C4QPR9_SCHMA Loading...

MEG-2 (ESP15) family AlphaSync

AlphaFold DB , UniProt , Accession C4QPR9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 85 aa.

						>C4QPR9_SCHMA|C4QPR9
MKLFGTSCLLIVCLIQILVPVCKSIQCNGNKCCDIDVTKSNLTTTLCCVKMVVTVDNPELTLKNYLRKAQMIDKLREAVQKLGGR
					

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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	36.4	Very low	47.9	Very low	238 Å²	238	124.9 Å²	124.9	100%	1.172	67%	0.67	S	S	*	*				0	126.4	0	-73.1	177.5	175.5	0	0	109.1
2	K	37.3	Very low	48.7	Very low	193 Å²	193	120.8 Å²	120.8	84%	0.839	65%	0.652	S	S	*	*			trans	55.9	86.8	157.5	-63.6	173.4	178.1	168.4	0	118.9
3	L	44.8	Very low	49.3	Very low	162 Å²	162	116.6 Å²	116.6	85%	0.848	64%	0.637	S	S	*	*			trans	-97	17.4	159.7	-94	120.2	0	0	0	113.3	G5	L3-G5 PolarHBondContact O-N 2.98Å
4	F	47.7	Very low	49.9	Very low	171 Å²	171	116.5 Å²	116.5	75%	0.75	63%	0.634	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.8	29.5	-175.7	-79.3	-84	0	0	0	115.1
5	G	50.7	Low	50.4	Low	48 Å²	48	115.3 Å²	115.3	50%	0.495	63%	0.626	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.9	-34.3	-173.4	0	0	0	0	0	115.3	L3	L3-G5 PolarHBondContact O-N 2.98Å
6	T	49.6	Very low	50.4	Low	105 Å²	105	116 Å²	116	64%	0.644	62%	0.623	S	S	*	*	H	α-helix	trans	-97.2	-29.2	-164.5	24.8	0	0	0	0	114.3
7	S	51.4	Low	50.7	Low	67 Å²	67	117.2 Å²	117.2	47%	0.469	63%	0.628	S	S	.	*	H	α-helix	trans	-74.8	-31.6	-179	26.1	0	0	0	0	113.3	I11	S7-I11 WeakPolarHBondContact O-CG1 3.26Å; S7-I11 PolarHBondContact O-N 3.33Å
8	C	47.7	Very low	50.8	Low	78 Å²	78	119.1 Å²	119.1	53%	0.527	64%	0.637	S	S	.	*	H	α-helix	trans	-68.6	-34.3	175.1	-80.1	0	0	0	0	112.9	L10 I11 V12	C8-L10 PolarHBondContact O-N 3.03Å; C8-I11 PolarHBondContact O-N 2.81Å; C8-V12 WeakPolarHBondContact O-CG2 3.46Å; C8-V12 PolarHBondContact O-N 3.26Å
9	L	51.2	Low	50.6	Low	113 Å²	113	117.2 Å²	117.2	59%	0.592	63%	0.63	S	S	*	*	H	α-helix	trans	-63.3	-41.9	179.3	-80.3	162.3	0	0	0	111.6	I11 V12 C13	L9-I11 VanDerWaalsContact C-N 3.34Å; L9-I11 PolarHBondContact O-N 2.95Å; L9-V12 PolarHBondContact O-N 3.46Å; L9-C13 WeakPolarHBondContact O-CB 3.37Å; L9-C13 PolarHBondContact O-N 2.77Å; L9-C13 PolarHBondContact O-SG 3.3Å
10	L	52.5	Low	50.6	Low	120 Å²	120	114.9 Å²	114.9	63%	0.628	62%	0.622	S	S	*	*	H	α-helix	trans	-63.8	-39.4	177.4	-76.5	169.1	0	0	0	112.5	C8 C13 L14	C8-L10 PolarHBondContact O-N 3.03Å; L10-C13 PolarHBondContact O-N 3.29Å; L10-L14 WeakPolarHBondContact O-CG 3.44Å; L10-L14 PolarHBondContact O-N 3.42Å
11	I	57.9	Low	50.4	Low	79 Å²	79	113.8 Å²	113.8	41%	0.405	62%	0.619	S	S	.	*	H	α-helix	trans	-67.7	-43.4	178.2	-63.2	167.7	0	0	0	110.3	S7 C8 L9 C13 L14 I15	S7-I11 WeakPolarHBondContact O-CG1 3.26Å; S7-I11 PolarHBondContact O-N 3.33Å; C8-I11 PolarHBondContact O-N 2.81Å; L9-I11 VanDerWaalsContact C-N 3.34Å; L9-I11 PolarHBondContact O-N 2.95Å; I11-C13 VanDerWaalsContact C-N 3.35Å; I11-C13 PolarHBondContact O-N 2.97Å; I11-L14 PolarHBondContact O-N 2.87Å; I11-I15 HydrophobicContact CG2-CD1 3.84Å; I11-I15 WeakPolarHBondContact O-CD1 3.4Å; I11-I15 VanDerWaalsContact O-CG1 3.23Å; I11-I15 WeakPolarHBondContact O-CG1 3.25Å; I11-I15 PolarHBondContact O-N 3.5Å
12	V	57.7	Low	50.7	Low	75 Å²	75	105 Å²	105	46%	0.455	58%	0.58	S	S	.	*	H	α-helix	trans	-64.6	-40.1	176.1	175.9	0	0	0	0	110.9	C8 L9 I15 Q16	C8-V12 WeakPolarHBondContact O-CG2 3.46Å; C8-V12 PolarHBondContact O-N 3.26Å; L9-V12 PolarHBondContact O-N 3.46Å; V12-I15 PolarHBondContact O-N 3.36Å; V12-Q16 WeakPolarHBondContact O-CG 3.32Å; V12-Q16 PolarHBondContact O-N 3.47Å
13	C	56.5	Low	51.2	Low	67 Å²	67	104.1 Å²	104.1	45%	0.453	58%	0.576	S	S	.	*	H	α-helix	trans	-61.4	-44.5	173.9	-74.9	0	0	0	0	112.1	L9 L10 I11 I15 Q16 I17	L9-C13 WeakPolarHBondContact O-CB 3.37Å; L9-C13 PolarHBondContact O-N 2.77Å; L9-C13 PolarHBondContact O-SG 3.3Å; L10-C13 PolarHBondContact O-N 3.29Å; I11-C13 VanDerWaalsContact C-N 3.35Å; I11-C13 PolarHBondContact O-N 2.97Å; C13-I15 VanDerWaalsContact C-N 3.33Å; C13-I15 PolarHBondContact O-N 3.24Å; C13-Q16 PolarHBondContact O-N 3.45Å; C13-I17 VanDerWaalsContact O-CG1 3.25Å; C13-I17 WeakPolarHBondContact O-CG1 3.46Å; C13-I17 PolarHBondContact O-N 2.93Å
