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Mitochondrial translation release factor in rescue

Part of a mitoribosome-associated quality control pathway that prevents aberrant translation by responding to interruptions during elongation. As heterodimer with MTRES1, ejects the unfinished nascent chain and peptidyl transfer RNA (tRNA), respectively, from stalled ribosomes. Recruitment of mitoribosome biogenesis factors to these quality control intermediates suggests additional roles for MTRES1 and MTRF during mitoribosome rescue.

AlphaFold DB , UniProt , Accession A0A060XC42, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene mtrfr, Length 167 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	M	39.3	Very low	43.4	Very low	247 Å²	247	165.9 Å²	165.9	100%	1.217	85%	0.848	S	S	*	*				0	117.5	0	-74.5	173.9	89.9	0	0	109.1
2	S	42.1	Very low	43.6	Very low	117 Å²	117	165.9 Å²	165.9	82%	0.818	84%	0.842	S	S	*	*			trans	51.2	93.1	161.1	-140.6	0	0	0	0	120.3
3	S	41.2	Very low	43.9	Very low	113 Å²	113	162.6 Å²	162.6	79%	0.79	84%	0.835	S	S	*	*			trans	-83	125.5	158.9	-48.8	0	0	0	0	109.4	L5	S3-L5 PolarHBondContact O-N 3.4Å
4	R	48	Very low	44.5	Very low	237 Å²	237	160.9 Å²	160.9	89%	0.894	84%	0.836	S	S	*	*			trans	-84.7	101.3	175.7	-71.8	179.1	175.4	178.8	-2	109.7
5	L	46	Very low	44.6	Very low	158 Å²	158	154.4 Å²	154.4	83%	0.827	82%	0.823	S	S	*	*			trans	-90.3	113.6	167	-69.4	170.1	0	0	0	108.5	S3	S3-L5 PolarHBondContact O-N 3.4Å
6	F	41	Very low	44.8	Very low	201 Å²	201	157.3 Å²	157.3	88%	0.882	83%	0.826	S	S	*	*			trans	-82.6	113.5	169	-115.4	-99.1	0	0	0	108.2
7	V	48.2	Very low	45.3	Very low	126 Å²	126	154.6 Å²	154.6	76%	0.764	82%	0.818	S	S	*	*			trans	-83.8	122.9	178.6	179.6	0	0	0	0	108.8	L9	V7-L9 PolarHBondContact O-N 3.3Å
8	N	39.8	Very low	45.9	Very low	154 Å²	154	153 Å²	153	82%	0.824	82%	0.815	S	S	*	*			trans	-69.9	119.2	169.9	-82.7	-49.2	0	0	0	109.8
9	L	42.6	Very low	45.6	Very low	154 Å²	154	158.1 Å²	158.1	81%	0.806	82%	0.822	S	S	*	*			trans	-97.8	102.3	171.5	-173.7	64.6	0	0	0	109.3	V7 F11	V7-L9 PolarHBondContact O-N 3.3Å; L9-F11 PolarHBondContact O-N 2.82Å
10	I	52	Low	45.5	Very low	150 Å²	150	154 Å²	154	77%	0.769	82%	0.82	S	S	*	*			trans	-74.1	116.5	167	-65.4	178	0	0	0	107.2
11	F	37.3	Very low	45.9	Very low	168 Å²	168	153 Å²	153	74%	0.737	82%	0.82	S	S	*	*			trans	-105.8	105.8	171	-145.3	-97.2	0	0	0	109.1	L9 V13	L9-F11 PolarHBondContact O-N 2.82Å; F11-V13 HydrophobicContact CD1-CG2 3.86Å; F11-V13 HydrophobicContact CE1-CG2 4.28Å
12	Q	45.9	Very low	46.5	Very low	166 Å²	166	147.2 Å²	147.2	78%	0.776	80%	0.804	S	S	*	*			trans	-69.6	129.9	163.8	-94.5	174.7	3.8	0	0	108.8
13	V	47.6	Very low	46.9	Very low	123 Å²	123	145.1 Å²	145.1	75%	0.745	80%	0.801	S	S	*	*			trans	-116.8	105	163.8	177.1	0	0	0	0	107.9	F11	F11-V13 HydrophobicContact CD1-CG2 3.86Å; F11-V13 HydrophobicContact CE1-CG2 4.28Å
14	T	52.2	Low	47.6	Very low	139 Å²	139	151.1 Å²	151.1	85%	0.853	81%	0.806	S	S	*	*			trans	-90.5	104.5	164.4	41.3	0	0	0	0	108
15	G	45.3	Very low	48	Very low	63 Å²	63	145.3 Å²	145.3	65%	0.649	80%	0.799	S	S	*	*			trans	-119.6	110.9	178.6	0	0	0	0	0	111.1
16	K	47.7	Very low	48.5	Very low	200 Å²	200	142.8 Å²	142.8	87%	0.87	79%	0.792	S	S	*	*			trans	-68	127.1	-177.5	-169.3	166.9	172.2	165.6	0	111
17	V	54.4	Low	49.2	Very low	113 Å²	113	141 Å²	141	69%	0.685	79%	0.791	S	S	*	*			trans	-82.7	117.4	178.2	-179.1	0	0	0	0	109.7
18	T	56.2	Low	49.4	Very low	125 Å²	125	144.2 Å²	144.2	77%	0.767	80%	0.795	S	S	*	*			trans	-106.8	117.6	168.5	54	0	0	0	0	109.1
19	W	40.1	Very low	50.3	Low	249 Å²	249	142.6 Å²	142.6	94%	0.943	79%	0.791	S	S	*	*			trans	-82.4	115.4	172.3	-68.6	79.1	0	0	0	108.8
20	G	43.4	Very low	51.4	Low	76 Å²	76	141.3 Å²	141.3	78%	0.784	79%	0.789	S	S	*	*			trans	-130	123	175.4	0	0	0	0	0	109.3
21	T	52.8	Low	52	Low	134 Å²	134	139 Å²	139	82%	0.822	78%	0.784	S	S	*	*			trans	-81.2	160.9	-172.1	56	0	0	0	0	112.4
22	S	52.3	Low	53.3	Low	125 Å²	125	136.8 Å²	136.8	87%	0.874	79%	0.787	S	S	*	*			trans	78	98.3	165.4	74.2	0	0	0	0	118
23	G	50.1	Low	54.2	Low	74 Å²	74	135.3 Å²	135.3	76%	0.763	79%	0.789	S	S	*	*			trans	171.9	114.7	166.4	0	0	0	0	0	110.1
24	R	55.8	Low	54.9	Low	239 Å²	239	134.6 Å²	134.6	90%	0.902	79%	0.789	S	S	*	*			trans	-32.4	134.2	179.3	-75.8	168.4	165.9	-146.7	-2.7	113.5
25	P	57.4	Low	55.5	Low	114 Å²	114	135.8 Å²	135.8	74%	0.74	79%	0.789	S	S	*	*			trans	-62.1	132.3	170.5	27.4	-31.9	0	0	0	108.5	L27	P25-L27 PolarHBondContact O-N 3.32Å
26	P	57.2	Low	56.3	Low	106 Å²	106	136.8 Å²	136.8	69%	0.688	79%	0.791	S	S	*	*			trans	-59	131	168.4	26.5	-31.2	0	0	0	106.7	F28	P26-F28 PolarHBondContact O-N 3.3Å
27	L	54.1	Low	57	Low	162 Å²	162	134.3 Å²	134.3	85%	0.848	78%	0.782	S	S	*	*			trans	-49.6	103.9	172.4	-73.3	158.1	0	0	0	107.3	P25 T29	P25-L27 PolarHBondContact O-N 3.32Å; L27-T29 PolarHBondContact O-N 2.84Å
28	F	53.1	Low	57.6	Low	195 Å²	195	134.3 Å²	134.3	86%	0.855	78%	0.783	S	S	*	*			trans	-64.5	91.5	167.4	-99.8	-90.4	0	0	0	105.5	P26 V30	P26-F28 PolarHBondContact O-N 3.3Å; F28-V30 PolarHBondContact O-N 3.38Å
29	T	57.9	Low	57.8	Low	120 Å²	120	135.9 Å²	135.9	74%	0.736	78%	0.781	S	S	*	*			trans	-68.2	93.4	167.8	60.7	0	0	0	0	105.5	L27 P31	L27-T29 PolarHBondContact O-N 2.84Å; T29-P31 WeakPolarHBondContact O-CD 3.21Å; T29-P31 VanDerWaalsContact O-N 3.11Å
30	V	65.9	Low	58.6	Low	127 Å²	127	130 Å²	130	77%	0.77	77%	0.773	S	S	*	*	P	Polyproline II helix	trans	-52.5	119.7	166.4	-122.5	0	0	0	0	105.8	F28	F28-V30 PolarHBondContact O-N 3.38Å
31	P	64.6	Low	59.3	Low	101 Å²	101	130.8 Å²	130.8	66%	0.656	77%	0.772	S	S	*	*	P	Polyproline II helix	trans	-57.3	136	173.1	24.9	-32.3	0	0	0	106.9	T29 V33	T29-P31 WeakPolarHBondContact O-CD 3.21Å; T29-P31 VanDerWaalsContact O-N 3.11Å; P31-V33 PolarHBondContact O-N 3.23Å
32	P	65	Low	59.2	Low	122 Å²	122	127.7 Å²	127.7	79%	0.792	77%	0.767	S	S	*	*	P	Polyproline II helix	trans	-56.8	118.4	176.8	24.3	-32	0	0	0	106.9	S34	P32-S34 VanDerWaalsContact C-N 3.33Å; P32-S34 PolarHBondContact O-N 3.05Å
33	V	64.4	Low	59	Low	135 Å²	135	130.5 Å²	130.5	82%	0.818	76%	0.763	S	S	*	*			trans	-55.4	103.9	174	-178.1	0	0	0	0	105.4	P31 L35	P31-V33 PolarHBondContact O-N 3.23Å; V33-L35 PolarHBondContact O-N 3.49Å
34	S	62.8	Low	59	Low	108 Å²	108	134.2 Å²	134.2	76%	0.755	76%	0.759	S	S	*	*			trans	-63.3	108.5	176.9	47.1	0	0	0	0	105.9	P32 A36	P32-S34 VanDerWaalsContact C-N 3.33Å; P32-S34 PolarHBondContact O-N 3.05Å; S34-A36 VanDerWaalsContact C-N 3.33Å; S34-A36 PolarHBondContact O-N 3.14Å
35	L	65.3	Low	59.1	Low	164 Å²	164	129.1 Å²	129.1	86%	0.859	75%	0.749	S	S	*	*			trans	-60.5	101.6	176	-148.8	93.7	0	0	0	105.7	V33 H37	V33-L35 PolarHBondContact O-N 3.49Å; L35-H37 PolarHBondContact O-N 3.31Å
36	A	62	Low	59.1	Low	84 Å²	84	132.2 Å²	132.2	69%	0.694	75%	0.747	S	S	*	*			trans	-59	105.4	174.7	0	0	0	0	0	106.7	S34 V38	S34-A36 VanDerWaalsContact C-N 3.33Å; S34-A36 PolarHBondContact O-N 3.14Å; A36-V38 PolarHBondContact O-N 3.24Å
37	H	61.9	Low	59.6	Low	147 Å²	147	129.7 Å²	129.7	68%	0.681	73%	0.728	S	S	*	*			trans	-69	88.6	177.6	-179.3	73.4	0	0	0	107.5	L35 Q39	L35-H37 PolarHBondContact O-N 3.31Å; H37-Q39 WeakPolarHBondContact CD2-CG 3.42Å; H37-Q39 PolarHBondContact O-N 3.35Å
38	V	67.7	Low	60.5	Low	114 Å²	114	128.9 Å²	128.9	69%	0.691	72%	0.724	S	S	*	*			trans	-67.4	100	171.5	175.7	0	0	0	0	106.7	A36 T40	A36-V38 PolarHBondContact O-N 3.24Å; V38-T40 VanDerWaalsContact C-N 3.35Å; V38-T40 HydrophobicContact CG1-CG2 4.4Å; V38-T40 PolarHBondContact O-N 2.88Å
39	Q	59.6	Low	61.6	Low	157 Å²	157	121.2 Å²	121.2	73%	0.734	69%	0.692	S	S	*	*			trans	-69	96.3	169.3	-68.4	-177.5	-15.5	0	0	107.8	H37 A41	H37-Q39 WeakPolarHBondContact CD2-CG 3.42Å; H37-Q39 PolarHBondContact O-N 3.35Å; Q39-A41 PolarHBondContact O-N 2.6Å
40	T	57.4	Low	62.5	Low	125 Å²	125	117.6 Å²	117.6	77%	0.767	67%	0.67	S	S	*	*			trans	-68.7	101.7	164.6	37.6	0	0	0	0	107.6	V38 G42	V38-T40 VanDerWaalsContact C-N 3.35Å; V38-T40 HydrophobicContact CG1-CG2 4.4Å; V38-T40 PolarHBondContact O-N 2.88Å; T40-G42 PolarHBondContact O-N 2.86Å
41	A	58.9	Low	63.2	Low	94 Å²	94	118 Å²	118	78%	0.777	67%	0.673	S	S	*	*			trans	-65.2	85.7	171	0	0	0	0	0	109.2	Q39 K43	Q39-A41 PolarHBondContact O-N 2.6Å; A41-K43 PolarHBondContact O-N 3.33Å
42	G	49.8	Very low	64.1	Low	69 Å²	69	114.6 Å²	114.6	71%	0.711	65%	0.649	S	S	*	*			trans	-68.9	93.1	171.3	0	0	0	0	0	109.2	T40 K44	T40-G42 PolarHBondContact O-N 2.86Å; G42-K44 PolarHBondContact O-N 3.38Å
43	K	48	Very low	65.3	Low	183 Å²	183	112.7 Å²	112.7	80%	0.796	63%	0.632	S	S	*	*			trans	-62.7	104.1	164.2	-74.4	-178.4	175.8	179	0	107.2	A41 D45	A41-K43 PolarHBondContact O-N 3.33Å; K43-D45 PolarHBondContact O-N 2.88Å
44	K	50.8	Low	66.5	Low	153 Å²	153	111 Å²	111	67%	0.665	62%	0.615	S	S	*	*			trans	-88.9	89.5	175.1	-142.6	164.3	173.6	-162.4	0	105.6	G42 Y46	G42-K44 PolarHBondContact O-N 3.38Å; K44-Y46 HydrophobicContact CB-CD2 3.96Å; K44-Y46 HydrophobicContact CB-CE2 3.84Å; K44-Y46 HydrophobicContact CD-CD2 4.37Å; K44-Y46 HydrophobicContact CD-CE2 3.45Å; K44-Y46 VanDerWaalsContact CD-CE2 3.45Å; K44-Y46 WeakPolarHBondContact CE-OH 3.38Å; K44-Y46 HydrophobicContact CG-CD2 3.94Å; K44-Y46 HydrophobicContact CG-CE2 3.49Å; K44-Y46 VanDerWaalsContact CG-CE2 3.49Å; K44-Y46 PolarHBondContact NZ-OH 3.46Å; K44-Y46 PolarHBondContact O-N 3.1Å
