A0A3Q0KBU2_SCHMA Loading...

Deltameth_res domain-containing protein

AlphaFold DB , UniProt , Accession A0A3Q0KBU2, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 102 aa.

						>A0A3Q0KBU2_SCHMA|A0A3Q0KBU2
MSTTRILSAHHSLSRTYSSTVPEVKNDKLQNEQIRYSTHKKWHAVMTYIPKPRDIPDYQYPILLMCSLIIATYFCFIHTRCDLDDILDENFKAFEKNKLGKK
					

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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	40.6	Very low	52.2	Low	241 Å²	241	123.5 Å²	123.5	100%	1.187	65%	0.651	S	S	*	*				0	124.9	0	-83.6	174.6	153.2	0	0	108.3	T3	M1-T3 PolarHBondContact O-N 3.5Å
2	S	51	Low	52.4	Low	80 Å²	80	119.1 Å²	119.1	56%	0.559	64%	0.638	S	S	*	*			trans	-83.1	105.3	-163.5	-171.7	0	0	0	0	112	T4	S2-T4 VanDerWaalsContact C-N 3.27Å; S2-T4 PolarHBondContact O-N 3.07Å; S2-T4 PolarHBondContact OG-OG1 2.94Å
3	T	55	Low	52.3	Low	106 Å²	106	118.8 Å²	118.8	65%	0.65	64%	0.636	S	S	*	*	T	Hydrogen-bonded Turn	trans	-69.7	-20.8	178.3	46.5	0	0	0	0	113.4	M1 R5 I6	M1-T3 PolarHBondContact O-N 3.5Å; T3-R5 VanDerWaalsContact C-N 3.33Å; T3-R5 PolarHBondContact O-N 3.05Å; T3-I6 PolarHBondContact O-N 3.45Å
4	T	56.1	Low	52.1	Low	97 Å²	97	116.1 Å²	116.1	60%	0.595	63%	0.631	S	S	*	*	H	α-helix	trans	-67.1	-27.1	-177	42.4	0	0	0	0	114.1	S2 S8	S2-T4 VanDerWaalsContact C-N 3.27Å; S2-T4 PolarHBondContact O-N 3.07Å; S2-T4 PolarHBondContact OG-OG1 2.94Å; T4-S8 PolarHBondContact O-N 2.82Å; T4-S8 PolarHBondContact O-OG 2.89Å
5	R	52.1	Low	51.6	Low	201 Å²	201	121.1 Å²	121.1	76%	0.758	64%	0.637	S	S	*	*	H	α-helix	trans	-72.3	-28.7	176.8	-73.7	-168.2	170.5	-177.9	-2	113.6	T3 S8 A9	T3-R5 VanDerWaalsContact C-N 3.33Å; T3-R5 PolarHBondContact O-N 3.05Å; R5-S8 WeakPolarHBondContact CA-OG 3.02Å; R5-S8 PolarHBondContact O-OG 3.23Å; R5-S8 VanDerWaalsContact O-OG 3.13Å; R5-A9 PolarHBondContact O-N 2.78Å
6	I	55.5	Low	51.3	Low	115 Å²	115	119.3 Å²	119.3	59%	0.59	63%	0.632	S	S	*	*	H	α-helix	trans	-75.4	-41.9	-178.9	-57.6	174.5	0	0	0	110.3	T3 A9 H10	T3-I6 PolarHBondContact O-N 3.45Å; I6-A9 PolarHBondContact O-N 2.97Å; I6-H10 PolarHBondContact O-N 3.25Å; I6-H10 VanDerWaalsContact O-N 3.16Å
7	L	53.9	Low	51	Low	136 Å²	136	124.2 Å²	124.2	71%	0.712	64%	0.642	S	S	*	*	H	α-helix	trans	-64.5	-41.1	178.8	-107.4	147.3	0	0	0	112.8	H10 H11	L7-H10 PolarHBondContact O-N 3.02Å; L7-H11 PolarHBondContact O-N 3.46Å
8	S	55.9	Low	51	Low	73 Å²	73	122.8 Å²	122.8	51%	0.51	65%	0.645	S	S	.	*	H	α-helix	trans	-67.4	-36.5	177.7	43.6	0	0	0	0	112.9	T4 R5 H11 S12	T4-S8 PolarHBondContact O-N 2.82Å; T4-S8 PolarHBondContact O-OG 2.89Å; R5-S8 WeakPolarHBondContact CA-OG 3.02Å; R5-S8 PolarHBondContact O-OG 3.23Å; R5-S8 VanDerWaalsContact O-OG 3.13Å; S8-H11 PolarHBondContact O-N 3.02Å; S8-S12 PolarHBondContact O-N 2.96Å
9	A	52.9	Low	51	Low	46 Å²	46	121.6 Å²	121.6	38%	0.38	65%	0.647	S	S	.	*	H	α-helix	trans	-65.3	-38.6	173.7	0	0	0	0	0	112.4	R5 I6 H11 S12 L13	R5-A9 PolarHBondContact O-N 2.78Å; I6-A9 PolarHBondContact O-N 2.97Å; A9-H11 PolarHBondContact O-N 3.29Å; A9-S12 PolarHBondContact O-N 3.18Å; A9-S12 PolarHBondContact O-OG 3.45Å; A9-L13 WeakPolarHBondContact O-CG 3.41Å; A9-L13 PolarHBondContact O-N 3.41Å
10	H	49.2	Very low	50.9	Low	126 Å²	126	120.9 Å²	120.9	58%	0.583	65%	0.648	S	S	*	*	H	α-helix	trans	-65.2	-38.2	176.4	-100.9	-93.1	0	0	0	112.9	I6 L7 S14	I6-H10 PolarHBondContact O-N 3.25Å; I6-H10 VanDerWaalsContact O-N 3.16Å; L7-H10 PolarHBondContact O-N 3.02Å; H10-S14 PolarHBondContact O-N 3.28Å; H10-S14 PolarHBondContact O-OG 3.09Å
11	H	52.2	Low	51.1	Low	138 Å²	138	119.7 Å²	119.7	64%	0.639	64%	0.644	S	S	*	*	H	α-helix	trans	-71.7	-32.9	-179.4	-153.2	-87.2	0	0	0	112.4	L7 S8 A9 R15	L7-H11 PolarHBondContact O-N 3.46Å; S8-H11 PolarHBondContact O-N 3.02Å; A9-H11 PolarHBondContact O-N 3.29Å; H11-R15 WeakPolarHBondContact O-CB 3.48Å; H11-R15 PolarHBondContact O-N 3.09Å
12	S	54.2	Low	51.7	Low	70 Å²	70	112.8 Å²	112.8	49%	0.49	62%	0.618	S	S	.	*	H	α-helix	trans	-73.4	-38	178.1	79.1	0	0	0	0	112.9	S8 A9 R15 T16	S8-S12 PolarHBondContact O-N 2.96Å; A9-S12 PolarHBondContact O-N 3.18Å; A9-S12 PolarHBondContact O-OG 3.45Å; S12-R15 PolarHBondContact O-N 3.49Å; S12-T16 PolarHBondContact O-N 2.96Å; S12-T16 PolarHBondContact O-OG1 3.42Å
13	L	50.9	Low	52.1	Low	116 Å²	116	118.2 Å²	118.2	61%	0.607	63%	0.634	S	S	*	*	H	α-helix	trans	-66.1	-40.4	178	-73.8	168.2	0	0	0	112	A9 T16	A9-L13 WeakPolarHBondContact O-CG 3.41Å; A9-L13 PolarHBondContact O-N 3.41Å; L13-T16 PolarHBondContact O-OG1 3.21Å
14	S	49.5	Very low	52.2	Low	81 Å²	81	116.5 Å²	116.5	57%	0.566	62%	0.624	S	S	*	*	H	α-helix	trans	-69.5	-35.5	179.2	-51.2	0	0	0	0	111.9	H10	H10-S14 PolarHBondContact O-N 3.28Å; H10-S14 PolarHBondContact O-OG 3.09Å
15	R	44.8	Very low	52.5	Low	191 Å²	191	121.3 Å²	121.3	72%	0.721	64%	0.636	S	S	*	*	H	α-helix	trans	-73.3	-31.1	-178	-156	174.3	85.3	169.2	5.6	113.1	H11 S12	H11-R15 WeakPolarHBondContact O-CB 3.48Å; H11-R15 PolarHBondContact O-N 3.09Å; S12-R15 PolarHBondContact O-N 3.49Å
16	T	46.4	Very low	53.1	Low	92 Å²	92	117.4 Å²	117.4	56%	0.564	63%	0.63	S	S	*	*	H	α-helix	trans	-76.8	-29.3	-178.4	21.1	0	0	0	0	113.5	S12 L13	S12-T16 PolarHBondContact O-N 2.96Å; S12-T16 PolarHBondContact O-OG1 3.42Å; L13-T16 PolarHBondContact O-OG1 3.21Å
17	Y	46.6	Very low	53.5	Low	203 Å²	203	117.8 Å²	117.8	80%	0.796	63%	0.634	S	S	*	*	H	α-helix	trans	-77	-23.2	-176.7	-121.6	-88.7	0	0	0	114.3
18	S	52	Low	53.8	Low	99 Å²	99	118.2 Å²	118.2	69%	0.692	63%	0.63	S	S	*	*	H	α-helix	trans	-87	-36.5	-173.4	-174.9	0	0	0	0	113.7