14	L	56.4	Low	51.4	Low	115 Å²	115	98.3 Å²	98.3	60%	0.602	55%	0.549	S	S	*	.	H	α-helix	trans	-63.2	-38.8	176.5	-75.7	167.3	0	0	0	112.1	L10 I11 I17 L18	L10-L14 WeakPolarHBondContact O-CG 3.44Å; L10-L14 PolarHBondContact O-N 3.42Å; I11-L14 PolarHBondContact O-N 2.87Å; L14-I17 PolarHBondContact O-N 3.48Å; L14-L18 WeakPolarHBondContact O-CB 3.24Å; L14-L18 PolarHBondContact O-N 3Å
15	I	57.6	Low	51.8	Low	99 Å²	99	94 Å²	94	51%	0.508	53%	0.533	S	S	.	.	H	α-helix	trans	-66.6	-38.5	176	-65.6	163.8	0	0	0	111	I11 V12 C13 L18 V19	I11-I15 HydrophobicContact CG2-CD1 3.84Å; I11-I15 WeakPolarHBondContact O-CD1 3.4Å; I11-I15 VanDerWaalsContact O-CG1 3.23Å; I11-I15 WeakPolarHBondContact O-CG1 3.25Å; I11-I15 PolarHBondContact O-N 3.5Å; V12-I15 PolarHBondContact O-N 3.36Å; C13-I15 VanDerWaalsContact C-N 3.33Å; C13-I15 PolarHBondContact O-N 3.24Å; I15-L18 PolarHBondContact O-N 3.46Å; I15-V19 PolarHBondContact O-N 3.32Å
16	Q	51	Low	52	Low	126 Å²	126	97.6 Å²	97.6	59%	0.589	54%	0.537	S	S	*	.	H	α-helix	trans	-71	-27.7	176.1	-72.2	-160.1	8.6	0	0	113.7	V12 C13 V19	V12-Q16 WeakPolarHBondContact O-CG 3.32Å; V12-Q16 PolarHBondContact O-N 3.47Å; C13-Q16 PolarHBondContact O-N 3.45Å; Q16-V19 CarbonylContact O-C 3.46Å
17	I	55.5	Low	52.4	Low	136 Å²	136	96.2 Å²	96.2	70%	0.697	53%	0.531	S	S	*	.	H	α-helix	trans	-74.9	-37.2	171.9	-64	162.6	0	0	0	110.5	C13 L14	C13-I17 VanDerWaalsContact O-CG1 3.25Å; C13-I17 WeakPolarHBondContact O-CG1 3.46Å; C13-I17 PolarHBondContact O-N 2.93Å; L14-I17 PolarHBondContact O-N 3.48Å
18	L	52.1	Low	52.7	Low	151 Å²	151	99.8 Å²	99.8	79%	0.791	54%	0.544	S	S	*	.	H	α-helix	trans	-80.4	-26	-177.1	-152.9	75.5	0	0	0	113.3	L14 I15	L14-L18 WeakPolarHBondContact O-CB 3.24Å; L14-L18 PolarHBondContact O-N 3Å; I15-L18 PolarHBondContact O-N 3.46Å
19	V	47.8	Very low	53.3	Low	84 Å²	84	98.9 Å²	98.9	51%	0.509	55%	0.548	S	S	.	.	S	Bend	trans	-123.4	91.3	173.1	-173.2	0	0	0	0	105.6	I15 Q16 V21	I15-V19 PolarHBondContact O-N 3.32Å; Q16-V19 CarbonylContact O-C 3.46Å; V19-V21 VanDerWaalsContact C-N 3.27Å; V19-V21 WeakPolarHBondContact O-CG2 3.34Å; V19-V21 PolarHBondContact O-N 3.24Å
20	P	50	Low	53.7	Low	71 Å²	71	98.5 Å²	98.5	46%	0.461	55%	0.547	S	S	.	.			trans	-57.5	105.4	166.3	23.6	-29.2	0	0	0	105.3	C22	P20-C22 PolarHBondContact O-N 2.86Å; P20-C22 PolarHBondContact O-SG 3.33Å; P20-C22 VanDerWaalsContact O-SG 3.32Å
21	V	45.9	Very low	53.8	Low	92 Å²	92	99 Å²	99	56%	0.558	54%	0.544	S	S	*	.			trans	-69.4	81.3	176.1	-171.1	0	0	0	0	104.9	V19 K23	V19-V21 VanDerWaalsContact C-N 3.27Å; V19-V21 WeakPolarHBondContact O-CG2 3.34Å; V19-V21 PolarHBondContact O-N 3.24Å; V21-K23 HydrophobicContact CG1-CG 4.38Å; V21-K23 PolarHBondContact O-N 3.3Å
22	C	42.4	Very low	53.9	Low	52 Å²	52	96.2 Å²	96.2	35%	0.351	53%	0.531	S	S	.	.			trans	-58.6	85.1	175.6	-81.8	0	0	0	0	108.3	P20 S24 I25	P20-C22 PolarHBondContact O-N 2.86Å; P20-C22 PolarHBondContact O-SG 3.33Å; P20-C22 VanDerWaalsContact O-SG 3.32Å; C22-S24 PolarHBondContact O-N 2.92Å; C22-I25 HydrophobicContact CB-CD1 3.18Å; C22-I25 HydrophobicContact CB-CG1 3.45Å; C22-I25 VanDerWaalsContact CB-CG1 3.45Å; C22-I25 VanDerWaalsContact SG-CD1 3.5Å
23	K	49.6	Very low	54	Low	175 Å²	175	94 Å²	94	76%	0.761	52%	0.519	S	S	*	.	S	Bend	trans	-71.1	-24.3	-176.9	-87.7	-178.5	172.8	178.8	0	111.8	V21	V21-K23 HydrophobicContact CG1-CG 4.38Å; V21-K23 PolarHBondContact O-N 3.3Å
24	S	48.7	Very low	54.1	Low	40 Å²	40	93 Å²	93	28%	0.28	51%	0.509	S	S	.	.	S	Bend	trans	-148.8	79.3	-177.5	-53.6	0	0	0	0	109.6	C22 D34 I35 D36	C22-S24 PolarHBondContact O-N 2.92Å; S24-D34 WeakPolarHBondContact O-CA 3.38Å; S24-I35 WeakPolarHBondContact O-CG1 3.38Å; S24-I35 PolarHBondContact O-N 3.12Å; S24-D36 PolarHBondContact OG-OD2 2.92Å
25	I	56.5	Low	54.1	Low	80 Å²	80	91.3 Å²	91.3	41%	0.41	50%	0.5	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.6	126.5	170.6	-71.6	157.7	0	0	0	109.5	C22 C27 C32 C33	C22-I25 HydrophobicContact CB-CD1 3.18Å; C22-I25 HydrophobicContact CB-CG1 3.45Å; C22-I25 VanDerWaalsContact CB-CG1 3.45Å; C22-I25 VanDerWaalsContact SG-CD1 3.5Å; I25-C27 WeakPolarHBondContact CG2-SG 3.45Å; I25-C32 HydrophobicContact CG2-CB 3.51Å; I25-C33 CarbonylContact C-O 3.51Å; I25-C33 VanDerWaalsContact CA-O 3.3Å; I25-C33 WeakPolarHBondContact CA-O 3.49Å
