.8	-72.6	176.2	-169.7	143.6	3.6	112.4	P100 E101 L102 E107 Y108	P100-R104 WeakPolarHBondContact O-CG 3.43Å; P100-R104 PolarHBondContact O-N 3.29Å; E101-R104 PolarHBondContact O-N 3Å; L102-R104 PolarHBondContact O-N 3.13Å; R104-E107 PolarHBondContact O-N 2.85Å; R104-Y108 WeakPolarHBondContact O-CB 3.3Å; R104-Y108 PolarHBondContact O-N 2.95Å
105	Q	97.4	Very high	97.7	Very high	84 Å²	84	78.8 Å²	78.8	39%	0.393	38%	0.378	S	S	.	.	H	α-helix	trans	-62.7	-46.9	176.4	-71	176	-46.1	0	0	111.1	F63 E101 L102 L103 E107 Y108 C109	F63-Q105 HydrophobicContact CD1-CB 4.41Å; F63-Q105 HydrophobicContact CD2-CB 3.82Å; F63-Q105 HydrophobicContact CE1-CB 4.27Å; F63-Q105 HydrophobicContact CE2-CB 3.67Å; F63-Q105 HydrophobicContact CE2-CG 4.24Å; F63-Q105 HydrophobicContact CG-CB 4.23Å; F63-Q105 HydrophobicContact CZ-CB 3.92Å; F63-Q105 HydrophobicContact CZ-CG 4.36Å; E101-Q105 WeakPolarHBondContact O-CG 3.46Å; E101-Q105 PolarHBondContact O-N 2.79Å; L102-Q105 PolarHBondContact O-N 2.98Å; L103-Q105 VanDerWaalsContact C-N 3.31Å; L103-Q105 PolarHBondContact O-N 2.78Å; Q105-E107 PolarHBondContact O-N 2.95Å; Q105-Y108 WeakPolarHBondContact O-CB 3.49Å; Q105-Y108 PolarHBondContact O-N 2.99Å; Q105-C109 PolarHBondContact O-N 2.77Å; Q105-C109 PolarHBondContact O-SG 3.4Å
106	W	98.3	Very high	97.8	Very high	4 Å²	4	79 Å²	79	2%	0.015	38%	0.38	C	S	.	.	H	α-helix	trans	-63.1	-40	175.8	177.6	64	0	0	0	112.9	F63 M65 Y92 L102 L103 C109 Q111 P112 K113 P161	F63-W106 HydrophobicContact CB-CB 3.92Å; F63-W106 HydrophobicContact CB-CG 4.39Å; F63-W106 HydrophobicContact CG-CB 4.5Å; M65-W106 HydrophobicContact CB-CZ2 3.92Å; M65-W106 HydrophobicContact CE-CH2 3.84Å; M65-W106 HydrophobicContact CE-CZ2 4.01Å; M65-W106 HydrophobicContact SD-CZ2 4.47Å; Y92-W106 HydrophobicContact CD2-CZ3 4.12Å; L102-W106 PolarHBondContact O-N 3.08Å; L102-W106 VanDerWaalsContact O-N 3.08Å; L103-W106 HydrophobicContact CD1-CE3 3.82Å; L103-W106 HydrophobicContact CD1-CZ3 4.14Å; L103-W106 PolarHBondContact O-N 2.87Å; W106-C109 PolarHBondContact O-N 2.71Å; W106-Q111 HydrophobicContact CD2-CB 3.94Å; W106-Q111 VanDerWaalsContact CE2-CA 3.46Å; W106-Q111 HydrophobicContact CE3-CB 3.94Å; W106-Q111 HydrophobicContact CH2-CB 3.84Å; W106-Q111 HydrophobicContact CZ2-CB 3.78Å; W106-Q111 WeakPolarHBondContact CZ2-O 3.39Å; W106-Q111 HydrophobicContact CZ3-CB 3.88Å; W106-Q111 VanDerWaalsContact O-CA 3.24Å; W106-Q111 WeakPolarHBondContact O-CA 3.39Å; W106-Q111 PolarHBondContact O-N 2.9Å; W106-P112 PolarHBondContact NE1-O 3.49Å; W106-K113 HydrophobicContact CZ2-CG 3.94Å; W106-P161 HydrophobicContact CB-CB 3.78Å; W106-P161 HydrophobicContact CB-CG 4.4Å; W106-P161 HydrophobicContact CD2-CB 3.47Å; W106-P161 VanDerWaalsContact CD2-CB 3.47Å; W106-P161 HydrophobicContact CD2-CG 3.95Å; W106-P161 HydrophobicContact CE3-CB 4.01Å; W106-P161 HydrophobicContact CE3-CG 3.95Å; W106-P161 HydrophobicContact CG-CB 3.37Å; W106-P161 HydrophobicContact CG-CG 4.19Å; W106-P161 HydrophobicContact CZ3-CG 4.49Å
107	E	97.9	Very high	97.8	Very high	75 Å²	75	77.3 Å²	77.3	35%	0.35	37%	0.371	S	S	.	.	H	α-helix	trans	-62.5	-41.9	174.1	-72.7	173.6	160	0	0	112	Y92 L103 R104 Q105 C109 G110	Y92-E107 WeakPolarHBondContact CE2-OE1 3.12Å; Y92-E107 PolarHBondContact OH-OE1 2.82Å; L103-E107 HydrophobicContact CD1-CG 4.45Å; L103-E107 HydrophobicContact CG-CG 4.41Å; L103-E107 WeakPolarHBondContact O-CG 3.24Å; L103-E107 PolarHBondContact O-N 2.88Å; R104-E107 PolarHBondContact O-N 2.85Å; Q105-E107 PolarHBondContact O-N 2.95Å; E107-C109 VanDerWaalsContact C-N 3.27Å; E107-C109 PolarHBondContact O-N 2.82Å; E107-G110 WeakPolarHBondContact O-CA 3.49Å; E107-G110 PolarHBondContact O-N 3.33Å
108	Y	97.1	Very high	97.8	Very high	213 Å²	213	68.6 Å²	68.6	84%	0.835	34%	0.338	S	S	*	.	H	α-helix	trans	-61.9	-35	175.5	-174.8	-97.9	0	0	0	112.2	R104 Q105 G110	R104-Y108 WeakPolarHBondContact O-CB 3.3Å; R104-Y108 PolarHBondContact O-N 2.95Å; Q105-Y108 WeakPolarHBondContact O-CB 3.49Å; Q105-Y108 PolarHBondContact O-N 2.99Å; Y108-G110 PolarHBondContact O-N 2.79Å; Y108-G110 VanDerWaalsContact O-N 3.14Å
109	C	95.9	Very high	97.9	Very high	54 Å²	54	64 Å²	64	37%	0.365	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-71.7	5.4	171.6	-62	0	0	0	0	114	Q105 W106 E107 P112	Q105-C109 PolarHBondContact O-N 2.77Å; Q105-C109 PolarHBondContact O-SG 3.4Å; W106-C109 PolarHBondContact O-N 2.71Å; E107-C109 VanDerWaalsContact C-N 3.27Å; E107-C109 PolarHBondContact O-N 2.82Å; C109-P112 WeakPolarHBondContact O-CD 3.24Å
110	G	97.1	Very high	97.9	Very high	57 Å²	57	64.9 Å²	64.9	59%	0.588	33%	0.331	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.3	21.9	-176.5	0	0	0	0	0	113.4	E107 Y108	E107-G110 WeakPolarHBondContact O-CA 3.49Å; E107-G110 PolarHBondContact O-N 3.33Å; Y108-G110 PolarHBondContact O-N 2.79Å; Y108-G110 VanDerWaalsContact O-N 3.14Å
111	Q	97.9	Very high	97.9	Very high	92 Å²	92	65.2 Å²	65.2	43%	0.43	33%	0.329	S	S	.	.			trans	48.4	50.4	175	56.5	174.5	26.2	0	0	114.3	W106 K113	W106-Q111 HydrophobicContact CD2-CB 3.94Å; W106-Q111 VanDerWaalsContact CE2-CA 3.46Å; W106-Q111 HydrophobicContact CE3-CB 3.94Å; W106-Q111 HydrophobicContact CH2-CB 3.84Å; W106-Q111 HydrophobicContact CZ2-CB 3.78Å; W106-Q111 WeakPolarHBondContact CZ2-O 3.39Å; W106-Q111 HydrophobicContact CZ3-CB 3.88Å; W106-Q111 VanDerWaalsContact O-CA 3.24Å; W106-Q111 WeakPolarHBondContact O-CA 3.39Å; W106-Q111 PolarHBondContact O-N 2.9Å; Q111-K113 PolarHBondContact O-NZ 2.82Å
