A0A077Z0A5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z0A5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 116 aa.

						>A0A077Z0A5_TRITR|A0A077Z0A5
MAYETYPPICVTAPKNLPSERSVQVEDNVDDDEQEEQFTEFDVVDEDEVEEDSAAATADVIMRNNGGVEGDFDEEIRQLIDNYGYDSSFLIRLAISVNLHVVVLGTFHSQILFIFS
					

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(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.2	Very low	47.1	Very low	222 Å²	222	149 Å²	149	100%	1.094	80%	0.801	S	S	*	*				0	116.7	0	-65.9	-70.8	-173	0	0	105.6	Y3	M1-Y3 PolarHBondContact O-N 2.84Å
2	A	42.4	Very low	46.9	Very low	98 Å²	98	147.6 Å²	147.6	81%	0.81	80%	0.802	S	S	*	*			trans	-70.5	124.1	-173.3	0	0	0	0	0	109.7	E4	A2-E4 PolarHBondContact O-N 3.18Å
3	Y	47.1	Very low	47.2	Very low	213 Å²	213	142.2 Å²	142.2	84%	0.835	79%	0.789	S	S	*	*			trans	-65.5	119	172.6	-32.3	-84.6	0	0	0	106.8	M1 T5	M1-Y3 PolarHBondContact O-N 2.84Å; Y3-T5 VanDerWaalsContact C-N 3.34Å; Y3-T5 PolarHBondContact O-N 3.01Å
4	E	50.8	Low	46.8	Very low	172 Å²	172	141 Å²	141	80%	0.804	79%	0.791	S	S	*	*			trans	-68	97.4	175.5	-66.3	-147.3	162.3	0	0	108.5	A2 Y6	A2-E4 PolarHBondContact O-N 3.18Å; E4-Y6 PolarHBondContact O-N 2.97Å
5	T	46.9	Very low	46.7	Very low	131 Å²	131	145.1 Å²	145.1	80%	0.804	80%	0.797	S	S	*	*			trans	-60.2	103.3	165.9	-61.6	0	0	0	0	107.4	Y3	Y3-T5 VanDerWaalsContact C-N 3.34Å; Y3-T5 PolarHBondContact O-N 3.01Å
6	Y	48.3	Very low	46	Very low	205 Å²	205	145.8 Å²	145.8	80%	0.804	80%	0.799	S	S	*	*	P	Polyproline II helix	trans	-57.7	126.3	171.2	-79.5	-92.3	0	0	0	108.7	E4	E4-Y6 PolarHBondContact O-N 2.97Å
7	P	49.2	Very low	45.8	Very low	106 Å²	106	147.2 Å²	147.2	69%	0.688	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-62.7	138.6	175.3	24.5	-31.3	0	0	0	109.1	I9	P7-I9 PolarHBondContact O-N 3.24Å
8	P	49.9	Very low	45.3	Very low	115 Å²	115	145.6 Å²	145.6	75%	0.747	80%	0.803	S	S	*	*	P	Polyproline II helix	trans	-56.7	131.9	-179.2	22.4	-31.9	0	0	0	109.5	C10	P8-C10 PolarHBondContact O-N 3.12Å
9	I	50.9	Low	45	Very low	142 Å²	142	143 Å²	143	73%	0.728	80%	0.796	S	S	*	*			trans	-64.4	99.2	178.6	-62.1	166.8	0	0	0	107.1	P7 V11	P7-I9 PolarHBondContact O-N 3.24Å; I9-V11 HydrophobicContact CG2-CG2 3.9Å; I9-V11 PolarHBondContact O-N 3.22Å
10	C	45.1	Very low	44.8	Very low	111 Å²	111	144.6 Å²	144.6	75%	0.75	80%	0.797	S	S	*	*			trans	-68.3	87.5	167.5	-73.3	0	0	0	0	108.2	P8 T12	P8-C10 PolarHBondContact O-N 3.12Å; C10-T12 VanDerWaalsContact C-N 3.26Å; C10-T12 PolarHBondContact O-N 2.94Å
11	V	48.3	Very low	44.7	Very low	124 Å²	124	149 Å²	149	75%	0.752	80%	0.802	S	S	*	*			trans	-63.4	95	166.9	-175.1	0	0	0	0	106.5	I9 A13	I9-V11 HydrophobicContact CG2-CG2 3.9Å; I9-V11 PolarHBondContact O-N 3.22Å; V11-A13 VanDerWaalsContact C-N 3.3Å; V11-A13 PolarHBondContact O-N 3.47Å
12	T	44.4	Very low	45	Very low	132 Å²	132	144 Å²	144	81%	0.81	79%	0.789	S	S	*	*			trans	-74	93	172.3	7.6	0	0	0	0	106.3	C10	C10-T12 VanDerWaalsContact C-N 3.26Å; C10-T12 PolarHBondContact O-N 2.94Å
13	A	50.9	Low	45.2	Very low	77 Å²	77	144.9 Å²	144.9	64%	0.636	78%	0.784	S	S	*	*			trans	-54.6	132.5	172.5	0	0	0	0	0	108.9	V11 K15	V11-A13 VanDerWaalsContact C-N 3.3Å; V11-A13 PolarHBondContact O-N 3.47Å; A13-K15 PolarHBondContact O-N 2.95Å
14	P	41.7	Very low	45.2	Very low	126 Å²	126	143 Å²	143	82%	0.818	78%	0.783	S	S	*	*			trans	-58.2	123.3	-172.1	16.9	-27.8	0	0	0	111.2	N16	P14-N16 VanDerWaalsContact C-N 3.29Å; P14-N16 PolarHBondContact O-N 3.25Å
15	K	45.2	Very low	45.5	Very low	202 Å²	202	140.4 Å²	140.4	88%	0.878	78%	0.778	S	S	*	*	S	Bend	trans	-62.5	86.7	172.2	-77.1	179	174.5	174.1	0	109.5	A13	A13-K15 PolarHBondContact O-N 2.95Å
16	N	35.6	Very low	45.6	Very low	156 Å²	156	141.5 Å²	141.5	83%	0.834	77%	0.774	S	S	*	*			trans	-163.8	73.7	159.2	-92.5	-26	0	0	0	109.4	P14	P14-N16 VanDerWaalsContact C-N 3.29Å; P14-N16 PolarHBondContact O-N 3.25Å
17	L	42.4	Very low	46.2	Very low	171 Å²	171	138 Å²	138	90%	0.895	77%	0.769	S	S	*	*	S	Bend	trans	-157.5	130.8	149.1	-96.5	162.4	0	0	0	107.3
18	P	37.8	Very low	46.2	Very low	118 Å²	118	139.6 Å²	139.6	77%	0.766	77%	0.772	S	S	*	*			trans	-80.3	130.3	-171.6	30.7	-31.1	0	0	0	112.2
19	S	39.3	Very low	46.6	Very low	96 Å²	96	138.8 Å²	138.8	67%	0.671	77%	0.765	S	S	*	*			trans	65.2	117.4	147.5	-159	0	0	0	0	120.1
20	E	41.3	Very low	46.7	Very low	175 Å²	175	139 Å²	139	82%	0.818	77%	0.768	S	S	*	*			trans	74.1	94.8	143	-70.6	177.7	180	0	0	120.1
21	R	41.2	Very low	47.4	Very low	237 Å²	237	141.1 Å²	141.1	89%	0.894	77%	0.771	S	S	*	*				-164.6	102	117.3	-99.9	169.6	-164.6	-149.3	3.6	109.1	V23	R21-V23 PolarHBondContact O-N 2.94Å
22	S	45.4	Very low	48	Very low	118 Å²	118	142.2 Å²	142.2	83%	0.825	77%	0.773	S	S	*	*			trans	-65.6	108.9	165.5	49.8	0	0	0	0	108.6
23	V	48.3	Very low	48.6	Very low	116 Å²	116	144.7 Å²	144.7	70%	0.703	78%	0.776	S	S	*	*			trans	-98.2	103.2	163.8	-177	0	0	0	0	105.6	R21 V25	R21-V23 PolarHBondContact O-N 2.94Å; V23-V25 HydrophobicContact CG1-CG2 3.91Å; V23-V25 PolarHBondContact O-N 3.03Å
24	Q	46	Very low	48.8	Very low	173 Å²	173	149.5 Å²	149.5	81%	0.808	79%	0.785	S	S	*	*			trans	-70.1	104.1	165.2	-72	179.2	-22.9	0	0	106.2
