A0A077ZJK5_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZJK5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 148 aa.

Structure Viewer

Loading PAE data...

(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	22.8	Very low	26	Very low	229 Å²	229	141.5 Å²	141.5	100%	1.128	75%	0.752	S	S	*	*				0	103.3	0	-168.3	171.4	116.3	0	0	106.2
2	V	21.6	Very low	26.7	Very low	141 Å²	141	135.9 Å²	135.9	86%	0.855	75%	0.753	S	S	*	*			trans	-99.2	116.1	179.8	-179.1	0	0	0	0	107.1
3	T	19.4	Very low	27.4	Very low	114 Å²	114	135.5 Å²	135.5	70%	0.699	75%	0.749	S	S	*	*			trans	-90.7	112.5	-179.7	-26.7	0	0	0	0	108.1
4	V	27.4	Very low	27.9	Very low	82 Å²	82	137.5 Å²	137.5	50%	0.497	75%	0.746	S	S	.	*	P	Polyproline II helix	trans	-82	116.8	174	-178.4	0	0	0	0	107.7	Y6	V4-Y6 HydrophobicContact CG1-CE1 4.38Å; V4-Y6 WeakPolarHBondContact O-CD2 3.03Å; V4-Y6 VanDerWaalsContact O-CE2 3.3Å; V4-Y6 WeakPolarHBondContact O-CE2 3.3Å
5	Q	23.4	Very low	28.6	Very low	184 Å²	184	136.3 Å²	136.3	86%	0.86	74%	0.739	S	S	*	*	P	Polyproline II helix	trans	-90.6	134	173.2	-78.4	-155.3	-21.3	0	0	111
6	Y	28.3	Very low	29.4	Very low	174 Å²	174	134.6 Å²	134.6	68%	0.682	74%	0.737	S	S	*	*	P	Polyproline II helix	trans	-103.5	125.2	-176.5	-57.8	-90.7	0	0	0	109.9	V4	V4-Y6 HydrophobicContact CG1-CE1 4.38Å; V4-Y6 WeakPolarHBondContact O-CD2 3.03Å; V4-Y6 VanDerWaalsContact O-CE2 3.3Å; V4-Y6 WeakPolarHBondContact O-CE2 3.3Å
7	G	25.2	Very low	29.9	Very low	73 Å²	73	134.8 Å²	134.8	75%	0.753	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-102.6	138.6	172.1	0	0	0	0	0	111.9
8	R	26	Very low	30.1	Very low	208 Å²	208	134.7 Å²	134.7	79%	0.785	73%	0.73	S	S	*	*	P	Polyproline II helix	trans	-91.4	126.3	171.1	-170.5	-174.8	-75.4	170.7	-0.8	107.7
9	I	32.1	Very low	30.4	Very low	106 Å²	106	132.8 Å²	132.8	54%	0.544	72%	0.719	S	S	.	*			trans	-86.7	111	172.6	-58.7	166.3	0	0	0	106.9	L19	I9-L19 HydrophobicContact CG1-CD1 4.15Å
10	D	27.5	Very low	30.5	Very low	109 Å²	109	132.4 Å²	132.4	58%	0.583	72%	0.715	S	S	*	*			trans	-75.5	136.2	174	-75.3	-40.8	0	0	0	110.1	G12 D13	D10-G12 PolarHBondContact O-N 2.7Å; D10-D13 PolarHBondContact O-N 2.88Å
11	P	32.1	Very low	30.6	Very low	136 Å²	136	130.6 Å²	130.6	88%	0.883	71%	0.711	S	S	*	*	T	Hydrogen-bonded Turn	trans	-73.7	89.1	-174.8	29.3	-32.9	0	0	0	109.9
12	G	34.5	Very low	31	Very low	75 Å²	75	129.7 Å²	129.7	77%	0.773	70%	0.701	S	S	*	*	T	Hydrogen-bonded Turn	trans	165.7	-15.1	-179.2	0	0	0	0	0	113.4	D10	D10-G12 PolarHBondContact O-N 2.7Å
13	D	35.7	Very low	31.4	Very low	130 Å²	130	131.2 Å²	131.2	70%	0.695	70%	0.698	S	S	*	*			trans	-86.4	139.8	179.1	-125.2	-17	0	0	0	112.6	D10	D10-D13 PolarHBondContact O-N 2.88Å
14	K	34.7	Very low	31.7	Very low	164 Å²	164	134.5 Å²	134.5	71%	0.713	70%	0.703	S	S	*	*			trans	-69.1	164.9	-167.6	-60.7	-172.7	177.3	-155.9	0	111.8
15	D	38.5	Very low	31.7	Very low	120 Å²	120	139 Å²	139	64%	0.642	72%	0.718	S	S	*	*			trans	-11.3	128.5	-178.4	-105.1	-62.1	0	0	0	115.4	H17 D18	D15-H17 PolarHBondContact O-N 3.17Å; D15-D18 PolarHBondContact O-N 3.42Å
16	P	41	Very low	32.1	Very low	108 Å²	108	139.1 Å²	139.1	70%	0.701	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-56.3	-4.1	-173.4	20.6	-32.1	0	0	0	115.8
17	H	37.5	Very low	32.2	Very low	139 Å²	139	137.5 Å²	137.5	64%	0.644	72%	0.719	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.5	-26.6	168.4	-75.5	-76.3	0	0	0	114.9	D15 L19	D15-H17 PolarHBondContact O-N 3.17Å; H17-L19 VanDerWaalsContact C-N 3.32Å; H17-L19 PolarHBondContact O-N 2.96Å
18	D	34.9	Very low	32.7	Very low	133 Å²	133	138.4 Å²	138.4	71%	0.711	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83	-7.2	-176.9	-81.3	-18.1	0	0	0	113.8	D15 L20	D15-D18 PolarHBondContact O-N 3.42Å; D18-L20 VanDerWaalsContact C-N 3.27Å; D18-L20 PolarHBondContact O-N 2.67Å
19	L	35.1	Very low	33.3	Very low	99 Å²	99	134.5 Å²	134.5	52%	0.518	71%	0.709	S	S	.	*	T	Hydrogen-bonded Turn	trans	-84.9	7.6	174.3	-69	171.5	0	0	0	113.9	I9 H17 P21	I9-L19 HydrophobicContact CG1-CD1 4.15Å; H17-L19 VanDerWaalsContact C-N 3.32Å; H17-L19 PolarHBondContact O-N 2.96Å; L19-P21 VanDerWaalsContact O-CD 3.28Å; L19-P21 WeakPolarHBondContact O-CD 3.36Å
20	L	33.2	Very low	33.5	Very low	123 Å²	123	132.4 Å²	132.4	64%	0.644	70%	0.703	S	S	*	*	S	Bend	trans	-73.7	115.3	172.5	-89.7	149.9	0	0	0	110.1	D18 K22	D18-L20 VanDerWaalsContact C-N 3.27Å; D18-L20 PolarHBondContact O-N 2.67Å; L20-K22 PolarHBondContact O-N 2.75Å
21	P	31.8	Very low	34.2	Very low	96 Å²	96	130.6 Å²	130.6	62%	0.623	69%	0.693	S	S	*	*			trans	-60.9	118.5	170.4	-14.4	28.8	0	0	0	107.9	L19 H23	L19-P21 VanDerWaalsContact O-CD 3.28Å; L19-P21 WeakPolarHBondContact O-CD 3.36Å; P21-H23 PolarHBondContact O-N 3.03Å
22	K	32.1	Very low	34.6	Very low	210 Å²	210	131.5 Å²	131.5	91%	0.913	69%	0.689	S	S	*	*			trans	-70.4	68.5	171.1	-61.9	-161.4	-176.5	-172.3	0	109.6	L20	L20-K22 PolarHBondContact O-N 2.75Å
23	H	29	Very low	34.9	Very low	172 Å²	172	133.9 Å²	133.9	80%	0.796	68%	0.68	S	S	*	*			trans	-107.2	105.5	174.5	-116.7	-92.9	0	0	0	110.4	P21	P21-H23 PolarHBondContact O-N 3.03Å
24	K	25.5	Very low	35.2	Very low	183 Å²	183	129.8 Å²	129.8	80%	0.796	66%	0.661	S	S	*	*			trans	11.1	109.5	157.6	-70.2	-98.4	-175.6	173	0	115.4	K26	K24-K26 PolarHBondContact O-N 2.64Å
25	Q	27.7	Very low	35.6	Very low	177 Å²	177	128.8 Å²	128.8	83%	0.827	65%	0.653	S	S	*	*			trans	-24.2	103.8	151.2	-162.5	92.4	20.8	0	0	110.8
26	K	31.9	Very low	35.9	Very low	187 Å²	187	125.8 Å²	125.8	81%	0.813	64%	0.635	S	S	*	*			trans	-127.2	107.1	168.1	-165.7	165	-175.6	175.1	0	106.5	K24 S28	K24-K26 PolarHBondContact O-N 2.64Å; K26-S28 PolarHBondContact O-N 3.43Å
27	D	30.8	Very low	36.1	Very low	139 Å²	139	124.2 Å²	124.2	74%	0.743	62%	0.618	S	S	*	*			trans	-58.9	104	-177.9	-47.5	-55.1	0	0	0	108.9
28	S	35.5	Very low	36.5	Very low	93 Å²	93	120.4 Å²	120.4	65%	0.65	60%	0.602	S	S	*	*			trans	-175.7	108.4	162.1	11.2	0	0	0	0	111.3	K26	K26-S28 PolarHBondContact O-N 3.43Å
29	N	38	Very low	36.9	Very low	126 Å²	126	117.8 Å²	117.8	67%	0.674	59%	0.585	S	S	*	*			trans	42.3	106.7	154.8	-72.5	-33.3	0	0	0	117.6	I31	N29-I31 PolarHBondContact O-N 3.1Å
30	C	37.2	Very low	36.7	Very low	62 Å²	62	121.6 Å²	121.6	42%	0.419	60%	0.597	S	S	.	*	T	Hydrogen-bonded Turn	trans	-57.1	15.2	178.4	-52.5	0	0	0	0	116.8	C142	C30-C142 HydrophobicContact CB-CB 4.29Å
31	I	42.2	Very low	37.1	Very low	71 Å²	71	116.9 Å²	116.9	36%	0.364	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-99.6	-27	-172.2	-56.1	-179.9	0	0	0	112.4	N29 K143	N29-I31 PolarHBondContact O-N 3.1Å; I31-K143 HydrophobicContact CD1-CD 4.39Å; I31-K143 HydrophobicContact CD1-CG 4.34Å
32	L	40	Very low	37.4	Very low	154 Å²	154	122.3 Å²	122.3	81%	0.806	58%	0.583	S	S	*	*	S	Bend	trans	-98.1	-8.2	-165.3	-108.9	92.4	0	0	0	117.7
33	E	40.6	Very low	37.7	Very low	126 Å²	126	117.8 Å²	117.8	59%	0.589	58%	0.577	S	S	*	*			trans	-124	63.3	-177.7	-66.4	-100.4	135.7	0	0	109.8	W35	E33-W35 PolarHBondContact O-NE1 3.03Å; E33-W35 WeakPolarHBondContact OE2-CZ2 3.36Å