112	P	98.4	Very high	97.9	Very high	40 Å²	40	65.6 Å²	65.6	26%	0.26	33%	0.334	S	S	.	.			trans	-66	140.2	-172.5	28.5	-36	0	0	0	111.5	F63 K64 M65 W106 C109	F63-P112 WeakPolarHBondContact O-CG 3.3Å; K64-P112 HydrophobicContact CB-CG 4.08Å; M65-P112 PolarHBondContact N-O 2.6Å; W106-P112 PolarHBondContact NE1-O 3.49Å; C109-P112 WeakPolarHBondContact O-CD 3.24Å
113	K	98.6	Very high	98	Very high	87 Å²	87	65.6 Å²	65.6	38%	0.378	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	124.7	-179	-61.3	168.6	-163.3	66.9	0	108.7	M65 A88 W106 Q111	M65-K113 HydrophobicContact CB-CG 4.37Å; M65-K113 CarbonylContact O-C 3.59Å; M65-K113 VanDerWaalsContact O-CA 3.3Å; M65-K113 WeakPolarHBondContact O-CA 3.39Å; M65-K113 HydrophobicContact SD-CG 4.36Å; A88-K113 HydrophobicContact CB-CD 4.4Å; W106-K113 HydrophobicContact CZ2-CG 3.94Å; Q111-K113 PolarHBondContact O-NZ 2.82Å
114	V	98.7	Very high	98	Very high	52 Å²	52	65.2 Å²	65.2	32%	0.315	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	133.1	177.5	-176.7	0	0	0	0	108.9	M65 V66 L67 V116 L176	M65-V114 PolarHBondContact O-N 3.49Å; V66-V114 CarbonylContact C-O 3.29Å; V66-V114 WeakPolarHBondContact CA-O 3.36Å; V66-V114 HydrophobicContact CG2-CB 4.37Å; L67-V114 PolarHBondContact N-O 3.22Å; V114-V116 HydrophobicContact CG1-CG1 4.17Å; V114-L176 HydrophobicContact CG1-CD2 3.66Å
115	V	98.8	Very high	98	Very high	49 Å²	49	60.5 Å²	60.5	30%	0.297	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	121.5	178.8	-166.2	0	0	0	0	109.3	L67 V69 Y177	L67-V115 HydrophobicContact CB-CG1 4.48Å; L67-V115 HydrophobicContact CB-CG2 4.4Å; L67-V115 HydrophobicContact CD1-CG2 4.41Å; L67-V115 WeakPolarHBondContact O-CA 3.25Å; V69-V115 HydrophobicContact CG2-CG1 3.55Å; V115-Y177 HydrophobicContact CG1-CG 4.16Å; V115-Y177 PolarHBondContact O-N 3.36Å; V115-Y177 VanDerWaalsContact O-N 3.08Å
116	V	98.9	Very high	98.1	Very high	7 Å²	7	61.7 Å²	61.7	4%	0.042	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.7	169	179.5	-60.6	0	0	0	0	110	V66 L67 V68 V69 V114 L174 K175 L176	V66-V116 HydrophobicContact CG1-CG1 4.26Å; V66-V116 HydrophobicContact CG1-CG2 3.49Å; V66-V116 VanDerWaalsContact CG1-CG2 3.49Å; L67-V116 PolarHBondContact O-N 2.88Å; V68-V116 HydrophobicContact CB-CG2 4.14Å; V68-V116 HydrophobicContact CG1-CG2 4.22Å; V68-V116 HydrophobicContact CG2-CG2 3.73Å; V69-V116 PolarHBondContact N-O 3.41Å; V114-V116 HydrophobicContact CG1-CG1 4.17Å; V116-L174 HydrophobicContact CB-CB 3.89Å; V116-L174 HydrophobicContact CG1-CB 4.38Å; V116-L174 HydrophobicContact CG2-CB 3.93Å; V116-L174 HydrophobicContact CG2-CD1 3.71Å; V116-L174 HydrophobicContact CG2-CG 4.5Å; V116-K175 CarbonylContact C-O 3.6Å; V116-K175 VanDerWaalsContact CA-O 3.24Å; V116-K175 WeakPolarHBondContact CA-O 3.26Å; V116-K175 VanDerWaalsContact CB-O 3.3Å; V116-K175 WeakPolarHBondContact CB-O 3.16Å; V116-L176 HydrophobicContact CG1-CD2 4.24Å
117	K	98.4	Very high	98.1	Very high	60 Å²	60	61.8 Å²	61.8	26%	0.261	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	137.5	-179.5	59.8	-172.4	160.3	-139.8	0	113.8	V69 N71 K175 L176 Y177	V69-K117 CarbonylContact O-C 3.51Å; V69-K117 VanDerWaalsContact O-CA 3.3Å; V69-K117 WeakPolarHBondContact O-CA 3.3Å; N71-K117 HydrophobicContact CB-CB 4.26Å; K117-K175 HydrophobicContact CG-CB 4.26Å; K117-K175 PolarHBondContact N-O 3.05Å; K117-L176 WeakPolarHBondContact CE-O 3.47Å; K117-L176 PolarHBondContact NZ-O 2.86Å; K117-Y177 HydrophobicContact CB-CD2 4.09Å; K117-Y177 PolarHBondContact NZ-OXT 3.11Å
118	A	98.5	Very high	98.1	Very high	0 Å²	0	58.7 Å²	58.7	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	143.9	164.3	0	0	0	0	0	109.5	V68 V69 N71 T123 L124	V68-A118 HydrophobicContact CG1-CB 3.63Å; V69-A118 PolarHBondContact O-N 2.83Å; N71-A118 WeakPolarHBondContact CB-O 3.43Å; N71-A118 PolarHBondContact N-O 2.77Å; A118-T123 HydrophobicContact CB-CG2 4.12Å; A118-L124 HydrophobicContact CB-CD1 4.4Å
119	P	98	Very high	98.2	Very high	73 Å²	73	50.2 Å²	50.2	47%	0.474	29%	0.292	S	S	.	.	S	Bend	trans	-67	-36.2	179.1	26.9	-32.9	0	0	0	112.5	D72 T123	D72-P119 WeakPolarHBondContact CB-O 3.42Å; D72-P119 PolarHBondContact N-O 2.73Å; P119-T123 HydrophobicContact CG-CG2 4.4Å; P119-T123 WeakPolarHBondContact CG-OG1 3.42Å
120	D	97.8	Very high	98.3	Very high	59 Å²	59	52.8 Å²	52.8	32%	0.316	29%	0.294	S	S	.	.	S	Bend	trans	-154	-179.9	-168.5	49.5	48.2	0	0	0	113.1	D122 T123 L124	D120-D122 PolarHBondContact OD1-N 2.96Å; D120-T123 VanDerWaalsContact OD1-CB 3.23Å; D120-T123 WeakPolarHBondContact OD1-CB 3.45Å; D120-T123 PolarHBondContact OD1-N 3.27Å; D120-T123 PolarHBondContact OD1-OG1 3.38Å; D120-L124 PolarHBondContact O-N 3.25Å
121	E	97.4	Very high	98.4	Very high	55 Å²	55	50 Å²	50	26%	0.257	27%	0.266	S	S	.	.	H	α-helix	trans	-67.5	-38.3	177.8	-165.4	164.1	156.4	0	0	113.5	R70 T123 L124 M125 R154	R70-E121 IonicContact CZ-OE2 3.67Å; R70-E121 IonicContact NH1-OE2 3.71Å; R70-E121 PolarHBondContact NH1-OE2 2.83Å; R70-E121 IonicContact NH2-OE2 2.73Å; E121-T123 PolarHBondContact O-N 3.4Å; E121-L124 WeakPolarHBondContact O-CA 3.47Å; E121-L124 VanDerWaalsContact O-CB 3.29Å; E121-L124 WeakPolarHBondContact O-CB 3.29Å; E121-L124 PolarHBondContact O-N 3.47Å; E121-L124 VanDerWaalsContact O-N 3.11Å; E121-M125 HydrophobicContact CG-CG 4.3Å; E121-M125 WeakPolarHBondContact O-CG 3.23Å; E121-M125 PolarHBondContact O-N 3.11Å; E121-R154 HydrophobicContact CG-CB 4.49Å; E121-R154 VanDerWaalsContact OE1-CD 3.26Å; E121-R154 WeakPolarHBondContact OE1-CD 3.33Å; E121-R154 IonicContact OE1-CZ 2.66Å; E121-R154 IonicContact OE1-NE 3.47Å; E121-R154 IonicContact OE1-NH1 2.6Å; E121-R154 PolarHBondContact OE1-NH1 3.21Å