25	V	57.2	Low	49.7	Very low	118 Å²	118	152.3 Å²	152.3	72%	0.715	79%	0.787	S	S	*	*			trans	-87.9	105	167.3	-178.6	0	0	0	0	105.2	V23 D27	V23-V25 HydrophobicContact CG1-CG2 3.91Å; V23-V25 PolarHBondContact O-N 3.03Å; V25-D27 PolarHBondContact O-N 3.49Å
26	E	49.8	Very low	50.6	Low	153 Å²	153	149.7 Å²	149.7	72%	0.715	78%	0.778	S	S	*	*			trans	-68.7	107.5	166.5	-66.6	-95.8	136.7	0	0	106.6	N28	E26-N28 PolarHBondContact O-N 2.92Å; E26-N28 VanDerWaalsContact O-N 3.11Å
27	D	59.9	Low	51.6	Low	132 Å²	132	151 Å²	151	71%	0.706	78%	0.779	S	S	*	*			trans	-81.3	83.1	-179.2	-158.9	21.4	0	0	0	108.6	V25 V29	V25-D27 PolarHBondContact O-N 3.49Å; D27-V29 VanDerWaalsContact C-N 3.33Å; D27-V29 PolarHBondContact O-N 3.22Å; D27-V29 VanDerWaalsContact OD1-CG2 3.25Å; D27-V29 WeakPolarHBondContact OD1-CG2 3.5Å
28	N	49.1	Very low	52.8	Low	140 Å²	140	152 Å²	152	75%	0.749	78%	0.776	S	S	*	*			trans	-87.9	78.3	168.7	-68.3	-41	0	0	0	107.9	E26	E26-N28 PolarHBondContact O-N 2.92Å; E26-N28 VanDerWaalsContact O-N 3.11Å
29	V	58.6	Low	53.9	Low	97 Å²	97	151.7 Å²	151.7	59%	0.588	77%	0.773	S	S	*	*			trans	-101.9	106.2	165	-175.8	0	0	0	0	105.8	D27 D31	D27-V29 VanDerWaalsContact C-N 3.33Å; D27-V29 PolarHBondContact O-N 3.22Å; D27-V29 VanDerWaalsContact OD1-CG2 3.25Å; D27-V29 WeakPolarHBondContact OD1-CG2 3.5Å; V29-D31 PolarHBondContact O-N 2.89Å; V29-D31 VanDerWaalsContact O-N 3.15Å
30	D	54.3	Low	55.5	Low	148 Å²	148	156 Å²	156	79%	0.791	78%	0.782	S	S	*	*			trans	-61.1	111.5	172.8	-78.2	-43.6	0	0	0	108.5	D32	D30-D32 PolarHBondContact O-N 3.4Å; D30-D32 VanDerWaalsContact O-N 3.11Å
31	D	59.8	Low	56.6	Low	154 Å²	154	156.5 Å²	156.5	82%	0.824	78%	0.782	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.4	11.5	-178.4	-91.7	-24.8	0	0	0	113.8	V29	V29-D31 PolarHBondContact O-N 2.89Å; V29-D31 VanDerWaalsContact O-N 3.15Å
32	D	59.2	Low	57.9	Low	147 Å²	147	152.4 Å²	152.4	79%	0.786	78%	0.778	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	6.5	-162.6	-77.9	-18.7	0	0	0	116.5	D30	D30-D32 PolarHBondContact O-N 3.4Å; D30-D32 VanDerWaalsContact O-N 3.11Å
33	E	58	Low	58.8	Low	185 Å²	185	152.5 Å²	152.5	86%	0.864	77%	0.773	S	S	*	*	S	Bend	trans	-126.3	18.7	-170.6	-76.7	-165.1	173.1	0	0	119.1
34	Q	55.3	Low	59.5	Low	177 Å²	177	152.7 Å²	152.7	83%	0.827	77%	0.774	S	S	*	*			trans	-124	64.2	167.8	-59.5	-149	49.3	0	0	113.2	E36	Q34-E36 VanDerWaalsContact C-N 3.32Å; Q34-E36 PolarHBondContact O-N 3.21Å
35	E	59.1	Low	60.2	Low	186 Å²	186	150.8 Å²	150.8	87%	0.869	77%	0.77	S	S	*	*			trans	-67.1	96.3	152.7	-69	-163.9	173.6	0	0	108.3	Q37	E35-Q37 PolarHBondContact O-N 3.06Å
36	E	65	Low	60.5	Low	146 Å²	146	153.6 Å²	153.6	68%	0.682	78%	0.775	S	S	*	*			trans	-60.6	104.9	172.8	-70.1	-177.2	172.9	0	0	109.5	Q34 F38	Q34-E36 VanDerWaalsContact C-N 3.32Å; Q34-E36 PolarHBondContact O-N 3.21Å; E36-F38 WeakPolarHBondContact O-CD2 3.46Å; E36-F38 PolarHBondContact O-N 3.21Å
37	Q	56	Low	60.8	Low	185 Å²	185	153.3 Å²	153.3	86%	0.864	78%	0.778	S	S	*	*			trans	-61.8	100.9	169.9	-79.6	172.4	46.7	0	0	109.5	E35 T39	E35-Q37 PolarHBondContact O-N 3.06Å; Q37-T39 PolarHBondContact O-N 3.1Å
38	F	67.6	Low	60.4	Low	191 Å²	191	155.9 Å²	155.9	84%	0.838	79%	0.786	S	S	*	*			trans	-65	113.8	163.9	-67.8	-84	0	0	0	108.4	E36 E40	E36-F38 WeakPolarHBondContact O-CD2 3.46Å; E36-F38 PolarHBondContact O-N 3.21Å; F38-E40 PolarHBondContact O-N 3.18Å
39	T	62.2	Low	60.8	Low	112 Å²	112	155 Å²	155	69%	0.687	79%	0.786	S	S	*	*			trans	-74.9	114	168.7	-54.8	0	0	0	0	107.3	Q37 F41	Q37-T39 PolarHBondContact O-N 3.1Å; T39-F41 WeakPolarHBondContact O-CD2 3.14Å; T39-F41 PolarHBondContact O-N 2.88Å
40	E	72.6	Confident	60.4	Low	186 Å²	186	158.3 Å²	158.3	87%	0.869	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-61.1	116.3	172.5	-174.2	170.7	-155.8	0	0	108.7	F38	F38-E40 PolarHBondContact O-N 3.18Å
41	F	64.7	Low	60.1	Low	186 Å²	186	159.7 Å²	159.7	82%	0.816	80%	0.796	S	S	*	*	P	Polyproline II helix	trans	-79.7	118.9	171.9	-75.4	-92	0	0	0	107.9	T39 V43	T39-F41 WeakPolarHBondContact O-CD2 3.14Å; T39-F41 PolarHBondContact O-N 2.88Å; F41-V43 PolarHBondContact O-N 2.77Å
42	D	67	Low	59.6	Low	150 Å²	150	159.3 Å²	159.3	80%	0.802	79%	0.794	S	S	*	*	P	Polyproline II helix	trans	-63.9	121.8	172.1	-157.1	9.5	0	0	0	108.1	V44	D42-V44 VanDerWaalsContact C-N 3.33Å; D42-V44 PolarHBondContact O-N 2.96Å
43	V	65.6	Low	59	Low	121 Å²	121	156.5 Å²	156.5	73%	0.733	79%	0.786	S	S	*	*			trans	-71.1	95.2	178	-177.3	0	0	0	0	106.1	F41 D45	F41-V43 PolarHBondContact O-N 2.77Å; V43-D45 PolarHBondContact O-N 3.17Å; V43-D45 VanDerWaalsContact O-N 3.15Å
44	V	61.9	Low	58.7	Low	119 Å²	119	151 Å²	151	72%	0.721	77%	0.772	S	S	*	*			trans	-67.4	112.3	166.4	178.4	0	0	0	0	105.7	D42 E46	D42-V44 VanDerWaalsContact C-N 3.33Å; D42-V44 PolarHBondContact O-N 2.96Å; V44-E46 PolarHBondContact O-N 2.84Å
45	D	60.7	Low	58.5	Low	134 Å²	134	146.8 Å²	146.8	72%	0.717	77%	0.768	S	S	*	*			trans	-53	110.9	170.5	-75.4	-36.6	0	0	0	107.6	V43 D47	V43-D45 PolarHBondContact O-N 3.17Å; V43-D45 VanDerWaalsContact O-N 3.15Å; D45-D47 VanDerWaalsContact C-N 3.26Å; D45-D47 PolarHBondContact O-N 2.98Å
46	E	63.4	Low	58.1	Low	176 Å²	176	140.7 Å²	140.7	82%	0.822	75%	0.749	S	S	*	*			trans	-68.9	91.6	173.7	-70.1	-175	159.3	0	0	107.2	V44 E48	V44-E46 PolarHBondContact O-N 2.84Å; E46-E48 PolarHBondContact O-N 3.22Å; E46-E48 VanDerWaalsContact O-N 3.16Å
