A0A5K4EIJ7_SCHMA Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A5K4EIJ7, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 128 aa.

						>A0A5K4EIJ7_SCHMA|A0A5K4EIJ7
MCYSYEVVGLENQSTASRSFSNKRKVSSLIEEAENTKVDSMEGEADDGRYIELDLLIPSGANDEPLEIPVNFSDSSTEDEDSSSESESEFREIIIPSPVRLSSAVSPLCTSRKLIEELKSVCTDDCII
					

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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	47.2	Very low	41.9	Very low	213 Å²	213	151.9 Å²	151.9	100%	1.049	81%	0.809	S	S	*	*				0	127.9	0	-60.8	-153.2	-140.1	0	0	107.5	Y3	M1-Y3 HydrophobicContact CB-CE2 4.45Å
2	C	37.7	Very low	42.2	Very low	132 Å²	132	151.3 Å²	151.3	89%	0.892	81%	0.806	S	S	*	*			trans	-116.1	126.5	-179.5	-65.5	0	0	0	0	108.2
3	Y	39.6	Very low	42.2	Very low	178 Å²	178	153.6 Å²	153.6	70%	0.698	81%	0.809	S	S	*	*			trans	-98.5	122.9	178.4	-64	-85.7	0	0	0	108.9	M1	M1-Y3 HydrophobicContact CB-CE2 4.45Å
4	S	44.1	Very low	42.3	Very low	115 Å²	115	148.2 Å²	148.2	80%	0.804	79%	0.791	S	S	*	*			trans	-107.7	124.2	169.9	47.5	0	0	0	0	108.1
5	Y	42.4	Very low	42.7	Very low	199 Å²	199	146.9 Å²	146.9	78%	0.78	79%	0.791	S	S	*	*			trans	-99	122.2	176	-62.7	-92.6	0	0	0	108.4
6	E	37.8	Very low	43.1	Very low	180 Å²	180	141.4 Å²	141.4	84%	0.841	77%	0.772	S	S	*	*			trans	-81.9	119.8	172	-71.3	-173.4	163.4	0	0	109.6	V8	E6-V8 PolarHBondContact O-N 2.9Å
7	V	46.3	Very low	43.4	Very low	141 Å²	141	137.8 Å²	137.8	86%	0.855	76%	0.759	S	S	*	*			trans	-80.1	96.6	173.5	179.6	0	0	0	0	107.7	G9	V7-G9 VanDerWaalsContact C-N 3.28Å; V7-G9 PolarHBondContact O-N 3.35Å
8	V	41.2	Very low	43.5	Very low	128 Å²	128	141 Å²	141	78%	0.776	76%	0.758	S	S	*	*			trans	-73.7	85.9	172.5	-172.7	0	0	0	0	108.3	E6 L10	E6-V8 PolarHBondContact O-N 2.9Å; V8-L10 PolarHBondContact O-N 2.93Å
9	G	39.5	Very low	43.9	Very low	56 Å²	56	136.7 Å²	136.7	58%	0.577	74%	0.74	S	S	*	*			trans	-71.1	105.5	173.4	0	0	0	0	0	110.3	V7 E11	V7-G9 VanDerWaalsContact C-N 3.28Å; V7-G9 PolarHBondContact O-N 3.35Å; G9-E11 VanDerWaalsContact C-N 3.31Å; G9-E11 PolarHBondContact O-N 3.19Å
10	L	45.7	Very low	44.4	Very low	163 Å²	163	137 Å²	137	85%	0.853	73%	0.734	S	S	*	*			trans	-60.5	94.3	163.9	-98.2	156.4	0	0	0	108.7	V8 N12	V8-L10 PolarHBondContact O-N 2.93Å; L10-N12 PolarHBondContact O-N 3.21Å
11	E	40.1	Very low	44.9	Very low	166 Å²	166	133.3 Å²	133.3	78%	0.776	72%	0.719	S	S	*	*			trans	-58.4	126.8	168.6	-71	-175.6	134.8	0	0	109.8	G9	G9-E11 VanDerWaalsContact C-N 3.31Å; G9-E11 PolarHBondContact O-N 3.19Å
12	N	45.1	Very low	45.4	Very low	145 Å²	145	127.2 Å²	127.2	78%	0.775	69%	0.691	S	S	*	*			trans	79.4	43.6	149.4	-53	-30.5	0	0	0	119.8	L10	L10-N12 PolarHBondContact O-N 3.21Å
13	Q	42.1	Very low	46.6	Very low	181 Å²	181	128 Å²	128	85%	0.846	68%	0.679	S	S	*	*	S	Bend	trans	-118.9	95.6	156.3	-71.5	-170.8	46.4	0	0	112.8
14	S	43.1	Very low	47.9	Very low	78 Å²	78	129.5 Å²	129.5	55%	0.545	68%	0.683	S	S	.	*			trans	59.7	68	153.4	-152.4	0	0	0	0	118.3	A16 S17	S14-A16 PolarHBondContact O-N 3.43Å; S14-S17 PolarHBondContact OG-OG 3.03Å
15	T	49.1	Very low	49.3	Very low	129 Å²	129	130 Å²	130	79%	0.791	67%	0.671	S	S	*	*	H	α-helix	trans	-69.9	-17.1	166.4	45.9	0	0	0	0	113.7	S19	T15-S19 PolarHBondContact O-OG 3.05Å; T15-S19 VanDerWaalsContact O-OG 3.05Å
16	A	49.4	Very low	50.7	Low	59 Å²	59	124.5 Å²	124.5	49%	0.488	66%	0.658	S	S	.	*	H	α-helix	trans	-70	-40.9	-178.4	0	0	0	0	0	112.4	S14 S19 F20	S14-A16 PolarHBondContact O-N 3.43Å; A16-S19 PolarHBondContact O-OG 3.24Å; A16-S19 VanDerWaalsContact O-OG 3.07Å; A16-F20 WeakPolarHBondContact O-CD2 3.11Å
17	S	47.4	Very low	52.5	Low	80 Å²	80	119.5 Å²	119.5	56%	0.559	64%	0.643	S	S	*	*	H	α-helix	trans	-72.4	-34.7	-176.3	-40.2	0	0	0	0	112.6	S14	S14-S17 PolarHBondContact OG-OG 3.03Å
18	R	46.2	Very low	53.9	Low	195 Å²	195	116 Å²	116	74%	0.736	63%	0.625	S	S	*	*	H	α-helix	trans	-74.9	-33.1	-174.2	-157.4	173.5	-177.3	177.9	-0.2	112.6	S21 N22	R18-S21 PolarHBondContact O-N 3.07Å; R18-N22 PolarHBondContact O-N 3.22Å
19	S	51.2	Low	55.6	Low	59 Å²	59	115 Å²	115	41%	0.413	62%	0.615	S	S	.	*	H	α-helix	trans	-68.6	-37.1	-179.9	45.6	0	0	0	0	113	T15 A16 K23	T15-S19 PolarHBondContact O-OG 3.05Å; T15-S19 VanDerWaalsContact O-OG 3.05Å; A16-S19 PolarHBondContact O-OG 3.24Å; A16-S19 VanDerWaalsContact O-OG 3.07Å; S19-K23 PolarHBondContact O-N 2.94Å
20	F	52.7	Low	57.3	Low	143 Å²	143	116.5 Å²	116.5	63%	0.627	61%	0.609	S	S	*	*	H	α-helix	trans	-68.2	-38	174.3	-70.2	-72.5	0	0	0	112.9	A16 N22 K23 R24	A16-F20 WeakPolarHBondContact O-CD2 3.11Å; F20-N22 VanDerWaalsContact C-N 3.35Å; F20-K23 PolarHBondContact O-N 3.36Å; F20-R24 PolarHBondContact O-N 3.42Å
21	S	55.4	Low	59	Low	60 Å²	60	114.6 Å²	114.6	42%	0.42	60%	0.595	S	S	.	*	H	α-helix	trans	-63.3	-41.6	177.7	-175.1	0	0	0	0	111.6	R18 R24 K25	R18-S21 PolarHBondContact O-N 3.07Å; S21-R24 PolarHBondContact O-N 3.18Å; S21-K25 WeakPolarHBondContact O-CG 3.49Å; S21-K25 PolarHBondContact O-N 3.41Å