122	D	98.1	Very high	98.4	Very high	118 Å²	118	53.1 Å²	53.1	63%	0.631	27%	0.274	S	S	*	.	H	α-helix	trans	-64.7	-43.9	-176.6	-67.2	-24.6	0	0	0	110.5	D120 L124 M125 N126	D120-D122 PolarHBondContact OD1-N 2.96Å; D122-L124 VanDerWaalsContact C-N 3.3Å; D122-L124 PolarHBondContact O-N 2.93Å; D122-M125 PolarHBondContact O-N 3.25Å; D122-N126 WeakPolarHBondContact O-CB 3.41Å; D122-N126 VanDerWaalsContact O-CG 3.22Å; D122-N126 PolarHBondContact O-N 2.96Å; D122-N126 PolarHBondContact O-ND2 3.34Å
123	T	98.3	Very high	98.4	Very high	38 Å²	38	59.1 Å²	59.1	23%	0.233	30%	0.298	C	S	.	.	H	α-helix	trans	-59.5	-42.8	172.5	-55.2	0	0	0	0	111.2	A118 P119 D120 E121 M125 N126 L127	A118-T123 HydrophobicContact CB-CG2 4.12Å; P119-T123 HydrophobicContact CG-CG2 4.4Å; P119-T123 WeakPolarHBondContact CG-OG1 3.42Å; D120-T123 VanDerWaalsContact OD1-CB 3.23Å; D120-T123 WeakPolarHBondContact OD1-CB 3.45Å; D120-T123 PolarHBondContact OD1-N 3.27Å; D120-T123 PolarHBondContact OD1-OG1 3.38Å; E121-T123 PolarHBondContact O-N 3.4Å; T123-M125 VanDerWaalsContact C-N 3.33Å; T123-M125 PolarHBondContact O-N 3.1Å; T123-N126 PolarHBondContact O-N 3.32Å; T123-L127 HydrophobicContact CG2-CD1 4.12Å; T123-L127 VanDerWaalsContact O-CG 3.27Å; T123-L127 WeakPolarHBondContact O-CG 3.33Å; T123-L127 PolarHBondContact O-N 3.37Å
124	L	98.4	Very high	98.4	Very high	0 Å²	0	57.7 Å²	57.7	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-60.5	-42.8	177.7	-162.9	75.6	0	0	0	111.6	V68 R70 A118 D120 E121 D122 L128 L140 R154 L157	V68-L124 HydrophobicContact CB-CD1 4.03Å; V68-L124 HydrophobicContact CG1-CD1 3.81Å; R70-L124 HydrophobicContact CG-CB 4.42Å; R70-L124 HydrophobicContact CG-CD2 4.13Å; A118-L124 HydrophobicContact CB-CD1 4.4Å; D120-L124 PolarHBondContact O-N 3.25Å; E121-L124 WeakPolarHBondContact O-CA 3.47Å; E121-L124 VanDerWaalsContact O-CB 3.29Å; E121-L124 WeakPolarHBondContact O-CB 3.29Å; E121-L124 PolarHBondContact O-N 3.47Å; E121-L124 VanDerWaalsContact O-N 3.11Å; D122-L124 VanDerWaalsContact C-N 3.3Å; D122-L124 PolarHBondContact O-N 2.93Å; L124-L128 PolarHBondContact O-N 2.98Å; L124-L140 HydrophobicContact CD2-CD1 3.82Å; L124-L140 HydrophobicContact CG-CD1 4.49Å; L124-R154 HydrophobicContact CD2-CB 4.07Å; L124-L157 HydrophobicContact CD1-CB 3.48Å; L124-L157 VanDerWaalsContact CD1-CB 3.48Å; L124-L157 HydrophobicContact CD1-CD2 4.4Å; L124-L157 HydrophobicContact CD2-CB 4.42Å; L124-L157 HydrophobicContact CG-CB 3.88Å; L124-L157 WeakPolarHBondContact O-CD2 3.49Å
125	M	98.5	Very high	98.4	Very high	54 Å²	54	58.4 Å²	58.4	27%	0.266	32%	0.315	S	S	.	.	H	α-helix	trans	-72.1	-36.2	180	-69.7	-55.5	-62.4	0	0	112.8	E121 D122 T123 L128 G129 L140 R154	E121-M125 HydrophobicContact CG-CG 4.3Å; E121-M125 WeakPolarHBondContact O-CG 3.23Å; E121-M125 PolarHBondContact O-N 3.11Å; D122-M125 PolarHBondContact O-N 3.25Å; T123-M125 VanDerWaalsContact C-N 3.33Å; T123-M125 PolarHBondContact O-N 3.1Å; M125-L128 HydrophobicContact CE-CD1 4.39Å; M125-L128 HydrophobicContact CE-CD2 4.48Å; M125-L128 WeakPolarHBondContact O-CB 3.4Å; M125-L128 PolarHBondContact O-N 3.04Å; M125-L128 HydrophobicContact SD-CD1 4.31Å; M125-G129 PolarHBondContact O-N 3.04Å; M125-L140 HydrophobicContact SD-CD2 4.1Å; M125-R154 VanDerWaalsContact SD-CD 3.55Å; M125-R154 PolarHBondContact SD-NH1 3.05Å; M125-R154 VanDerWaalsContact SD-NH1 3.38Å
126	N	98.6	Very high	98.4	Very high	109 Å²	109	56.8 Å²	56.8	58%	0.583	30%	0.304	S	S	*	.	H	α-helix	trans	-62.7	-44.1	173.2	-71.7	-24.4	0	0	0	111.6	D122 T123 L128 G129 R130	D122-N126 WeakPolarHBondContact O-CB 3.41Å; D122-N126 VanDerWaalsContact O-CG 3.22Å; D122-N126 PolarHBondContact O-N 2.96Å; D122-N126 PolarHBondContact O-ND2 3.34Å; T123-N126 PolarHBondContact O-N 3.32Å; N126-L128 VanDerWaalsContact C-N 3.33Å; N126-L128 PolarHBondContact O-N 3.44Å; N126-G129 PolarHBondContact O-N 3.24Å; N126-R130 WeakPolarHBondContact O-CG 3.42Å; N126-R130 PolarHBondContact O-N 3.37Å
127	L	98.8	Very high	98.3	Very high	6 Å²	6	57.4 Å²	57.4	3%	0.031	31%	0.308	C	S	.	.	H	α-helix	trans	-62	-40.5	174.7	-70	165.3	0	0	0	112	V68 T123 G129 R130 A131 L157 I159 V170 L174	V68-L127 HydrophobicContact CG1-CD1 3.9Å; V68-L127 HydrophobicContact CG2-CD1 4.4Å; T123-L127 HydrophobicContact CG2-CD1 4.12Å; T123-L127 VanDerWaalsContact O-CG 3.27Å; T123-L127 WeakPolarHBondContact O-CG 3.33Å; T123-L127 PolarHBondContact O-N 3.37Å; L127-G129 VanDerWaalsContact C-N 3.34Å; L127-G129 PolarHBondContact O-N 2.7Å; L127-R130 PolarHBondContact O-N 3.42Å; L127-A131 VanDerWaalsContact O-CB 3.25Å; L127-A131 WeakPolarHBondContact O-CB 3.28Å; L127-A131 PolarHBondContact O-N 2.93Å; L127-L157 HydrophobicContact CB-CD2 3.93Å; L127-I159 HydrophobicContact CB-CD1 4.41Å; L127-V170 HydrophobicContact CD2-CG1 3.91Å; L127-V170 WeakPolarHBondContact CD2-O 3.5Å; L127-L174 HydrophobicContact CD1-CD1 3.62Å; L127-L174 HydrophobicContact CD1-CD2 4.3Å; L127-L174 HydrophobicContact CD2-CD1 4.17Å
128	L	98.8	Very high	98.3	Very high	10 Å²	10	55.2 Å²	55.2	5%	0.052	30%	0.3	C	S	.	.	H	α-helix	trans	-60.3	-43.9	175.5	176.8	157.7	0	0	0	111.6	L124 M125 N126 R132 V138 L140 L157	L124-L128 PolarHBondContact O-N 2.98Å; M125-L128 HydrophobicContact CE-CD1 4.39Å; M125-L128 HydrophobicContact CE-CD2 4.48Å; M125-L128 WeakPolarHBondContact O-CB 3.4Å; M125-L128 PolarHBondContact O-N 3.04Å; M125-L128 HydrophobicContact SD-CD1 4.31Å; N126-L128 VanDerWaalsContact C-N 3.33Å; N126-L128 PolarHBondContact O-N 3.44Å; L128-R132 WeakPolarHBondContact O-CG 3.49Å; L128-R132 PolarHBondContact O-N 2.91Å; L128-R132 VanDerWaalsContact O-N 3.13Å; L128-V138 HydrophobicContact CG-CG2 4.45Å; L128-L140 HydrophobicContact CD1-CB 4Å; L128-L140 HydrophobicContact CD1-CD1 4.38Å; L128-L140 HydrophobicContact CD1-CD2 3.78Å; L128-L140 HydrophobicContact CD1-CG 4.28Å; L128-L157 HydrophobicContact CB-CD1 4.09Å; L128-L157 HydrophobicContact CB-CD2 3.88Å; L128-L157 HydrophobicContact CD1-CD1 4.05Å; L128-L157 HydrophobicContact CG-CD1 4.27Å