47	D	56.8	Low	57.4	Low	147 Å²	147	137.6 Å²	137.6	79%	0.786	74%	0.74	S	S	*	*			trans	-45.8	121.1	165	-76.5	-39	0	0	0	108.8	D45 V49	D45-D47 VanDerWaalsContact C-N 3.26Å; D45-D47 PolarHBondContact O-N 2.98Å; D47-V49 PolarHBondContact O-N 2.65Å
48	E	51.7	Low	57.1	Low	186 Å²	186	131.2 Å²	131.2	87%	0.869	72%	0.719	S	S	*	*			trans	-17.1	86.1	175.3	-66	179.2	160.8	0	0	114.5	E46 E50	E46-E48 PolarHBondContact O-N 3.22Å; E46-E48 VanDerWaalsContact O-N 3.16Å; E48-E50 PolarHBondContact O-N 2.93Å; E48-E50 VanDerWaalsContact O-N 3.16Å
49	V	57.4	Low	56.1	Low	123 Å²	123	125.4 Å²	125.4	75%	0.745	70%	0.697	S	S	*	*			trans	-79.3	97	161	-82	0	0	0	0	107.2	D47 E51	D47-V49 PolarHBondContact O-N 2.65Å; V49-E51 PolarHBondContact O-N 3.28Å
50	E	49.7	Very low	55.6	Low	165 Å²	165	123.8 Å²	123.8	77%	0.771	69%	0.687	S	S	*	*			trans	-35.6	120.6	169.3	-67.5	-107.2	165.6	0	0	110.4	E48 D52	E48-E50 PolarHBondContact O-N 2.93Å; E48-E50 VanDerWaalsContact O-N 3.16Å; E50-D52 PolarHBondContact O-N 3.47Å
51	E	48.9	Very low	54.6	Low	178 Å²	178	119.6 Å²	119.6	83%	0.832	67%	0.669	S	S	*	*			trans	-71.3	46.6	-172	-157.9	-172.7	-173.7	0	0	112.5	V49	V49-E51 PolarHBondContact O-N 3.28Å
52	D	48.1	Very low	53.9	Low	146 Å²	146	117 Å²	117	78%	0.781	66%	0.661	S	S	*	*			trans	-106	65.9	-176.2	-107.8	5.4	0	0	0	110.4	E50	E50-D52 PolarHBondContact O-N 3.47Å
53	S	46.5	Very low	53.1	Low	87 Å²	87	118.6 Å²	118.6	61%	0.608	66%	0.656	S	S	*	*	S	Bend	trans	173.4	7.3	149.5	-90	0	0	0	0	118.1	A55 A56	S53-A55 PolarHBondContact O-N 2.8Å; S53-A55 VanDerWaalsContact O-N 3.08Å; S53-A56 PolarHBondContact O-N 2.84Å
54	A	51.6	Low	52.3	Low	70 Å²	70	119.1 Å²	119.1	58%	0.579	66%	0.655	S	S	*	*	H	α-helix	trans	-60.3	-25.1	-178.5	0	0	0	0	0	114.2	A56	A54-A56 PolarHBondContact O-N 3.21Å
55	A	51.2	Low	51.6	Low	88 Å²	88	119.6 Å²	119.6	73%	0.727	65%	0.653	S	S	*	*	H	α-helix	trans	-71.4	-26.3	177.1	0	0	0	0	0	113.7	S53	S53-A55 PolarHBondContact O-N 2.8Å; S53-A55 VanDerWaalsContact O-N 3.08Å
56	A	50.9	Low	50.5	Low	58 Å²	58	116.1 Å²	116.1	48%	0.479	65%	0.649	S	S	.	*	H	α-helix	trans	-76.7	-34.1	-177.8	0	0	0	0	0	112.2	S53 A54 V60	S53-A56 PolarHBondContact O-N 2.84Å; A54-A56 PolarHBondContact O-N 3.21Å; A56-V60 WeakPolarHBondContact O-CG2 3.5Å; A56-V60 PolarHBondContact O-N 3.07Å
57	T	50.8	Low	49.5	Very low	81 Å²	81	110.6 Å²	110.6	50%	0.497	64%	0.639	S	S	.	*	H	α-helix	trans	-72.6	-32.1	-179.7	2.9	0	0	0	0	112.5	D59 V60 I61	T57-D59 PolarHBondContact O-N 2.86Å; T57-V60 PolarHBondContact O-N 3.01Å; T57-I61 VanDerWaalsContact O-CG1 3.24Å; T57-I61 WeakPolarHBondContact O-CG1 3.48Å; T57-I61 PolarHBondContact O-N 3.22Å
58	A	49.4	Very low	49.2	Very low	51 Å²	51	110.4 Å²	110.4	42%	0.421	64%	0.643	S	S	.	*	H	α-helix	trans	-64.2	-39.2	176.8	0	0	0	0	0	112.6	I61 M62	A58-I61 PolarHBondContact O-N 3Å; A58-M62 WeakPolarHBondContact O-CG 3.41Å; A58-M62 PolarHBondContact O-N 2.84Å
59	D	47.1	Very low	49.2	Very low	70 Å²	70	111 Å²	111	37%	0.374	65%	0.646	S	S	.	*	H	α-helix	trans	-70.1	-33.1	176.2	-163.8	50.4	0	0	0	112	T57 R63	T57-D59 PolarHBondContact O-N 2.86Å; D59-R63 WeakPolarHBondContact O-CB 3.45Å; D59-R63 PolarHBondContact O-N 3.41Å; D59-R63 IonicContact OD2-CZ 3.31Å; D59-R63 VanDerWaalsContact OD2-CZ 3.31Å; D59-R63 IonicContact OD2-NH1 2.72Å; D59-R63 PolarHBondContact OD2-NH1 3.04Å; D59-R63 IonicContact OD2-NH2 3.7Å
60	V	51.9	Low	49	Very low	77 Å²	77	106.9 Å²	106.9	47%	0.467	63%	0.628	S	S	.	*	H	α-helix	trans	-71.1	-40	175.2	176.1	0	0	0	0	111.6	A56 T57 R63 N64	A56-V60 WeakPolarHBondContact O-CG2 3.5Å; A56-V60 PolarHBondContact O-N 3.07Å; T57-V60 PolarHBondContact O-N 3.01Å; V60-R63 PolarHBondContact O-N 2.87Å; V60-N64 WeakPolarHBondContact O-CB 3.28Å; V60-N64 PolarHBondContact O-N 3.14Å
61	I	50.6	Low	49.3	Very low	98 Å²	98	104 Å²	104	50%	0.503	62%	0.618	S	S	.	*	H	α-helix	trans	-67.5	-38.4	177.5	-66.1	164.4	0	0	0	110.3	T57 A58 N64 N65	T57-I61 VanDerWaalsContact O-CG1 3.24Å; T57-I61 WeakPolarHBondContact O-CG1 3.48Å; T57-I61 PolarHBondContact O-N 3.22Å; A58-I61 PolarHBondContact O-N 3Å; I61-N64 PolarHBondContact O-N 2.81Å; I61-N65 WeakPolarHBondContact O-CB 3.23Å; I61-N65 PolarHBondContact O-N 2.86Å
62	M	50.4	Low	49.6	Very low	133 Å²	133	102.1 Å²	102.1	66%	0.655	61%	0.608	S	S	*	*	H	α-helix	trans	-70.4	-32.3	175.2	-70	-168.9	-65.5	0	0	113.2	A58	A58-M62 WeakPolarHBondContact O-CG 3.41Å; A58-M62 PolarHBondContact O-N 2.84Å
63	R	50	Low	50.2	Low	183 Å²	183	100.8 Å²	100.8	69%	0.691	60%	0.6	S	S	*	*	H	α-helix	trans	-74.4	-33.7	172.7	-81.7	-176.6	175.6	129	8.4	113.5	D59 V60 G66	D59-R63 WeakPolarHBondContact O-CB 3.45Å; D59-R63 PolarHBondContact O-N 3.41Å; D59-R63 IonicContact OD2-CZ 3.31Å; D59-R63 VanDerWaalsContact OD2-CZ 3.31Å; D59-R63 IonicContact OD2-NH1 2.72Å; D59-R63 PolarHBondContact OD2-NH1 3.04Å; D59-R63 IonicContact OD2-NH2 3.7Å; V60-R63 PolarHBondContact O-N 2.87Å; R63-G66 PolarHBondContact O-N 3.42Å
64	N	49.2	Very low	51	Low	132 Å²	132	100.6 Å²	100.6	71%	0.706	59%	0.59	S	S	*	*	H	α-helix	trans	-81.7	-19.7	176.4	-85.3	-22.5	0	0	0	113.7	V60 I61 G66	V60-N64 WeakPolarHBondContact O-CB 3.28Å; V60-N64 PolarHBondContact O-N 3.14Å; I61-N64 PolarHBondContact O-N 2.81Å; N64-G66 PolarHBondContact O-N 3.43Å