19	S	50.5	Low	54.1	Low	100 Å²	100	118.1 Å²	118.1	70%	0.699	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-88.6	-10.9	-164	89.6	0	0	0	0	116.1
20	T	49.3	Very low	54.7	Low	107 Å²	107	126 Å²	126	66%	0.656	65%	0.652	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.8	6.1	-170.2	57.2	0	0	0	0	114.5	P22	T20-P22 WeakPolarHBondContact O-CD 3.47Å
21	V	54.9	Low	55.8	Low	95 Å²	95	124.3 Å²	124.3	58%	0.576	65%	0.648	S	S	*	*	S	Bend	trans	-87.3	108.8	172.2	-172.4	0	0	0	0	108	E23	V21-E23 PolarHBondContact O-N 3.38Å
22	P	53.8	Low	56.5	Low	97 Å²	97	125.6 Å²	125.6	63%	0.63	65%	0.654	S	S	*	*			trans	-55.8	133.9	171.9	21.3	-30.9	0	0	0	109.3	T20 V24	T20-P22 WeakPolarHBondContact O-CD 3.47Å; P22-V24 VanDerWaalsContact C-N 3.29Å; P22-V24 WeakPolarHBondContact O-CG2 3.35Å; P22-V24 PolarHBondContact O-N 2.97Å
23	E	57.6	Low	57	Low	194 Å²	194	127.7 Å²	127.7	91%	0.907	66%	0.656	S	S	*	*			trans	-63.2	89.7	175	-169.9	-173.9	167.5	0	0	108.7	V21 K25	V21-E23 PolarHBondContact O-N 3.38Å; E23-K25 PolarHBondContact O-N 3.22Å
24	V	57.8	Low	57.7	Low	70 Å²	70	127.3 Å²	127.3	42%	0.424	65%	0.653	S	S	.	*			trans	-77	108.9	177.2	-174.3	0	0	0	0	107.5	P22 N26 R35	P22-V24 VanDerWaalsContact C-N 3.29Å; P22-V24 WeakPolarHBondContact O-CG2 3.35Å; P22-V24 PolarHBondContact O-N 2.97Å; V24-N26 HydrophobicContact CG1-CB 4.32Å; V24-N26 PolarHBondContact O-N 3.13Å; V24-R35 VanDerWaalsContact CB-NH1 3.25Å; V24-R35 VanDerWaalsContact CG2-NH1 3.28Å
25	K	62.9	Low	58.4	Low	197 Å²	197	128.5 Å²	128.5	86%	0.857	65%	0.645	S	S	*	*			trans	-63.9	-2.5	-178.9	-159.9	175.1	179.4	-179.7	0	115.1	E23	E23-K25 PolarHBondContact O-N 3.22Å
26	N	63.9	Low	59.2	Low	119 Å²	119	125.8 Å²	125.8	64%	0.636	64%	0.636	S	S	*	*			trans	-99.8	113.6	179.7	-87.3	-47.8	0	0	0	111.1	V24 K28	V24-N26 HydrophobicContact CG1-CB 4.32Å; V24-N26 PolarHBondContact O-N 3.13Å; N26-K28 PolarHBondContact O-N 3.19Å
27	D	64.1	Low	60.2	Low	124 Å²	124	124 Å²	124	66%	0.663	63%	0.628	S	S	*	*	S	Bend	trans	-70.8	-5	176.3	-75.8	-17.3	0	0	0	113.7	R35	D27-R35 PolarHBondContact O-N 2.87Å
28	K	59.8	Low	61.1	Low	145 Å²	145	120.2 Å²	120.2	63%	0.63	63%	0.626	S	S	*	*	B	Isolated β-bridge	trans	-112.9	129	180	-64.3	-171	178.5	-169.8	0	110.7	N26	N26-K28 PolarHBondContact O-N 3.19Å
29	L	63.8	Low	61.8	Low	70 Å²	70	121.7 Å²	121.7	37%	0.366	62%	0.621	S	S	.	*			trans	-66.5	162.6	162.6	-80.2	79.6	0	0	0	109.4	N31 E32 Q33 R35	L29-N31 WeakPolarHBondContact CB-OD1 3.4Å; L29-N31 PolarHBondContact O-N 3.43Å; L29-E32 PolarHBondContact O-N 3.42Å; L29-Q33 HydrophobicContact CB-CB 4.31Å; L29-Q33 WeakPolarHBondContact CB-O 3.39Å; L29-Q33 HydrophobicContact CD1-CB 4.47Å; L29-Q33 WeakPolarHBondContact CD1-O 3.49Å; L29-Q33 PolarHBondContact N-O 2.81Å; L29-R35 HydrophobicContact CD1-CB 3.57Å; L29-R35 HydrophobicContact CD1-CG 3.79Å
30	Q	64.8	Low	62.8	Low	211 Å²	211	122 Å²	122	99%	0.986	61%	0.61	S	S	*	*	T	Hydrogen-bonded Turn	trans	-55.9	-21.8	177.1	-74.6	179.6	-11.2	0	0	114
31	N	72.7	Confident	64	Low	92 Å²	92	122.9 Å²	122.9	49%	0.492	61%	0.605	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.4	25.4	179.5	62.5	-14.7	0	0	0	113.2	L29 Q33	L29-N31 WeakPolarHBondContact CB-OD1 3.4Å; L29-N31 PolarHBondContact O-N 3.43Å; N31-Q33 PolarHBondContact ND2-OE1 3.38Å; N31-Q33 PolarHBondContact O-N 3.42Å; N31-Q33 WeakPolarHBondContact OD1-CB 3.19Å; N31-Q33 PolarHBondContact OD1-N 2.85Å
32	E	67	Low	64.9	Low	164 Å²	164	126 Å²	126	77%	0.766	61%	0.606	S	S	*	*	S	Bend	trans	59.7	4.3	-176.2	-57.1	-170.5	145.6	0	0	115.6	L29 I34	L29-E32 PolarHBondContact O-N 3.42Å; E32-I34 PolarHBondContact O-N 2.91Å
33	Q	64.2	Low	65.9	Low	114 Å²	114	125.6 Å²	125.6	53%	0.533	60%	0.596	S	S	.	*			trans	-69.7	134.5	173	-69.8	-177.6	-27.8	0	0	110	L29 N31 R35	L29-Q33 HydrophobicContact CB-CB 4.31Å; L29-Q33 WeakPolarHBondContact CB-O 3.39Å; L29-Q33 HydrophobicContact CD1-CB 4.47Å; L29-Q33 WeakPolarHBondContact CD1-O 3.49Å; L29-Q33 PolarHBondContact N-O 2.81Å; N31-Q33 PolarHBondContact ND2-OE1 3.38Å; N31-Q33 PolarHBondContact O-N 3.42Å; N31-Q33 WeakPolarHBondContact OD1-CB 3.19Å; N31-Q33 PolarHBondContact OD1-N 2.85Å; Q33-R35 PolarHBondContact O-N 3.14Å
34	I	64.6	Low	66.8	Low	109 Å²	109	117.8 Å²	117.8	56%	0.559	57%	0.565	S	S	*	*	B	Isolated β-bridge	trans	-63.1	126	174	-59	171.1	0	0	0	107.9	E32 Y36	E32-I34 PolarHBondContact O-N 2.91Å; I34-Y36 PolarHBondContact O-N 3.31Å
35	R	64.1	Low	67.8	Low	105 Å²	105	118.9 Å²	118.9	40%	0.396	57%	0.571	S	S	.	*			trans	-66.4	103.6	173.6	-160.6	176.2	-140.4	-145.6	6.5	108.4	V24 D27 L29 Q33 S37	V24-R35 VanDerWaalsContact CB-NH1 3.25Å; V24-R35 VanDerWaalsContact CG2-NH1 3.28Å; D27-R35 PolarHBondContact O-N 2.87Å; L29-R35 HydrophobicContact CD1-CB 3.57Å; L29-R35 HydrophobicContact CD1-CG 3.79Å; Q33-R35 PolarHBondContact O-N 3.14Å; R35-S37 PolarHBondContact O-N 3.1Å; R35-S37 VanDerWaalsContact O-N 3.09Å
36	Y	61.9	Low	68.4	Low	134 Å²	134	113.2 Å²	113.2	53%	0.525	55%	0.549	S	S	.	.			trans	-62.3	114.7	166.5	-63.6	-78.7	0	0	0	107.8	I34 K40 K41	I34-Y36 PolarHBondContact O-N 3.31Å; Y36-K40 HydrophobicContact CD1-CB 3.88Å; Y36-K40 HydrophobicContact CG-CB 4.47Å; Y36-K41 WeakPolarHBondContact O-CE 3.37Å
37	S	68.8	Low	69	Low	56 Å²	56	113.1 Å²	113.1	39%	0.392	55%	0.553	S	S	.	*			trans	-55.2	157.1	164.4	66.1	0	0	0	0	109.1	R35 H39 K40 K41	R35-S37 PolarHBondContact O-N 3.1Å; R35-S37 VanDerWaalsContact O-N 3.09Å; S37-H39 PolarHBondContact O-N 2.97Å; S37-H39 VanDerWaalsContact O-N 3.1Å; S37-K40 CarbonylContact O-C 3.55Å; S37-K40 WeakPolarHBondContact O-CA 3.49Å; S37-K40 PolarHBondContact O-N 2.89Å; S37-K40 WeakPolarHBondContact OG-CG 3.45Å; S37-K40 PolarHBondContact OG-N 3.36Å; S37-K41 PolarHBondContact O-N 3.3Å
