A0AA82N813_SCHMA Loading...

Protein Asterix AlphaSync

AlphaFold DB , UniProt , Accession A0AA82N813, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 117 aa.

						>A0AA82N813_SCHMA|A0AA82N813
MLQLYPSVCSPRSFIMLAASDPRRPNKLRRFVPLSQDAPSLDQTIDYLNFFGIVLSMCGLLFEMKFAAWLAVVCAFITYANSRTGEDTKQLISGFMLSISALIICYMHNPQPMQLPW
					

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(Predicted Aligned Error values between residue pairs)

Download Structure AlphaSync Parameters PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	42.5	Very low	42.7	Very low	238 Å²	238	142.5 Å²	142.5	100%	1.172	79%	0.788	S	S	*	*				0	120.7	0	-173.3	-179.1	-95.4	0	0	106.1
2	L	39	Very low	43	Very low	168 Å²	168	149 Å²	149	88%	0.88	79%	0.792	S	S	*	*			trans	86	100.1	-161.2	-60.1	160.2	0	0	0	114.8
3	Q	38.6	Very low	43.3	Very low	158 Å²	158	146.8 Å²	146.8	74%	0.738	80%	0.796	S	S	*	*			cis	46.4	113.5	10.1	-73	-79.3	-38.2	0	0	114.1
4	L	40.3	Very low	44	Very low	116 Å²	116	146.2 Å²	146.2	61%	0.607	78%	0.782	S	S	*	*			cis	175.1	128.7	18.3	-176.4	85.7	0	0	0	102.5
5	Y	37.1	Very low	44.6	Very low	213 Å²	213	146.2 Å²	146.2	84%	0.835	78%	0.78	S	S	*	*			trans	-161.9	89.5	145	-121.5	-83.1	0	0	0	109.7
6	P	42.3	Very low	45.1	Very low	98 Å²	98	148.4 Å²	148.4	64%	0.636	79%	0.787	S	S	*	*			trans	-80.9	119.5	158.8	32.3	-27.7	0	0	0	107.7
7	S	46.4	Very low	45.4	Very low	92 Å²	92	146.6 Å²	146.6	64%	0.643	78%	0.777	S	S	*	*			trans	-141.7	70.7	163.4	-76.4	0	0	0	0	108.1	C9	S7-C9 PolarHBondContact O-N 3.46Å
8	V	46.4	Very low	45.8	Very low	149 Å²	149	141.6 Å²	141.6	90%	0.903	76%	0.76	S	S	*	*			trans	-64.4	86.2	153.6	178.1	0	0	0	0	106.1
9	C	48.3	Very low	46.3	Very low	117 Å²	117	139.3 Å²	139.3	79%	0.791	76%	0.763	S	S	*	*			trans	-115.6	93.9	169.2	-153.1	0	0	0	0	109.1	S7	S7-C9 PolarHBondContact O-N 3.46Å
10	S	41.2	Very low	46.5	Very low	95 Å²	95	136.9 Å²	136.9	66%	0.664	76%	0.756	S	S	*	*			trans	60.7	108.4	151.1	-157.2	0	0	0	0	119.8	R12	S10-R12 PolarHBondContact O-N 2.97Å
11	P	47.8	Very low	46.7	Very low	123 Å²	123	134.7 Å²	134.7	80%	0.799	74%	0.743	S	S	*	*			trans	-87	18.3	173.9	25.5	-18.4	0	0	0	115.6
12	R	46.6	Very low	47.3	Very low	221 Å²	221	129.1 Å²	129.1	83%	0.834	73%	0.725	S	S	*	*	S	Bend	trans	-98.6	-1.9	-160.8	-110.9	-179.5	177.3	-173.3	-1.3	120	S10	S10-R12 PolarHBondContact O-N 2.97Å
13	S	46	Very low	47.9	Very low	121 Å²	121	130.8 Å²	130.8	85%	0.846	72%	0.72	S	S	*	*	S	Bend	trans	-125.3	10.9	-178	-68	0	0	0	0	116.5
14	F	53.9	Low	48.7	Very low	138 Å²	138	133.2 Å²	133.2	61%	0.605	72%	0.722	S	S	*	*			trans	-93	-8.2	179.4	-147.8	-97.6	0	0	0	114.7	M16 L17 A18	F14-M16 VanDerWaalsContact C-N 3.31Å; F14-M16 PolarHBondContact O-N 3.2Å; F14-L17 PolarHBondContact O-N 3.28Å; F14-A18 HydrophobicContact CD1-CB 4.41Å; F14-A18 PolarHBondContact O-N 3.38Å
15	I	53.4	Low	49.4	Very low	146 Å²	146	132.6 Å²	132.6	75%	0.749	73%	0.725	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67.8	-28	-171.7	-61.8	179.2	0	0	0	112.7
16	M	51.3	Low	50.2	Low	182 Å²	182	130.3 Å²	130.3	90%	0.897	73%	0.727	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.2	-22.8	-179.9	-84.8	-174.9	-167.2	0	0	115.1	F14	F14-M16 VanDerWaalsContact C-N 3.31Å; F14-M16 PolarHBondContact O-N 3.2Å
17	L	50.2	Low	50.8	Low	117 Å²	117	134.3 Å²	134.3	61%	0.613	74%	0.735	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-15.9	178.5	-77.7	168.4	0	0	0	113.6	F14 A19 S20	F14-L17 PolarHBondContact O-N 3.28Å; L17-A19 PolarHBondContact O-N 3.14Å; L17-S20 PolarHBondContact O-N 2.88Å; L17-S20 PolarHBondContact O-OG 3.23Å
18	A	53.5	Low	51	Low	56 Å²	56	136.6 Å²	136.6	46%	0.463	74%	0.739	S	S	.	*	G	3₁₀ helix	trans	-69.8	-14.7	178	0	0	0	0	0	113.7	F14 S20	F14-A18 HydrophobicContact CD1-CB 4.41Å; F14-A18 PolarHBondContact O-N 3.38Å; A18-S20 PolarHBondContact O-N 3.13Å
19	A	54.2	Low	51.5	Low	99 Å²	99	140.7 Å²	140.7	82%	0.818	74%	0.738	S	S	*	*	G	3₁₀ helix	trans	-70.2	-14.9	176.8	0	0	0	0	0	113.4	L17	L17-A19 PolarHBondContact O-N 3.14Å
20	S	50.5	Low	51.8	Low	90 Å²	90	145.7 Å²	145.7	63%	0.629	74%	0.741	S	S	*	*	G	3₁₀ helix	trans	-113.1	5.8	-178.9	62.6	0	0	0	0	114.7	L17 A18 P22	L17-S20 PolarHBondContact O-N 2.88Å; L17-S20 PolarHBondContact O-OG 3.23Å; A18-S20 PolarHBondContact O-N 3.13Å; S20-P22 WeakPolarHBondContact O-CD 3.06Å
21	D	51	Low	52.4	Low	91 Å²	91	149.8 Å²	149.8	49%	0.487	75%	0.747	S	S	.	*			trans	-77.5	107.6	177.4	-128.5	-57.3	0	0	0	109.7	R23	D21-R23 PolarHBondContact O-N 2.71Å
22	P	54.5	Low	52.8	Low	122 Å²	122	148.7 Å²	148.7	79%	0.792	74%	0.738	S	S	*	*			trans	-75.9	9.5	-177.2	34.1	-33	0	0	0	112	S20 R24	S20-P22 WeakPolarHBondContact O-CD 3.06Å; P22-R24 VanDerWaalsContact C-N 3.28Å; P22-R24 PolarHBondContact O-N 2.95Å
23	R	52.3	Low	53.3	Low	202 Å²	202	142.5 Å²	142.5	76%	0.762	73%	0.726	S	S	*	*			trans	-76.4	81	170.7	-72.8	-178.1	169.7	-167	-0.9	109.2	D21 P25	D21-R23 PolarHBondContact O-N 2.71Å; R23-P25 WeakPolarHBondContact O-CD 2.92Å
24	R	55.6	Low	53.6	Low	209 Å²	209	142.9 Å²	142.9	79%	0.789	72%	0.718	S	S	*	*			trans	-45.1	106.4	170.3	-82.6	-175.3	172.9	-154.2	-0.3	110.4	P22 N26 K27	P22-R24 VanDerWaalsContact C-N 3.28Å; P22-R24 PolarHBondContact O-N 2.95Å; R24-N26 PolarHBondContact O-N 3.47Å; R24-N26 VanDerWaalsContact O-N 3.09Å; R24-K27 PolarHBondContact O-N 3.16Å
25	P	55.3	Low	53.4	Low	103 Å²	103	139.4 Å²	139.4	67%	0.669	71%	0.71	S	S	*	*	G	3₁₀ helix	trans	-63.9	-21.3	-178.5	24.7	-33	0	0	0	112.3	R23 K27 L28	R23-P25 WeakPolarHBondContact O-CD 2.92Å; P25-K27 PolarHBondContact O-N 3.13Å; P25-K27 VanDerWaalsContact O-N 3.11Å; P25-L28 PolarHBondContact O-N 3.48Å
26	N	53.8	Low	53.4	Low	166 Å²	166	141.4 Å²	141.4	89%	0.888	72%	0.717	S	S	*	*	G	3₁₀ helix	trans	-70	-3.8	179.4	-71.2	-26.4	0	0	0	115	R24	R24-N26 PolarHBondContact O-N 3.47Å; R24-N26 VanDerWaalsContact O-N 3.09Å
27	K	53.9	Low	53.4	Low	182 Å²	182	139.7 Å²	139.7	79%	0.791	71%	0.711	S	S	*	*	G	3₁₀ helix	trans	-120	12.5	173.8	-153.2	159.8	-177.6	177.6	0	113.8	R24 P25 R29	R24-K27 PolarHBondContact O-N 3.16Å; P25-K27 PolarHBondContact O-N 3.13Å; P25-K27 VanDerWaalsContact O-N 3.11Å; K27-R29 PolarHBondContact O-N 2.84Å
