A0A5K4F6H8_SCHMA Loading...

Cytochrome c oxidase assembly protein COX19

AlphaFold DB , UniProt , Accession A0A5K4F6H8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 101 aa.

						>A0A5K4F6H8_SCHMA|A0A5K4F6H8
MGIPLTVSADSTGYIPNRSRVLPPLRGSFPLDHHGVCKVAMLEWTQCMKKNHWNNSLCRSEAAGYLRCRAENNLMDPNEISLLGFTEEEWNQANKHFQSKT
					

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(Predicted Aligned Error values between residue pairs)

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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	61.8	Low	68.4	Low	245 Å²	245	133.6 Å²	133.6	100%	1.207	82%	0.821	S	S	*	*				0	92.9	0	-67.7	173.5	-179.4	0	0	107
2	G	60	Low	68.5	Low	79 Å²	79	133.1 Å²	133.1	81%	0.814	82%	0.818	S	S	*	*			trans	-94.8	120.9	-176.2	0	0	0	0	0	110
3	I	73.2	Confident	68.1	Low	150 Å²	150	128.6 Å²	128.6	77%	0.769	82%	0.815	S	S	*	*			trans	-86.1	119.3	175.6	-56	176.5	0	0	0	107.1	L5	I3-L5 PolarHBondContact O-N 3.45Å
4	P	67.6	Low	68.3	Low	109 Å²	109	132.9 Å²	132.9	71%	0.708	81%	0.809	S	S	*	*			trans	-73.2	115.2	176	28.3	-30.9	0	0	0	109.5	T6	P4-T6 PolarHBondContact O-N 2.89Å
5	L	72.1	Confident	68.5	Low	167 Å²	167	133.9 Å²	133.9	87%	0.874	81%	0.806	S	S	*	*			trans	-77.5	101.6	171.9	-67.1	172.6	0	0	0	108.8	I3 V7	I3-L5 PolarHBondContact O-N 3.45Å; L5-V7 PolarHBondContact O-N 3.27Å
6	T	76.1	Confident	68.5	Low	129 Å²	129	130.5 Å²	130.5	79%	0.791	79%	0.788	S	S	*	*			trans	-82.1	108	168.7	57.9	0	0	0	0	108.4	P4	P4-T6 PolarHBondContact O-N 2.89Å
7	V	76.8	Confident	68.6	Low	137 Å²	137	131.6 Å²	131.6	83%	0.83	79%	0.789	S	S	*	*			trans	-89.4	120.7	170.1	66.7	0	0	0	0	108.9	L5	L5-V7 PolarHBondContact O-N 3.27Å
8	S	67.7	Low	68.9	Low	103 Å²	103	137.2 Å²	137.2	72%	0.72	79%	0.793	S	S	*	*			trans	-85.3	112.3	171.5	-53.5	0	0	0	0	108.1	D10	S8-D10 PolarHBondContact O-N 3.27Å
9	A	67.7	Low	69.2	Low	87 Å²	87	135.1 Å²	135.1	72%	0.719	79%	0.787	S	S	*	*			trans	-88.7	96	173.6	0	0	0	0	0	109.4	S11	A9-S11 PolarHBondContact O-N 3.05Å
10	D	64.8	Low	69.4	Low	148 Å²	148	139.9 Å²	139.9	79%	0.791	79%	0.791	S	S	*	*			trans	-70	92.5	167.6	-74.9	-36.3	0	0	0	109.1	S8 T12	S8-D10 PolarHBondContact O-N 3.27Å; D10-T12 VanDerWaalsContact C-N 3.31Å; D10-T12 PolarHBondContact O-N 3.02Å
11	S	64	Low	69.8	Low	116 Å²	116	139.4 Å²	139.4	81%	0.811	79%	0.791	S	S	*	*			trans	-69.2	88.3	171.1	-79.4	0	0	0	0	109.5	A9 G13	A9-S11 PolarHBondContact O-N 3.05Å; S11-G13 PolarHBondContact O-N 3.37Å
12	T	69.6	Low	70.5	Confident	127 Å²	127	134.6 Å²	134.6	78%	0.779	77%	0.77	S	S	*	*			trans	-69	111.1	158.9	51.2	0	0	0	0	107.2	D10 Y14	D10-T12 VanDerWaalsContact C-N 3.31Å; D10-T12 PolarHBondContact O-N 3.02Å; T12-Y14 PolarHBondContact O-N 2.93Å
13	G	63.9	Low	71.4	Confident	75 Å²	75	135.9 Å²	135.9	77%	0.773	76%	0.764	S	S	*	*			trans	-69.2	65.4	-174.4	0	0	0	0	0	113.7	S11 I15	S11-G13 PolarHBondContact O-N 3.37Å; G13-I15 PolarHBondContact O-N 3.3Å; G13-I15 VanDerWaalsContact O-N 3.14Å
14	Y	71	Confident	71.7	Confident	188 Å²	188	133.4 Å²	133.4	74%	0.737	76%	0.757	S	S	*	*			trans	-72.6	100.2	164.5	180	-106.1	0	0	0	108.4	T12 P16	T12-Y14 PolarHBondContact O-N 2.93Å; Y14-P16 HydrophobicContact CD1-CB 4.32Å; Y14-P16 HydrophobicContact CE1-CB 3.67Å; Y14-P16 HydrophobicContact CE1-CG 4.43Å; Y14-P16 WeakPolarHBondContact O-CD 3.1Å
15	I	71.5	Confident	72	Confident	148 Å²	148	136.4 Å²	136.4	76%	0.759	77%	0.767	S	S	*	*			trans	-80.4	104.4	164.2	-54.2	175.5	0	0	0	105.1	G13 N17	G13-I15 PolarHBondContact O-N 3.3Å; G13-I15 VanDerWaalsContact O-N 3.14Å; I15-N17 PolarHBondContact O-N 3.23Å; I15-N17 VanDerWaalsContact O-N 3.1Å
16	P	68.3	Low	71.8	Confident	80 Å²	80	134.6 Å²	134.6	52%	0.519	75%	0.748	S	S	.	*			trans	-56	126.1	172.3	22.5	-31.1	0	0	0	107.1	Y14 R18	Y14-P16 HydrophobicContact CD1-CB 4.32Å; Y14-P16 HydrophobicContact CE1-CB 3.67Å; Y14-P16 HydrophobicContact CE1-CG 4.43Å; Y14-P16 WeakPolarHBondContact O-CD 3.1Å; P16-R18 PolarHBondContact O-N 3.42Å
17	N	70.4	Confident	71.5	Confident	150 Å²	150	130.6 Å²	130.6	80%	0.802	73%	0.733	S	S	*	*			trans	-51.1	108.8	168.5	-87.5	-67.3	0	0	0	106.3	I15 S19	I15-N17 PolarHBondContact O-N 3.23Å; I15-N17 VanDerWaalsContact O-N 3.1Å; N17-S19 VanDerWaalsContact C-N 3.28Å; N17-S19 PolarHBondContact O-N 3.46Å
18	R	73.1	Confident	71.2	Confident	231 Å²	231	129.9 Å²	129.9	87%	0.872	73%	0.734	S	S	*	*			trans	-53.7	103.4	170.6	-175.2	-177.2	-154.9	-166.4	5.7	104.8	P16 R20	P16-R18 PolarHBondContact O-N 3.42Å; R18-R20 PolarHBondContact O-N 3.24Å
19	S	74.9	Confident	71.5	Confident	97 Å²	97	131 Å²	131	68%	0.678	73%	0.726	S	S	*	*			trans	-54.1	108.7	177.1	35.9	0	0	0	0	105	N17 V21	N17-S19 VanDerWaalsContact C-N 3.28Å; N17-S19 PolarHBondContact O-N 3.46Å; S19-V21 PolarHBondContact O-N 2.62Å
20	R	73.5	Confident	72.2	Confident	231 Å²	231	130 Å²	130	87%	0.872	71%	0.712	S	S	*	*			trans	-63.8	101.2	171.7	-71.9	-169.5	-171.9	-143.8	4.6	103.8	R18 L22	R18-R20 PolarHBondContact O-N 3.24Å; R20-L22 VanDerWaalsContact C-N 3.26Å; R20-L22 PolarHBondContact O-N 2.83Å
21	V	77.4	Confident	73.4	Confident	130 Å²	130	128.7 Å²	128.7	79%	0.788	71%	0.705	S	S	*	*			trans	-65.4	97.4	175.7	-179.4	0	0	0	0	105.2	S19	S19-V21 PolarHBondContact O-N 2.62Å
22	L	77.4	Confident	74.5	Confident	145 Å²	145	125 Å²	125	76%	0.759	68%	0.676	S	S	*	*	P	Polyproline II helix	trans	-67.6	130	169.2	-68.5	171.7	0	0	0	106.2	R20	R20-L22 VanDerWaalsContact C-N 3.26Å; R20-L22 PolarHBondContact O-N 2.83Å
23	P	78	Confident	75.6	Confident	105 Å²	105	126.3 Å²	126.3	68%	0.682	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-58.3	146.6	174	25.7	-32.9	0	0	0	109	L25	P23-L25 PolarHBondContact O-N 2.04Å
24	P	80.1	Confident	77	Confident	98 Å²	98	131.1 Å²	131.1	64%	0.636	68%	0.675	S	S	*	*	P	Polyproline II helix	trans	-51.5	134.6	173	-25.5	34.1	0	0	0	110.4	R26 G27	P24-R26 WeakPolarHBondContact CB-O 3.4Å; P24-R26 CarbonylContact O-C 3.55Å; P24-R26 PolarHBondContact O-N 3.37Å; P24-G27 PolarHBondContact O-N 3.44Å
25	L	73.3	Confident	78	Confident	173 Å²	173	123.4 Å²	123.4	91%	0.906	65%	0.652	S	S	*	*	S	Bend	trans	-55.1	-38.4	-179.1	-174.1	70.7	0	0	0	111.7	P23	P23-L25 PolarHBondContact O-N 2.04Å