26	Q	53.8	Low	53.9	Low	125 Å²	125	90.2 Å²	90.2	58%	0.584	50%	0.495	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.6	123.1	156.4	-131	166.3	-19	0	0	108.5	C32 C33 I35	Q26-C32 CarbonylContact O-C 3.58Å; Q26-C32 VanDerWaalsContact O-CA 3.3Å; Q26-C32 WeakPolarHBondContact O-CA 3.39Å; Q26-C33 PolarHBondContact N-O 2.86Å; Q26-C33 PolarHBondContact O-N 2.88Å; Q26-I35 HydrophobicContact CB-CD1 3.31Å; Q26-I35 HydrophobicContact CB-CG1 3.55Å; Q26-I35 HydrophobicContact CG-CD1 3.61Å; Q26-I35 HydrophobicContact CG-CG1 4.34Å
27	C	58.7	Low	53.9	Low	76 Å²	76	87.6 Å²	87.6	51%	0.514	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	123.6	166.1	-63.3	0	0	0	0	109.8	I25 K31 C32	I25-C27 WeakPolarHBondContact CG2-SG 3.45Å; C27-K31 CarbonylContact C-O 3.52Å; C27-K31 WeakPolarHBondContact CA-O 3.38Å; C27-C32 HydrophobicContact CB-CB 4.25Å; C27-C32 WeakPolarHBondContact CB-SG 3.5Å; C27-C32 WeakPolarHBondContact SG-CB 3.41Å; C27-C32 CovalentContact SG-SG 2.06Å; C27-C32 PolarHBondContact SG-SG 2.91Å
28	N	57.3	Low	53.7	Low	142 Å²	142	86.9 Å²	86.9	76%	0.759	49%	0.49	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-115.7	101.8	165.8	-170.5	12.8	0	0	0	108.3	N30 K31	N28-N30 PolarHBondContact O-N 3.31Å; N28-K31 PolarHBondContact N-O 3.36Å; N28-K31 PolarHBondContact O-N 3.34Å; N28-K31 VanDerWaalsContact O-N 3.12Å
29	G	61.3	Low	53.6	Low	59 Å²	59	89.2 Å²	89.2	61%	0.608	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	59.6	-123.5	-174.2	0	0	0	0	0	112.8	K31	G29-K31 PolarHBondContact O-N 2.95Å
30	N	59.3	Low	53.6	Low	104 Å²	104	88.5 Å²	88.5	56%	0.556	49%	0.492	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.3	12.1	178.7	-69.3	-1	0	0	0	113.3	N28 V49 K50	N28-N30 PolarHBondContact O-N 3.31Å; N30-V49 CarbonylContact O-C 3.46Å; N30-V49 WeakPolarHBondContact O-CA 3.33Å; N30-V49 WeakPolarHBondContact O-CG1 3.37Å; N30-K50 WeakPolarHBondContact O-CB 3.49Å; N30-K50 PolarHBondContact O-N 3.06Å
31	K	53.2	Low	53.5	Low	130 Å²	130	93.3 Å²	93.3	57%	0.565	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-121.4	131.8	179.3	-61.6	-177.2	-179	179.2	0	109	C27 N28 G29 V49	C27-K31 CarbonylContact C-O 3.52Å; C27-K31 WeakPolarHBondContact CA-O 3.38Å; N28-K31 PolarHBondContact N-O 3.36Å; N28-K31 PolarHBondContact O-N 3.34Å; N28-K31 VanDerWaalsContact O-N 3.12Å; G29-K31 PolarHBondContact O-N 2.95Å; K31-V49 HydrophobicContact CG-CG2 4.44Å
32	C	60.7	Low	53.7	Low	21 Å²	21	93.4 Å²	93.4	14%	0.142	51%	0.511	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.6	112.7	179.5	-72.3	0	0	0	0	107.6	I25 Q26 C27 C47 C48	I25-C32 HydrophobicContact CG2-CB 3.51Å; Q26-C32 CarbonylContact O-C 3.58Å; Q26-C32 VanDerWaalsContact O-CA 3.3Å; Q26-C32 WeakPolarHBondContact O-CA 3.39Å; C27-C32 HydrophobicContact CB-CB 4.25Å; C27-C32 WeakPolarHBondContact CB-SG 3.5Å; C27-C32 WeakPolarHBondContact SG-CB 3.41Å; C27-C32 CovalentContact SG-SG 2.06Å; C27-C32 PolarHBondContact SG-SG 2.91Å; C32-C47 CarbonylContact O-C 3.44Å; C32-C48 PolarHBondContact N-O 3.24Å; C32-C48 WeakPolarHBondContact O-CA 3.23Å; C32-C48 PolarHBondContact O-N 3.35Å; C32-C48 VanDerWaalsContact O-O 3.09Å
33	C	59.3	Low	53.8	Low	30 Å²	30	97.8 Å²	97.8	20%	0.203	54%	0.536	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.4	139.1	-175.7	-59.1	0	0	0	0	110.7	I25 Q26 I35 T45 L46 C47	I25-C33 CarbonylContact C-O 3.51Å; I25-C33 VanDerWaalsContact CA-O 3.3Å; I25-C33 WeakPolarHBondContact CA-O 3.49Å; Q26-C33 PolarHBondContact N-O 2.86Å; Q26-C33 PolarHBondContact O-N 2.88Å; C33-I35 PolarHBondContact O-N 3.03Å; C33-T45 HydrophobicContact CB-CG2 3.93Å; C33-L46 WeakPolarHBondContact CA-O 3.47Å; C33-C47 HydrophobicContact CB-CB 4.08Å; C33-C47 WeakPolarHBondContact CB-SG 3.36Å; C33-C47 WeakPolarHBondContact SG-CB 3.31Å; C33-C47 CovalentContact SG-SG 2.04Å; C33-C47 PolarHBondContact SG-SG 3.21Å
34	D	59.7	Low	53.8	Low	44 Å²	44	93.5 Å²	93.5	24%	0.235	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.8	119.3	169.1	-159.1	-20.1	0	0	0	109.4	S24 D36 T45 L46	S24-D34 WeakPolarHBondContact O-CA 3.38Å; D34-D36 PolarHBondContact OD1-N 3.36Å; D34-T45 WeakPolarHBondContact O-CG2 3.39Å; D34-L46 PolarHBondContact N-O 2.84Å