38	T	65.4	Low	69.7	Low	123 Å²	123	117 Å²	117	76%	0.755	56%	0.559	S	S	*	*	H	α-helix	trans	-48.9	-40.8	179.4	44.5	0	0	0	0	112.1	K41 W42	T38-K41 PolarHBondContact O-N 3.31Å; T38-W42 PolarHBondContact O-N 3.06Å
39	H	66.9	Low	70.5	Confident	129 Å²	129	114.3 Å²	114.3	60%	0.597	55%	0.551	S	S	*	*	H	α-helix	trans	-62.5	-46.1	173.2	-174.8	-103.9	0	0	0	112.9	S37 K41 W42 H43	S37-H39 PolarHBondContact O-N 2.97Å; S37-H39 VanDerWaalsContact O-N 3.1Å; H39-K41 VanDerWaalsContact C-N 3.33Å; H39-K41 PolarHBondContact O-N 3.31Å; H39-W42 PolarHBondContact O-N 3.44Å; H39-H43 AromaticContact CD2-NE2 3.82Å; H39-H43 AromaticContact CE1-CD2 3.44Å; H39-H43 PolarHBondContact CE1-CD2 2.93Å; H39-H43 VanDerWaalsContact CE1-CD2 3.44Å; H39-H43 AromaticContact CE1-NE2 2.97Å; H39-H43 PolarHBondContact CE1-NE2 3.15Å; H39-H43 AromaticContact ND1-CD2 3.61Å; H39-H43 AromaticContact ND1-NE2 3.61Å; H39-H43 AromaticContact NE2-CD2 3.83Å; H39-H43 AromaticContact NE2-NE2 3.06Å; H39-H43 PolarHBondContact NE2-NE2 3.25Å; H39-H43 PolarHBondContact O-CD2 3.44Å; H39-H43 PolarHBondContact O-N 3.18Å
40	K	69.5	Low	71	Confident	108 Å²	108	116.2 Å²	116.2	47%	0.47	57%	0.568	S	S	.	*	H	α-helix	trans	-66.8	-31.6	178.5	-65.7	177	-179.9	178.2	0	112.8	Y36 S37 W42 H43 A44	Y36-K40 HydrophobicContact CD1-CB 3.88Å; Y36-K40 HydrophobicContact CG-CB 4.47Å; S37-K40 CarbonylContact O-C 3.55Å; S37-K40 WeakPolarHBondContact O-CA 3.49Å; S37-K40 PolarHBondContact O-N 2.89Å; S37-K40 WeakPolarHBondContact OG-CG 3.45Å; S37-K40 PolarHBondContact OG-N 3.36Å; K40-W42 VanDerWaalsContact C-N 3.33Å; K40-H43 PolarHBondContact O-N 2.95Å; K40-A44 WeakPolarHBondContact O-CB 3.44Å; K40-A44 PolarHBondContact O-N 3.45Å
41	K	74.5	Confident	71.4	Confident	124 Å²	124	114.8 Å²	114.8	54%	0.539	56%	0.558	S	S	.	*	H	α-helix	trans	-62.1	-41.8	175.3	-71	-174.7	-179.9	-176.1	0	111.5	Y36 S37 T38 H39 A44 V45	Y36-K41 WeakPolarHBondContact O-CE 3.37Å; S37-K41 PolarHBondContact O-N 3.3Å; T38-K41 PolarHBondContact O-N 3.31Å; H39-K41 VanDerWaalsContact C-N 3.33Å; H39-K41 PolarHBondContact O-N 3.31Å; K41-A44 PolarHBondContact O-N 3.08Å; K41-V45 WeakPolarHBondContact O-CG2 3.41Å; K41-V45 PolarHBondContact O-N 3.32Å
42	W	75.3	Confident	71.4	Confident	160 Å²	160	115.3 Å²	115.3	61%	0.606	57%	0.567	S	S	*	*	H	α-helix	trans	-62.9	-46.3	179.3	-162.9	93.1	0	0	0	111.6	T38 H39 K40 A44 V45 M46	T38-W42 PolarHBondContact O-N 3.06Å; H39-W42 PolarHBondContact O-N 3.44Å; K40-W42 VanDerWaalsContact C-N 3.33Å; W42-A44 VanDerWaalsContact C-N 3.32Å; W42-A44 PolarHBondContact O-N 3.39Å; W42-V45 PolarHBondContact O-N 3.37Å; W42-M46 HydrophobicContact CD2-CE 4.35Å; W42-M46 HydrophobicContact CD2-CG 4.04Å; W42-M46 HydrophobicContact CE3-CG 3.6Å; W42-M46 HydrophobicContact CH2-CE 3.4Å; W42-M46 HydrophobicContact CH2-CG 3.79Å; W42-M46 HydrophobicContact CH2-SD 4.11Å; W42-M46 HydrophobicContact CZ2-CE 3.12Å; W42-M46 HydrophobicContact CZ2-CG 4.2Å; W42-M46 HydrophobicContact CZ2-SD 4.36Å; W42-M46 HydrophobicContact CZ3-CB 4.5Å; W42-M46 HydrophobicContact CZ3-CE 4.12Å; W42-M46 HydrophobicContact CZ3-CG 3.47Å; W42-M46 VanDerWaalsContact CZ3-CG 3.47Å; W42-M46 HydrophobicContact CZ3-SD 4.38Å; W42-M46 WeakPolarHBondContact O-CG 3.44Å; W42-M46 PolarHBondContact O-N 3.33Å
43	H	75.3	Confident	71.5	Confident	89 Å²	89	118.2 Å²	118.2	41%	0.412	57%	0.571	S	S	.	*	H	α-helix	trans	-61.2	-38.6	174.6	-70.8	-62.1	0	0	0	112.9	H39 K40 M46 T47	H39-H43 AromaticContact CD2-NE2 3.82Å; H39-H43 AromaticContact CE1-CD2 3.44Å; H39-H43 PolarHBondContact CE1-CD2 2.93Å; H39-H43 VanDerWaalsContact CE1-CD2 3.44Å; H39-H43 AromaticContact CE1-NE2 2.97Å; H39-H43 PolarHBondContact CE1-NE2 3.15Å; H39-H43 AromaticContact ND1-CD2 3.61Å; H39-H43 AromaticContact ND1-NE2 3.61Å; H39-H43 AromaticContact NE2-CD2 3.83Å; H39-H43 AromaticContact NE2-NE2 3.06Å; H39-H43 PolarHBondContact NE2-NE2 3.25Å; H39-H43 PolarHBondContact O-CD2 3.44Å; H39-H43 PolarHBondContact O-N 3.18Å; K40-H43 PolarHBondContact O-N 2.95Å; H43-M46 PolarHBondContact O-N 2.91Å; H43-T47 PolarHBondContact O-N 2.95Å; H43-T47 PolarHBondContact O-OG1 3.09Å
44	A	76	Confident	72	Confident	31 Å²	31	119.9 Å²	119.9	26%	0.256	58%	0.583	S	S	.	*	H	α-helix	trans	-64.2	-46	176	0	0	0	0	0	111.8	K40 K41 W42 M46 T47 Y48	K40-A44 WeakPolarHBondContact O-CB 3.44Å; K40-A44 PolarHBondContact O-N 3.45Å; K41-A44 PolarHBondContact O-N 3.08Å; W42-A44 VanDerWaalsContact C-N 3.32Å; W42-A44 PolarHBondContact O-N 3.39Å; A44-M46 VanDerWaalsContact C-N 3.32Å; A44-M46 PolarHBondContact O-N 3.5Å; A44-T47 WeakPolarHBondContact O-CB 3.38Å; A44-T47 PolarHBondContact O-N 2.89Å; A44-Y48 WeakPolarHBondContact O-CD2 3.41Å
45	V	78.8	Confident	72.6	Confident	92 Å²	92	117.3 Å²	117.3	56%	0.558	57%	0.57	S	S	*	*	H	α-helix	trans	-61.3	-42	176.4	172.7	0	0	0	0	111.1	K41 W42 T47 Y48	K41-V45 WeakPolarHBondContact O-CG2 3.41Å; K41-V45 PolarHBondContact O-N 3.32Å; W42-V45 PolarHBondContact O-N 3.37Å; V45-T47 PolarHBondContact O-N 2.95Å; V45-Y48 PolarHBondContact O-N 3.14Å; V45-Y48 VanDerWaalsContact O-N 3.09Å