34	S	43.1	Very low	38.4	Very low	43 Å²	43	111.1 Å²	111.1	30%	0.301	55%	0.552	S	S	.	*	P	Polyproline II helix	trans	-79	116.3	167.5	62.3	0	0	0	0	109.3
35	W	43.2	Very low	39.4	Very low	143 Å²	143	107.9 Å²	107.9	54%	0.542	54%	0.543	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	128.1	-178.9	-57.7	75.7	0	0	0	109.2	E33 V70	E33-W35 PolarHBondContact O-NE1 3.03Å; E33-W35 WeakPolarHBondContact OE2-CZ2 3.36Å; W35-V70 PolarHBondContact N-O 3.31Å; W35-V70 PolarHBondContact O-N 3.4Å
36	F	43.8	Very low	40.5	Very low	58 Å²	58	105.7 Å²	105.7	25%	0.254	54%	0.536	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	121.5	176.1	-64.7	-93.4	0	0	0	109.6	I69	F36-I69 HydrophobicContact CD1-CD1 4.12Å; F36-I69 HydrophobicContact CD1-CG1 3.53Å; F36-I69 HydrophobicContact CE1-CD1 3.56Å; F36-I69 HydrophobicContact CE1-CG1 3.5Å; F36-I69 HydrophobicContact CG-CG1 4.43Å; F36-I69 HydrophobicContact CZ-CD1 4.3Å; F36-I69 HydrophobicContact CZ-CG1 4.38Å
37	Q	45.5	Very low	41.3	Very low	75 Å²	75	98.2 Å²	98.2	35%	0.35	51%	0.512	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	126.1	178.8	-164.9	85.8	20.9	0	0	109.4	F39 G68 V70	Q37-F39 HydrophobicContact CB-CE2 3.84Å; Q37-F39 HydrophobicContact CB-CZ 4.32Å; Q37-F39 HydrophobicContact CG-CE2 3.77Å; Q37-F39 HydrophobicContact CG-CZ 3.79Å; Q37-F39 WeakPolarHBondContact O-CD2 3.49Å; Q37-G68 PolarHBondContact N-O 2.81Å; Q37-G68 VanDerWaalsContact O-CA 3.22Å; Q37-G68 WeakPolarHBondContact O-CA 3.32Å; Q37-G68 PolarHBondContact O-N 2.82Å; Q37-G68 VanDerWaalsContact O-O 3.07Å; Q37-V70 HydrophobicContact CB-CG2 4.43Å
38	N	45.6	Very low	42.1	Very low	58 Å²	58	93.5 Å²	93.5	31%	0.31	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	132.4	-176.3	-64.8	-13.7	0	0	0	111.6	L85	N38-L85 WeakPolarHBondContact OD1-CD1 3.27Å
39	F	42.6	Very low	42.7	Very low	79 Å²	79	92.6 Å²	92.6	35%	0.346	48%	0.48	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.4	79.3	176.5	-65.8	-86.7	0	0	0	109.5	Q37 V66 L76	Q37-F39 HydrophobicContact CB-CE2 3.84Å; Q37-F39 HydrophobicContact CB-CZ 4.32Å; Q37-F39 HydrophobicContact CG-CE2 3.77Å; Q37-F39 HydrophobicContact CG-CZ 3.79Å; Q37-F39 WeakPolarHBondContact O-CD2 3.49Å; F39-V66 PolarHBondContact N-O 3.27Å; F39-V66 WeakPolarHBondContact O-CB 3.13Å; F39-L76 HydrophobicContact CD2-CD1 4.43Å; F39-L76 HydrophobicContact CE2-CD1 3.57Å; F39-L76 HydrophobicContact CE2-CD2 4Å; F39-L76 HydrophobicContact CE2-CG 4.4Å; F39-L76 HydrophobicContact CZ-CD1 4.17Å; F39-L76 HydrophobicContact CZ-CD2 3.96Å
40	F	32.6	Very low	43.2	Very low	179 Å²	179	93 Å²	93	79%	0.785	48%	0.481	S	S	*	.	E	Extended strand (participates in β ladder)	trans	68.8	141.9	168.4	-66.3	-94.6	0	0	0	117.7	V66	F40-V66 PolarHBondContact O-N 3.38Å
41	S	40.7	Very low	43.6	Very low	24 Å²	24	97.5 Å²	97.5	17%	0.168	49%	0.49	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	140.3	163.1	-54.8	0	0	0	0	108.5	S43 Q62 T65	S41-S43 PolarHBondContact O-N 3.44Å; S41-Q62 PolarHBondContact OG-OE1 2.68Å; S41-T65 PolarHBondContact OG-OG1 3.01Å
42	R	37.4	Very low	44.3	Very low	210 Å²	210	100 Å²	100	79%	0.792	51%	0.514	S	S	*	.	T	Hydrogen-bonded Turn	trans	-39.9	109.8	179.5	-169.6	173.6	-173.6	176.8	3.2	113.1	A44	R42-A44 PolarHBondContact O-N 3.22Å
43	S	39.8	Very low	45.5	Very low	114 Å²	114	98.1 Å²	98.1	80%	0.797	50%	0.504	S	S	*	.	T	Hydrogen-bonded Turn	trans	24.8	38.9	165	77.9	0	0	0	0	119	S41 N45	S41-S43 PolarHBondContact O-N 3.44Å; S43-N45 PolarHBondContact O-N 3.07Å
44	A	42.3	Very low	45.8	Very low	32 Å²	32	100.3 Å²	100.3	26%	0.264	51%	0.507	S	S	.	.			trans	-61.5	114.7	158	0	0	0	0	0	104.9	R42 I46 V49	R42-A44 PolarHBondContact O-N 3.22Å; A44-I46 PolarHBondContact O-N 3.48Å; A44-I46 VanDerWaalsContact O-N 3.1Å; A44-V49 HydrophobicContact CB-CG2 3.72Å
45	N	46.1	Very low	46.4	Very low	115 Å²	115	102.8 Å²	102.8	62%	0.615	53%	0.531	S	S	*	.			trans	-33.8	123.8	169.4	159.6	-32.9	0	0	0	107.3	S43 G47 S48 V49	S43-N45 PolarHBondContact O-N 3.07Å; N45-G47 CarbonylContact O-C 3.52Å; N45-G47 PolarHBondContact O-N 2.84Å; N45-G47 WeakPolarHBondContact OD1-CA 3.35Å; N45-G47 PolarHBondContact OD1-N 3.35Å; N45-S48 PolarHBondContact N-OG 2.97Å; N45-S48 WeakPolarHBondContact O-CA 3.41Å; N45-S48 WeakPolarHBondContact O-CB 3.28Å; N45-S48 PolarHBondContact O-N 3.34Å; N45-S48 PolarHBondContact O-OG 3.07Å; N45-S48 PolarHBondContact OD1-N 3.44Å; N45-V49 PolarHBondContact O-N 3.12Å
46	I	51.4	Low	47.1	Very low	132 Å²	132	104 Å²	104	68%	0.677	54%	0.539	S	S	*	.	H	α-helix	trans	-51.1	-37.3	-174.6	-65.5	167.7	0	0	0	110.5	A44 S48 V49 L50	A44-I46 PolarHBondContact O-N 3.48Å; A44-I46 VanDerWaalsContact O-N 3.1Å; I46-S48 PolarHBondContact O-N 3.29Å; I46-V49 PolarHBondContact O-N 3.43Å; I46-L50 HydrophobicContact CG2-CD1 3.86Å; I46-L50 HydrophobicContact CG2-CG 4.35Å; I46-L50 VanDerWaalsContact O-CG 3.3Å; I46-L50 WeakPolarHBondContact O-CG 3.47Å; I46-L50 PolarHBondContact O-N 3.05Å; I46-L50 VanDerWaalsContact O-N 3.07Å
47	G	48.7	Very low	47.5	Very low	29 Å²	29	105.4 Å²	105.4	30%	0.299	55%	0.553	S	S	.	*	H	α-helix	trans	-55.6	-43.8	169.6	0	0	0	0	0	114	N45 V49 L50 R51	N45-G47 CarbonylContact O-C 3.52Å; N45-G47 PolarHBondContact O-N 2.84Å; N45-G47 WeakPolarHBondContact OD1-CA 3.35Å; N45-G47 PolarHBondContact OD1-N 3.35Å; G47-V49 VanDerWaalsContact C-N 3.3Å; G47-V49 PolarHBondContact O-N 2.76Å; G47-L50 CarbonylContact O-C 3.54Å; G47-L50 PolarHBondContact O-N 3.11Å; G47-L50 VanDerWaalsContact O-N 3.12Å; G47-R51 VanDerWaalsContact O-CG 3.27Å; G47-R51 WeakPolarHBondContact O-CG 3.42Å; G47-R51 PolarHBondContact O-N 3.44Å
48	S	47.7	Very low	48.2	Very low	41 Å²	41	103.9 Å²	103.9	29%	0.287	55%	0.553	S	S	.	*	H	α-helix	trans	-63	-30.5	176.5	70	0	0	0	0	114.4	N45 I46	N45-S48 PolarHBondContact N-OG 2.97Å; N45-S48 WeakPolarHBondContact O-CA 3.41Å; N45-S48 WeakPolarHBondContact O-CB 3.28Å; N45-S48 PolarHBondContact O-N 3.34Å; N45-S48 PolarHBondContact O-OG 3.07Å; N45-S48 PolarHBondContact OD1-N 3.44Å; I46-S48 PolarHBondContact O-N 3.29Å
49	V	48.6	Very low	48.8	Very low	73 Å²	73	105.5 Å²	105.5	44%	0.442	56%	0.561	S	S	.	*	H	α-helix	trans	-76.2	-31.2	173.8	179.4	0	0	0	0	111.3	A44 N45 I46 G47	A44-V49 HydrophobicContact CB-CG2 3.72Å; N45-V49 PolarHBondContact O-N 3.12Å; I46-V49 PolarHBondContact O-N 3.43Å; G47-V49 VanDerWaalsContact C-N 3.3Å; G47-V49 PolarHBondContact O-N 2.76Å
50	L	48.6	Very low	49.4	Very low	134 Å²	134	103.9 Å²	103.9	70%	0.702	56%	0.556	S	S	*	*	H	α-helix	trans	-85.4	-16.6	179.5	-66.6	177.7	0	0	0	113.8	I46 G47 S52	I46-L50 HydrophobicContact CG2-CD1 3.86Å; I46-L50 HydrophobicContact CG2-CG 4.35Å; I46-L50 VanDerWaalsContact O-CG 3.3Å; I46-L50 WeakPolarHBondContact O-CG 3.47Å; I46-L50 PolarHBondContact O-N 3.05Å; I46-L50 VanDerWaalsContact O-N 3.07Å; G47-L50 CarbonylContact O-C 3.54Å; G47-L50 PolarHBondContact O-N 3.11Å; G47-L50 VanDerWaalsContact O-N 3.12Å; L50-S52 PolarHBondContact O-N 2.98Å