35	I	56.8	Low	54	Low	80 Å²	80	95.2 Å²	95.2	41%	0.41	53%	0.534	S	S	.	.			trans	-87.8	-12.7	-175.8	-38.7	167.8	0	0	0	110.6	S24 Q26 C33 V37	S24-I35 WeakPolarHBondContact O-CG1 3.38Å; S24-I35 PolarHBondContact O-N 3.12Å; Q26-I35 HydrophobicContact CB-CD1 3.31Å; Q26-I35 HydrophobicContact CB-CG1 3.55Å; Q26-I35 HydrophobicContact CG-CD1 3.61Å; Q26-I35 HydrophobicContact CG-CG1 4.34Å; C33-I35 PolarHBondContact O-N 3.03Å; I35-V37 PolarHBondContact O-N 2.89Å
36	D	52.8	Low	53.8	Low	76 Å²	76	96.1 Å²	96.1	41%	0.406	54%	0.539	S	S	.	.			trans	-86.9	52.4	-168.8	-127.4	-43.6	0	0	0	113.5	S24 D34 T38	S24-D36 PolarHBondContact OG-OD2 2.92Å; D34-D36 PolarHBondContact OD1-N 3.36Å; D36-T38 PolarHBondContact O-N 3.34Å; D36-T38 PolarHBondContact OD1-OG1 3.31Å
37	V	51.6	Low	53.6	Low	71 Å²	71	93.5 Å²	93.5	43%	0.43	53%	0.533	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.6	2.4	175.6	-95	0	0	0	0	113.7	I35 K39	I35-V37 PolarHBondContact O-N 2.89Å; V37-K39 PolarHBondContact O-N 2.97Å
38	T	50.1	Low	53.4	Low	122 Å²	122	93.3 Å²	93.3	75%	0.748	53%	0.532	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.4	-6.2	-179.4	10.2	0	0	0	0	115.1	D36	D36-T38 PolarHBondContact O-N 3.34Å; D36-T38 PolarHBondContact OD1-OG1 3.31Å
39	K	50.3	Low	53.1	Low	200 Å²	200	91 Å²	91	87%	0.87	52%	0.523	S	S	*	.	S	Bend	trans	-136	1.1	178.8	-75.5	-168	177	-178.7	0	116.3	V37	V37-K39 PolarHBondContact O-N 2.97Å
40	S	47.3	Very low	52.5	Low	69 Å²	69	94.3 Å²	94.3	48%	0.483	52%	0.52	S	S	.	.			trans	-113.1	121.2	176.7	-102.6	0	0	0	0	109.5	L42	S40-L42 PolarHBondContact O-N 2.96Å
41	N	48.5	Very low	51.6	Low	171 Å²	171	96.9 Å²	96.9	91%	0.914	53%	0.531	S	S	*	.			trans	-62	25	165.9	-112.8	-31.1	0	0	0	112.8
42	L	49	Very low	50.9	Low	94 Å²	94	94.8 Å²	94.8	49%	0.492	53%	0.529	S	S	.	.			trans	-92	101.6	168.8	-91.8	71	0	0	0	106.7	S40 T44	S40-L42 PolarHBondContact O-N 2.96Å; L42-T44 PolarHBondContact O-N 3.1Å
43	T	44.8	Very low	49.9	Very low	145 Å²	145	98 Å²	98	89%	0.89	55%	0.548	S	S	*	.	S	Bend	trans	-60.1	12.3	170.1	37.1	0	0	0	0	114.4
44	T	51.2	Low	48.9	Very low	85 Å²	85	100.7 Å²	100.7	52%	0.521	56%	0.564	S	S	.	*	S	Bend	trans	-133.1	102.5	-173.3	55.9	0	0	0	0	108.9	L42 L46	L42-T44 PolarHBondContact O-N 3.1Å; T44-L46 PolarHBondContact O-N 3.49Å; T44-L46 VanDerWaalsContact O-N 3.12Å
45	T	52	Low	48.2	Very low	76 Å²	76	101.4 Å²	101.4	47%	0.466	57%	0.569	S	S	.	*			trans	-51.8	115.6	166.3	-52.5	0	0	0	0	108.8	C33 D34 C47	C33-T45 HydrophobicContact CB-CG2 3.93Å; D34-T45 WeakPolarHBondContact O-CG2 3.39Å; T45-C47 PolarHBondContact O-N 2.93Å
46	L	52.4	Low	47.8	Very low	98 Å²	98	104.1 Å²	104.1	51%	0.513	59%	0.585	S	S	.	*			trans	-74.3	100.5	176.8	-124.6	88	0	0	0	108.2	C33 D34 T44	C33-L46 WeakPolarHBondContact CA-O 3.47Å; D34-L46 PolarHBondContact N-O 2.84Å; T44-L46 PolarHBondContact O-N 3.49Å; T44-L46 VanDerWaalsContact O-N 3.12Å
47	C	49	Very low	47.8	Very low	70 Å²	70	104 Å²	104	47%	0.473	58%	0.584	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-99.5	113.2	174.7	-71.2	0	0	0	0	110.2	C32 C33 T45	C32-C47 CarbonylContact O-C 3.44Å; C33-C47 HydrophobicContact CB-CB 4.08Å; C33-C47 WeakPolarHBondContact CB-SG 3.36Å; C33-C47 WeakPolarHBondContact SG-CB 3.31Å; C33-C47 CovalentContact SG-SG 2.04Å; C33-C47 PolarHBondContact SG-SG 3.21Å; T45-C47 PolarHBondContact O-N 2.93Å
48	C	54.7	Low	48.2	Very low	73 Å²	73	105 Å²	105	49%	0.493	59%	0.592	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-85	114.5	166.2	-67.7	0	0	0	0	108.4	C32 K50	C32-C48 PolarHBondContact N-O 3.24Å; C32-C48 WeakPolarHBondContact O-CA 3.23Å; C32-C48 PolarHBondContact O-N 3.35Å; C32-C48 VanDerWaalsContact O-O 3.09Å; C48-K50 PolarHBondContact O-N 3.13Å
49	V	50.9	Low	49.1	Very low	92 Å²	92	106 Å²	106	56%	0.558	59%	0.588	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-63	124.6	158.5	-176.1	0	0	0	0	105.4	N30 K31 M51	N30-V49 CarbonylContact O-C 3.46Å; N30-V49 WeakPolarHBondContact O-CA 3.33Å; N30-V49 WeakPolarHBondContact O-CG1 3.37Å; K31-V49 HydrophobicContact CG-CG2 4.44Å; V49-M51 PolarHBondContact O-N 3.15Å