22	N	58.3	Low	60.8	Low	85 Å²	85	112.3 Å²	112.3	46%	0.455	59%	0.585	S	S	.	*	H	α-helix	trans	-67.1	-39.8	178.1	-77.2	-10.3	0	0	0	112.6	R18 F20 R24 K25 V26	R18-N22 PolarHBondContact O-N 3.22Å; F20-N22 VanDerWaalsContact C-N 3.35Å; N22-R24 VanDerWaalsContact C-N 3.35Å; N22-R24 PolarHBondContact O-N 3.47Å; N22-K25 PolarHBondContact O-N 3.32Å; N22-V26 WeakPolarHBondContact O-CG2 3.43Å; N22-V26 PolarHBondContact O-N 2.98Å
23	K	62.8	Low	62	Low	149 Å²	149	108.2 Å²	108.2	65%	0.648	57%	0.571	S	S	*	*	H	α-helix	trans	-58.8	-44.9	177.1	-75.5	-173.4	178.8	-176.2	0	112.2	S19 F20 K25 V26 S27	S19-K23 PolarHBondContact O-N 2.94Å; F20-K23 PolarHBondContact O-N 3.36Å; K23-K25 VanDerWaalsContact C-N 3.35Å; K23-K25 PolarHBondContact O-N 3.46Å; K23-V26 PolarHBondContact O-N 3Å; K23-S27 PolarHBondContact O-N 3.41Å; K23-S27 PolarHBondContact O-OG 3.24Å
24	R	67	Low	63.7	Low	208 Å²	208	107 Å²	107	79%	0.785	57%	0.565	S	S	*	*	H	α-helix	trans	-62.4	-40.7	177.1	-75	-171.6	-179.4	-179.7	0.3	112.5	F20 S21 N22 S28	F20-R24 PolarHBondContact O-N 3.42Å; S21-R24 PolarHBondContact O-N 3.18Å; N22-R24 VanDerWaalsContact C-N 3.35Å; N22-R24 PolarHBondContact O-N 3.47Å; R24-S28 WeakPolarHBondContact O-CB 3.35Å; R24-S28 PolarHBondContact O-N 3.22Å
25	K	73.3	Confident	65.1	Low	127 Å²	127	109.2 Å²	109.2	55%	0.552	57%	0.571	S	S	*	*	H	α-helix	trans	-63.7	-45	176.7	-72.1	-177.6	178.3	-171.4	0	112.1	S21 N22 K23 S28 L29	S21-K25 WeakPolarHBondContact O-CG 3.49Å; S21-K25 PolarHBondContact O-N 3.41Å; N22-K25 PolarHBondContact O-N 3.32Å; K23-K25 VanDerWaalsContact C-N 3.35Å; K23-K25 PolarHBondContact O-N 3.46Å; K25-S28 PolarHBondContact O-N 3.19Å; K25-L29 WeakPolarHBondContact O-CG 3.31Å; K25-L29 PolarHBondContact O-N 2.97Å
26	V	71.7	Confident	66.1	Low	82 Å²	82	105.9 Å²	105.9	50%	0.497	55%	0.551	S	S	.	*	H	α-helix	trans	-63.4	-45.2	178.3	174.2	0	0	0	0	110.8	N22 K23 S28 L29 I30	N22-V26 WeakPolarHBondContact O-CG2 3.43Å; N22-V26 PolarHBondContact O-N 2.98Å; K23-V26 PolarHBondContact O-N 3Å; V26-S28 VanDerWaalsContact C-N 3.33Å; V26-S28 PolarHBondContact O-N 3.32Å; V26-L29 PolarHBondContact O-N 2.99Å; V26-I30 HydrophobicContact CG1-CD1 3.81Å; V26-I30 HydrophobicContact CG1-CG1 4.45Å; V26-I30 VanDerWaalsContact O-CG1 3.3Å; V26-I30 WeakPolarHBondContact O-CG1 3.37Å; V26-I30 PolarHBondContact O-N 2.94Å
27	S	75.6	Confident	67.1	Low	76 Å²	76	112.2 Å²	112.2	53%	0.531	57%	0.567	S	S	.	*	H	α-helix	trans	-60.8	-41.2	175.9	-63.1	0	0	0	0	112.6	K23 L29 I30 E31	K23-S27 PolarHBondContact O-N 3.41Å; K23-S27 PolarHBondContact O-OG 3.24Å; S27-L29 VanDerWaalsContact C-N 3.34Å; S27-L29 PolarHBondContact O-N 2.92Å; S27-I30 PolarHBondContact O-N 2.97Å; S27-E31 WeakPolarHBondContact O-CB 3.41Å; S27-E31 PolarHBondContact O-N 3.31Å
28	S	75.2	Confident	68.1	Low	68 Å²	68	110.8 Å²	110.8	48%	0.476	56%	0.555	S	S	.	*	H	α-helix	trans	-62.5	-40.4	176.2	-173.8	0	0	0	0	112.3	R24 K25 V26 E31 E32	R24-S28 WeakPolarHBondContact O-CB 3.35Å; R24-S28 PolarHBondContact O-N 3.22Å; K25-S28 PolarHBondContact O-N 3.19Å; V26-S28 VanDerWaalsContact C-N 3.33Å; V26-S28 PolarHBondContact O-N 3.32Å; S28-E31 PolarHBondContact O-N 3.43Å; S28-E32 VanDerWaalsContact O-CB 3.31Å; S28-E32 WeakPolarHBondContact O-CB 3.3Å; S28-E32 PolarHBondContact O-N 3.48Å
29	L	76.6	Confident	69.4	Low	107 Å²	107	106 Å²	106	56%	0.56	54%	0.544	S	S	*	.	H	α-helix	trans	-69	-35.8	177.7	-74.2	166.7	0	0	0	112.1	K25 V26 S27 A33	K25-L29 WeakPolarHBondContact O-CG 3.31Å; K25-L29 PolarHBondContact O-N 2.97Å; V26-L29 PolarHBondContact O-N 2.99Å; S27-L29 VanDerWaalsContact C-N 3.34Å; S27-L29 PolarHBondContact O-N 2.92Å; L29-A33 WeakPolarHBondContact O-CB 3.39Å; L29-A33 PolarHBondContact O-N 3.49Å
30	I	76.1	Confident	70.3	Confident	87 Å²	87	106.2 Å²	106.2	45%	0.446	55%	0.545	S	S	.	.	H	α-helix	trans	-66.5	-47	175	-66.4	164.9	0	0	0	109.9	V26 S27 E32 A33 E34	V26-I30 HydrophobicContact CG1-CD1 3.81Å; V26-I30 HydrophobicContact CG1-CG1 4.45Å; V26-I30 VanDerWaalsContact O-CG1 3.3Å; V26-I30 WeakPolarHBondContact O-CG1 3.37Å; V26-I30 PolarHBondContact O-N 2.94Å; S27-I30 PolarHBondContact O-N 2.97Å; I30-E32 VanDerWaalsContact C-N 3.3Å; I30-E32 PolarHBondContact O-N 2.85Å; I30-A33 PolarHBondContact O-N 3.21Å; I30-E34 HydrophobicContact CG2-CG 4.37Å; I30-E34 WeakPolarHBondContact O-CB 3.48Å; I30-E34 WeakPolarHBondContact O-CG 3.33Å; I30-E34 PolarHBondContact O-N 3.42Å
31	E	80.4	Confident	71.5	Confident	122 Å²	122	104 Å²	104	57%	0.57	54%	0.538	S	S	*	.	H	α-helix	trans	-62.6	-37.9	177.3	-175.4	177.2	-175.2	0	0	111.8	S27 S28 N35	S27-E31 WeakPolarHBondContact O-CB 3.41Å; S27-E31 PolarHBondContact O-N 3.31Å; S28-E31 PolarHBondContact O-N 3.43Å; E31-N35 WeakPolarHBondContact O-CB 3.49Å; E31-N35 VanDerWaalsContact O-CG 3.32Å; E31-N35 PolarHBondContact O-N 2.93Å; E31-N35 VanDerWaalsContact O-N 3.1Å; E31-N35 PolarHBondContact O-ND2 3.1Å