51	R	45.1	Very low	50.5	Low	158 Å²	158	100.9 Å²	100.9	60%	0.596	54%	0.544	S	S	*	.			trans	-70.9	124.5	177.9	-75.3	-172.9	-178.4	-169.3	-1	110.4	G47 D53	G47-R51 VanDerWaalsContact O-CG 3.27Å; G47-R51 WeakPolarHBondContact O-CG 3.42Å; G47-R51 PolarHBondContact O-N 3.44Å; R51-D53 WeakPolarHBondContact CB-OD1 3.33Å; R51-D53 PolarHBondContact O-N 3.48Å
52	S	56.8	Low	51.4	Low	123 Å²	123	102.6 Å²	102.6	86%	0.86	55%	0.549	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.6	-10.1	177.2	50.9	0	0	0	0	113.8	L50 R54	L50-S52 PolarHBondContact O-N 2.98Å; S52-R54 VanDerWaalsContact C-N 3.34Å
53	D	65.1	Low	52.1	Low	115 Å²	115	96.9 Å²	96.9	62%	0.615	54%	0.539	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.2	-15.2	-175.3	72.3	-30.1	0	0	0	113.5	R51	R51-D53 WeakPolarHBondContact CB-OD1 3.33Å; R51-D53 PolarHBondContact O-N 3.48Å
54	R	46.8	Very low	52.7	Low	171 Å²	171	92.3 Å²	92.3	65%	0.645	51%	0.51	S	S	*	.	S	Bend	trans	-102.8	139.2	176.2	-66.3	-171.5	178.1	-159.4	-2.4	110.7	S52 K56	S52-R54 VanDerWaalsContact C-N 3.34Å; R54-K56 PolarHBondContact O-N 2.92Å
55	A	55.9	Low	53.1	Low	96 Å²	96	90.8 Å²	90.8	79%	0.793	50%	0.498	S	S	*	.			trans	-51.7	113.8	171	0	0	0	0	0	108.6	V57	A55-V57 VanDerWaalsContact C-N 3.3Å; A55-V57 PolarHBondContact O-N 3.02Å
56	K	57.1	Low	53.3	Low	167 Å²	167	86.3 Å²	86.3	73%	0.726	48%	0.475	S	S	*	.			trans	-72.3	91.8	-177.8	-150.6	172.6	-170.4	175.7	0	106.9	R54 A58	R54-K56 PolarHBondContact O-N 2.92Å; K56-A58 PolarHBondContact O-N 3.32Å
57	V	53.2	Low	53.2	Low	88 Å²	88	80.4 Å²	80.4	53%	0.533	45%	0.445	S	S	.	.			trans	-58	127.4	168.9	178.9	0	0	0	0	106.1	A55 I59 Q61	A55-V57 VanDerWaalsContact C-N 3.3Å; A55-V57 PolarHBondContact O-N 3.02Å; V57-I59 PolarHBondContact O-N 3.25Å; V57-Q61 HydrophobicContact CG1-CB 3.95Å
58	A	59.6	Low	53.1	Low	43 Å²	43	79 Å²	79	36%	0.355	43%	0.431	S	S	.	.			trans	-59.5	134	180	0	0	0	0	0	108.4	K56 D60 Q61	K56-A58 PolarHBondContact O-N 3.32Å; A58-D60 VanDerWaalsContact C-OD1 3.25Å; A58-D60 WeakPolarHBondContact CB-OD1 2.83Å; A58-D60 PolarHBondContact O-N 3.49Å; A58-D60 VanDerWaalsContact O-N 3.08Å; A58-Q61 HydrophobicContact CB-CG 4.37Å; A58-Q61 WeakPolarHBondContact O-CA 3.14Å; A58-Q61 WeakPolarHBondContact O-CB 3.22Å; A58-Q61 PolarHBondContact O-N 2.82Å
59	I	58.8	Low	53.4	Low	92 Å²	92	77.8 Å²	77.8	47%	0.472	42%	0.421	S	S	.	.	G	3₁₀ helix	trans	-57.3	-30.9	-169.1	-67.6	169.8	0	0	0	111.3	V57 Q61 Q62 T65	V57-I59 PolarHBondContact O-N 3.25Å; I59-Q61 PolarHBondContact O-N 3.08Å; I59-Q62 PolarHBondContact O-N 3.35Å; I59-T65 PolarHBondContact O-OG1 2.75Å
60	D	54.8	Low	53.5	Low	46 Å²	46	76.9 Å²	76.9	25%	0.246	42%	0.415	C	S	.	.	G	3₁₀ helix	trans	-65.4	-20.5	175.7	62.8	-54.3	0	0	0	113.9	A58 T84 L85 S86	A58-D60 VanDerWaalsContact C-OD1 3.25Å; A58-D60 WeakPolarHBondContact CB-OD1 2.83Å; A58-D60 PolarHBondContact O-N 3.49Å; A58-D60 VanDerWaalsContact O-N 3.08Å; D60-T84 WeakPolarHBondContact O-CB 3.33Å; D60-L85 HydrophobicContact CB-CB 4.37Å; D60-L85 HydrophobicContact CB-CD2 4.28Å; D60-L85 PolarHBondContact O-N 3.22Å; D60-S86 PolarHBondContact O-N 2.88Å
61	Q	56.7	Low	53.6	Low	115 Å²	115	71 Å²	71	54%	0.537	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-97.6	-4.7	178	-56.7	-169.1	-59.7	0	0	113.2	V57 A58 I59 P63 T84	V57-Q61 HydrophobicContact CG1-CB 3.95Å; A58-Q61 HydrophobicContact CB-CG 4.37Å; A58-Q61 WeakPolarHBondContact O-CA 3.14Å; A58-Q61 WeakPolarHBondContact O-CB 3.22Å; A58-Q61 PolarHBondContact O-N 2.82Å; I59-Q61 PolarHBondContact O-N 3.08Å; Q61-P63 WeakPolarHBondContact O-CD 3.36Å; Q61-T84 VanDerWaalsContact O-CG2 3.29Å; Q61-T84 WeakPolarHBondContact O-CG2 3.44Å
62	Q	58.2	Low	54.1	Low	60 Å²	60	67.6 Å²	67.6	28%	0.28	38%	0.384	S	S	.	.	S	Bend	trans	-78.5	126.1	-178.7	-165	163.3	8	0	0	110.9	S41 I59 T65	S41-Q62 PolarHBondContact OG-OE1 2.68Å; I59-Q62 PolarHBondContact O-N 3.35Å; Q62-T65 PolarHBondContact O-OG1 2.77Å
63	P	52.7	Low	53.8	Low	90 Å²	90	63.5 Å²	63.5	58%	0.584	36%	0.355	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.1	142.3	173.4	-19.6	31.5	0	0	0	111.5	Q61	Q61-P63 WeakPolarHBondContact O-CD 3.36Å
64	G	52.6	Low	53.2	Low	18 Å²	18	69.1 Å²	69.1	19%	0.186	37%	0.368	C	S	.	.	T	Hydrogen-bonded Turn	trans	78.4	23.7	179	0	0	0	0	0	114.4
65	T	50.9	Low	53	Low	0 Å²	0	63.8 Å²	63.8	0%	0	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80	129.5	170.8	-63.2	0	0	0	0	109.6	S41 I59 Q62 L85 Q88	S41-T65 PolarHBondContact OG-OG1 3.01Å; I59-T65 PolarHBondContact O-OG1 2.75Å; Q62-T65 PolarHBondContact O-OG1 2.77Å; T65-L85 HydrophobicContact CG2-CD1 4.32Å; T65-Q88 PolarHBondContact O-NE2 2.97Å
66	V	50.2	Low	52.7	Low	22 Å²	22	63 Å²	63	13%	0.133	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.5	115.9	176.9	-177.9	0	0	0	0	108.7	F39 F40 I78 E80	F39-V66 PolarHBondContact N-O 3.27Å; F39-V66 WeakPolarHBondContact O-CB 3.13Å; F40-V66 PolarHBondContact O-N 3.38Å; V66-I78 HydrophobicContact CG1-CB 4.35Å; V66-I78 HydrophobicContact CG1-CG2 3.09Å; V66-E80 HydrophobicContact CG2-CB 4.05Å; V66-E80 HydrophobicContact CG2-CG 3.91Å
67	S	48.3	Very low	52.6	Low	7 Å²	7	59.2 Å²	59.2	5%	0.049	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	134.5	-178.4	-38.9	0	0	0	0	109.7	Y77 I78 R79 L85 Q88	S67-Y77 VanDerWaalsContact O-O 3.05Å; S67-I78 WeakPolarHBondContact O-CA 3.41Å; S67-R79 PolarHBondContact O-N 2.93Å; S67-R79 VanDerWaalsContact O-N 3.11Å; S67-L85 WeakPolarHBondContact OG-CD1 3.3Å; S67-Q88 PolarHBondContact OG-OE1 3.11Å
68	G	48	Very low	52.6	Low	0 Å²	0	59.5 Å²	59.5	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	121.9	173	0	0	0	0	0	111	Q37 Y77	Q37-G68 PolarHBondContact N-O 2.81Å; Q37-G68 VanDerWaalsContact O-CA 3.22Å; Q37-G68 WeakPolarHBondContact O-CA 3.32Å; Q37-G68 PolarHBondContact O-N 2.82Å; Q37-G68 VanDerWaalsContact O-O 3.07Å; G68-Y77 CarbonylContact C-O 3.52Å; G68-Y77 WeakPolarHBondContact CA-O 3.29Å
69	I	53	Low	52.3	Low	15 Å²	15	62.5 Å²	62.5	8%	0.077	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.1	118	167.6	-63.3	164.6	0	0	0	107.7	F36 T75 L76 Y77 V135	F36-I69 HydrophobicContact CD1-CD1 4.12Å; F36-I69 HydrophobicContact CD1-CG1 3.53Å; F36-I69 HydrophobicContact CE1-CD1 3.56Å; F36-I69 HydrophobicContact CE1-CG1 3.5Å; F36-I69 HydrophobicContact CG-CG1 4.43Å; F36-I69 HydrophobicContact CZ-CD1 4.3Å; F36-I69 HydrophobicContact CZ-CG1 4.38Å; I69-T75 VanDerWaalsContact O-O 3.09Å; I69-L76 WeakPolarHBondContact O-CA 3.45Å; I69-Y77 PolarHBondContact N-O 3.44Å; I69-Y77 PolarHBondContact O-N 3.14Å; I69-V135 HydrophobicContact CD1-CG1 4.45Å; I69-V135 HydrophobicContact CD1-CG2 3.37Å
70	V	52.1	Low	51.9	Low	54 Å²	54	65.5 Å²	65.5	33%	0.327	33%	0.33	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95	108.6	172.4	-177.2	0	0	0	0	108.1	W35 Q37 T75 L76	W35-V70 PolarHBondContact N-O 3.31Å; W35-V70 PolarHBondContact O-N 3.4Å; Q37-V70 HydrophobicContact CB-CG2 4.43Å; V70-T75 WeakPolarHBondContact CA-O 3.48Å; V70-L76 HydrophobicContact CG2-CB 4.47Å; V70-L76 HydrophobicContact CG2-CD1 3.5Å