65	N	46.7	Very low	51.3	Low	129 Å²	129	104 Å²	104	69%	0.69	59%	0.594	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.2	8.2	165.4	-77.3	6.8	0	0	0	112.6	I61 G67	I61-N65 WeakPolarHBondContact O-CB 3.23Å; I61-N65 PolarHBondContact O-N 2.86Å; N65-G67 VanDerWaalsContact C-N 3.28Å; N65-G67 PolarHBondContact O-N 2.89Å
66	G	38.9	Very low	51.7	Low	60 Å²	60	102.5 Å²	102.5	62%	0.619	57%	0.573	S	S	*	*	S	Bend	trans	-62.4	87.8	166.8	0	0	0	0	0	111.3	R63 N64	R63-G66 PolarHBondContact O-N 3.42Å; N64-G66 PolarHBondContact O-N 3.43Å
67	G	42.5	Very low	52.1	Low	60 Å²	60	107.4 Å²	107.4	62%	0.619	58%	0.579	S	S	*	*			trans	70.2	69.8	153.1	0	0	0	0	0	115.1	N65 E69	N65-G67 VanDerWaalsContact C-N 3.28Å; N65-G67 PolarHBondContact O-N 2.89Å; G67-E69 PolarHBondContact O-N 2.96Å
68	V	49.4	Very low	52.5	Low	144 Å²	144	109 Å²	109	87%	0.873	58%	0.581	S	S	*	*			trans	-72.9	76.3	133.8	-179.2	0	0	0	0	105.5	G70	V68-G70 PolarHBondContact O-N 2.79Å
69	E	52.9	Low	52.8	Low	197 Å²	197	109.9 Å²	109.9	92%	0.921	58%	0.578	S	S	*	*			trans	-73.3	47.1	151.8	-156.4	174.9	-158.3	0	0	106.7	G67	G67-E69 PolarHBondContact O-N 2.96Å
70	G	51.8	Low	53.2	Low	37 Å²	37	109.1 Å²	109.1	38%	0.381	57%	0.574	S	S	.	*			trans	-75.6	131.8	162.6	0	0	0	0	0	104.5	V68 F72	V68-G70 PolarHBondContact O-N 2.79Å; G70-F72 PolarHBondContact O-N 3.11Å
71	D	55.8	Low	53.6	Low	106 Å²	106	111.7 Å²	111.7	57%	0.567	59%	0.585	S	S	*	*			trans	-60.7	75.5	178.2	-160.8	-5.8	0	0	0	109.4	D73 E74 E75	D71-D73 PolarHBondContact O-N 3.28Å; D71-E74 HydrophobicContact CB-CB 3.9Å; D71-E74 VanDerWaalsContact CG-CB 3.46Å; D71-E74 WeakPolarHBondContact O-CA 3.43Å; D71-E74 WeakPolarHBondContact O-CB 3.5Å; D71-E74 PolarHBondContact O-N 3.31Å; D71-E74 PolarHBondContact OD1-N 3.3Å; D71-E75 PolarHBondContact O-N 2.77Å
72	F	56.4	Low	54	Low	138 Å²	138	113.1 Å²	113.1	61%	0.605	59%	0.593	S	S	*	*	H	α-helix	trans	-61.5	-28.3	-176.6	-171.8	-111	0	0	0	109.8	G70 I76	G70-F72 PolarHBondContact O-N 3.11Å; F72-I76 HydrophobicContact CD1-CD1 3.4Å; F72-I76 VanDerWaalsContact CD1-CD1 3.4Å; F72-I76 HydrophobicContact CD1-CG1 4.29Å; F72-I76 HydrophobicContact CE1-CD1 3.18Å; F72-I76 HydrophobicContact CE1-CG1 4.15Å; F72-I76 HydrophobicContact CE2-CD1 4.46Å; F72-I76 HydrophobicContact CG-CD1 4.17Å; F72-I76 HydrophobicContact CZ-CD1 3.76Å; F72-I76 HydrophobicContact CZ-CG1 4.33Å; F72-I76 VanDerWaalsContact O-CB 3.29Å; F72-I76 WeakPolarHBondContact O-CB 3.29Å; F72-I76 WeakPolarHBondContact O-CG1 3.44Å; F72-I76 PolarHBondContact O-N 3.45Å
73	D	60.8	Low	54.1	Low	117 Å²	117	113.5 Å²	113.5	63%	0.626	59%	0.588	S	S	*	*	H	α-helix	trans	-64.8	-42	172.1	-72.7	-6	0	0	0	111.4	D71 R77	D71-D73 PolarHBondContact O-N 3.28Å; D73-R77 WeakPolarHBondContact O-CB 3.24Å; D73-R77 VanDerWaalsContact O-CG 3.23Å; D73-R77 WeakPolarHBondContact O-CG 3.23Å; D73-R77 PolarHBondContact O-N 3.5Å
74	E	62.6	Low	54.2	Low	84 Å²	84	107.9 Å²	107.9	39%	0.393	59%	0.587	S	S	.	*	H	α-helix	trans	-70.6	-41.9	176.9	-176	59.8	-153.9	0	0	112.3	D71 I76 R77 Q78	D71-E74 HydrophobicContact CB-CB 3.9Å; D71-E74 VanDerWaalsContact CG-CB 3.46Å; D71-E74 WeakPolarHBondContact O-CA 3.43Å; D71-E74 WeakPolarHBondContact O-CB 3.5Å; D71-E74 PolarHBondContact O-N 3.31Å; D71-E74 PolarHBondContact OD1-N 3.3Å; E74-I76 PolarHBondContact O-N 3.41Å; E74-R77 PolarHBondContact O-N 2.81Å; E74-Q78 WeakPolarHBondContact O-CG 3.42Å; E74-Q78 PolarHBondContact O-N 3.1Å; E74-Q78 PolarHBondContact OE1-NE2 2.98Å
75	E	58.5	Low	54.2	Low	140 Å²	140	106 Å²	106	65%	0.654	57%	0.571	S	S	*	*	H	α-helix	trans	-63.4	-40.3	174.4	-80.5	-172.8	176.6	0	0	112	D71 L79	D71-E75 PolarHBondContact O-N 2.77Å; E75-L79 WeakPolarHBondContact O-CB 3.19Å; E75-L79 PolarHBondContact O-N 3.31Å
76	I	59	Low	54.8	Low	58 Å²	58	105.8 Å²	105.8	30%	0.297	57%	0.57	S	S	.	*	H	α-helix	trans	-64.7	-42.3	174	-73.9	171.8	0	0	0	110.8	F72 E74 L79 I80	F72-I76 HydrophobicContact CD1-CD1 3.4Å; F72-I76 VanDerWaalsContact CD1-CD1 3.4Å; F72-I76 HydrophobicContact CD1-CG1 4.29Å; F72-I76 HydrophobicContact CE1-CD1 3.18Å; F72-I76 HydrophobicContact CE1-CG1 4.15Å; F72-I76 HydrophobicContact CE2-CD1 4.46Å; F72-I76 HydrophobicContact CG-CD1 4.17Å; F72-I76 HydrophobicContact CZ-CD1 3.76Å; F72-I76 HydrophobicContact CZ-CG1 4.33Å; F72-I76 VanDerWaalsContact O-CB 3.29Å; F72-I76 WeakPolarHBondContact O-CB 3.29Å; F72-I76 WeakPolarHBondContact O-CG1 3.44Å; F72-I76 PolarHBondContact O-N 3.45Å; E74-I76 PolarHBondContact O-N 3.41Å; I76-L79 WeakPolarHBondContact O-CB 3.32Å; I76-L79 PolarHBondContact O-N 2.86Å; I76-I80 HydrophobicContact CG2-CD1 3.65Å; I76-I80 HydrophobicContact CG2-CG1 4.24Å; I76-I80 VanDerWaalsContact O-CG1 3.28Å; I76-I80 WeakPolarHBondContact O-CG1 3.43Å; I76-I80 PolarHBondContact O-N 3.34Å
77	R	59.6	Low	55.7	Low	161 Å²	161	106.5 Å²	106.5	61%	0.608	57%	0.565	S	S	*	*	H	α-helix	trans	-63.5	-42.9	178.9	-78.3	179.7	76.5	133.5	5.9	112.1	D73 E74 L79 I80 D81	D73-R77 WeakPolarHBondContact O-CB 3.24Å; D73-R77 VanDerWaalsContact O-CG 3.23Å; D73-R77 WeakPolarHBondContact O-CG 3.23Å; D73-R77 PolarHBondContact O-N 3.5Å; E74-R77 PolarHBondContact O-N 2.81Å; R77-L79 VanDerWaalsContact C-N 3.28Å; R77-L79 PolarHBondContact O-N 3.45Å; R77-I80 PolarHBondContact O-N 3.15Å; R77-D81 WeakPolarHBondContact O-CB 3.3Å; R77-D81 PolarHBondContact O-N 3.01Å