45	D	57.2	Low	67.9	Low	132 Å²	132	113.4 Å²	113.4	71%	0.706	62%	0.62	S	S	*	*			trans	-70.6	82.8	176.9	-56.6	-34.5	0	0	0	107.6	K43 I47	K43-D45 PolarHBondContact O-N 2.88Å; D45-I47 VanDerWaalsContact C-N 3.35Å; D45-I47 PolarHBondContact O-N 2.78Å
46	Y	58	Low	69.2	Low	178 Å²	178	108.8 Å²	108.8	70%	0.698	59%	0.594	S	S	*	*			trans	-74.7	92.7	172.7	-82.6	-84.8	0	0	0	108.1	K44	K44-Y46 HydrophobicContact CB-CD2 3.96Å; K44-Y46 HydrophobicContact CB-CE2 3.84Å; K44-Y46 HydrophobicContact CD-CD2 4.37Å; K44-Y46 HydrophobicContact CD-CE2 3.45Å; K44-Y46 VanDerWaalsContact CD-CE2 3.45Å; K44-Y46 WeakPolarHBondContact CE-OH 3.38Å; K44-Y46 HydrophobicContact CG-CD2 3.94Å; K44-Y46 HydrophobicContact CG-CE2 3.49Å; K44-Y46 VanDerWaalsContact CG-CE2 3.49Å; K44-Y46 PolarHBondContact NZ-OH 3.46Å; K44-Y46 PolarHBondContact O-N 3.1Å
47	I	67.4	Low	70.8	Confident	54 Å²	54	105.8 Å²	105.8	28%	0.277	57%	0.566	S	S	.	*			trans	-76.2	127.9	163.6	-56	171	0	0	0	106.3	D45 L49 D123 I124	D45-I47 VanDerWaalsContact C-N 3.35Å; D45-I47 PolarHBondContact O-N 2.78Å; I47-L49 VanDerWaalsContact C-N 3.29Å; I47-L49 HydrophobicContact CG2-CG 4.47Å; I47-L49 PolarHBondContact O-N 2.86Å; I47-D123 HydrophobicContact CG2-CB 4.34Å; I47-I124 HydrophobicContact CD1-CG1 4.15Å; I47-I124 HydrophobicContact CG2-CG1 4.48Å
48	D	72.3	Confident	72.4	Confident	144 Å²	144	101 Å²	101	77%	0.77	55%	0.545	S	S	*	.			trans	-72.2	88.5	175.4	-168.9	27.7	0	0	0	109.1
49	L	76.4	Confident	73.7	Confident	34 Å²	34	98 Å²	98	18%	0.178	52%	0.524	C	S	.	.	P	Polyproline II helix	trans	-83.3	142.5	179.4	-73	164.7	0	0	0	109.6	I47 V51 R110 E111 E114 I124	I47-L49 VanDerWaalsContact C-N 3.29Å; I47-L49 HydrophobicContact CG2-CG 4.47Å; I47-L49 PolarHBondContact O-N 2.86Å; L49-V51 PolarHBondContact O-N 2.85Å; L49-R110 HydrophobicContact CB-CB 4.26Å; L49-R110 HydrophobicContact CD1-CB 4.3Å; L49-R110 HydrophobicContact CD2-CB 4.17Å; L49-E111 HydrophobicContact CD2-CG 4.4Å; L49-E114 HydrophobicContact CD2-CB 4.35Å; L49-E114 WeakPolarHBondContact CD2-OE2 3.2Å; L49-I124 HydrophobicContact CD2-CD1 4.02Å
50	P	76.4	Confident	75.5	Confident	44 Å²	44	94.9 Å²	94.9	29%	0.286	51%	0.509	S	S	.	.	P	Polyproline II helix	trans	-57.3	140.8	178	24.1	-33	0	0	0	111.4	L52 R110 L113	P50-L52 PolarHBondContact O-N 3.36Å; P50-R110 WeakPolarHBondContact O-CD 3.44Å; P50-L113 HydrophobicContact CG-CB 4.42Å
51	V	81.6	Confident	77.3	Confident	137 Å²	137	93.7 Å²	93.7	83%	0.83	49%	0.494	S	S	*	.	P	Polyproline II helix	trans	-63.7	130.6	173.8	-179.4	0	0	0	0	108.4	L49	L49-V51 PolarHBondContact O-N 2.85Å
52	L	84	Confident	79	Confident	28 Å²	28	92.3 Å²	92.3	15%	0.147	48%	0.476	C	S	.	.	P	Polyproline II helix	trans	-101.1	119	-177.9	-166.5	68.4	0	0	0	109	P50 L57 R106 M109 R110 L113	P50-L52 PolarHBondContact O-N 3.36Å; L52-L57 HydrophobicContact CD1-CD2 4.21Å; L52-L57 HydrophobicContact CD2-CD1 3.5Å; L52-L57 VanDerWaalsContact CD2-CD1 3.5Å; L52-L57 HydrophobicContact CD2-CD2 4.21Å; L52-L57 HydrophobicContact CD2-CG 4.36Å; L52-L57 HydrophobicContact CG-CD1 3.83Å; L52-L57 HydrophobicContact CG-CD2 4.34Å; L52-L57 HydrophobicContact CG-CG 4.37Å; L52-R106 HydrophobicContact CD2-CB 4.42Å; L52-R106 HydrophobicContact CD2-CG 4.4Å; L52-M109 HydrophobicContact CD1-CG 4.45Å; L52-M109 HydrophobicContact CD2-CG 4.5Å; L52-R110 HydrophobicContact CB-CG 4.15Å; L52-R110 HydrophobicContact CD2-CG 4.3Å; L52-L113 HydrophobicContact CD1-CD1 3.52Å
53	N	89.3	Confident	81	Confident	82 Å²	82	97 Å²	97	44%	0.439	47%	0.472	S	S	.	.	P	Polyproline II helix	trans	-77.2	125.8	172.9	-64	-24.9	0	0	0	109.2	D55 E56	N53-D55 VanDerWaalsContact C-N 3.28Å; N53-D55 PolarHBondContact O-N 3.16Å; N53-E56 HydrophobicContact CB-CG 4.21Å; N53-E56 PolarHBondContact ND2-OE1 3.28Å; N53-E56 PolarHBondContact O-N 3.23Å
54	E	89.8	Confident	82.7	Confident	99 Å²	99	88.7 Å²	88.7	46%	0.463	44%	0.438	S	S	.	.	G	3₁₀ helix	trans	-70.8	-25.2	-179.6	-63.7	-76.1	161.4	0	0	112	E56 L57 R106	E54-E56 PolarHBondContact O-N 2.93Å; E54-L57 PolarHBondContact O-N 3.3Å; E54-R106 WeakPolarHBondContact OE1-CD 3.43Å; E54-R106 IonicContact OE1-CZ 3.37Å; E54-R106 IonicContact OE1-NE 3.17Å; E54-R106 PolarHBondContact OE1-NE 3.49Å; E54-R106 IonicContact OE1-NH2 3.72Å; E54-R106 IonicContact OE2-CZ 2.77Å; E54-R106 IonicContact OE2-NE 3.15Å; E54-R106 PolarHBondContact OE2-NE 2.89Å; E54-R106 VanDerWaalsContact OE2-NE 3.08Å; E54-R106 IonicContact OE2-NH2 3.65Å; E54-R106 PolarHBondContact OE2-NH2 2.87Å
55	D	92.4	Very high	84.2	Confident	160 Å²	160	87.6 Å²	87.6	86%	0.856	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-69.7	-21.2	-179.6	-57.1	-42.3	0	0	0	113.3	N53 L57	N53-D55 VanDerWaalsContact C-N 3.28Å; N53-D55 PolarHBondContact O-N 3.16Å; D55-L57 VanDerWaalsContact C-N 3.32Å
56	E	92.2	Very high	85.3	Confident	67 Å²	67	83.2 Å²	83.2	31%	0.313	44%	0.436	S	S	.	.	G	3₁₀ helix	trans	-91	2.3	178.2	-64.9	172.1	-152.8	0	0	112.8	N53 E54 H83 I84	N53-E56 HydrophobicContact CB-CG 4.21Å; N53-E56 PolarHBondContact ND2-OE1 3.28Å; N53-E56 PolarHBondContact O-N 3.23Å; E54-E56 PolarHBondContact O-N 2.93Å; E56-H83 IonicContact OE2-CD2 3.83Å; E56-H83 IonicContact OE2-CE1 3.08Å; E56-H83 IonicContact OE2-NE2 3.39Å; E56-H83 PolarHBondContact OE2-NE2 3.43Å; E56-I84 WeakPolarHBondContact O-CB 3.08Å; E56-I84 WeakPolarHBondContact O-CG1 3.39Å; E56-I84 PolarHBondContact O-N 2.83Å
57	L	94.7	Very high	86.3	Confident	21 Å²	21	82 Å²	82	11%	0.11	45%	0.45	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	130	-177.2	-62.3	174.7	0	0	0	110.9	L52 E54 D55 L81 R82 H83 M109	L52-L57 HydrophobicContact CD1-CD2 4.21Å; L52-L57 HydrophobicContact CD2-CD1 3.5Å; L52-L57 VanDerWaalsContact CD2-CD1 3.5Å; L52-L57 HydrophobicContact CD2-CD2 4.21Å; L52-L57 HydrophobicContact CD2-CG 4.36Å; L52-L57 HydrophobicContact CG-CD1 3.83Å; L52-L57 HydrophobicContact CG-CD2 4.34Å; L52-L57 HydrophobicContact CG-CG 4.37Å; E54-L57 PolarHBondContact O-N 3.3Å; D55-L57 VanDerWaalsContact C-N 3.32Å; L57-L81 HydrophobicContact CB-CD1 4.02Å; L57-L81 HydrophobicContact CD1-CD1 4.28Å; L57-L81 HydrophobicContact CD1-CD2 4.5Å; L57-L81 HydrophobicContact CD2-CD1 4.35Å; L57-L81 HydrophobicContact CD2-CD2 4.47Å; L57-L81 HydrophobicContact CD2-CG 4.31Å; L57-L81 HydrophobicContact CG-CD1 4.47Å; L57-R82 WeakPolarHBondContact CA-O 3.21Å; L57-H83 HydrophobicContact CD2-CB 4.14Å; L57-M109 HydrophobicContact CD2-CG 4.5Å
58	D	95.9	Very high	86.7	Confident	45 Å²	45	80.9 Å²	80.9	24%	0.241	45%	0.452	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	117.4	166.1	-178.7	23.8	0	0	0	109.3	Q60 R82	D58-Q60 PolarHBondContact OD2-NE2 2.86Å; D58-R82 HydrophobicContact CB-CB 4.33Å; D58-R82 PolarHBondContact N-O 2.9Å; D58-R82 PolarHBondContact O-N 3.31Å; D58-R82 IonicContact OD2-CZ 3.15Å; D58-R82 IonicContact OD2-NE 3.33Å; D58-R82 PolarHBondContact OD2-NE 2.88Å; D58-R82 IonicContact OD2-NH2 2.6Å; D58-R82 PolarHBondContact OD2-NH2 3.44Å
59	E	96.4	Very high	87.2	Confident	53 Å²	53	76.6 Å²	76.6	25%	0.248	44%	0.441	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.2	119.9	-176.2	-168.8	179.8	162.2	0	0	110.2	F61 V79 L81 R102 R106	E59-F61 HydrophobicContact CG-CZ 4.24Å; E59-F61 VanDerWaalsContact OE1-CE1 3.27Å; E59-F61 WeakPolarHBondContact OE1-CE1 3.44Å; E59-F61 WeakPolarHBondContact OE1-CZ 3.38Å; E59-V79 HydrophobicContact CG-CG1 4.09Å; E59-L81 HydrophobicContact CB-CD1 4.06Å; E59-L81 HydrophobicContact CG-CD1 4.24Å; E59-R102 WeakPolarHBondContact OE1-CD 3.48Å; E59-R102 WeakPolarHBondContact OE1-CG 3.5Å; E59-R102 IonicContact OE1-CZ 3.26Å; E59-R102 IonicContact OE1-NE 3.74Å; E59-R102 PolarHBondContact OE1-NE 3.26Å; E59-R102 IonicContact OE2-CZ 2.69Å; E59-R102 IonicContact OE2-NE 2.73Å; E59-R102 PolarHBondContact OE2-NE 3.08Å; E59-R102 VanDerWaalsContact OE2-NE 3.17Å; E59-R102 IonicContact OE2-NH2 3.86Å; E59-R102 PolarHBondContact OE2-NH2 3.05Å; E59-R106 IonicContact OE2-NH2 2.81Å; E59-R106 PolarHBondContact OE2-NH2 3.37Å; E59-R106 VanDerWaalsContact OE2-NH2 3.15Å
60	Q	96.3	Very high	87.4	Confident	90 Å²	90	81.8 Å²	81.8	42%	0.421	47%	0.465	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.7	140	179.3	-60.8	-177.8	24.6	0	0	111.5	D58 V80	D58-Q60 PolarHBondContact OD2-NE2 2.86Å; Q60-V80 HydrophobicContact CB-CB 4.37Å; Q60-V80 PolarHBondContact N-O 3.08Å; Q60-V80 PolarHBondContact O-N 3.34Å
61	F	96	Very high	87.6	Confident	101 Å²	101	83.1 Å²	83.1	44%	0.443	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	120.8	176.5	-57.3	-69.9	0	0	0	110.7	E59 C78 V79 V98 R102	E59-F61 HydrophobicContact CG-CZ 4.24Å; E59-F61 VanDerWaalsContact OE1-CE1 3.27Å; E59-F61 WeakPolarHBondContact OE1-CE1 3.44Å; E59-F61 WeakPolarHBondContact OE1-CZ 3.38Å; F61-C78 WeakPolarHBondContact CA-O 3.25Å; F61-V79 HydrophobicContact CD1-CG2 4.02Å; F61-V79 HydrophobicContact CE1-CG1 4.48Å; F61-V79 HydrophobicContact CE1-CG2 3.91Å; F61-V98 HydrophobicContact CD1-CG1 3.61Å; F61-V98 HydrophobicContact CE1-CG1 3.26Å; F61-V98 HydrophobicContact CZ-CG1 4.1Å; F61-R102 HydrophobicContact CE1-CG 4.07Å