71	G	50	Low	51.8	Low	11 Å²	11	64.4 Å²	64.4	11%	0.113	33%	0.325	C	S	.	.			trans	-73.1	151.5	168.4	0	0	0	0	0	110.7	C73 R74 T75	G71-C73 PolarHBondContact O-N 2.99Å; G71-C73 VanDerWaalsContact O-N 3.11Å; G71-R74 PolarHBondContact O-N 2.92Å; G71-T75 PolarHBondContact N-O 3.11Å
72	T	54.8	Low	51.9	Low	86 Å²	86	61.8 Å²	61.8	53%	0.528	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-21.7	167.8	53.3	0	0	0	0	111.9	R74	T72-R74 PolarHBondContact O-N 3.23Å
73	C	50.8	Low	52.2	Low	38 Å²	38	62.4 Å²	62.4	26%	0.257	33%	0.333	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.5	14.1	170.1	13.9	0	0	0	0	114.5	G71 T75 H138 C142	G71-C73 PolarHBondContact O-N 2.99Å; G71-C73 VanDerWaalsContact O-N 3.11Å; C73-T75 VanDerWaalsContact C-N 3.3Å; C73-T75 PolarHBondContact O-N 2.88Å; C73-H138 PolarHBondContact SG-CE1 3.19Å; C73-H138 PolarHBondContact SG-NE2 3.34Å; C73-C142 HydrophobicContact CB-CB 4.3Å; C73-C142 WeakPolarHBondContact CB-SG 3.28Å; C73-C142 WeakPolarHBondContact SG-CB 3.49Å; C73-C142 CovalentContact SG-SG 2.07Å; C73-C142 PolarHBondContact SG-SG 3.14Å
74	R	52.1	Low	52.7	Low	233 Å²	233	60.3 Å²	60.3	88%	0.879	32%	0.319	S	S	*	.	S	Bend	trans	64.5	21.6	173.1	-53.1	-178.9	178.6	-177.7	-0.7	115.7	G71 T72	G71-R74 PolarHBondContact O-N 2.92Å; T72-R74 PolarHBondContact O-N 3.23Å
75	T	43.7	Very low	53.2	Low	58 Å²	58	60.2 Å²	60.2	36%	0.356	31%	0.314	S	S	.	.			trans	-93.3	135.4	170	56.1	0	0	0	0	109.3	I69 V70 G71 C73 H138	I69-T75 VanDerWaalsContact O-O 3.09Å; V70-T75 WeakPolarHBondContact CA-O 3.48Å; G71-T75 PolarHBondContact N-O 3.11Å; C73-T75 VanDerWaalsContact C-N 3.3Å; C73-T75 PolarHBondContact O-N 2.88Å; T75-H138 WeakPolarHBondContact CG2-CE1 3.12Å; T75-H138 PolarHBondContact OG1-CE1 3.27Å; T75-H138 PolarHBondContact OG1-ND1 3.38Å; T75-H138 PolarHBondContact OG1-NE2 2.98Å
76	L	49.4	Very low	53.9	Low	80 Å²	80	63.5 Å²	63.5	42%	0.419	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.5	111.1	175.2	172	64.7	0	0	0	108.1	F39 I69 V70 I78	F39-L76 HydrophobicContact CD2-CD1 4.43Å; F39-L76 HydrophobicContact CE2-CD1 3.57Å; F39-L76 HydrophobicContact CE2-CD2 4Å; F39-L76 HydrophobicContact CE2-CG 4.4Å; F39-L76 HydrophobicContact CZ-CD1 4.17Å; F39-L76 HydrophobicContact CZ-CD2 3.96Å; I69-L76 WeakPolarHBondContact O-CA 3.45Å; V70-L76 HydrophobicContact CG2-CB 4.47Å; V70-L76 HydrophobicContact CG2-CD1 3.5Å; L76-I78 HydrophobicContact CD1-CG1 4.44Å; L76-I78 HydrophobicContact CD2-CD1 3.99Å; L76-I78 HydrophobicContact CD2-CG1 4.22Å; L76-I78 HydrophobicContact CG-CD1 4.27Å; L76-I78 HydrophobicContact CG-CG1 3.95Å
77	Y	54.4	Low	54.8	Low	87 Å²	87	66.7 Å²	66.7	34%	0.341	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	109.5	179.8	-178.3	-105	0	0	0	111.7	S67 G68 I69 R79 A134	S67-Y77 VanDerWaalsContact O-O 3.05Å; G68-Y77 CarbonylContact C-O 3.52Å; G68-Y77 WeakPolarHBondContact CA-O 3.29Å; I69-Y77 PolarHBondContact N-O 3.44Å; I69-Y77 PolarHBondContact O-N 3.14Å; Y77-R79 HydrophobicContact CD1-CB 4.48Å; Y77-R79 HydrophobicContact CE1-CB 3.75Å; Y77-R79 HydrophobicContact CE1-CG 4.29Å; Y77-A134 HydrophobicContact CD2-CB 3.93Å; Y77-A134 HydrophobicContact CE1-CB 4.33Å; Y77-A134 HydrophobicContact CE2-CB 3.54Å; Y77-A134 HydrophobicContact CG-CB 4.48Å
78	I	52.8	Low	55.6	Low	94 Å²	94	66.6 Å²	66.6	48%	0.482	35%	0.349	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.5	113.5	-176.5	-61.1	-176.3	0	0	0	108.8	V66 S67 L76	V66-I78 HydrophobicContact CG1-CB 4.35Å; V66-I78 HydrophobicContact CG1-CG2 3.09Å; S67-I78 WeakPolarHBondContact O-CA 3.41Å; L76-I78 HydrophobicContact CD1-CG1 4.44Å; L76-I78 HydrophobicContact CD2-CD1 3.99Å; L76-I78 HydrophobicContact CD2-CG1 4.22Å; L76-I78 HydrophobicContact CG-CD1 4.27Å; L76-I78 HydrophobicContact CG-CG1 3.95Å
79	R	54	Low	56.5	Low	107 Å²	107	67.9 Å²	67.9	40%	0.404	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	121.4	174.5	-157.1	-175.5	-171	-157.1	2.6	111.7	S67 Y77 T81	S67-R79 PolarHBondContact O-N 2.93Å; S67-R79 VanDerWaalsContact O-N 3.11Å; Y77-R79 HydrophobicContact CD1-CB 4.48Å; Y77-R79 HydrophobicContact CE1-CB 3.75Å; Y77-R79 HydrophobicContact CE1-CG 4.29Å; R79-T81 PolarHBondContact O-N 3Å
80	E	51.2	Low	57.4	Low	155 Å²	155	70 Å²	70	72%	0.724	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-81.1	109.8	168.1	-163.8	174.9	-155.1	0	0	108.1	V66	V66-E80 HydrophobicContact CG2-CB 4.05Å; V66-E80 HydrophobicContact CG2-CG 3.91Å
81	T	52.4	Low	58.5	Low	23 Å²	23	71.3 Å²	71.3	14%	0.141	38%	0.38	C	S	.	.			trans	-128.7	141	175.8	-47.1	0	0	0	0	109.3	R79 N83	R79-T81 PolarHBondContact O-N 3Å; T81-N83 HydrophobicContact CG2-CB 4.01Å; T81-N83 PolarHBondContact O-N 2.95Å; T81-N83 VanDerWaalsContact O-N 3.14Å
82	G	58.8	Low	59.6	Low	59 Å²	59	71.7 Å²	71.7	61%	0.608	38%	0.379	S	S	*	.	S	Bend	trans	-66.6	-7.7	175.8	0	0	0	0	0	114.5
83	N	63.4	Low	60.6	Low	73 Å²	73	72.1 Å²	72.1	39%	0.39	38%	0.378	S	S	.	.	S	Bend	trans	-92.8	155.2	-178.2	-61.7	-17.2	0	0	0	111.3	T81 H87 Q88	T81-N83 HydrophobicContact CG2-CB 4.01Å; T81-N83 PolarHBondContact O-N 2.95Å; T81-N83 VanDerWaalsContact O-N 3.14Å; N83-H87 HydrophobicContact CB-CB 4.36Å; N83-H87 PolarHBondContact ND2-CD2 3.45Å; N83-Q88 PolarHBondContact O-NE2 3.12Å
84	T	63.2	Low	62	Low	47 Å²	47	72.1 Å²	72.1	29%	0.288	38%	0.384	S	S	.	.			trans	-61.5	153.5	177.9	64.6	0	0	0	0	111.3	D60 Q61 S86 H87 Q88	D60-T84 WeakPolarHBondContact O-CB 3.33Å; Q61-T84 VanDerWaalsContact O-CG2 3.29Å; Q61-T84 WeakPolarHBondContact O-CG2 3.44Å; T84-S86 VanDerWaalsContact C-N 3.3Å; T84-S86 PolarHBondContact O-N 2.82Å; T84-H87 VanDerWaalsContact O-CB 3.32Å; T84-H87 WeakPolarHBondContact O-CB 3.22Å; T84-H87 PolarHBondContact O-N 3.05Å; T84-H87 VanDerWaalsContact O-N 3.12Å; T84-H87 WeakPolarHBondContact OG1-CB 3.42Å; T84-H87 PolarHBondContact OG1-N 3.35Å; T84-Q88 PolarHBondContact O-N 3.33Å; T84-Q88 VanDerWaalsContact O-N 3.11Å
85	L	63.7	Low	63.1	Low	16 Å²	16	63 Å²	63	8%	0.084	35%	0.353	C	S	.	.	H	α-helix	trans	-63.6	-38.3	-178.8	-178.7	142.7	0	0	0	112.1	N38 D60 T65 S67 H87 Q88 S89	N38-L85 WeakPolarHBondContact OD1-CD1 3.27Å; D60-L85 HydrophobicContact CB-CB 4.37Å; D60-L85 HydrophobicContact CB-CD2 4.28Å; D60-L85 PolarHBondContact O-N 3.22Å; T65-L85 HydrophobicContact CG2-CD1 4.32Å; S67-L85 WeakPolarHBondContact OG-CD1 3.3Å; L85-H87 PolarHBondContact O-N 3.19Å; L85-Q88 PolarHBondContact O-N 3.32Å; L85-Q88 VanDerWaalsContact O-N 3.12Å; L85-S89 WeakPolarHBondContact O-CB 2.94Å; L85-S89 PolarHBondContact O-N 3.01Å
86	S	65.9	Low	64.7	Low	69 Å²	69	62.3 Å²	62.3	48%	0.483	35%	0.347	S	S	.	.	H	α-helix	trans	-57.1	-39.8	175.1	-179.1	0	0	0	0	111.3	D60 T84 A90	D60-S86 PolarHBondContact O-N 2.88Å; T84-S86 VanDerWaalsContact C-N 3.3Å; T84-S86 PolarHBondContact O-N 2.82Å; S86-A90 WeakPolarHBondContact O-CB 3.06Å; S86-A90 PolarHBondContact O-N 3.48Å