46	M	75.3	Confident	73.5	Confident	78 Å²	78	114.8 Å²	114.8	38%	0.384	57%	0.567	S	S	.	*	H	α-helix	trans	-63.6	-22.7	178.1	-76.5	-64.6	172	0	0	113.9	W42 H43 A44 Y48 I49	W42-M46 HydrophobicContact CD2-CE 4.35Å; W42-M46 HydrophobicContact CD2-CG 4.04Å; W42-M46 HydrophobicContact CE3-CG 3.6Å; W42-M46 HydrophobicContact CH2-CE 3.4Å; W42-M46 HydrophobicContact CH2-CG 3.79Å; W42-M46 HydrophobicContact CH2-SD 4.11Å; W42-M46 HydrophobicContact CZ2-CE 3.12Å; W42-M46 HydrophobicContact CZ2-CG 4.2Å; W42-M46 HydrophobicContact CZ2-SD 4.36Å; W42-M46 HydrophobicContact CZ3-CB 4.5Å; W42-M46 HydrophobicContact CZ3-CE 4.12Å; W42-M46 HydrophobicContact CZ3-CG 3.47Å; W42-M46 VanDerWaalsContact CZ3-CG 3.47Å; W42-M46 HydrophobicContact CZ3-SD 4.38Å; W42-M46 WeakPolarHBondContact O-CG 3.44Å; W42-M46 PolarHBondContact O-N 3.33Å; H43-M46 PolarHBondContact O-N 2.91Å; A44-M46 VanDerWaalsContact C-N 3.32Å; A44-M46 PolarHBondContact O-N 3.5Å; M46-Y48 VanDerWaalsContact C-N 3.29Å; M46-Y48 PolarHBondContact O-N 3.2Å; M46-I49 HydrophobicContact CE-CD1 4.16Å; M46-I49 PolarHBondContact O-N 2.91Å; M46-I49 HydrophobicContact SD-CD1 3.55Å; M46-I49 VanDerWaalsContact SD-CD1 3.55Å; M46-I49 HydrophobicContact SD-CG1 4.4Å
47	T	77.1	Confident	74.6	Confident	118 Å²	118	114.6 Å²	114.6	72%	0.724	58%	0.576	S	S	*	*	H	α-helix	trans	-70.7	-27.3	176	-52.7	0	0	0	0	112	H43 A44 V45	H43-T47 PolarHBondContact O-N 2.95Å; H43-T47 PolarHBondContact O-OG1 3.09Å; A44-T47 WeakPolarHBondContact O-CB 3.38Å; A44-T47 PolarHBondContact O-N 2.89Å; V45-T47 PolarHBondContact O-N 2.95Å
48	Y	77	Confident	75.6	Confident	204 Å²	204	119.1 Å²	119.1	80%	0.8	59%	0.585	S	S	*	*	H	α-helix	trans	-83.1	-15.2	177.1	-65.5	-77.4	0	0	0	113.4	A44 V45 M46 P50	A44-Y48 WeakPolarHBondContact O-CD2 3.41Å; V45-Y48 PolarHBondContact O-N 3.14Å; V45-Y48 VanDerWaalsContact O-N 3.09Å; M46-Y48 VanDerWaalsContact C-N 3.29Å; M46-Y48 PolarHBondContact O-N 3.2Å; Y48-P50 WeakPolarHBondContact O-CD 3.13Å
49	I	76.6	Confident	76.7	Confident	89 Å²	89	116.5 Å²	116.5	46%	0.456	56%	0.564	S	S	.	*	S	Bend	trans	-74.2	122.3	174.4	-57	-171.3	0	0	0	107.1	M46 K51	M46-I49 HydrophobicContact CE-CD1 4.16Å; M46-I49 PolarHBondContact O-N 2.91Å; M46-I49 HydrophobicContact SD-CD1 3.55Å; M46-I49 VanDerWaalsContact SD-CD1 3.55Å; M46-I49 HydrophobicContact SD-CG1 4.4Å; I49-K51 PolarHBondContact O-N 2.96Å; I49-K51 VanDerWaalsContact O-N 3.13Å
50	P	75.5	Confident	77.8	Confident	111 Å²	111	116.5 Å²	116.5	72%	0.721	56%	0.56	S	S	*	*	P	Polyproline II helix	trans	-57.2	125.4	175	24.1	-32.2	0	0	0	108.2	Y48	Y48-P50 WeakPolarHBondContact O-CD 3.13Å
51	K	73.4	Confident	78.9	Confident	180 Å²	180	114.7 Å²	114.7	78%	0.783	56%	0.559	S	S	*	*	P	Polyproline II helix	trans	-51.7	130.3	172.9	-69.1	-177.5	-179.9	-177.6	0	107.6	I49 R53	I49-K51 PolarHBondContact O-N 2.96Å; I49-K51 VanDerWaalsContact O-N 3.13Å; K51-R53 WeakPolarHBondContact O-CG 3.5Å; K51-R53 PolarHBondContact O-N 3.44Å
52	P	71.3	Confident	79.8	Confident	103 Å²	103	113.3 Å²	113.3	67%	0.669	56%	0.556	S	S	*	*			trans	-58.9	108.5	174.8	24.5	-31.9	0	0	0	107.1	I55	P52-I55 HydrophobicContact CB-CG1 4.13Å; P52-I55 HydrophobicContact CG-CD1 4.35Å; P52-I55 HydrophobicContact CG-CG1 4.47Å
53	R	70.5	Confident	80.5	Confident	225 Å²	225	110.7 Å²	110.7	85%	0.849	55%	0.554	S	S	*	*			trans	-79.6	-34	-176.6	-70.4	-169.2	178.9	-161.4	-0.3	111.1	K51	K51-R53 WeakPolarHBondContact O-CG 3.5Å; K51-R53 PolarHBondContact O-N 3.44Å
54	D	74.9	Confident	81.4	Confident	149 Å²	149	111 Å²	111	80%	0.797	56%	0.558	S	S	*	*			trans	-125.4	75.2	-171.6	-50.9	-45.3	0	0	0	109.3	P56	D54-P56 WeakPolarHBondContact O-CD 3.42Å
55	I	75.9	Confident	82.3	Confident	56 Å²	56	114.6 Å²	114.6	29%	0.287	57%	0.571	S	S	.	*			trans	-73	117.7	163	-63.5	178	0	0	0	105.4	P52 D57 Q59	P52-I55 HydrophobicContact CB-CG1 4.13Å; P52-I55 HydrophobicContact CG-CD1 4.35Å; P52-I55 HydrophobicContact CG-CG1 4.47Å; I55-D57 PolarHBondContact O-N 3.38Å; I55-Q59 HydrophobicContact CG2-CB 3.93Å; I55-Q59 VanDerWaalsContact CG2-OE1 3.28Å
56	P	83.5	Confident	83.1	Confident	51 Å²	51	113.2 Å²	113.2	33%	0.331	56%	0.564	S	S	.	*			trans	-66.9	137.2	-178	28.3	-34.6	0	0	0	110.2	D54 Y58 Q59	D54-P56 WeakPolarHBondContact O-CD 3.42Å; P56-Y58 HydrophobicContact CB-CD1 3.6Å; P56-Y58 HydrophobicContact CB-CE1 3.31Å; P56-Y58 HydrophobicContact CG-CD1 3.92Å; P56-Y58 HydrophobicContact CG-CE1 3.22Å; P56-Y58 PolarHBondContact O-N 3.03Å; P56-Q59 HydrophobicContact CG-CG 3.96Å; P56-Q59 WeakPolarHBondContact O-CB 3.46Å; P56-Q59 PolarHBondContact O-N 3.45Å
57	D	86.1	Confident	84	Confident	131 Å²	131	112.5 Å²	112.5	70%	0.701	57%	0.567	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.5	-26.1	-167.2	-67.8	-33.3	0	0	0	114.4	I55 Q59 Y60 P61	I55-D57 PolarHBondContact O-N 3.38Å; D57-Q59 PolarHBondContact O-N 3.03Å; D57-Q59 VanDerWaalsContact O-N 3.14Å; D57-Y60 PolarHBondContact O-N 3.37Å; D57-P61 WeakPolarHBondContact O-CD 3.27Å
58	Y	89.1	Confident	84.9	Confident	151 Å²	151	111 Å²	111	59%	0.592	55%	0.554	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64	-15.4	176.5	75.4	-99.4	0	0	0	113.6	P56 P61 I62	P56-Y58 HydrophobicContact CB-CD1 3.6Å; P56-Y58 HydrophobicContact CB-CE1 3.31Å; P56-Y58 HydrophobicContact CG-CD1 3.92Å; P56-Y58 HydrophobicContact CG-CE1 3.22Å; P56-Y58 PolarHBondContact O-N 3.03Å; Y58-P61 WeakPolarHBondContact O-CD 3.46Å; Y58-P61 VanDerWaalsContact O-CG 3.27Å; Y58-P61 WeakPolarHBondContact O-CG 3.43Å; Y58-I62 HydrophobicContact CD2-CD1 4.14Å; Y58-I62 HydrophobicContact CE2-CD1 4.49Å