62	V	94.2	Very high	87.7	Confident	65 Å²	65	78.5 Å²	78.5	39%	0.394	45%	0.452	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	155.3	-177.8	-171.2	0	0	0	0	109.2	S76 C78 V80	V62-S76 CarbonylContact O-C 3.6Å; V62-S76 WeakPolarHBondContact O-CA 3.37Å; V62-C78 PolarHBondContact N-O 3.49Å; V62-C78 WeakPolarHBondContact O-CB 3.39Å; V62-C78 PolarHBondContact O-N 2.93Å; V62-V80 HydrophobicContact CB-CG2 4.24Å; V62-V80 HydrophobicContact CG2-CB 4.46Å; V62-V80 HydrophobicContact CG2-CG2 3.62Å
63	R	92.2	Very high	87.7	Confident	167 Å²	167	81.1 Å²	81.1	63%	0.63	47%	0.466	S	S	*	.			trans	-73.5	146.4	170.7	-66.5	175.2	179.8	125.9	2.2	109.9	N73	R63-N73 WeakPolarHBondContact CD-O 3.42Å
64	G	83	Confident	87.5	Confident	9 Å²	9	83.8 Å²	83.8	9%	0.093	47%	0.474	C	S	.	.			trans	-60	143.1	172.7	0	0	0	0	0	110.4
65	S	81.4	Confident	87.5	Confident	129 Å²	129	82.2 Å²	82.2	90%	0.902	47%	0.471	S	S	*	.			trans	-118.2	136.1	172.6	-179.3	0	0	0	0	108.6
66	G	82.1	Confident	87.5	Confident	41 Å²	41	77.4 Å²	77.4	42%	0.423	45%	0.45	S	S	.	.	S	Bend	trans	143.6	179.6	178	0	0	0	0	0	113.1	G68	G66-G68 PolarHBondContact O-N 2.91Å
67	P	78.9	Confident	87.5	Confident	151 Å²	151	74.6 Å²	74.6	98%	0.981	44%	0.437	S	S	*	.	S	Bend	trans	-72.3	41.8	178.5	32.5	-36.9	0	0	0	112.8
68	G	75.6	Confident	87.5	Confident	32 Å²	32	74.3 Å²	74.3	33%	0.33	44%	0.436	S	S	.	.			trans	-80	161.3	177.1	0	0	0	0	0	112.4	G66	G66-G68 PolarHBondContact O-N 2.91Å
69	G	82.8	Confident	87.5	Confident	53 Å²	53	72.2 Å²	72.2	55%	0.546	43%	0.425	S	S	.	.			trans	-70	-179.7	171.4	0	0	0	0	0	113.2	A71 T72	G69-A71 PolarHBondContact O-N 3.02Å; G69-T72 PolarHBondContact O-N 3.41Å; G69-T72 VanDerWaalsContact O-N 3.08Å
70	Q	80.3	Confident	87.6	Confident	143 Å²	143	70.6 Å²	70.6	67%	0.668	42%	0.419	S	S	*	.	H	α-helix	trans	-51.7	-32.8	-177.6	-65.7	-161.3	42.9	0	0	114.3	K74	Q70-K74 VanDerWaalsContact O-CG 3.28Å; Q70-K74 WeakPolarHBondContact O-CG 3.44Å; Q70-K74 PolarHBondContact O-N 3.31Å
71	A	80.4	Confident	87.6	Confident	72 Å²	72	66.4 Å²	66.4	60%	0.595	40%	0.4	S	S	*	.	H	α-helix	trans	-67.6	-37.2	-178	0	0	0	0	0	113.2	G69 T75	G69-A71 PolarHBondContact O-N 3.02Å; A71-T75 WeakPolarHBondContact O-CB 3.4Å; A71-T75 PolarHBondContact O-N 3.5Å; A71-T75 PolarHBondContact O-OG1 3.33Å
72	T	83.6	Confident	87.6	Confident	41 Å²	41	67.1 Å²	67.1	25%	0.252	40%	0.399	S	S	.	.	H	α-helix	trans	-70.4	-38.2	-177.5	-58.7	0	0	0	0	111.8	G69	G69-T72 PolarHBondContact O-N 3.41Å; G69-T72 VanDerWaalsContact O-N 3.08Å
73	N	83.9	Confident	87.7	Confident	82 Å²	82	64.2 Å²	64.2	44%	0.439	38%	0.381	S	S	.	.	H	α-helix	trans	-80	-23.5	-176	-63.5	-13.2	0	0	0	112.8	R63	R63-N73 WeakPolarHBondContact CD-O 3.42Å
74	K	84.7	Confident	87.8	Confident	138 Å²	138	61.1 Å²	61.1	60%	0.6	38%	0.376	S	S	*	.	H	α-helix	trans	-86.7	-36.4	-179.6	-68	175.7	-171	179.5	0	112.7	Q70	Q70-K74 VanDerWaalsContact O-CG 3.28Å; Q70-K74 WeakPolarHBondContact O-CG 3.44Å; Q70-K74 PolarHBondContact O-N 3.31Å
75	T	89.9	Confident	88.3	Confident	66 Å²	66	64.7 Å²	64.7	41%	0.405	40%	0.398	S	S	.	.			trans	-90.4	127.8	-169.8	-43.7	0	0	0	0	111.9	A71 N77	A71-T75 WeakPolarHBondContact O-CB 3.4Å; A71-T75 PolarHBondContact O-N 3.5Å; A71-T75 PolarHBondContact O-OG1 3.33Å; T75-N77 VanDerWaalsContact C-N 3.3Å; T75-N77 HydrophobicContact CG2-CB 4.05Å; T75-N77 PolarHBondContact O-N 2.93Å; T75-N77 VanDerWaalsContact O-N 3.12Å
76	S	92.1	Very high	88.9	Confident	59 Å²	59	60.9 Å²	60.9	41%	0.413	37%	0.369	S	S	.	.			trans	-85.3	64.5	174.3	55.5	0	0	0	0	111.7	V62	V62-S76 CarbonylContact O-C 3.6Å; V62-S76 WeakPolarHBondContact O-CA 3.37Å
77	N	93.3	Very high	89.5	Confident	8 Å²	8	61.3 Å²	61.3	4%	0.043	37%	0.374	C	S	.	.			trans	-105.4	-2.9	-178.1	62.4	0.4	0	0	0	114.8	T75 H93 R96 V98 N101	T75-N77 VanDerWaalsContact C-N 3.3Å; T75-N77 HydrophobicContact CG2-CB 4.05Å; T75-N77 PolarHBondContact O-N 2.93Å; T75-N77 VanDerWaalsContact O-N 3.12Å; N77-H93 PolarHBondContact OD1-CD2 3.39Å; N77-H93 PolarHBondContact OD1-NE2 2.77Å; N77-R96 WeakPolarHBondContact ND2-CA 3.44Å; N77-R96 PolarHBondContact ND2-O 3.38Å; N77-V98 HydrophobicContact CB-CG2 3.93Å; N77-N101 PolarHBondContact O-ND2 3.43Å
78	C	94.8	Very high	90.2	Very high	15 Å²	15	55.4 Å²	55.4	10%	0.101	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.3	126.1	171.6	-177.1	0	0	0	0	108.6	F61 V62 H93	F61-C78 WeakPolarHBondContact CA-O 3.25Å; V62-C78 PolarHBondContact N-O 3.49Å; V62-C78 WeakPolarHBondContact O-CB 3.39Å; V62-C78 PolarHBondContact O-N 2.93Å; C78-H93 HydrophobicContact CB-CB 4.12Å
79	V	96.5	Very high	91.3	Very high	1 Å²	1	57 Å²	57	1%	0.006	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	124.5	177.6	-175.5	0	0	0	0	108.2	E59 F61 K91 C92 V98 N101 R102 A105	E59-V79 HydrophobicContact CG-CG1 4.09Å; F61-V79 HydrophobicContact CD1-CG2 4.02Å; F61-V79 HydrophobicContact CE1-CG1 4.48Å; F61-V79 HydrophobicContact CE1-CG2 3.91Å; V79-K91 CarbonylContact O-C 3.53Å; V79-K91 WeakPolarHBondContact O-CA 3.43Å; V79-C92 PolarHBondContact N-O 2.87Å; V79-C92 PolarHBondContact O-N 2.94Å; V79-V98 HydrophobicContact CG2-CG1 4.28Å; V79-N101 HydrophobicContact CG2-CB 3.78Å; V79-R102 HydrophobicContact CG1-CG 4.34Å; V79-R102 HydrophobicContact CG2-CG 3.84Å; V79-A105 HydrophobicContact CG1-CB 4.22Å
80	V	96.8	Very high	91.9	Very high	20 Å²	20	54.6 Å²	54.6	12%	0.121	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	111	169.6	-176.5	0	0	0	0	106.7	Q60 V62 V89 V90 K91	Q60-V80 HydrophobicContact CB-CB 4.37Å; Q60-V80 PolarHBondContact N-O 3.08Å; Q60-V80 PolarHBondContact O-N 3.34Å; V62-V80 HydrophobicContact CB-CG2 4.24Å; V62-V80 HydrophobicContact CG2-CB 4.46Å; V62-V80 HydrophobicContact CG2-CG2 3.62Å; V80-V89 HydrophobicContact CG1-CG1 3.77Å; V80-V90 WeakPolarHBondContact CA-O 3.32Å; V80-K91 HydrophobicContact CG1-CG 4.24Å; V80-K91 HydrophobicContact CG2-CD 4.37Å; V80-K91 HydrophobicContact CG2-CG 4.06Å
81	L	96.7	Very high	92.6	Very high	2 Å²	2	55.4 Å²	55.4	1%	0.01	31%	0.313	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	126.5	179.8	-170.6	66	0	0	0	108.5	L57 E59 V89 V90 A105 R106 M109	L57-L81 HydrophobicContact CB-CD1 4.02Å; L57-L81 HydrophobicContact CD1-CD1 4.28Å; L57-L81 HydrophobicContact CD1-CD2 4.5Å; L57-L81 HydrophobicContact CD2-CD1 4.35Å; L57-L81 HydrophobicContact CD2-CD2 4.47Å; L57-L81 HydrophobicContact CD2-CG 4.31Å; L57-L81 HydrophobicContact CG-CD1 4.47Å; E59-L81 HydrophobicContact CB-CD1 4.06Å; E59-L81 HydrophobicContact CG-CD1 4.24Å; L81-V89 WeakPolarHBondContact O-CA 3.39Å; L81-V90 PolarHBondContact N-O 2.93Å; L81-V90 PolarHBondContact O-N 3.47Å; L81-A105 HydrophobicContact CB-CB 4.3Å; L81-A105 HydrophobicContact CD2-CB 4.23Å; L81-R106 HydrophobicContact CD2-CG 4.11Å; L81-M109 HydrophobicContact CB-CE 4Å; L81-M109 HydrophobicContact CD2-CB 4.08Å; L81-M109 HydrophobicContact CD2-CE 3.98Å; L81-M109 HydrophobicContact CD2-CG 4.42Å; L81-M109 HydrophobicContact CG-CE 3.75Å; L81-M109 WeakPolarHBondContact O-CE 3.23Å
82	R	96.6	Very high	93.3	Very high	115 Å²	115	52.1 Å²	52.1	43%	0.434	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.3	128.8	177.1	173.1	173.7	63.1	171.4	3	109.4	L57 D58 I88 V89	L57-R82 WeakPolarHBondContact CA-O 3.21Å; D58-R82 HydrophobicContact CB-CB 4.33Å; D58-R82 PolarHBondContact N-O 2.9Å; D58-R82 PolarHBondContact O-N 3.31Å; D58-R82 IonicContact OD2-CZ 3.15Å; D58-R82 IonicContact OD2-NE 3.33Å; D58-R82 PolarHBondContact OD2-NE 2.88Å; D58-R82 IonicContact OD2-NH2 2.6Å; D58-R82 PolarHBondContact OD2-NH2 3.44Å; R82-I88 WeakPolarHBondContact CA-O 3.4Å; R82-V89 HydrophobicContact CB-CG2 4.25Å; R82-V89 HydrophobicContact CG-CG2 4.13Å
83	H	96.2	Very high	93.8	Very high	4 Å²	4	53.8 Å²	53.8	2%	0.019	29%	0.29	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	118.1	169	-173.9	-127.5	0	0	0	108.8	E56 L57 P85 T86 G87 I88 M109	E56-H83 IonicContact OE2-CD2 3.83Å; E56-H83 IonicContact OE2-CE1 3.08Å; E56-H83 IonicContact OE2-NE2 3.39Å; E56-H83 PolarHBondContact OE2-NE2 3.43Å; L57-H83 HydrophobicContact CD2-CB 4.14Å; H83-P85 WeakPolarHBondContact CE1-CG 3.5Å; H83-P85 WeakPolarHBondContact NE2-CG 3.46Å; H83-T86 PolarHBondContact CE1-OG1 3.22Å; H83-T86 WeakPolarHBondContact ND1-CB 3.4Å; H83-T86 PolarHBondContact ND1-OG1 2.9Å; H83-G87 VanDerWaalsContact O-CA 3.28Å; H83-G87 WeakPolarHBondContact O-CA 3.35Å; H83-G87 PolarHBondContact O-N 3.04Å; H83-I88 PolarHBondContact N-O 3.38Å; H83-M109 HydrophobicContact CB-CE 4.27Å; H83-M109 HydrophobicContact CB-SD 3.99Å
84	I	94.7	Very high	94.2	Very high	102 Å²	102	56.1 Å²	56.1	52%	0.523	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.7	-50.5	-171	-61.4	165.9	0	0	0	112.5	E56	E56-I84 WeakPolarHBondContact O-CB 3.08Å; E56-I84 WeakPolarHBondContact O-CG1 3.39Å; E56-I84 PolarHBondContact O-N 2.83Å
85	P	93.4	Very high	94.6	Very high	85 Å²	85	51.6 Å²	51.6	55%	0.552	28%	0.283	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.6	-34.9	-173.4	29.1	-35.8	0	0	0	113	H83	H83-P85 WeakPolarHBondContact CE1-CG 3.5Å; H83-P85 WeakPolarHBondContact NE2-CG 3.46Å