32	E	77.7	Confident	72.4	Confident	119 Å²	119	109.1 Å²	109.1	56%	0.556	56%	0.555	S	S	*	*	H	α-helix	trans	-64.1	-46	173.4	-173.6	176.5	-178.7	0	0	111.4	S28 I30 N35 T36	S28-E32 VanDerWaalsContact O-CB 3.31Å; S28-E32 WeakPolarHBondContact O-CB 3.3Å; S28-E32 PolarHBondContact O-N 3.48Å; I30-E32 VanDerWaalsContact C-N 3.3Å; I30-E32 PolarHBondContact O-N 2.85Å; E32-N35 CarbonylContact O-C 3.59Å; E32-N35 PolarHBondContact O-N 2.85Å; E32-T36 WeakPolarHBondContact O-CG2 3.28Å; E32-T36 PolarHBondContact O-N 3.01Å
33	A	71.9	Confident	73.5	Confident	59 Å²	59	106.7 Å²	106.7	49%	0.488	55%	0.55	S	S	.	*	H	α-helix	trans	-63.2	-41.8	177	0	0	0	0	0	112.5	L29 I30 N35 T36	L29-A33 WeakPolarHBondContact O-CB 3.39Å; L29-A33 PolarHBondContact O-N 3.49Å; I30-A33 PolarHBondContact O-N 3.21Å; A33-N35 VanDerWaalsContact C-N 3.27Å; A33-N35 PolarHBondContact O-N 3.49Å; A33-T36 PolarHBondContact O-N 2.9Å; A33-T36 PolarHBondContact O-OG1 3.03Å
34	E	75.9	Confident	74.6	Confident	155 Å²	155	105.9 Å²	105.9	72%	0.724	55%	0.549	S	S	*	.	H	α-helix	trans	-65.2	-30.1	176.4	-74	177.5	180	0	0	112.6	I30	I30-E34 HydrophobicContact CG2-CG 4.37Å; I30-E34 WeakPolarHBondContact O-CB 3.48Å; I30-E34 WeakPolarHBondContact O-CG 3.33Å; I30-E34 PolarHBondContact O-N 3.42Å
35	N	73.9	Confident	75.2	Confident	124 Å²	124	97.1 Å²	97.1	66%	0.663	52%	0.521	S	S	*	.	H	α-helix	trans	-88.1	-9.6	176.6	-72.5	-47.8	0	0	0	113.5	E31 E32 A33 K37	E31-N35 WeakPolarHBondContact O-CB 3.49Å; E31-N35 VanDerWaalsContact O-CG 3.32Å; E31-N35 PolarHBondContact O-N 2.93Å; E31-N35 VanDerWaalsContact O-N 3.1Å; E31-N35 PolarHBondContact O-ND2 3.1Å; E32-N35 CarbonylContact O-C 3.59Å; E32-N35 PolarHBondContact O-N 2.85Å; A33-N35 VanDerWaalsContact C-N 3.27Å; A33-N35 PolarHBondContact O-N 3.49Å; N35-K37 PolarHBondContact O-N 2.98Å
36	T	70.2	Confident	75.9	Confident	60 Å²	60	99.9 Å²	99.9	37%	0.368	54%	0.542	S	S	.	.	S	Bend	trans	-67.5	122.9	177	60.1	0	0	0	0	109.7	E32 A33 V38	E32-T36 WeakPolarHBondContact O-CG2 3.28Å; E32-T36 PolarHBondContact O-N 3.01Å; A33-T36 PolarHBondContact O-N 2.9Å; A33-T36 PolarHBondContact O-OG1 3.03Å; T36-V38 PolarHBondContact O-N 3.08Å
37	K	69.2	Low	76.9	Confident	192 Å²	192	100.5 Å²	100.5	84%	0.835	54%	0.542	S	S	*	.			trans	-67.6	107.8	175	-172	179.3	-179.8	-172.7	0	107.7	N35	N35-K37 PolarHBondContact O-N 2.98Å
38	V	68.7	Low	77.4	Confident	50 Å²	50	98.6 Å²	98.6	30%	0.303	54%	0.535	S	S	.	.			trans	-79.3	132.7	176.3	-167.3	0	0	0	0	108	T36 S40 D54 L55 L56	T36-V38 PolarHBondContact O-N 3.08Å; V38-S40 PolarHBondContact O-N 2.72Å; V38-D54 HydrophobicContact CG1-CB 3.96Å; V38-L55 WeakPolarHBondContact CG1-O 3.17Å; V38-L56 HydrophobicContact CG1-CD2 4.4Å
39	D	73.1	Confident	78	Confident	95 Å²	95	103.5 Å²	103.5	51%	0.508	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.8	115	172.5	-73.2	-33.2	0	0	0	108.2	L55	D39-L55 WeakPolarHBondContact O-CB 2.92Å; D39-L55 PolarHBondContact O-N 3.15Å
40	S	71.8	Confident	78.3	Confident	62 Å²	62	107.3 Å²	107.3	43%	0.434	55%	0.551	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-90.7	132.1	176.5	-49	0	0	0	0	109.2	V38 D54	V38-S40 PolarHBondContact O-N 2.72Å; S40-D54 PolarHBondContact OG-OD1 3.24Å
41	M	76	Confident	78.6	Confident	97 Å²	97	107 Å²	107	48%	0.478	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	134.7	168.7	-74.5	-168.9	-49.1	0	0	110.2	L53 L55	M41-L53 PolarHBondContact N-O 3.26Å; M41-L53 PolarHBondContact O-N 2.99Å; M41-L55 HydrophobicContact CE-CD1 3.48Å; M41-L55 VanDerWaalsContact CE-CD1 3.48Å; M41-L55 HydrophobicContact CE-CD2 3.64Å; M41-L55 HydrophobicContact CE-CG 3.71Å; M41-L55 HydrophobicContact CG-CD1 3.9Å; M41-L55 HydrophobicContact CG-CG 4.37Å; M41-L55 HydrophobicContact SD-CD1 3.73Å; M41-L55 HydrophobicContact SD-CG 4.49Å
42	E	75.3	Confident	78.6	Confident	168 Å²	168	107.4 Å²	107.4	79%	0.785	55%	0.552	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-96	135.6	173.6	-62.5	177	-177.5	0	0	109.8
43	G	81.7	Confident	78.6	Confident	34 Å²	34	106.5 Å²	106.5	35%	0.351	55%	0.55	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140	158.5	173.8	0	0	0	0	0	111.9	I51	G43-I51 PolarHBondContact N-O 2.83Å; G43-I51 PolarHBondContact O-N 3.2Å
44	E	84.5	Confident	78.8	Confident	132 Å²	132	108.9 Å²	108.9	62%	0.617	55%	0.554	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-108.7	127.5	173.7	-171.3	177.3	-177.7	0	0	108.8	G48	E44-G48 WeakPolarHBondContact OE1-CA 3.15Å
45	A	81.1	Confident	78.5	Confident	24 Å²	24	104.2 Å²	104.2	20%	0.198	53%	0.534	C	S	.	.			trans	-76.3	162.2	175	0	0	0	0	0	111	D47 G48 R49 I51	A45-D47 WeakPolarHBondContact CB-OD1 3.28Å; A45-D47 PolarHBondContact O-N 3.21Å; A45-G48 PolarHBondContact O-N 2.78Å; A45-R49 PolarHBondContact N-O 2.73Å; A45-I51 HydrophobicContact CB-CD1 3.59Å; A45-I51 HydrophobicContact CB-CG1 4.16Å
46	D	88	Confident	78.3	Confident	185 Å²	185	105.5 Å²	105.5	99%	0.989	54%	0.54	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-19.9	178.8	-65.4	-22.7	0	0	0	114