59	Q	88.6	Confident	85.7	Confident	68 Å²	68	106.6 Å²	106.6	32%	0.318	54%	0.544	S	S	.	.	H	α-helix	trans	-79.9	-30.6	179.5	-69.1	-176.4	2.4	0	0	113.1	I55 P56 D57 I62 L63	I55-Q59 HydrophobicContact CG2-CB 3.93Å; I55-Q59 VanDerWaalsContact CG2-OE1 3.28Å; P56-Q59 HydrophobicContact CG-CG 3.96Å; P56-Q59 WeakPolarHBondContact O-CB 3.46Å; P56-Q59 PolarHBondContact O-N 3.45Å; D57-Q59 PolarHBondContact O-N 3.03Å; D57-Q59 VanDerWaalsContact O-N 3.14Å; Q59-I62 WeakPolarHBondContact O-CB 3.49Å; Q59-I62 PolarHBondContact O-N 3.31Å; Q59-I62 VanDerWaalsContact O-N 3.09Å; Q59-L63 WeakPolarHBondContact O-CG 3.25Å; Q59-L63 PolarHBondContact O-N 2.91Å
60	Y	89.1	Confident	86.4	Confident	129 Å²	129	107 Å²	107	51%	0.506	55%	0.545	S	S	.	.	H	α-helix	trans	-55.7	-47.5	178.4	-67.8	-67.7	0	0	0	114	D57 I62 L63 L64	D57-Y60 PolarHBondContact O-N 3.37Å; Y60-I62 VanDerWaalsContact C-N 3.27Å; Y60-I62 PolarHBondContact O-N 2.98Å; Y60-L63 PolarHBondContact O-N 3.46Å; Y60-L64 WeakPolarHBondContact O-CB 3.36Å; Y60-L64 PolarHBondContact O-N 2.66Å
61	P	93.2	Very high	87.2	Confident	70 Å²	70	104.2 Å²	104.2	46%	0.455	53%	0.532	S	S	.	.	H	α-helix	trans	-64.1	-33.8	176.3	24.5	-34.3	0	0	0	112	D57 Y58 L64 M65	D57-P61 WeakPolarHBondContact O-CD 3.27Å; Y58-P61 WeakPolarHBondContact O-CD 3.46Å; Y58-P61 VanDerWaalsContact O-CG 3.27Å; Y58-P61 WeakPolarHBondContact O-CG 3.43Å; P61-L64 WeakPolarHBondContact O-CB 3.34Å; P61-L64 PolarHBondContact O-N 3.48Å; P61-M65 VanDerWaalsContact O-CG 3.28Å; P61-M65 WeakPolarHBondContact O-CG 3.42Å; P61-M65 PolarHBondContact O-N 3.36Å
62	I	92.7	Very high	88	Confident	94 Å²	94	99 Å²	99	48%	0.482	52%	0.516	S	S	.	.	H	α-helix	trans	-64.9	-47.8	176.7	-58.7	172.1	0	0	0	110.2	Y58 Q59 Y60 L64 M65 C66	Y58-I62 HydrophobicContact CD2-CD1 4.14Å; Y58-I62 HydrophobicContact CE2-CD1 4.49Å; Q59-I62 WeakPolarHBondContact O-CB 3.49Å; Q59-I62 PolarHBondContact O-N 3.31Å; Q59-I62 VanDerWaalsContact O-N 3.09Å; Y60-I62 VanDerWaalsContact C-N 3.27Å; Y60-I62 PolarHBondContact O-N 2.98Å; I62-L64 VanDerWaalsContact C-N 3.27Å; I62-L64 PolarHBondContact O-N 3.23Å; I62-M65 PolarHBondContact O-N 3.38Å; I62-C66 PolarHBondContact O-N 3.09Å; I62-C66 PolarHBondContact O-SG 3.36Å; I62-C66 VanDerWaalsContact O-SG 3.34Å
63	L	91.5	Very high	88.9	Confident	106 Å²	106	99.5 Å²	99.5	56%	0.555	51%	0.505	S	S	*	.	H	α-helix	trans	-59.2	-40.5	176.2	-69.9	172	0	0	0	111.6	Q59 Y60 C66 S67	Q59-L63 WeakPolarHBondContact O-CG 3.25Å; Q59-L63 PolarHBondContact O-N 2.91Å; Y60-L63 PolarHBondContact O-N 3.46Å; L63-C66 PolarHBondContact O-N 2.93Å; L63-S67 WeakPolarHBondContact O-CB 3.28Å; L63-S67 PolarHBondContact O-N 3.46Å
64	L	94	Very high	89.6	Confident	94 Å²	94	94.1 Å²	94.1	49%	0.492	49%	0.488	S	S	.	.	H	α-helix	trans	-61.5	-52	175.5	-164.4	172.1	0	0	0	110.3	Y60 P61 I62 C66 S67 L68	Y60-L64 WeakPolarHBondContact O-CB 3.36Å; Y60-L64 PolarHBondContact O-N 2.66Å; P61-L64 WeakPolarHBondContact O-CB 3.34Å; P61-L64 PolarHBondContact O-N 3.48Å; I62-L64 VanDerWaalsContact C-N 3.27Å; I62-L64 PolarHBondContact O-N 3.23Å; L64-C66 VanDerWaalsContact C-N 3.32Å; L64-C66 PolarHBondContact O-N 2.89Å; L64-S67 PolarHBondContact O-N 2.89Å; L64-S67 VanDerWaalsContact O-N 3.09Å; L64-S67 PolarHBondContact O-OG 3.36Å; L64-L68 HydrophobicContact CD2-CD1 3.36Å; L64-L68 HydrophobicContact CD2-CG 3.75Å; L64-L68 PolarHBondContact O-N 2.94Å
65	M	95.2	Very high	89.9	Confident	108 Å²	108	91.7 Å²	91.7	53%	0.532	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-41.4	179	-68.2	-54.3	-66.4	0	0	112.2	P61 I62 S67 L68 I69	P61-M65 VanDerWaalsContact O-CG 3.28Å; P61-M65 WeakPolarHBondContact O-CG 3.42Å; P61-M65 PolarHBondContact O-N 3.36Å; I62-M65 PolarHBondContact O-N 3.38Å; M65-S67 PolarHBondContact O-N 2.79Å; M65-L68 PolarHBondContact O-N 3.26Å; M65-L68 HydrophobicContact SD-CD1 4.36Å; M65-I69 VanDerWaalsContact O-CG1 3.28Å; M65-I69 WeakPolarHBondContact O-CG1 3.46Å; M65-I69 PolarHBondContact O-N 3.28Å
66	C	95.1	Very high	90.3	Very high	62 Å²	62	96.8 Å²	96.8	42%	0.419	50%	0.502	S	S	.	.	H	α-helix	trans	-59.9	-45.1	173.6	-71.2	0	0	0	0	111.7	I62 L63 L64 L68 I69 I70	I62-C66 PolarHBondContact O-N 3.09Å; I62-C66 PolarHBondContact O-SG 3.36Å; I62-C66 VanDerWaalsContact O-SG 3.34Å; L63-C66 PolarHBondContact O-N 2.93Å; L64-C66 VanDerWaalsContact C-N 3.32Å; L64-C66 PolarHBondContact O-N 2.89Å; C66-L68 VanDerWaalsContact C-N 3.32Å; C66-L68 PolarHBondContact O-N 3.43Å; C66-I69 PolarHBondContact O-N 2.87Å; C66-I70 WeakPolarHBondContact O-CD1 3.47Å; C66-I70 VanDerWaalsContact O-CG1 3.27Å; C66-I70 WeakPolarHBondContact O-CG1 3.4Å; C66-I70 PolarHBondContact O-N 3.09Å
67	S	94.6	Very high	90	Very high	63 Å²	63	99.6 Å²	99.6	44%	0.441	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-38.3	177.8	76	0	0	0	0	112.5	L63 L64 M65 I70 A71	L63-S67 WeakPolarHBondContact O-CB 3.28Å; L63-S67 PolarHBondContact O-N 3.46Å; L64-S67 PolarHBondContact O-N 2.89Å; L64-S67 VanDerWaalsContact O-N 3.09Å; L64-S67 PolarHBondContact O-OG 3.36Å; M65-S67 PolarHBondContact O-N 2.79Å; S67-I70 PolarHBondContact O-N 3.46Å; S67-A71 VanDerWaalsContact O-CB 3.27Å; S67-A71 WeakPolarHBondContact O-CB 3.49Å; S67-A71 PolarHBondContact O-N 3.42Å
68	L	94.5	Very high	89.4	Confident	87 Å²	87	95.7 Å²	95.7	46%	0.455	49%	0.49	S	S	.	.	H	α-helix	trans	-69	-41.1	177.6	-72.7	178.7	0	0	0	112.5	L64 M65 C66 I70 A71 T72	L64-L68 HydrophobicContact CD2-CD1 3.36Å; L64-L68 HydrophobicContact CD2-CG 3.75Å; L64-L68 PolarHBondContact O-N 2.94Å; M65-L68 PolarHBondContact O-N 3.26Å; M65-L68 HydrophobicContact SD-CD1 4.36Å; C66-L68 VanDerWaalsContact C-N 3.32Å; C66-L68 PolarHBondContact O-N 3.43Å; L68-I70 VanDerWaalsContact C-N 3.34Å; L68-A71 PolarHBondContact O-N 2.92Å; L68-T72 VanDerWaalsContact O-CB 3.27Å; L68-T72 WeakPolarHBondContact O-CB 3.42Å; L68-T72 PolarHBondContact O-N 3.28Å; L68-T72 PolarHBondContact O-OG1 3.28Å