28	L	51.2	Low	53.5	Low	140 Å²	140	135.6 Å²	135.6	73%	0.733	69%	0.694	S	S	*	*			trans	-71	81.7	161.6	-91.8	79.4	0	0	0	108	P25 R30	P25-L28 PolarHBondContact O-N 3.48Å; L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.35Å
29	R	56.2	Low	53.5	Low	234 Å²	234	138.1 Å²	138.1	88%	0.883	71%	0.706	S	S	*	*			trans	-62.4	103.9	157.2	-75.9	-72.4	-151	-170.7	4.9	105.5	K27 F31	K27-R29 PolarHBondContact O-N 2.84Å; R29-F31 PolarHBondContact O-N 3.3Å
30	R	54.5	Low	53.5	Low	223 Å²	223	135.4 Å²	135.4	84%	0.842	68%	0.681	S	S	*	*			trans	-45.2	125.2	164.9	177.7	164.3	166.5	171	-6.3	106.6	L28 V32	L28-R30 VanDerWaalsContact C-N 3.32Å; L28-R30 PolarHBondContact O-N 3.35Å; R30-V32 PolarHBondContact O-N 3.24Å
31	F	54.9	Low	53.7	Low	181 Å²	181	134.6 Å²	134.6	79%	0.794	67%	0.669	S	S	*	*			trans	-59.7	94.5	173.3	-165	-92.5	0	0	0	105.9	R29 P33	R29-F31 PolarHBondContact O-N 3.3Å; F31-P33 WeakPolarHBondContact O-CD 3.36Å
32	V	56.4	Low	54.2	Low	100 Å²	100	134.9 Å²	134.9	61%	0.606	67%	0.671	S	S	*	*			trans	-67.4	113.5	161.7	-178.6	0	0	0	0	101	R30 L34	R30-V32 PolarHBondContact O-N 3.24Å; V32-L34 PolarHBondContact O-N 3.46Å
33	P	55.9	Low	54.6	Low	91 Å²	91	133.8 Å²	133.8	59%	0.591	66%	0.655	S	S	*	*			trans	-48.4	122.4	166.3	24	-31.3	0	0	0	103.6	F31 S35	F31-P33 WeakPolarHBondContact O-CD 3.36Å; P33-S35 VanDerWaalsContact C-N 3.32Å; P33-S35 PolarHBondContact O-N 2.85Å
34	L	53.2	Low	55.5	Low	129 Å²	129	126.6 Å²	126.6	68%	0.675	63%	0.634	S	S	*	*			trans	-40	112.3	174.8	-78.1	161.9	0	0	0	104.5	V32 Q36 A38	V32-L34 PolarHBondContact O-N 3.46Å; L34-Q36 PolarHBondContact O-N 3.48Å; L34-A38 HydrophobicContact CB-CB 4.44Å
35	S	49.4	Very low	56.1	Low	64 Å²	64	118 Å²	118	45%	0.448	60%	0.603	S	S	.	*			trans	-45.6	135.4	-177.4	-35.7	0	0	0	0	104.4	P33 D37 A38	P33-S35 VanDerWaalsContact C-N 3.32Å; P33-S35 PolarHBondContact O-N 2.85Å; S35-D37 PolarHBondContact O-N 3.31Å; S35-A38 PolarHBondContact O-N 3.17Å
36	Q	53.8	Low	57.1	Low	189 Å²	189	118.1 Å²	118.1	88%	0.883	60%	0.598	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.2	-7.6	176.1	-71.3	175.3	-87.7	0	0	112.5	L34	L34-Q36 PolarHBondContact O-N 3.48Å
37	D	51.6	Low	58	Low	146 Å²	146	115.8 Å²	115.8	78%	0.781	58%	0.578	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80	-11.2	169.6	-51.6	-51.8	0	0	0	115.7	S35 P39	S35-D37 PolarHBondContact O-N 3.31Å; D37-P39 VanDerWaalsContact O-CD 3.31Å; D37-P39 WeakPolarHBondContact O-CD 3.24Å
38	A	52.2	Low	58.8	Low	30 Å²	30	107.4 Å²	107.4	25%	0.248	54%	0.541	C	S	.	.	S	Bend	trans	-63	126.4	158.6	0	0	0	0	0	104.4	L34 S35 S40	L34-A38 HydrophobicContact CB-CB 4.44Å; S35-A38 PolarHBondContact O-N 3.17Å; A38-S40 PolarHBondContact O-N 2.99Å; A38-S40 PolarHBondContact O-OG 3.3Å
39	P	52.4	Low	59.8	Low	109 Å²	109	104.7 Å²	104.7	71%	0.708	53%	0.527	S	S	*	.			trans	-69.8	41.6	172.1	29.3	-33.9	0	0	0	110.2	D37 L41	D37-P39 VanDerWaalsContact O-CD 3.31Å; D37-P39 WeakPolarHBondContact O-CD 3.24Å; P39-L41 VanDerWaalsContact C-N 3.31Å; P39-L41 PolarHBondContact O-N 2.95Å
40	S	54.7	Low	60.9	Low	43 Å²	43	99.7 Å²	99.7	30%	0.301	51%	0.513	S	S	.	.			trans	-75.9	83	-168.2	51.6	0	0	0	0	107.7	A38 D42	A38-S40 PolarHBondContact O-N 2.99Å; A38-S40 PolarHBondContact O-OG 3.3Å; S40-D42 PolarHBondContact O-N 3.49Å
41	L	55.4	Low	61.8	Low	72 Å²	72	92.9 Å²	92.9	38%	0.377	49%	0.489	S	S	.	.	S	Bend	trans	72.8	-32.6	151.1	-165.6	-91.2	0	0	0	115.1	P39 T44 I45 T84	P39-L41 VanDerWaalsContact C-N 3.31Å; P39-L41 PolarHBondContact O-N 2.95Å; L41-T44 WeakPolarHBondContact O-CB 2.96Å; L41-T44 PolarHBondContact O-N 3.42Å; L41-I45 HydrophobicContact CD1-CD1 3.75Å; L41-I45 HydrophobicContact CD1-CG1 4.44Å; L41-I45 WeakPolarHBondContact O-CG1 2.99Å; L41-I45 PolarHBondContact O-N 2.98Å; L41-T84 HydrophobicContact CD1-CG2 3.29Å; L41-T84 HydrophobicContact CD2-CG2 3.41Å; L41-T84 VanDerWaalsContact CD2-CG2 3.41Å; L41-T84 WeakPolarHBondContact CD2-OG1 3.42Å; L41-T84 HydrophobicContact CG-CG2 3.9Å
42	D	61.2	Low	62.7	Low	98 Å²	98	85.6 Å²	85.6	52%	0.524	47%	0.465	S	S	.	.	H	α-helix	trans	-56.5	-52.3	172.5	-68.8	-37.4	0	0	0	111.3	S40 T44 I45 D46	S40-D42 PolarHBondContact O-N 3.49Å; D42-T44 PolarHBondContact O-N 2.74Å; D42-T44 VanDerWaalsContact O-N 3.15Å; D42-I45 WeakPolarHBondContact O-CA 3.38Å; D42-I45 VanDerWaalsContact O-CB 3.31Å; D42-I45 WeakPolarHBondContact O-CB 2.92Å; D42-I45 PolarHBondContact O-N 3.36Å; D42-D46 PolarHBondContact O-N 2.79Å
43	Q	64	Low	63.7	Low	98 Å²	98	85.3 Å²	85.3	46%	0.458	46%	0.459	S	S	.	.	H	α-helix	trans	-60.5	-32.9	179.5	-163.8	-178.5	-47.4	0	0	111.8	D46 Y47	Q43-D46 PolarHBondContact O-N 3.31Å; Q43-Y47 HydrophobicContact CB-CE2 4.49Å; Q43-Y47 HydrophobicContact CG-CD2 4.11Å; Q43-Y47 HydrophobicContact CG-CE2 3.5Å; Q43-Y47 VanDerWaalsContact CG-CE2 3.5Å; Q43-Y47 PolarHBondContact NE2-OH 2.86Å; Q43-Y47 WeakPolarHBondContact O-CD2 3.4Å; Q43-Y47 PolarHBondContact O-N 2.8Å
44	T	69.7	Low	64.6	Low	52 Å²	52	83.7 Å²	83.7	32%	0.319	45%	0.447	S	S	.	.	H	α-helix	trans	-67.7	-38.2	174.3	-52.1	0	0	0	0	111.5	L41 D42 Y47 L48	L41-T44 WeakPolarHBondContact O-CB 2.96Å; L41-T44 PolarHBondContact O-N 3.42Å; D42-T44 PolarHBondContact O-N 2.74Å; D42-T44 VanDerWaalsContact O-N 3.15Å; T44-Y47 PolarHBondContact O-N 3.37Å; T44-L48 HydrophobicContact CG2-CD1 4.34Å; T44-L48 WeakPolarHBondContact O-CB 3.27Å; T44-L48 VanDerWaalsContact O-CG 3.25Å; T44-L48 WeakPolarHBondContact O-CG 3.36Å; T44-L48 PolarHBondContact O-N 3.31Å