47	D	91.7	Very high	78	Confident	94 Å²	94	107.5 Å²	107.5	50%	0.503	55%	0.547	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	6.8	175.5	66.6	12.1	0	0	0	114.1	A45 R49	A45-D47 WeakPolarHBondContact CB-OD1 3.28Å; A45-D47 PolarHBondContact O-N 3.21Å; D47-R49 VanDerWaalsContact C-N 3.31Å; D47-R49 VanDerWaalsContact CG-NE 3.33Å; D47-R49 VanDerWaalsContact OD1-CB 3.26Å; D47-R49 WeakPolarHBondContact OD1-CB 3.1Å; D47-R49 WeakPolarHBondContact OD1-CG 3.27Å; D47-R49 PolarHBondContact OD1-N 3.19Å; D47-R49 VanDerWaalsContact OD1-N 3.09Å; D47-R49 IonicContact OD1-NE 3.22Å; D47-R49 PolarHBondContact OD1-NE 2.75Å; D47-R49 IonicContact OD2-CZ 3.13Å; D47-R49 IonicContact OD2-NE 2.78Å; D47-R49 PolarHBondContact OD2-NE 2.7Å; D47-R49 IonicContact OD2-NH2 2.71Å; D47-R49 PolarHBondContact OD2-NH2 3.39Å
48	G	87	Confident	77.7	Confident	37 Å²	37	103.8 Å²	103.8	38%	0.381	54%	0.543	S	S	.	.	S	Bend	trans	78.8	7.2	179.4	0	0	0	0	0	114.5	E44 A45	E44-G48 WeakPolarHBondContact OE1-CA 3.15Å; A45-G48 PolarHBondContact O-N 2.78Å
49	R	87.4	Confident	77.4	Confident	171 Å²	171	106.2 Å²	106.2	65%	0.645	56%	0.562	S	S	*	*			trans	-78.8	136.2	173.9	-68	-174.2	-69.3	167.7	-3.3	110.6	A45 D47	A45-R49 PolarHBondContact N-O 2.73Å; D47-R49 VanDerWaalsContact C-N 3.31Å; D47-R49 VanDerWaalsContact CG-NE 3.33Å; D47-R49 VanDerWaalsContact OD1-CB 3.26Å; D47-R49 WeakPolarHBondContact OD1-CB 3.1Å; D47-R49 WeakPolarHBondContact OD1-CG 3.27Å; D47-R49 PolarHBondContact OD1-N 3.19Å; D47-R49 VanDerWaalsContact OD1-N 3.09Å; D47-R49 IonicContact OD1-NE 3.22Å; D47-R49 PolarHBondContact OD1-NE 2.75Å; D47-R49 IonicContact OD2-CZ 3.13Å; D47-R49 IonicContact OD2-NE 2.78Å; D47-R49 PolarHBondContact OD2-NE 2.7Å; D47-R49 IonicContact OD2-NH2 2.71Å; D47-R49 PolarHBondContact OD2-NH2 3.39Å
50	Y	83.1	Confident	76.6	Confident	187 Å²	187	103.8 Å²	103.8	73%	0.733	56%	0.56	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-70.9	130.4	168.5	-74.1	-89.8	0	0	0	109.8
51	I	81.7	Confident	75.9	Confident	80 Å²	80	105.3 Å²	105.3	41%	0.41	58%	0.576	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-120.1	118.5	173.9	-57.3	178.2	0	0	0	106.9	G43 A45 L53	G43-I51 PolarHBondContact N-O 2.83Å; G43-I51 PolarHBondContact O-N 3.2Å; A45-I51 HydrophobicContact CB-CD1 3.59Å; A45-I51 HydrophobicContact CB-CG1 4.16Å; I51-L53 HydrophobicContact CG2-CD2 3.67Å; I51-L53 HydrophobicContact CG2-CG 3.98Å
52	E	80.9	Confident	75.1	Confident	131 Å²	131	107.1 Å²	107.1	61%	0.612	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-92.6	128	168.2	-172.8	173.7	-163.8	0	0	108.1
53	L	76.8	Confident	74.4	Confident	100 Å²	100	106.7 Å²	106.7	52%	0.524	59%	0.591	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-117.6	120.8	179	-62.8	177.4	0	0	0	109.2	M41 I51 L55	M41-L53 PolarHBondContact N-O 3.26Å; M41-L53 PolarHBondContact O-N 2.99Å; I51-L53 HydrophobicContact CG2-CD2 3.67Å; I51-L53 HydrophobicContact CG2-CG 3.98Å; L53-L55 PolarHBondContact O-N 2.73Å
54	D	76.7	Confident	73.4	Confident	108 Å²	108	112.9 Å²	112.9	58%	0.578	61%	0.611	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-80.5	113.1	172.9	-71.5	-29.5	0	0	0	109.8	V38 S40 L56	V38-D54 HydrophobicContact CG1-CB 3.96Å; S40-D54 PolarHBondContact OG-OD1 3.24Å; D54-L56 PolarHBondContact O-N 2.89Å
55	L	70.7	Confident	72.3	Confident	58 Å²	58	111.3 Å²	111.3	30%	0.304	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-84.1	104.3	173.6	-65.7	-179.5	0	0	0	109.8	V38 D39 M41 L53 I57	V38-L55 WeakPolarHBondContact CG1-O 3.17Å; D39-L55 WeakPolarHBondContact O-CB 2.92Å; D39-L55 PolarHBondContact O-N 3.15Å; M41-L55 HydrophobicContact CE-CD1 3.48Å; M41-L55 VanDerWaalsContact CE-CD1 3.48Å; M41-L55 HydrophobicContact CE-CD2 3.64Å; M41-L55 HydrophobicContact CE-CG 3.71Å; M41-L55 HydrophobicContact CG-CD1 3.9Å; M41-L55 HydrophobicContact CG-CG 4.37Å; M41-L55 HydrophobicContact SD-CD1 3.73Å; M41-L55 HydrophobicContact SD-CG 4.49Å; L53-L55 PolarHBondContact O-N 2.73Å; L55-I57 HydrophobicContact CB-CD1 4.33Å; L55-I57 HydrophobicContact CB-CG1 3.84Å; L55-I57 HydrophobicContact CD1-CD1 4.16Å; L55-I57 HydrophobicContact CD1-CG1 4.44Å; L55-I57 PolarHBondContact O-N 3.32Å
56	L	68	Low	71.5	Confident	150 Å²	150	118 Å²	118	79%	0.785	64%	0.644	S	S	*	*			trans	-72.8	67.6	164.9	-62.4	173.5	0	0	0	109.4	V38 D54 P58	V38-L56 HydrophobicContact CG1-CD2 4.4Å; D54-L56 PolarHBondContact O-N 2.89Å; L56-P58 VanDerWaalsContact O-CD 3.27Å; L56-P58 WeakPolarHBondContact O-CD 3.35Å
57	I	65.4	Low	70.2	Confident	102 Å²	102	117.7 Å²	117.7	52%	0.523	64%	0.636	S	S	.	*			trans	-73.1	117.5	168.3	-50.3	-177.7	0	0	0	105.6	L55 S59	L55-I57 HydrophobicContact CB-CD1 4.33Å; L55-I57 HydrophobicContact CB-CG1 3.84Å; L55-I57 HydrophobicContact CD1-CD1 4.16Å; L55-I57 HydrophobicContact CD1-CG1 4.44Å; L55-I57 PolarHBondContact O-N 3.32Å; I57-S59 PolarHBondContact O-N 3.07Å