50	K	47.9	Very low	49.8	Very low	129 Å²	129	100.4 Å²	100.4	56%	0.561	57%	0.568	S	S	*	*			trans	-59.3	85.4	160	-163.8	178.6	-173.3	179.1	0	104.7	N30 C48 V52	N30-K50 WeakPolarHBondContact O-CB 3.49Å; N30-K50 PolarHBondContact O-N 3.06Å; C48-K50 PolarHBondContact O-N 3.13Å; K50-V52 HydrophobicContact CG-CG2 4.46Å; K50-V52 PolarHBondContact O-N 3.02Å
51	M	40.6	Very low	50.6	Low	159 Å²	159	100.3 Å²	100.3	78%	0.783	56%	0.564	S	S	*	*			trans	-57.5	96.9	153	-96.6	-168.3	163.9	0	0	102.5	V49 V53	V49-M51 PolarHBondContact O-N 3.15Å; M51-V53 HydrophobicContact CB-CG2 3.87Å; M51-V53 PolarHBondContact O-N 2.82Å; M51-V53 HydrophobicContact SD-CG2 4.38Å
52	V	39.2	Very low	51.6	Low	86 Å²	86	97.1 Å²	97.1	52%	0.521	55%	0.547	S	S	.	.			trans	-59.3	82.1	146.9	-168.9	0	0	0	0	102.6	K50 T54	K50-V52 HydrophobicContact CG-CG2 4.46Å; K50-V52 PolarHBondContact O-N 3.02Å; V52-T54 HydrophobicContact CG1-CG2 3.62Å; V52-T54 PolarHBondContact O-N 2.88Å
53	V	40.4	Very low	52.6	Low	88 Å²	88	99.7 Å²	99.7	53%	0.533	55%	0.554	S	S	.	*			trans	-67.1	87.2	151.6	-164.9	0	0	0	0	100.3	M51 V55	M51-V53 HydrophobicContact CB-CG2 3.87Å; M51-V53 PolarHBondContact O-N 2.82Å; M51-V53 HydrophobicContact SD-CG2 4.38Å; V53-V55 HydrophobicContact CB-CG2 4.14Å; V53-V55 HydrophobicContact CG1-CB 4.45Å; V53-V55 HydrophobicContact CG1-CG2 3.79Å; V53-V55 WeakPolarHBondContact O-CG2 3.34Å; V53-V55 PolarHBondContact O-N 3.31Å
54	T	37.7	Very low	54	Low	87 Å²	87	96.5 Å²	96.5	53%	0.534	53%	0.531	S	S	.	.			trans	-56.7	99.8	150.8	45.7	0	0	0	0	101.7	V52 D56	V52-T54 HydrophobicContact CG1-CG2 3.62Å; V52-T54 PolarHBondContact O-N 2.88Å; T54-D56 WeakPolarHBondContact CB-OD2 3.46Å; T54-D56 PolarHBondContact O-N 2.93Å; T54-D56 PolarHBondContact OG1-OD2 3.45Å
55	V	44.9	Very low	54.9	Low	59 Å²	59	100 Å²	100	36%	0.358	54%	0.536	S	S	.	.			trans	-76.4	67.4	170.7	-149.6	0	0	0	0	104.4	V53 N57 L60 T61	V53-V55 HydrophobicContact CB-CG2 4.14Å; V53-V55 HydrophobicContact CG1-CB 4.45Å; V53-V55 HydrophobicContact CG1-CG2 3.79Å; V53-V55 WeakPolarHBondContact O-CG2 3.34Å; V53-V55 PolarHBondContact O-N 3.31Å; V55-N57 WeakPolarHBondContact CG1-O 3.49Å; V55-N57 PolarHBondContact O-N 3.21Å; V55-L60 HydrophobicContact CG1-CB 4.23Å; V55-T61 WeakPolarHBondContact CB-OG1 3.38Å; V55-T61 WeakPolarHBondContact CG1-OG1 3.49Å
56	D	47.8	Very low	55.9	Low	136 Å²	136	100.8 Å²	100.8	73%	0.727	54%	0.537	S	S	*	.			trans	-61.8	-10	174.8	-77.7	-51.1	0	0	0	110.5	T54 P58	T54-D56 WeakPolarHBondContact CB-OD2 3.46Å; T54-D56 PolarHBondContact O-N 2.93Å; T54-D56 PolarHBondContact OG1-OD2 3.45Å; D56-P58 WeakPolarHBondContact O-CD 3.32Å
57	N	53.5	Low	57.1	Low	73 Å²	73	103.6 Å²	103.6	39%	0.39	54%	0.54	S	S	.	.			trans	-107.4	95.5	168.7	-165.3	-12.8	0	0	0	111.7	V55 E59 L60 T61	V55-N57 WeakPolarHBondContact CG1-O 3.49Å; V55-N57 PolarHBondContact O-N 3.21Å; N57-E59 PolarHBondContact O-N 2.79Å; N57-E59 VanDerWaalsContact O-N 3.08Å; N57-E59 WeakPolarHBondContact OD1-CB 3.46Å; N57-E59 PolarHBondContact OD1-N 2.82Å; N57-L60 HydrophobicContact CB-CB 4.04Å; N57-L60 WeakPolarHBondContact O-CB 3.31Å; N57-L60 PolarHBondContact O-N 3.38Å; N57-T61 PolarHBondContact O-N 2.7Å
58	P	59.8	Low	58.4	Low	94 Å²	94	107 Å²	107	61%	0.61	55%	0.548	S	S	*	.	H	α-helix	trans	-54.8	-26.9	174.7	22	-33.1	0	0	0	113	D56 L60 T61 L62	D56-P58 WeakPolarHBondContact O-CD 3.32Å; P58-L60 VanDerWaalsContact C-N 3.35Å; P58-T61 WeakPolarHBondContact O-CB 3.45Å; P58-T61 PolarHBondContact O-N 2.8Å; P58-L62 WeakPolarHBondContact O-CB 3.26Å; P58-L62 PolarHBondContact O-N 2.73Å
59	E	68.5	Low	59.4	Low	142 Å²	142	105.1 Å²	105.1	66%	0.664	54%	0.537	S	S	*	.	H	α-helix	trans	-66.3	-36.4	174.1	-57.8	-175.5	94.1	0	0	112.2	N57 L62 K63	N57-E59 PolarHBondContact O-N 2.79Å; N57-E59 VanDerWaalsContact O-N 3.08Å; N57-E59 WeakPolarHBondContact OD1-CB 3.46Å; N57-E59 PolarHBondContact OD1-N 2.82Å; E59-L62 PolarHBondContact O-N 3.32Å; E59-K63 VanDerWaalsContact O-CB 3.26Å; E59-K63 WeakPolarHBondContact O-CB 3.03Å; E59-K63 PolarHBondContact O-N 2.76Å