26	R	68	Low	79.1	Confident	128 Å²	128	120 Å²	120	48%	0.483	64%	0.639	S	S	.	*	S	Bend	trans	-99.5	96.6	170.7	-61	-83.2	170.1	74.2	4	105	P24 E79	P24-R26 WeakPolarHBondContact CB-O 3.4Å; P24-R26 CarbonylContact O-C 3.55Å; P24-R26 PolarHBondContact O-N 3.37Å; R26-E79 WeakPolarHBondContact CD-OE1 3.36Å; R26-E79 IonicContact CZ-OE1 3.3Å; R26-E79 IonicContact NE-OE1 3.92Å; R26-E79 IonicContact NH1-OE1 2.8Å; R26-E79 PolarHBondContact NH1-OE1 3.15Å
27	G	69.5	Low	80.3	Confident	46 Å²	46	116.3 Å²	116.3	47%	0.474	61%	0.614	S	S	.	*			trans	-57.7	-177.8	-177.5	0	0	0	0	0	112.9	P24 F29	P24-G27 PolarHBondContact O-N 3.44Å; G27-F29 PolarHBondContact O-N 3.04Å
28	S	71.4	Confident	81.4	Confident	122 Å²	122	114.9 Å²	114.9	85%	0.853	60%	0.601	S	S	*	*	S	Bend	trans	-47	117.4	178	51.8	0	0	0	0	111.4
29	F	74	Confident	82.4	Confident	126 Å²	126	108 Å²	108	55%	0.553	58%	0.584	S	S	*	*	P	Polyproline II helix	trans	-52.3	132.4	178.7	-69	-85.5	0	0	0	110.4	G27 L31	G27-F29 PolarHBondContact O-N 3.04Å; F29-L31 PolarHBondContact O-N 2.95Å
30	P	83.1	Confident	83.3	Confident	65 Å²	65	103.4 Å²	103.4	42%	0.422	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-55.1	128.9	175.9	-24.1	32.7	0	0	0	110.7	R69 L74	P30-R69 PolarHBondContact O-NH2 3.4Å; P30-L74 HydrophobicContact CB-CD2 4.12Å
31	L	88.6	Confident	84.3	Confident	122 Å²	122	95.1 Å²	95.1	64%	0.639	52%	0.524	S	S	*	.	P	Polyproline II helix	trans	-79.9	138.8	174.6	-62.6	178.8	0	0	0	109.4	F29 H33	F29-L31 PolarHBondContact O-N 2.95Å; L31-H33 PolarHBondContact O-CD2 3.38Å; L31-H33 PolarHBondContact O-N 3.41Å
32	D	88.8	Confident	85.2	Confident	39 Å²	39	92.4 Å²	92.4	21%	0.209	51%	0.505	C	S	.	.			trans	-77.4	74.8	173.9	-175.3	12.4	0	0	0	110.3	G35 V36 C37 L74	D32-G35 PolarHBondContact O-N 2.93Å; D32-G35 WeakPolarHBondContact OD1-CA 3.48Å; D32-G35 PolarHBondContact OD1-N 3.03Å; D32-G35 WeakPolarHBondContact OD2-CA 3.43Å; D32-V36 PolarHBondContact OD1-N 2.81Å; D32-V36 PolarHBondContact OD2-N 3.16Å; D32-C37 PolarHBondContact OD2-N 3.42Å; D32-L74 HydrophobicContact CB-CD1 3.85Å
33	H	91.9	Very high	86	Confident	154 Å²	154	87.6 Å²	87.6	71%	0.713	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66	-37.5	-176.1	-75.3	-72.4	0	0	0	113.5	L31 G35	L31-H33 PolarHBondContact O-CD2 3.38Å; L31-H33 PolarHBondContact O-N 3.41Å; H33-G35 VanDerWaalsContact C-N 3.28Å
34	H	92.1	Very high	86.9	Confident	176 Å²	176	85.9 Å²	85.9	82%	0.815	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.7	-5.8	-178.8	-60.6	-64.2	0	0	0	112.7	V36	H34-V36 VanDerWaalsContact C-N 3.27Å; H34-V36 HydrophobicContact CB-CG2 3.91Å; H34-V36 PolarHBondContact O-N 3.43Å
35	G	93.9	Very high	87.7	Confident	26 Å²	26	82.6 Å²	82.6	27%	0.268	44%	0.437	S	S	.	.			trans	64.8	33	-178.1	0	0	0	0	0	112.3	D32 H33 C37 K38	D32-G35 PolarHBondContact O-N 2.93Å; D32-G35 WeakPolarHBondContact OD1-CA 3.48Å; D32-G35 PolarHBondContact OD1-N 3.03Å; D32-G35 WeakPolarHBondContact OD2-CA 3.43Å; H33-G35 VanDerWaalsContact C-N 3.28Å; G35-C37 PolarHBondContact O-N 3.33Å; G35-K38 WeakPolarHBondContact O-CB 3.01Å; G35-K38 PolarHBondContact O-N 3.32Å
36	V	93.1	Very high	88.8	Confident	77 Å²	77	80.3 Å²	80.3	47%	0.467	42%	0.421	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.9	-37.9	-177.1	-175.4	0	0	0	0	110.1	D32 H34 N72	D32-V36 PolarHBondContact OD1-N 2.81Å; D32-V36 PolarHBondContact OD2-N 3.16Å; H34-V36 VanDerWaalsContact C-N 3.27Å; H34-V36 HydrophobicContact CB-CG2 3.91Å; H34-V36 PolarHBondContact O-N 3.43Å; V36-N72 HydrophobicContact CG1-CB 4.4Å; V36-N72 WeakPolarHBondContact CG1-OD1 3.19Å
37	C	93.7	Very high	90.3	Very high	1 Å²	1	74.9 Å²	74.9	1%	0.007	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.9	18	-179.9	-60.3	0	0	0	0	113.1	D32 G35 V39 A40 M41 Y65 C68 R69	D32-C37 PolarHBondContact OD2-N 3.42Å; G35-C37 PolarHBondContact O-N 3.33Å; C37-V39 PolarHBondContact O-N 3.23Å; C37-A40 PolarHBondContact O-N 3.38Å; C37-M41 WeakPolarHBondContact O-CB 3.24Å; C37-M41 PolarHBondContact O-N 3.47Å; C37-Y65 HydrophobicContact CB-CD2 4.16Å; C37-Y65 HydrophobicContact CB-CE2 4.08Å; C37-C68 WeakPolarHBondContact CA-SG 3.06Å; C37-C68 HydrophobicContact CB-CB 3.82Å; C37-C68 WeakPolarHBondContact CB-SG 2.97Å; C37-C68 WeakPolarHBondContact SG-CB 3.31Å; C37-C68 PolarHBondContact SG-O 3.39Å; C37-C68 VanDerWaalsContact SG-O 3.33Å; C37-C68 CovalentContact SG-SG 2.04Å; C37-C68 PolarHBondContact SG-SG 3.27Å; C37-R69 HydrophobicContact CB-CG 4.32Å; C37-R69 PolarHBondContact SG-N 3.45Å; C37-R69 VanDerWaalsContact SG-N 3.44Å
38	K	94.3	Very high	91.6	Very high	121 Å²	121	73.5 Å²	73.5	53%	0.526	38%	0.384	S	S	.	.	H	α-helix	trans	-62.9	-39.6	-176.1	-175.8	175.1	-178.9	179	0	112.6	G35 M41 L42	G35-K38 WeakPolarHBondContact O-CB 3.01Å; G35-K38 PolarHBondContact O-N 3.32Å; K38-M41 HydrophobicContact CG-CE 4.25Å; K38-M41 PolarHBondContact O-N 3.33Å; K38-L42 HydrophobicContact CG-CD1 4.15Å; K38-L42 HydrophobicContact CG-CG 4.42Å; K38-L42 WeakPolarHBondContact O-CB 3.34Å; K38-L42 VanDerWaalsContact O-CG 3.24Å; K38-L42 WeakPolarHBondContact O-CG 3.35Å; K38-L42 PolarHBondContact O-N 3.26Å
39	V	93.8	Very high	92.9	Very high	86 Å²	86	74.1 Å²	74.1	52%	0.521	37%	0.371	S	S	.	.	H	α-helix	trans	-62.1	-50.2	178.6	179.1	0	0	0	0	110.3	C37 M41 L42 E43	C37-V39 PolarHBondContact O-N 3.23Å; V39-M41 VanDerWaalsContact C-N 3.31Å; V39-M41 PolarHBondContact O-N 3.3Å; V39-L42 PolarHBondContact O-N 3.48Å; V39-L42 VanDerWaalsContact O-N 3.16Å; V39-E43 PolarHBondContact O-N 3.36Å
40	A	93.5	Very high	94.1	Very high	1 Å²	1	76.3 Å²	76.3	1%	0.008	38%	0.381	C	S	.	.	H	α-helix	trans	-59	-44.2	177.6	0	0	0	0	0	111.8	C37 L42 E43 W44 Y65 C68 F97	C37-A40 PolarHBondContact O-N 3.38Å; A40-L42 VanDerWaalsContact C-N 3.32Å; A40-L42 PolarHBondContact O-N 3.1Å; A40-E43 PolarHBondContact O-N 3.33Å; A40-W44 PolarHBondContact O-N 3.34Å; A40-Y65 HydrophobicContact CB-CD2 4.14Å; A40-C68 HydrophobicContact CB-CB 4.48Å; A40-F97 HydrophobicContact CB-CE1 4.27Å; A40-F97 HydrophobicContact CB-CE2 3.54Å; A40-F97 HydrophobicContact CB-CZ 3.22Å