86	T	93.4	Very high	94.6	Very high	48 Å²	48	59.4 Å²	59.4	29%	0.294	31%	0.305	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.7	-16.5	178.5	-37.6	0	0	0	0	112.7	H83 I88 L113 T116	H83-T86 PolarHBondContact CE1-OG1 3.22Å; H83-T86 WeakPolarHBondContact ND1-CB 3.4Å; H83-T86 PolarHBondContact ND1-OG1 2.9Å; T86-I88 HydrophobicContact CG2-CD1 3.5Å; T86-I88 HydrophobicContact CG2-CG1 3.67Å; T86-I88 PolarHBondContact O-N 3.49Å; T86-L113 HydrophobicContact CG2-CD2 4.26Å; T86-L113 WeakPolarHBondContact OG1-CD2 3.47Å; T86-T116 HydrophobicContact CG2-CG2 4.04Å
87	G	94.3	Very high	94.6	Very high	50 Å²	50	58.9 Å²	58.9	52%	0.515	30%	0.301	S	S	.	.			trans	69.2	9.8	-175.2	0	0	0	0	0	114.8	H83	H83-G87 VanDerWaalsContact O-CA 3.28Å; H83-G87 WeakPolarHBondContact O-CA 3.35Å; H83-G87 PolarHBondContact O-N 3.04Å
88	I	95.2	Very high	94.7	Very high	28 Å²	28	60.9 Å²	60.9	14%	0.144	31%	0.313	C	S	.	.			trans	-74.4	130.6	-178.2	-62.7	175.4	0	0	0	109.8	R82 H83 T86 V90 M109 K112 L113	R82-I88 WeakPolarHBondContact CA-O 3.4Å; H83-I88 PolarHBondContact N-O 3.38Å; T86-I88 HydrophobicContact CG2-CD1 3.5Å; T86-I88 HydrophobicContact CG2-CG1 3.67Å; T86-I88 PolarHBondContact O-N 3.49Å; I88-V90 HydrophobicContact CG2-CG2 4.39Å; I88-M109 HydrophobicContact CB-SD 4.24Å; I88-M109 HydrophobicContact CG2-SD 3.91Å; I88-K112 HydrophobicContact CG2-CB 4.37Å; I88-K112 HydrophobicContact CG2-CD 3.68Å; I88-L113 HydrophobicContact CD1-CD2 4.04Å
89	V	96.7	Very high	94.7	Very high	66 Å²	66	65 Å²	65	40%	0.4	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	133.6	175	-173.6	0	0	0	0	110.4	V80 L81 R82 K112	V80-V89 HydrophobicContact CG1-CG1 3.77Å; L81-V89 WeakPolarHBondContact O-CA 3.39Å; R82-V89 HydrophobicContact CB-CG2 4.25Å; R82-V89 HydrophobicContact CG-CG2 4.13Å; V89-K112 PolarHBondContact O-NZ 3.07Å
90	V	96.5	Very high	94.7	Very high	2 Å²	2	67.7 Å²	67.7	1%	0.012	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.7	175.5	176.4	0	0	0	0	108.5	V80 L81 I88 I108 M109 K112	V80-V90 WeakPolarHBondContact CA-O 3.32Å; L81-V90 PolarHBondContact N-O 2.93Å; L81-V90 PolarHBondContact O-N 3.47Å; I88-V90 HydrophobicContact CG2-CG2 4.39Å; V90-I108 HydrophobicContact CG1-CB 3.98Å; V90-I108 HydrophobicContact CG1-CG2 3.66Å; V90-I108 HydrophobicContact CG2-CG2 4.15Å; V90-M109 HydrophobicContact CB-CE 3.92Å; V90-M109 HydrophobicContact CG2-CB 4.37Å; V90-M109 HydrophobicContact CG2-CE 3.62Å; V90-M109 HydrophobicContact CG2-SD 3.76Å; V90-K112 HydrophobicContact CG2-CD 3.74Å
91	K	95.7	Very high	94.7	Very high	160 Å²	160	66.7 Å²	66.7	70%	0.696	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.8	129.4	171.6	-59.1	-171.1	177.3	176.8	0	108.7	V79 V80	V79-K91 CarbonylContact O-C 3.53Å; V79-K91 WeakPolarHBondContact O-CA 3.43Å; V80-K91 HydrophobicContact CG1-CG 4.24Å; V80-K91 HydrophobicContact CG2-CD 4.37Å; V80-K91 HydrophobicContact CG2-CG 4.06Å
92	C	95	Very high	94.6	Very high	3 Å²	3	70.4 Å²	70.4	2%	0.02	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.6	115.3	179.2	-175.7	0	0	0	0	111	V79 A105	V79-C92 PolarHBondContact N-O 2.87Å; V79-C92 PolarHBondContact O-N 2.94Å; C92-A105 HydrophobicContact CB-CB 3.91Å
93	H	93.4	Very high	94.6	Very high	76 Å²	76	70.9 Å²	70.9	35%	0.352	36%	0.361	S	S	.	.			trans	-134.1	85.2	171.6	-172.2	-121.7	0	0	0	108.8	N77 C78	N77-H93 PolarHBondContact OD1-CD2 3.39Å; N77-H93 PolarHBondContact OD1-NE2 2.77Å; C78-H93 HydrophobicContact CB-CB 4.12Å
94	Q	92.1	Very high	94.5	Very high	131 Å²	131	75.9 Å²	75.9	61%	0.612	38%	0.379	S	S	*	.			trans	-115	-34.3	-174.3	-71	-64.2	-15.5	0	0	112.9	N101 R104	Q94-N101 PolarHBondContact N-OD1 2.9Å; Q94-R104 VanDerWaalsContact CB-NH1 3.31Å
95	T	92.4	Very high	94.6	Very high	43 Å²	43	71 Å²	71	26%	0.264	35%	0.354	S	S	.	.	S	Bend	trans	-131.1	165.4	-179	68.8	0	0	0	0	110.1	S97 T100 N101	T95-S97 PolarHBondContact O-N 3.33Å; T95-S97 PolarHBondContact OG1-N 3.3Å; T95-S97 PolarHBondContact OG1-O 3.41Å; T95-T100 HydrophobicContact CG2-CG2 4.01Å; T95-T100 WeakPolarHBondContact OG1-CB 3.42Å; T95-N101 PolarHBondContact N-OD1 2.84Å; T95-N101 PolarHBondContact O-ND2 3.42Å; T95-N101 PolarHBondContact O-OD1 3.12Å; T95-N101 PolarHBondContact OG1-OD1 2.81Å
96	R	89.9	Confident	94.7	Very high	229 Å²	229	68.7 Å²	68.7	86%	0.864	34%	0.335	S	S	*	.	S	Bend	trans	-66.8	-22	173.3	67	-178.3	179.7	-134.2	0.5	113.4	N77	N77-R96 WeakPolarHBondContact ND2-CA 3.44Å; N77-R96 PolarHBondContact ND2-O 3.38Å
97	S	93.8	Very high	94.6	Very high	49 Å²	49	70.9 Å²	70.9	34%	0.343	34%	0.341	S	S	.	.			trans	-86	127.5	-177	178.6	0	0	0	0	111.5	T95 N101	T95-S97 PolarHBondContact O-N 3.33Å; T95-S97 PolarHBondContact OG1-N 3.3Å; T95-S97 PolarHBondContact OG1-O 3.41Å; S97-N101 VanDerWaalsContact O-CG 3.23Å; S97-N101 PolarHBondContact O-N 2.96Å; S97-N101 PolarHBondContact O-ND2 3.25Å
98	V	94.4	Very high	94.6	Very high	49 Å²	49	71.1 Å²	71.1	30%	0.297	33%	0.33	S	S	.	.	H	α-helix	trans	-64.1	-48.1	177.8	-173	0	0	0	0	110.6	F61 N77 V79 T100 N101 R102	F61-V98 HydrophobicContact CD1-CG1 3.61Å; F61-V98 HydrophobicContact CE1-CG1 3.26Å; F61-V98 HydrophobicContact CZ-CG1 4.1Å; N77-V98 HydrophobicContact CB-CG2 3.93Å; V79-V98 HydrophobicContact CG2-CG1 4.28Å; V98-T100 VanDerWaalsContact C-N 3.32Å; V98-T100 PolarHBondContact O-N 3.05Å; V98-N101 CarbonylContact O-C 3.48Å; V98-N101 WeakPolarHBondContact O-CA 3.42Å; V98-N101 WeakPolarHBondContact O-CB 3.43Å; V98-N101 PolarHBondContact O-N 3.41Å; V98-R102 HydrophobicContact CG1-CG 4.23Å; V98-R102 WeakPolarHBondContact O-CG 3.31Å; V98-R102 PolarHBondContact O-N 3.3Å
99	E	96	Very high	94.6	Very high	103 Å²	103	69.8 Å²	69.8	48%	0.481	32%	0.324	S	S	.	.	H	α-helix	trans	-60.5	-41.4	-176.3	-166	-166.9	159.3	0	0	112.4	N101 R102 K103	E99-N101 VanDerWaalsContact C-N 3.32Å; E99-N101 PolarHBondContact O-N 3.46Å; E99-R102 WeakPolarHBondContact O-CB 3.49Å; E99-R102 PolarHBondContact O-N 2.87Å; E99-K103 WeakPolarHBondContact O-CG 3.05Å; E99-K103 PolarHBondContact O-N 3.21Å; E99-K103 WeakPolarHBondContact OE1-CE 3.2Å; E99-K103 IonicContact OE1-NZ 3.44Å; E99-K103 PolarHBondContact OE1-NZ 2.77Å
100	T	96.1	Very high	94.4	Very high	56 Å²	56	71 Å²	71	34%	0.344	32%	0.321	S	S	.	.	H	α-helix	trans	-63.6	-41.1	175.1	-55	0	0	0	0	111.1	T95 V98 R104	T95-T100 HydrophobicContact CG2-CG2 4.01Å; T95-T100 WeakPolarHBondContact OG1-CB 3.42Å; V98-T100 VanDerWaalsContact C-N 3.32Å; V98-T100 PolarHBondContact O-N 3.05Å; T100-R104 WeakPolarHBondContact O-CG 3.31Å; T100-R104 PolarHBondContact O-N 3.49Å; T100-R104 VanDerWaalsContact O-N 3.08Å
101	N	95.8	Very high	94.1	Very high	0 Å²	0	74 Å²	74	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-66.7	-36.5	176.1	-66.9	-16.5	0	0	0	111.7	N77 V79 Q94 T95 S97 V98 E99 R104 A105	N77-N101 PolarHBondContact O-ND2 3.43Å; V79-N101 HydrophobicContact CG2-CB 3.78Å; Q94-N101 PolarHBondContact N-OD1 2.9Å; T95-N101 PolarHBondContact N-OD1 2.84Å; T95-N101 PolarHBondContact O-ND2 3.42Å; T95-N101 PolarHBondContact O-OD1 3.12Å; T95-N101 PolarHBondContact OG1-OD1 2.81Å; S97-N101 VanDerWaalsContact O-CG 3.23Å; S97-N101 PolarHBondContact O-N 2.96Å; S97-N101 PolarHBondContact O-ND2 3.25Å; V98-N101 CarbonylContact O-C 3.48Å; V98-N101 WeakPolarHBondContact O-CA 3.42Å; V98-N101 WeakPolarHBondContact O-CB 3.43Å; V98-N101 PolarHBondContact O-N 3.41Å; E99-N101 VanDerWaalsContact C-N 3.32Å; E99-N101 PolarHBondContact O-N 3.46Å; N101-R104 PolarHBondContact O-N 2.91Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.27Å; N101-A105 PolarHBondContact O-N 3.38Å
102	R	95.8	Very high	93.9	Very high	79 Å²	79	70.4 Å²	70.4	30%	0.298	32%	0.319	S	S	.	.	H	α-helix	trans	-61.6	-49.9	174.5	-69.4	-179.8	61.6	-135.6	2.7	112.1	E59 F61 V79 V98 E99 R104 A105 R106	E59-R102 WeakPolarHBondContact OE1-CD 3.48Å; E59-R102 WeakPolarHBondContact OE1-CG 3.5Å; E59-R102 IonicContact OE1-CZ 3.26Å; E59-R102 IonicContact OE1-NE 3.74Å; E59-R102 PolarHBondContact OE1-NE 3.26Å; E59-R102 IonicContact OE2-CZ 2.69Å; E59-R102 IonicContact OE2-NE 2.73Å; E59-R102 PolarHBondContact OE2-NE 3.08Å; E59-R102 VanDerWaalsContact OE2-NE 3.17Å; E59-R102 IonicContact OE2-NH2 3.86Å; E59-R102 PolarHBondContact OE2-NH2 3.05Å; F61-R102 HydrophobicContact CE1-CG 4.07Å; V79-R102 HydrophobicContact CG1-CG 4.34Å; V79-R102 HydrophobicContact CG2-CG 3.84Å; V98-R102 HydrophobicContact CG1-CG 4.23Å; V98-R102 WeakPolarHBondContact O-CG 3.31Å; V98-R102 PolarHBondContact O-N 3.3Å; E99-R102 WeakPolarHBondContact O-CB 3.49Å; E99-R102 PolarHBondContact O-N 2.87Å; R102-R104 VanDerWaalsContact C-N 3.31Å; R102-R104 PolarHBondContact O-N 3.39Å; R102-A105 PolarHBondContact O-N 3.49Å; R102-R106 PolarHBondContact O-N 3.06Å
103	K	95.4	Very high	93.8	Very high	125 Å²	125	70.5 Å²	70.5	54%	0.543	32%	0.32	S	S	.	.	H	α-helix	trans	-58.7	-44.4	177.7	-70.9	175.9	-175	169.6	0	111.1	E99 R106 Q107	E99-K103 WeakPolarHBondContact O-CG 3.05Å; E99-K103 PolarHBondContact O-N 3.21Å; E99-K103 WeakPolarHBondContact OE1-CE 3.2Å; E99-K103 IonicContact OE1-NZ 3.44Å; E99-K103 PolarHBondContact OE1-NZ 2.77Å; K103-R106 PolarHBondContact O-N 3.23Å; K103-Q107 PolarHBondContact O-N 3.01Å; K103-Q107 VanDerWaalsContact O-N 3.09Å