78	Q	58.6	Low	56.4	Low	115 Å²	115	106.5 Å²	106.5	54%	0.537	56%	0.556	S	S	.	*	H	α-helix	trans	-62.7	-36.3	174.7	-71.6	-179.8	24	0	0	112	E74 N82	E74-Q78 WeakPolarHBondContact O-CG 3.42Å; E74-Q78 PolarHBondContact O-N 3.1Å; E74-Q78 PolarHBondContact OE1-NE2 2.98Å; Q78-N82 WeakPolarHBondContact O-CB 3.48Å; Q78-N82 PolarHBondContact O-N 2.76Å
79	L	56.3	Low	57	Low	69 Å²	69	104.4 Å²	104.4	36%	0.361	54%	0.536	S	S	.	.	H	α-helix	trans	-66.2	-42.6	174.2	-171.3	74.1	0	0	0	112.1	E75 I76 R77 Y83 L90	E75-L79 WeakPolarHBondContact O-CB 3.19Å; E75-L79 PolarHBondContact O-N 3.31Å; I76-L79 WeakPolarHBondContact O-CB 3.32Å; I76-L79 PolarHBondContact O-N 2.86Å; R77-L79 VanDerWaalsContact C-N 3.28Å; R77-L79 PolarHBondContact O-N 3.45Å; L79-Y83 HydrophobicContact CD1-CD2 3.57Å; L79-Y83 HydrophobicContact CD1-CE2 3.64Å; L79-Y83 HydrophobicContact CG-CD2 4.32Å; L79-Y83 PolarHBondContact O-N 3.07Å; L79-L90 HydrophobicContact CD2-CD2 3.78Å
80	I	54.8	Low	57.2	Low	54 Å²	54	96.2 Å²	96.2	28%	0.277	50%	0.498	S	S	.	.	H	α-helix	trans	-59.9	-50.1	175.9	-69.2	162.3	0	0	0	110.2	I76 R77 G84 L90	I76-I80 HydrophobicContact CG2-CD1 3.65Å; I76-I80 HydrophobicContact CG2-CG1 4.24Å; I76-I80 VanDerWaalsContact O-CG1 3.28Å; I76-I80 WeakPolarHBondContact O-CG1 3.43Å; I76-I80 PolarHBondContact O-N 3.34Å; R77-I80 PolarHBondContact O-N 3.15Å; I80-G84 PolarHBondContact O-N 2.8Å; I80-G84 VanDerWaalsContact O-N 3.1Å; I80-L90 HydrophobicContact CB-CD1 4.33Å; I80-L90 HydrophobicContact CD1-CD1 4.2Å; I80-L90 HydrophobicContact CG1-CD1 3.24Å
81	D	60	Low	57.9	Low	130 Å²	130	99.2 Å²	99.2	70%	0.695	50%	0.504	S	S	*	.	H	α-helix	trans	-69.4	-38.2	-175	-74.7	-15.9	0	0	0	112.3	R77	R77-D81 WeakPolarHBondContact O-CB 3.3Å; R77-D81 PolarHBondContact O-N 3.01Å
82	N	59.1	Low	58.2	Low	128 Å²	128	102.5 Å²	102.5	68%	0.684	51%	0.509	S	S	*	.	H	α-helix	trans	-77.6	-34.3	-174.2	-164.5	16	0	0	0	113.1	Q78	Q78-N82 WeakPolarHBondContact O-CB 3.48Å; Q78-N82 PolarHBondContact O-N 2.76Å
83	Y	52.8	Low	58.6	Low	141 Å²	141	99.8 Å²	99.8	55%	0.553	50%	0.5	S	S	*	.	H	α-helix	trans	-104.8	-4.7	-175.4	-69.8	-85.9	0	0	0	114	L79 Y85	L79-Y83 HydrophobicContact CD1-CD2 3.57Å; L79-Y83 HydrophobicContact CD1-CE2 3.64Å; L79-Y83 HydrophobicContact CG-CD2 4.32Å; L79-Y83 PolarHBondContact O-N 3.07Å; Y83-Y85 AromaticContact CD1-CE2 4Å; Y83-Y85 HydrophobicContact CD1-CE2 4Å; Y83-Y85 HydrophobicContact CD2-CE2 4.14Å; Y83-Y85 HydrophobicContact CG-CD2 4.05Å; Y83-Y85 AromaticContact CG-CE2 3.5Å; Y83-Y85 HydrophobicContact CG-CE2 3.5Å; Y83-Y85 PolarHBondContact O-N 2.9Å; Y83-Y85 VanDerWaalsContact O-N 3.12Å
84	G	53.2	Low	58.7	Low	65 Å²	65	96.5 Å²	96.5	67%	0.67	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	58.2	25.9	-178.4	0	0	0	0	0	112.6	I80 D86	I80-G84 PolarHBondContact O-N 2.8Å; I80-G84 VanDerWaalsContact O-N 3.1Å; G84-D86 PolarHBondContact O-N 3.39Å
85	Y	48.8	Very low	58.8	Low	93 Å²	93	97.6 Å²	97.6	37%	0.365	50%	0.496	S	S	.	.			trans	-64.2	121.5	176	-73.4	-61.6	0	0	0	108	Y83 S87 F89 L90	Y83-Y85 AromaticContact CD1-CE2 4Å; Y83-Y85 HydrophobicContact CD1-CE2 4Å; Y83-Y85 HydrophobicContact CD2-CE2 4.14Å; Y83-Y85 HydrophobicContact CG-CD2 4.05Å; Y83-Y85 AromaticContact CG-CE2 3.5Å; Y83-Y85 HydrophobicContact CG-CE2 3.5Å; Y83-Y85 PolarHBondContact O-N 2.9Å; Y83-Y85 VanDerWaalsContact O-N 3.12Å; Y85-S87 PolarHBondContact O-N 2.83Å; Y85-F89 AromaticContact CD1-CD1 3.5Å; Y85-F89 HydrophobicContact CD1-CD1 3.5Å; Y85-F89 AromaticContact CD1-CE1 3.89Å; Y85-F89 HydrophobicContact CD1-CE1 3.89Å; Y85-F89 HydrophobicContact CD1-CG 4.24Å; Y85-F89 AromaticContact CE1-CD1 3.95Å; Y85-F89 HydrophobicContact CE1-CD1 3.95Å; Y85-F89 AromaticContact CE1-CE1 3.82Å; Y85-F89 HydrophobicContact CE1-CE1 3.82Å; Y85-F89 HydrophobicContact CG-CD1 4.03Å; Y85-L90 HydrophobicContact CD2-CD2 4.3Å
86	D	59.1	Low	58.9	Low	125 Å²	125	93.5 Å²	93.5	67%	0.668	48%	0.484	S	S	*	.			trans	-48.7	128.7	165.5	-101.9	-38.9	0	0	0	107.7	G84 S88 F89	G84-D86 PolarHBondContact O-N 3.39Å; D86-S88 PolarHBondContact O-N 2.75Å; D86-F89 WeakPolarHBondContact O-CB 3.3Å; D86-F89 PolarHBondContact O-N 3.36Å
87	S	58.3	Low	59	Low	74 Å²	74	94.4 Å²	94.4	52%	0.517	49%	0.491	S	S	.	.	H	α-helix	trans	-49.2	-27.2	179.8	53.1	0	0	0	0	112.8	Y85 I91	Y85-S87 PolarHBondContact O-N 2.83Å; S87-I91 WeakPolarHBondContact O-CD1 3.38Å; S87-I91 VanDerWaalsContact O-CG1 3.24Å; S87-I91 WeakPolarHBondContact O-CG1 3.15Å; S87-I91 PolarHBondContact O-N 3.48Å; S87-I91 VanDerWaalsContact O-N 3.07Å
88	S	56.5	Low	58.8	Low	61 Å²	61	91.8 Å²	91.8	43%	0.427	49%	0.49	S	S	.	.	H	α-helix	trans	-64.4	-34.8	173.4	71.7	0	0	0	0	114.8	D86 R92	D86-S88 PolarHBondContact O-N 2.75Å; S88-R92 WeakPolarHBondContact O-CB 3.44Å; S88-R92 VanDerWaalsContact O-CG 3.23Å; S88-R92 WeakPolarHBondContact O-CG 3.37Å; S88-R92 PolarHBondContact O-N 3.37Å
89	F	62.9	Low	58.8	Low	100 Å²	100	91.3 Å²	91.3	44%	0.439	49%	0.49	S	S	.	.	H	α-helix	trans	-68.4	-44.1	177.3	179.6	-99.5	0	0	0	111	Y85 D86 R92 L93	Y85-F89 AromaticContact CD1-CD1 3.5Å; Y85-F89 HydrophobicContact CD1-CD1 3.5Å; Y85-F89 AromaticContact CD1-CE1 3.89Å; Y85-F89 HydrophobicContact CD1-CE1 3.89Å; Y85-F89 HydrophobicContact CD1-CG 4.24Å; Y85-F89 AromaticContact CE1-CD1 3.95Å; Y85-F89 HydrophobicContact CE1-CD1 3.95Å; Y85-F89 AromaticContact CE1-CE1 3.82Å; Y85-F89 HydrophobicContact CE1-CE1 3.82Å; Y85-F89 HydrophobicContact CG-CD1 4.03Å; D86-F89 WeakPolarHBondContact O-CB 3.3Å; D86-F89 PolarHBondContact O-N 3.36Å; F89-R92 WeakPolarHBondContact O-CB 3.22Å; F89-R92 PolarHBondContact O-N 2.75Å; F89-L93 PolarHBondContact O-N 2.9Å