60	L	66	Low	60.8	Low	83 Å²	83	106.7 Å²	106.7	44%	0.435	54%	0.538	S	S	.	.	H	α-helix	trans	-71.4	-37.5	177.4	-164.7	70.8	0	0	0	110.9	V55 N57 P58 K63 N64	V55-L60 HydrophobicContact CG1-CB 4.23Å; N57-L60 HydrophobicContact CB-CB 4.04Å; N57-L60 WeakPolarHBondContact O-CB 3.31Å; N57-L60 PolarHBondContact O-N 3.38Å; P58-L60 VanDerWaalsContact C-N 3.35Å; L60-K63 PolarHBondContact O-N 2.98Å; L60-N64 WeakPolarHBondContact O-CB 3.07Å; L60-N64 VanDerWaalsContact O-CG 3.23Å; L60-N64 PolarHBondContact O-N 3.48Å; L60-N64 PolarHBondContact O-ND2 2.86Å
61	T	64	Low	62.2	Low	67 Å²	67	105.9 Å²	105.9	41%	0.411	54%	0.537	S	S	.	.	H	α-helix	trans	-58.3	-50.6	170.1	-55.6	0	0	0	0	110.5	V55 N57 P58 K63 N64 Y65	V55-T61 WeakPolarHBondContact CB-OG1 3.38Å; V55-T61 WeakPolarHBondContact CG1-OG1 3.49Å; N57-T61 PolarHBondContact O-N 2.7Å; P58-T61 WeakPolarHBondContact O-CB 3.45Å; P58-T61 PolarHBondContact O-N 2.8Å; T61-K63 PolarHBondContact O-N 2.93Å; T61-N64 PolarHBondContact O-N 3.17Å; T61-Y65 WeakPolarHBondContact O-CB 3.44Å; T61-Y65 PolarHBondContact O-N 3.45Å
62	L	68.8	Low	64.1	Low	104 Å²	104	103.6 Å²	103.6	55%	0.545	53%	0.528	S	S	.	.	H	α-helix	trans	-62.2	-44.6	-178.9	-177.8	62.8	0	0	0	111	P58 E59 N64 Y65 L66	P58-L62 WeakPolarHBondContact O-CB 3.26Å; P58-L62 PolarHBondContact O-N 2.73Å; E59-L62 PolarHBondContact O-N 3.32Å; L62-N64 VanDerWaalsContact C-N 3.34Å; L62-N64 PolarHBondContact O-N 3.31Å; L62-Y65 WeakPolarHBondContact O-CB 3.3Å; L62-Y65 PolarHBondContact O-N 3.25Å; L62-L66 HydrophobicContact CD1-CD1 4.49Å; L62-L66 HydrophobicContact CD1-CG 4.41Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 HydrophobicContact CG-CG 4.49Å; L62-L66 WeakPolarHBondContact O-CB 3.3Å; L62-L66 VanDerWaalsContact O-CG 3.32Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 2.92Å
63	K	71.3	Confident	65.9	Low	148 Å²	148	104 Å²	104	64%	0.643	53%	0.527	S	S	*	.	H	α-helix	trans	-61.7	-41.7	177	-170.9	174.7	-177.3	175.4	0	112	E59 L60 T61 R67	E59-K63 VanDerWaalsContact O-CB 3.26Å; E59-K63 WeakPolarHBondContact O-CB 3.03Å; E59-K63 PolarHBondContact O-N 2.76Å; L60-K63 PolarHBondContact O-N 2.98Å; T61-K63 PolarHBondContact O-N 2.93Å; K63-R67 VanDerWaalsContact O-CB 3.31Å; K63-R67 WeakPolarHBondContact O-CB 3.46Å; K63-R67 PolarHBondContact O-N 3.44Å
64	N	72.9	Confident	67.8	Low	77 Å²	77	107.1 Å²	107.1	41%	0.412	53%	0.533	S	S	.	.	H	α-helix	trans	-66.9	-39.5	175.8	-75.1	-24.8	0	0	0	112	L60 T61 L62 R67 K68	L60-N64 WeakPolarHBondContact O-CB 3.07Å; L60-N64 VanDerWaalsContact O-CG 3.23Å; L60-N64 PolarHBondContact O-N 3.48Å; L60-N64 PolarHBondContact O-ND2 2.86Å; T61-N64 PolarHBondContact O-N 3.17Å; L62-N64 VanDerWaalsContact C-N 3.34Å; L62-N64 PolarHBondContact O-N 3.31Å; N64-R67 PolarHBondContact O-N 3.27Å; N64-K68 WeakPolarHBondContact O-CB 3.21Å; N64-K68 WeakPolarHBondContact O-CG 3.41Å; N64-K68 PolarHBondContact O-N 2.92Å
65	Y	70.6	Confident	69.7	Low	159 Å²	159	108.4 Å²	108.4	62%	0.624	54%	0.536	S	S	*	.	H	α-helix	trans	-62.8	-49.3	174.6	-179.7	-94.2	0	0	0	111.4	T61 L62 R67 K68 A69	T61-Y65 WeakPolarHBondContact O-CB 3.44Å; T61-Y65 PolarHBondContact O-N 3.45Å; L62-Y65 WeakPolarHBondContact O-CB 3.3Å; L62-Y65 PolarHBondContact O-N 3.25Å; Y65-R67 VanDerWaalsContact C-N 3.32Å; Y65-R67 PolarHBondContact O-N 3.44Å; Y65-K68 WeakPolarHBondContact O-CB 3.15Å; Y65-K68 PolarHBondContact O-N 3.4Å; Y65-K68 VanDerWaalsContact O-N 3.17Å; Y65-A69 PolarHBondContact O-N 2.04Å
66	L	73.9	Confident	71.3	Confident	93 Å²	93	113.5 Å²	113.5	49%	0.487	55%	0.549	S	S	.	.	H	α-helix	trans	-59.2	-43	176.1	-71.8	172.7	0	0	0	111.5	L62 K68 A69 Q70	L62-L66 HydrophobicContact CD1-CD1 4.49Å; L62-L66 HydrophobicContact CD1-CG 4.41Å; L62-L66 HydrophobicContact CG-CD1 4.15Å; L62-L66 HydrophobicContact CG-CG 4.49Å; L62-L66 WeakPolarHBondContact O-CB 3.3Å; L62-L66 VanDerWaalsContact O-CG 3.32Å; L62-L66 WeakPolarHBondContact O-CG 3.33Å; L62-L66 PolarHBondContact O-N 2.92Å; L66-K68 PolarHBondContact O-N 2.83Å; L66-A69 PolarHBondContact O-N 2.81Å; L66-Q70 WeakPolarHBondContact O-CG 3.44Å; L66-Q70 PolarHBondContact O-N 2.82Å