69	I	93.9	Very high	88.5	Confident	112 Å²	112	94 Å²	94	57%	0.574	50%	0.496	S	S	*	.	H	α-helix	trans	-62.4	-46	176.5	-68.3	164.6	0	0	0	109.7	M65 C66 T72 Y73	M65-I69 VanDerWaalsContact O-CG1 3.28Å; M65-I69 WeakPolarHBondContact O-CG1 3.46Å; M65-I69 PolarHBondContact O-N 3.28Å; C66-I69 PolarHBondContact O-N 2.87Å; I69-T72 PolarHBondContact O-N 2.85Å; I69-Y73 WeakPolarHBondContact O-CB 3.39Å; I69-Y73 PolarHBondContact O-N 3.23Å
70	I	93.1	Very high	87.8	Confident	96 Å²	96	99.4 Å²	99.4	49%	0.492	51%	0.513	S	S	.	.	H	α-helix	trans	-62.4	-47.4	177.5	-67.7	166.8	0	0	0	110.4	C66 S67 L68 T72 Y73 F74	C66-I70 WeakPolarHBondContact O-CD1 3.47Å; C66-I70 VanDerWaalsContact O-CG1 3.27Å; C66-I70 WeakPolarHBondContact O-CG1 3.4Å; C66-I70 PolarHBondContact O-N 3.09Å; S67-I70 PolarHBondContact O-N 3.46Å; L68-I70 VanDerWaalsContact C-N 3.34Å; I70-T72 VanDerWaalsContact C-N 3.31Å; I70-T72 PolarHBondContact O-N 3.26Å; I70-Y73 WeakPolarHBondContact O-CB 3.45Å; I70-Y73 PolarHBondContact O-N 3.45Å; I70-F74 HydrophobicContact CG2-CD2 3.66Å; I70-F74 HydrophobicContact CG2-CE2 3.77Å; I70-F74 WeakPolarHBondContact O-CD2 3.33Å; I70-F74 PolarHBondContact O-N 3.05Å
71	A	90.9	Very high	87	Confident	54 Å²	54	95.7 Å²	95.7	45%	0.446	51%	0.505	S	S	.	.	H	α-helix	trans	-60.5	-41.2	178	0	0	0	0	0	112.1	S67 L68 F74 C75	S67-A71 VanDerWaalsContact O-CB 3.27Å; S67-A71 WeakPolarHBondContact O-CB 3.49Å; S67-A71 PolarHBondContact O-N 3.42Å; L68-A71 PolarHBondContact O-N 2.92Å; A71-F74 PolarHBondContact O-N 3.4Å; A71-C75 WeakPolarHBondContact O-CB 3.47Å; A71-C75 PolarHBondContact O-N 3.23Å
72	T	91.4	Very high	86.4	Confident	71 Å²	71	98.7 Å²	98.7	44%	0.436	52%	0.518	S	S	.	.	H	α-helix	trans	-66	-42.2	177.4	-56.3	0	0	0	0	110.8	L68 I69 I70 C75 F76	L68-T72 VanDerWaalsContact O-CB 3.27Å; L68-T72 WeakPolarHBondContact O-CB 3.42Å; L68-T72 PolarHBondContact O-N 3.28Å; L68-T72 PolarHBondContact O-OG1 3.28Å; I69-T72 PolarHBondContact O-N 2.85Å; I70-T72 VanDerWaalsContact C-N 3.31Å; I70-T72 PolarHBondContact O-N 3.26Å; T72-C75 PolarHBondContact O-N 3.39Å; T72-F76 HydrophobicContact CG2-CD2 3.63Å; T72-F76 HydrophobicContact CG2-CE2 4.05Å; T72-F76 WeakPolarHBondContact O-CD2 3.27Å; T72-F76 PolarHBondContact O-N 2.92Å
73	Y	89	Confident	85.6	Confident	112 Å²	112	100.5 Å²	100.5	44%	0.439	53%	0.528	S	S	.	.	I	π-helix	trans	-59.4	-48.7	174.2	174.3	-100.6	0	0	0	111.4	I69 I70 C75 I77 H78	I69-Y73 WeakPolarHBondContact O-CB 3.39Å; I69-Y73 PolarHBondContact O-N 3.23Å; I70-Y73 WeakPolarHBondContact O-CB 3.45Å; I70-Y73 PolarHBondContact O-N 3.45Å; Y73-C75 PolarHBondContact O-N 2.97Å; Y73-I77 HydrophobicContact CD2-CB 3.82Å; Y73-I77 HydrophobicContact CD2-CD1 4.23Å; Y73-I77 HydrophobicContact CD2-CG2 3.83Å; Y73-I77 HydrophobicContact CE2-CB 4.08Å; Y73-I77 HydrophobicContact CE2-CG2 3.61Å; Y73-I77 CarbonylContact O-C 3.59Å; Y73-I77 WeakPolarHBondContact O-CA 3.5Å; Y73-I77 WeakPolarHBondContact O-CB 3.27Å; Y73-I77 PolarHBondContact O-N 3.34Å; Y73-H78 HydrophobicContact CE1-CB 4.42Å; Y73-H78 AromaticContact CE1-CD2 3.91Å; Y73-H78 PolarHBondContact O-N 2.86Å
74	F	84.6	Confident	85.1	Confident	113 Å²	113	97.7 Å²	97.7	50%	0.496	51%	0.513	S	S	.	.	I	π-helix	trans	-66.5	-34.2	177.5	-84.5	-73.8	0	0	0	113.6	I70 A71 H78	I70-F74 HydrophobicContact CG2-CD2 3.66Å; I70-F74 HydrophobicContact CG2-CE2 3.77Å; I70-F74 WeakPolarHBondContact O-CD2 3.33Å; I70-F74 PolarHBondContact O-N 3.05Å; A71-F74 PolarHBondContact O-N 3.4Å; F74-H78 HydrophobicContact CD1-CB 3.95Å; F74-H78 AromaticContact CD1-CD2 3.81Å; F74-H78 AromaticContact CD1-CG 3.69Å; F74-H78 AromaticContact CE1-CD2 3.59Å; F74-H78 AromaticContact CE1-CG 3.93Å; F74-H78 AromaticContact CE1-NE2 3.67Å
75	C	83.1	Confident	84.8	Confident	97 Å²	97	96.6 Å²	96.6	66%	0.655	51%	0.508	S	S	*	.	I	π-helix	trans	-75.7	-40.4	-178.3	-169.2	0	0	0	0	112.8	A71 T72 Y73	A71-C75 WeakPolarHBondContact O-CB 3.47Å; A71-C75 PolarHBondContact O-N 3.23Å; T72-C75 PolarHBondContact O-N 3.39Å; Y73-C75 PolarHBondContact O-N 2.97Å
76	F	83.4	Confident	84.4	Confident	163 Å²	163	95.9 Å²	95.9	72%	0.715	51%	0.505	S	S	*	.	I	π-helix	trans	-111.1	-33.7	-170	-64.9	-73.6	0	0	0	114.8	T72	T72-F76 HydrophobicContact CG2-CD2 3.63Å; T72-F76 HydrophobicContact CG2-CE2 4.05Å; T72-F76 WeakPolarHBondContact O-CD2 3.27Å; T72-F76 PolarHBondContact O-N 2.92Å
77	I	77.7	Confident	84	Confident	111 Å²	111	97.2 Å²	97.2	57%	0.569	51%	0.508	S	S	*	.	I	π-helix	trans	-107.7	-31.3	-168	-61.8	171.7	0	0	0	111.7	Y73 T79	Y73-I77 HydrophobicContact CD2-CB 3.82Å; Y73-I77 HydrophobicContact CD2-CD1 4.23Å; Y73-I77 HydrophobicContact CD2-CG2 3.83Å; Y73-I77 HydrophobicContact CE2-CB 4.08Å; Y73-I77 HydrophobicContact CE2-CG2 3.61Å; Y73-I77 CarbonylContact O-C 3.59Å; Y73-I77 WeakPolarHBondContact O-CA 3.5Å; Y73-I77 WeakPolarHBondContact O-CB 3.27Å; Y73-I77 PolarHBondContact O-N 3.34Å; I77-T79 PolarHBondContact O-N 3.49Å
78	H	72.6	Confident	83.7	Confident	49 Å²	49	97.7 Å²	97.7	23%	0.227	51%	0.505	C	S	.	.			trans	-68.2	95.2	-178.4	-165.9	-91.3	0	0	0	110.2	Y73 F74 C81 D84	Y73-H78 HydrophobicContact CE1-CB 4.42Å; Y73-H78 AromaticContact CE1-CD2 3.91Å; Y73-H78 PolarHBondContact O-N 2.86Å; F74-H78 HydrophobicContact CD1-CB 3.95Å; F74-H78 AromaticContact CD1-CD2 3.81Å; F74-H78 AromaticContact CD1-CG 3.69Å; F74-H78 AromaticContact CE1-CD2 3.59Å; F74-H78 AromaticContact CE1-CG 3.93Å; F74-H78 AromaticContact CE1-NE2 3.67Å; H78-C81 VanDerWaalsContact CE1-SG 3.52Å; H78-D84 IonicContact CE1-OD1 3.76Å; H78-D84 IonicContact CE1-OD2 3.23Å; H78-D84 PolarHBondContact CE1-OD2 3.21Å; H78-D84 VanDerWaalsContact CE1-OD2 3.23Å; H78-D84 IonicContact ND1-OD2 3.44Å; H78-D84 PolarHBondContact ND1-OD2 2.85Å