90	L	57.5	Low	58.5	Low	24 Å²	24	94.1 Å²	94.1	13%	0.126	50%	0.501	C	S	.	.	H	α-helix	trans	-69.8	-37.3	179	-67.6	171.2	0	0	0	112.2	L79 I80 Y85 R92 L93 A94	L79-L90 HydrophobicContact CD2-CD2 3.78Å; I80-L90 HydrophobicContact CB-CD1 4.33Å; I80-L90 HydrophobicContact CD1-CD1 4.2Å; I80-L90 HydrophobicContact CG1-CD1 3.24Å; Y85-L90 HydrophobicContact CD2-CD2 4.3Å; L90-R92 VanDerWaalsContact C-N 3.31Å; L90-R92 PolarHBondContact O-N 3.31Å; L90-L93 PolarHBondContact O-N 3.11Å; L90-A94 WeakPolarHBondContact O-CB 3.25Å; L90-A94 PolarHBondContact O-N 2.72Å
91	I	64.7	Low	58.5	Low	100 Å²	100	95.8 Å²	95.8	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-61.3	-42.2	170.9	-68.5	165.2	0	0	0	110.3	S87 A94 I95	S87-I91 WeakPolarHBondContact O-CD1 3.38Å; S87-I91 VanDerWaalsContact O-CG1 3.24Å; S87-I91 WeakPolarHBondContact O-CG1 3.15Å; S87-I91 PolarHBondContact O-N 3.48Å; S87-I91 VanDerWaalsContact O-N 3.07Å; I91-A94 PolarHBondContact O-N 3.4Å; I91-I95 HydrophobicContact CG2-CD1 3.75Å; I91-I95 HydrophobicContact CG2-CG1 4.43Å; I91-I95 WeakPolarHBondContact O-CB 3.49Å; I91-I95 VanDerWaalsContact O-CG1 3.22Å; I91-I95 WeakPolarHBondContact O-CG1 3.36Å; I91-I95 PolarHBondContact O-N 2.84Å
92	R	62.1	Low	58.3	Low	176 Å²	176	94 Å²	94	66%	0.664	51%	0.507	S	S	*	.	H	α-helix	trans	-63.4	-41.7	175.5	-77	173	-177.7	-125.3	2.3	112.2	S88 F89 L90 I95 S96	S88-R92 WeakPolarHBondContact O-CB 3.44Å; S88-R92 VanDerWaalsContact O-CG 3.23Å; S88-R92 WeakPolarHBondContact O-CG 3.37Å; S88-R92 PolarHBondContact O-N 3.37Å; F89-R92 WeakPolarHBondContact O-CB 3.22Å; F89-R92 PolarHBondContact O-N 2.75Å; L90-R92 VanDerWaalsContact C-N 3.31Å; L90-R92 PolarHBondContact O-N 3.31Å; R92-I95 PolarHBondContact O-N 2.74Å; R92-S96 WeakPolarHBondContact O-CB 3.45Å; R92-S96 PolarHBondContact O-N 2.9Å
93	L	66.4	Low	58	Low	80 Å²	80	90.3 Å²	90.3	42%	0.419	49%	0.489	S	S	.	.	H	α-helix	trans	-65.5	-44.2	176.2	-173.4	70.5	0	0	0	111.1	F89 L90 I95 S96 V97	F89-L93 PolarHBondContact O-N 2.9Å; L90-L93 PolarHBondContact O-N 3.11Å; L93-I95 VanDerWaalsContact C-N 3.32Å; L93-I95 PolarHBondContact O-N 3.28Å; L93-S96 PolarHBondContact O-N 3.36Å; L93-S96 VanDerWaalsContact O-N 3.14Å; L93-S96 PolarHBondContact O-OG 3.48Å; L93-S96 VanDerWaalsContact O-OG 3.04Å; L93-V97 HydrophobicContact CD1-CG2 4.48Å; L93-V97 HydrophobicContact CG-CG2 4.42Å; L93-V97 WeakPolarHBondContact O-CB 3.34Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.45Å; L93-V97 PolarHBondContact O-N 3.4Å
94	A	61.4	Low	58	Low	49 Å²	49	88.1 Å²	88.1	41%	0.405	49%	0.487	S	S	.	.	H	α-helix	trans	-62	-40.8	176.3	0	0	0	0	0	111.6	L90 I91 N98	L90-A94 WeakPolarHBondContact O-CB 3.25Å; L90-A94 PolarHBondContact O-N 2.72Å; I91-A94 PolarHBondContact O-N 3.4Å; A94-N98 VanDerWaalsContact O-CB 3.3Å; A94-N98 WeakPolarHBondContact O-CB 3.34Å; A94-N98 PolarHBondContact O-N 3.47Å; A94-N98 PolarHBondContact O-ND2 3.15Å
95	I	65.1	Low	57.9	Low	106 Å²	106	87 Å²	87	54%	0.544	48%	0.475	S	S	.	.	H	α-helix	trans	-67.1	-40.3	173.1	-67.3	167	0	0	0	110.5	I91 R92 L93 N98 L99	I91-I95 HydrophobicContact CG2-CD1 3.75Å; I91-I95 HydrophobicContact CG2-CG1 4.43Å; I91-I95 WeakPolarHBondContact O-CB 3.49Å; I91-I95 VanDerWaalsContact O-CG1 3.22Å; I91-I95 WeakPolarHBondContact O-CG1 3.36Å; I91-I95 PolarHBondContact O-N 2.84Å; R92-I95 PolarHBondContact O-N 2.74Å; L93-I95 VanDerWaalsContact C-N 3.32Å; L93-I95 PolarHBondContact O-N 3.28Å; I95-N98 PolarHBondContact O-N 2.88Å; I95-L99 WeakPolarHBondContact O-CB 3.24Å; I95-L99 PolarHBondContact O-N 3.43Å
96	S	60.2	Low	57.9	Low	55 Å²	55	85.6 Å²	85.6	39%	0.385	48%	0.476	S	S	.	.	H	α-helix	trans	-68.5	-39.2	-179.3	83.8	0	0	0	0	111.9	R92 L93 L99 H100	R92-S96 WeakPolarHBondContact O-CB 3.45Å; R92-S96 PolarHBondContact O-N 2.9Å; L93-S96 PolarHBondContact O-N 3.36Å; L93-S96 VanDerWaalsContact O-N 3.14Å; L93-S96 PolarHBondContact O-OG 3.48Å; L93-S96 VanDerWaalsContact O-OG 3.04Å; S96-L99 PolarHBondContact O-N 3.06Å; S96-H100 WeakPolarHBondContact O-CB 3.41Å; S96-H100 PolarHBondContact O-N 2.96Å
97	V	61.2	Low	57.1	Low	76 Å²	76	85.6 Å²	85.6	46%	0.461	47%	0.47	S	S	.	.	H	α-helix	trans	-69.3	-45.4	175.9	174.7	0	0	0	0	110.2	L93 L99 H100 V101	L93-V97 HydrophobicContact CD1-CG2 4.48Å; L93-V97 HydrophobicContact CG-CG2 4.42Å; L93-V97 WeakPolarHBondContact O-CB 3.34Å; L93-V97 VanDerWaalsContact O-CG2 3.3Å; L93-V97 WeakPolarHBondContact O-CG2 3.45Å; L93-V97 PolarHBondContact O-N 3.4Å; V97-L99 VanDerWaalsContact C-N 3.3Å; V97-L99 PolarHBondContact O-N 3.49Å; V97-H100 CarbonylContact O-C 3.58Å; V97-H100 WeakPolarHBondContact O-CB 3.4Å; V97-H100 PolarHBondContact O-N 3.22Å; V97-H100 VanDerWaalsContact O-N 3.1Å; V97-V101 HydrophobicContact CG1-CG2 4.44Å; V97-V101 WeakPolarHBondContact O-CG2 3.42Å; V97-V101 PolarHBondContact O-N 2.8Å