45	I	69.6	Low	65.5	Low	27 Å²	27	77.9 Å²	77.9	14%	0.138	42%	0.417	C	S	.	.	H	α-helix	trans	-63.2	-44.7	175.6	-64.2	156.1	0	0	0	110.1	L41 D42 Y47 L48 N49 T84 D87	L41-I45 HydrophobicContact CD1-CD1 3.75Å; L41-I45 HydrophobicContact CD1-CG1 4.44Å; L41-I45 WeakPolarHBondContact O-CG1 2.99Å; L41-I45 PolarHBondContact O-N 2.98Å; D42-I45 WeakPolarHBondContact O-CA 3.38Å; D42-I45 VanDerWaalsContact O-CB 3.31Å; D42-I45 WeakPolarHBondContact O-CB 2.92Å; D42-I45 PolarHBondContact O-N 3.36Å; I45-Y47 VanDerWaalsContact C-N 3.32Å; I45-Y47 PolarHBondContact O-N 3.26Å; I45-L48 WeakPolarHBondContact O-CB 3.39Å; I45-L48 PolarHBondContact O-N 3.28Å; I45-N49 PolarHBondContact O-N 3.47Å; I45-T84 HydrophobicContact CD1-CG2 3.64Å; I45-T84 HydrophobicContact CG1-CG2 3.33Å; I45-D87 WeakPolarHBondContact CD1-OD2 3.29Å; I45-D87 HydrophobicContact CG2-CB 3.88Å
46	D	74.9	Confident	66.6	Low	107 Å²	107	77.5 Å²	77.5	57%	0.572	41%	0.414	S	S	*	.	H	α-helix	trans	-60.7	-43	176	-66.5	-51.2	0	0	0	111.5	D42 Q43 N49 F50	D42-D46 PolarHBondContact O-N 2.79Å; Q43-D46 PolarHBondContact O-N 3.31Å; D46-N49 PolarHBondContact O-N 3.29Å; D46-F50 WeakPolarHBondContact O-CB 3.42Å; D46-F50 PolarHBondContact O-N 3.4Å
47	Y	72.8	Confident	67.6	Low	117 Å²	117	73.8 Å²	73.8	46%	0.459	40%	0.398	S	S	.	.	H	α-helix	trans	-62.1	-46.1	174	-73.9	-49.2	0	0	0	112.1	Q43 T44 I45 N49 F50 F51	Q43-Y47 HydrophobicContact CB-CE2 4.49Å; Q43-Y47 HydrophobicContact CG-CD2 4.11Å; Q43-Y47 HydrophobicContact CG-CE2 3.5Å; Q43-Y47 VanDerWaalsContact CG-CE2 3.5Å; Q43-Y47 PolarHBondContact NE2-OH 2.86Å; Q43-Y47 WeakPolarHBondContact O-CD2 3.4Å; Q43-Y47 PolarHBondContact O-N 2.8Å; T44-Y47 PolarHBondContact O-N 3.37Å; I45-Y47 VanDerWaalsContact C-N 3.32Å; I45-Y47 PolarHBondContact O-N 3.26Å; Y47-N49 VanDerWaalsContact C-N 3.27Å; Y47-N49 PolarHBondContact O-N 3.43Å; Y47-F50 PolarHBondContact O-N 2.94Å; Y47-F51 HydrophobicContact CD1-CE2 4.41Å; Y47-F51 HydrophobicContact CG-CE2 4.43Å; Y47-F51 WeakPolarHBondContact O-CB 3.22Å; Y47-F51 WeakPolarHBondContact O-CD2 3.2Å; Y47-F51 WeakPolarHBondContact O-CG 3.31Å; Y47-F51 PolarHBondContact O-N 2.88Å
48	L	71.2	Confident	68.5	Low	6 Å²	6	68.9 Å²	68.9	3%	0.031	38%	0.375	C	S	.	.	H	α-helix	trans	-59	-40.5	178.8	-77.4	169.4	0	0	0	112.2	T44 I45 G52 N81 L91	T44-L48 HydrophobicContact CG2-CD1 4.34Å; T44-L48 WeakPolarHBondContact O-CB 3.27Å; T44-L48 VanDerWaalsContact O-CG 3.25Å; T44-L48 WeakPolarHBondContact O-CG 3.36Å; T44-L48 PolarHBondContact O-N 3.31Å; I45-L48 WeakPolarHBondContact O-CB 3.39Å; I45-L48 PolarHBondContact O-N 3.28Å; L48-G52 PolarHBondContact O-N 3.33Å; L48-N81 HydrophobicContact CD2-CB 3.51Å; L48-N81 HydrophobicContact CG-CB 4.41Å; L48-L91 HydrophobicContact CB-CD1 3.43Å; L48-L91 VanDerWaalsContact CB-CD1 3.43Å; L48-L91 HydrophobicContact CB-CD2 4.49Å; L48-L91 HydrophobicContact CD1-CD1 4.02Å; L48-L91 HydrophobicContact CG-CD1 4.28Å
49	N	72.8	Confident	69	Low	82 Å²	82	67.8 Å²	67.8	44%	0.439	37%	0.366	S	S	.	.	H	α-helix	trans	-67.1	-47	175.7	-170.6	24.6	0	0	0	111.8	I45 D46 Y47 F51 G52 I53 L91	I45-N49 PolarHBondContact O-N 3.47Å; D46-N49 PolarHBondContact O-N 3.29Å; Y47-N49 VanDerWaalsContact C-N 3.27Å; Y47-N49 PolarHBondContact O-N 3.43Å; N49-F51 VanDerWaalsContact C-N 3.35Å; N49-F51 PolarHBondContact O-N 2.87Å; N49-G52 PolarHBondContact O-N 3.43Å; N49-G52 VanDerWaalsContact O-N 3.14Å; N49-I53 WeakPolarHBondContact O-CG1 3.29Å; N49-I53 PolarHBondContact O-N 2.97Å; N49-L91 HydrophobicContact CB-CD2 4.13Å
50	F	78.6	Confident	69.5	Low	130 Å²	130	67.9 Å²	67.9	57%	0.57	36%	0.36	S	S	*	.	H	α-helix	trans	-58	-47.2	176.1	-176.3	-102	0	0	0	111.7	D46 Y47 G52 I53 V54	D46-F50 WeakPolarHBondContact O-CB 3.42Å; D46-F50 PolarHBondContact O-N 3.4Å; Y47-F50 PolarHBondContact O-N 2.94Å; F50-G52 VanDerWaalsContact C-N 3.34Å; F50-G52 PolarHBondContact O-N 2.95Å; F50-I53 PolarHBondContact O-N 3.18Å; F50-V54 HydrophobicContact CD1-CG2 4.15Å; F50-V54 HydrophobicContact CE1-CG2 3.8Å; F50-V54 HydrophobicContact CE2-CG2 4.28Å; F50-V54 HydrophobicContact CZ-CG2 3.87Å; F50-V54 WeakPolarHBondContact O-CB 3.34Å; F50-V54 VanDerWaalsContact O-CG2 3.28Å; F50-V54 WeakPolarHBondContact O-CG2 3.41Å; F50-V54 PolarHBondContact O-N 3.47Å
51	F	74.2	Confident	69.9	Low	80 Å²	80	72.9 Å²	72.9	35%	0.351	38%	0.383	S	S	.	.	H	α-helix	trans	-63.8	-38	175.6	-72.1	-59.8	0	0	0	112.2	Y47 N49 V54 L55	Y47-F51 HydrophobicContact CD1-CE2 4.41Å; Y47-F51 HydrophobicContact CG-CE2 4.43Å; Y47-F51 WeakPolarHBondContact O-CB 3.22Å; Y47-F51 WeakPolarHBondContact O-CD2 3.2Å; Y47-F51 WeakPolarHBondContact O-CG 3.31Å; Y47-F51 PolarHBondContact O-N 2.88Å; N49-F51 VanDerWaalsContact C-N 3.35Å; N49-F51 PolarHBondContact O-N 2.87Å; F51-V54 PolarHBondContact O-N 3.42Å; F51-L55 WeakPolarHBondContact O-CB 3.27Å; F51-L55 PolarHBondContact O-N 3.49Å
52	G	72.6	Confident	70.2	Confident	27 Å²	27	74.2 Å²	74.2	28%	0.278	39%	0.386	S	S	.	.	H	α-helix	trans	-62.3	-40.9	175	0	0	0	0	0	113.1	L48 N49 F50 S56	L48-G52 PolarHBondContact O-N 3.33Å; N49-G52 PolarHBondContact O-N 3.43Å; N49-G52 VanDerWaalsContact O-N 3.14Å; F50-G52 VanDerWaalsContact C-N 3.34Å; F50-G52 PolarHBondContact O-N 2.95Å; G52-S56 WeakPolarHBondContact O-CB 3.5Å; G52-S56 PolarHBondContact O-N 2.91Å
53	I	77.9	Confident	70.1	Confident	95 Å²	95	75.4 Å²	75.4	49%	0.487	39%	0.388	S	S	.	.	H	α-helix	trans	-69.2	-47.9	175.9	-66	166.1	0	0	0	110.8	N49 F50 L55 S56 M57	N49-I53 WeakPolarHBondContact O-CG1 3.29Å; N49-I53 PolarHBondContact O-N 2.97Å; F50-I53 PolarHBondContact O-N 3.18Å; I53-L55 VanDerWaalsContact C-N 3.28Å; I53-L55 PolarHBondContact O-N 2.85Å; I53-S56 PolarHBondContact O-N 2.99Å; I53-M57 HydrophobicContact CG2-CG 4.41Å; I53-M57 WeakPolarHBondContact O-CB 3.36Å; I53-M57 WeakPolarHBondContact O-CG 3.41Å; I53-M57 PolarHBondContact O-N 3.35Å
54	V	75.5	Confident	69.8	Low	56 Å²	56	78.1 Å²	78.1	34%	0.339	40%	0.402	S	S	.	.	H	α-helix	trans	-59.5	-43	178.2	172	0	0	0	0	110.1	F50 F51 M57 C58	F50-V54 HydrophobicContact CD1-CG2 4.15Å; F50-V54 HydrophobicContact CE1-CG2 3.8Å; F50-V54 HydrophobicContact CE2-CG2 4.28Å; F50-V54 HydrophobicContact CZ-CG2 3.87Å; F50-V54 WeakPolarHBondContact O-CB 3.34Å; F50-V54 VanDerWaalsContact O-CG2 3.28Å; F50-V54 WeakPolarHBondContact O-CG2 3.41Å; F50-V54 PolarHBondContact O-N 3.47Å; F51-V54 PolarHBondContact O-N 3.42Å; V54-M57 PolarHBondContact O-N 2.78Å; V54-C58 WeakPolarHBondContact O-CB 3.26Å; V54-C58 PolarHBondContact O-N 3.31Å; V54-C58 PolarHBondContact O-SG 3.39Å