79	T	71.2	Confident	83.5	Confident	116 Å²	116	100.2 Å²	100.2	71%	0.712	52%	0.515	S	S	*	.			trans	-63.3	135.3	166.1	51.4	0	0	0	0	108.4	I77 C81	I77-T79 PolarHBondContact O-N 3.49Å; T79-C81 PolarHBondContact O-N 3.04Å; T79-C81 VanDerWaalsContact O-N 3.11Å; T79-C81 PolarHBondContact O-SG 3.38Å
80	R	73.4	Confident	83.3	Confident	181 Å²	181	99.6 Å²	99.6	68%	0.683	51%	0.513	S	S	*	.			trans	-37.3	117.8	178.5	-160.2	-175.4	-168.7	138.3	13.1	110.7	D84 D85 D88	R80-D84 HydrophobicContact CG-CB 4.47Å; R80-D85 IonicContact CZ-OD1 3.57Å; R80-D85 IonicContact NE-OD1 2.88Å; R80-D85 PolarHBondContact NE-OD1 3.23Å; R80-D85 IonicContact NH2-OD1 3.5Å; R80-D85 PolarHBondContact NH2-OD1 3.5Å; R80-D88 IonicContact NH2-OD2 3.84Å
81	C	73.1	Confident	83.1	Confident	50 Å²	50	100.9 Å²	100.9	34%	0.338	52%	0.515	S	S	.	.			trans	-103.1	156.8	177.8	-74.3	0	0	0	0	110	H78 T79 L83 D84	H78-C81 VanDerWaalsContact CE1-SG 3.52Å; T79-C81 PolarHBondContact O-N 3.04Å; T79-C81 VanDerWaalsContact O-N 3.11Å; T79-C81 PolarHBondContact O-SG 3.38Å; C81-L83 PolarHBondContact O-N 3.3Å; C81-D84 PolarHBondContact N-OD2 3.48Å; C81-D84 VanDerWaalsContact O-CB 3.31Å; C81-D84 WeakPolarHBondContact O-CB 3.28Å; C81-D84 PolarHBondContact O-N 2.69Å
82	D	78.8	Confident	83.1	Confident	134 Å²	134	105.4 Å²	105.4	72%	0.717	52%	0.524	S	S	*	.	H	α-helix	trans	-54.1	-28	175.8	-60.9	-16.2	0	0	0	112.9	D84 D85 I86	D82-D84 VanDerWaalsContact C-N 3.34Å; D82-D85 PolarHBondContact O-N 2.98Å; D82-I86 WeakPolarHBondContact O-CG1 3.27Å; D82-I86 PolarHBondContact O-N 3.43Å
83	L	77.1	Confident	82.9	Confident	132 Å²	132	104.1 Å²	104.1	69%	0.691	52%	0.521	S	S	*	.	H	α-helix	trans	-67.2	-31.8	175.1	-117.8	76.1	0	0	0	113.3	C81 D85 I86 L87	C81-L83 PolarHBondContact O-N 3.3Å; L83-D85 VanDerWaalsContact C-N 3.33Å; L83-I86 PolarHBondContact O-N 3.43Å; L83-L87 WeakPolarHBondContact O-CB 3.43Å; L83-L87 PolarHBondContact O-N 3.34Å
84	D	80.9	Confident	82.7	Confident	46 Å²	46	105 Å²	105	25%	0.246	53%	0.528	C	S	.	.	H	α-helix	trans	-67.3	-39.3	176.9	-60.7	-36.7	0	0	0	109.9	H78 R80 C81 D82 L87 D88	H78-D84 IonicContact CE1-OD1 3.76Å; H78-D84 IonicContact CE1-OD2 3.23Å; H78-D84 PolarHBondContact CE1-OD2 3.21Å; H78-D84 VanDerWaalsContact CE1-OD2 3.23Å; H78-D84 IonicContact ND1-OD2 3.44Å; H78-D84 PolarHBondContact ND1-OD2 2.85Å; R80-D84 HydrophobicContact CG-CB 4.47Å; C81-D84 PolarHBondContact N-OD2 3.48Å; C81-D84 VanDerWaalsContact O-CB 3.31Å; C81-D84 WeakPolarHBondContact O-CB 3.28Å; C81-D84 PolarHBondContact O-N 2.69Å; D82-D84 VanDerWaalsContact C-N 3.34Å; D84-L87 WeakPolarHBondContact O-CB 3.31Å; D84-L87 PolarHBondContact O-N 3.4Å; D84-D88 PolarHBondContact O-N 3.37Å
85	D	86.8	Confident	82.8	Confident	72 Å²	72	105.5 Å²	105.5	39%	0.385	53%	0.532	S	S	.	.	H	α-helix	trans	-66.9	-39.7	177.8	-67.1	-22.6	0	0	0	111.7	R80 D82 L83 L87 D88 E89	R80-D85 IonicContact CZ-OD1 3.57Å; R80-D85 IonicContact NE-OD1 2.88Å; R80-D85 PolarHBondContact NE-OD1 3.23Å; R80-D85 IonicContact NH2-OD1 3.5Å; R80-D85 PolarHBondContact NH2-OD1 3.5Å; D82-D85 PolarHBondContact O-N 2.98Å; L83-D85 VanDerWaalsContact C-N 3.33Å; D85-L87 VanDerWaalsContact C-N 3.32Å; D85-D88 PolarHBondContact O-N 3.01Å; D85-E89 PolarHBondContact O-N 3.41Å
86	I	87	Confident	82.9	Confident	92 Å²	92	108.7 Å²	108.7	47%	0.472	53%	0.534	S	S	.	.	H	α-helix	trans	-64.5	-38.6	173.2	-65.8	169.6	0	0	0	110.9	D82 L83 E89 N90	D82-I86 WeakPolarHBondContact O-CG1 3.27Å; D82-I86 PolarHBondContact O-N 3.43Å; L83-I86 PolarHBondContact O-N 3.43Å; I86-E89 PolarHBondContact O-N 3.18Å; I86-N90 PolarHBondContact O-N 3.16Å; I86-N90 VanDerWaalsContact O-N 3.09Å; I86-N90 PolarHBondContact O-ND2 3.5Å
87	L	86.8	Confident	82.9	Confident	90 Å²	90	106.3 Å²	106.3	47%	0.471	53%	0.529	S	S	.	.	H	α-helix	trans	-65.4	-44.6	178	-175.5	62.4	0	0	0	110.9	L83 D84 D85 E89 N90 F91	L83-L87 WeakPolarHBondContact O-CB 3.43Å; L83-L87 PolarHBondContact O-N 3.34Å; D84-L87 WeakPolarHBondContact O-CB 3.31Å; D84-L87 PolarHBondContact O-N 3.4Å; D85-L87 VanDerWaalsContact C-N 3.32Å; L87-E89 VanDerWaalsContact C-N 3.34Å; L87-E89 PolarHBondContact O-N 3.22Å; L87-N90 PolarHBondContact O-N 3.47Å; L87-F91 HydrophobicContact CD1-CD2 4.04Å; L87-F91 HydrophobicContact CD1-CE2 3.58Å; L87-F91 HydrophobicContact CD1-CZ 4.39Å; L87-F91 HydrophobicContact CD2-CE2 4.1Å; L87-F91 HydrophobicContact CG-CD2 3.86Å; L87-F91 HydrophobicContact CG-CE2 3.59Å; L87-F91 VanDerWaalsContact O-CD2 3.25Å; L87-F91 WeakPolarHBondContact O-CD2 3.49Å; L87-F91 PolarHBondContact O-N 2.88Å
88	D	89.1	Confident	83.1	Confident	74 Å²	74	108.1 Å²	108.1	40%	0.396	53%	0.533	S	S	.	.	H	α-helix	trans	-59.2	-42.3	175.1	-85	-7.8	0	0	0	112.3	R80 D84 D85 F91 K92	R80-D88 IonicContact NH2-OD2 3.84Å; D84-D88 PolarHBondContact O-N 3.37Å; D85-D88 PolarHBondContact O-N 3.01Å; D88-F91 PolarHBondContact O-N 2.84Å; D88-K92 WeakPolarHBondContact O-CG 3.44Å; D88-K92 PolarHBondContact O-N 2.88Å
89	E	89.8	Confident	83.3	Confident	140 Å²	140	112.1 Å²	112.1	65%	0.654	56%	0.555	S	S	*	*	H	α-helix	trans	-63	-43.8	176.7	-171	178.5	-178	0	0	111.7	D85 I86 L87 F91 K92 A93	D85-E89 PolarHBondContact O-N 3.41Å; I86-E89 PolarHBondContact O-N 3.18Å; L87-E89 VanDerWaalsContact C-N 3.34Å; L87-E89 PolarHBondContact O-N 3.22Å; E89-F91 VanDerWaalsContact C-N 3.35Å; E89-F91 PolarHBondContact O-N 3.23Å; E89-K92 PolarHBondContact O-N 3.4Å; E89-A93 PolarHBondContact O-N 3.48Å