58	P	62.6	Low	68.9	Low	115 Å²	115	119.7 Å²	119.7	75%	0.747	65%	0.645	S	S	*	*			trans	-58.9	110.5	167	24	-29.6	0	0	0	106.3	L56 G60	L56-P58 VanDerWaalsContact O-CD 3.27Å; L56-P58 WeakPolarHBondContact O-CD 3.35Å; P58-G60 PolarHBondContact O-N 2.81Å
59	S	61.1	Low	67.8	Low	100 Å²	100	123.1 Å²	123.1	70%	0.699	66%	0.661	S	S	*	*			trans	-69.1	73.6	168.9	49.7	0	0	0	0	107	I57 A61	I57-S59 PolarHBondContact O-N 3.07Å; S59-A61 PolarHBondContact O-N 2.81Å
60	G	57.7	Low	66.6	Low	45 Å²	45	119.2 Å²	119.2	46%	0.464	66%	0.656	S	S	.	*			trans	-64.3	86.4	177.9	0	0	0	0	0	108.5	P58 N62	P58-G60 PolarHBondContact O-N 2.81Å; G60-N62 PolarHBondContact O-N 2.86Å
61	A	57.5	Low	65.8	Low	94 Å²	94	117 Å²	117	78%	0.777	66%	0.657	S	S	*	*	S	Bend	trans	-64.8	-5.8	161	0	0	0	0	0	111.5	S59	S59-A61 PolarHBondContact O-N 2.81Å
62	N	58.7	Low	65.1	Low	134 Å²	134	121.2 Å²	121.2	72%	0.717	67%	0.673	S	S	*	*			trans	-105.2	89.6	170	-49.2	-41.8	0	0	0	107.1	G60 E64	G60-N62 PolarHBondContact O-N 2.86Å; N62-E64 PolarHBondContact O-N 3.46Å
63	D	59.9	Low	64.5	Low	159 Å²	159	120 Å²	120	85%	0.85	68%	0.679	S	S	*	*			trans	-66.2	46	164	-67.7	-52	0	0	0	110.4	P65	D63-P65 VanDerWaalsContact O-CD 3.28Å; D63-P65 WeakPolarHBondContact O-CD 3.2Å
64	E	61.3	Low	63.7	Low	164 Å²	164	122.3 Å²	122.3	77%	0.766	69%	0.691	S	S	*	*			trans	-74.3	114.4	174	-151.1	170.2	-152.9	0	0	105.8	N62 L66	N62-E64 PolarHBondContact O-N 3.46Å; E64-L66 PolarHBondContact O-N 2.94Å
65	P	62.2	Low	62.9	Low	99 Å²	99	123 Å²	123	64%	0.643	70%	0.704	S	S	*	*			trans	-56.2	131.3	179.8	22.2	-30.6	0	0	0	107.8	D63 E67	D63-P65 VanDerWaalsContact O-CD 3.28Å; D63-P65 WeakPolarHBondContact O-CD 3.2Å; P65-E67 PolarHBondContact O-N 2.9Å
66	L	64	Low	62.1	Low	165 Å²	165	125 Å²	125	86%	0.864	72%	0.724	S	S	*	*			trans	-60.6	94.3	172.1	-68.4	171.5	0	0	0	107.2	E64 I68	E64-L66 PolarHBondContact O-N 2.94Å; L66-I68 PolarHBondContact O-N 3.36Å
67	E	60.1	Low	61.3	Low	179 Å²	179	123.5 Å²	123.5	84%	0.836	72%	0.721	S	S	*	*			trans	-66	90.2	170.9	-71.2	-171.1	171.7	0	0	106.8	P65 P69	P65-E67 PolarHBondContact O-N 2.9Å; E67-P69 VanDerWaalsContact O-CD 3.28Å; E67-P69 WeakPolarHBondContact O-CD 3.2Å
68	I	64.8	Low	60.8	Low	135 Å²	135	127.3 Å²	127.3	69%	0.692	74%	0.736	S	S	*	*			trans	-64.9	120.6	167.2	-56.3	172.5	0	0	0	104.9	L66 V70	L66-I68 PolarHBondContact O-N 3.36Å; I68-V70 HydrophobicContact CB-CG2 4.23Å; I68-V70 HydrophobicContact CG2-CG2 3.9Å; I68-V70 PolarHBondContact O-N 3.42Å
69	P	64.4	Low	60.5	Low	110 Å²	110	129.2 Å²	129.2	71%	0.714	74%	0.74	S	S	*	*			trans	-70.4	81.3	176.1	28.8	-33.4	0	0	0	108.5	E67 N71	E67-P69 VanDerWaalsContact O-CD 3.28Å; E67-P69 WeakPolarHBondContact O-CD 3.2Å; P69-N71 VanDerWaalsContact C-N 3.27Å; P69-N71 PolarHBondContact O-N 2.91Å; P69-N71 VanDerWaalsContact O-N 3.08Å
70	V	61.2	Low	59.8	Low	88 Å²	88	132.5 Å²	132.5	53%	0.533	74%	0.744	S	S	.	*			trans	-80.9	85.1	169.2	-172.2	0	0	0	0	106.4	I68 F72	I68-V70 HydrophobicContact CB-CG2 4.23Å; I68-V70 HydrophobicContact CG2-CG2 3.9Å; I68-V70 PolarHBondContact O-N 3.42Å; V70-F72 VanDerWaalsContact C-N 3.34Å; V70-F72 HydrophobicContact CB-CE2 4.17Å; V70-F72 HydrophobicContact CG1-CD1 4.44Å; V70-F72 HydrophobicContact CG1-CD2 3.9Å; V70-F72 HydrophobicContact CG1-CE1 4.03Å; V70-F72 HydrophobicContact CG1-CE2 3.43Å; V70-F72 VanDerWaalsContact CG1-CE2 3.43Å; V70-F72 HydrophobicContact CG1-CG 4.39Å; V70-F72 HydrophobicContact CG1-CZ 3.51Å; V70-F72 PolarHBondContact O-N 2.88Å
71	N	66.9	Low	59.3	Low	141 Å²	141	137.1 Å²	137.1	75%	0.754	76%	0.759	S	S	*	*			trans	-71.7	93.7	167.6	-74.5	-24	0	0	0	108	P69 S73	P69-N71 VanDerWaalsContact C-N 3.27Å; P69-N71 PolarHBondContact O-N 2.91Å; P69-N71 VanDerWaalsContact O-N 3.08Å; N71-S73 VanDerWaalsContact C-N 3.32Å; N71-S73 PolarHBondContact O-N 2.95Å
72	F	67	Low	58.8	Low	169 Å²	169	138.6 Å²	138.6	74%	0.741	76%	0.763	S	S	*	*			trans	-66.1	100.8	158.4	-64.1	-78.7	0	0	0	106.4	V70 D74	V70-F72 VanDerWaalsContact C-N 3.34Å; V70-F72 HydrophobicContact CB-CE2 4.17Å; V70-F72 HydrophobicContact CG1-CD1 4.44Å; V70-F72 HydrophobicContact CG1-CD2 3.9Å; V70-F72 HydrophobicContact CG1-CE1 4.03Å; V70-F72 HydrophobicContact CG1-CE2 3.43Å; V70-F72 VanDerWaalsContact CG1-CE2 3.43Å; V70-F72 HydrophobicContact CG1-CG 4.39Å; V70-F72 HydrophobicContact CG1-CZ 3.51Å; V70-F72 PolarHBondContact O-N 2.88Å; F72-D74 VanDerWaalsContact C-N 3.3Å; F72-D74 PolarHBondContact O-N 2.9Å
73	S	68.7	Low	58.2	Low	106 Å²	106	138 Å²	138	74%	0.741	77%	0.77	S	S	*	*			trans	-71.5	94.5	170.7	-61.8	0	0	0	0	106.8	N71 S75	N71-S73 VanDerWaalsContact C-N 3.32Å; N71-S73 PolarHBondContact O-N 2.95Å; S73-S75 PolarHBondContact O-N 3.21Å
74	D	59.6	Low	57.7	Low	148 Å²	148	135.9 Å²	135.9	79%	0.791	77%	0.767	S	S	*	*			trans	-64.6	91.4	165.6	-71.9	-33	0	0	0	107.2	F72 S76	F72-D74 VanDerWaalsContact C-N 3.3Å; F72-D74 PolarHBondContact O-N 2.9Å; D74-S76 PolarHBondContact O-N 2.9Å