129	G	98.6	Very high	98.3	Very high	35 Å²	35	55.3 Å²	55.3	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-60.1	-54.6	176.2	0	0	0	0	0	111.9	M125 N126 L127 A131 R132 E133	M125-G129 PolarHBondContact O-N 3.04Å; N126-G129 PolarHBondContact O-N 3.24Å; L127-G129 VanDerWaalsContact C-N 3.34Å; L127-G129 PolarHBondContact O-N 2.7Å; G129-A131 VanDerWaalsContact C-N 3.34Å; G129-A131 PolarHBondContact O-N 3.41Å; G129-R132 PolarHBondContact O-N 2.98Å; G129-R132 VanDerWaalsContact O-N 3.16Å; G129-E133 PolarHBondContact O-N 3.33Å
130	R	98.6	Very high	98.4	Very high	107 Å²	107	54.4 Å²	54.4	40%	0.404	29%	0.292	S	S	.	.	H	α-helix	trans	-56.8	-44.5	178.3	-71.9	172.6	61	-160.6	0.6	112.6	N126 L127 R132 E133 V134 S169 V170	N126-R130 WeakPolarHBondContact O-CG 3.42Å; N126-R130 PolarHBondContact O-N 3.37Å; L127-R130 PolarHBondContact O-N 3.42Å; R130-R132 VanDerWaalsContact C-N 3.35Å; R130-R132 PolarHBondContact O-N 2.98Å; R130-E133 WeakPolarHBondContact O-CB 3.29Å; R130-E133 PolarHBondContact O-N 3.39Å; R130-V134 WeakPolarHBondContact O-CG2 3.46Å; R130-V134 PolarHBondContact O-N 3.47Å; R130-S169 PolarHBondContact NH2-O 3.11Å; R130-V170 HydrophobicContact CB-CG1 4.1Å; R130-V170 PolarHBondContact NH1-O 2.86Å
131	A	98.7	Very high	98.4	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	28%	0.282	C	S	.	.	H	α-helix	trans	-61.8	-41.3	178.3	0	0	0	0	0	112.3	L127 G129 V134 G135 L136 V138 I159 V170	L127-A131 VanDerWaalsContact O-CB 3.25Å; L127-A131 WeakPolarHBondContact O-CB 3.28Å; L127-A131 PolarHBondContact O-N 2.93Å; G129-A131 VanDerWaalsContact C-N 3.34Å; G129-A131 PolarHBondContact O-N 3.41Å; A131-V134 WeakPolarHBondContact O-CG2 3.4Å; A131-G135 PolarHBondContact O-N 2.85Å; A131-L136 HydrophobicContact CB-CB 4.36Å; A131-L136 WeakPolarHBondContact O-CB 3.48Å; A131-L136 PolarHBondContact O-N 3.46Å; A131-V138 HydrophobicContact CB-CG1 3.49Å; A131-V138 VanDerWaalsContact CB-CG1 3.49Å; A131-I159 HydrophobicContact CB-CD1 4.19Å; A131-I159 HydrophobicContact CB-CG1 4.18Å; A131-I159 HydrophobicContact CB-CG2 4.03Å; A131-V170 HydrophobicContact CB-CG1 4.24Å
132	R	98.4	Very high	98.2	Very high	157 Å²	157	55.3 Å²	55.3	59%	0.592	29%	0.294	S	S	*	.	H	α-helix	trans	-66.6	-40.1	176.1	-75.3	179.1	176.7	174.6	0.5	112.4	L128 G129 R130 V134 G135 V138	L128-R132 WeakPolarHBondContact O-CG 3.49Å; L128-R132 PolarHBondContact O-N 2.91Å; L128-R132 VanDerWaalsContact O-N 3.13Å; G129-R132 PolarHBondContact O-N 2.98Å; G129-R132 VanDerWaalsContact O-N 3.16Å; R130-R132 VanDerWaalsContact C-N 3.35Å; R130-R132 PolarHBondContact O-N 2.98Å; R132-V134 VanDerWaalsContact C-N 3.3Å; R132-V134 PolarHBondContact O-N 2.75Å; R132-G135 PolarHBondContact O-N 2.87Å; R132-V138 HydrophobicContact CG-CG1 4.27Å; R132-V138 HydrophobicContact CG-CG2 3.76Å
133	E	98.5	Very high	97.7	Very high	165 Å²	165	50.1 Å²	50.1	77%	0.771	27%	0.266	S	S	*	.	H	α-helix	trans	-59.9	-41	179.5	-174.5	175.9	-170.3	0	0	111.8	G129 R130 G135	G129-E133 PolarHBondContact O-N 3.33Å; R130-E133 WeakPolarHBondContact O-CB 3.29Å; R130-E133 PolarHBondContact O-N 3.39Å; E133-G135 PolarHBondContact O-N 2.79Å
134	V	98	Very high	96.6	Very high	58 Å²	58	52.2 Å²	52.2	35%	0.352	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84	8.5	176	-54.8	0	0	0	0	113.8	R130 A131 R132 L136 L166 V170	R130-V134 WeakPolarHBondContact O-CG2 3.46Å; R130-V134 PolarHBondContact O-N 3.47Å; A131-V134 WeakPolarHBondContact O-CG2 3.4Å; R132-V134 VanDerWaalsContact C-N 3.3Å; R132-V134 PolarHBondContact O-N 2.75Å; V134-L136 HydrophobicContact CG2-CB 4.49Å; V134-L136 HydrophobicContact CG2-CD1 3.76Å; V134-L136 HydrophobicContact CG2-CG 3.91Å; V134-L136 PolarHBondContact O-N 2.88Å; V134-L166 HydrophobicContact CB-CD1 3.96Å; V134-L166 HydrophobicContact CG2-CD1 4.15Å; V134-L166 HydrophobicContact CG2-CG 4.26Å; V134-V170 HydrophobicContact CG2-CG2 3.92Å
135	G	97.8	Very high	95.2	Very high	67 Å²	67	53.6 Å²	53.6	69%	0.691	30%	0.302	S	S	*	.	T	Hydrogen-bonded Turn	trans	78.5	14	174.7	0	0	0	0	0	115.7	A131 R132 E133	A131-G135 PolarHBondContact O-N 2.85Å; R132-G135 PolarHBondContact O-N 2.87Å; E133-G135 PolarHBondContact O-N 2.79Å
136	L	98.5	Very high	93.5	Very high	14 Å²	14	62.1 Å²	62.1	7%	0.073	33%	0.331	C	S	.	.			trans	-76.3	145.4	176.1	-69.6	167.8	0	0	0	111.5	A131 V134 I159 L166 V167 V170	A131-L136 HydrophobicContact CB-CB 4.36Å; A131-L136 WeakPolarHBondContact O-CB 3.48Å; A131-L136 PolarHBondContact O-N 3.46Å; V134-L136 HydrophobicContact CG2-CB 4.49Å; V134-L136 HydrophobicContact CG2-CD1 3.76Å; V134-L136 HydrophobicContact CG2-CG 3.91Å; V134-L136 PolarHBondContact O-N 2.88Å; L136-I159 HydrophobicContact CB-CG2 4.26Å; L136-I159 HydrophobicContact CD1-CG2 3.73Å; L136-L166 HydrophobicContact CD1-CG 4.2Å; L136-L166 HydrophobicContact CD2-CD2 3.83Å; L136-L166 HydrophobicContact CD2-CG 4.12Å; L136-L166 HydrophobicContact CG-CD2 4.05Å; L136-L166 HydrophobicContact CG-CG 4.13Å; L136-V167 HydrophobicContact CD1-CG2 4.19Å; L136-V167 HydrophobicContact CD2-CG2 3.98Å; L136-V170 HydrophobicContact CD1-CG2 4.17Å
137	T	98.5	Very high	92	Very high	21 Å²	21	59.9 Å²	59.9	13%	0.129	32%	0.322	C	S	.	.			trans	-67.3	135.6	169.2	-68.7	0	0	0	0	109.7	Q94 V95 G160	Q94-T137 HydrophobicContact CB-CG2 3.77Å; V95-T137 HydrophobicContact CG2-CG2 3.79Å; V95-T137 WeakPolarHBondContact CG2-OG1 3.45Å; T137-G160 PolarHBondContact O-N 3.3Å