67	R	76.3	Confident	72.9	Confident	156 Å²	156	112.4 Å²	112.4	59%	0.589	54%	0.539	S	S	*	.	H	α-helix	trans	-63.7	-40.4	176.9	-165.3	-178	-176.9	176.6	0.6	111.8	K63 N64 Y65 M71	K63-R67 VanDerWaalsContact O-CB 3.31Å; K63-R67 WeakPolarHBondContact O-CB 3.46Å; K63-R67 PolarHBondContact O-N 3.44Å; N64-R67 PolarHBondContact O-N 3.27Å; Y65-R67 VanDerWaalsContact C-N 3.32Å; Y65-R67 PolarHBondContact O-N 3.44Å; R67-M71 HydrophobicContact CG-CE 3.91Å; R67-M71 WeakPolarHBondContact O-CG 3.42Å; R67-M71 PolarHBondContact O-N 3.45Å
68	K	76.2	Confident	74.1	Confident	143 Å²	143	111 Å²	111	62%	0.622	54%	0.538	S	S	*	.	H	α-helix	trans	-63.8	-46	174	-78.3	-179.2	178.8	-176	0	111.4	N64 Y65 L66 Q70 M71 I72	N64-K68 WeakPolarHBondContact O-CB 3.21Å; N64-K68 WeakPolarHBondContact O-CG 3.41Å; N64-K68 PolarHBondContact O-N 2.92Å; Y65-K68 WeakPolarHBondContact O-CB 3.15Å; Y65-K68 PolarHBondContact O-N 3.4Å; Y65-K68 VanDerWaalsContact O-N 3.17Å; L66-K68 PolarHBondContact O-N 2.83Å; K68-Q70 VanDerWaalsContact C-N 3.34Å; K68-Q70 PolarHBondContact O-N 2.91Å; K68-M71 PolarHBondContact O-N 2.76Å; K68-M71 VanDerWaalsContact O-N 3.15Å; K68-I72 WeakPolarHBondContact O-CG1 3.44Å; K68-I72 PolarHBondContact O-N 3.12Å
69	A	75.9	Confident	74.9	Confident	32 Å²	32	109.9 Å²	109.9	26%	0.264	53%	0.529	S	S	.	.	H	α-helix	trans	-58.1	-46.5	176.8	0	0	0	0	0	111.4	Y65 L66 M71 I72 D73	Y65-A69 PolarHBondContact O-N 2.04Å; L66-A69 PolarHBondContact O-N 2.81Å; A69-M71 VanDerWaalsContact C-N 3.32Å; A69-M71 PolarHBondContact O-N 2.77Å; A69-I72 WeakPolarHBondContact O-CB 3.38Å; A69-I72 PolarHBondContact O-N 3.23Å; A69-I72 VanDerWaalsContact O-N 3.1Å; A69-D73 PolarHBondContact O-N 2.71Å
70	Q	81	Confident	75.3	Confident	125 Å²	125	109.1 Å²	109.1	58%	0.584	53%	0.525	S	S	*	.	H	α-helix	trans	-59.5	-39.5	174.9	-74.3	177.1	-18.9	0	0	113.1	L66 K68 K74	L66-Q70 WeakPolarHBondContact O-CG 3.44Å; L66-Q70 PolarHBondContact O-N 2.82Å; K68-Q70 VanDerWaalsContact C-N 3.34Å; K68-Q70 PolarHBondContact O-N 2.91Å; Q70-K74 WeakPolarHBondContact O-CB 3.44Å; Q70-K74 WeakPolarHBondContact O-CG 3.48Å; Q70-K74 PolarHBondContact O-N 2.69Å
71	M	77.4	Confident	75.9	Confident	112 Å²	112	113.3 Å²	113.3	55%	0.552	54%	0.54	S	S	*	.	H	α-helix	trans	-67.2	-38.4	175.5	-70.9	-168	-152.2	0	0	111.8	R67 K68 A69 K74 L75	R67-M71 HydrophobicContact CG-CE 3.91Å; R67-M71 WeakPolarHBondContact O-CG 3.42Å; R67-M71 PolarHBondContact O-N 3.45Å; K68-M71 PolarHBondContact O-N 2.76Å; K68-M71 VanDerWaalsContact O-N 3.15Å; A69-M71 VanDerWaalsContact C-N 3.32Å; A69-M71 PolarHBondContact O-N 2.77Å; M71-K74 PolarHBondContact O-N 3.37Å; M71-L75 VanDerWaalsContact O-CB 3.31Å; M71-L75 WeakPolarHBondContact O-CB 3.49Å; M71-L75 PolarHBondContact O-N 2.78Å
72	I	79.5	Confident	76.3	Confident	112 Å²	112	117.1 Å²	117.1	57%	0.574	56%	0.557	S	S	*	*	H	α-helix	trans	-64.1	-44.2	175.9	-68.5	166.4	0	0	0	110.5	K68 A69 L75 R76	K68-I72 WeakPolarHBondContact O-CG1 3.44Å; K68-I72 PolarHBondContact O-N 3.12Å; A69-I72 WeakPolarHBondContact O-CB 3.38Å; A69-I72 PolarHBondContact O-N 3.23Å; A69-I72 VanDerWaalsContact O-N 3.1Å; I72-L75 WeakPolarHBondContact O-CB 3.41Å; I72-L75 PolarHBondContact O-N 2.74Å; I72-R76 WeakPolarHBondContact O-CB 3.48Å; I72-R76 PolarHBondContact O-N 3.39Å
73	D	78.4	Confident	76	Confident	94 Å²	94	115.1 Å²	115.1	50%	0.503	56%	0.562	S	S	.	*	H	α-helix	trans	-63.5	-45.3	177.5	-77	-31.4	0	0	0	111.6	A69 L75 R76 E77	A69-D73 PolarHBondContact O-N 2.71Å; D73-L75 VanDerWaalsContact C-N 3.29Å; D73-L75 PolarHBondContact O-N 2.93Å; D73-R76 WeakPolarHBondContact O-CB 2.9Å; D73-R76 PolarHBondContact O-N 3.48Å; D73-R76 VanDerWaalsContact O-N 3.13Å; D73-E77 PolarHBondContact O-N 3.08Å
74	K	78.7	Confident	75.1	Confident	154 Å²	154	111.1 Å²	111.1	67%	0.67	56%	0.563	S	S	*	*	H	α-helix	trans	-59.9	-40.2	174.1	-75.8	-175	178.4	-172.9	0	112.3	Q70 M71 R76 A78	Q70-K74 WeakPolarHBondContact O-CB 3.44Å; Q70-K74 WeakPolarHBondContact O-CG 3.48Å; Q70-K74 PolarHBondContact O-N 2.69Å; M71-K74 PolarHBondContact O-N 3.37Å; K74-R76 VanDerWaalsContact C-N 3.35Å; K74-A78 WeakPolarHBondContact O-CB 3.42Å; K74-A78 PolarHBondContact O-N 2.88Å