41	M	94.7	Very high	94.8	Very high	57 Å²	57	75.4 Å²	75.4	28%	0.281	37%	0.372	S	S	.	.	H	α-helix	trans	-59.7	-43.6	177.7	-178.6	-83.2	-68.2	0	0	111.4	C37 K38 V39 T45 Y65	C37-M41 WeakPolarHBondContact O-CB 3.24Å; C37-M41 PolarHBondContact O-N 3.47Å; K38-M41 HydrophobicContact CG-CE 4.25Å; K38-M41 PolarHBondContact O-N 3.33Å; V39-M41 VanDerWaalsContact C-N 3.31Å; V39-M41 PolarHBondContact O-N 3.3Å; M41-T45 VanDerWaalsContact O-CB 3.28Å; M41-T45 WeakPolarHBondContact O-CB 3.47Å; M41-T45 PolarHBondContact O-N 3.22Å; M41-T45 PolarHBondContact O-OG1 2.8Å; M41-T45 PolarHBondContact SD-OG1 3.4Å; M41-Y65 HydrophobicContact CB-CD2 3.74Å; M41-Y65 HydrophobicContact CB-CE2 3.58Å; M41-Y65 HydrophobicContact CB-CG 4.38Å; M41-Y65 HydrophobicContact CG-CE2 4.07Å
42	L	96	Very high	95.2	Very high	73 Å²	73	77.8 Å²	77.8	38%	0.382	38%	0.38	S	S	.	.	H	α-helix	trans	-66	-42.7	179	-72.9	173.3	0	0	0	111.6	K38 V39 A40 T45 Q46	K38-L42 HydrophobicContact CG-CD1 4.15Å; K38-L42 HydrophobicContact CG-CG 4.42Å; K38-L42 WeakPolarHBondContact O-CB 3.34Å; K38-L42 VanDerWaalsContact O-CG 3.24Å; K38-L42 WeakPolarHBondContact O-CG 3.35Å; K38-L42 PolarHBondContact O-N 3.26Å; V39-L42 PolarHBondContact O-N 3.48Å; V39-L42 VanDerWaalsContact O-N 3.16Å; A40-L42 VanDerWaalsContact C-N 3.32Å; A40-L42 PolarHBondContact O-N 3.1Å; L42-T45 PolarHBondContact O-N 3.47Å; L42-Q46 WeakPolarHBondContact O-CB 3.34Å; L42-Q46 WeakPolarHBondContact O-CG 3.18Å; L42-Q46 PolarHBondContact O-N 2.93Å
43	E	95.1	Very high	95.6	Very high	43 Å²	43	83.8 Å²	83.8	20%	0.201	40%	0.4	C	S	.	.	H	α-helix	trans	-60.4	-48.4	176.5	-70.5	178.8	165.1	0	0	111.3	V39 A40 T45 Q46 C47 H96 K100	V39-E43 PolarHBondContact O-N 3.36Å; A40-E43 PolarHBondContact O-N 3.33Å; E43-T45 PolarHBondContact O-N 3.04Å; E43-Q46 PolarHBondContact O-N 3.47Å; E43-C47 PolarHBondContact O-N 2.78Å; E43-H96 IonicContact OE2-CD2 3.52Å; E43-K100 IonicContact OE1-NZ 2.62Å; E43-K100 PolarHBondContact OE1-NZ 3.43Å
44	W	95.9	Very high	95.8	Very high	69 Å²	69	79.8 Å²	79.8	26%	0.261	38%	0.384	S	S	.	.	H	α-helix	trans	-60.1	-45.8	175	175.4	52.4	0	0	0	112.1	A40 Q46 C47 M48 E61 A62 Y65	A40-W44 PolarHBondContact O-N 3.34Å; W44-Q46 VanDerWaalsContact C-N 3.33Å; W44-Q46 PolarHBondContact O-N 3.31Å; W44-C47 WeakPolarHBondContact O-CB 3.47Å; W44-C47 PolarHBondContact O-N 3.42Å; W44-M48 VanDerWaalsContact O-CG 3.29Å; W44-M48 WeakPolarHBondContact O-CG 3.49Å; W44-M48 PolarHBondContact O-N 3.03Å; W44-E61 HydrophobicContact CB-CB 3.93Å; W44-E61 HydrophobicContact CG-CB 4.49Å; W44-A62 HydrophobicContact CG-CB 4.37Å; W44-Y65 HydrophobicContact CD2-CD1 4.2Å; W44-Y65 AromaticContact CE3-CD1 3.4Å; W44-Y65 HydrophobicContact CE3-CD1 3.4Å; W44-Y65 VanDerWaalsContact CE3-CD1 3.4Å; W44-Y65 AromaticContact CE3-CE1 3.78Å; W44-Y65 HydrophobicContact CE3-CE1 3.78Å; W44-Y65 HydrophobicContact CE3-CG 4.3Å; W44-Y65 AromaticContact CZ3-CD1 3.71Å; W44-Y65 HydrophobicContact CZ3-CD1 3.71Å; W44-Y65 AromaticContact CZ3-CE1 3.66Å; W44-Y65 HydrophobicContact CZ3-CE1 3.66Å
45	T	96.6	Very high	95.9	Very high	30 Å²	30	74.8 Å²	74.8	18%	0.184	36%	0.363	C	S	.	.	H	α-helix	trans	-65.7	-36.3	179.8	-56.5	0	0	0	0	112	M41 L42 E43 M48 K49 W53	M41-T45 VanDerWaalsContact O-CB 3.28Å; M41-T45 WeakPolarHBondContact O-CB 3.47Å; M41-T45 PolarHBondContact O-N 3.22Å; M41-T45 PolarHBondContact O-OG1 2.8Å; M41-T45 PolarHBondContact SD-OG1 3.4Å; L42-T45 PolarHBondContact O-N 3.47Å; E43-T45 PolarHBondContact O-N 3.04Å; T45-M48 PolarHBondContact O-N 3Å; T45-K49 HydrophobicContact CG2-CD 4.31Å; T45-K49 WeakPolarHBondContact O-CB 3.06Å; T45-K49 VanDerWaalsContact O-CG 3.29Å; T45-K49 WeakPolarHBondContact O-CG 3.28Å; T45-K49 PolarHBondContact O-N 2.98Å; T45-W53 HydrophobicContact CG2-CH2 4.46Å
46	Q	97.7	Very high	95.9	Very high	125 Å²	125	77.5 Å²	77.5	58%	0.584	38%	0.378	S	S	*	.	H	α-helix	trans	-64.6	-44	174.6	-76	172.4	27.5	0	0	111	L42 E43 W44 K49 K50	L42-Q46 WeakPolarHBondContact O-CB 3.34Å; L42-Q46 WeakPolarHBondContact O-CG 3.18Å; L42-Q46 PolarHBondContact O-N 2.93Å; E43-Q46 PolarHBondContact O-N 3.47Å; W44-Q46 VanDerWaalsContact C-N 3.33Å; W44-Q46 PolarHBondContact O-N 3.31Å; Q46-K49 PolarHBondContact O-N 2.96Å; Q46-K50 WeakPolarHBondContact O-CB 3.41Å; Q46-K50 PolarHBondContact O-N 3.22Å
47	C	98.2	Very high	96	Very high	14 Å²	14	78.8 Å²	78.8	10%	0.095	38%	0.382	C	S	.	.	H	α-helix	trans	-58.6	-48.4	173.2	-176.5	0	0	0	0	111.1	E43 W44 K49 K50 N51 C58 E61	E43-C47 PolarHBondContact O-N 2.78Å; W44-C47 WeakPolarHBondContact O-CB 3.47Å; W44-C47 PolarHBondContact O-N 3.42Å; C47-K49 VanDerWaalsContact C-N 3.33Å; C47-K49 PolarHBondContact O-N 2.98Å; C47-K50 PolarHBondContact O-N 3.19Å; C47-N51 WeakPolarHBondContact O-CB 3.36Å; C47-N51 PolarHBondContact O-N 3.23Å; C47-N51 PolarHBondContact O-ND2 2.86Å; C47-N51 VanDerWaalsContact O-ND2 3.09Å; C47-N51 PolarHBondContact SG-ND2 3.45Å; C47-C58 HydrophobicContact CB-CB 3.77Å; C47-C58 WeakPolarHBondContact CB-SG 3.47Å; C47-C58 PolarHBondContact O-SG 3.35Å; C47-C58 VanDerWaalsContact O-SG 3.34Å; C47-C58 WeakPolarHBondContact SG-CA 3.29Å; C47-C58 WeakPolarHBondContact SG-CB 3.29Å; C47-C58 CovalentContact SG-SG 2.04Å; C47-C58 PolarHBondContact SG-SG 3.12Å; C47-E61 HydrophobicContact CB-CG 4.17Å
48	M	98.1	Very high	96.1	Very high	17 Å²	17	78.8 Å²	78.8	8%	0.084	38%	0.381	C	S	.	.	H	α-helix	trans	-57.6	-46.3	178.5	-69.5	-67.3	-76.2	0	0	111.2	W44 T45 K50 N51 H52 W53 N55 C58	W44-M48 VanDerWaalsContact O-CG 3.29Å; W44-M48 WeakPolarHBondContact O-CG 3.49Å; W44-M48 PolarHBondContact O-N 3.03Å; T45-M48 PolarHBondContact O-N 3Å; M48-K50 PolarHBondContact O-N 3.34Å; M48-N51 CarbonylContact O-C 3.5Å; M48-N51 PolarHBondContact O-N 2.96Å; M48-H52 PolarHBondContact O-N 2.73Å; M48-W53 HydrophobicContact CB-CD2 4.37Å; M48-W53 HydrophobicContact CB-CE3 3.69Å; M48-W53 HydrophobicContact CB-CZ3 3.92Å; M48-W53 HydrophobicContact CE-CB 4.23Å; M48-W53 HydrophobicContact CE-CE3 3.89Å; M48-W53 WeakPolarHBondContact CE-O 3.46Å; M48-W53 HydrophobicContact CG-CE3 4.42Å; M48-W53 WeakPolarHBondContact O-CA 3.46Å; M48-W53 PolarHBondContact O-N 3.22Å; M48-N55 HydrophobicContact CE-CB 4.14Å; M48-N55 HydrophobicContact SD-CB 4.17Å; M48-C58 PolarHBondContact N-SG 3.48Å; M48-C58 VanDerWaalsContact N-SG 3.44Å; M48-C58 HydrophobicContact SD-CB 4.07Å