87	H	68.1	Low	66.1	Low	89 Å²	89	62.4 Å²	62.4	41%	0.412	35%	0.351	S	S	.	.	H	α-helix	trans	-64.7	-46.7	174.8	-170.5	77.5	0	0	0	111.8	N83 T84 L85 S89 A90 E91	N83-H87 HydrophobicContact CB-CB 4.36Å; N83-H87 PolarHBondContact ND2-CD2 3.45Å; T84-H87 VanDerWaalsContact O-CB 3.32Å; T84-H87 WeakPolarHBondContact O-CB 3.22Å; T84-H87 PolarHBondContact O-N 3.05Å; T84-H87 VanDerWaalsContact O-N 3.12Å; T84-H87 WeakPolarHBondContact OG1-CB 3.42Å; T84-H87 PolarHBondContact OG1-N 3.35Å; L85-H87 PolarHBondContact O-N 3.19Å; H87-S89 PolarHBondContact O-N 2.07Å; H87-A90 PolarHBondContact O-N 3.03Å; H87-E91 IonicContact CD2-OE2 2.76Å; H87-E91 IonicContact NE2-OE2 2.98Å; H87-E91 WeakPolarHBondContact O-CG 3.47Å; H87-E91 PolarHBondContact O-N 3.47Å
88	Q	66.8	Low	67.3	Low	5 Å²	5	62.4 Å²	62.4	2%	0.023	35%	0.353	C	S	.	.	H	α-helix	trans	-62.8	-43	178.6	-63.2	174.2	34.3	0	0	112.2	T65 S67 N83 T84 L85 E91 H92	T65-Q88 PolarHBondContact O-NE2 2.97Å; S67-Q88 PolarHBondContact OG-OE1 3.11Å; N83-Q88 PolarHBondContact O-NE2 3.12Å; T84-Q88 PolarHBondContact O-N 3.33Å; T84-Q88 VanDerWaalsContact O-N 3.11Å; L85-Q88 PolarHBondContact O-N 3.32Å; L85-Q88 VanDerWaalsContact O-N 3.12Å; Q88-E91 PolarHBondContact O-N 2.94Å; Q88-H92 PolarHBondContact O-CD2 2.85Å; Q88-H92 PolarHBondContact O-N 3.12Å
89	S	65.5	Low	68.3	Low	26 Å²	26	58.3 Å²	58.3	18%	0.182	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-43.7	177.3	-174.2	0	0	0	0	111	L85 H87 E91 H92 L93	L85-S89 WeakPolarHBondContact O-CB 2.94Å; L85-S89 PolarHBondContact O-N 3.01Å; H87-S89 PolarHBondContact O-N 2.07Å; S89-E91 PolarHBondContact O-N 2.91Å; S89-H92 PolarHBondContact O-N 3.31Å; S89-L93 WeakPolarHBondContact O-CG 3.32Å; S89-L93 PolarHBondContact O-N 3.31Å
90	A	71.8	Confident	69.5	Low	59 Å²	59	54.5 Å²	54.5	49%	0.488	33%	0.325	S	S	.	.	H	α-helix	trans	-62.2	-41.3	174.3	0	0	0	0	0	112.4	S86 H87 L93 G94	S86-A90 WeakPolarHBondContact O-CB 3.06Å; S86-A90 PolarHBondContact O-N 3.48Å; H87-A90 PolarHBondContact O-N 3.03Å; A90-L93 PolarHBondContact O-N 3.49Å; A90-G94 PolarHBondContact O-N 3.44Å
91	E	75.6	Confident	70.8	Confident	83 Å²	83	51.5 Å²	51.5	39%	0.388	31%	0.314	S	S	.	.	H	α-helix	trans	-60.8	-43.7	174.2	-74.6	-170.2	111.4	0	0	111.7	H87 Q88 S89 G94 N95	H87-E91 IonicContact CD2-OE2 2.76Å; H87-E91 IonicContact NE2-OE2 2.98Å; H87-E91 WeakPolarHBondContact O-CG 3.47Å; H87-E91 PolarHBondContact O-N 3.47Å; Q88-E91 PolarHBondContact O-N 2.94Å; S89-E91 PolarHBondContact O-N 2.91Å; E91-G94 PolarHBondContact O-N 3.03Å; E91-N95 VanDerWaalsContact O-CG 3.28Å; E91-N95 PolarHBondContact O-N 3.19Å; E91-N95 PolarHBondContact O-ND2 3.49Å
92	H	73.3	Confident	72	Confident	19 Å²	19	50.5 Å²	50.5	9%	0.088	31%	0.308	C	S	.	.	H	α-helix	trans	-64.3	-46.8	177.9	-72.2	-42.2	0	0	0	112.6	Q88 S89 G94 N95 L96	Q88-H92 PolarHBondContact O-CD2 2.85Å; Q88-H92 PolarHBondContact O-N 3.12Å; S89-H92 PolarHBondContact O-N 3.31Å; H92-G94 VanDerWaalsContact C-N 3.28Å; H92-G94 PolarHBondContact O-N 3.33Å; H92-N95 PolarHBondContact O-N 3.27Å; H92-L96 WeakPolarHBondContact O-CG 3.24Å; H92-L96 PolarHBondContact O-N 3.4Å
93	L	76.5	Confident	72.8	Confident	94 Å²	94	49.9 Å²	49.9	49%	0.492	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-39	175.6	-69.1	173.9	0	0	0	111.5	S89 A90 L96 T97	S89-L93 WeakPolarHBondContact O-CG 3.32Å; S89-L93 PolarHBondContact O-N 3.31Å; A90-L93 PolarHBondContact O-N 3.49Å; L93-L96 PolarHBondContact O-N 2.95Å; L93-T97 WeakPolarHBondContact O-CB 3.43Å; L93-T97 PolarHBondContact O-N 3.45Å; L93-T97 PolarHBondContact O-OG1 3.45Å
94	G	78.6	Confident	73.3	Confident	39 Å²	39	48.9 Å²	48.9	40%	0.402	29%	0.286	S	S	.	.	H	α-helix	trans	-61.3	-44.6	173.5	0	0	0	0	0	112.5	A90 E91 H92 T97 K98	A90-G94 PolarHBondContact O-N 3.44Å; E91-G94 PolarHBondContact O-N 3.03Å; H92-G94 VanDerWaalsContact C-N 3.28Å; H92-G94 PolarHBondContact O-N 3.33Å; G94-T97 PolarHBondContact O-N 2.86Å; G94-K98 WeakPolarHBondContact O-CB 3.34Å; G94-K98 PolarHBondContact O-N 3.1Å
95	N	75.2	Confident	73.8	Confident	40 Å²	40	47.7 Å²	47.7	21%	0.214	28%	0.283	C	S	.	.	H	α-helix	trans	-66.2	-40.8	178.1	-72.7	-22.9	0	0	0	112.5	E91 H92 T97 K98 L99 T129	E91-N95 VanDerWaalsContact O-CG 3.28Å; E91-N95 PolarHBondContact O-N 3.19Å; E91-N95 PolarHBondContact O-ND2 3.49Å; H92-N95 PolarHBondContact O-N 3.27Å; N95-T97 VanDerWaalsContact C-N 3.34Å; N95-K98 PolarHBondContact O-N 2.93Å; N95-L99 WeakPolarHBondContact O-CB 3.32Å; N95-L99 PolarHBondContact O-N 3Å; N95-T129 HydrophobicContact CB-CG2 4.21Å
96	L	77.2	Confident	74.1	Confident	44 Å²	44	52.9 Å²	52.9	23%	0.23	31%	0.307	C	S	.	.	H	α-helix	trans	-63.3	-41.5	174.5	-71.6	174.6	0	0	0	111.6	H92 L93 K98 L99 G100 V135 A139	H92-L96 WeakPolarHBondContact O-CG 3.24Å; H92-L96 PolarHBondContact O-N 3.4Å; L93-L96 PolarHBondContact O-N 2.95Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.27Å; L96-L99 PolarHBondContact O-N 3.12Å; L96-G100 PolarHBondContact O-N 3.41Å; L96-V135 HydrophobicContact CD2-CG1 4.39Å; L96-A139 HydrophobicContact CD2-CB 4.47Å
97	T	79.7	Confident	74.5	Confident	82 Å²	82	55.2 Å²	55.2	50%	0.503	31%	0.312	S	S	.	.	H	α-helix	trans	-61.9	-43.9	175.2	-57.1	0	0	0	0	111	L93 G94 N95 L99 G100 N101	L93-T97 WeakPolarHBondContact O-CB 3.43Å; L93-T97 PolarHBondContact O-N 3.45Å; L93-T97 PolarHBondContact O-OG1 3.45Å; G94-T97 PolarHBondContact O-N 2.86Å; N95-T97 VanDerWaalsContact C-N 3.34Å; T97-L99 PolarHBondContact O-N 2.9Å; T97-G100 PolarHBondContact O-N 3.32Å; T97-N101 WeakPolarHBondContact O-CB 3.37Å; T97-N101 VanDerWaalsContact O-CG 3.25Å; T97-N101 PolarHBondContact O-N 3.27Å
98	K	79.3	Confident	74.3	Confident	88 Å²	88	54 Å²	54	38%	0.383	32%	0.323	S	S	.	.	H	α-helix	trans	-63.5	-40.7	177.4	-166.5	-175.5	-173.6	-158.1	0	112.1	G94 N95 L96 A102 V125	G94-K98 WeakPolarHBondContact O-CB 3.34Å; G94-K98 PolarHBondContact O-N 3.1Å; N95-K98 PolarHBondContact O-N 2.93Å; L96-K98 VanDerWaalsContact C-N 3.33Å; L96-K98 PolarHBondContact O-N 3.27Å; K98-A102 VanDerWaalsContact O-CB 3.31Å; K98-A102 WeakPolarHBondContact O-CB 3.49Å; K98-A102 PolarHBondContact O-N 3.35Å; K98-V125 HydrophobicContact CD-CG1 4.21Å; K98-V125 HydrophobicContact CG-CG1 4.03Å
99	L	74.5	Confident	74.1	Confident	8 Å²	8	59.1 Å²	59.1	4%	0.042	35%	0.35	C	S	.	.	H	α-helix	trans	-61.4	-49.4	174.2	-178.5	66.9	0	0	0	110.7	N95 L96 T97 N101 A102 E103 M126 T129 A136 V140	N95-L99 WeakPolarHBondContact O-CB 3.32Å; N95-L99 PolarHBondContact O-N 3Å; L96-L99 PolarHBondContact O-N 3.12Å; T97-L99 PolarHBondContact O-N 2.9Å; L99-N101 PolarHBondContact O-N 2.91Å; L99-A102 PolarHBondContact O-N 3.35Å; L99-A102 VanDerWaalsContact O-N 3.16Å; L99-E103 WeakPolarHBondContact O-CG 3.49Å; L99-E103 PolarHBondContact O-N 3.48Å; L99-M126 HydrophobicContact CD1-CB 4.48Å; L99-M126 HydrophobicContact CD1-CE 4.42Å; L99-M126 HydrophobicContact CD1-CG 4.33Å; L99-T129 HydrophobicContact CB-CG2 4.31Å; L99-A136 HydrophobicContact CD2-CB 4.14Å; L99-V140 HydrophobicContact CD2-CG2 4.29Å
100	G	78.3	Confident	73.6	Confident	26 Å²	26	61.7 Å²	61.7	27%	0.268	36%	0.362	S	S	.	.	H	α-helix	trans	-61.1	-40.5	178.5	0	0	0	0	0	113.3	L96 T97 E103 T104	L96-G100 PolarHBondContact O-N 3.41Å; T97-G100 PolarHBondContact O-N 3.32Å; G100-E103 PolarHBondContact O-N 2.82Å; G100-T104 WeakPolarHBondContact O-CB 3.41Å; G100-T104 PolarHBondContact O-N 3.08Å; G100-T104 PolarHBondContact O-OG1 3.5Å