138	V	98.6	Very high	90.4	Very high	14 Å²	14	69.5 Å²	69.5	9%	0.085	37%	0.367	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	144.5	176.7	-62.8	0	0	0	0	111.5	Q94 L128 A131 R132 L157 G158	Q94-V138 PolarHBondContact NE2-O 3.11Å; Q94-V138 PolarHBondContact OE1-O 3.44Å; L128-V138 HydrophobicContact CG-CG2 4.45Å; A131-V138 HydrophobicContact CB-CG1 3.49Å; A131-V138 VanDerWaalsContact CB-CG1 3.49Å; R132-V138 HydrophobicContact CG-CG1 4.27Å; R132-V138 HydrophobicContact CG-CG2 3.76Å; V138-L157 HydrophobicContact CB-CD1 4.15Å; V138-G158 CarbonylContact C-O 3.59Å; V138-G158 VanDerWaalsContact CA-O 3.28Å; V138-G158 WeakPolarHBondContact CA-O 3.37Å
139	S	98.5	Very high	89.3	Confident	2 Å²	2	70 Å²	70	1%	0.014	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133	107.9	173.6	-175.6	0	0	0	0	110.2	A87 S90 L157 G158	A87-S139 PolarHBondContact O-OG 3.38Å; S90-S139 WeakPolarHBondContact CB-OG 3.46Å; S90-S139 PolarHBondContact OG-OG 2.98Å; S139-L157 CarbonylContact O-C 3.57Å; S139-L157 WeakPolarHBondContact O-CA 3.14Å; S139-G158 PolarHBondContact N-O 3.24Å; S139-G158 PolarHBondContact O-N 3.47Å
140	L	98.4	Very high	88.1	Confident	54 Å²	54	71.5 Å²	71.5	28%	0.283	38%	0.378	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98	121.3	179.1	-178.2	65.8	0	0	0	109.7	L124 M125 L128 R154 L157	L124-L140 HydrophobicContact CD2-CD1 3.82Å; L124-L140 HydrophobicContact CG-CD1 4.49Å; M125-L140 HydrophobicContact SD-CD2 4.1Å; L128-L140 HydrophobicContact CD1-CB 4Å; L128-L140 HydrophobicContact CD1-CD1 4.38Å; L128-L140 HydrophobicContact CD1-CD2 3.78Å; L128-L140 HydrophobicContact CD1-CG 4.28Å; L140-R154 HydrophobicContact CD1-CB 4.07Å; L140-R154 HydrophobicContact CD1-CG 4.2Å; L140-R154 HydrophobicContact CD2-CG 4Å; L140-R154 HydrophobicContact CG-CG 4.24Å; L140-L157 HydrophobicContact CB-CD1 4.41Å; L140-L157 HydrophobicContact CD1-CB 4.46Å; L140-L157 HydrophobicContact CD1-CD1 4.42Å
141	I	97.5	Very high	87.1	Confident	21 Å²	21	71.3 Å²	71.3	11%	0.108	39%	0.391	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140	179.6	-53.5	-56	0	0	0	110.2	H86 A87 R154 T155 V156	H86-I141 HydrophobicContact CB-CD1 4.03Å; H86-I141 HydrophobicContact CB-CG1 4.19Å; H86-I141 HydrophobicContact CB-CG2 4.2Å; A87-I141 HydrophobicContact CB-CD1 4.37Å; A87-I141 HydrophobicContact CB-CG1 3.66Å; I141-R154 CarbonylContact O-C 3.58Å; I141-R154 WeakPolarHBondContact O-CA 3.29Å; I141-T155 PolarHBondContact O-N 3.45Å; I141-T155 PolarHBondContact O-OG1 3.37Å; I141-V156 PolarHBondContact N-O 2.7Å
142	Q	94.6	Very high	86.5	Confident	111 Å²	111	73.2 Å²	73.2	52%	0.519	41%	0.41	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	143.4	174.3	-66.1	180	-60.1	0	0	109.9	G152 S153 R154	Q142-G152 PolarHBondContact NE2-O 3.48Å; Q142-G152 VanDerWaalsContact NE2-O 3.16Å; Q142-S153 CarbonylContact C-O 3.6Å; Q142-S153 VanDerWaalsContact CA-O 3.31Å; Q142-S153 WeakPolarHBondContact CA-O 3.22Å; Q142-R154 HydrophobicContact CG-CG 4.03Å
143	D	86.6	Confident	86.1	Confident	9 Å²	9	66.6 Å²	66.6	5%	0.048	39%	0.388	C	S	.	.			trans	-74.6	128.1	173.2	-165.3	29.3	0	0	0	110.5	K79 G145 T147 G152 S153 T155	K79-D143 VanDerWaalsContact NZ-CG 3.31Å; K79-D143 IonicContact NZ-OD1 3.42Å; K79-D143 IonicContact NZ-OD2 2.7Å; K79-D143 PolarHBondContact NZ-OD2 2.89Å; D143-G145 PolarHBondContact O-N 3.03Å; D143-T147 PolarHBondContact OD2-OG1 3.17Å; D143-G152 PolarHBondContact O-N 2.74Å; D143-S153 PolarHBondContact N-O 3.41Å; D143-T155 HydrophobicContact CB-CG2 3.93Å
144	A	75.4	Confident	86	Confident	83 Å²	83	62.1 Å²	62.1	69%	0.686	36%	0.364	S	S	*	.			trans	-75.6	10.6	-178.8	0	0	0	0	0	113.5
145	G	68.3	Low	86	Confident	29 Å²	29	59.3 Å²	59.3	30%	0.299	35%	0.347	S	S	.	.	S	Bend	trans	76.1	19.4	177.8	0	0	0	0	0	115	D143 T147	D143-G145 PolarHBondContact O-N 3.03Å; G145-T147 PolarHBondContact O-N 2.78Å
146	R	64.5	Low	86	Confident	232 Å²	232	56.1 Å²	56.1	88%	0.875	31%	0.314	S	S	*	.	S	Bend	trans	-87.9	11.7	176.1	-63.5	-173.9	-179.5	177.4	-0.3	113.4
147	T	67.4	Low	86	Confident	63 Å²	63	55.5 Å²	55.5	39%	0.387	31%	0.311	S	S	.	.	S	Bend	trans	-143	-178.8	-173.8	78.3	0	0	0	0	111	K79 D143 G145 I149	K79-T147 HydrophobicContact CD-CG2 4.14Å; K79-T147 PolarHBondContact NZ-OG1 3.16Å; D143-T147 PolarHBondContact OD2-OG1 3.17Å; G145-T147 PolarHBondContact O-N 2.78Å; T147-I149 PolarHBondContact O-N 3.16Å; T147-I149 VanDerWaalsContact O-N 3.11Å; T147-I149 PolarHBondContact OG1-N 3.05Å
148	Q	63.8	Low	86	Confident	208 Å²	208	54.5 Å²	54.5	97%	0.972	31%	0.305	S	S	*	.	S	Bend	trans	-66.9	-2.5	179.5	-61.5	172	-0.6	0	0	115
149	I	75.1	Confident	86	Confident	21 Å²	21	53.8 Å²	53.8	11%	0.108	30%	0.301	C	S	.	.	S	Bend	trans	-92	142.7	176.8	-60.1	-164	0	0	0	109.3	L73 M75 K79 T147 S153	L73-I149 HydrophobicContact CB-CD1 3.75Å; L73-I149 HydrophobicContact CD1-CD1 4.04Å; L73-I149 HydrophobicContact CD1-CG2 4.47Å; L73-I149 HydrophobicContact CD2-CD1 4.25Å; L73-I149 HydrophobicContact CD2-CG2 4.01Å; L73-I149 HydrophobicContact CG-CD1 4.22Å; M75-I149 HydrophobicContact CG-CD1 3.46Å; M75-I149 VanDerWaalsContact CG-CD1 3.46Å; M75-I149 HydrophobicContact SD-CD1 4.08Å; K79-I149 VanDerWaalsContact NZ-CD1 3.25Å; K79-I149 VanDerWaalsContact NZ-CG1 3.3Å; T147-I149 PolarHBondContact O-N 3.16Å; T147-I149 VanDerWaalsContact O-N 3.11Å; T147-I149 PolarHBondContact OG1-N 3.05Å; I149-S153 VanDerWaalsContact CG2-CB 3.46Å; I149-S153 WeakPolarHBondContact CG2-OG 3.38Å