49	K	98.3	Very high	96.1	Very high	134 Å²	134	75.6 Å²	75.6	58%	0.583	37%	0.366	S	S	*	.	H	α-helix	trans	-61.1	-43.2	177.5	-75	174.3	178.8	179.9	0	112.4	T45 Q46 C47 N51 W53	T45-K49 HydrophobicContact CG2-CD 4.31Å; T45-K49 WeakPolarHBondContact O-CB 3.06Å; T45-K49 VanDerWaalsContact O-CG 3.29Å; T45-K49 WeakPolarHBondContact O-CG 3.28Å; T45-K49 PolarHBondContact O-N 2.98Å; Q46-K49 PolarHBondContact O-N 2.96Å; C47-K49 VanDerWaalsContact C-N 3.33Å; C47-K49 PolarHBondContact O-N 2.98Å; K49-N51 VanDerWaalsContact C-N 3.29Å; K49-N51 PolarHBondContact O-N 3.41Å; K49-W53 HydrophobicContact CG-CH2 4.32Å; K49-W53 HydrophobicContact CG-CZ2 4.05Å
50	K	98.2	Very high	96.1	Very high	172 Å²	172	75.1 Å²	75.1	75%	0.748	37%	0.366	S	S	*	.	H	α-helix	trans	-64.8	-34.6	178.9	-176.9	178.8	175.8	-175.5	0	112.2	Q46 C47 M48	Q46-K50 WeakPolarHBondContact O-CB 3.41Å; Q46-K50 PolarHBondContact O-N 3.22Å; C47-K50 PolarHBondContact O-N 3.19Å; M48-K50 PolarHBondContact O-N 3.34Å
51	N	98	Very high	96.1	Very high	46 Å²	46	78 Å²	78	25%	0.246	38%	0.38	C	S	.	.	T	Hydrogen-bonded Turn	trans	-103.7	27.9	-174.9	-64.9	-55.1	0	0	0	113.2	C47 M48 K49 W53 N54 L57 C58	C47-N51 WeakPolarHBondContact O-CB 3.36Å; C47-N51 PolarHBondContact O-N 3.23Å; C47-N51 PolarHBondContact O-ND2 2.86Å; C47-N51 VanDerWaalsContact O-ND2 3.09Å; C47-N51 PolarHBondContact SG-ND2 3.45Å; M48-N51 CarbonylContact O-C 3.5Å; M48-N51 PolarHBondContact O-N 2.96Å; K49-N51 VanDerWaalsContact C-N 3.29Å; K49-N51 PolarHBondContact O-N 3.41Å; N51-W53 VanDerWaalsContact C-N 3.25Å; N51-W53 PolarHBondContact O-N 2.89Å; N51-N54 WeakPolarHBondContact O-CB 3.45Å; N51-N54 PolarHBondContact O-N 3.3Å; N51-L57 HydrophobicContact CB-CB 4.28Å; N51-L57 HydrophobicContact CB-CD1 4.09Å; N51-C58 PolarHBondContact ND2-SG 2.83Å; N51-C58 VanDerWaalsContact ND2-SG 3.39Å
52	H	97.5	Very high	96.1	Very high	172 Å²	172	75.4 Å²	75.4	80%	0.796	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	51.2	42.2	177.8	-56.9	-74.3	0	0	0	114	M48 N54	M48-H52 PolarHBondContact O-N 2.73Å; H52-N54 PolarHBondContact O-N 3.21Å
53	W	96.6	Very high	96	Very high	165 Å²	165	72 Å²	72	63%	0.625	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	62.1	23.2	-178.6	-56.1	95.8	0	0	0	114.8	T45 M48 K49 N51 N55	T45-W53 HydrophobicContact CG2-CH2 4.46Å; M48-W53 HydrophobicContact CB-CD2 4.37Å; M48-W53 HydrophobicContact CB-CE3 3.69Å; M48-W53 HydrophobicContact CB-CZ3 3.92Å; M48-W53 HydrophobicContact CE-CB 4.23Å; M48-W53 HydrophobicContact CE-CE3 3.89Å; M48-W53 WeakPolarHBondContact CE-O 3.46Å; M48-W53 HydrophobicContact CG-CE3 4.42Å; M48-W53 WeakPolarHBondContact O-CA 3.46Å; M48-W53 PolarHBondContact O-N 3.22Å; K49-W53 HydrophobicContact CG-CH2 4.32Å; K49-W53 HydrophobicContact CG-CZ2 4.05Å; N51-W53 VanDerWaalsContact C-N 3.25Å; N51-W53 PolarHBondContact O-N 2.89Å; W53-N55 PolarHBondContact O-N 2.98Å
54	N	96.8	Very high	95.9	Very high	70 Å²	70	70.2 Å²	70.2	37%	0.374	34%	0.343	S	S	.	.			trans	-80.3	100.9	173.1	-170.3	-5.8	0	0	0	111.3	N51 H52 S56 L57	N51-N54 WeakPolarHBondContact O-CB 3.45Å; N51-N54 PolarHBondContact O-N 3.3Å; H52-N54 PolarHBondContact O-N 3.21Å; N54-S56 VanDerWaalsContact C-N 3.3Å; N54-S56 PolarHBondContact O-N 3.45Å; N54-S56 PolarHBondContact OD1-N 3.04Å; N54-S56 PolarHBondContact OD1-OG 3.02Å; N54-L57 HydrophobicContact CB-CD1 4.18Å; N54-L57 HydrophobicContact CB-CG 4.43Å; N54-L57 PolarHBondContact O-N 2.97Å
55	N	93.1	Very high	95.8	Very high	72 Å²	72	68.4 Å²	68.4	39%	0.385	34%	0.336	S	S	.	.	G	3₁₀ helix	trans	-63.1	-31.5	-177.8	-171.6	34.1	0	0	0	113.7	M48 W53 L57 C58 R59	M48-N55 HydrophobicContact CE-CB 4.14Å; M48-N55 HydrophobicContact SD-CB 4.17Å; W53-N55 PolarHBondContact O-N 2.98Å; N55-L57 PolarHBondContact O-N 3.07Å; N55-C58 PolarHBondContact O-N 2.92Å; N55-R59 PolarHBondContact O-N 3.36Å
56	S	94.4	Very high	95.7	Very high	83 Å²	83	68.7 Å²	68.7	58%	0.58	34%	0.336	S	S	*	.	G	3₁₀ helix	trans	-64.3	-25.7	-177.4	64.6	0	0	0	0	112.7	N54 R59	N54-S56 VanDerWaalsContact C-N 3.3Å; N54-S56 PolarHBondContact O-N 3.45Å; N54-S56 PolarHBondContact OD1-N 3.04Å; N54-S56 PolarHBondContact OD1-OG 3.02Å; S56-R59 VanDerWaalsContact O-CG 3.25Å; S56-R59 WeakPolarHBondContact O-CG 3.42Å
57	L	95.5	Very high	95.5	Very high	104 Å²	104	64.2 Å²	64.2	55%	0.545	31%	0.314	S	S	.	.	G	3₁₀ helix	trans	-83.9	-11	176.8	-60.8	178.2	0	0	0	113.6	N51 N54 N55	N51-L57 HydrophobicContact CB-CB 4.28Å; N51-L57 HydrophobicContact CB-CD1 4.09Å; N54-L57 HydrophobicContact CB-CD1 4.18Å; N54-L57 HydrophobicContact CB-CG 4.43Å; N54-L57 PolarHBondContact O-N 2.97Å; N55-L57 PolarHBondContact O-N 3.07Å
58	C	95.9	Very high	95.2	Very high	0 Å²	0	64 Å²	64	0%	0	31%	0.313	C	S	.	.	G	3₁₀ helix	trans	-119.9	26.6	-174	-63.4	0	0	0	0	112.6	C47 M48 N51 N55 S60 E61 A62	C47-C58 HydrophobicContact CB-CB 3.77Å; C47-C58 WeakPolarHBondContact CB-SG 3.47Å; C47-C58 PolarHBondContact O-SG 3.35Å; C47-C58 VanDerWaalsContact O-SG 3.34Å; C47-C58 WeakPolarHBondContact SG-CA 3.29Å; C47-C58 WeakPolarHBondContact SG-CB 3.29Å; C47-C58 CovalentContact SG-SG 2.04Å; C47-C58 PolarHBondContact SG-SG 3.12Å; M48-C58 PolarHBondContact N-SG 3.48Å; M48-C58 VanDerWaalsContact N-SG 3.44Å; M48-C58 HydrophobicContact SD-CB 4.07Å; N51-C58 PolarHBondContact ND2-SG 2.83Å; N51-C58 VanDerWaalsContact ND2-SG 3.39Å; N55-C58 PolarHBondContact O-N 2.92Å; C58-S60 PolarHBondContact O-N 3.26Å; C58-E61 WeakPolarHBondContact CA-OE2 3.06Å; C58-E61 PolarHBondContact O-N 3.4Å; C58-A62 VanDerWaalsContact O-CB 3.31Å; C58-A62 WeakPolarHBondContact O-CB 3.36Å; C58-A62 PolarHBondContact O-N 3.26Å
59	R	94.7	Very high	95	Very high	55 Å²	55	65 Å²	65	21%	0.208	32%	0.315	C	S	.	.	H	α-helix	trans	-63.9	-39.6	-173.4	-76.3	-76.2	-64.9	176.3	-8.6	112.6	N55 S56 A62 A63 G84 F85 E89	N55-R59 PolarHBondContact O-N 3.36Å; S56-R59 VanDerWaalsContact O-CG 3.25Å; S56-R59 WeakPolarHBondContact O-CG 3.42Å; R59-A62 PolarHBondContact O-N 2.82Å; R59-A63 WeakPolarHBondContact O-CB 3.48Å; R59-A63 PolarHBondContact O-N 3.45Å; R59-G84 PolarHBondContact NH2-O 2.75Å; R59-F85 VanDerWaalsContact NH2-CA 3.33Å; R59-F85 WeakPolarHBondContact O-CE1 3.36Å; R59-E89 IonicContact CZ-OE2 3.85Å; R59-E89 IonicContact NE-OE1 3.67Å; R59-E89 IonicContact NE-OE2 3.76Å; R59-E89 IonicContact NH2-OE1 3.56Å; R59-E89 IonicContact NH2-OE2 3.66Å; R59-E89 PolarHBondContact NH2-OE2 3.34Å