55	L	70.5	Confident	69.4	Low	8 Å²	8	84 Å²	84	4%	0.042	42%	0.424	C	S	.	.	H	α-helix	trans	-65.2	-42.6	176.6	-170.4	163.9	0	0	0	111.3	F51 I53 M57 C58 G59 C74 T78 F95 S98	F51-L55 WeakPolarHBondContact O-CB 3.27Å; F51-L55 PolarHBondContact O-N 3.49Å; I53-L55 VanDerWaalsContact C-N 3.28Å; I53-L55 PolarHBondContact O-N 2.85Å; L55-M57 VanDerWaalsContact C-N 3.27Å; L55-M57 PolarHBondContact O-N 3.45Å; L55-C58 PolarHBondContact O-N 3.46Å; L55-G59 PolarHBondContact O-N 2.66Å; L55-C74 HydrophobicContact CD1-CB 4.47Å; L55-C74 WeakPolarHBondContact CD1-SG 3.35Å; L55-C74 WeakPolarHBondContact CG-SG 2.87Å; L55-T78 VanDerWaalsContact CD1-OG1 3.31Å; L55-T78 WeakPolarHBondContact CD1-OG1 3.33Å; L55-F95 HydrophobicContact CD1-CD2 3.88Å; L55-F95 HydrophobicContact CD1-CE2 3.81Å; L55-S98 WeakPolarHBondContact CD2-OG 3.48Å
56	S	73.4	Confident	69	Low	55 Å²	55	91 Å²	91	39%	0.385	45%	0.453	S	S	.	.	H	α-helix	trans	-62.5	-33.9	174.9	-174.4	0	0	0	0	112.7	G52 I53	G52-S56 WeakPolarHBondContact O-CB 3.5Å; G52-S56 PolarHBondContact O-N 2.91Å; I53-S56 PolarHBondContact O-N 2.99Å
57	M	75.1	Confident	68.6	Low	111 Å²	111	86.5 Å²	86.5	55%	0.547	43%	0.431	S	S	.	.	H	α-helix	trans	-77.4	-42.5	177.2	-70.5	-75	90	0	0	112.1	I53 V54 L55 G59 L60	I53-M57 HydrophobicContact CG2-CG 4.41Å; I53-M57 WeakPolarHBondContact O-CB 3.36Å; I53-M57 WeakPolarHBondContact O-CG 3.41Å; I53-M57 PolarHBondContact O-N 3.35Å; V54-M57 PolarHBondContact O-N 2.78Å; L55-M57 VanDerWaalsContact C-N 3.27Å; L55-M57 PolarHBondContact O-N 3.45Å; M57-G59 VanDerWaalsContact C-N 3.31Å; M57-G59 PolarHBondContact O-N 3.47Å; M57-L60 HydrophobicContact CE-CD1 4.17Å
58	C	69.1	Low	68.2	Low	44 Å²	44	83 Å²	83	30%	0.297	43%	0.426	S	S	.	.	H	α-helix	trans	-61.8	-40	173.8	-80.8	0	0	0	0	111.9	V54 L55 L60 L61 F62	V54-C58 WeakPolarHBondContact O-CB 3.26Å; V54-C58 PolarHBondContact O-N 3.31Å; V54-C58 PolarHBondContact O-SG 3.39Å; L55-C58 PolarHBondContact O-N 3.46Å; C58-L60 PolarHBondContact O-N 2.85Å; C58-L60 VanDerWaalsContact O-N 3.13Å; C58-L61 PolarHBondContact O-N 3.27Å; C58-L61 VanDerWaalsContact O-N 3.16Å; C58-F62 HydrophobicContact CB-CD2 3.92Å; C58-F62 HydrophobicContact CB-CE2 3.49Å; C58-F62 VanDerWaalsContact CB-CE2 3.49Å; C58-F62 WeakPolarHBondContact O-CD2 3.46Å
59	G	63.8	Low	68.2	Low	6 Å²	6	92.4 Å²	92.4	6%	0.062	46%	0.462	C	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-25.3	-175.4	0	0	0	0	0	114.8	L55 M57 L102	L55-G59 PolarHBondContact O-N 2.66Å; M57-G59 VanDerWaalsContact C-N 3.31Å; M57-G59 PolarHBondContact O-N 3.47Å; G59-L102 VanDerWaalsContact O-CD2 3.27Å; G59-L102 WeakPolarHBondContact O-CD2 3.26Å
60	L	62.3	Low	68.1	Low	112 Å²	112	92.9 Å²	92.9	59%	0.586	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87	-17.7	-178.7	-67	168.3	0	0	0	113.8	M57 C58	M57-L60 HydrophobicContact CE-CD1 4.17Å; C58-L60 PolarHBondContact O-N 2.85Å; C58-L60 VanDerWaalsContact O-N 3.13Å
61	L	63	Low	67.8	Low	148 Å²	148	88.2 Å²	88.2	78%	0.775	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-111.1	-6.8	-167.7	-64.8	178	0	0	0	115	C58 E63	C58-L61 PolarHBondContact O-N 3.27Å; C58-L61 VanDerWaalsContact O-N 3.16Å; L61-E63 PolarHBondContact O-N 2.91Å
62	F	62.1	Low	67.7	Low	100 Å²	100	89.4 Å²	89.4	44%	0.439	46%	0.462	S	S	.	.			trans	-96.5	94.9	-165.8	-82.3	-53.6	0	0	0	114.2	C58 A67 L70	C58-F62 HydrophobicContact CB-CD2 3.92Å; C58-F62 HydrophobicContact CB-CE2 3.49Å; C58-F62 VanDerWaalsContact CB-CE2 3.49Å; C58-F62 WeakPolarHBondContact O-CD2 3.46Å; F62-A67 HydrophobicContact CB-CB 3.69Å; F62-A67 HydrophobicContact CG-CB 4.43Å; F62-L70 HydrophobicContact CE1-CD1 4.47Å
63	E	59.4	Low	67.9	Low	123 Å²	123	91.6 Å²	91.6	58%	0.575	47%	0.47	S	S	*	.			trans	-109.7	36.1	-175.9	-114.6	-164	112.5	0	0	115	L61 N109	L61-E63 PolarHBondContact O-N 2.91Å; E63-N109 HydrophobicContact CG-CB 4.4Å; E63-N109 VanDerWaalsContact OE1-CG 3.26Å; E63-N109 PolarHBondContact OE1-ND2 3.25Å; E63-N109 VanDerWaalsContact OE1-ND2 3.13Å
64	M	57.4	Low	67.7	Low	154 Å²	154	89 Å²	89	76%	0.759	46%	0.46	S	S	*	.	S	Bend	trans	-140.5	157.7	-175.7	-61.2	-69.9	-99.4	0	0	113.4	F66 A67	M64-F66 PolarHBondContact O-N 2.92Å; M64-A67 WeakPolarHBondContact O-CA 3.03Å; M64-A67 WeakPolarHBondContact O-CB 3.49Å; M64-A67 PolarHBondContact O-N 2.91Å
65	K	61.4	Low	67.4	Low	177 Å²	177	87.6 Å²	87.6	77%	0.77	45%	0.454	S	S	*	.	H	α-helix	trans	-49.8	-29.5	-176.6	-75.3	161	62	160.5	0	116.1	A67	K65-A67 VanDerWaalsContact C-N 3.31Å
66	F	61.8	Low	67.5	Low	172 Å²	172	94.3 Å²	94.3	75%	0.754	48%	0.484	S	S	*	.	H	α-helix	trans	-72.3	-22.1	173.7	-73	-78.6	0	0	0	113.6	M64 A68 W69 L70	M64-F66 PolarHBondContact O-N 2.92Å; F66-A68 PolarHBondContact O-N 2.89Å; F66-W69 PolarHBondContact O-N 2.67Å; F66-L70 WeakPolarHBondContact O-CG 3.28Å; F66-L70 PolarHBondContact O-N 3.26Å
67	A	65.1	Low	67.5	Low	14 Å²	14	95.4 Å²	95.4	12%	0.116	48%	0.484	C	S	.	.	H	α-helix	trans	-59.7	-41.1	-179.5	0	0	0	0	0	112.8	F62 M64 K65 W69 L70 A71	F62-A67 HydrophobicContact CB-CB 3.69Å; F62-A67 HydrophobicContact CG-CB 4.43Å; M64-A67 WeakPolarHBondContact O-CA 3.03Å; M64-A67 WeakPolarHBondContact O-CB 3.49Å; M64-A67 PolarHBondContact O-N 2.91Å; K65-A67 VanDerWaalsContact C-N 3.31Å; A67-W69 PolarHBondContact O-N 3.02Å; A67-L70 CarbonylContact O-C 3.6Å; A67-L70 PolarHBondContact O-N 2.97Å; A67-A71 WeakPolarHBondContact O-CB 3.39Å; A67-A71 PolarHBondContact O-N 3.19Å
68	A	65.2	Low	67.2	Low	42 Å²	42	90.9 Å²	90.9	35%	0.347	46%	0.463	S	S	.	.	H	α-helix	trans	-64.5	-42.8	-179.8	0	0	0	0	0	111.2	F66 A71 V72 Y106	F66-A68 PolarHBondContact O-N 2.89Å; A68-A71 PolarHBondContact O-N 3.36Å; A68-V72 VanDerWaalsContact O-CG2 3.31Å; A68-V72 WeakPolarHBondContact O-CG2 3.48Å; A68-V72 PolarHBondContact O-N 3.35Å; A68-Y106 HydrophobicContact CB-CE2 4.49Å