90	N	89.1	Confident	83.2	Confident	98 Å²	98	109.8 Å²	109.8	52%	0.524	55%	0.554	S	S	.	*	H	α-helix	trans	-63.4	-39.3	176.6	-77.2	-56.4	0	0	0	112.3	I86 L87 A93 F94	I86-N90 PolarHBondContact O-N 3.16Å; I86-N90 VanDerWaalsContact O-N 3.09Å; I86-N90 PolarHBondContact O-ND2 3.5Å; L87-N90 PolarHBondContact O-N 3.47Å; N90-A93 PolarHBondContact O-N 2.88Å; N90-F94 WeakPolarHBondContact O-CB 3.41Å; N90-F94 PolarHBondContact O-N 2.96Å
91	F	89.5	Confident	82.5	Confident	124 Å²	124	110.4 Å²	110.4	54%	0.544	56%	0.562	S	S	.	*	H	α-helix	trans	-64.5	-43.4	175.3	-84	-62.5	0	0	0	112.1	L87 D88 E89 A93 F94 E95	L87-F91 HydrophobicContact CD1-CD2 4.04Å; L87-F91 HydrophobicContact CD1-CE2 3.58Å; L87-F91 HydrophobicContact CD1-CZ 4.39Å; L87-F91 HydrophobicContact CD2-CE2 4.1Å; L87-F91 HydrophobicContact CG-CD2 3.86Å; L87-F91 HydrophobicContact CG-CE2 3.59Å; L87-F91 VanDerWaalsContact O-CD2 3.25Å; L87-F91 WeakPolarHBondContact O-CD2 3.49Å; L87-F91 PolarHBondContact O-N 2.88Å; D88-F91 PolarHBondContact O-N 2.84Å; E89-F91 VanDerWaalsContact C-N 3.35Å; E89-F91 PolarHBondContact O-N 3.23Å; F91-A93 VanDerWaalsContact C-N 3.33Å; F91-A93 PolarHBondContact O-N 3.35Å; F91-F94 PolarHBondContact O-N 2.85Å; F91-E95 PolarHBondContact O-N 3.44Å
92	K	90.4	Very high	81.3	Confident	148 Å²	148	120 Å²	120	64%	0.643	60%	0.598	S	S	*	*	H	α-helix	trans	-60.7	-42.3	174.5	-72.3	171.3	-176.5	168.1	0	112	D88 E89 F94 E95 K96	D88-K92 WeakPolarHBondContact O-CG 3.44Å; D88-K92 PolarHBondContact O-N 2.88Å; E89-K92 PolarHBondContact O-N 3.4Å; K92-F94 VanDerWaalsContact C-N 3.34Å; K92-E95 PolarHBondContact O-N 2.85Å; K92-K96 WeakPolarHBondContact O-CB 3.38Å; K92-K96 PolarHBondContact O-N 2.94Å
93	A	87.3	Confident	81.5	Confident	45 Å²	45	119.4 Å²	119.4	37%	0.372	59%	0.592	S	S	.	*	H	α-helix	trans	-63.7	-40.5	176.1	0	0	0	0	0	111.9	E89 N90 F91 N97	E89-A93 PolarHBondContact O-N 3.48Å; N90-A93 PolarHBondContact O-N 2.88Å; F91-A93 VanDerWaalsContact C-N 3.33Å; F91-A93 PolarHBondContact O-N 3.35Å; A93-N97 PolarHBondContact O-N 2.94Å; A93-N97 VanDerWaalsContact O-N 3.08Å; A93-N97 PolarHBondContact O-ND2 3.35Å
94	F	86	Confident	81.7	Confident	130 Å²	130	118.7 Å²	118.7	57%	0.57	59%	0.587	S	S	*	*	H	α-helix	trans	-64.3	-45.3	176.1	-176.8	-97.6	0	0	0	112.3	N90 F91 K92 K96 N97 K98	N90-F94 WeakPolarHBondContact O-CB 3.41Å; N90-F94 PolarHBondContact O-N 2.96Å; F91-F94 PolarHBondContact O-N 2.85Å; K92-F94 VanDerWaalsContact C-N 3.34Å; F94-K96 PolarHBondContact O-N 3.35Å; F94-N97 PolarHBondContact O-N 3.41Å; F94-K98 HydrophobicContact CE1-CD 4.33Å; F94-K98 WeakPolarHBondContact O-CB 3.16Å; F94-K98 PolarHBondContact O-N 3.45Å
95	E	85.4	Confident	81.8	Confident	124 Å²	124	122.7 Å²	122.7	58%	0.579	61%	0.606	S	S	*	*	H	α-helix	trans	-61.8	-43.4	176.6	-74.5	-167.9	154.4	0	0	112.2	F91 K92 N97 K98 L99	F91-E95 PolarHBondContact O-N 3.44Å; K92-E95 PolarHBondContact O-N 2.85Å; E95-N97 VanDerWaalsContact C-N 3.31Å; E95-N97 PolarHBondContact O-N 3.31Å; E95-K98 PolarHBondContact O-N 3.38Å; E95-K98 VanDerWaalsContact O-N 3.15Å; E95-L99 WeakPolarHBondContact O-CB 3.5Å; E95-L99 PolarHBondContact O-N 3.3Å
96	K	84.8	Confident	81.5	Confident	164 Å²	164	125.7 Å²	125.7	71%	0.713	62%	0.619	S	S	*	*	H	α-helix	trans	-57.8	-43.6	174.9	-174.2	-180	178.8	-178.7	0	111.7	K92 F94 G100	K92-K96 WeakPolarHBondContact O-CB 3.38Å; K92-K96 PolarHBondContact O-N 2.94Å; F94-K96 PolarHBondContact O-N 3.35Å; K96-G100 PolarHBondContact O-N 3.13Å
97	N	83.4	Confident	81.1	Confident	112 Å²	112	127.8 Å²	127.8	60%	0.599	63%	0.628	S	S	*	*	H	α-helix	trans	-69	-32.1	177.6	-73.9	-24.9	0	0	0	113	A93 F94 E95	A93-N97 PolarHBondContact O-N 2.94Å; A93-N97 VanDerWaalsContact O-N 3.08Å; A93-N97 PolarHBondContact O-ND2 3.35Å; F94-N97 PolarHBondContact O-N 3.41Å; E95-N97 VanDerWaalsContact C-N 3.31Å; E95-N97 PolarHBondContact O-N 3.31Å
98	K	81.9	Confident	80.7	Confident	149 Å²	149	130.3 Å²	130.3	65%	0.648	64%	0.638	S	S	*	*	H	α-helix	trans	-73.6	-40.1	177.1	-165.4	-179.7	179.6	-174.6	0	111.5	F94 E95 K101	F94-K98 HydrophobicContact CE1-CD 4.33Å; F94-K98 WeakPolarHBondContact O-CB 3.16Å; F94-K98 PolarHBondContact O-N 3.45Å; E95-K98 PolarHBondContact O-N 3.38Å; E95-K98 VanDerWaalsContact O-N 3.15Å; K98-K101 PolarHBondContact O-N 3.11Å
99	L	77	Confident	80.1	Confident	134 Å²	134	134.4 Å²	134.4	70%	0.702	66%	0.656	S	S	*	*	H	α-helix	trans	-68.9	-38.3	174.9	-75.1	163.9	0	0	0	112	E95 K101 K102	E95-L99 WeakPolarHBondContact O-CB 3.5Å; E95-L99 PolarHBondContact O-N 3.3Å; L99-K101 PolarHBondContact O-N 2.84Å; L99-K102 PolarHBondContact O-N 3Å
100	G	68.9	Low	79.4	Confident	67 Å²	67	133.9 Å²	133.9	69%	0.691	66%	0.656	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70.3	-4.6	176.6	0	0	0	0	0	115.3	K96	K96-G100 PolarHBondContact O-N 3.13Å
101	K	60.4	Low	78.6	Confident	193 Å²	193	136.9 Å²	136.9	84%	0.839	67%	0.667	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.6	3.5	175.6	-83.2	-172.9	175.2	-177.2	0	113.9	K98 L99	K98-K101 PolarHBondContact O-N 3.11Å; L99-K101 PolarHBondContact O-N 2.84Å
102	K	48.1	Very low	77.6	Confident	253 Å²	253	138.1 Å²	138.1	100%	1.1	68%	0.678	S	S	*	*			trans	-107.3	0	174.6	-154.2	-176.6	-175.9	-171.2	0	109.9	L99	L99-K102 PolarHBondContact O-N 3Å

Retrieved 102 of 102 residues in 86.7 ms (Link to these results)

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