60	S	92.8	Very high	94.7	Very high	75 Å²	75	59 Å²	59	52%	0.524	29%	0.292	S	S	.	.	H	α-helix	trans	-60.4	-47	177.6	29.6	0	0	0	0	112.6	C58 A63 G64	C58-S60 PolarHBondContact O-N 3.26Å; S60-A63 PolarHBondContact O-N 2.87Å; S60-G64 PolarHBondContact O-N 3.3Å; S60-G64 VanDerWaalsContact O-N 3.1Å
61	E	93.8	Very high	94.3	Very high	61 Å²	61	56.3 Å²	56.3	29%	0.285	28%	0.281	S	S	.	.	H	α-helix	trans	-72.3	-39.1	-178.9	-62.1	81.5	168.9	0	0	110.6	W44 C47 C58 A63 G64 Y65	W44-E61 HydrophobicContact CB-CB 3.93Å; W44-E61 HydrophobicContact CG-CB 4.49Å; C47-E61 HydrophobicContact CB-CG 4.17Å; C58-E61 WeakPolarHBondContact CA-OE2 3.06Å; C58-E61 PolarHBondContact O-N 3.4Å; E61-A63 VanDerWaalsContact C-N 3.35Å; E61-G64 PolarHBondContact O-N 3.1Å; E61-Y65 PolarHBondContact O-N 2.9Å
62	A	94.9	Very high	94	Very high	4 Å²	4	57.4 Å²	57.4	3%	0.033	29%	0.287	C	S	.	.	H	α-helix	trans	-59.4	-46.2	173.2	0	0	0	0	0	111.3	W44 C58 R59 G64 Y65 L66 F85	W44-A62 HydrophobicContact CG-CB 4.37Å; C58-A62 VanDerWaalsContact O-CB 3.31Å; C58-A62 WeakPolarHBondContact O-CB 3.36Å; C58-A62 PolarHBondContact O-N 3.26Å; R59-A62 PolarHBondContact O-N 2.82Å; A62-G64 VanDerWaalsContact C-N 3.35Å; A62-G64 PolarHBondContact O-N 3.46Å; A62-Y65 PolarHBondContact O-N 3.45Å; A62-L66 WeakPolarHBondContact O-CB 3.37Å; A62-L66 VanDerWaalsContact O-CG 3.3Å; A62-L66 WeakPolarHBondContact O-CG 3.47Å; A62-L66 PolarHBondContact O-N 2.99Å; A62-F85 HydrophobicContact CB-CE1 4.43Å; A62-F85 HydrophobicContact CB-CZ 4.09Å
63	A	94	Very high	93.7	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-58.7	-46.4	176.5	0	0	0	0	0	110.9	R59 S60 E61 Y65 L66 R67 F85 A93	R59-A63 WeakPolarHBondContact O-CB 3.48Å; R59-A63 PolarHBondContact O-N 3.45Å; S60-A63 PolarHBondContact O-N 2.87Å; E61-A63 VanDerWaalsContact C-N 3.35Å; A63-Y65 PolarHBondContact O-N 3.43Å; A63-L66 PolarHBondContact O-N 3.47Å; A63-R67 WeakPolarHBondContact O-CB 3.3Å; A63-R67 PolarHBondContact O-N 3.22Å; A63-F85 HydrophobicContact CB-CD1 3.82Å; A63-F85 HydrophobicContact CB-CE1 3.65Å; A63-F85 HydrophobicContact CB-CG 4.37Å; A63-F85 HydrophobicContact CB-CZ 4.07Å; A63-A93 HydrophobicContact CB-CB 3.95Å
64	G	93.3	Very high	93.4	Very high	6 Å²	6	49 Å²	49	6%	0.062	26%	0.26	C	S	.	.	H	α-helix	trans	-60	-43.8	176.5	0	0	0	0	0	113.6	S60 E61 A62 C68	S60-G64 PolarHBondContact O-N 3.3Å; S60-G64 VanDerWaalsContact O-N 3.1Å; E61-G64 PolarHBondContact O-N 3.1Å; A62-G64 VanDerWaalsContact C-N 3.35Å; A62-G64 PolarHBondContact O-N 3.46Å; G64-C68 PolarHBondContact O-N 3.34Å
65	Y	94.3	Very high	93	Very high	32 Å²	32	46.9 Å²	46.9	13%	0.125	25%	0.248	C	C	.	.	H	α-helix	trans	-64.7	-48.8	177.7	171.8	-129.9	0	0	0	112.8	C37 A40 M41 W44 E61 A62 A63 R67 C68 R69	C37-Y65 HydrophobicContact CB-CD2 4.16Å; C37-Y65 HydrophobicContact CB-CE2 4.08Å; A40-Y65 HydrophobicContact CB-CD2 4.14Å; M41-Y65 HydrophobicContact CB-CD2 3.74Å; M41-Y65 HydrophobicContact CB-CE2 3.58Å; M41-Y65 HydrophobicContact CB-CG 4.38Å; M41-Y65 HydrophobicContact CG-CE2 4.07Å; W44-Y65 HydrophobicContact CD2-CD1 4.2Å; W44-Y65 AromaticContact CE3-CD1 3.4Å; W44-Y65 HydrophobicContact CE3-CD1 3.4Å; W44-Y65 VanDerWaalsContact CE3-CD1 3.4Å; W44-Y65 AromaticContact CE3-CE1 3.78Å; W44-Y65 HydrophobicContact CE3-CE1 3.78Å; W44-Y65 HydrophobicContact CE3-CG 4.3Å; W44-Y65 AromaticContact CZ3-CD1 3.71Å; W44-Y65 HydrophobicContact CZ3-CD1 3.71Å; W44-Y65 AromaticContact CZ3-CE1 3.66Å; W44-Y65 HydrophobicContact CZ3-CE1 3.66Å; E61-Y65 PolarHBondContact O-N 2.9Å; A62-Y65 PolarHBondContact O-N 3.45Å; A63-Y65 PolarHBondContact O-N 3.43Å; Y65-R67 VanDerWaalsContact C-N 3.29Å; Y65-R67 PolarHBondContact O-N 2.96Å; Y65-C68 PolarHBondContact O-N 3.39Å; Y65-R69 HydrophobicContact CD2-CG 4.44Å; Y65-R69 HydrophobicContact CE2-CG 3.99Å; Y65-R69 PolarHBondContact O-N 3.37Å; Y65-R69 PolarHBondContact OH-NH1 3.09Å; Y65-R69 VanDerWaalsContact OH-NH1 3.07Å
66	L	94.1	Very high	92.6	Very high	35 Å²	35	46.2 Å²	46.2	18%	0.183	25%	0.245	C	C	.	.	H	α-helix	trans	-67.8	-34.5	-178.7	-65.5	168.4	0	0	0	111.5	A62 A63 R69 A70 M75 L83 F85	A62-L66 WeakPolarHBondContact O-CB 3.37Å; A62-L66 VanDerWaalsContact O-CG 3.3Å; A62-L66 WeakPolarHBondContact O-CG 3.47Å; A62-L66 PolarHBondContact O-N 2.99Å; A63-L66 PolarHBondContact O-N 3.47Å; L66-R69 WeakPolarHBondContact O-CB 3.39Å; L66-R69 PolarHBondContact O-N 3.18Å; L66-A70 PolarHBondContact O-N 2.97Å; L66-M75 HydrophobicContact CD2-CE 3.7Å; L66-M75 HydrophobicContact CD2-SD 4.37Å; L66-L83 HydrophobicContact CB-CD1 4.12Å; L66-L83 HydrophobicContact CD1-CD1 4.11Å; L66-L83 HydrophobicContact CD1-CD2 4.45Å; L66-F85 HydrophobicContact CD1-CE2 3.68Å; L66-F85 HydrophobicContact CD1-CZ 3.9Å
67	R	92.1	Very high	91.9	Very high	32 Å²	32	45.8 Å²	45.8	12%	0.121	24%	0.24	C	C	.	.	H	α-helix	trans	-61.9	-48.8	172.7	-177.4	171.6	-170.4	125.7	19.6	112.8	A63 Y65 R69 A70 E71 W90 N94	A63-R67 WeakPolarHBondContact O-CB 3.3Å; A63-R67 PolarHBondContact O-N 3.22Å; Y65-R67 VanDerWaalsContact C-N 3.29Å; Y65-R67 PolarHBondContact O-N 2.96Å; R67-R69 PolarHBondContact O-N 2.96Å; R67-A70 PolarHBondContact O-N 3.44Å; R67-E71 HydrophobicContact CG-CG 4.36Å; R67-E71 WeakPolarHBondContact CG-OE1 3.41Å; R67-E71 IonicContact CZ-OE1 2.75Å; R67-E71 IonicContact NE-OE1 2.74Å; R67-E71 PolarHBondContact NE-OE1 3.25Å; R67-E71 IonicContact NH2-OE1 3.78Å; R67-E71 PolarHBondContact NH2-OE1 3.19Å; R67-E71 WeakPolarHBondContact O-CG 3.47Å; R67-E71 PolarHBondContact O-N 3.28Å; R67-W90 HydrophobicContact CB-CH2 3.54Å; R67-W90 HydrophobicContact CB-CZ2 3.64Å; R67-W90 HydrophobicContact CB-CZ3 4.04Å; R67-W90 HydrophobicContact CG-CH2 4.11Å; R67-W90 HydrophobicContact CG-CZ2 3.65Å; R67-W90 PolarHBondContact NH1-O 2.04Å; R67-N94 PolarHBondContact NE-OD1 3.05Å; R67-N94 PolarHBondContact NH1-ND2 3.48Å; R67-N94 PolarHBondContact NH1-OD1 2.74Å; R67-N94 VanDerWaalsContact NH2-CG 3.26Å; R67-N94 PolarHBondContact NH2-ND2 3.32Å; R67-N94 PolarHBondContact NH2-OD1 3.48Å