69	W	70.6	Confident	67.2	Low	205 Å²	205	96.9 Å²	96.9	78%	0.777	48%	0.48	S	S	*	.	H	α-helix	trans	-64.1	-44.1	174.6	-88.8	72.2	0	0	0	111.6	F66 A67 A71 V72 V73	F66-W69 PolarHBondContact O-N 2.67Å; A67-W69 PolarHBondContact O-N 3.02Å; W69-A71 PolarHBondContact O-N 3.02Å; W69-V72 PolarHBondContact O-N 3.45Å; W69-V73 WeakPolarHBondContact O-CB 3.31Å; W69-V73 VanDerWaalsContact O-CG2 3.26Å; W69-V73 WeakPolarHBondContact O-CG2 3.13Å; W69-V73 PolarHBondContact O-N 3.25Å
70	L	71	Confident	67.5	Low	92 Å²	92	99.9 Å²	99.9	48%	0.482	51%	0.505	S	S	.	.	H	α-helix	trans	-63.4	-40	175.7	-73.3	170.8	0	0	0	112	F62 F66 A67 V73 C74	F62-L70 HydrophobicContact CE1-CD1 4.47Å; F66-L70 WeakPolarHBondContact O-CG 3.28Å; F66-L70 PolarHBondContact O-N 3.26Å; A67-L70 CarbonylContact O-C 3.6Å; A67-L70 PolarHBondContact O-N 2.97Å; L70-V73 PolarHBondContact O-N 3.37Å; L70-C74 WeakPolarHBondContact O-CB 3.3Å; L70-C74 PolarHBondContact O-N 3.05Å
71	A	73.6	Confident	67.7	Low	32 Å²	32	97.6 Å²	97.6	26%	0.264	49%	0.493	S	S	.	.	H	α-helix	trans	-65.7	-41.5	178.4	0	0	0	0	0	111.7	A67 A68 W69 C74 A75 L102	A67-A71 WeakPolarHBondContact O-CB 3.39Å; A67-A71 PolarHBondContact O-N 3.19Å; A68-A71 PolarHBondContact O-N 3.36Å; W69-A71 PolarHBondContact O-N 3.02Å; A71-C74 PolarHBondContact O-N 3.01Å; A71-A75 VanDerWaalsContact O-CB 3.3Å; A71-A75 WeakPolarHBondContact O-CB 3.39Å; A71-A75 PolarHBondContact O-N 3.23Å; A71-L102 HydrophobicContact CB-CD1 4.28Å
72	V	71.7	Confident	67.4	Low	104 Å²	104	92 Å²	92	63%	0.63	47%	0.466	S	S	*	.	H	α-helix	trans	-65.1	-46.8	175.3	172.3	0	0	0	0	110.9	A68 W69 C74 A75 F76	A68-V72 VanDerWaalsContact O-CG2 3.31Å; A68-V72 WeakPolarHBondContact O-CG2 3.48Å; A68-V72 PolarHBondContact O-N 3.35Å; W69-V72 PolarHBondContact O-N 3.45Å; V72-C74 VanDerWaalsContact C-N 3.32Å; V72-C74 PolarHBondContact O-N 2.82Å; V72-A75 PolarHBondContact O-N 3.43Å; V72-F76 WeakPolarHBondContact O-CB 3.49Å; V72-F76 PolarHBondContact O-N 3.24Å
73	V	76.7	Confident	67.2	Low	74 Å²	74	98.6 Å²	98.6	45%	0.448	49%	0.488	S	S	.	.	H	α-helix	trans	-62.7	-42.8	177.5	171.3	0	0	0	0	110.5	W69 L70 F76 I77	W69-V73 WeakPolarHBondContact O-CB 3.31Å; W69-V73 VanDerWaalsContact O-CG2 3.26Å; W69-V73 WeakPolarHBondContact O-CG2 3.13Å; W69-V73 PolarHBondContact O-N 3.25Å; L70-V73 PolarHBondContact O-N 3.37Å; V73-F76 PolarHBondContact O-N 3.01Å; V73-I77 HydrophobicContact CG1-CD1 3.8Å; V73-I77 HydrophobicContact CG1-CG1 4.46Å; V73-I77 WeakPolarHBondContact O-CD1 3.5Å; V73-I77 VanDerWaalsContact O-CG1 3.25Å; V73-I77 WeakPolarHBondContact O-CG1 3.27Å; V73-I77 PolarHBondContact O-N 3.38Å
74	C	72.7	Confident	67	Low	40 Å²	40	93 Å²	93	27%	0.27	46%	0.462	S	S	.	.	H	α-helix	trans	-62.6	-44.9	177.8	-166.7	0	0	0	0	111.5	L55 L70 A71 V72 F76 I77 T78	L55-C74 HydrophobicContact CD1-CB 4.47Å; L55-C74 WeakPolarHBondContact CD1-SG 3.35Å; L55-C74 WeakPolarHBondContact CG-SG 2.87Å; L70-C74 WeakPolarHBondContact O-CB 3.3Å; L70-C74 PolarHBondContact O-N 3.05Å; A71-C74 PolarHBondContact O-N 3.01Å; V72-C74 VanDerWaalsContact C-N 3.32Å; V72-C74 PolarHBondContact O-N 2.82Å; C74-F76 VanDerWaalsContact C-N 3.3Å; C74-F76 PolarHBondContact O-N 2.81Å; C74-I77 PolarHBondContact O-N 2.92Å; C74-T78 PolarHBondContact O-N 3.41Å; C74-T78 PolarHBondContact O-OG1 3.42Å
75	A	69.4	Low	66.8	Low	26 Å²	26	89.2 Å²	89.2	22%	0.215	46%	0.463	C	S	.	.	H	α-helix	trans	-59.8	-40.2	175.2	0	0	0	0	0	112.6	A71 V72 T78 Y79 F95 I99	A71-A75 VanDerWaalsContact O-CB 3.3Å; A71-A75 WeakPolarHBondContact O-CB 3.39Å; A71-A75 PolarHBondContact O-N 3.23Å; V72-A75 PolarHBondContact O-N 3.43Å; A75-T78 PolarHBondContact O-N 3.32Å; A75-Y79 WeakPolarHBondContact O-CB 3.39Å; A75-Y79 PolarHBondContact O-N 3.34Å; A75-F95 HydrophobicContact CB-CE2 4.14Å; A75-F95 HydrophobicContact CB-CZ 3.83Å; A75-I99 HydrophobicContact CB-CD1 4.48Å
76	F	73.6	Confident	66.6	Low	150 Å²	150	87.7 Å²	87.7	66%	0.658	46%	0.459	S	S	*	.	H	α-helix	trans	-67.3	-40	178.1	-155.6	-97.9	0	0	0	112.4	V72 V73 C74 Y79 A80	V72-F76 WeakPolarHBondContact O-CB 3.49Å; V72-F76 PolarHBondContact O-N 3.24Å; V73-F76 PolarHBondContact O-N 3.01Å; C74-F76 VanDerWaalsContact C-N 3.3Å; C74-F76 PolarHBondContact O-N 2.81Å; F76-Y79 PolarHBondContact O-N 3.14Å; F76-A80 PolarHBondContact O-N 2.86Å
77	I	73.1	Confident	66.7	Low	78 Å²	78	82.9 Å²	82.9	40%	0.4	44%	0.441	S	S	.	.	H	α-helix	trans	-61.9	-45.2	175.6	-68	163	0	0	0	110.5	V73 C74 N81	V73-I77 HydrophobicContact CG1-CD1 3.8Å; V73-I77 HydrophobicContact CG1-CG1 4.46Å; V73-I77 WeakPolarHBondContact O-CD1 3.5Å; V73-I77 VanDerWaalsContact O-CG1 3.25Å; V73-I77 WeakPolarHBondContact O-CG1 3.27Å; V73-I77 PolarHBondContact O-N 3.38Å; C74-I77 PolarHBondContact O-N 2.92Å; I77-N81 PolarHBondContact O-N 3.39Å; I77-N81 PolarHBondContact O-ND2 2.95Å
78	T	68.9	Low	66.8	Low	15 Å²	15	82.9 Å²	82.9	9%	0.092	44%	0.44	C	S	.	.	H	α-helix	trans	-65.5	-40.7	178.2	-55.5	0	0	0	0	111.9	L55 C74 A75 N81 S82 F95	L55-T78 VanDerWaalsContact CD1-OG1 3.31Å; L55-T78 WeakPolarHBondContact CD1-OG1 3.33Å; C74-T78 PolarHBondContact O-N 3.41Å; C74-T78 PolarHBondContact O-OG1 3.42Å; A75-T78 PolarHBondContact O-N 3.32Å; T78-N81 PolarHBondContact O-N 3.48Å; T78-S82 PolarHBondContact O-N 2.77Å; T78-F95 HydrophobicContact CG2-CD2 3.57Å; T78-F95 HydrophobicContact CG2-CE2 3.75Å; T78-F95 HydrophobicContact CG2-CG 4.16Å; T78-F95 HydrophobicContact CG2-CZ 4.45Å
79	Y	68.7	Low	67.2	Low	171 Å²	171	88.6 Å²	88.6	67%	0.671	46%	0.456	S	S	*	.	H	α-helix	trans	-64.3	-44	179.3	-176.4	-102.7	0	0	0	112.9	A75 F76 N81 S82	A75-Y79 WeakPolarHBondContact O-CB 3.39Å; A75-Y79 PolarHBondContact O-N 3.34Å; F76-Y79 PolarHBondContact O-N 3.14Å; Y79-N81 PolarHBondContact O-N 3.11Å; Y79-S82 PolarHBondContact O-N 2.77Å; Y79-S82 PolarHBondContact O-OG 3.36Å
80	A	69.1	Low	67.5	Low	69 Å²	69	85.9 Å²	85.9	57%	0.57	45%	0.453	S	S	*	.	H	α-helix	trans	-61.8	-28.7	178.9	0	0	0	0	0	112.6	F76	F76-A80 PolarHBondContact O-N 2.86Å