150	A	73.8	Confident	86	Confident	66 Å²	66	53.7 Å²	53.7	55%	0.545	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-51.1	127.6	177.2	0	0	0	0	0	110.9	G152 S153	A150-G152 PolarHBondContact O-N 3.04Å; A150-S153 VanDerWaalsContact O-CB 3.26Å; A150-S153 WeakPolarHBondContact O-CB 3.29Å; A150-S153 PolarHBondContact O-N 2.94Å; A150-S153 VanDerWaalsContact O-N 3.12Å; A150-S153 PolarHBondContact O-OG 2.86Å
151	P	78.9	Confident	86	Confident	103 Å²	103	51.2 Å²	51.2	67%	0.669	29%	0.287	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.6	138.6	177.8	-25.9	32.8	0	0	0	111.9	S153	P151-S153 VanDerWaalsContact C-N 3.26Å; P151-S153 PolarHBondContact O-N 3.45Å
152	G	85.8	Confident	86.1	Confident	39 Å²	39	50.2 Å²	50.2	40%	0.402	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.6	-4.7	-179.7	0	0	0	0	0	115.1	Q142 D143 A150 R154	Q142-G152 PolarHBondContact NE2-O 3.48Å; Q142-G152 VanDerWaalsContact NE2-O 3.16Å; D143-G152 PolarHBondContact O-N 2.74Å; A150-G152 PolarHBondContact O-N 3.04Å; G152-R154 PolarHBondContact O-N 3.29Å
153	S	89.8	Confident	86.2	Confident	19 Å²	19	47 Å²	47	13%	0.133	27%	0.271	C	S	.	.			trans	-56.8	128.3	174	-63.6	0	0	0	0	110.6	Q142 D143 I149 A150 P151	Q142-S153 CarbonylContact C-O 3.6Å; Q142-S153 VanDerWaalsContact CA-O 3.31Å; Q142-S153 WeakPolarHBondContact CA-O 3.22Å; D143-S153 PolarHBondContact N-O 3.41Å; I149-S153 VanDerWaalsContact CG2-CB 3.46Å; I149-S153 WeakPolarHBondContact CG2-OG 3.38Å; A150-S153 VanDerWaalsContact O-CB 3.26Å; A150-S153 WeakPolarHBondContact O-CB 3.29Å; A150-S153 PolarHBondContact O-N 2.94Å; A150-S153 VanDerWaalsContact O-N 3.12Å; A150-S153 PolarHBondContact O-OG 2.86Å; P151-S153 VanDerWaalsContact C-N 3.26Å; P151-S153 PolarHBondContact O-N 3.45Å
154	R	96.7	Very high	86.7	Confident	70 Å²	70	46.9 Å²	46.9	26%	0.264	27%	0.27	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	128.3	171.2	-64.6	172.5	-177.5	144.7	-10.7	108.4	R70 E121 L124 M125 L140 I141 Q142 G152	R70-R154 WeakPolarHBondContact CD-O 3.01Å; R70-R154 PolarHBondContact NH1-O 3.4Å; E121-R154 HydrophobicContact CG-CB 4.49Å; E121-R154 VanDerWaalsContact OE1-CD 3.26Å; E121-R154 WeakPolarHBondContact OE1-CD 3.33Å; E121-R154 IonicContact OE1-CZ 2.66Å; E121-R154 IonicContact OE1-NE 3.47Å; E121-R154 IonicContact OE1-NH1 2.6Å; E121-R154 PolarHBondContact OE1-NH1 3.21Å; L124-R154 HydrophobicContact CD2-CB 4.07Å; M125-R154 VanDerWaalsContact SD-CD 3.55Å; M125-R154 PolarHBondContact SD-NH1 3.05Å; M125-R154 VanDerWaalsContact SD-NH1 3.38Å; L140-R154 HydrophobicContact CD1-CB 4.07Å; L140-R154 HydrophobicContact CD1-CG 4.2Å; L140-R154 HydrophobicContact CD2-CG 4Å; L140-R154 HydrophobicContact CG-CG 4.24Å; I141-R154 CarbonylContact O-C 3.58Å; I141-R154 WeakPolarHBondContact O-CA 3.29Å; Q142-R154 HydrophobicContact CG-CG 4.03Å; G152-R154 PolarHBondContact O-N 3.29Å
155	T	96.9	Very high	87.8	Confident	0 Å²	0	48.5 Å²	48.5	0%	0	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.7	-51.3	-169.6	48.4	0	0	0	0	112.6	R70 L73 M75 Q83 I141 D143	R70-T155 PolarHBondContact N-O 3.24Å; L73-T155 HydrophobicContact CD1-CG2 3.99Å; M75-T155 HydrophobicContact SD-CG2 3.94Å; Q83-T155 PolarHBondContact OE1-OG1 3.26Å; I141-T155 PolarHBondContact O-N 3.45Å; I141-T155 PolarHBondContact O-OG1 3.37Å; D143-T155 HydrophobicContact CB-CG2 3.93Å
156	V	98.4	Very high	89.2	Confident	0 Å²	0	50 Å²	50	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.1	137.6	-174.2	179	0	0	0	0	109.7	L67 V68 V69 Q83 A87 I141	L67-V156 HydrophobicContact CB-CG1 4.41Å; V68-V156 CarbonylContact O-C 3.56Å; V68-V156 VanDerWaalsContact O-CA 3.29Å; V68-V156 WeakPolarHBondContact O-CA 3.42Å; V69-V156 HydrophobicContact CB-CG2 4.47Å; V69-V156 HydrophobicContact CG1-CG2 4.31Å; V69-V156 HydrophobicContact CG2-CG2 4.11Å; Q83-V156 HydrophobicContact CB-CB 4.4Å; Q83-V156 HydrophobicContact CB-CG2 3.59Å; A87-V156 HydrophobicContact CB-CB 4.46Å; A87-V156 HydrophobicContact CB-CG1 3.78Å; I141-V156 PolarHBondContact N-O 2.7Å
157	L	98.8	Very high	90.8	Very high	0 Å²	0	38.9 Å²	38.9	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	117.7	169.9	174.3	67.4	0	0	0	109.2	V68 L124 L127 L128 V138 S139 L140 I159	V68-L157 HydrophobicContact CB-CB 4.3Å; V68-L157 PolarHBondContact N-O 2.8Å; V68-L157 PolarHBondContact O-N 3.29Å; L124-L157 HydrophobicContact CD1-CB 3.48Å; L124-L157 VanDerWaalsContact CD1-CB 3.48Å; L124-L157 HydrophobicContact CD1-CD2 4.4Å; L124-L157 HydrophobicContact CD2-CB 4.42Å; L124-L157 HydrophobicContact CG-CB 3.88Å; L124-L157 WeakPolarHBondContact O-CD2 3.49Å; L127-L157 HydrophobicContact CB-CD2 3.93Å; L128-L157 HydrophobicContact CB-CD1 4.09Å; L128-L157 HydrophobicContact CB-CD2 3.88Å; L128-L157 HydrophobicContact CD1-CD1 4.05Å; L128-L157 HydrophobicContact CG-CD1 4.27Å; V138-L157 HydrophobicContact CB-CD1 4.15Å; S139-L157 CarbonylContact O-C 3.57Å; S139-L157 WeakPolarHBondContact O-CA 3.14Å; L140-L157 HydrophobicContact CB-CD1 4.41Å; L140-L157 HydrophobicContact CD1-CB 4.46Å; L140-L157 HydrophobicContact CD1-CD1 4.42Å; L157-I159 HydrophobicContact CD2-CD1 3.84Å; L157-I159 HydrophobicContact CD2-CG1 3.96Å; L157-I159 HydrophobicContact CG-CD1 4.32Å; L157-I159 HydrophobicContact CG-CG1 3.93Å
158	G	98.8	Very high	92.3	Very high	0 Å²	0	39 Å²	39	0%	0	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.9	130.2	164.8	0	0	0	0	0	110.6	V66 V138 S139	V66-G158 CarbonylContact O-C 3.51Å; V66-G158 WeakPolarHBondContact O-CA 3.06Å; V138-G158 CarbonylContact C-O 3.59Å; V138-G158 VanDerWaalsContact CA-O 3.28Å; V138-G158 WeakPolarHBondContact CA-O 3.37Å; S139-G158 PolarHBondContact N-O 3.24Å; S139-G158 PolarHBondContact O-N 3.47Å