104	R	95.6	Very high	93.6	Very high	109 Å²	109	67 Å²	67	41%	0.411	30%	0.303	S	S	.	.	H	α-helix	trans	-65.6	-42	175.7	-75.1	-171.8	-180	-174.8	2.3	112.8	Q94 T100 N101 R102 R106 Q107 I108	Q94-R104 VanDerWaalsContact CB-NH1 3.31Å; T100-R104 WeakPolarHBondContact O-CG 3.31Å; T100-R104 PolarHBondContact O-N 3.49Å; T100-R104 VanDerWaalsContact O-N 3.08Å; N101-R104 PolarHBondContact O-N 2.91Å; R102-R104 VanDerWaalsContact C-N 3.31Å; R102-R104 PolarHBondContact O-N 3.39Å; R104-R106 VanDerWaalsContact C-N 3.34Å; R104-R106 PolarHBondContact O-N 3.17Å; R104-Q107 PolarHBondContact O-N 3.4Å; R104-I108 VanDerWaalsContact O-CG1 3.31Å; R104-I108 WeakPolarHBondContact O-CG1 2.99Å; R104-I108 PolarHBondContact O-N 3.14Å
105	A	96	Very high	93.5	Very high	0 Å²	0	62.9 Å²	62.9	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-59.8	-44.3	177.7	0	0	0	0	0	111.6	V79 L81 C92 N101 R102 I108 M109	V79-A105 HydrophobicContact CG1-CB 4.22Å; L81-A105 HydrophobicContact CB-CB 4.3Å; L81-A105 HydrophobicContact CD2-CB 4.23Å; C92-A105 HydrophobicContact CB-CB 3.91Å; N101-A105 VanDerWaalsContact O-CB 3.31Å; N101-A105 WeakPolarHBondContact O-CB 3.27Å; N101-A105 PolarHBondContact O-N 3.38Å; R102-A105 PolarHBondContact O-N 3.49Å; A105-I108 PolarHBondContact O-N 2.88Å; A105-M109 WeakPolarHBondContact O-CB 3.35Å; A105-M109 PolarHBondContact O-N 3.31Å
106	R	94.9	Very high	93.4	Very high	37 Å²	37	64.7 Å²	64.7	14%	0.14	30%	0.298	C	S	.	.	H	α-helix	trans	-62.3	-41.6	174.3	-71.6	-173.9	-179.2	76.1	15.4	112.6	L52 E54 E59 L81 R102 K103 R104 M109 R110	L52-R106 HydrophobicContact CD2-CB 4.42Å; L52-R106 HydrophobicContact CD2-CG 4.4Å; E54-R106 WeakPolarHBondContact OE1-CD 3.43Å; E54-R106 IonicContact OE1-CZ 3.37Å; E54-R106 IonicContact OE1-NE 3.17Å; E54-R106 PolarHBondContact OE1-NE 3.49Å; E54-R106 IonicContact OE1-NH2 3.72Å; E54-R106 IonicContact OE2-CZ 2.77Å; E54-R106 IonicContact OE2-NE 3.15Å; E54-R106 PolarHBondContact OE2-NE 2.89Å; E54-R106 VanDerWaalsContact OE2-NE 3.08Å; E54-R106 IonicContact OE2-NH2 3.65Å; E54-R106 PolarHBondContact OE2-NH2 2.87Å; E59-R106 IonicContact OE2-NH2 2.81Å; E59-R106 PolarHBondContact OE2-NH2 3.37Å; E59-R106 VanDerWaalsContact OE2-NH2 3.15Å; L81-R106 HydrophobicContact CD2-CG 4.11Å; R102-R106 PolarHBondContact O-N 3.06Å; K103-R106 PolarHBondContact O-N 3.23Å; R104-R106 VanDerWaalsContact C-N 3.34Å; R104-R106 PolarHBondContact O-N 3.17Å; R106-M109 PolarHBondContact O-N 2.92Å; R106-R110 WeakPolarHBondContact O-CG 3.34Å; R106-R110 PolarHBondContact O-N 2.9Å
107	Q	92.6	Very high	93.3	Very high	93 Å²	93	61.1 Å²	61.1	44%	0.435	29%	0.286	S	S	.	.	H	α-helix	trans	-60.1	-50.3	175.6	-177.3	-177.1	-19.5	0	0	111.1	K103 R104 M109 R110 E111	K103-Q107 PolarHBondContact O-N 3.01Å; K103-Q107 VanDerWaalsContact O-N 3.09Å; R104-Q107 PolarHBondContact O-N 3.4Å; Q107-M109 VanDerWaalsContact C-N 3.27Å; Q107-M109 PolarHBondContact O-N 3.19Å; Q107-R110 PolarHBondContact O-N 3.24Å; Q107-E111 WeakPolarHBondContact CG-OE1 3.28Å; Q107-E111 PolarHBondContact NE2-OE1 2.94Å; Q107-E111 WeakPolarHBondContact O-CG 3.4Å; Q107-E111 PolarHBondContact O-N 2.93Å
108	I	93.7	Very high	93.1	Very high	55 Å²	55	63 Å²	63	28%	0.282	29%	0.288	S	S	.	.	H	α-helix	trans	-62.1	-37.6	178.2	-64.7	164.2	0	0	0	110.9	V90 R104 A105 E111 K112	V90-I108 HydrophobicContact CG1-CB 3.98Å; V90-I108 HydrophobicContact CG1-CG2 3.66Å; V90-I108 HydrophobicContact CG2-CG2 4.15Å; R104-I108 VanDerWaalsContact O-CG1 3.31Å; R104-I108 WeakPolarHBondContact O-CG1 2.99Å; R104-I108 PolarHBondContact O-N 3.14Å; A105-I108 PolarHBondContact O-N 2.88Å; I108-E111 PolarHBondContact O-N 3.1Å; I108-K112 WeakPolarHBondContact O-CG 3.46Å; I108-K112 PolarHBondContact O-N 2.99Å
109	M	94.2	Very high	92.7	Very high	0 Å²	0	62.1 Å²	62.1	0%	0	29%	0.288	C	S	.	.	H	α-helix	trans	-61.6	-47.5	176.1	-170.2	65.9	79.1	0	0	111.3	L52 L57 L81 H83 I88 V90 A105 R106 Q107 E111 K112 L113	L52-M109 HydrophobicContact CD1-CG 4.45Å; L52-M109 HydrophobicContact CD2-CG 4.5Å; L57-M109 HydrophobicContact CD2-CG 4.5Å; L81-M109 HydrophobicContact CB-CE 4Å; L81-M109 HydrophobicContact CD2-CB 4.08Å; L81-M109 HydrophobicContact CD2-CE 3.98Å; L81-M109 HydrophobicContact CD2-CG 4.42Å; L81-M109 HydrophobicContact CG-CE 3.75Å; L81-M109 WeakPolarHBondContact O-CE 3.23Å; H83-M109 HydrophobicContact CB-CE 4.27Å; H83-M109 HydrophobicContact CB-SD 3.99Å; I88-M109 HydrophobicContact CB-SD 4.24Å; I88-M109 HydrophobicContact CG2-SD 3.91Å; V90-M109 HydrophobicContact CB-CE 3.92Å; V90-M109 HydrophobicContact CG2-CB 4.37Å; V90-M109 HydrophobicContact CG2-CE 3.62Å; V90-M109 HydrophobicContact CG2-SD 3.76Å; A105-M109 WeakPolarHBondContact O-CB 3.35Å; A105-M109 PolarHBondContact O-N 3.31Å; R106-M109 PolarHBondContact O-N 2.92Å; Q107-M109 VanDerWaalsContact C-N 3.27Å; Q107-M109 PolarHBondContact O-N 3.19Å; M109-E111 VanDerWaalsContact C-N 3.33Å; M109-E111 PolarHBondContact O-N 3.2Å; M109-K112 PolarHBondContact O-N 3.44Å; M109-L113 HydrophobicContact CG-CD1 4.14Å; M109-L113 WeakPolarHBondContact O-CG 3.41Å; M109-L113 PolarHBondContact O-N 3.17Å
110	R	92.3	Very high	92	Very high	91 Å²	91	64.5 Å²	64.5	34%	0.343	30%	0.299	S	S	.	.	H	α-helix	trans	-59.7	-43.4	176.2	-72.6	-172.1	-64.9	174.1	0.6	112.1	L49 P50 L52 R106 Q107 K112 L113 E114	L49-R110 HydrophobicContact CB-CB 4.26Å; L49-R110 HydrophobicContact CD1-CB 4.3Å; L49-R110 HydrophobicContact CD2-CB 4.17Å; P50-R110 WeakPolarHBondContact O-CD 3.44Å; L52-R110 HydrophobicContact CB-CG 4.15Å; L52-R110 HydrophobicContact CD2-CG 4.3Å; R106-R110 WeakPolarHBondContact O-CG 3.34Å; R106-R110 PolarHBondContact O-N 2.9Å; Q107-R110 PolarHBondContact O-N 3.24Å; R110-K112 VanDerWaalsContact C-N 3.34Å; R110-K112 PolarHBondContact O-N 3.43Å; R110-L113 PolarHBondContact O-N 3.34Å; R110-E114 PolarHBondContact O-N 2.98Å
111	E	91.1	Very high	91.3	Very high	65 Å²	65	68.8 Å²	68.8	30%	0.304	32%	0.316	S	S	.	.	H	α-helix	trans	-60.7	-43.7	176.7	-70.9	172.2	-162.4	0	0	111.7	L49 Q107 I108 M109 V115 I124	L49-E111 HydrophobicContact CD2-CG 4.4Å; Q107-E111 WeakPolarHBondContact CG-OE1 3.28Å; Q107-E111 PolarHBondContact NE2-OE1 2.94Å; Q107-E111 WeakPolarHBondContact O-CG 3.4Å; Q107-E111 PolarHBondContact O-N 2.93Å; I108-E111 PolarHBondContact O-N 3.1Å; M109-E111 VanDerWaalsContact C-N 3.33Å; M109-E111 PolarHBondContact O-N 3.2Å; E111-V115 WeakPolarHBondContact O-CG2 3.43Å; E111-V115 PolarHBondContact O-N 2.98Å; E111-I124 VanDerWaalsContact CA-CD1 3.49Å; E111-I124 HydrophobicContact CB-CD1 3.71Å; E111-I124 HydrophobicContact CG-CD1 3.81Å
112	K	91.9	Very high	90.9	Very high	86 Å²	86	68.8 Å²	68.8	37%	0.374	32%	0.316	S	S	.	.	H	α-helix	trans	-64.5	-44.6	176	-74.8	-170.5	-178.4	-171.7	0	112.1	I88 V89 V90 I108 M109 R110 E114 V115 T116	I88-K112 HydrophobicContact CG2-CB 4.37Å; I88-K112 HydrophobicContact CG2-CD 3.68Å; V89-K112 PolarHBondContact O-NZ 3.07Å; V90-K112 HydrophobicContact CG2-CD 3.74Å; I108-K112 WeakPolarHBondContact O-CG 3.46Å; I108-K112 PolarHBondContact O-N 2.99Å; M109-K112 PolarHBondContact O-N 3.44Å; R110-K112 VanDerWaalsContact C-N 3.34Å; R110-K112 PolarHBondContact O-N 3.43Å; K112-E114 VanDerWaalsContact C-N 3.34Å; K112-E114 PolarHBondContact O-N 3.02Å; K112-V115 PolarHBondContact O-N 3.02Å; K112-T116 PolarHBondContact O-N 2.85Å; K112-T116 PolarHBondContact O-OG1 3.08Å; K112-T116 VanDerWaalsContact O-OG1 3.06Å
113	L	91.6	Very high	90.4	Very high	5 Å²	5	68.2 Å²	68.2	3%	0.026	32%	0.318	C	S	.	.	H	α-helix	trans	-61.9	-43.2	178.9	-73.7	172	0	0	0	111.3	P50 L52 T86 I88 M109 R110 V115 T116 Y117	P50-L113 HydrophobicContact CG-CB 4.42Å; L52-L113 HydrophobicContact CD1-CD1 3.52Å; T86-L113 HydrophobicContact CG2-CD2 4.26Å; T86-L113 WeakPolarHBondContact OG1-CD2 3.47Å; I88-L113 HydrophobicContact CD1-CD2 4.04Å; M109-L113 HydrophobicContact CG-CD1 4.14Å; M109-L113 WeakPolarHBondContact O-CG 3.41Å; M109-L113 PolarHBondContact O-N 3.17Å; R110-L113 PolarHBondContact O-N 3.34Å; L113-V115 VanDerWaalsContact C-N 3.3Å; L113-V115 PolarHBondContact O-N 3.32Å; L113-T116 PolarHBondContact O-N 3.39Å; L113-T116 VanDerWaalsContact O-N 3.1Å; L113-Y117 HydrophobicContact CB-CD2 4.21Å; L113-Y117 HydrophobicContact CB-CE2 4.07Å; L113-Y117 HydrophobicContact CD2-CE2 4.08Å; L113-Y117 WeakPolarHBondContact O-CD2 3.28Å; L113-Y117 PolarHBondContact O-N 2.92Å
114	E	90.4	Very high	90	Very high	2 Å²	2	63.6 Å²	63.6	1%	0.009	30%	0.299	C	S	.	.	H	α-helix	trans	-58.5	-44.6	175.6	-172.9	-176.3	178.1	0	0	111.5	L49 R110 K112 T116 Y117 K118 I124	L49-E114 HydrophobicContact CD2-CB 4.35Å; L49-E114 WeakPolarHBondContact CD2-OE2 3.2Å; R110-E114 PolarHBondContact O-N 2.98Å; K112-E114 VanDerWaalsContact C-N 3.34Å; K112-E114 PolarHBondContact O-N 3.02Å; E114-T116 VanDerWaalsContact C-N 3.31Å; E114-T116 PolarHBondContact O-N 3.46Å; E114-Y117 PolarHBondContact O-N 3.05Å; E114-K118 HydrophobicContact CG-CD 3.78Å; E114-K118 HydrophobicContact CG-CG 4.3Å; E114-K118 WeakPolarHBondContact O-CB 3.3Å; E114-K118 PolarHBondContact O-N 3.29Å; E114-K118 IonicContact OE1-NZ 3.92Å; E114-K118 PolarHBondContact OE1-NZ 3.44Å; E114-I124 HydrophobicContact CB-CD1 4.06Å; E114-I124 HydrophobicContact CG-CD1 4.4Å; E114-I124 WeakPolarHBondContact OE2-CD1 3.21Å; E114-I124 VanDerWaalsContact OE2-CG1 3.31Å; E114-I124 WeakPolarHBondContact OE2-CG1 3.32Å