101	N	78.6	Confident	72.9	Confident	92 Å²	92	66.2 Å²	66.2	49%	0.492	38%	0.376	S	S	.	.	H	α-helix	trans	-66.1	-39.6	175	-68.8	-9.6	0	0	0	111.7	T97 L99 T104 G105	T97-N101 WeakPolarHBondContact O-CB 3.37Å; T97-N101 VanDerWaalsContact O-CG 3.25Å; T97-N101 PolarHBondContact O-N 3.27Å; L99-N101 PolarHBondContact O-N 2.91Å; N101-T104 PolarHBondContact O-N 3.49Å; N101-G105 PolarHBondContact O-N 2.7Å
102	A	77.3	Confident	72.1	Confident	2 Å²	2	71.4 Å²	71.4	2%	0.017	40%	0.397	C	S	.	.	H	α-helix	trans	-68.9	-39.1	177	0	0	0	0	0	112.1	K98 L99 T104 G105 H106 V125 M126	K98-A102 VanDerWaalsContact O-CB 3.31Å; K98-A102 WeakPolarHBondContact O-CB 3.49Å; K98-A102 PolarHBondContact O-N 3.35Å; L99-A102 PolarHBondContact O-N 3.35Å; L99-A102 VanDerWaalsContact O-N 3.16Å; A102-T104 VanDerWaalsContact C-N 3.34Å; A102-G105 PolarHBondContact O-N 3.29Å; A102-H106 VanDerWaalsContact O-CB 3.28Å; A102-H106 WeakPolarHBondContact O-CB 3.5Å; A102-H106 PolarHBondContact O-N 3.04Å; A102-V125 HydrophobicContact CB-CB 4.25Å; A102-V125 HydrophobicContact CB-CG1 4.09Å; A102-M126 HydrophobicContact CB-CG 3.57Å
103	E	75.5	Confident	71.3	Confident	47 Å²	47	75.5 Å²	75.5	22%	0.22	42%	0.424	C	S	.	.	H	α-helix	trans	-59.5	-45.1	171.1	-74.4	-177.6	168.5	0	0	110.6	L99 G100 H106 M107 M126 K143	L99-E103 WeakPolarHBondContact O-CG 3.49Å; L99-E103 PolarHBondContact O-N 3.48Å; G100-E103 PolarHBondContact O-N 2.82Å; E103-H106 PolarHBondContact O-N 3.27Å; E103-M107 HydrophobicContact CB-CE 4.47Å; E103-M107 WeakPolarHBondContact O-CE 3.42Å; E103-M107 WeakPolarHBondContact O-CG 3.35Å; E103-M107 PolarHBondContact O-N 3.06Å; E103-M126 HydrophobicContact CG-CE 3.79Å; E103-M126 HydrophobicContact CG-SD 4.4Å; E103-K143 VanDerWaalsContact CD-NZ 3.27Å; E103-K143 IonicContact OE1-NZ 3.65Å; E103-K143 PolarHBondContact OE1-NZ 3.29Å; E103-K143 IonicContact OE2-NZ 3.67Å; E103-K143 PolarHBondContact OE2-NZ 3.06Å
104	T	74.5	Confident	70.5	Confident	51 Å²	51	82.7 Å²	82.7	31%	0.313	45%	0.445	S	S	.	.	H	α-helix	trans	-64.2	-43.3	178.2	-55.2	0	0	0	0	112	G100 N101 A102 M107 G108 L109 D110	G100-T104 WeakPolarHBondContact O-CB 3.41Å; G100-T104 PolarHBondContact O-N 3.08Å; G100-T104 PolarHBondContact O-OG1 3.5Å; N101-T104 PolarHBondContact O-N 3.49Å; A102-T104 VanDerWaalsContact C-N 3.34Å; T104-M107 PolarHBondContact O-N 3.23Å; T104-G108 PolarHBondContact O-N 3.13Å; T104-L109 HydrophobicContact CG2-CB 3.75Å; T104-L109 PolarHBondContact O-N 3.46Å; T104-D110 HydrophobicContact CG2-CB 4.49Å; T104-D110 PolarHBondContact O-N 3.35Å
105	G	72.9	Confident	69.7	Low	22 Å²	22	87.6 Å²	87.6	23%	0.227	46%	0.462	C	S	.	.	H	α-helix	trans	-66	-38.7	175.1	0	0	0	0	0	113.2	N101 A102 G108	N101-G105 PolarHBondContact O-N 2.7Å; A102-G105 PolarHBondContact O-N 3.29Å; G105-G108 PolarHBondContact O-N 2.99Å; G105-G108 VanDerWaalsContact O-N 3.14Å
106	H	70.4	Confident	69.1	Low	125 Å²	125	96.4 Å²	96.4	58%	0.579	49%	0.492	S	S	*	.	H	α-helix	trans	-66.8	-39.9	176.4	-175.5	59.4	0	0	0	112.2	A102 E103 G108 P122 M126	A102-H106 VanDerWaalsContact O-CB 3.28Å; A102-H106 WeakPolarHBondContact O-CB 3.5Å; A102-H106 PolarHBondContact O-N 3.04Å; E103-H106 PolarHBondContact O-N 3.27Å; H106-G108 PolarHBondContact O-N 2.91Å; H106-P122 HydrophobicContact CB-CB 4.18Å; H106-M126 HydrophobicContact CB-SD 4.34Å
107	M	74	Confident	68.2	Low	119 Å²	119	100.1 Å²	100.1	59%	0.586	52%	0.518	S	S	*	.	T	Hydrogen-bonded Turn	trans	-71	-4.4	173.6	-68.7	-173.8	-72	0	0	113.4	E103 T104 L109	E103-M107 HydrophobicContact CB-CE 4.47Å; E103-M107 WeakPolarHBondContact O-CE 3.42Å; E103-M107 WeakPolarHBondContact O-CG 3.35Å; E103-M107 PolarHBondContact O-N 3.06Å; T104-M107 PolarHBondContact O-N 3.23Å; M107-L109 HydrophobicContact CB-CD1 4.12Å; M107-L109 HydrophobicContact CB-CG 3.93Å; M107-L109 HydrophobicContact CE-CD1 3.96Å; M107-L109 PolarHBondContact O-N 3.14Å; M107-L109 HydrophobicContact SD-CD1 4.28Å
108	G	64.6	Low	67.4	Low	63 Å²	63	101.5 Å²	101.5	65%	0.649	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.1	14.7	-176.2	0	0	0	0	0	113.8	T104 G105 H106	T104-G108 PolarHBondContact O-N 3.13Å; G105-G108 PolarHBondContact O-N 2.99Å; G105-G108 VanDerWaalsContact O-N 3.14Å; H106-G108 PolarHBondContact O-N 2.91Å
109	L	62.1	Low	66.7	Low	112 Å²	112	102.7 Å²	102.7	59%	0.586	55%	0.545	S	S	*	.			trans	-80.8	-8.7	176.8	-65	179.5	0	0	0	112.3	T104 M107 I111	T104-L109 HydrophobicContact CG2-CB 3.75Å; T104-L109 PolarHBondContact O-N 3.46Å; M107-L109 HydrophobicContact CB-CD1 4.12Å; M107-L109 HydrophobicContact CB-CG 3.93Å; M107-L109 HydrophobicContact CE-CD1 3.96Å; M107-L109 PolarHBondContact O-N 3.14Å; M107-L109 HydrophobicContact SD-CD1 4.28Å; L109-I111 PolarHBondContact O-N 2.95Å
110	D	56.7	Low	66.4	Low	81 Å²	81	104.9 Å²	104.9	43%	0.433	56%	0.561	S	S	.	*			trans	-69.8	106.1	179.1	-160.1	11.8	0	0	0	109.7	T104 K112	T104-D110 HydrophobicContact CG2-CB 4.49Å; T104-D110 PolarHBondContact O-N 3.35Å; D110-K112 VanDerWaalsContact C-N 3.26Å; D110-K112 PolarHBondContact O-N 2.88Å
111	I	56.1	Low	66.3	Low	153 Å²	153	109 Å²	109	79%	0.785	57%	0.574	S	S	*	*			trans	-67	91.6	176.1	-59	178.7	0	0	0	106.3	L109 T113	L109-I111 PolarHBondContact O-N 2.95Å; I111-T113 PolarHBondContact O-N 2.88Å
112	K	58.4	Low	66.2	Low	192 Å²	192	106.5 Å²	106.5	84%	0.835	56%	0.562	S	S	*	*			trans	-10	85.5	171.4	-67.8	-173.8	173	-179.7	0	112.8	D110 R114	D110-K112 VanDerWaalsContact C-N 3.26Å; D110-K112 PolarHBondContact O-N 2.88Å; K112-R114 PolarHBondContact O-N 3.31Å
113	T	57.2	Low	66.3	Low	105 Å²	105	108.4 Å²	108.4	64%	0.644	58%	0.578	S	S	*	*			trans	-63.8	123.3	163.6	33.5	0	0	0	0	106.1	I111 D115	I111-T113 PolarHBondContact O-N 2.88Å; T113-D115 PolarHBondContact O-N 3.4Å
114	R	59.2	Low	66.7	Low	246 Å²	246	112.5 Å²	112.5	93%	0.928	60%	0.595	S	S	*	*	S	Bend	trans	-62.5	-9.4	-176.5	-72.6	-177.2	174.5	-179.3	-1.6	113.1	K112	K112-R114 PolarHBondContact O-N 3.31Å
115	D	62.6	Low	66.9	Low	142 Å²	142	110.5 Å²	110.5	76%	0.759	58%	0.583	S	S	*	*	S	Bend	trans	-104.4	98.9	-173.4	-65.6	-56.3	0	0	0	111.1	T113	T113-D115 PolarHBondContact O-N 3.4Å
116	R	61.5	Low	67.3	Low	225 Å²	225	111.3 Å²	111.3	85%	0.849	58%	0.581	S	S	*	*			trans	64.6	113.1	167.6	-161.4	166.9	-170.7	153.8	1.2	116.1	Q118	R116-Q118 PolarHBondContact O-N 3.19Å
117	P	59.7	Low	67.9	Low	121 Å²	121	110.7 Å²	110.7	79%	0.786	58%	0.578	S	S	*	*			trans	-52.9	131.5	168.5	-22.2	31.9	0	0	0	110.3	A119	P117-A119 PolarHBondContact O-N 2.9Å
118	Q	62.8	Low	68.3	Low	112 Å²	112	111.6 Å²	111.6	52%	0.523	58%	0.579	S	S	.	*			trans	-55.1	117.5	164.7	-81.6	-170.3	26.4	0	0	107.3	R116 S120	R116-Q118 PolarHBondContact O-N 3.19Å; Q118-S120 PolarHBondContact O-N 3.41Å; Q118-S120 VanDerWaalsContact O-N 3.16Å
119	A	64.7	Low	68.9	Low	113 Å²	113	108.6 Å²	108.6	93%	0.934	55%	0.548	S	S	*	.	S	Bend	trans	-65.2	-18.7	-176.2	0	0	0	0	0	112.6	P117	P117-A119 PolarHBondContact O-N 2.9Å