75	S	58.8	Low	56.6	Low	121 Å²	121	137.5 Å²	137.5	85%	0.846	78%	0.775	S	S	*	*			trans	-65.1	104.3	173.5	64.3	0	0	0	0	108.2	S73	S73-S75 PolarHBondContact O-N 3.21Å
76	S	54	Low	55.8	Low	102 Å²	102	137.7 Å²	137.7	71%	0.713	78%	0.779	S	S	*	*			trans	-89.8	142.2	165	47.1	0	0	0	0	109	D74	D74-S76 PolarHBondContact O-N 2.9Å
77	T	51.6	Low	54.8	Low	118 Å²	118	138.7 Å²	138.7	72%	0.724	78%	0.779	S	S	*	*			trans	133.9	112.1	157.8	46.3	0	0	0	0	108.8
78	E	55.5	Low	54.1	Low	182 Å²	182	134.3 Å²	134.3	85%	0.85	77%	0.768	S	S	*	*			trans	-146.1	126.6	136.9	-71.5	-63.8	79.1	0	0	105.3
79	D	54.7	Low	53.8	Low	154 Å²	154	135.1 Å²	135.1	82%	0.824	77%	0.769	S	S	*	*			trans	-63.1	153.1	-168.5	-70	-87.8	0	0	0	115.3
80	E	48.3	Very low	53.3	Low	169 Å²	169	138.2 Å²	138.2	79%	0.79	77%	0.771	S	S	*	*			trans	-66.8	148.3	170.1	-65.5	-83.5	113.1	0	0	111.7
81	D	45.9	Very low	53.3	Low	143 Å²	143	143.6 Å²	143.6	77%	0.765	78%	0.782	S	S	*	*			trans	75.1	92.9	159.9	-61.6	-36	0	0	0	119.3
82	S	47.4	Very low	52.8	Low	125 Å²	125	145.1 Å²	145.1	87%	0.874	79%	0.785	S	S	*	*				-166.4	122.9	123.6	-81.5	0	0	0	0	112.2	S84	S82-S84 PolarHBondContact O-N 3.19Å
83	S	46.4	Very low	52.4	Low	121 Å²	121	144 Å²	144	85%	0.846	79%	0.785	S	S	*	*			trans	-57.7	127.5	178.7	-46.1	0	0	0	0	112.8
84	S	48.1	Very low	51.7	Low	115 Å²	115	145.7 Å²	145.7	80%	0.804	78%	0.784	S	S	*	*			trans	-159.4	105.9	151.6	-78.5	0	0	0	0	108.7	S82 S86	S82-S84 PolarHBondContact O-N 3.19Å; S84-S86 PolarHBondContact O-N 3.05Å; S84-S86 VanDerWaalsContact O-N 3.15Å
85	E	38.6	Very low	51.8	Low	197 Å²	197	145.3 Å²	145.3	92%	0.921	78%	0.781	S	S	*	*			trans	-63.5	107.2	171	-55.8	-153.6	103.2	0	0	108.9
86	S	45.6	Very low	51.3	Low	104 Å²	104	145 Å²	145	73%	0.727	78%	0.775	S	S	*	*			trans	-164.7	118.5	169.5	-78.2	0	0	0	0	110.7	S84	S84-S86 PolarHBondContact O-N 3.05Å; S84-S86 VanDerWaalsContact O-N 3.15Å
87	E	42.8	Very low	51.2	Low	186 Å²	186	144.3 Å²	144.3	87%	0.869	77%	0.771	S	S	*	*			trans	66.2	87.7	151.1	-29.5	-138.7	115.1	0	0	114.9	E89	E87-E89 VanDerWaalsContact C-N 3.3Å; E87-E89 PolarHBondContact O-N 2.85Å
88	S	46.2	Very low	51.3	Low	87 Å²	87	144.3 Å²	144.3	61%	0.608	77%	0.773	S	S	*	*			trans	-62.3	90.2	170.8	-169.8	0	0	0	0	110.3	F90	S88-F90 PolarHBondContact O-N 2.78Å; S88-F90 WeakPolarHBondContact OG-CD2 3.49Å; S88-F90 WeakPolarHBondContact OG-CE2 3.45Å; S88-F90 WeakPolarHBondContact OG-CZ 3.32Å
89	E	57.9	Low	50.9	Low	151 Å²	151	141.2 Å²	141.2	71%	0.706	77%	0.766	S	S	*	*			trans	-71.5	75	163	-171.5	175.5	-150.5	0	0	107.4	E87 R91	E87-E89 VanDerWaalsContact C-N 3.3Å; E87-E89 PolarHBondContact O-N 2.85Å; E89-R91 VanDerWaalsContact C-N 3.32Å; E89-R91 PolarHBondContact O-N 2.71Å; E89-R91 IonicContact OE2-NH2 3.94Å
90	F	53.4	Low	50.7	Low	176 Å²	176	144.4 Å²	144.4	77%	0.772	77%	0.767	S	S	*	*			trans	-57.7	102.3	165.8	-70.3	-77.2	0	0	0	107.2	S88 E92	S88-F90 PolarHBondContact O-N 2.78Å; S88-F90 WeakPolarHBondContact OG-CD2 3.49Å; S88-F90 WeakPolarHBondContact OG-CE2 3.45Å; S88-F90 WeakPolarHBondContact OG-CZ 3.32Å; F90-E92 PolarHBondContact O-N 2.8Å
91	R	61.3	Low	50.8	Low	201 Å²	201	144.4 Å²	144.4	76%	0.758	77%	0.771	S	S	*	*			trans	-67.1	92.2	167.8	-66.5	-179.7	-179.3	-117	-7.7	106.5	E89 I93	E89-R91 VanDerWaalsContact C-N 3.32Å; E89-R91 PolarHBondContact O-N 2.71Å; E89-R91 IonicContact OE2-NH2 3.94Å; R91-I93 PolarHBondContact O-N 3.22Å
92	E	56.6	Low	50.7	Low	172 Å²	172	142.4 Å²	142.4	80%	0.804	77%	0.769	S	S	*	*			trans	-56.3	108.3	170.2	-172.7	173.8	-166.9	0	0	107.1	F90 I94	F90-E92 PolarHBondContact O-N 2.8Å; E92-I94 VanDerWaalsContact C-N 3.28Å; E92-I94 PolarHBondContact O-N 2.84Å
93	I	59.3	Low	50.8	Low	146 Å²	146	141.6 Å²	141.6	75%	0.749	76%	0.763	S	S	*	*			trans	-71.1	94.7	176	-58.8	169.9	0	0	0	105.3	R91 I95	R91-I93 PolarHBondContact O-N 3.22Å; I93-I95 VanDerWaalsContact C-N 3.27Å; I93-I95 HydrophobicContact CG2-CG1 4.48Å; I93-I95 PolarHBondContact O-N 2.8Å
94	I	54.4	Low	51	Low	142 Å²	142	140.2 Å²	140.2	73%	0.728	76%	0.759	S	S	*	*			trans	-65.9	93.8	173.1	-55.5	174.3	0	0	0	106.4	E92 P96	E92-I94 VanDerWaalsContact C-N 3.28Å; E92-I94 PolarHBondContact O-N 2.84Å; I94-P96 WeakPolarHBondContact O-CD 3.26Å
95	I	61.5	Low	51	Low	139 Å²	139	140 Å²	140	71%	0.713	75%	0.753	S	S	*	*			trans	-65.8	115.6	164.1	-60.7	173.1	0	0	0	104.9	I93 S97	I93-I95 VanDerWaalsContact C-N 3.27Å; I93-I95 HydrophobicContact CG2-CG1 4.48Å; I93-I95 PolarHBondContact O-N 2.8Å; I95-S97 VanDerWaalsContact C-N 3.34Å; I95-S97 PolarHBondContact O-N 2.98Å
96	P	48	Very low	51.7	Low	114 Å²	114	135.1 Å²	135.1	74%	0.74	74%	0.74	S	S	*	*			trans	-62.2	102.7	175.7	24	-30.2	0	0	0	107.6	I94	I94-P96 WeakPolarHBondContact O-CD 3.26Å
97	S	51.7	Low	52.1	Low	89 Å²	89	135.6 Å²	135.6	62%	0.622	74%	0.741	S	S	*	*			trans	-54.6	135.1	169.2	178.1	0	0	0	0	107.1	I95 V99	I95-S97 VanDerWaalsContact C-N 3.34Å; I95-S97 PolarHBondContact O-N 2.98Å; S97-V99 PolarHBondContact O-N 3.44Å