115	V	90.1	Very high	89.6	Confident	45 Å²	45	60.6 Å²	60.6	27%	0.273	29%	0.291	S	S	.	.	H	α-helix	trans	-64.4	-36.8	176.1	174.7	0	0	0	0	111.6	E111 K112 L113 G119 L125	E111-V115 WeakPolarHBondContact O-CG2 3.43Å; E111-V115 PolarHBondContact O-N 2.98Å; K112-V115 PolarHBondContact O-N 3.02Å; L113-V115 VanDerWaalsContact C-N 3.3Å; L113-V115 PolarHBondContact O-N 3.32Å; V115-G119 WeakPolarHBondContact O-CA 3.3Å; V115-G119 PolarHBondContact O-N 2.99Å; V115-L125 HydrophobicContact CG1-CD1 4.04Å; V115-L125 HydrophobicContact CG1-CG 4.44Å; V115-L125 HydrophobicContact CG2-CG 4.13Å
116	T	89.4	Confident	89.3	Confident	81 Å²	81	65.5 Å²	65.5	50%	0.497	31%	0.313	S	S	.	.	H	α-helix	trans	-68.6	-40.1	177.1	-60.5	0	0	0	0	112.2	T86 K112 L113 E114	T86-T116 HydrophobicContact CG2-CG2 4.04Å; K112-T116 PolarHBondContact O-N 2.85Å; K112-T116 PolarHBondContact O-OG1 3.08Å; K112-T116 VanDerWaalsContact O-OG1 3.06Å; L113-T116 PolarHBondContact O-N 3.39Å; L113-T116 VanDerWaalsContact O-N 3.1Å; E114-T116 VanDerWaalsContact C-N 3.31Å; E114-T116 PolarHBondContact O-N 3.46Å
117	Y	89	Confident	89	Confident	153 Å²	153	67.3 Å²	67.3	60%	0.6	33%	0.325	S	S	*	.	H	α-helix	trans	-79.4	-44.9	-179.1	-70.8	-60.5	0	0	0	113.5	L113 E114	L113-Y117 HydrophobicContact CB-CD2 4.21Å; L113-Y117 HydrophobicContact CB-CE2 4.07Å; L113-Y117 HydrophobicContact CD2-CE2 4.08Å; L113-Y117 WeakPolarHBondContact O-CD2 3.28Å; L113-Y117 PolarHBondContact O-N 2.92Å; E114-Y117 PolarHBondContact O-N 3.05Å
118	K	88.1	Confident	88.8	Confident	90 Å²	90	69.2 Å²	69.2	39%	0.391	33%	0.332	S	S	.	.	H	α-helix	trans	-92.8	-14.4	-177.4	-61.2	-177.2	-173.9	169.5	0	113.3	E114 E120 E121	E114-K118 HydrophobicContact CG-CD 3.78Å; E114-K118 HydrophobicContact CG-CG 4.3Å; E114-K118 WeakPolarHBondContact O-CB 3.3Å; E114-K118 PolarHBondContact O-N 3.29Å; E114-K118 IonicContact OE1-NZ 3.92Å; E114-K118 PolarHBondContact OE1-NZ 3.44Å; K118-E120 PolarHBondContact O-N 2.89Å; K118-E121 PolarHBondContact O-N 2.89Å
119	G	87.4	Confident	88.7	Confident	29 Å²	29	71.8 Å²	71.8	30%	0.299	34%	0.341	S	S	.	.	G	3₁₀ helix	trans	60.1	-131.4	-178.1	0	0	0	0	0	112.9	V115 E121 S122 L125	V115-G119 WeakPolarHBondContact O-CA 3.3Å; V115-G119 PolarHBondContact O-N 2.99Å; G119-E121 PolarHBondContact O-N 3.22Å; G119-S122 WeakPolarHBondContact O-CB 3.37Å; G119-S122 PolarHBondContact O-N 3.43Å; G119-S122 PolarHBondContact O-OG 3.21Å; G119-L125 WeakPolarHBondContact O-CD1 3.35Å
120	E	81.1	Confident	88.7	Confident	154 Å²	154	75.7 Å²	75.7	72%	0.72	36%	0.359	S	S	*	.	G	3₁₀ helix	trans	-68.1	-20.2	-177.8	-57.1	-161.6	146.7	0	0	114.1	K118 S122	K118-E120 PolarHBondContact O-N 2.89Å; E120-S122 VanDerWaalsContact C-N 3.26Å; E120-S122 PolarHBondContact O-N 3.46Å
121	E	81.3	Confident	88.7	Confident	146 Å²	146	73.9 Å²	73.9	68%	0.682	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	-81.3	-8.5	-179.9	-60.9	-170	161.9	0	0	113.1	K118 G119 D123 K126	K118-E121 PolarHBondContact O-N 2.89Å; G119-E121 PolarHBondContact O-N 3.22Å; E121-D123 PolarHBondContact O-N 2.93Å; E121-K126 WeakPolarHBondContact O-CE 3.47Å; E121-K126 PolarHBondContact O-NZ 3.06Å
122	S	86.9	Confident	88.8	Confident	0 Å²	0	74.5 Å²	74.5	0%	0	37%	0.365	C	S	.	.			trans	-55.5	132.2	178.2	56.1	0	0	0	0	111.8	G119 E120 I124 L125 K126	G119-S122 WeakPolarHBondContact O-CB 3.37Å; G119-S122 PolarHBondContact O-N 3.43Å; G119-S122 PolarHBondContact O-OG 3.21Å; E120-S122 VanDerWaalsContact C-N 3.26Å; E120-S122 PolarHBondContact O-N 3.46Å; S122-I124 PolarHBondContact O-N 2.95Å; S122-L125 PolarHBondContact O-N 3.39Å; S122-L125 WeakPolarHBondContact OG-CB 3.34Å; S122-L125 WeakPolarHBondContact OG-CD1 3.33Å; S122-L125 WeakPolarHBondContact OG-CG 3.36Å; S122-K126 PolarHBondContact O-N 3.01Å; S122-K126 VanDerWaalsContact O-N 3.14Å
123	D	86.2	Confident	88.9	Confident	67 Å²	67	75.7 Å²	75.7	36%	0.358	37%	0.372	S	S	.	.	H	α-helix	trans	-63.7	-29.7	-178.5	-61.6	-44.3	0	0	0	110.9	I47 E121 L125 K126 N127	I47-D123 HydrophobicContact CG2-CB 4.34Å; E121-D123 PolarHBondContact O-N 2.93Å; D123-L125 PolarHBondContact O-N 3.2Å; D123-K126 PolarHBondContact O-N 2.85Å; D123-K126 IonicContact OD1-NZ 3.99Å; D123-N127 VanDerWaalsContact O-CB 3.27Å; D123-N127 WeakPolarHBondContact O-CB 3.47Å; D123-N127 PolarHBondContact O-N 3.2Å; D123-N127 PolarHBondContact O-ND2 2.91Å
124	I	86.1	Confident	89.2	Confident	28 Å²	28	82.2 Å²	82.2	14%	0.144	40%	0.396	C	S	.	.	H	α-helix	trans	-57.6	-49.3	171.9	-58.7	170.7	0	0	0	111.4	I47 L49 E111 E114 S122 K128	I47-I124 HydrophobicContact CD1-CG1 4.15Å; I47-I124 HydrophobicContact CG2-CG1 4.48Å; L49-I124 HydrophobicContact CD2-CD1 4.02Å; E111-I124 VanDerWaalsContact CA-CD1 3.49Å; E111-I124 HydrophobicContact CB-CD1 3.71Å; E111-I124 HydrophobicContact CG-CD1 3.81Å; E114-I124 HydrophobicContact CB-CD1 4.06Å; E114-I124 HydrophobicContact CG-CD1 4.4Å; E114-I124 WeakPolarHBondContact OE2-CD1 3.21Å; E114-I124 VanDerWaalsContact OE2-CG1 3.31Å; E114-I124 WeakPolarHBondContact OE2-CG1 3.32Å; S122-I124 PolarHBondContact O-N 2.95Å; I124-K128 VanDerWaalsContact O-CB 3.23Å; I124-K128 WeakPolarHBondContact O-CB 3.36Å; I124-K128 PolarHBondContact O-N 3.32Å
125	L	86.6	Confident	89.4	Confident	46 Å²	46	88.6 Å²	88.6	24%	0.241	42%	0.424	C	S	.	.	H	α-helix	trans	-68.3	-40.1	-178.8	-73.8	-177.9	0	0	0	111.2	V115 G119 S122 D123 K128 K129	V115-L125 HydrophobicContact CG1-CD1 4.04Å; V115-L125 HydrophobicContact CG1-CG 4.44Å; V115-L125 HydrophobicContact CG2-CG 4.13Å; G119-L125 WeakPolarHBondContact O-CD1 3.35Å; S122-L125 PolarHBondContact O-N 3.39Å; S122-L125 WeakPolarHBondContact OG-CB 3.34Å; S122-L125 WeakPolarHBondContact OG-CD1 3.33Å; S122-L125 WeakPolarHBondContact OG-CG 3.36Å; D123-L125 PolarHBondContact O-N 3.2Å; L125-K128 PolarHBondContact O-N 2.98Å; L125-K129 WeakPolarHBondContact O-CB 3.36Å; L125-K129 VanDerWaalsContact O-CG 3.25Å; L125-K129 WeakPolarHBondContact O-CG 3.42Å; L125-K129 PolarHBondContact O-N 3.33Å
126	K	89.5	Confident	89.7	Confident	103 Å²	103	91 Å²	91	45%	0.448	43%	0.432	S	S	.	.	H	α-helix	trans	-59.4	-51.6	175.4	-67.7	172.4	-178.7	157.6	0	111.1	E121 S122 D123 K128 K129 E130	E121-K126 WeakPolarHBondContact O-CE 3.47Å; E121-K126 PolarHBondContact O-NZ 3.06Å; S122-K126 PolarHBondContact O-N 3.01Å; S122-K126 VanDerWaalsContact O-N 3.14Å; D123-K126 PolarHBondContact O-N 2.85Å; D123-K126 IonicContact OD1-NZ 3.99Å; K126-K128 VanDerWaalsContact C-N 3.31Å; K126-K128 PolarHBondContact O-N 2.98Å; K126-K129 PolarHBondContact O-N 3.44Å; K126-E130 WeakPolarHBondContact O-CB 3.03Å; K126-E130 PolarHBondContact O-N 3.49Å
127	N	89.4	Confident	90	Very high	75 Å²	75	91.2 Å²	91.2	40%	0.401	43%	0.43	S	S	.	.	H	α-helix	trans	-61.6	-38.7	178.5	-68.9	-14.7	0	0	0	112	D123 S131	D123-N127 VanDerWaalsContact O-CB 3.27Å; D123-N127 WeakPolarHBondContact O-CB 3.47Å; D123-N127 PolarHBondContact O-N 3.2Å; D123-N127 PolarHBondContact O-ND2 2.91Å; N127-S131 WeakPolarHBondContact O-CB 3.41Å; N127-S131 PolarHBondContact O-N 2.93Å
128	K	89.5	Confident	90.4	Very high	132 Å²	132	91.4 Å²	91.4	57%	0.574	43%	0.434	S	S	*	.	H	α-helix	trans	-67.2	-45.9	176.5	-171.8	174.2	-178.6	178.8	0	111.7	I124 L125 K126 E130 S131 I132	I124-K128 VanDerWaalsContact O-CB 3.23Å; I124-K128 WeakPolarHBondContact O-CB 3.36Å; I124-K128 PolarHBondContact O-N 3.32Å; L125-K128 PolarHBondContact O-N 2.98Å; K126-K128 VanDerWaalsContact C-N 3.31Å; K126-K128 PolarHBondContact O-N 2.98Å; K128-E130 VanDerWaalsContact C-N 3.35Å; K128-S131 PolarHBondContact O-N 3.22Å; K128-I132 HydrophobicContact CG-CD1 3.99Å; K128-I132 WeakPolarHBondContact O-CD1 3.44Å; K128-I132 WeakPolarHBondContact O-CG1 3.23Å; K128-I132 PolarHBondContact O-N 3.09Å
129	K	90.9	Very high	90.8	Very high	110 Å²	110	96.4 Å²	96.4	48%	0.478	45%	0.451	S	S	.	.	H	α-helix	trans	-59.2	-46.9	175.5	-74.5	176.3	-172.6	-178.5	0	110.4	L125 K126 S131 I132 Q133	L125-K129 WeakPolarHBondContact O-CB 3.36Å; L125-K129 VanDerWaalsContact O-CG 3.25Å; L125-K129 WeakPolarHBondContact O-CG 3.42Å; L125-K129 PolarHBondContact O-N 3.33Å; K126-K129 PolarHBondContact O-N 3.44Å; K129-S131 PolarHBondContact O-N 3.02Å; K129-I132 PolarHBondContact O-N 3.49Å; K129-Q133 WeakPolarHBondContact O-CG 3.44Å; K129-Q133 PolarHBondContact O-N 3.45Å
130	E	93.1	Very high	91.2	Very high	81 Å²	81	100.6 Å²	100.6	38%	0.379	46%	0.461	S	S	.	.	H	α-helix	trans	-62.1	-45.3	178.7	-168.1	-170.4	-160	0	0	112.1	K126 K128 I132 Q133 R134	K126-E130 WeakPolarHBondContact O-CB 3.03Å; K126-E130 PolarHBondContact O-N 3.49Å; K128-E130 VanDerWaalsContact C-N 3.35Å; E130-I132 VanDerWaalsContact C-N 3.29Å; E130-I132 PolarHBondContact O-N 2.85Å; E130-Q133 PolarHBondContact O-N 2.87Å; E130-R134 HydrophobicContact CG-CG 4.43Å; E130-R134 WeakPolarHBondContact O-CB 3.41Å; E130-R134 VanDerWaalsContact O-CG 3.28Å; E130-R134 WeakPolarHBondContact O-CG 3.32Å; E130-R134 PolarHBondContact O-N 3.43Å; E130-R134 IonicContact OE1-CZ 2.89Å; E130-R134 IonicContact OE1-NE 3.89Å; E130-R134 PolarHBondContact OE1-NE 2.86Å; E130-R134 IonicContact OE1-NH2 3.75Å; E130-R134 PolarHBondContact OE1-NH2 3.37Å; E130-R134 IonicContact OE2-CZ 3.38Å; E130-R134 IonicContact OE2-NE 2.85Å; E130-R134 IonicContact OE2-NH1 3.43Å; E130-R134 IonicContact OE2-NH2 2.66Å; E130-R134 PolarHBondContact OE2-NH2 3.36Å