81	N	66.8	Low	67.6	Low	64 Å²	64	82.9 Å²	82.9	34%	0.342	44%	0.437	S	S	.	.	H	α-helix	trans	-90.8	-19	-175	-72.1	-47.5	0	0	0	113.9	L48 I77 T78 Y79 R83	L48-N81 HydrophobicContact CD2-CB 3.51Å; L48-N81 HydrophobicContact CG-CB 4.41Å; I77-N81 PolarHBondContact O-N 3.39Å; I77-N81 PolarHBondContact O-ND2 2.95Å; T78-N81 PolarHBondContact O-N 3.48Å; Y79-N81 PolarHBondContact O-N 3.11Å; N81-R83 PolarHBondContact O-N 2.81Å
82	S	58.2	Low	67.7	Low	31 Å²	31	84.6 Å²	84.6	22%	0.217	44%	0.441	C	S	.	.			trans	-72.1	24.3	-168.4	73.7	0	0	0	0	115.4	T78 Y79 T84 T88	T78-S82 PolarHBondContact O-N 2.77Å; Y79-S82 PolarHBondContact O-N 2.77Å; Y79-S82 PolarHBondContact O-OG 3.36Å; S82-T84 PolarHBondContact O-N 3.09Å; S82-T88 VanDerWaalsContact O-CG2 3.31Å; S82-T88 WeakPolarHBondContact O-CG2 3.25Å; S82-T88 PolarHBondContact O-OG1 3.34Å
83	R	57.7	Low	68.2	Low	238 Å²	238	82.5 Å²	82.5	90%	0.898	43%	0.431	S	S	*	.			trans	-73.8	10.1	-174.9	-160	169.3	171.4	178	-2.3	114.2	N81	N81-R83 PolarHBondContact O-N 2.81Å
84	T	54.6	Low	68.2	Low	4 Å²	4	80.7 Å²	80.7	3%	0.025	43%	0.427	C	S	.	.			trans	-102.8	91.1	-173.7	-51.8	0	0	0	0	113.2	L41 I45 S82 E86 T88	L41-T84 HydrophobicContact CD1-CG2 3.29Å; L41-T84 HydrophobicContact CD2-CG2 3.41Å; L41-T84 VanDerWaalsContact CD2-CG2 3.41Å; L41-T84 WeakPolarHBondContact CD2-OG1 3.42Å; L41-T84 HydrophobicContact CG-CG2 3.9Å; I45-T84 HydrophobicContact CD1-CG2 3.64Å; I45-T84 HydrophobicContact CG1-CG2 3.33Å; S82-T84 PolarHBondContact O-N 3.09Å; T84-E86 VanDerWaalsContact C-N 3.26Å; T84-E86 PolarHBondContact O-N 3.44Å; T84-T88 PolarHBondContact N-OG1 2.86Å; T84-T88 WeakPolarHBondContact O-CB 2.94Å; T84-T88 PolarHBondContact O-N 3.22Å; T84-T88 VanDerWaalsContact O-N 3.16Å; T84-T88 PolarHBondContact O-OG1 3.42Å
85	G	54.2	Low	68.3	Low	76 Å²	76	80.2 Å²	80.2	78%	0.784	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60	-6.5	-159.6	0	0	0	0	0	120.1
86	E	57	Low	69	Low	145 Å²	145	84.3 Å²	84.3	68%	0.678	44%	0.437	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.1	-47.8	-175.7	-66.2	167.7	99.8	0	0	112	T84 K89	T84-E86 VanDerWaalsContact C-N 3.26Å; T84-E86 PolarHBondContact O-N 3.44Å; E86-K89 WeakPolarHBondContact O-CE 3.44Å
87	D	62.8	Low	69.2	Low	70 Å²	70	83 Å²	83	37%	0.374	44%	0.436	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.1	-15.7	-178.5	-56	-58.7	0	0	0	113.3	I45 K89 Q90 L91	I45-D87 WeakPolarHBondContact CD1-OD2 3.29Å; I45-D87 HydrophobicContact CG2-CB 3.88Å; D87-K89 PolarHBondContact O-N 2.85Å; D87-K89 VanDerWaalsContact O-N 3.07Å; D87-Q90 PolarHBondContact O-N 3.3Å; D87-L91 PolarHBondContact O-N 2.99Å
88	T	68.1	Low	69.3	Low	15 Å²	15	79.7 Å²	79.7	9%	0.092	42%	0.42	C	S	.	.	H	α-helix	trans	-53.6	-30.3	176.1	-82.7	0	0	0	0	112.7	S82 T84 Q90 L91 I92	S82-T88 VanDerWaalsContact O-CG2 3.31Å; S82-T88 WeakPolarHBondContact O-CG2 3.25Å; S82-T88 PolarHBondContact O-OG1 3.34Å; T84-T88 PolarHBondContact N-OG1 2.86Å; T84-T88 WeakPolarHBondContact O-CB 2.94Å; T84-T88 PolarHBondContact O-N 3.22Å; T84-T88 VanDerWaalsContact O-N 3.16Å; T84-T88 PolarHBondContact O-OG1 3.42Å; T88-Q90 PolarHBondContact O-N 3.34Å; T88-L91 PolarHBondContact O-N 3.43Å; T88-I92 HydrophobicContact CG2-CD1 3.24Å; T88-I92 HydrophobicContact CG2-CG1 3.78Å; T88-I92 WeakPolarHBondContact O-CB 3.42Å; T88-I92 WeakPolarHBondContact O-CG1 3.17Å; T88-I92 PolarHBondContact O-N 3.46Å
89	K	73.9	Confident	69.8	Low	161 Å²	161	81.1 Å²	81.1	70%	0.7	43%	0.426	S	S	*	.	H	α-helix	trans	-62.4	-40.2	-179.8	65.9	-171.9	174.7	-174.7	0	113.8	E86 D87 S93	E86-K89 WeakPolarHBondContact O-CE 3.44Å; D87-K89 PolarHBondContact O-N 2.85Å; D87-K89 VanDerWaalsContact O-N 3.07Å; K89-S93 PolarHBondContact O-N 3.21Å; K89-S93 VanDerWaalsContact O-N 3.11Å; K89-S93 PolarHBondContact O-OG 2.98Å
90	Q	76.3	Confident	70.4	Confident	149 Å²	149	75.9 Å²	75.9	70%	0.696	42%	0.415	S	S	*	.	H	α-helix	trans	-76.2	-32.7	-179.4	-179	173.4	-21.7	0	0	110.6	D87 T88 S93 G94	D87-Q90 PolarHBondContact O-N 3.3Å; T88-Q90 PolarHBondContact O-N 3.34Å; Q90-S93 PolarHBondContact O-OG 3.07Å; Q90-G94 PolarHBondContact O-N 2.9Å; Q90-G94 VanDerWaalsContact O-N 3.09Å
91	L	73.6	Confident	70.8	Confident	28 Å²	28	74.1 Å²	74.1	15%	0.147	40%	0.4	C	S	.	.	H	α-helix	trans	-72.1	-41.3	175.9	-62.4	163.1	0	0	0	111.1	L48 N49 D87 T88 S93 G94 F95	L48-L91 HydrophobicContact CB-CD1 3.43Å; L48-L91 VanDerWaalsContact CB-CD1 3.43Å; L48-L91 HydrophobicContact CB-CD2 4.49Å; L48-L91 HydrophobicContact CD1-CD1 4.02Å; L48-L91 HydrophobicContact CG-CD1 4.28Å; N49-L91 HydrophobicContact CB-CD2 4.13Å; D87-L91 PolarHBondContact O-N 2.99Å; T88-L91 PolarHBondContact O-N 3.43Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 3.27Å; L91-G94 PolarHBondContact O-N 3.33Å; L91-F95 WeakPolarHBondContact O-CB 3.21Å; L91-F95 PolarHBondContact O-N 3.32Å
92	I	75.7	Confident	71.1	Confident	68 Å²	68	72.7 Å²	72.7	35%	0.349	39%	0.393	S	S	.	.	H	α-helix	trans	-63	-40.1	174.5	-72.9	170.8	0	0	0	110.5	T88 F95 M96	T88-I92 HydrophobicContact CG2-CD1 3.24Å; T88-I92 HydrophobicContact CG2-CG1 3.78Å; T88-I92 WeakPolarHBondContact O-CB 3.42Å; T88-I92 WeakPolarHBondContact O-CG1 3.17Å; T88-I92 PolarHBondContact O-N 3.46Å; I92-F95 WeakPolarHBondContact O-CB 3.41Å; I92-F95 PolarHBondContact O-N 3.16Å; I92-M96 HydrophobicContact CG2-CE 4.38Å; I92-M96 HydrophobicContact CG2-CG 4.2Å; I92-M96 WeakPolarHBondContact O-CB 3.4Å; I92-M96 WeakPolarHBondContact O-CG 3.44Å; I92-M96 PolarHBondContact O-N 2.85Å
93	S	81	Confident	71.9	Confident	61 Å²	61	76 Å²	76	43%	0.427	41%	0.407	S	S	.	.	H	α-helix	trans	-65.9	-44.2	176.5	61.8	0	0	0	0	111.6	K89 Q90 L91 F95 M96 L97	K89-S93 PolarHBondContact O-N 3.21Å; K89-S93 VanDerWaalsContact O-N 3.11Å; K89-S93 PolarHBondContact O-OG 2.98Å; Q90-S93 PolarHBondContact O-OG 3.07Å; L91-S93 VanDerWaalsContact C-N 3.33Å; L91-S93 PolarHBondContact O-N 3.27Å; S93-F95 VanDerWaalsContact C-N 3.3Å; S93-F95 PolarHBondContact O-N 3.42Å; S93-M96 PolarHBondContact O-N 2.77Å; S93-L97 VanDerWaalsContact O-CG 3.24Å; S93-L97 WeakPolarHBondContact O-CG 3.24Å; S93-L97 PolarHBondContact O-N 3.07Å