159	I	98.9	Very high	93.9	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	127.5	173.9	-61.8	172.5	0	0	0	108	M65 V66 V68 L127 A131 L136 L157 V167 V170 T171	M65-I159 WeakPolarHBondContact CA-O 3.18Å; V66-I159 PolarHBondContact N-O 3.2Å; V66-I159 PolarHBondContact O-N 2.93Å; V68-I159 HydrophobicContact CG2-CD1 4.16Å; L127-I159 HydrophobicContact CB-CD1 4.41Å; A131-I159 HydrophobicContact CB-CD1 4.19Å; A131-I159 HydrophobicContact CB-CG1 4.18Å; A131-I159 HydrophobicContact CB-CG2 4.03Å; L136-I159 HydrophobicContact CB-CG2 4.26Å; L136-I159 HydrophobicContact CD1-CG2 3.73Å; L157-I159 HydrophobicContact CD2-CD1 3.84Å; L157-I159 HydrophobicContact CD2-CG1 3.96Å; L157-I159 HydrophobicContact CG-CD1 4.32Å; L157-I159 HydrophobicContact CG-CG1 3.93Å; I159-V167 HydrophobicContact CG2-CG1 4.49Å; I159-V170 HydrophobicContact CD1-CG1 4.07Å; I159-T171 HydrophobicContact CD1-CG2 3.52Å
160	G	98.3	Very high	95	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	91.9	-160.2	-174.4	0	0	0	0	0	113.6	T137	T137-G160 PolarHBondContact O-N 3.3Å
161	P	98.3	Very high	96.2	Very high	2 Å²	2	28.5 Å²	28.5	1%	0.013	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	cis	-60.4	154.6	1.8	28.5	-37.2	0	0	0	112.9	K64 V95 L102 W106	K64-P161 VanDerWaalsContact O-CA 3.31Å; K64-P161 WeakPolarHBondContact O-CA 3.39Å; V95-P161 HydrophobicContact CB-CG 4.28Å; V95-P161 HydrophobicContact CG1-CG 4.22Å; V95-P161 HydrophobicContact CG2-CG 3.92Å; L102-P161 HydrophobicContact CD2-CB 4.19Å; L102-P161 HydrophobicContact CD2-CG 3.95Å; L102-P161 VanDerWaalsContact CD2-O 3.24Å; L102-P161 WeakPolarHBondContact CD2-O 3.26Å; W106-P161 HydrophobicContact CB-CB 3.78Å; W106-P161 HydrophobicContact CB-CG 4.4Å; W106-P161 HydrophobicContact CD2-CB 3.47Å; W106-P161 VanDerWaalsContact CD2-CB 3.47Å; W106-P161 HydrophobicContact CD2-CG 3.95Å; W106-P161 HydrophobicContact CE3-CB 4.01Å; W106-P161 HydrophobicContact CE3-CG 3.95Å; W106-P161 HydrophobicContact CG-CB 3.37Å; W106-P161 HydrophobicContact CG-CG 4.19Å; W106-P161 HydrophobicContact CZ3-CG 4.49Å
162	G	97.9	Very high	97.1	Very high	0 Å²	0	25.8 Å²	25.8	0%	0	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-173.9	177.6	177.4	0	0	0	0	0	111.8	F63 K64 A164	F63-G162 CarbonylContact C-O 3.54Å; F63-G162 VanDerWaalsContact CA-O 3.3Å; F63-G162 WeakPolarHBondContact CA-O 3.2Å; K64-G162 PolarHBondContact N-O 2.66Å; K64-G162 PolarHBondContact O-N 2.65Å; G162-A164 PolarHBondContact O-N 3.2Å
163	P	97.8	Very high	97.6	Very high	44 Å²	44	31 Å²	31	29%	0.286	19%	0.186	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-54.8	132.7	176.4	-23.9	33.9	0	0	0	110.8	E62 F63 T165 L166 V167	E62-P163 CarbonylContact O-C 3.6Å; F63-P163 HydrophobicContact CE1-CG 3.92Å; F63-P163 HydrophobicContact CZ-CG 4.22Å; P163-T165 VanDerWaalsContact C-N 3.3Å; P163-T165 PolarHBondContact O-N 3.15Å; P163-L166 HydrophobicContact CB-CB 4.25Å; P163-L166 PolarHBondContact O-N 3.01Å; P163-V167 WeakPolarHBondContact O-CG2 3.31Å; P163-V167 PolarHBondContact O-N 3.46Å
164	A	97.8	Very high	98	Very high	5 Å²	5	31.9 Å²	31.9	4%	0.041	19%	0.189	C	C	.	.	H	α-helix	trans	-58.8	-41.9	-172.7	0	0	0	0	0	111.8	E62 K64 G162 L166 V167 D168	E62-A164 HydrophobicContact CB-CB 3.83Å; E62-A164 HydrophobicContact CG-CB 3.92Å; E62-A164 VanDerWaalsContact O-CB 3.25Å; E62-A164 WeakPolarHBondContact O-CB 3.4Å; E62-A164 PolarHBondContact O-N 2.89Å; K64-A164 HydrophobicContact CD-CB 3.94Å; K64-A164 HydrophobicContact CG-CB 4.23Å; G162-A164 PolarHBondContact O-N 3.2Å; A164-L166 VanDerWaalsContact C-N 3.33Å; A164-L166 PolarHBondContact O-N 2.88Å; A164-V167 PolarHBondContact O-N 3.4Å; A164-D168 WeakPolarHBondContact O-CB 3.4Å; A164-D168 VanDerWaalsContact O-CG 3.29Å; A164-D168 PolarHBondContact O-N 3.16Å
165	T	97.1	Very high	98.1	Very high	118 Å²	118	36.2 Å²	36.2	72%	0.724	21%	0.209	S	C	*	.	H	α-helix	trans	-58.6	-42.3	175.9	53.9	0	0	0	0	112.5	P163 D168 S169	P163-T165 VanDerWaalsContact C-N 3.3Å; P163-T165 PolarHBondContact O-N 3.15Å; T165-D168 PolarHBondContact O-N 3.49Å; T165-S169 PolarHBondContact O-N 3.34Å
166	L	97.8	Very high	98.2	Very high	59 Å²	59	42 Å²	42	31%	0.309	24%	0.24	S	C	.	.	H	α-helix	trans	-70.3	-40.8	178	-168.3	62.6	0	0	0	111.3	V134 L136 P163 A164 D168 S169	V134-L166 HydrophobicContact CB-CD1 3.96Å; V134-L166 HydrophobicContact CG2-CD1 4.15Å; V134-L166 HydrophobicContact CG2-CG 4.26Å; L136-L166 HydrophobicContact CD1-CG 4.2Å; L136-L166 HydrophobicContact CD2-CD2 3.83Å; L136-L166 HydrophobicContact CD2-CG 4.12Å; L136-L166 HydrophobicContact CG-CD2 4.05Å; L136-L166 HydrophobicContact CG-CG 4.13Å; P163-L166 HydrophobicContact CB-CB 4.25Å; P163-L166 PolarHBondContact O-N 3.01Å; A164-L166 VanDerWaalsContact C-N 3.33Å; A164-L166 PolarHBondContact O-N 2.88Å; L166-D168 VanDerWaalsContact C-N 3.34Å; L166-S169 WeakPolarHBondContact O-CB 3.34Å; L166-S169 PolarHBondContact O-N 3.38Å; L166-S169 PolarHBondContact O-OG 2.62Å
167	V	98.4	Very high	98	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65	-39	176	175.6	0	0	0	0	111.2	K64 V66 L136 I159 P163 A164 V170 T171	K64-V167 HydrophobicContact CG-CB 4.25Å; K64-V167 HydrophobicContact CG-CG1 4.1Å; V66-V167 HydrophobicContact CB-CG1 4.06Å; V66-V167 HydrophobicContact CG2-CG1 3.45Å; V66-V167 VanDerWaalsContact CG2-CG1 3.45Å; L136-V167 HydrophobicContact CD1-CG2 4.19Å; L136-V167 HydrophobicContact CD2-CG2 3.98Å; I159-V167 HydrophobicContact CG2-CG1 4.49Å; P163-V167 WeakPolarHBondContact O-CG2 3.31Å; P163-V167 PolarHBondContact O-N 3.46Å; A164-V167 PolarHBondContact O-N 3.4Å; V167-V170 PolarHBondContact O-N 2.73Å; V167-T171 PolarHBondContact O-N 3.44Å; V167-T171 PolarHBondContact O-OG1 3.12Å