68	C	93.3	Very high	91.2	Very high	9 Å²	9	46.2 Å²	46.2	6%	0.061	24%	0.243	C	C	.	.	H	α-helix	trans	-54.2	-41	174.9	176.5	0	0	0	0	111	C37 A40 G64 Y65 E71 N72	C37-C68 WeakPolarHBondContact CA-SG 3.06Å; C37-C68 HydrophobicContact CB-CB 3.82Å; C37-C68 WeakPolarHBondContact CB-SG 2.97Å; C37-C68 WeakPolarHBondContact SG-CB 3.31Å; C37-C68 PolarHBondContact SG-O 3.39Å; C37-C68 VanDerWaalsContact SG-O 3.33Å; C37-C68 CovalentContact SG-SG 2.04Å; C37-C68 PolarHBondContact SG-SG 3.27Å; A40-C68 HydrophobicContact CB-CB 4.48Å; G64-C68 PolarHBondContact O-N 3.34Å; Y65-C68 PolarHBondContact O-N 3.39Å; C68-E71 PolarHBondContact O-N 2.75Å; C68-N72 WeakPolarHBondContact O-CB 3.36Å; C68-N72 PolarHBondContact O-N 2.97Å; C68-N72 VanDerWaalsContact O-N 3.1Å; C68-N72 PolarHBondContact O-ND2 2.89Å
69	R	93.8	Very high	90.4	Very high	37 Å²	37	47.4 Å²	47.4	14%	0.14	25%	0.249	C	C	.	.	H	α-helix	trans	-65.1	-41.8	177.2	-67.8	-176.1	66.4	121.6	6.5	112.4	P30 C37 Y65 L66 R67 N72 N73 L74 M75	P30-R69 PolarHBondContact O-NH2 3.4Å; C37-R69 HydrophobicContact CB-CG 4.32Å; C37-R69 PolarHBondContact SG-N 3.45Å; C37-R69 VanDerWaalsContact SG-N 3.44Å; Y65-R69 HydrophobicContact CD2-CG 4.44Å; Y65-R69 HydrophobicContact CE2-CG 3.99Å; Y65-R69 PolarHBondContact O-N 3.37Å; Y65-R69 PolarHBondContact OH-NH1 3.09Å; Y65-R69 VanDerWaalsContact OH-NH1 3.07Å; L66-R69 WeakPolarHBondContact O-CB 3.39Å; L66-R69 PolarHBondContact O-N 3.18Å; R67-R69 PolarHBondContact O-N 2.96Å; R69-N72 PolarHBondContact O-N 3.48Å; R69-N73 PolarHBondContact O-N 3.41Å; R69-L74 HydrophobicContact CB-CB 3.96Å; R69-L74 HydrophobicContact CG-CB 4.28Å; R69-L74 PolarHBondContact NH2-O 3.48Å; R69-L74 CarbonylContact O-C 3.53Å; R69-L74 WeakPolarHBondContact O-CA 3.44Å; R69-L74 WeakPolarHBondContact O-CB 3.22Å; R69-L74 PolarHBondContact O-N 2.9Å; R69-M75 HydrophobicContact CB-CB 4.01Å; R69-M75 PolarHBondContact O-N 3.47Å
70	A	90.9	Very high	89.7	Confident	10 Å²	10	46.7 Å²	46.7	8%	0.083	25%	0.248	C	C	.	.	H	α-helix	trans	-64.9	-42.5	177.7	0	0	0	0	0	112.1	L66 R67 N72 N73 I80	L66-A70 PolarHBondContact O-N 2.97Å; R67-A70 PolarHBondContact O-N 3.44Å; A70-N72 VanDerWaalsContact C-N 3.3Å; A70-N72 PolarHBondContact O-N 3.01Å; A70-N73 PolarHBondContact O-N 3.45Å; A70-I80 HydrophobicContact CB-CD1 3.96Å; A70-I80 HydrophobicContact CB-CG1 4.2Å
71	E	91.5	Very high	89.4	Confident	114 Å²	114	48 Å²	48	53%	0.533	26%	0.258	S	S	.	.	H	α-helix	trans	-68.9	-28	-179.7	-69.7	174.7	176.6	0	0	113	R67 C68	R67-E71 HydrophobicContact CG-CG 4.36Å; R67-E71 WeakPolarHBondContact CG-OE1 3.41Å; R67-E71 IonicContact CZ-OE1 2.75Å; R67-E71 IonicContact NE-OE1 2.74Å; R67-E71 PolarHBondContact NE-OE1 3.25Å; R67-E71 IonicContact NH2-OE1 3.78Å; R67-E71 PolarHBondContact NH2-OE1 3.19Å; R67-E71 WeakPolarHBondContact O-CG 3.47Å; R67-E71 PolarHBondContact O-N 3.28Å; C68-E71 PolarHBondContact O-N 2.75Å
72	N	91.2	Very high	89.1	Confident	70 Å²	70	51.4 Å²	51.4	37%	0.374	28%	0.277	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.9	18.6	179.4	-69.7	-81.3	0	0	0	113.6	V36 C68 R69 A70 L74	V36-N72 HydrophobicContact CG1-CB 4.4Å; V36-N72 WeakPolarHBondContact CG1-OD1 3.19Å; C68-N72 WeakPolarHBondContact O-CB 3.36Å; C68-N72 PolarHBondContact O-N 2.97Å; C68-N72 VanDerWaalsContact O-N 3.1Å; C68-N72 PolarHBondContact O-ND2 2.89Å; R69-N72 PolarHBondContact O-N 3.48Å; A70-N72 VanDerWaalsContact C-N 3.3Å; A70-N72 PolarHBondContact O-N 3.01Å; N72-L74 HydrophobicContact CB-CD1 4.3Å; N72-L74 HydrophobicContact CB-CG 4.35Å; N72-L74 PolarHBondContact O-N 3.45Å; N72-L74 VanDerWaalsContact O-N 3.15Å
73	N	89.7	Confident	88.9	Confident	138 Å²	138	53.9 Å²	53.9	74%	0.738	29%	0.29	S	S	*	.	T	Hydrogen-bonded Turn	trans	57	26.3	-179.1	-55.5	-74.4	0	0	0	114.1	R69 A70	R69-N73 PolarHBondContact O-N 3.41Å; A70-N73 PolarHBondContact O-N 3.45Å
74	L	90.5	Very high	88.8	Confident	21 Å²	21	56.3 Å²	56.3	11%	0.11	32%	0.315	C	S	.	.	S	Bend	trans	-94.5	1.1	173.5	-60.5	171.5	0	0	0	112.5	P30 D32 R69 N72	P30-L74 HydrophobicContact CB-CD2 4.12Å; D32-L74 HydrophobicContact CB-CD1 3.85Å; R69-L74 HydrophobicContact CB-CB 3.96Å; R69-L74 HydrophobicContact CG-CB 4.28Å; R69-L74 PolarHBondContact NH2-O 3.48Å; R69-L74 CarbonylContact O-C 3.53Å; R69-L74 WeakPolarHBondContact O-CA 3.44Å; R69-L74 WeakPolarHBondContact O-CB 3.22Å; R69-L74 PolarHBondContact O-N 2.9Å; N72-L74 HydrophobicContact CB-CD1 4.3Å; N72-L74 HydrophobicContact CB-CG 4.35Å; N72-L74 PolarHBondContact O-N 3.45Å; N72-L74 VanDerWaalsContact O-N 3.15Å
75	M	88.7	Confident	88.7	Confident	26 Å²	26	57.5 Å²	57.5	13%	0.128	32%	0.318	C	S	.	.	S	Bend	trans	-157.8	149.2	177.1	-179.5	169.7	-70.9	0	0	108.5	L66 R69 L83	L66-M75 HydrophobicContact CD2-CE 3.7Å; L66-M75 HydrophobicContact CD2-SD 4.37Å; R69-M75 HydrophobicContact CB-CB 4.01Å; R69-M75 PolarHBondContact O-N 3.47Å; M75-L83 HydrophobicContact SD-CD1 4.08Å
76	D	84.8	Confident	88.6	Confident	58 Å²	58	59.1 Å²	59.1	31%	0.31	33%	0.332	S	S	.	.			trans	-75.1	128.4	177.3	-175.7	-29.5	0	0	0	110	N78 E79	D76-N78 PolarHBondContact O-N 3.01Å; D76-N78 VanDerWaalsContact OD1-CB 3.24Å; D76-N78 WeakPolarHBondContact OD1-CB 3.29Å; D76-N78 VanDerWaalsContact OD1-CG 3.32Å; D76-N78 PolarHBondContact OD1-N 3.28Å; D76-N78 PolarHBondContact OD1-ND2 3.45Å; D76-E79 HydrophobicContact CB-CG 4.05Å; D76-E79 WeakPolarHBondContact O-CB 3.28Å; D76-E79 PolarHBondContact O-N 3.29Å
77	P	80.8	Confident	88.3	Confident	75 Å²	75	64.7 Å²	64.7	49%	0.487	36%	0.357	S	S	.	.	G	3₁₀ helix	trans	-61.9	-25	179	25.4	-35.2	0	0	0	113.4	E79 I80	P77-E79 PolarHBondContact O-N 3.29Å; P77-I80 HydrophobicContact CB-CD1 4.16Å; P77-I80 WeakPolarHBondContact O-CB 3.24Å; P77-I80 VanDerWaalsContact O-CD1 3.29Å; P77-I80 WeakPolarHBondContact O-CD1 3.45Å; P77-I80 WeakPolarHBondContact O-CG1 3.37Å; P77-I80 PolarHBondContact O-N 3.21Å
78	N	81	Confident	88.1	Confident	113 Å²	113	69.4 Å²	69.4	60%	0.604	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-68.1	-19.3	175.5	-58.1	-50.7	0	0	0	112.2	D76 I80 S81	D76-N78 PolarHBondContact O-N 3.01Å; D76-N78 VanDerWaalsContact OD1-CB 3.24Å; D76-N78 WeakPolarHBondContact OD1-CB 3.29Å; D76-N78 VanDerWaalsContact OD1-CG 3.32Å; D76-N78 PolarHBondContact OD1-N 3.28Å; D76-N78 PolarHBondContact OD1-ND2 3.45Å; N78-I80 VanDerWaalsContact C-N 3.27Å; N78-I80 PolarHBondContact O-N 3.24Å; N78-S81 PolarHBondContact O-OG 3.48Å