131	S	92.1	Very high	91.9	Very high	54 Å²	54	96.8 Å²	96.8	38%	0.378	45%	0.451	S	S	.	.	H	α-helix	trans	-60.9	-38.7	176.5	-171.9	0	0	0	0	112.3	N127 K128 K129 K135	N127-S131 WeakPolarHBondContact O-CB 3.41Å; N127-S131 PolarHBondContact O-N 2.93Å; K128-S131 PolarHBondContact O-N 3.22Å; K129-S131 PolarHBondContact O-N 3.02Å; S131-K135 VanDerWaalsContact O-CG 3.32Å; S131-K135 WeakPolarHBondContact O-CG 3.5Å; S131-K135 PolarHBondContact O-N 3Å; S131-K135 VanDerWaalsContact O-N 3.14Å
132	I	93.9	Very high	92.6	Very high	78 Å²	78	92.3 Å²	92.3	40%	0.4	44%	0.439	S	S	.	.	H	α-helix	trans	-67.1	-47.4	176.1	-68.2	164.4	0	0	0	110.5	K128 K129 E130 K135 Q136	K128-I132 HydrophobicContact CG-CD1 3.99Å; K128-I132 WeakPolarHBondContact O-CD1 3.44Å; K128-I132 WeakPolarHBondContact O-CG1 3.23Å; K128-I132 PolarHBondContact O-N 3.09Å; K129-I132 PolarHBondContact O-N 3.49Å; E130-I132 VanDerWaalsContact C-N 3.29Å; E130-I132 PolarHBondContact O-N 2.85Å; I132-K135 PolarHBondContact O-N 2.79Å; I132-Q136 HydrophobicContact CG2-CG 4.45Å; I132-Q136 WeakPolarHBondContact O-CG 3.19Å; I132-Q136 PolarHBondContact O-N 3.05Å
133	Q	95.2	Very high	93.1	Very high	111 Å²	111	95.9 Å²	95.9	52%	0.519	46%	0.458	S	S	.	.	H	α-helix	trans	-59.4	-50.3	177.8	-73.9	177.7	3.2	0	0	111.3	K129 E130 K135 Q136 D137	K129-Q133 WeakPolarHBondContact O-CG 3.44Å; K129-Q133 PolarHBondContact O-N 3.45Å; E130-Q133 PolarHBondContact O-N 2.87Å; Q133-K135 PolarHBondContact O-N 2.81Å; Q133-K135 VanDerWaalsContact O-N 3.16Å; Q133-Q136 CarbonylContact O-C 3.57Å; Q133-Q136 WeakPolarHBondContact O-CA 3.17Å; Q133-Q136 WeakPolarHBondContact O-CB 3.46Å; Q133-Q136 PolarHBondContact O-N 2.83Å; Q133-D137 VanDerWaalsContact O-CG 3.31Å; Q133-D137 PolarHBondContact O-N 2.66Å
134	R	96	Very high	93.6	Very high	142 Å²	142	96.9 Å²	96.9	54%	0.536	46%	0.461	S	S	.	.	H	α-helix	trans	-54.6	-38.5	175.8	-72.7	172.2	176.5	176.8	-0.1	112.5	E130 K138	E130-R134 HydrophobicContact CG-CG 4.43Å; E130-R134 WeakPolarHBondContact O-CB 3.41Å; E130-R134 VanDerWaalsContact O-CG 3.28Å; E130-R134 WeakPolarHBondContact O-CG 3.32Å; E130-R134 PolarHBondContact O-N 3.43Å; E130-R134 IonicContact OE1-CZ 2.89Å; E130-R134 IonicContact OE1-NE 3.89Å; E130-R134 PolarHBondContact OE1-NE 2.86Å; E130-R134 IonicContact OE1-NH2 3.75Å; E130-R134 PolarHBondContact OE1-NH2 3.37Å; E130-R134 IonicContact OE2-CZ 3.38Å; E130-R134 IonicContact OE2-NE 2.85Å; E130-R134 IonicContact OE2-NH1 3.43Å; E130-R134 IonicContact OE2-NH2 2.66Å; E130-R134 PolarHBondContact OE2-NH2 3.36Å; R134-K138 WeakPolarHBondContact O-CB 3.44Å; R134-K138 WeakPolarHBondContact O-CG 3.47Å; R134-K138 PolarHBondContact O-N 2.77Å
135	K	95.3	Very high	94.2	Very high	136 Å²	136	99.3 Å²	99.3	59%	0.591	47%	0.474	S	S	*	.	H	α-helix	trans	-70.3	-39.2	175.5	-75.7	175.4	-176.9	177.2	0	111.9	S131 I132 Q133 R139	S131-K135 VanDerWaalsContact O-CG 3.32Å; S131-K135 WeakPolarHBondContact O-CG 3.5Å; S131-K135 PolarHBondContact O-N 3Å; S131-K135 VanDerWaalsContact O-N 3.14Å; I132-K135 PolarHBondContact O-N 2.79Å; Q133-K135 PolarHBondContact O-N 2.81Å; Q133-K135 VanDerWaalsContact O-N 3.16Å; K135-R139 VanDerWaalsContact O-CG 3.3Å; K135-R139 WeakPolarHBondContact O-CG 3.36Å; K135-R139 PolarHBondContact O-N 3.37Å; K135-R139 VanDerWaalsContact O-N 3.1Å
136	Q	96.7	Very high	94.7	Very high	95 Å²	95	101.4 Å²	101.4	44%	0.444	49%	0.485	S	S	.	.	H	α-helix	trans	-65.7	-45.7	176.7	-72.2	179.6	2.6	0	0	111.5	I132 Q133 K138 R139 K140	I132-Q136 HydrophobicContact CG2-CG 4.45Å; I132-Q136 WeakPolarHBondContact O-CG 3.19Å; I132-Q136 PolarHBondContact O-N 3.05Å; Q133-Q136 CarbonylContact O-C 3.57Å; Q133-Q136 WeakPolarHBondContact O-CA 3.17Å; Q133-Q136 WeakPolarHBondContact O-CB 3.46Å; Q133-Q136 PolarHBondContact O-N 2.83Å; Q136-K138 VanDerWaalsContact C-N 3.35Å; Q136-K138 PolarHBondContact O-N 3.15Å; Q136-R139 WeakPolarHBondContact O-CA 3.39Å; Q136-R139 WeakPolarHBondContact O-CB 3.31Å; Q136-R139 PolarHBondContact O-N 2.98Å; Q136-R139 VanDerWaalsContact O-N 3.08Å; Q136-K140 WeakPolarHBondContact O-CG 3.31Å; Q136-K140 PolarHBondContact O-N 3.17Å
137	D	96.4	Very high	95	Very high	85 Å²	85	100.8 Å²	100.8	46%	0.455	48%	0.484	S	S	.	.	H	α-helix	trans	-65.2	-39.9	-179.2	-60.7	-27.7	0	0	0	111.6	Q133 R139 K140 S141	Q133-D137 VanDerWaalsContact O-CG 3.31Å; Q133-D137 PolarHBondContact O-N 2.66Å; D137-R139 VanDerWaalsContact C-N 3.32Å; D137-R139 PolarHBondContact O-N 3.46Å; D137-K140 PolarHBondContact O-N 2.85Å; D137-S141 WeakPolarHBondContact O-CB 3.49Å; D137-S141 PolarHBondContact O-N 3.08Å
138	K	96.7	Very high	95.4	Very high	157 Å²	157	104.6 Å²	104.6	68%	0.683	49%	0.492	S	S	*	.	H	α-helix	trans	-59.7	-41.7	171.1	-75.5	177	-177.3	-172	0	112.2	R134 Q136 A142	R134-K138 WeakPolarHBondContact O-CB 3.44Å; R134-K138 WeakPolarHBondContact O-CG 3.47Å; R134-K138 PolarHBondContact O-N 2.77Å; Q136-K138 VanDerWaalsContact C-N 3.35Å; Q136-K138 PolarHBondContact O-N 3.15Å; K138-A142 VanDerWaalsContact O-CB 3.3Å; K138-A142 WeakPolarHBondContact O-CB 3.46Å; K138-A142 PolarHBondContact O-N 3.08Å
139	R	95.8	Very high	95.7	Very high	195 Å²	195	104.4 Å²	104.4	74%	0.736	49%	0.492	S	S	*	.	H	α-helix	trans	-65.9	-43.3	176.7	-76.5	174.6	172.4	-169.8	-3.2	111.8	K135 Q136 D137 A142 N143	K135-R139 VanDerWaalsContact O-CG 3.3Å; K135-R139 WeakPolarHBondContact O-CG 3.36Å; K135-R139 PolarHBondContact O-N 3.37Å; K135-R139 VanDerWaalsContact O-N 3.1Å; Q136-R139 WeakPolarHBondContact O-CA 3.39Å; Q136-R139 WeakPolarHBondContact O-CB 3.31Å; Q136-R139 PolarHBondContact O-N 2.98Å; Q136-R139 VanDerWaalsContact O-N 3.08Å; D137-R139 VanDerWaalsContact C-N 3.32Å; D137-R139 PolarHBondContact O-N 3.46Å; R139-A142 PolarHBondContact O-N 3.43Å; R139-N143 PolarHBondContact O-N 3Å
140	K	96.6	Very high	96	Very high	118 Å²	118	107 Å²	107	51%	0.513	50%	0.498	S	S	.	.	H	α-helix	trans	-60.8	-52.1	176.8	-70.1	174.1	-175.4	173.9	0	111.1	Q136 D137 A142 N143 E144	Q136-K140 WeakPolarHBondContact O-CG 3.31Å; Q136-K140 PolarHBondContact O-N 3.17Å; D137-K140 PolarHBondContact O-N 2.85Å; K140-A142 VanDerWaalsContact C-N 3.32Å; K140-A142 PolarHBondContact O-N 3.23Å; K140-N143 WeakPolarHBondContact O-CB 3.45Å; K140-N143 PolarHBondContact O-N 3.42Å; K140-E144 WeakPolarHBondContact O-CG 3.45Å; K140-E144 PolarHBondContact O-N 2.81Å
141	S	95.6	Very high	96.1	Very high	73 Å²	73	108.5 Å²	108.5	51%	0.51	51%	0.509	S	S	.	.	H	α-helix	trans	-59.9	-40.2	178.5	179.9	0	0	0	0	112.7	D137 N145	D137-S141 WeakPolarHBondContact O-CB 3.49Å; D137-S141 PolarHBondContact O-N 3.08Å; S141-N145 WeakPolarHBondContact O-CB 3.19Å; S141-N145 PolarHBondContact O-N 2.99Å
142	A	96.4	Very high	96.3	Very high	53 Å²	53	112.6 Å²	112.6	44%	0.438	52%	0.52	S	S	.	.	H	α-helix	trans	-63.2	-41.4	174.4	0	0	0	0	0	112	K138 R139 K140 N145 L146	K138-A142 VanDerWaalsContact O-CB 3.3Å; K138-A142 WeakPolarHBondContact O-CB 3.46Å; K138-A142 PolarHBondContact O-N 3.08Å; R139-A142 PolarHBondContact O-N 3.43Å; K140-A142 VanDerWaalsContact C-N 3.32Å; K140-A142 PolarHBondContact O-N 3.23Å; A142-N145 PolarHBondContact O-N 2.86Å; A142-L146 WeakPolarHBondContact O-CG 2.99Å; A142-L146 PolarHBondContact O-N 2.69Å; A142-L146 VanDerWaalsContact O-N 3.08Å
143	N	97.1	Very high	96.3	Very high	75 Å²	75	115.4 Å²	115.4	40%	0.401	53%	0.529	S	S	.	.	H	α-helix	trans	-65.1	-47	177.4	-170.1	55.5	0	0	0	111.9	R139 K140 N145 L146 E147	R139-N143 PolarHBondContact O-N 3Å; K140-N143 WeakPolarHBondContact O-CB 3.45Å; K140-N143 PolarHBondContact O-N 3.42Å; N143-N145 VanDerWaalsContact C-N 3.27Å; N143-N145 PolarHBondContact O-N 2.82Å; N143-L146 WeakPolarHBondContact O-CB 3.06Å; N143-L146 PolarHBondContact O-N 2.73Å; N143-L146 VanDerWaalsContact O-N 3.07Å; N143-E147 PolarHBondContact ND2-OE1 2.86Å; N143-E147 PolarHBondContact O-N 3.25Å
144	E	97.3	Very high	96.3	Very high	88 Å²	88	115.9 Å²	115.9	41%	0.411	53%	0.531	S	S	.	.	H	α-helix	trans	-57.7	-40.3	175.6	-70.7	172.3	-157.1	0	0	111.9	K140 L146 E147 R148	K140-E144 WeakPolarHBondContact O-CG 3.45Å; K140-E144 PolarHBondContact O-N 2.81Å; E144-L146 VanDerWaalsContact C-N 3.35Å; E144-L146 PolarHBondContact O-N 2.81Å; E144-E147 PolarHBondContact O-N 2.86Å; E144-R148 WeakPolarHBondContact O-CG 3.34Å; E144-R148 PolarHBondContact O-N 3.04Å; E144-R148 IonicContact OE2-NH2 3.3Å; E144-R148 PolarHBondContact OE2-NH2 2.96Å
145	N	97.4	Very high	96.1	Very high	78 Å²	78	111.3 Å²	111.3	42%	0.417	52%	0.524	S	S	.	.	H	α-helix	trans	-65.9	-37.3	177	-169.9	23.1	0	0	0	112.1	S141 A142 N143 K149	S141-N145 WeakPolarHBondContact O-CB 3.19Å; S141-N145 PolarHBondContact O-N 2.99Å; A142-N145 PolarHBondContact O-N 2.86Å; N143-N145 VanDerWaalsContact C-N 3.27Å; N143-N145 PolarHBondContact O-N 2.82Å; N145-K149 WeakPolarHBondContact O-CG 3.47Å; N145-K149 PolarHBondContact O-N 3.48Å; N145-K149 VanDerWaalsContact O-N 3.17Å
146	L	97.1	Very high	95.9	Very high	91 Å²	91	108.6 Å²	108.6	48%	0.476	52%	0.516	S	S	.	.	H	α-helix	trans	-66	-41.9	174.1	-69.7	173.7	0	0	0	111.4	A142 N143 E144 K149 R150	A142-L146 WeakPolarHBondContact O-CG 2.99Å; A142-L146 PolarHBondContact O-N 2.69Å; A142-L146 VanDerWaalsContact O-N 3.08Å; N143-L146 WeakPolarHBondContact O-CB 3.06Å; N143-L146 PolarHBondContact O-N 2.73Å; N143-L146 VanDerWaalsContact O-N 3.07Å; E144-L146 VanDerWaalsContact C-N 3.35Å; E144-L146 PolarHBondContact O-N 2.81Å; L146-K149 PolarHBondContact O-N 2.93Å; L146-R150 WeakPolarHBondContact O-CG 3.27Å; L146-R150 PolarHBondContact O-N 2.84Å