98	N	55.4	Low	56.3	Low	107 Å²	107	88.3 Å²	88.3	57%	0.572	48%	0.475	S	S	*	.	H	α-helix	trans	-61.2	-40.2	173.6	-82	-60.1	0	0	0	111.7	A94 I95 H100 V101 V102	A94-N98 VanDerWaalsContact O-CB 3.3Å; A94-N98 WeakPolarHBondContact O-CB 3.34Å; A94-N98 PolarHBondContact O-N 3.47Å; A94-N98 PolarHBondContact O-ND2 3.15Å; I95-N98 PolarHBondContact O-N 2.88Å; N98-H100 VanDerWaalsContact C-N 3.35Å; N98-V101 PolarHBondContact O-N 2.93Å; N98-V102 WeakPolarHBondContact O-CB 3.18Å; N98-V102 WeakPolarHBondContact O-CG2 3.09Å; N98-V102 PolarHBondContact O-N 3.5Å
99	L	59.3	Low	55.6	Low	105 Å²	105	88.9 Å²	88.9	55%	0.55	48%	0.478	S	S	.	.	H	α-helix	trans	-64.3	-40.7	173.2	-173.9	69.2	0	0	0	110.7	I95 S96 V97 V102 V103	I95-L99 WeakPolarHBondContact O-CB 3.24Å; I95-L99 PolarHBondContact O-N 3.43Å; S96-L99 PolarHBondContact O-N 3.06Å; V97-L99 VanDerWaalsContact C-N 3.3Å; V97-L99 PolarHBondContact O-N 3.49Å; L99-V102 PolarHBondContact O-N 2.84Å; L99-V103 HydrophobicContact CD1-CG2 4.26Å; L99-V103 HydrophobicContact CG-CG2 4.17Å; L99-V103 WeakPolarHBondContact O-CB 3.2Å; L99-V103 WeakPolarHBondContact O-CG2 3.39Å; L99-V103 PolarHBondContact O-N 3.32Å
100	H	49.4	Very low	54.3	Low	127 Å²	127	89.8 Å²	89.8	59%	0.588	48%	0.484	S	S	*	.	H	α-helix	trans	-63.4	-41.8	175.9	-126.9	66	0	0	0	111.6	S96 V97 N98 V103 L104	S96-H100 WeakPolarHBondContact O-CB 3.41Å; S96-H100 PolarHBondContact O-N 2.96Å; V97-H100 CarbonylContact O-C 3.58Å; V97-H100 WeakPolarHBondContact O-CB 3.4Å; V97-H100 PolarHBondContact O-N 3.22Å; V97-H100 VanDerWaalsContact O-N 3.1Å; N98-H100 VanDerWaalsContact C-N 3.35Å; H100-V103 PolarHBondContact O-N 3.47Å; H100-L104 VanDerWaalsContact O-CB 3.24Å; H100-L104 WeakPolarHBondContact O-CB 3.24Å; H100-L104 WeakPolarHBondContact O-CD1 3.31Å; H100-L104 WeakPolarHBondContact O-CG 3.26Å; H100-L104 PolarHBondContact O-N 3.06Å
101	V	56.2	Low	53.7	Low	90 Å²	90	92.8 Å²	92.8	55%	0.545	50%	0.499	S	S	.	.	H	α-helix	trans	-67.6	-41.2	176	173.7	0	0	0	0	111	V97 N98 G105	V97-V101 HydrophobicContact CG1-CG2 4.44Å; V97-V101 WeakPolarHBondContact O-CG2 3.42Å; V97-V101 PolarHBondContact O-N 2.8Å; N98-V101 PolarHBondContact O-N 2.93Å; V101-G105 WeakPolarHBondContact O-CA 3.41Å; V101-G105 PolarHBondContact O-N 3.48Å
102	V	54.7	Low	52.5	Low	91 Å²	91	94.2 Å²	94.2	55%	0.552	51%	0.507	S	S	*	.	H	α-helix	trans	-64.6	-41.9	174.3	170.3	0	0	0	0	110.6	N98 L99 G105 T106	N98-V102 WeakPolarHBondContact O-CB 3.18Å; N98-V102 WeakPolarHBondContact O-CG2 3.09Å; N98-V102 PolarHBondContact O-N 3.5Å; L99-V102 PolarHBondContact O-N 2.84Å; V102-G105 PolarHBondContact O-N 3Å; V102-T106 HydrophobicContact CG1-CG2 4.48Å; V102-T106 VanDerWaalsContact O-CG2 3.31Å; V102-T106 WeakPolarHBondContact O-CG2 3.42Å; V102-T106 PolarHBondContact O-N 2.93Å; V102-T106 PolarHBondContact O-OG1 3.18Å
103	V	53.6	Low	51.4	Low	52 Å²	52	94.2 Å²	94.2	32%	0.315	51%	0.512	S	S	.	.	H	α-helix	trans	-68.3	-46.8	178.6	169.5	0	0	0	0	110.5	L99 H100 G105 T106 F107	L99-V103 HydrophobicContact CD1-CG2 4.26Å; L99-V103 HydrophobicContact CG-CG2 4.17Å; L99-V103 WeakPolarHBondContact O-CB 3.2Å; L99-V103 WeakPolarHBondContact O-CG2 3.39Å; L99-V103 PolarHBondContact O-N 3.32Å; H100-V103 PolarHBondContact O-N 3.47Å; V103-G105 VanDerWaalsContact C-N 3.29Å; V103-G105 PolarHBondContact O-N 3.08Å; V103-T106 WeakPolarHBondContact CA-OG1 3.4Å; V103-T106 CarbonylContact O-C 3.6Å; V103-T106 PolarHBondContact O-N 2.74Å; V103-T106 PolarHBondContact O-OG1 3.11Å; V103-F107 HydrophobicContact CG1-CD2 3.42Å; V103-F107 VanDerWaalsContact CG1-CD2 3.42Å; V103-F107 HydrophobicContact CG1-CE2 3.41Å; V103-F107 VanDerWaalsContact CG1-CE2 3.41Å; V103-F107 WeakPolarHBondContact O-CB 3.39Å; V103-F107 WeakPolarHBondContact O-CD2 3.17Å; V103-F107 PolarHBondContact O-N 3.3Å
104	L	51.7	Low	50.3	Low	95 Å²	95	96.5 Å²	96.5	50%	0.497	52%	0.524	S	S	.	.	H	α-helix	trans	-61.9	-38	173.6	-82.9	153.2	0	0	0	111.7	H100 F107 H108	H100-L104 VanDerWaalsContact O-CB 3.24Å; H100-L104 WeakPolarHBondContact O-CB 3.24Å; H100-L104 WeakPolarHBondContact O-CD1 3.31Å; H100-L104 WeakPolarHBondContact O-CG 3.26Å; H100-L104 PolarHBondContact O-N 3.06Å; L104-F107 PolarHBondContact O-N 3.17Å; L104-H108 WeakPolarHBondContact O-CB 3.43Å; L104-H108 PolarHBondContact O-N 3.01Å
105	G	50.7	Low	49.5	Very low	41 Å²	41	102.4 Å²	102.4	42%	0.423	54%	0.541	S	S	.	.	H	α-helix	trans	-66.5	-38.6	174.3	0	0	0	0	0	112.9	V101 V102 V103 S109	V101-G105 WeakPolarHBondContact O-CA 3.41Å; V101-G105 PolarHBondContact O-N 3.48Å; V102-G105 PolarHBondContact O-N 3Å; V103-G105 VanDerWaalsContact C-N 3.29Å; V103-G105 PolarHBondContact O-N 3.08Å; G105-S109 VanDerWaalsContact O-CB 3.26Å; G105-S109 WeakPolarHBondContact O-CB 3.47Å; G105-S109 PolarHBondContact O-N 3.13Å
106	T	49	Very low	48.5	Very low	63 Å²	63	104.7 Å²	104.7	39%	0.387	57%	0.566	S	S	.	*	H	α-helix	trans	-76.3	-33.4	174	57.1	0	0	0	0	112.3	V102 V103 S109 Q110	V102-T106 HydrophobicContact CG1-CG2 4.48Å; V102-T106 VanDerWaalsContact O-CG2 3.31Å; V102-T106 WeakPolarHBondContact O-CG2 3.42Å; V102-T106 PolarHBondContact O-N 2.93Å; V102-T106 PolarHBondContact O-OG1 3.18Å; V103-T106 WeakPolarHBondContact CA-OG1 3.4Å; V103-T106 CarbonylContact O-C 3.6Å; V103-T106 PolarHBondContact O-N 2.74Å; V103-T106 PolarHBondContact O-OG1 3.11Å; T106-S109 CarbonylContact O-C 3.56Å; T106-S109 PolarHBondContact O-N 2.77Å; T106-Q110 VanDerWaalsContact O-CB 3.31Å; T106-Q110 WeakPolarHBondContact O-CB 3.45Å; T106-Q110 VanDerWaalsContact O-CG 3.3Å; T106-Q110 WeakPolarHBondContact O-CG 3.24Å; T106-Q110 PolarHBondContact O-N 2.85Å