79	E	77.9	Confident	87.9	Confident	25 Å²	25	72 Å²	72	12%	0.117	39%	0.391	C	S	.	.	G	3₁₀ helix	trans	-76.1	-16.1	177.3	-66.4	-176.6	164	0	0	112.3	R26 D76 P77 S81 L82 L83	R26-E79 WeakPolarHBondContact CD-OE1 3.36Å; R26-E79 IonicContact CZ-OE1 3.3Å; R26-E79 IonicContact NE-OE1 3.92Å; R26-E79 IonicContact NH1-OE1 2.8Å; R26-E79 PolarHBondContact NH1-OE1 3.15Å; D76-E79 HydrophobicContact CB-CG 4.05Å; D76-E79 WeakPolarHBondContact O-CB 3.28Å; D76-E79 PolarHBondContact O-N 3.29Å; P77-E79 PolarHBondContact O-N 3.29Å; E79-S81 VanDerWaalsContact C-N 3.29Å; E79-S81 PolarHBondContact O-N 2.92Å; E79-L82 WeakPolarHBondContact O-CA 3.19Å; E79-L82 WeakPolarHBondContact O-CB 3.36Å; E79-L82 PolarHBondContact O-N 2.82Å; E79-L83 WeakPolarHBondContact O-CG 3.41Å; E79-L83 PolarHBondContact O-N 3.49Å
80	I	80.5	Confident	87.7	Confident	39 Å²	39	71.5 Å²	71.5	20%	0.2	39%	0.39	C	S	.	.	G	3₁₀ helix	trans	-56.6	-42.7	-177.1	-62.6	166.6	0	0	0	111.7	A70 P77 N78 L82 L83 W90	A70-I80 HydrophobicContact CB-CD1 3.96Å; A70-I80 HydrophobicContact CB-CG1 4.2Å; P77-I80 HydrophobicContact CB-CD1 4.16Å; P77-I80 WeakPolarHBondContact O-CB 3.24Å; P77-I80 VanDerWaalsContact O-CD1 3.29Å; P77-I80 WeakPolarHBondContact O-CD1 3.45Å; P77-I80 WeakPolarHBondContact O-CG1 3.37Å; P77-I80 PolarHBondContact O-N 3.21Å; N78-I80 VanDerWaalsContact C-N 3.27Å; N78-I80 PolarHBondContact O-N 3.24Å; I80-L82 PolarHBondContact O-N 3.21Å; I80-L83 PolarHBondContact O-N 2.92Å; I80-W90 HydrophobicContact CB-CH2 4.29Å; I80-W90 HydrophobicContact CB-CZ2 4.19Å; I80-W90 HydrophobicContact CD1-CH2 4.06Å; I80-W90 HydrophobicContact CD1-CZ2 3.4Å; I80-W90 VanDerWaalsContact CD1-CZ2 3.4Å; I80-W90 HydrophobicContact CG1-CH2 3.7Å; I80-W90 HydrophobicContact CG1-CZ2 3.58Å; I80-W90 HydrophobicContact CG2-CD2 3.63Å; I80-W90 VanDerWaalsContact CG2-CE2 3.43Å; I80-W90 HydrophobicContact CG2-CE3 3.86Å; I80-W90 HydrophobicContact CG2-CG 4.28Å; I80-W90 HydrophobicContact CG2-CH2 3.72Å; I80-W90 HydrophobicContact CG2-CZ2 3.52Å; I80-W90 HydrophobicContact CG2-CZ3 3.89Å
81	S	85.5	Confident	87.5	Confident	103 Å²	103	75 Å²	75	72%	0.72	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-68.7	-22.2	178.7	59.4	0	0	0	0	113.3	N78 E79	N78-S81 PolarHBondContact O-OG 3.48Å; E79-S81 VanDerWaalsContact C-N 3.29Å; E79-S81 PolarHBondContact O-N 2.92Å
82	L	88.6	Confident	87.2	Confident	132 Å²	132	74.9 Å²	74.9	69%	0.691	41%	0.406	S	S	*	.	G	3₁₀ helix	trans	-86.9	-15	178.9	-69	147.1	0	0	0	112.6	E79 I80 G84	E79-L82 WeakPolarHBondContact O-CA 3.19Å; E79-L82 WeakPolarHBondContact O-CB 3.36Å; E79-L82 PolarHBondContact O-N 2.82Å; I80-L82 PolarHBondContact O-N 3.21Å; L82-G84 PolarHBondContact O-N 3.33Å
83	L	89.7	Confident	86.9	Confident	56 Å²	56	72 Å²	72	29%	0.293	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75	-8.3	179.9	-64.6	173.3	0	0	0	113.6	L66 M75 E79 I80 F85 W90	L66-L83 HydrophobicContact CB-CD1 4.12Å; L66-L83 HydrophobicContact CD1-CD1 4.11Å; L66-L83 HydrophobicContact CD1-CD2 4.45Å; M75-L83 HydrophobicContact SD-CD1 4.08Å; E79-L83 WeakPolarHBondContact O-CG 3.41Å; E79-L83 PolarHBondContact O-N 3.49Å; I80-L83 PolarHBondContact O-N 2.92Å; L83-F85 HydrophobicContact CB-CD2 3.6Å; L83-F85 HydrophobicContact CB-CE2 3.71Å; L83-F85 HydrophobicContact CD1-CD2 4.38Å; L83-F85 HydrophobicContact CD1-CE2 4.19Å; L83-F85 PolarHBondContact O-N 3.28Å; L83-W90 HydrophobicContact CD1-CZ3 4.4Å
84	G	92.3	Very high	85.9	Confident	52 Å²	52	67.3 Å²	67.3	54%	0.536	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	72.7	23.7	176.1	0	0	0	0	0	114.4	R59 L82	R59-G84 PolarHBondContact NH2-O 2.75Å; L82-G84 PolarHBondContact O-N 3.33Å
85	F	91.8	Very high	84.6	Confident	30 Å²	30	72.6 Å²	72.6	13%	0.132	39%	0.389	C	S	.	.			trans	-81.8	144.9	168	-64.2	-76.2	0	0	0	111.2	R59 A62 A63 L66 L83 E89 W90	R59-F85 VanDerWaalsContact NH2-CA 3.33Å; R59-F85 WeakPolarHBondContact O-CE1 3.36Å; A62-F85 HydrophobicContact CB-CE1 4.43Å; A62-F85 HydrophobicContact CB-CZ 4.09Å; A63-F85 HydrophobicContact CB-CD1 3.82Å; A63-F85 HydrophobicContact CB-CE1 3.65Å; A63-F85 HydrophobicContact CB-CG 4.37Å; A63-F85 HydrophobicContact CB-CZ 4.07Å; L66-F85 HydrophobicContact CD1-CE2 3.68Å; L66-F85 HydrophobicContact CD1-CZ 3.9Å; L83-F85 HydrophobicContact CB-CD2 3.6Å; L83-F85 HydrophobicContact CB-CE2 3.71Å; L83-F85 HydrophobicContact CD1-CD2 4.38Å; L83-F85 HydrophobicContact CD1-CE2 4.19Å; L83-F85 PolarHBondContact O-N 3.28Å; F85-E89 WeakPolarHBondContact CA-OE2 3.41Å; F85-E89 HydrophobicContact CD1-CB 4.44Å; F85-W90 HydrophobicContact CB-CE3 4.45Å; F85-W90 HydrophobicContact CD2-CE3 4.12Å; F85-W90 HydrophobicContact CD2-CZ3 4.2Å; F85-W90 HydrophobicContact CG-CE3 4.4Å
86	T	90.8	Very high	83.3	Confident	66 Å²	66	76 Å²	76	41%	0.405	41%	0.405	S	S	.	.			trans	-75.9	159.8	166.9	83.8	0	0	0	0	109.9	E88 E89 W90	T86-E88 WeakPolarHBondContact CB-OE2 3.25Å; T86-E88 PolarHBondContact O-N 3.34Å; T86-E88 PolarHBondContact OG1-N 3.49Å; T86-E88 PolarHBondContact OG1-OE2 3.02Å; T86-E89 PolarHBondContact N-OE2 3.27Å; T86-E89 PolarHBondContact O-N 3.2Å; T86-E89 WeakPolarHBondContact OG1-CG 3.41Å; T86-E89 PolarHBondContact OG1-N 3.34Å; T86-W90 PolarHBondContact O-N 2.75Å
87	E	88.2	Confident	82.2	Confident	152 Å²	152	76.6 Å²	76.6	71%	0.71	41%	0.405	S	S	*	.	H	α-helix	trans	-60.7	-35.6	178.1	-70.2	-175	-177	0	0	111.6	W90 N91	E87-W90 PolarHBondContact O-N 3.23Å; E87-N91 VanDerWaalsContact O-CB 3.22Å; E87-N91 WeakPolarHBondContact O-CB 3.16Å; E87-N91 PolarHBondContact O-N 3.2Å; E87-N91 PolarHBondContact O-ND2 2.82Å
88	E	88.4	Confident	81.1	Confident	132 Å²	132	80.4 Å²	80.4	62%	0.617	42%	0.416	S	S	*	.	H	α-helix	trans	-66.2	-46.1	177.8	-54.8	75.9	-163.2	0	0	111.4	T86 W90 N91 Q92	T86-E88 WeakPolarHBondContact CB-OE2 3.25Å; T86-E88 PolarHBondContact O-N 3.34Å; T86-E88 PolarHBondContact OG1-N 3.49Å; T86-E88 PolarHBondContact OG1-OE2 3.02Å; E88-W90 VanDerWaalsContact C-N 3.34Å; E88-W90 PolarHBondContact O-N 3.29Å; E88-N91 PolarHBondContact O-N 3.33Å; E88-Q92 VanDerWaalsContact O-CB 3.28Å; E88-Q92 WeakPolarHBondContact O-CB 3.49Å; E88-Q92 PolarHBondContact O-N 2.83Å