94	G	76.8	Confident	72.8	Confident	36 Å²	36	70 Å²	70	37%	0.371	39%	0.391	S	S	.	.	H	α-helix	trans	-59.6	-39.8	171.7	0	0	0	0	0	112.9	Q90 L91 L97 S98	Q90-G94 PolarHBondContact O-N 2.9Å; Q90-G94 VanDerWaalsContact O-N 3.09Å; L91-G94 PolarHBondContact O-N 3.33Å; G94-L97 PolarHBondContact O-N 3.46Å; G94-S98 WeakPolarHBondContact O-CB 2.95Å; G94-S98 PolarHBondContact O-N 3.18Å; G94-S98 PolarHBondContact O-OG 2.66Å
95	F	75.3	Confident	73.4	Confident	29 Å²	29	72.4 Å²	72.4	13%	0.127	41%	0.408	C	S	.	.	H	α-helix	trans	-64	-47.8	176.4	-178.4	-113.4	0	0	0	112.3	L55 A75 T78 L91 I92 S93 L97 S98 I99	L55-F95 HydrophobicContact CD1-CD2 3.88Å; L55-F95 HydrophobicContact CD1-CE2 3.81Å; A75-F95 HydrophobicContact CB-CE2 4.14Å; A75-F95 HydrophobicContact CB-CZ 3.83Å; T78-F95 HydrophobicContact CG2-CD2 3.57Å; T78-F95 HydrophobicContact CG2-CE2 3.75Å; T78-F95 HydrophobicContact CG2-CG 4.16Å; T78-F95 HydrophobicContact CG2-CZ 4.45Å; L91-F95 WeakPolarHBondContact O-CB 3.21Å; L91-F95 PolarHBondContact O-N 3.32Å; I92-F95 WeakPolarHBondContact O-CB 3.41Å; I92-F95 PolarHBondContact O-N 3.16Å; S93-F95 VanDerWaalsContact C-N 3.3Å; S93-F95 PolarHBondContact O-N 3.42Å; F95-L97 VanDerWaalsContact C-N 3.27Å; F95-L97 PolarHBondContact O-N 3.19Å; F95-S98 WeakPolarHBondContact CA-OG 3.25Å; F95-S98 PolarHBondContact O-N 3.02Å; F95-S98 PolarHBondContact O-OG 2.74Å; F95-I99 HydrophobicContact CD1-CD1 3.61Å; F95-I99 HydrophobicContact CD2-CD1 4.07Å; F95-I99 HydrophobicContact CD2-CG1 4.45Å; F95-I99 HydrophobicContact CE1-CD1 3.16Å; F95-I99 HydrophobicContact CE1-CG1 4.41Å; F95-I99 HydrophobicContact CE2-CD1 3.67Å; F95-I99 HydrophobicContact CE2-CG1 4.2Å; F95-I99 HydrophobicContact CG-CD1 4.07Å; F95-I99 HydrophobicContact CZ-CD1 3.23Å; F95-I99 HydrophobicContact CZ-CG1 4.22Å; F95-I99 PolarHBondContact O-N 2.9Å
96	M	82.9	Confident	74.2	Confident	112 Å²	112	76.9 Å²	76.9	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-59.7	-40.1	175.8	-72.4	-67.6	175.9	0	0	111.4	I92 S93 S100	I92-M96 HydrophobicContact CG2-CE 4.38Å; I92-M96 HydrophobicContact CG2-CG 4.2Å; I92-M96 WeakPolarHBondContact O-CB 3.4Å; I92-M96 WeakPolarHBondContact O-CG 3.44Å; I92-M96 PolarHBondContact O-N 2.85Å; S93-M96 PolarHBondContact O-N 2.77Å; M96-S100 VanDerWaalsContact O-CB 3.27Å; M96-S100 WeakPolarHBondContact O-CB 3.42Å; M96-S100 PolarHBondContact O-N 3.16Å; M96-S100 PolarHBondContact O-OG 2.65Å
97	L	79	Confident	74.6	Confident	123 Å²	123	76.8 Å²	76.8	64%	0.644	40%	0.404	S	S	*	.	H	α-helix	trans	-65	-44.9	175.6	-69.8	171.3	0	0	0	111.8	S93 G94 F95 S100 A101	S93-L97 VanDerWaalsContact O-CG 3.24Å; S93-L97 WeakPolarHBondContact O-CG 3.24Å; S93-L97 PolarHBondContact O-N 3.07Å; G94-L97 PolarHBondContact O-N 3.46Å; F95-L97 VanDerWaalsContact C-N 3.27Å; F95-L97 PolarHBondContact O-N 3.19Å; L97-S100 PolarHBondContact O-N 3.15Å; L97-A101 WeakPolarHBondContact O-CB 3.33Å; L97-A101 PolarHBondContact O-N 2.74Å
98	S	75.6	Confident	74.7	Confident	8 Å²	8	81 Å²	81	6%	0.056	42%	0.421	C	S	.	.	H	α-helix	trans	-66.7	-41.3	-179.7	67.5	0	0	0	0	113.4	L55 G94 F95 S100 A101 L102	L55-S98 WeakPolarHBondContact CD2-OG 3.48Å; G94-S98 WeakPolarHBondContact O-CB 2.95Å; G94-S98 PolarHBondContact O-N 3.18Å; G94-S98 PolarHBondContact O-OG 2.66Å; F95-S98 WeakPolarHBondContact CA-OG 3.25Å; F95-S98 PolarHBondContact O-N 3.02Å; F95-S98 PolarHBondContact O-OG 2.74Å; S98-S100 VanDerWaalsContact C-N 3.33Å; S98-A101 PolarHBondContact O-N 3.41Å; S98-L102 WeakPolarHBondContact O-CB 3.44Å; S98-L102 VanDerWaalsContact O-CG 3.29Å; S98-L102 WeakPolarHBondContact O-CG 3.34Å; S98-L102 PolarHBondContact O-N 2.79Å
99	I	77.6	Confident	74.4	Confident	45 Å²	45	82.7 Å²	82.7	23%	0.231	43%	0.429	C	S	.	.	H	α-helix	trans	-64.8	-41.9	174	-70.6	167.3	0	0	0	110	A75 F95 L102 I103	A75-I99 HydrophobicContact CB-CD1 4.48Å; F95-I99 HydrophobicContact CD1-CD1 3.61Å; F95-I99 HydrophobicContact CD2-CD1 4.07Å; F95-I99 HydrophobicContact CD2-CG1 4.45Å; F95-I99 HydrophobicContact CE1-CD1 3.16Å; F95-I99 HydrophobicContact CE1-CG1 4.41Å; F95-I99 HydrophobicContact CE2-CD1 3.67Å; F95-I99 HydrophobicContact CE2-CG1 4.2Å; F95-I99 HydrophobicContact CG-CD1 4.07Å; F95-I99 HydrophobicContact CZ-CD1 3.23Å; F95-I99 HydrophobicContact CZ-CG1 4.22Å; F95-I99 PolarHBondContact O-N 2.9Å; I99-L102 WeakPolarHBondContact O-CB 3.14Å; I99-L102 PolarHBondContact O-N 3.19Å; I99-I103 HydrophobicContact CG2-CD1 3.6Å; I99-I103 HydrophobicContact CG2-CG1 4.19Å; I99-I103 VanDerWaalsContact O-CG1 3.27Å; I99-I103 WeakPolarHBondContact O-CG1 3.31Å; I99-I103 PolarHBondContact O-N 2.95Å
100	S	82.9	Confident	73.3	Confident	61 Å²	61	79.9 Å²	79.9	43%	0.427	43%	0.427	S	S	.	.	H	α-helix	trans	-63.9	-44.1	179	-58.8	0	0	0	0	111.2	M96 L97 S98 L102 I103 I104	M96-S100 VanDerWaalsContact O-CB 3.27Å; M96-S100 WeakPolarHBondContact O-CB 3.42Å; M96-S100 PolarHBondContact O-N 3.16Å; M96-S100 PolarHBondContact O-OG 2.65Å; L97-S100 PolarHBondContact O-N 3.15Å; S98-S100 VanDerWaalsContact C-N 3.33Å; S100-L102 VanDerWaalsContact C-N 3.33Å; S100-L102 PolarHBondContact O-N 2.74Å; S100-I103 PolarHBondContact O-N 2.74Å; S100-I104 VanDerWaalsContact O-CG1 3.26Å; S100-I104 WeakPolarHBondContact O-CG1 3.19Å; S100-I104 PolarHBondContact O-N 3.18Å
101	A	76.7	Confident	72.4	Confident	33 Å²	33	79 Å²	79	27%	0.273	42%	0.423	S	S	.	.	H	α-helix	trans	-59.5	-44.9	174.2	0	0	0	0	0	111.3	L97 S98 I103 I104 C105	L97-A101 WeakPolarHBondContact O-CB 3.33Å; L97-A101 PolarHBondContact O-N 2.74Å; S98-A101 PolarHBondContact O-N 3.41Å; A101-I103 PolarHBondContact O-N 2.91Å; A101-I104 PolarHBondContact O-N 2.75Å; A101-C105 WeakPolarHBondContact O-CB 3.31Å; A101-C105 PolarHBondContact O-N 2.99Å; A101-C105 PolarHBondContact O-SG 3.24Å