98	P	53.2	Low	52.8	Low	118 Å²	118	133.7 Å²	133.7	77%	0.766	74%	0.736	S	S	*	*			trans	-61.3	93.8	177	24.7	-32.1	0	0	0	107.8	R100	P98-R100 PolarHBondContact O-N 3.11Å
99	V	47.5	Very low	53.1	Low	117 Å²	117	134.7 Å²	134.7	71%	0.709	74%	0.741	S	S	*	*			trans	-58	108.2	170.9	175.8	0	0	0	0	103.9	S97 L101	S97-V99 PolarHBondContact O-N 3.44Å; V99-L101 VanDerWaalsContact C-N 3.29Å; V99-L101 PolarHBondContact O-N 3.13Å
100	R	49.6	Very low	53.1	Low	221 Å²	221	130.7 Å²	130.7	83%	0.834	73%	0.728	S	S	*	*			trans	-44.3	105.8	163	-68.5	-92.1	-179	148.4	-1.7	104.3	P98 S102	P98-R100 PolarHBondContact O-N 3.11Å; R100-S102 PolarHBondContact O-N 3Å; R100-S102 PolarHBondContact O-OG 2.75Å
101	L	50.5	Low	53.8	Low	169 Å²	169	126.3 Å²	126.3	89%	0.885	72%	0.719	S	S	*	*			trans	-64	83.1	178.8	-67.1	173.7	0	0	0	106	V99 S103	V99-L101 VanDerWaalsContact C-N 3.29Å; V99-L101 PolarHBondContact O-N 3.13Å; L101-S103 PolarHBondContact O-N 2.85Å
102	S	44.4	Very low	54.3	Low	101 Å²	101	125.3 Å²	125.3	71%	0.706	72%	0.715	S	S	*	*			trans	-59.1	110	164.7	-50	0	0	0	0	102.7	R100 A104	R100-S102 PolarHBondContact O-N 3Å; R100-S102 PolarHBondContact O-OG 2.75Å; S102-A104 VanDerWaalsContact C-N 3.25Å; S102-A104 PolarHBondContact O-N 2.86Å
103	S	49.6	Very low	55.3	Low	107 Å²	107	123.1 Å²	123.1	75%	0.748	70%	0.703	S	S	*	*			trans	-34.1	87.2	-178	-173.5	0	0	0	0	111.5	L101 V105	L101-S103 PolarHBondContact O-N 2.85Å; S103-V105 PolarHBondContact O-N 2.87Å
104	A	51.2	Low	56	Low	93 Å²	93	121.2 Å²	121.2	77%	0.769	69%	0.694	S	S	*	*			trans	-79	87.5	165.2	0	0	0	0	0	102.3	S102 S106	S102-A104 VanDerWaalsContact C-N 3.25Å; S102-A104 PolarHBondContact O-N 2.86Å; A104-S106 PolarHBondContact O-N 3.09Å
105	V	47.3	Very low	57	Low	111 Å²	111	118.9 Å²	118.9	67%	0.673	68%	0.681	S	S	*	*			trans	-54.8	94.2	166.5	177.9	0	0	0	0	104.9	S103 P107	S103-V105 PolarHBondContact O-N 2.87Å; V105-P107 VanDerWaalsContact O-N 3.14Å
106	S	53.1	Low	57.8	Low	94 Å²	94	118 Å²	118	66%	0.657	68%	0.675	S	S	*	*			trans	-50.1	123.2	169.5	36.9	0	0	0	0	105.5	A104 L108	A104-S106 PolarHBondContact O-N 3.09Å; S106-L108 PolarHBondContact O-N 2.68Å
107	P	55.5	Low	59.3	Low	114 Å²	114	117.5 Å²	117.5	74%	0.74	66%	0.662	S	S	*	*			trans	-53	125.4	-176.1	19.8	-29.7	0	0	0	106.7	V105 C109	V105-P107 VanDerWaalsContact O-N 3.14Å; P107-C109 VanDerWaalsContact C-N 3.28Å; P107-C109 PolarHBondContact O-N 3.33Å
108	L	56.9	Low	60.5	Low	146 Å²	146	119 Å²	119	76%	0.764	66%	0.662	S	S	*	*			trans	-52.4	98.4	-178.6	-130.5	88.3	0	0	0	106.6	S106 T110	S106-L108 PolarHBondContact O-N 2.68Å; L108-T110 HydrophobicContact CB-CG2 4.23Å; L108-T110 HydrophobicContact CD2-CG2 3.81Å; L108-T110 HydrophobicContact CG-CG2 4.42Å; L108-T110 PolarHBondContact O-N 2.69Å
109	C	52.5	Low	61.5	Low	107 Å²	107	120.7 Å²	120.7	72%	0.723	66%	0.658	S	S	*	*			trans	-68.2	78.9	167	-100.1	0	0	0	0	104.9	P107 S111	P107-C109 VanDerWaalsContact C-N 3.28Å; P107-C109 PolarHBondContact O-N 3.33Å; C109-S111 PolarHBondContact O-N 3.2Å
110	T	58.6	Low	62.7	Low	68 Å²	68	119.5 Å²	119.5	42%	0.417	66%	0.655	S	S	.	*			trans	-64.7	131.8	171.2	53.7	0	0	0	0	106.2	L108 R112 K113	L108-T110 HydrophobicContact CB-CG2 4.23Å; L108-T110 HydrophobicContact CD2-CG2 3.81Å; L108-T110 HydrophobicContact CG-CG2 4.42Å; L108-T110 PolarHBondContact O-N 2.69Å; T110-R112 PolarHBondContact O-N 3.22Å; T110-K113 PolarHBondContact O-N 3.43Å
111	S	66.6	Low	63.9	Low	84 Å²	84	114.4 Å²	114.4	59%	0.587	65%	0.648	S	S	*	*	H	α-helix	trans	-44.3	-28.4	174	48.5	0	0	0	0	112.9	C109 K113 L114 I115	C109-S111 PolarHBondContact O-N 3.2Å; S111-K113 PolarHBondContact O-N 2.94Å; S111-L114 PolarHBondContact O-N 3.48Å; S111-I115 WeakPolarHBondContact O-CD1 3.49Å; S111-I115 VanDerWaalsContact O-CG1 3.26Å; S111-I115 WeakPolarHBondContact O-CG1 3.39Å; S111-I115 PolarHBondContact O-N 3Å
112	R	72.8	Confident	64.9	Low	180 Å²	180	110.4 Å²	110.4	68%	0.679	63%	0.633	S	S	*	*	H	α-helix	trans	-55.9	-41.1	175.4	-163.5	173.7	177	148.8	0.6	114.3	T110 I115 E116	T110-R112 PolarHBondContact O-N 3.22Å; R112-I115 PolarHBondContact O-N 3.5Å; R112-E116 PolarHBondContact O-N 3.39Å
113	K	76	Confident	65.9	Low	125 Å²	125	110.3 Å²	110.3	54%	0.543	63%	0.628	S	S	.	*	H	α-helix	trans	-67.4	-42.2	178.9	-169.9	-179.1	177.1	-170.4	0	111.4	T110 S111 I115 E116 E117	T110-K113 PolarHBondContact O-N 3.43Å; S111-K113 PolarHBondContact O-N 2.94Å; K113-I115 VanDerWaalsContact C-N 3.3Å; K113-I115 PolarHBondContact O-N 3.45Å; K113-E116 PolarHBondContact O-N 3.05Å; K113-E117 WeakPolarHBondContact CE-OE1 3.39Å; K113-E117 PolarHBondContact O-N 3.28Å
114	L	74	Confident	66.6	Low	107 Å²	107	113 Å²	113	56%	0.56	63%	0.634	S	S	*	*	H	α-helix	trans	-61.5	-39.4	175.1	-73.8	166.4	0	0	0	111.7	S111 E117 L118	S111-L114 PolarHBondContact O-N 3.48Å; L114-E117 PolarHBondContact O-N 3.43Å; L114-L118 WeakPolarHBondContact O-CB 3.34Å; L114-L118 PolarHBondContact O-N 3Å