168	D	98.4	Very high	98	Very high	66 Å²	66	49.7 Å²	49.7	35%	0.353	27%	0.273	S	S	.	.	H	α-helix	trans	-69.9	-31.8	177	-75.2	-31.5	0	0	0	112.9	K64 A164 T165 L166 V170 T171 G172	K64-D168 WeakPolarHBondContact CE-OD1 3.42Å; K64-D168 IonicContact NZ-OD1 3.74Å; K64-D168 PolarHBondContact NZ-OD1 2.95Å; K64-D168 IonicContact NZ-OD2 3.78Å; K64-D168 PolarHBondContact NZ-OD2 3.08Å; A164-D168 WeakPolarHBondContact O-CB 3.4Å; A164-D168 VanDerWaalsContact O-CG 3.29Å; A164-D168 PolarHBondContact O-N 3.16Å; T165-D168 PolarHBondContact O-N 3.49Å; L166-D168 VanDerWaalsContact C-N 3.34Å; D168-V170 PolarHBondContact O-N 2.93Å; D168-T171 PolarHBondContact O-N 3.26Å; D168-G172 WeakPolarHBondContact O-CA 3.38Å; D168-G172 PolarHBondContact O-N 2.94Å
169	S	98.2	Very high	98	Very high	63 Å²	63	52.3 Å²	52.3	44%	0.441	29%	0.288	S	S	.	.	H	α-helix	trans	-57.7	-20.8	172.8	81.4	0	0	0	0	113.2	R130 T165 L166	R130-S169 PolarHBondContact NH2-O 3.11Å; T165-S169 PolarHBondContact O-N 3.34Å; L166-S169 WeakPolarHBondContact O-CB 3.34Å; L166-S169 PolarHBondContact O-N 3.38Å; L166-S169 PolarHBondContact O-OG 2.62Å
170	V	98.6	Very high	97.9	Very high	5 Å²	5	55.2 Å²	55.2	3%	0.03	30%	0.304	C	S	.	.	H	α-helix	trans	-101.6	-38.6	176.7	-175	0	0	0	0	112.3	L127 R130 A131 V134 L136 I159 V167 D168	L127-V170 HydrophobicContact CD2-CG1 3.91Å; L127-V170 WeakPolarHBondContact CD2-O 3.5Å; R130-V170 HydrophobicContact CB-CG1 4.1Å; R130-V170 PolarHBondContact NH1-O 2.86Å; A131-V170 HydrophobicContact CB-CG1 4.24Å; V134-V170 HydrophobicContact CG2-CG2 3.92Å; L136-V170 HydrophobicContact CD1-CG2 4.17Å; I159-V170 HydrophobicContact CD1-CG1 4.07Å; V167-V170 PolarHBondContact O-N 2.73Å; D168-V170 PolarHBondContact O-N 2.93Å
171	T	98.5	Very high	97.9	Very high	5 Å²	5	58.4 Å²	58.4	3%	0.031	32%	0.322	C	S	.	.	H	α-helix	trans	-118.6	-5.1	-164.3	60.1	0	0	0	0	115.5	V66 V68 I159 V167 D168 D173 L174	V66-T171 HydrophobicContact CB-CG2 4.32Å; V66-T171 HydrophobicContact CG1-CG2 3.99Å; V68-T171 HydrophobicContact CG2-CG2 4.36Å; I159-T171 HydrophobicContact CD1-CG2 3.52Å; V167-T171 PolarHBondContact O-N 3.44Å; V167-T171 PolarHBondContact O-OG1 3.12Å; D168-T171 PolarHBondContact O-N 3.26Å; T171-D173 PolarHBondContact O-N 2.7Å; T171-D173 VanDerWaalsContact O-N 3.16Å; T171-L174 HydrophobicContact CG2-CD1 4.23Å; T171-L174 WeakPolarHBondContact O-CB 3.35Å; T171-L174 WeakPolarHBondContact O-CG 3.31Å; T171-L174 PolarHBondContact O-N 3.46Å
172	G	97.1	Very high	97.9	Very high	46 Å²	46	61.9 Å²	61.9	47%	0.474	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.2	-27.1	-171.1	0	0	0	0	0	114.9	D168 L174	D168-G172 WeakPolarHBondContact O-CA 3.38Å; D168-G172 PolarHBondContact O-N 2.94Å; G172-L174 VanDerWaalsContact C-N 3.31Å
173	D	97.4	Very high	97.9	Very high	150 Å²	150	66.1 Å²	66.1	80%	0.802	36%	0.364	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.8	-6.4	179.5	-56.3	-44.2	0	0	0	113.5	T171	T171-D173 PolarHBondContact O-N 2.7Å; T171-D173 VanDerWaalsContact O-N 3.16Å
174	L	98.3	Very high	97.9	Very high	37 Å²	37	67.6 Å²	67.6	19%	0.194	37%	0.369	C	S	.	.	S	Bend	trans	-80.7	140.4	-177.7	-58.3	176.4	0	0	0	111.1	V68 V116 L127 T171 G172	V68-L174 HydrophobicContact CG1-CD1 4.04Å; V68-L174 HydrophobicContact CG2-CD1 4.03Å; V116-L174 HydrophobicContact CB-CB 3.89Å; V116-L174 HydrophobicContact CG1-CB 4.38Å; V116-L174 HydrophobicContact CG2-CB 3.93Å; V116-L174 HydrophobicContact CG2-CD1 3.71Å; V116-L174 HydrophobicContact CG2-CG 4.5Å; L127-L174 HydrophobicContact CD1-CD1 3.62Å; L127-L174 HydrophobicContact CD1-CD2 4.3Å; L127-L174 HydrophobicContact CD2-CD1 4.17Å; T171-L174 HydrophobicContact CG2-CD1 4.23Å; T171-L174 WeakPolarHBondContact O-CB 3.35Å; T171-L174 WeakPolarHBondContact O-CG 3.31Å; T171-L174 PolarHBondContact O-N 3.46Å; G172-L174 VanDerWaalsContact C-N 3.31Å
175	K	98.4	Very high	97.9	Very high	160 Å²	160	72.5 Å²	72.5	70%	0.696	39%	0.394	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.5	146.5	176.3	-62.3	-176.3	-178.8	-179.6	0	110.5	V116 K117	V116-K175 CarbonylContact C-O 3.6Å; V116-K175 VanDerWaalsContact CA-O 3.24Å; V116-K175 WeakPolarHBondContact CA-O 3.26Å; V116-K175 VanDerWaalsContact CB-O 3.3Å; V116-K175 WeakPolarHBondContact CB-O 3.16Å; K117-K175 HydrophobicContact CG-CB 4.26Å; K117-K175 PolarHBondContact N-O 3.05Å
176	L	98.4	Very high	97.9	Very high	123 Å²	123	68.7 Å²	68.7	64%	0.644	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-56.7	144.8	168.4	-63.2	177	0	0	0	110.7	V114 V116 K117	V114-L176 HydrophobicContact CG1-CD2 3.66Å; V116-L176 HydrophobicContact CG1-CD2 4.24Å; K117-L176 WeakPolarHBondContact CE-O 3.47Å; K117-L176 PolarHBondContact NZ-O 2.86Å
177	Y	95.9	Very high	98	Very high	110 Å²	110	69.5 Å²	69.5	43%	0.431	37%	0.372	S	S	.	.			trans	-61.6	0	-175.7	-179.5	-100.7	0	0	0	111.9	V69 V80 V115 K117	V69-Y177 HydrophobicContact CB-CD2 3.68Å; V69-Y177 HydrophobicContact CB-CE2 3.9Å; V69-Y177 HydrophobicContact CG1-CD2 3.91Å; V69-Y177 HydrophobicContact CG1-CE2 3.56Å; V69-Y177 HydrophobicContact CG2-CD2 4.12Å; V80-Y177 HydrophobicContact CB-CE1 4.44Å; V80-Y177 HydrophobicContact CG1-CD1 4.3Å; V80-Y177 HydrophobicContact CG1-CE1 3.83Å; V80-Y177 HydrophobicContact CG1-CE2 4.48Å; V80-Y177 HydrophobicContact CG2-CE1 4.23Å; V80-Y177 VanDerWaalsContact CG2-OH 3.31Å; V80-Y177 WeakPolarHBondContact CG2-OH 3.5Å; V115-Y177 HydrophobicContact CG1-CG 4.16Å; V115-Y177 PolarHBondContact O-N 3.36Å; V115-Y177 VanDerWaalsContact O-N 3.08Å; K117-Y177 HydrophobicContact CB-CD2 4.09Å; K117-Y177 PolarHBondContact NZ-OXT 3.11Å

Retrieved 177 of 177 residues in 122 ms (Link to these results)

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