75	L	79.1	Confident	73.8	Confident	114 Å²	114	122 Å²	122	60%	0.597	60%	0.598	S	S	*	*	H	α-helix	trans	-65.3	-41.6	176.1	-173.2	67.8	0	0	0	110.6	M71 I72 D73 A78 V79	M71-L75 VanDerWaalsContact O-CB 3.31Å; M71-L75 WeakPolarHBondContact O-CB 3.49Å; M71-L75 PolarHBondContact O-N 2.78Å; I72-L75 WeakPolarHBondContact O-CB 3.41Å; I72-L75 PolarHBondContact O-N 2.74Å; D73-L75 VanDerWaalsContact C-N 3.29Å; D73-L75 PolarHBondContact O-N 2.93Å; L75-A78 PolarHBondContact O-N 3.41Å; L75-V79 WeakPolarHBondContact O-CB 3.32Å; L75-V79 VanDerWaalsContact O-CG2 3.24Å; L75-V79 WeakPolarHBondContact O-CG2 3.13Å; L75-V79 PolarHBondContact O-N 3.25Å
76	R	77.5	Confident	73.9	Confident	166 Å²	166	120.2 Å²	120.2	63%	0.626	60%	0.597	S	S	*	*	H	α-helix	trans	-61.6	-46.7	176.7	-168.7	-179.1	-142	-137.8	2.7	111.7	I72 D73 K74 V79 Q80	I72-R76 WeakPolarHBondContact O-CB 3.48Å; I72-R76 PolarHBondContact O-N 3.39Å; D73-R76 WeakPolarHBondContact O-CB 2.9Å; D73-R76 PolarHBondContact O-N 3.48Å; D73-R76 VanDerWaalsContact O-N 3.13Å; K74-R76 VanDerWaalsContact C-N 3.35Å; R76-V79 PolarHBondContact O-N 3.22Å; R76-Q80 WeakPolarHBondContact O-CG 3.21Å; R76-Q80 PolarHBondContact O-N 2.85Å
77	E	81.5	Confident	73.9	Confident	113 Å²	113	121.6 Å²	121.6	53%	0.528	60%	0.603	S	S	.	*	H	α-helix	trans	-61	-43.6	174.7	-74.7	-175.2	177.4	0	0	111.8	D73 Q80 K81	D73-E77 PolarHBondContact O-N 3.08Å; E77-Q80 PolarHBondContact O-N 3.48Å; E77-K81 WeakPolarHBondContact O-CG 3.08Å; E77-K81 PolarHBondContact O-N 2.83Å
78	A	78.9	Confident	73.8	Confident	43 Å²	43	119.7 Å²	119.7	36%	0.355	60%	0.603	S	S	.	*	H	α-helix	trans	-62.7	-43.4	177.3	0	0	0	0	0	111.4	K74 L75 K81 L82	K74-A78 WeakPolarHBondContact O-CB 3.42Å; K74-A78 PolarHBondContact O-N 2.88Å; L75-A78 PolarHBondContact O-N 3.41Å; A78-K81 PolarHBondContact O-N 3.01Å; A78-L82 WeakPolarHBondContact O-CB 3.15Å; A78-L82 VanDerWaalsContact O-CG 3.26Å; A78-L82 WeakPolarHBondContact O-CG 3.37Å; A78-L82 PolarHBondContact O-N 3.33Å
79	V	77	Confident	73.7	Confident	70 Å²	70	118.4 Å²	118.4	42%	0.424	60%	0.602	S	S	.	*	H	α-helix	trans	-63.8	-41	175.7	170.9	0	0	0	0	111.2	L75 R76 L82 G83	L75-V79 WeakPolarHBondContact O-CB 3.32Å; L75-V79 VanDerWaalsContact O-CG2 3.24Å; L75-V79 WeakPolarHBondContact O-CG2 3.13Å; L75-V79 PolarHBondContact O-N 3.25Å; R76-V79 PolarHBondContact O-N 3.22Å; V79-L82 PolarHBondContact O-N 2.06Å; V79-G83 PolarHBondContact O-N 2.87Å
80	Q	76.5	Confident	73.5	Confident	126 Å²	126	123.8 Å²	123.8	59%	0.589	62%	0.623	S	S	*	*	H	α-helix	trans	-63.7	-41.4	175.2	-76.9	-178.6	-24.8	0	0	112.3	R76 E77 L82 G83 G84	R76-Q80 WeakPolarHBondContact O-CG 3.21Å; R76-Q80 PolarHBondContact O-N 2.85Å; E77-Q80 PolarHBondContact O-N 3.48Å; Q80-L82 VanDerWaalsContact C-N 3.31Å; Q80-L82 PolarHBondContact O-N 2.83Å; Q80-G83 PolarHBondContact O-N 2.82Å; Q80-G84 PolarHBondContact O-N 2.79Å
81	K	77.9	Confident	73	Confident	171 Å²	171	123.7 Å²	123.7	74%	0.743	63%	0.626	S	S	*	*	H	α-helix	trans	-63.5	-36.8	174.2	-75.8	178.5	179.8	174.3	0	112.3	E77 A78	E77-K81 WeakPolarHBondContact O-CG 3.08Å; E77-K81 PolarHBondContact O-N 2.83Å; A78-K81 PolarHBondContact O-N 3.01Å
82	L	72.8	Confident	72.7	Confident	148 Å²	148	124.5 Å²	124.5	78%	0.775	63%	0.631	S	S	*	*	H	α-helix	trans	-75.4	-30.7	177.1	-70.9	167.1	0	0	0	112.7	A78 V79 Q80	A78-L82 WeakPolarHBondContact O-CB 3.15Å; A78-L82 VanDerWaalsContact O-CG 3.26Å; A78-L82 WeakPolarHBondContact O-CG 3.37Å; A78-L82 PolarHBondContact O-N 3.33Å; V79-L82 PolarHBondContact O-N 2.06Å; Q80-L82 VanDerWaalsContact C-N 3.31Å; Q80-L82 PolarHBondContact O-N 2.83Å
83	G	62.4	Low	72.2	Confident	62 Å²	62	125.5 Å²	125.5	64%	0.639	64%	0.636	S	S	*	*	H	α-helix	trans	-89.4	-1.6	178.6	0	0	0	0	0	115.1	V79 Q80 R85	V79-G83 PolarHBondContact O-N 2.87Å; Q80-G83 PolarHBondContact O-N 2.82Å; G83-R85 PolarHBondContact O-N 3.06Å
84	G	52	Low	71.7	Confident	64 Å²	64	128.1 Å²	128.1	66%	0.66	65%	0.647	S	S	*	*			trans	-83.9	31	179.9	0	0	0	0	0	115.2	Q80	Q80-G84 PolarHBondContact O-N 2.79Å
85	R	45.8	Very low	71	Confident	306 Å²	306	125.7 Å²	125.7	100%	1.155	65%	0.645	S	S	*	*			trans	-128.6	0	170.2	-91	-174.3	172.8	159.3	-1.5	110.8	G83	G83-R85 PolarHBondContact O-N 3.06Å

Retrieved 85 of 85 residues in 51.9 ms (Link to these results)

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