89	E	88.7	Confident	79.8	Confident	62 Å²	62	79.1 Å²	79.1	29%	0.29	42%	0.416	S	S	.	.	H	α-helix	trans	-59.8	-45.9	176	-69.5	179.5	137.7	0	0	110.8	R59 F85 T86 Q92 A93	R59-E89 IonicContact CZ-OE2 3.85Å; R59-E89 IonicContact NE-OE1 3.67Å; R59-E89 IonicContact NE-OE2 3.76Å; R59-E89 IonicContact NH2-OE1 3.56Å; R59-E89 IonicContact NH2-OE2 3.66Å; R59-E89 PolarHBondContact NH2-OE2 3.34Å; F85-E89 WeakPolarHBondContact CA-OE2 3.41Å; F85-E89 HydrophobicContact CD1-CB 4.44Å; T86-E89 PolarHBondContact N-OE2 3.27Å; T86-E89 PolarHBondContact O-N 3.2Å; T86-E89 WeakPolarHBondContact OG1-CG 3.41Å; T86-E89 PolarHBondContact OG1-N 3.34Å; E89-Q92 PolarHBondContact O-N 2.77Å; E89-A93 PolarHBondContact O-N 2.82Å
90	W	90	Very high	78.7	Confident	28 Å²	28	83.8 Å²	83.8	11%	0.106	44%	0.436	C	S	.	.	H	α-helix	trans	-64.1	-44.1	-179.9	-170.1	-106.3	0	0	0	112	R67 I80 L83 F85 T86 E87 E88 A93	R67-W90 HydrophobicContact CB-CH2 3.54Å; R67-W90 HydrophobicContact CB-CZ2 3.64Å; R67-W90 HydrophobicContact CB-CZ3 4.04Å; R67-W90 HydrophobicContact CG-CH2 4.11Å; R67-W90 HydrophobicContact CG-CZ2 3.65Å; R67-W90 PolarHBondContact NH1-O 2.04Å; I80-W90 HydrophobicContact CB-CH2 4.29Å; I80-W90 HydrophobicContact CB-CZ2 4.19Å; I80-W90 HydrophobicContact CD1-CH2 4.06Å; I80-W90 HydrophobicContact CD1-CZ2 3.4Å; I80-W90 VanDerWaalsContact CD1-CZ2 3.4Å; I80-W90 HydrophobicContact CG1-CH2 3.7Å; I80-W90 HydrophobicContact CG1-CZ2 3.58Å; I80-W90 HydrophobicContact CG2-CD2 3.63Å; I80-W90 VanDerWaalsContact CG2-CE2 3.43Å; I80-W90 HydrophobicContact CG2-CE3 3.86Å; I80-W90 HydrophobicContact CG2-CG 4.28Å; I80-W90 HydrophobicContact CG2-CH2 3.72Å; I80-W90 HydrophobicContact CG2-CZ2 3.52Å; I80-W90 HydrophobicContact CG2-CZ3 3.89Å; L83-W90 HydrophobicContact CD1-CZ3 4.4Å; F85-W90 HydrophobicContact CB-CE3 4.45Å; F85-W90 HydrophobicContact CD2-CE3 4.12Å; F85-W90 HydrophobicContact CD2-CZ3 4.2Å; F85-W90 HydrophobicContact CG-CE3 4.4Å; T86-W90 PolarHBondContact O-N 2.75Å; E87-W90 PolarHBondContact O-N 3.23Å; E88-W90 VanDerWaalsContact C-N 3.34Å; E88-W90 PolarHBondContact O-N 3.29Å; W90-A93 WeakPolarHBondContact O-CB 3.49Å; W90-A93 PolarHBondContact O-N 3.46Å
91	N	87.3	Confident	77	Confident	82 Å²	82	91 Å²	91	44%	0.439	48%	0.482	S	S	.	.	H	α-helix	trans	-74.7	-27.4	-179	-72	-32.8	0	0	0	113.2	E87 E88 A93 N94	E87-N91 VanDerWaalsContact O-CB 3.22Å; E87-N91 WeakPolarHBondContact O-CB 3.16Å; E87-N91 PolarHBondContact O-N 3.2Å; E87-N91 PolarHBondContact O-ND2 2.82Å; E88-N91 PolarHBondContact O-N 3.33Å; N91-A93 VanDerWaalsContact C-N 3.32Å; N91-N94 WeakPolarHBondContact O-CB 3.13Å; N91-N94 PolarHBondContact O-N 2.84Å
92	Q	85.3	Confident	76.6	Confident	113 Å²	113	90.4 Å²	90.4	53%	0.528	47%	0.47	S	S	.	.	H	α-helix	trans	-69.5	-34.6	173.7	-173.7	61.6	14.1	0	0	111.3	E88 E89 N94 K95	E88-Q92 VanDerWaalsContact O-CB 3.28Å; E88-Q92 WeakPolarHBondContact O-CB 3.49Å; E88-Q92 PolarHBondContact O-N 2.83Å; E89-Q92 PolarHBondContact O-N 2.77Å; Q92-N94 PolarHBondContact O-N 3.28Å; Q92-K95 PolarHBondContact O-N 2.73Å; Q92-K95 VanDerWaalsContact O-N 3.12Å
93	A	83.8	Confident	76	Confident	9 Å²	9	88.2 Å²	88.2	7%	0.074	46%	0.458	C	S	.	.	H	α-helix	trans	-59.5	-31.1	176.8	0	0	0	0	0	113.4	A63 E89 W90 N91 K95 H96	A63-A93 HydrophobicContact CB-CB 3.95Å; E89-A93 PolarHBondContact O-N 2.82Å; W90-A93 WeakPolarHBondContact O-CB 3.49Å; W90-A93 PolarHBondContact O-N 3.46Å; N91-A93 VanDerWaalsContact C-N 3.32Å; A93-K95 VanDerWaalsContact C-N 3.29Å; A93-K95 PolarHBondContact O-N 3.32Å; A93-H96 PolarHBondContact O-N 2.85Å
94	N	69.3	Low	75.2	Confident	39 Å²	39	89.9 Å²	89.9	21%	0.209	47%	0.467	C	S	.	.	H	α-helix	trans	-52.8	-46.7	172.6	-92.3	-39.5	0	0	0	113.1	R67 N91 Q92 H96 F97 Q98	R67-N94 PolarHBondContact NE-OD1 3.05Å; R67-N94 PolarHBondContact NH1-ND2 3.48Å; R67-N94 PolarHBondContact NH1-OD1 2.74Å; R67-N94 VanDerWaalsContact NH2-CG 3.26Å; R67-N94 PolarHBondContact NH2-ND2 3.32Å; R67-N94 PolarHBondContact NH2-OD1 3.48Å; N91-N94 WeakPolarHBondContact O-CB 3.13Å; N91-N94 PolarHBondContact O-N 2.84Å; Q92-N94 PolarHBondContact O-N 3.28Å; N94-H96 VanDerWaalsContact C-N 3.27Å; N94-H96 PolarHBondContact O-N 3.1Å; N94-F97 PolarHBondContact O-N 2.69Å; N94-Q98 PolarHBondContact O-N 3.14Å
95	K	63.2	Low	74.2	Confident	132 Å²	132	92.2 Å²	92.2	57%	0.574	46%	0.463	S	S	*	.	H	α-helix	trans	-70.9	-30.5	-166.9	-60.7	179.5	-171	163.4	0	111	Q92 A93 F97 S99	Q92-K95 PolarHBondContact O-N 2.73Å; Q92-K95 VanDerWaalsContact O-N 3.12Å; A93-K95 VanDerWaalsContact C-N 3.29Å; A93-K95 PolarHBondContact O-N 3.32Å; K95-F97 VanDerWaalsContact C-N 3.32Å; K95-S99 PolarHBondContact O-OG 3.19Å
96	H	60.9	Low	73.1	Confident	99 Å²	99	96.1 Å²	96.1	46%	0.458	48%	0.484	S	S	.	.	H	α-helix	trans	-71.9	-28.2	-179	-155.9	75.2	0	0	0	112.6	E43 A93 N94 S99 K100	E43-H96 IonicContact OE2-CD2 3.52Å; A93-H96 PolarHBondContact O-N 2.85Å; N94-H96 VanDerWaalsContact C-N 3.27Å; N94-H96 PolarHBondContact O-N 3.1Å; H96-S99 PolarHBondContact O-OG 2.93Å; H96-K100 PolarHBondContact NE2-NZ 3.26Å
97	F	61.5	Low	71.9	Confident	70 Å²	70	98.1 Å²	98.1	31%	0.307	49%	0.489	S	S	.	.	H	α-helix	trans	-84.7	-41.1	178.9	-102.3	-84.6	0	0	0	113	A40 N94 K95 S99 K100	A40-F97 HydrophobicContact CB-CE1 4.27Å; A40-F97 HydrophobicContact CB-CE2 3.54Å; A40-F97 HydrophobicContact CB-CZ 3.22Å; N94-F97 PolarHBondContact O-N 2.69Å; K95-F97 VanDerWaalsContact C-N 3.32Å; F97-S99 PolarHBondContact O-N 2.76Å; F97-K100 PolarHBondContact O-N 2.99Å
98	Q	57.6	Low	70.8	Confident	154 Å²	154	94.2 Å²	94.2	72%	0.72	47%	0.473	S	S	*	.	H	α-helix	trans	-66.4	-21	-179.1	-68.5	-170.3	-1.4	0	0	113.5	N94	N94-Q98 PolarHBondContact O-N 3.14Å
99	S	54.9	Low	69.4	Low	87 Å²	87	91.3 Å²	91.3	61%	0.608	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-0.7	180	66.8	0	0	0	0	115.1	K95 H96 F97	K95-S99 PolarHBondContact O-OG 3.19Å; H96-S99 PolarHBondContact O-OG 2.93Å; F97-S99 PolarHBondContact O-N 2.76Å
100	K	54.3	Low	67.8	Low	122 Å²	122	93.8 Å²	93.8	53%	0.53	48%	0.477	S	S	.	.	T	Hydrogen-bonded Turn	trans	-114	6.4	-176.7	-73.9	-175.4	-174.9	170.3	0	115	E43 H96 F97	E43-K100 IonicContact OE1-NZ 2.62Å; E43-K100 PolarHBondContact OE1-NZ 3.43Å; H96-K100 PolarHBondContact NE2-NZ 3.26Å; F97-K100 PolarHBondContact O-N 2.99Å
101	T	45.9	Very low	65.8	Low	190 Å²	190	99.7 Å²	99.7	100%	1.166	51%	0.51	S	S	*	.			trans	-89.3	0	164.2	-52.1	0	0	0	0	109

Retrieved 101 of 101 residues in 51.8 ms (Link to these results)

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