107	F	42.1	Very low	47.9	Very low	125 Å²	125	107.2 Å²	107.2	55%	0.548	58%	0.575	S	S	.	*	H	α-helix	trans	-64.8	-44.9	171.5	-89	-75.3	0	0	0	110.4	V103 L104 S109 Q110 I111	V103-F107 HydrophobicContact CG1-CD2 3.42Å; V103-F107 VanDerWaalsContact CG1-CD2 3.42Å; V103-F107 HydrophobicContact CG1-CE2 3.41Å; V103-F107 VanDerWaalsContact CG1-CE2 3.41Å; V103-F107 WeakPolarHBondContact O-CB 3.39Å; V103-F107 WeakPolarHBondContact O-CD2 3.17Å; V103-F107 PolarHBondContact O-N 3.3Å; L104-F107 PolarHBondContact O-N 3.17Å; F107-S109 VanDerWaalsContact C-N 3.34Å; F107-S109 PolarHBondContact O-N 3.2Å; F107-Q110 PolarHBondContact O-N 3.3Å; F107-I111 WeakPolarHBondContact O-CB 3.16Å; F107-I111 WeakPolarHBondContact O-CD1 3.48Å; F107-I111 WeakPolarHBondContact O-CG1 3.32Å; F107-I111 PolarHBondContact O-N 3.04Å
108	H	42.2	Very low	47.2	Very low	132 Å²	132	108.8 Å²	108.8	61%	0.611	58%	0.581	S	S	*	*	H	α-helix	trans	-60.5	-43	170.8	-99.8	74.5	0	0	0	111.8	L104 Q110 I111 L112	L104-H108 WeakPolarHBondContact O-CB 3.43Å; L104-H108 PolarHBondContact O-N 3.01Å; H108-Q110 PolarHBondContact O-N 3.28Å; H108-I111 PolarHBondContact O-N 3.21Å; H108-L112 WeakPolarHBondContact O-CB 3.3Å; H108-L112 PolarHBondContact O-N 3.35Å
109	S	41.4	Very low	46.8	Very low	72 Å²	72	108.9 Å²	108.9	50%	0.503	58%	0.582	S	S	.	*	H	α-helix	trans	-69	-30.9	178.5	-172.7	0	0	0	0	113.3	G105 T106 F107 F113	G105-S109 VanDerWaalsContact O-CB 3.26Å; G105-S109 WeakPolarHBondContact O-CB 3.47Å; G105-S109 PolarHBondContact O-N 3.13Å; T106-S109 CarbonylContact O-C 3.56Å; T106-S109 PolarHBondContact O-N 2.77Å; F107-S109 VanDerWaalsContact C-N 3.34Å; F107-S109 PolarHBondContact O-N 3.2Å; S109-F113 WeakPolarHBondContact O-CB 3.31Å; S109-F113 PolarHBondContact O-N 3.19Å; S109-F113 VanDerWaalsContact O-N 3.11Å
110	Q	36.8	Very low	46	Very low	120 Å²	120	109.2 Å²	109.2	56%	0.561	58%	0.584	S	S	*	*	H	α-helix	trans	-80	-36	176.4	-76.5	-167.5	36.6	0	0	111.7	T106 F107 H108 L112 F113 I114	T106-Q110 VanDerWaalsContact O-CB 3.31Å; T106-Q110 WeakPolarHBondContact O-CB 3.45Å; T106-Q110 VanDerWaalsContact O-CG 3.3Å; T106-Q110 WeakPolarHBondContact O-CG 3.24Å; T106-Q110 PolarHBondContact O-N 2.85Å; F107-Q110 PolarHBondContact O-N 3.3Å; H108-Q110 PolarHBondContact O-N 3.28Å; Q110-L112 VanDerWaalsContact C-N 3.31Å; Q110-F113 PolarHBondContact O-N 2.98Å; Q110-I114 WeakPolarHBondContact O-CB 3.42Å; Q110-I114 VanDerWaalsContact O-CG1 3.24Å; Q110-I114 WeakPolarHBondContact O-CG1 3.44Å; Q110-I114 PolarHBondContact O-N 3.16Å
111	I	44.7	Very low	45.8	Very low	86 Å²	86	108.1 Å²	108.1	44%	0.441	58%	0.583	S	S	.	*	H	α-helix	trans	-57.4	-50.5	168.1	-71.4	165.6	0	0	0	108	F107 H108 F113 I114 F115	F107-I111 WeakPolarHBondContact O-CB 3.16Å; F107-I111 WeakPolarHBondContact O-CD1 3.48Å; F107-I111 WeakPolarHBondContact O-CG1 3.32Å; F107-I111 PolarHBondContact O-N 3.04Å; H108-I111 PolarHBondContact O-N 3.21Å; I111-F113 VanDerWaalsContact C-N 3.25Å; I111-F113 PolarHBondContact O-N 2.94Å; I111-I114 PolarHBondContact O-N 3.16Å; I111-I114 VanDerWaalsContact O-N 3.13Å; I111-F115 HydrophobicContact CG2-CD2 3.67Å; I111-F115 HydrophobicContact CG2-CE2 3.85Å; I111-F115 WeakPolarHBondContact O-CD2 3.16Å; I111-F115 PolarHBondContact O-N 2.87Å
112	L	39.5	Very low	45.1	Very low	130 Å²	130	109.3 Å²	109.3	68%	0.681	59%	0.586	S	S	*	*	H	α-helix	trans	-59.7	-32.6	177.3	-135.6	95.5	0	0	0	113.8	H108 Q110 S116	H108-L112 WeakPolarHBondContact O-CB 3.3Å; H108-L112 PolarHBondContact O-N 3.35Å; Q110-L112 VanDerWaalsContact C-N 3.31Å; L112-S116 WeakPolarHBondContact O-CB 3.49Å; L112-S116 PolarHBondContact O-N 3.15Å
113	F	38.1	Very low	44.5	Very low	176 Å²	176	110.6 Å²	110.6	77%	0.772	59%	0.588	S	S	*	*	H	α-helix	trans	-81.4	-22.5	179.6	-136.6	-84.7	0	0	0	113.8	S109 Q110 I111	S109-F113 WeakPolarHBondContact O-CB 3.31Å; S109-F113 PolarHBondContact O-N 3.19Å; S109-F113 VanDerWaalsContact O-N 3.11Å; Q110-F113 PolarHBondContact O-N 2.98Å; I111-F113 VanDerWaalsContact C-N 3.25Å; I111-F113 PolarHBondContact O-N 2.94Å
114	I	44.3	Very low	43.8	Very low	129 Å²	129	115.1 Å²	115.1	66%	0.662	61%	0.61	S	S	*	*	H	α-helix	trans	-83.5	-29.9	175.1	-67.7	165.7	0	0	0	110.4	Q110 I111	Q110-I114 WeakPolarHBondContact O-CB 3.42Å; Q110-I114 VanDerWaalsContact O-CG1 3.24Å; Q110-I114 WeakPolarHBondContact O-CG1 3.44Å; Q110-I114 PolarHBondContact O-N 3.16Å; I111-I114 PolarHBondContact O-N 3.16Å; I111-I114 VanDerWaalsContact O-N 3.13Å
115	F	44.5	Very low	43.1	Very low	172 Å²	172	116.8 Å²	116.8	75%	0.754	62%	0.619	S	S	*	*			trans	-94.8	0.4	-178.6	-71.9	-74.7	0	0	0	114.9	I111	I111-F115 HydrophobicContact CG2-CD2 3.67Å; I111-F115 HydrophobicContact CG2-CE2 3.85Å; I111-F115 WeakPolarHBondContact O-CD2 3.16Å; I111-F115 PolarHBondContact O-N 2.87Å
116	S	43.8	Very low	42.4	Very low	155 Å²	155	123.6 Å²	123.6	100%	1.084	64%	0.637	S	S	*	*			trans	-106.4	0	172.2	-176.2	0	0	0	0	112.4	L112	L112-S116 WeakPolarHBondContact O-CB 3.49Å; L112-S116 PolarHBondContact O-N 3.15Å

Retrieved 116 of 116 residues in 201.1 ms (Link to these results)

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