115	I	77	Confident	67	Low	92 Å²	92	114.2 Å²	114.2	47%	0.472	63%	0.628	S	S	.	*	H	α-helix	trans	-66.8	-40.9	177.6	-66.1	161.9	0	0	0	111.5	S111 R112 K113 L118 K119	S111-I115 WeakPolarHBondContact O-CD1 3.49Å; S111-I115 VanDerWaalsContact O-CG1 3.26Å; S111-I115 WeakPolarHBondContact O-CG1 3.39Å; S111-I115 PolarHBondContact O-N 3Å; R112-I115 PolarHBondContact O-N 3.5Å; K113-I115 VanDerWaalsContact C-N 3.3Å; K113-I115 PolarHBondContact O-N 3.45Å; I115-L118 PolarHBondContact O-N 2.88Å; I115-K119 HydrophobicContact CG2-CD 4.47Å; I115-K119 WeakPolarHBondContact O-CB 3.47Å; I115-K119 WeakPolarHBondContact O-CG 3.26Å; I115-K119 PolarHBondContact O-N 2.63Å
116	E	78.1	Confident	67.6	Low	122 Å²	122	114.6 Å²	114.6	57%	0.57	63%	0.634	S	S	*	*	H	α-helix	trans	-64.8	-43.3	175.5	-90.2	176	-176.9	0	0	112.1	R112 K113 L118 K119 S120	R112-E116 PolarHBondContact O-N 3.39Å; K113-E116 PolarHBondContact O-N 3.05Å; E116-L118 PolarHBondContact O-N 2.66Å; E116-K119 PolarHBondContact O-N 3.3Å; E116-S120 PolarHBondContact O-N 3.04Å
117	E	78.5	Confident	67.7	Low	102 Å²	102	117.4 Å²	117.4	48%	0.477	64%	0.64	S	S	.	*	H	α-helix	trans	-60.1	-45.3	174.1	-75.4	176.4	-173.9	0	0	111	K113 L114 K119 S120 V121	K113-E117 WeakPolarHBondContact CE-OE1 3.39Å; K113-E117 PolarHBondContact O-N 3.28Å; L114-E117 PolarHBondContact O-N 3.43Å; E117-K119 PolarHBondContact O-N 2.97Å; E117-S120 PolarHBondContact O-N 3.24Å; E117-S120 PolarHBondContact O-OG 2.73Å; E117-V121 PolarHBondContact O-N 2.71Å
118	L	78.5	Confident	67.4	Low	120 Å²	120	122.8 Å²	122.8	63%	0.628	66%	0.66	S	S	*	*	H	α-helix	trans	-63.5	-41.7	179.1	-148	81.5	0	0	0	112.4	L114 I115 E116 S120 V121 C122	L114-L118 WeakPolarHBondContact O-CB 3.34Å; L114-L118 PolarHBondContact O-N 3Å; I115-L118 PolarHBondContact O-N 2.88Å; E116-L118 PolarHBondContact O-N 2.66Å; L118-S120 VanDerWaalsContact C-N 3.25Å; L118-S120 PolarHBondContact O-N 2.8Å; L118-V121 PolarHBondContact O-N 2.72Å; L118-V121 VanDerWaalsContact O-N 3.11Å; L118-C122 PolarHBondContact O-N 3.39Å; L118-C122 VanDerWaalsContact O-N 3.13Å
119	K	73.8	Confident	67.9	Low	155 Å²	155	121.6 Å²	121.6	67%	0.674	66%	0.655	S	S	*	*	H	α-helix	trans	-61.4	-32.9	177	-81	-176.2	177.3	-173.3	0	112.9	I115 E116 E117 V121	I115-K119 HydrophobicContact CG2-CD 4.47Å; I115-K119 WeakPolarHBondContact O-CB 3.47Å; I115-K119 WeakPolarHBondContact O-CG 3.26Å; I115-K119 PolarHBondContact O-N 2.63Å; E116-K119 PolarHBondContact O-N 3.3Å; E117-K119 PolarHBondContact O-N 2.97Å; K119-V121 VanDerWaalsContact C-N 3.28Å
120	S	72.6	Confident	68.7	Low	92 Å²	92	122.4 Å²	122.4	64%	0.643	65%	0.651	S	S	*	*	H	α-helix	trans	-71.1	-24.8	177.1	75.4	0	0	0	0	113.5	E116 E117 L118	E116-S120 PolarHBondContact O-N 3.04Å; E117-S120 PolarHBondContact O-N 3.24Å; E117-S120 PolarHBondContact O-OG 2.73Å; L118-S120 VanDerWaalsContact C-N 3.25Å; L118-S120 PolarHBondContact O-N 2.8Å
121	V	75.3	Confident	69.3	Low	114 Å²	114	125.4 Å²	125.4	69%	0.691	67%	0.665	S	S	*	*	H	α-helix	trans	-87.8	-29.2	-179.2	178.6	0	0	0	0	111.4	E117 L118 K119 T123	E117-V121 PolarHBondContact O-N 2.71Å; L118-V121 PolarHBondContact O-N 2.72Å; L118-V121 VanDerWaalsContact O-N 3.11Å; K119-V121 VanDerWaalsContact C-N 3.28Å; V121-T123 PolarHBondContact O-N 3.04Å
122	C	70	Confident	69.4	Low	84 Å²	84	127.8 Å²	127.8	57%	0.568	67%	0.669	S	S	*	*			trans	-73.5	87.8	170.6	-65.3	0	0	0	0	109.9	L118	L118-C122 PolarHBondContact O-N 3.39Å; L118-C122 VanDerWaalsContact O-N 3.13Å
123	T	65.7	Low	69.2	Low	99 Å²	99	124.6 Å²	124.6	61%	0.607	67%	0.668	S	S	*	*			trans	-68.3	131	161.6	53	0	0	0	0	108	V121 D125	V121-T123 PolarHBondContact O-N 3.04Å; T123-D125 WeakPolarHBondContact CB-OD2 3.49Å; T123-D125 PolarHBondContact O-N 3.35Å; T123-D125 PolarHBondContact OG1-OD2 2.92Å
124	D	63.6	Low	68.8	Low	164 Å²	164	124.5 Å²	124.5	88%	0.877	68%	0.677	S	S	*	*	S	Bend	trans	-66.5	32.9	177.8	-81	-35.7	0	0	0	112.7	C126	D124-C126 PolarHBondContact O-N 2.88Å
125	D	60.9	Low	68.4	Low	119 Å²	119	125.8 Å²	125.8	64%	0.636	69%	0.685	S	S	*	*			trans	-82.2	33.8	175.4	-62.9	-42.1	0	0	0	111.5	T123 I127	T123-D125 WeakPolarHBondContact CB-OD2 3.49Å; T123-D125 PolarHBondContact O-N 3.35Å; T123-D125 PolarHBondContact OG1-OD2 2.92Å; D125-I127 PolarHBondContact O-N 3.4Å
126	C	60	Low	67.7	Low	119 Å²	119	128.4 Å²	128.4	80%	0.804	70%	0.701	S	S	*	*			trans	-72.9	73.9	156.9	-84.8	0	0	0	0	107.9	D124 I128	D124-C126 PolarHBondContact O-N 2.88Å; C126-I128 PolarHBondContact O-N 3.01Å
127	I	54.5	Low	66.9	Low	153 Å²	153	128.9 Å²	128.9	79%	0.785	71%	0.712	S	S	*	*			trans	-68.2	110.1	165.7	-55.7	176.1	0	0	0	106.2	D125	D125-I127 PolarHBondContact O-N 3.4Å
128	I	49.3	Very low	65.8	Low	226 Å²	226	131.4 Å²	131.4	100%	1.159	73%	0.734	S	S	*	*			trans	-68.5	0	170.9	-59.9	173	0	0	0	109.6	C126	C126-I128 PolarHBondContact O-N 3.01Å

Retrieved 128 of 128 residues in 70.3 ms (Link to these results)

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