120	S	66.5	Low	69.6	Low	53 Å²	53	105.5 Å²	105.5	37%	0.371	53%	0.532	S	S	.	.	S	Bend	trans	-100.6	131.2	177.4	50.4	0	0	0	0	110.9	Q118 V125	Q118-S120 PolarHBondContact O-N 3.41Å; Q118-S120 VanDerWaalsContact O-N 3.16Å; S120-V125 WeakPolarHBondContact OG-CG2 3.28Å
121	E	76.3	Confident	70.6	Confident	113 Å²	113	108.4 Å²	108.4	53%	0.528	54%	0.543	S	S	.	.			trans	-50.7	130.1	168.3	-172.6	-179.8	-179.5	0	0	111	A123 K124 V125	E121-A123 HydrophobicContact CG-CB 4.49Å; E121-A123 PolarHBondContact O-N 3.34Å; E121-A123 VanDerWaalsContact O-N 3.13Å; E121-K124 HydrophobicContact CB-CB 4.49Å; E121-K124 HydrophobicContact CB-CD 4.18Å; E121-K124 HydrophobicContact CB-CG 4.21Å; E121-K124 WeakPolarHBondContact O-CB 3.48Å; E121-K124 PolarHBondContact O-N 2.76Å; E121-K124 VanDerWaalsContact OE2-CE 3.26Å; E121-K124 WeakPolarHBondContact OE2-CE 3.48Å; E121-K124 IonicContact OE2-NZ 3.94Å; E121-V125 PolarHBondContact O-N 2.79Å
122	P	76.8	Confident	71.5	Confident	39 Å²	39	104.3 Å²	104.3	25%	0.253	53%	0.528	S	S	.	.	H	α-helix	trans	-52.3	-38.7	-175.1	-29.8	35	0	0	0	114	H106 K124 V125 M126	H106-P122 HydrophobicContact CB-CB 4.18Å; P122-K124 VanDerWaalsContact C-N 3.34Å; P122-K124 PolarHBondContact O-N 3.47Å; P122-V125 WeakPolarHBondContact O-CA 3.36Å; P122-V125 WeakPolarHBondContact O-CB 3.28Å; P122-V125 PolarHBondContact O-N 2.97Å; P122-M126 WeakPolarHBondContact O-CG 3.46Å; P122-M126 PolarHBondContact O-N 3.01Å
123	A	80.2	Confident	72.1	Confident	42 Å²	42	95.3 Å²	95.3	35%	0.347	49%	0.489	S	S	.	.	H	α-helix	trans	-59.7	-42	176.6	0	0	0	0	0	112.5	E121 V125 M126 Q127	E121-A123 HydrophobicContact CG-CB 4.49Å; E121-A123 PolarHBondContact O-N 3.34Å; E121-A123 VanDerWaalsContact O-N 3.13Å; A123-V125 VanDerWaalsContact C-N 3.28Å; A123-V125 PolarHBondContact O-N 2.9Å; A123-M126 PolarHBondContact O-N 2.94Å; A123-Q127 PolarHBondContact O-N 3.47Å
124	K	82.5	Confident	72.6	Confident	134 Å²	134	91.8 Å²	91.8	58%	0.583	47%	0.471	S	S	*	.	H	α-helix	trans	-65.7	-33.9	175.4	-66.7	-179.5	-177.8	168.8	0	111.6	E121 P122 K128	E121-K124 HydrophobicContact CB-CB 4.49Å; E121-K124 HydrophobicContact CB-CD 4.18Å; E121-K124 HydrophobicContact CB-CG 4.21Å; E121-K124 WeakPolarHBondContact O-CB 3.48Å; E121-K124 PolarHBondContact O-N 2.76Å; E121-K124 VanDerWaalsContact OE2-CE 3.26Å; E121-K124 WeakPolarHBondContact OE2-CE 3.48Å; E121-K124 IonicContact OE2-NZ 3.94Å; P122-K124 VanDerWaalsContact C-N 3.34Å; P122-K124 PolarHBondContact O-N 3.47Å; K124-K128 VanDerWaalsContact O-CB 3.27Å; K124-K128 WeakPolarHBondContact O-CB 3.44Å; K124-K128 PolarHBondContact O-N 3.4Å
125	V	80.2	Confident	73	Confident	8 Å²	8	80.8 Å²	80.8	5%	0.048	43%	0.431	C	S	.	.	H	α-helix	trans	-67.9	-44.2	175.8	-178.4	0	0	0	0	110.9	K98 A102 S120 E121 P122 A123 T129	K98-V125 HydrophobicContact CD-CG1 4.21Å; K98-V125 HydrophobicContact CG-CG1 4.03Å; A102-V125 HydrophobicContact CB-CB 4.25Å; A102-V125 HydrophobicContact CB-CG1 4.09Å; S120-V125 WeakPolarHBondContact OG-CG2 3.28Å; E121-V125 PolarHBondContact O-N 2.79Å; P122-V125 WeakPolarHBondContact O-CA 3.36Å; P122-V125 WeakPolarHBondContact O-CB 3.28Å; P122-V125 PolarHBondContact O-N 2.97Å; A123-V125 VanDerWaalsContact C-N 3.28Å; A123-V125 PolarHBondContact O-N 2.9Å; V125-T129 VanDerWaalsContact O-CB 3.31Å; V125-T129 WeakPolarHBondContact O-CB 3.46Å; V125-T129 PolarHBondContact O-N 3.31Å; V125-T129 PolarHBondContact O-OG1 2.98Å
126	M	80.7	Confident	73.2	Confident	39 Å²	39	74 Å²	74	19%	0.192	40%	0.395	C	S	.	.	H	α-helix	trans	-58.8	-53.8	175.6	-68	177.9	66.6	0	0	110.2	L99 A102 E103 H106 P122 A123 K128 T129 L130	L99-M126 HydrophobicContact CD1-CB 4.48Å; L99-M126 HydrophobicContact CD1-CE 4.42Å; L99-M126 HydrophobicContact CD1-CG 4.33Å; A102-M126 HydrophobicContact CB-CG 3.57Å; E103-M126 HydrophobicContact CG-CE 3.79Å; E103-M126 HydrophobicContact CG-SD 4.4Å; H106-M126 HydrophobicContact CB-SD 4.34Å; P122-M126 WeakPolarHBondContact O-CG 3.46Å; P122-M126 PolarHBondContact O-N 3.01Å; A123-M126 PolarHBondContact O-N 2.94Å; M126-K128 PolarHBondContact O-N 3.42Å; M126-T129 WeakPolarHBondContact O-CA 3.44Å; M126-T129 WeakPolarHBondContact O-CB 3.47Å; M126-T129 PolarHBondContact O-N 2.91Å; M126-L130 WeakPolarHBondContact O-CG 3.42Å; M126-L130 PolarHBondContact O-N 2.65Å
127	Q	82.7	Confident	73.5	Confident	112 Å²	112	69.3 Å²	69.3	52%	0.523	38%	0.382	S	S	.	.	H	α-helix	trans	-56.3	-50.7	179.9	-178.6	177.2	7.9	0	0	112	A123 T129 L130 E131	A123-Q127 PolarHBondContact O-N 3.47Å; Q127-T129 PolarHBondContact O-N 2.94Å; Q127-L130 PolarHBondContact O-N 2.99Å; Q127-L130 VanDerWaalsContact O-N 3.14Å; Q127-E131 HydrophobicContact CG-CG 4.46Å; Q127-E131 WeakPolarHBondContact CG-OE1 3.42Å; Q127-E131 PolarHBondContact NE2-OE1 2.93Å; Q127-E131 WeakPolarHBondContact O-CG 3.4Å; Q127-E131 PolarHBondContact O-N 3.42Å
128	K	81.9	Confident	73.9	Confident	138 Å²	138	66 Å²	66	60%	0.6	36%	0.356	S	S	*	.	H	α-helix	trans	-59.3	-35.4	177.4	-176.5	173.9	-177.9	174.6	0	112	K124 M126 S132	K124-K128 VanDerWaalsContact O-CB 3.27Å; K124-K128 WeakPolarHBondContact O-CB 3.44Å; K124-K128 PolarHBondContact O-N 3.4Å; M126-K128 PolarHBondContact O-N 3.42Å; K128-S132 VanDerWaalsContact O-CB 3.28Å; K128-S132 WeakPolarHBondContact O-CB 3.27Å; K128-S132 PolarHBondContact O-N 2.94Å; K128-S132 PolarHBondContact O-OG 2.96Å; K128-S132 VanDerWaalsContact O-OG 3.06Å
129	T	78	Confident	74	Confident	0 Å²	0	61.5 Å²	61.5	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-69.6	-43.1	178.3	-55.1	0	0	0	0	110.7	N95 L99 V125 M126 Q127 S132 S133 A136	N95-T129 HydrophobicContact CB-CG2 4.21Å; L99-T129 HydrophobicContact CB-CG2 4.31Å; V125-T129 VanDerWaalsContact O-CB 3.31Å; V125-T129 WeakPolarHBondContact O-CB 3.46Å; V125-T129 PolarHBondContact O-N 3.31Å; V125-T129 PolarHBondContact O-OG1 2.98Å; M126-T129 WeakPolarHBondContact O-CA 3.44Å; M126-T129 WeakPolarHBondContact O-CB 3.47Å; M126-T129 PolarHBondContact O-N 2.91Å; Q127-T129 PolarHBondContact O-N 2.94Å; T129-S132 WeakPolarHBondContact CA-OG 3.31Å; T129-S132 PolarHBondContact O-N 3.33Å; T129-S132 PolarHBondContact O-OG 3.16Å; T129-S133 VanDerWaalsContact O-CB 3.28Å; T129-S133 WeakPolarHBondContact O-CB 3.49Å; T129-S133 PolarHBondContact O-N 2.83Å; T129-A136 HydrophobicContact CG2-CB 4.16Å
130	L	76.8	Confident	74.2	Confident	47 Å²	47	58.2 Å²	58.2	25%	0.246	31%	0.306	C	S	.	.	H	α-helix	trans	-60.5	-46.9	174.5	-62.4	171.9	0	0	0	111.3	M126 Q127 S132 S133 A136 V140	M126-L130 WeakPolarHBondContact O-CG 3.42Å; M126-L130 PolarHBondContact O-N 2.65Å; Q127-L130 PolarHBondContact O-N 2.99Å; Q127-L130 VanDerWaalsContact O-N 3.14Å; L130-S132 VanDerWaalsContact C-N 3.28Å; L130-S132 PolarHBondContact O-N 2.9Å; L130-S133 CarbonylContact O-C 3.5Å; L130-S133 PolarHBondContact O-N 3.34Å; L130-A136 HydrophobicContact CD2-CB 4.08Å; L130-A136 WeakPolarHBondContact CD2-O 3.31Å; L130-V140 HydrophobicContact CD2-CB 4.29Å; L130-V140 HydrophobicContact CD2-CG2 3.66Å