147	E	96.3	Very high	95.5	Very high	89 Å²	89	110 Å²	110	42%	0.416	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-45.9	176.8	-73.4	172	-171.7	0	0	111.8	N143 E144 K149 R150 L151	N143-E147 PolarHBondContact ND2-OE1 2.86Å; N143-E147 PolarHBondContact O-N 3.25Å; E144-E147 PolarHBondContact O-N 2.86Å; E147-K149 VanDerWaalsContact C-N 3.29Å; E147-K149 PolarHBondContact O-N 3.35Å; E147-R150 WeakPolarHBondContact O-CB 3.43Å; E147-R150 PolarHBondContact O-N 2.81Å; E147-R150 VanDerWaalsContact O-N 3.08Å; E147-L151 WeakPolarHBondContact O-CG 3.45Å; E147-L151 PolarHBondContact O-N 3.32Å
148	R	96.9	Very high	95	Very high	155 Å²	155	109.6 Å²	109.6	59%	0.585	52%	0.524	S	S	*	.	H	α-helix	trans	-57	-42.4	174.8	-71.4	178.5	-157.4	152.4	10.4	112.3	E144 L151 F152	E144-R148 WeakPolarHBondContact O-CG 3.34Å; E144-R148 PolarHBondContact O-N 3.04Å; E144-R148 IonicContact OE2-NH2 3.3Å; E144-R148 PolarHBondContact OE2-NH2 2.96Å; R148-L151 PolarHBondContact O-N 3.48Å; R148-F152 WeakPolarHBondContact O-CB 3.44Å; R148-F152 PolarHBondContact O-N 3.35Å
149	K	96.6	Very high	94	Very high	129 Å²	129	108.3 Å²	108.3	56%	0.561	53%	0.525	S	S	*	.	H	α-helix	trans	-66.6	-36.3	176.6	-73.1	178.7	-179.7	-173.6	0	112.7	N145 L146 E147 K153	N145-K149 WeakPolarHBondContact O-CG 3.47Å; N145-K149 PolarHBondContact O-N 3.48Å; N145-K149 VanDerWaalsContact O-N 3.17Å; L146-K149 PolarHBondContact O-N 2.93Å; E147-K149 VanDerWaalsContact C-N 3.29Å; E147-K149 PolarHBondContact O-N 3.35Å; K149-K153 WeakPolarHBondContact O-CB 3.44Å; K149-K153 PolarHBondContact O-N 3.46Å
150	R	96.9	Very high	92.7	Very high	163 Å²	163	107.1 Å²	107.1	62%	0.615	53%	0.525	S	S	*	.	H	α-helix	trans	-63.6	-51	175	-73.4	172.8	-177.2	170.8	1.2	110.6	L146 E147 F152 K153 E154	L146-R150 WeakPolarHBondContact O-CG 3.27Å; L146-R150 PolarHBondContact O-N 2.84Å; E147-R150 WeakPolarHBondContact O-CB 3.43Å; E147-R150 PolarHBondContact O-N 2.81Å; E147-R150 VanDerWaalsContact O-N 3.08Å; R150-F152 VanDerWaalsContact C-N 3.34Å; R150-F152 PolarHBondContact O-N 3.22Å; R150-K153 PolarHBondContact O-N 2.84Å; R150-E154 WeakPolarHBondContact O-CB 3.05Å; R150-E154 PolarHBondContact O-N 2.84Å
151	L	95.8	Very high	91.2	Very high	114 Å²	114	109.2 Å²	109.2	60%	0.597	53%	0.534	S	S	*	.	H	α-helix	trans	-60.9	-42.5	178.5	-66.6	173.7	0	0	0	112	E147 R148 K153 E154 A155	E147-L151 WeakPolarHBondContact O-CG 3.45Å; E147-L151 PolarHBondContact O-N 3.32Å; R148-L151 PolarHBondContact O-N 3.48Å; L151-K153 PolarHBondContact O-N 3.02Å; L151-E154 PolarHBondContact O-N 3.07Å; L151-A155 WeakPolarHBondContact O-CB 3.44Å; L151-A155 PolarHBondContact O-N 3.21Å
152	F	95.5	Very high	89.5	Confident	139 Å²	139	111.3 Å²	111.3	61%	0.61	55%	0.547	S	S	*	.	H	α-helix	trans	-62.5	-42.8	176.5	-178.9	-102.3	0	0	0	112.3	R148 R150 L156	R148-F152 WeakPolarHBondContact O-CB 3.44Å; R148-F152 PolarHBondContact O-N 3.35Å; R150-F152 VanDerWaalsContact C-N 3.34Å; R150-F152 PolarHBondContact O-N 3.22Å; F152-L156 HydrophobicContact CD1-CD1 3.9Å; F152-L156 HydrophobicContact CE1-CD1 3.39Å; F152-L156 HydrophobicContact CE1-CG 4.26Å; F152-L156 HydrophobicContact CZ-CD1 3.83Å; F152-L156 HydrophobicContact CZ-CG 4.32Å; F152-L156 WeakPolarHBondContact O-CG 3.2Å; F152-L156 PolarHBondContact O-N 3.17Å
153	K	94.6	Very high	87.9	Confident	138 Å²	138	111.6 Å²	111.6	60%	0.6	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-42.5	175.7	-176	-178.6	178	-175.9	0	111.4	K149 R150 L151 L156 M157	K149-K153 WeakPolarHBondContact O-CB 3.44Å; K149-K153 PolarHBondContact O-N 3.46Å; R150-K153 PolarHBondContact O-N 2.84Å; L151-K153 PolarHBondContact O-N 3.02Å; K153-L156 PolarHBondContact O-N 3.12Å; K153-M157 HydrophobicContact CG-SD 4.47Å; K153-M157 WeakPolarHBondContact O-CG 3.45Å; K153-M157 PolarHBondContact O-N 3.35Å
154	E	94.6	Very high	86.2	Confident	120 Å²	120	114.8 Å²	114.8	56%	0.561	57%	0.571	S	S	*	*	H	α-helix	trans	-61.7	-45.9	177.6	-174.8	175.7	-176.9	0	0	111.5	R150 L151 L156 M157 T158	R150-E154 WeakPolarHBondContact O-CB 3.05Å; R150-E154 PolarHBondContact O-N 2.84Å; L151-E154 PolarHBondContact O-N 3.07Å; E154-L156 PolarHBondContact O-N 3.32Å; E154-M157 WeakPolarHBondContact O-CB 3.48Å; E154-M157 PolarHBondContact O-N 2.78Å; E154-T158 PolarHBondContact O-N 3.14Å
155	A	92.9	Very high	84.5	Confident	47 Å²	47	117.9 Å²	117.9	39%	0.388	59%	0.591	S	S	.	*	H	α-helix	trans	-60.1	-43.4	175.2	0	0	0	0	0	112.4	L151 M157 T158 D159	L151-A155 WeakPolarHBondContact O-CB 3.44Å; L151-A155 PolarHBondContact O-N 3.21Å; A155-M157 VanDerWaalsContact C-N 3.3Å; A155-M157 PolarHBondContact O-N 2.78Å; A155-T158 WeakPolarHBondContact CA-OG1 3.42Å; A155-T158 PolarHBondContact O-N 2.93Å; A155-T158 PolarHBondContact O-OG1 2.84Å; A155-D159 PolarHBondContact O-N 3.48Å
156	L	91.6	Very high	82.5	Confident	79 Å²	79	125.2 Å²	125.2	41%	0.414	61%	0.613	S	S	.	*	H	α-helix	trans	-59.6	-41.7	172.1	-76.9	170.8	0	0	0	111.5	F152 K153 E154 T158 D159 F160	F152-L156 HydrophobicContact CD1-CD1 3.9Å; F152-L156 HydrophobicContact CE1-CD1 3.39Å; F152-L156 HydrophobicContact CE1-CG 4.26Å; F152-L156 HydrophobicContact CZ-CD1 3.83Å; F152-L156 HydrophobicContact CZ-CG 4.32Å; F152-L156 WeakPolarHBondContact O-CG 3.2Å; F152-L156 PolarHBondContact O-N 3.17Å; K153-L156 PolarHBondContact O-N 3.12Å; E154-L156 PolarHBondContact O-N 3.32Å; L156-T158 VanDerWaalsContact C-N 3.35Å; L156-T158 PolarHBondContact O-N 3.39Å; L156-D159 PolarHBondContact O-N 3.08Å; L156-F160 VanDerWaalsContact O-CD2 3.31Å; L156-F160 WeakPolarHBondContact O-CD2 3.28Å; L156-F160 PolarHBondContact O-N 2.82Å
157	M	88.1	Confident	80.3	Confident	125 Å²	125	127.9 Å²	127.9	62%	0.616	66%	0.663	S	S	*	*	H	α-helix	trans	-69.1	-29.2	-179.9	-71.4	-174.8	70.8	0	0	113.6	K153 E154 A155	K153-M157 HydrophobicContact CG-SD 4.47Å; K153-M157 WeakPolarHBondContact O-CG 3.45Å; K153-M157 PolarHBondContact O-N 3.35Å; E154-M157 WeakPolarHBondContact O-CB 3.48Å; E154-M157 PolarHBondContact O-N 2.78Å; A155-M157 VanDerWaalsContact C-N 3.3Å; A155-M157 PolarHBondContact O-N 2.78Å
158	T	84.3	Confident	79.5	Confident	75 Å²	75	129.9 Å²	129.9	46%	0.46	68%	0.675	S	S	.	*	H	α-helix	trans	-69.2	-37.7	175.6	49.1	0	0	0	0	112.1	E154 A155 L156 F160 K161	E154-T158 PolarHBondContact O-N 3.14Å; A155-T158 WeakPolarHBondContact CA-OG1 3.42Å; A155-T158 PolarHBondContact O-N 2.93Å; A155-T158 PolarHBondContact O-OG1 2.84Å; L156-T158 VanDerWaalsContact C-N 3.35Å; L156-T158 PolarHBondContact O-N 3.39Å; T158-F160 VanDerWaalsContact C-N 3.27Å; T158-F160 PolarHBondContact O-N 2.87Å; T158-K161 PolarHBondContact O-N 2.96Å
159	D	77	Confident	78.5	Confident	131 Å²	131	128.5 Å²	128.5	70%	0.701	68%	0.68	S	S	*	*	H	α-helix	trans	-71.7	-23.5	-179.4	-61.3	-18.9	0	0	0	112.4	A155 L156	A155-D159 PolarHBondContact O-N 3.48Å; L156-D159 PolarHBondContact O-N 3.08Å
160	F	67.8	Low	77.5	Confident	169 Å²	169	128.5 Å²	128.5	74%	0.741	69%	0.686	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	11.3	178.3	-88	-79.1	0	0	0	114.7	L156 T158 P162	L156-F160 VanDerWaalsContact O-CD2 3.31Å; L156-F160 WeakPolarHBondContact O-CD2 3.28Å; L156-F160 PolarHBondContact O-N 2.82Å; T158-F160 VanDerWaalsContact C-N 3.27Å; T158-F160 PolarHBondContact O-N 2.87Å; F160-P162 WeakPolarHBondContact O-CD 3.4Å; F160-P162 VanDerWaalsContact O-N 3.1Å
161	K	64.8	Low	76.4	Confident	162 Å²	162	126.5 Å²	126.5	70%	0.704	69%	0.691	S	S	*	*			trans	-67.7	105.6	170.3	-85	-166	174	76.1	0	109	T158 G163	T158-K161 PolarHBondContact O-N 2.96Å; K161-G163 PolarHBondContact O-N 3.01Å
162	P	61.5	Low	75.2	Confident	118 Å²	118	127.3 Å²	127.3	77%	0.766	70%	0.696	S	S	*	*			trans	-65.3	135.6	172.8	30.3	-28.7	0	0	0	107.3	F160 D164	F160-P162 WeakPolarHBondContact O-CD 3.4Å; F160-P162 VanDerWaalsContact O-N 3.1Å; P162-D164 PolarHBondContact O-N 2.81Å
163	G	61.3	Low	73.8	Confident	59 Å²	59	126.5 Å²	126.5	61%	0.608	70%	0.702	S	S	*	*			trans	-51.7	128.1	175	0	0	0	0	0	109.6	K161 D165	K161-G163 PolarHBondContact O-N 3.01Å; G163-D165 PolarHBondContact O-N 2.91Å
164	D	60.9	Low	72.3	Confident	141 Å²	141	125.6 Å²	125.6	75%	0.754	71%	0.71	S	S	*	*			trans	-65.2	88.6	161.9	-172.3	15.2	0	0	0	106.2	P162 R166	P162-D164 PolarHBondContact O-N 2.81Å; D164-R166 PolarHBondContact O-N 2.8Å
165	D	61.6	Low	70.6	Confident	154 Å²	154	126.1 Å²	126.1	82%	0.824	72%	0.721	S	S	*	*			trans	-66.3	82.4	171.1	-72.1	-28.4	0	0	0	107.6	G163 G167	G163-D165 PolarHBondContact O-N 2.91Å; D165-G167 PolarHBondContact O-N 3.27Å; D165-G167 VanDerWaalsContact O-N 3.12Å
166	R	56.8	Low	68.8	Low	231 Å²	231	132.7 Å²	132.7	87%	0.872	75%	0.749	S	S	*	*			trans	-70.2	97.8	161.9	-71.5	-165.2	-69.7	173.2	-3.6	108.1	D164	D164-R166 PolarHBondContact O-N 2.8Å
167	G	49.7	Very low	66.7	Low	148 Å²	148	137.5 Å²	137.5	100%	1.526	78%	0.779	S	S	*	*			trans	-134.3	0	166.9	0	0	0	0	0	110.1	D165	D165-G167 PolarHBondContact O-N 3.27Å; D165-G167 VanDerWaalsContact O-N 3.12Å

Retrieved 167 of 167 residues in 1027.5 ms (Link to these results)

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