102	L	73.1	Confident	71.3	Confident	34 Å²	34	83.5 Å²	83.5	18%	0.178	45%	0.454	C	S	.	.	H	α-helix	trans	-60.1	-43.3	175.9	-83	167.8	0	0	0	113.2	G59 A71 S98 I99 S100 C105 Y106	G59-L102 VanDerWaalsContact O-CD2 3.27Å; G59-L102 WeakPolarHBondContact O-CD2 3.26Å; A71-L102 HydrophobicContact CB-CD1 4.28Å; S98-L102 WeakPolarHBondContact O-CB 3.44Å; S98-L102 VanDerWaalsContact O-CG 3.29Å; S98-L102 WeakPolarHBondContact O-CG 3.34Å; S98-L102 PolarHBondContact O-N 2.79Å; I99-L102 WeakPolarHBondContact O-CB 3.14Å; I99-L102 PolarHBondContact O-N 3.19Å; S100-L102 VanDerWaalsContact C-N 3.33Å; S100-L102 PolarHBondContact O-N 2.74Å; L102-C105 PolarHBondContact O-N 2.84Å; L102-Y106 VanDerWaalsContact O-CB 3.29Å; L102-Y106 WeakPolarHBondContact O-CB 3.35Å; L102-Y106 PolarHBondContact O-N 3Å
103	I	75.2	Confident	70.4	Confident	100 Å²	100	86.5 Å²	86.5	51%	0.513	47%	0.468	S	S	.	.	H	α-helix	trans	-67.9	-40.2	177.8	-68.2	167.6	0	0	0	110.8	I99 S100 A101 Y106 M107	I99-I103 HydrophobicContact CG2-CD1 3.6Å; I99-I103 HydrophobicContact CG2-CG1 4.19Å; I99-I103 VanDerWaalsContact O-CG1 3.27Å; I99-I103 WeakPolarHBondContact O-CG1 3.31Å; I99-I103 PolarHBondContact O-N 2.95Å; S100-I103 PolarHBondContact O-N 2.74Å; A101-I103 PolarHBondContact O-N 2.91Å; I103-Y106 WeakPolarHBondContact O-CB 3.4Å; I103-Y106 PolarHBondContact O-N 3.11Å; I103-M107 PolarHBondContact O-N 2.98Å
104	I	76.3	Confident	69.4	Low	111 Å²	111	90.9 Å²	90.9	57%	0.569	48%	0.482	S	S	*	.	H	α-helix	trans	-63.9	-47.6	175.5	-67.5	165.1	0	0	0	109.8	S100 A101 Y106 M107 H108	S100-I104 VanDerWaalsContact O-CG1 3.26Å; S100-I104 WeakPolarHBondContact O-CG1 3.19Å; S100-I104 PolarHBondContact O-N 3.18Å; A101-I104 PolarHBondContact O-N 2.75Å; I104-Y106 VanDerWaalsContact C-N 3.25Å; I104-Y106 PolarHBondContact O-N 3.22Å; I104-M107 PolarHBondContact O-N 3.01Å; I104-H108 WeakPolarHBondContact O-CB 3.05Å; I104-H108 PolarHBondContact O-N 3.43Å
105	C	67.6	Low	68.7	Low	56 Å²	56	95.7 Å²	95.7	38%	0.378	50%	0.498	S	S	.	.	H	α-helix	trans	-59.3	-37	174.9	-71.1	0	0	0	0	112	A101 L102 H108 N109	A101-C105 WeakPolarHBondContact O-CB 3.31Å; A101-C105 PolarHBondContact O-N 2.99Å; A101-C105 PolarHBondContact O-SG 3.24Å; L102-C105 PolarHBondContact O-N 2.84Å; C105-H108 PolarHBondContact O-N 3.24Å; C105-N109 PolarHBondContact O-N 3.32Å; C105-N109 VanDerWaalsContact O-N 3.14Å
106	Y	70.1	Confident	68.1	Low	170 Å²	170	97.9 Å²	97.9	67%	0.667	52%	0.515	S	S	*	.	H	α-helix	trans	-62.7	-45.2	175.2	-177	-97	0	0	0	112	A68 L102 I103 I104 H108	A68-Y106 HydrophobicContact CB-CE2 4.49Å; L102-Y106 VanDerWaalsContact O-CB 3.29Å; L102-Y106 WeakPolarHBondContact O-CB 3.35Å; L102-Y106 PolarHBondContact O-N 3Å; I103-Y106 WeakPolarHBondContact O-CB 3.4Å; I103-Y106 PolarHBondContact O-N 3.11Å; I104-Y106 VanDerWaalsContact C-N 3.25Å; I104-Y106 PolarHBondContact O-N 3.22Å; Y106-H108 VanDerWaalsContact C-N 3.28Å; Y106-H108 PolarHBondContact O-N 3.09Å
107	M	65.4	Low	66.8	Low	143 Å²	143	106.3 Å²	106.3	70%	0.704	54%	0.541	S	S	*	.	H	α-helix	trans	-69.6	-27.8	175.5	-70.5	-64.4	-64	0	0	112.5	I103 I104	I103-M107 PolarHBondContact O-N 2.98Å; I104-M107 PolarHBondContact O-N 3.01Å
108	H	65.2	Low	66.2	Low	158 Å²	158	105.5 Å²	105.5	73%	0.731	54%	0.536	S	S	*	.	H	α-helix	trans	-84.3	-10.5	-176.6	-141.3	80.2	0	0	0	114.2	I104 C105 Y106 P110	I104-H108 WeakPolarHBondContact O-CB 3.05Å; I104-H108 PolarHBondContact O-N 3.43Å; C105-H108 PolarHBondContact O-N 3.24Å; Y106-H108 VanDerWaalsContact C-N 3.28Å; Y106-H108 PolarHBondContact O-N 3.09Å; H108-P110 WeakPolarHBondContact O-CD 3.35Å
109	N	61.7	Low	65.7	Low	50 Å²	50	110.6 Å²	110.6	27%	0.267	56%	0.561	S	S	.	*			trans	-106.6	72.3	172.6	-171	14.4	0	0	0	112.2	E63 C105 Q111	E63-N109 HydrophobicContact CG-CB 4.4Å; E63-N109 VanDerWaalsContact OE1-CG 3.26Å; E63-N109 PolarHBondContact OE1-ND2 3.25Å; E63-N109 VanDerWaalsContact OE1-ND2 3.13Å; C105-N109 PolarHBondContact O-N 3.32Å; C105-N109 VanDerWaalsContact O-N 3.14Å; N109-Q111 PolarHBondContact O-N 3.41Å; N109-Q111 VanDerWaalsContact OD1-CB 3.24Å; N109-Q111 WeakPolarHBondContact OD1-CB 3.31Å; N109-Q111 WeakPolarHBondContact OD1-CG 3.32Å; N109-Q111 PolarHBondContact OD1-N 3.34Å
110	P	51.4	Low	65	Low	102 Å²	102	114.2 Å²	114.2	66%	0.662	58%	0.58	S	S	*	*			trans	-78.4	11.8	169.6	35.6	-36.3	0	0	0	112.2	H108 P112	H108-P110 WeakPolarHBondContact O-CD 3.35Å; P110-P112 WeakPolarHBondContact O-CD 3.12Å
111	Q	57.9	Low	64	Low	130 Å²	130	117.4 Å²	117.4	61%	0.607	59%	0.589	S	S	*	*			trans	-68.4	102.9	-172.8	-61.9	-166.6	-4.9	0	0	110.2	N109 M113	N109-Q111 PolarHBondContact O-N 3.41Å; N109-Q111 VanDerWaalsContact OD1-CB 3.24Å; N109-Q111 WeakPolarHBondContact OD1-CB 3.31Å; N109-Q111 WeakPolarHBondContact OD1-CG 3.32Å; N109-Q111 PolarHBondContact OD1-N 3.34Å; Q111-M113 PolarHBondContact O-N 3.39Å
112	P	49.3	Very low	63.2	Low	123 Å²	123	122.6 Å²	122.6	80%	0.799	61%	0.608	S	S	*	*			trans	-86	68.4	174.1	29.2	-10.3	0	0	0	105.3	P110 Q114	P110-P112 WeakPolarHBondContact O-CD 3.12Å; P112-Q114 PolarHBondContact O-N 3.27Å
113	M	56.6	Low	62.5	Low	132 Å²	132	128.5 Å²	128.5	65%	0.65	64%	0.637	S	S	*	*			trans	-99.2	92	173.9	-79.3	-136.5	-91	0	0	109.8	Q111	Q111-M113 PolarHBondContact O-N 3.39Å
114	Q	61.7	Low	61.6	Low	153 Å²	153	130.6 Å²	130.6	72%	0.715	65%	0.646	S	S	*	*			trans	54.9	108	137.5	36.1	-173.2	-69.2	0	0	115.8	P112 P116	P112-Q114 PolarHBondContact O-N 3.27Å; Q114-P116 WeakPolarHBondContact O-CD 3.12Å
115	L	61.1	Low	60.5	Low	136 Å²	136	132.1 Å²	132.1	71%	0.712	65%	0.652	S	S	*	*			trans	-56.1	113.9	151.8	-73	73.5	0	0	0	107.1
116	P	63.2	Low	59.9	Low	75 Å²	75	138.4 Å²	138.4	49%	0.487	68%	0.675	S	S	.	*			trans	-76.6	129.3	143.8	37.7	-29.4	0	0	0	104.8	Q114	Q114-P116 WeakPolarHBondContact O-CD 3.12Å
117	W	55.1	Low	59	Low	289 Å²	289	135.5 Å²	135.5	100%	1.095	68%	0.676	S	S	*	*			trans	69.8	0	177.6	60	74.7	0	0	0	118.8

Retrieved 117 of 117 residues in 109.7 ms (Link to these results)

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