131	E	78.4	Confident	74.1	Confident	142 Å²	142	57.2 Å²	57.2	66%	0.664	30%	0.304	S	S	*	.	H	α-helix	trans	-62.9	-32.8	177.5	-70.8	170.6	-176.2	0	0	112.9	Q127	Q127-E131 HydrophobicContact CG-CG 4.46Å; Q127-E131 WeakPolarHBondContact CG-OE1 3.42Å; Q127-E131 PolarHBondContact NE2-OE1 2.93Å; Q127-E131 WeakPolarHBondContact O-CG 3.4Å; Q127-E131 PolarHBondContact O-N 3.42Å
132	S	75	Confident	73.4	Confident	68 Å²	68	52 Å²	52	48%	0.476	28%	0.281	S	S	.	.	H	α-helix	trans	-87.1	-18.8	-179	69.5	0	0	0	0	114.3	K128 T129 L130	K128-S132 VanDerWaalsContact O-CB 3.28Å; K128-S132 WeakPolarHBondContact O-CB 3.27Å; K128-S132 PolarHBondContact O-N 2.94Å; K128-S132 PolarHBondContact O-OG 2.96Å; K128-S132 VanDerWaalsContact O-OG 3.06Å; T129-S132 WeakPolarHBondContact CA-OG 3.31Å; T129-S132 PolarHBondContact O-N 3.33Å; T129-S132 PolarHBondContact O-OG 3.16Å; L130-S132 VanDerWaalsContact C-N 3.28Å; L130-S132 PolarHBondContact O-N 2.9Å
133	S	70.6	Confident	72.4	Confident	2 Å²	2	54.4 Å²	54.4	1%	0.014	29%	0.287	C	S	.	.			trans	-138.2	98.6	-169.2	-176	0	0	0	0	110.2	T129 L130 V135 A136 E137	T129-S133 VanDerWaalsContact O-CB 3.28Å; T129-S133 WeakPolarHBondContact O-CB 3.49Å; T129-S133 PolarHBondContact O-N 2.83Å; L130-S133 CarbonylContact O-C 3.5Å; L130-S133 PolarHBondContact O-N 3.34Å; S133-V135 PolarHBondContact O-N 3.31Å; S133-V135 VanDerWaalsContact O-N 3.1Å; S133-A136 WeakPolarHBondContact O-CA 3.41Å; S133-A136 WeakPolarHBondContact O-CB 3.42Å; S133-A136 PolarHBondContact O-N 3.49Å; S133-A136 PolarHBondContact OG-N 2.95Å; S133-E137 PolarHBondContact O-N 3.48Å
134	A	67.3	Low	71	Confident	31 Å²	31	58.5 Å²	58.5	26%	0.256	30%	0.303	S	S	.	.	H	α-helix	trans	-54.5	-28.9	171.3	0	0	0	0	0	112.3	Y77 E137 H138	Y77-A134 HydrophobicContact CD2-CB 3.93Å; Y77-A134 HydrophobicContact CE1-CB 4.33Å; Y77-A134 HydrophobicContact CE2-CB 3.54Å; Y77-A134 HydrophobicContact CG-CB 4.48Å; A134-E137 PolarHBondContact O-N 2.77Å; A134-H138 VanDerWaalsContact O-CB 3.24Å; A134-H138 WeakPolarHBondContact O-CB 3.26Å; A134-H138 PolarHBondContact O-N 2.95Å
135	V	67.2	Low	69.1	Low	16 Å²	16	58.3 Å²	58.3	10%	0.097	31%	0.308	C	S	.	.	H	α-helix	trans	-65.1	-41.4	173.7	-175.8	0	0	0	0	111.2	I69 L96 S133 H138 A139	I69-V135 HydrophobicContact CD1-CG1 4.45Å; I69-V135 HydrophobicContact CD1-CG2 3.37Å; L96-V135 HydrophobicContact CD2-CG1 4.39Å; S133-V135 PolarHBondContact O-N 3.31Å; S133-V135 VanDerWaalsContact O-N 3.1Å; V135-H138 PolarHBondContact O-N 3.4Å; V135-A139 WeakPolarHBondContact O-CB 3.02Å; V135-A139 PolarHBondContact O-N 2.87Å
136	A	67.9	Low	66.9	Low	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-67.4	-43.5	176.4	0	0	0	0	0	110.8	L99 T129 L130 S133 H138 A139 V140	L99-A136 HydrophobicContact CD2-CB 4.14Å; T129-A136 HydrophobicContact CG2-CB 4.16Å; L130-A136 HydrophobicContact CD2-CB 4.08Å; L130-A136 WeakPolarHBondContact CD2-O 3.31Å; S133-A136 WeakPolarHBondContact O-CA 3.41Å; S133-A136 WeakPolarHBondContact O-CB 3.42Å; S133-A136 PolarHBondContact O-N 3.49Å; S133-A136 PolarHBondContact OG-N 2.95Å; A136-H138 VanDerWaalsContact C-N 3.32Å; A136-H138 PolarHBondContact O-N 2.93Å; A136-A139 PolarHBondContact O-N 3.45Å; A136-V140 PolarHBondContact O-N 3.47Å; A136-V140 VanDerWaalsContact O-N 3.08Å
137	E	67.8	Low	64.9	Low	125 Å²	125	67.2 Å²	67.2	58%	0.584	36%	0.362	S	S	*	.	H	α-helix	trans	-56.7	-47.1	173.6	-174.2	-177.5	-174.9	0	0	111.4	S133 A134 A139 V140 G141	S133-E137 PolarHBondContact O-N 3.48Å; A134-E137 PolarHBondContact O-N 2.77Å; E137-A139 PolarHBondContact O-N 3.37Å; E137-V140 PolarHBondContact O-N 2.97Å; E137-G141 PolarHBondContact O-N 3.16Å
138	H	67.3	Low	62.8	Low	53 Å²	53	72 Å²	72	25%	0.245	40%	0.399	C	S	.	.	H	α-helix	trans	-63.6	-42	177.5	-177.3	61.7	0	0	0	112.9	C73 T75 A134 V135 A136 V140 G141 C142	C73-H138 PolarHBondContact SG-CE1 3.19Å; C73-H138 PolarHBondContact SG-NE2 3.34Å; T75-H138 WeakPolarHBondContact CG2-CE1 3.12Å; T75-H138 PolarHBondContact OG1-CE1 3.27Å; T75-H138 PolarHBondContact OG1-ND1 3.38Å; T75-H138 PolarHBondContact OG1-NE2 2.98Å; A134-H138 VanDerWaalsContact O-CB 3.24Å; A134-H138 WeakPolarHBondContact O-CB 3.26Å; A134-H138 PolarHBondContact O-N 2.95Å; V135-H138 PolarHBondContact O-N 3.4Å; A136-H138 VanDerWaalsContact C-N 3.32Å; A136-H138 PolarHBondContact O-N 2.93Å; H138-V140 VanDerWaalsContact C-N 3.31Å; H138-V140 PolarHBondContact O-N 3.43Å; H138-G141 CarbonylContact O-C 3.57Å; H138-G141 WeakPolarHBondContact O-CA 3.38Å; H138-G141 PolarHBondContact O-N 3.03Å; H138-G141 VanDerWaalsContact O-N 3.12Å; H138-C142 PolarHBondContact CE1-SG 2.83Å; H138-C142 PolarHBondContact NE2-SG 3.41Å; H138-C142 PolarHBondContact O-N 3.13Å; H138-C142 PolarHBondContact O-SG 3.06Å
139	A	65.5	Low	61.9	Low	16 Å²	16	68.8 Å²	68.8	13%	0.132	39%	0.389	C	S	.	.	H	α-helix	trans	-60.5	-40.7	177.2	0	0	0	0	0	111.9	L96 V135 A136 E137 K143	L96-A139 HydrophobicContact CD2-CB 4.47Å; V135-A139 WeakPolarHBondContact O-CB 3.02Å; V135-A139 PolarHBondContact O-N 2.87Å; A136-A139 PolarHBondContact O-N 3.45Å; E137-A139 PolarHBondContact O-N 3.37Å; A139-K143 WeakPolarHBondContact O-CG 3.36Å; A139-K143 PolarHBondContact O-N 3.26Å
140	V	68.6	Low	61	Low	44 Å²	44	72.4 Å²	72.4	27%	0.267	41%	0.41	S	S	.	.	H	α-helix	trans	-66.9	-42	173.1	174.9	0	0	0	0	110.9	L99 L130 A136 E137 H138 C142 K143 N144	L99-V140 HydrophobicContact CD2-CG2 4.29Å; L130-V140 HydrophobicContact CD2-CB 4.29Å; L130-V140 HydrophobicContact CD2-CG2 3.66Å; A136-V140 PolarHBondContact O-N 3.47Å; A136-V140 VanDerWaalsContact O-N 3.08Å; E137-V140 PolarHBondContact O-N 2.97Å; H138-V140 VanDerWaalsContact C-N 3.31Å; H138-V140 PolarHBondContact O-N 3.43Å; V140-C142 PolarHBondContact O-N 2.99Å; V140-K143 PolarHBondContact O-N 3.3Å; V140-N144 PolarHBondContact O-ND2 3.2Å
141	G	63.9	Low	60.1	Low	32 Å²	32	73.8 Å²	73.8	33%	0.33	42%	0.419	S	S	.	.	H	α-helix	trans	-60.3	-42.3	176.2	0	0	0	0	0	113.7	E137 H138 K143 N144	E137-G141 PolarHBondContact O-N 3.16Å; H138-G141 CarbonylContact O-C 3.57Å; H138-G141 WeakPolarHBondContact O-CA 3.38Å; H138-G141 PolarHBondContact O-N 3.03Å; H138-G141 VanDerWaalsContact O-N 3.12Å; G141-K143 VanDerWaalsContact C-N 3.34Å; G141-K143 PolarHBondContact O-N 3.21Å; G141-N144 WeakPolarHBondContact O-CB 3.45Å; G141-N144 PolarHBondContact O-N 3.29Å; G141-N144 VanDerWaalsContact O-N 3.13Å
142	C	61.2	Low	59.1	Low	5 Å²	5	69.8 Å²	69.8	3%	0.034	40%	0.404	C	S	.	.	H	α-helix	trans	-71.2	-27.4	-179.7	-65.1	0	0	0	0	113	C30 C73 H138 V140 N144 L145	C30-C142 HydrophobicContact CB-CB 4.29Å; C73-C142 HydrophobicContact CB-CB 4.3Å; C73-C142 WeakPolarHBondContact CB-SG 3.28Å; C73-C142 WeakPolarHBondContact SG-CB 3.49Å; C73-C142 CovalentContact SG-SG 2.07Å; C73-C142 PolarHBondContact SG-SG 3.14Å; H138-C142 PolarHBondContact CE1-SG 2.83Å; H138-C142 PolarHBondContact NE2-SG 3.41Å; H138-C142 PolarHBondContact O-N 3.13Å; H138-C142 PolarHBondContact O-SG 3.06Å; V140-C142 PolarHBondContact O-N 2.99Å; C142-N144 PolarHBondContact O-N 3.01Å; C142-L145 PolarHBondContact O-N 2.82Å
143	K	57.1	Low	58.1	Low	88 Å²	88	69.9 Å²	69.9	38%	0.383	40%	0.4	S	S	.	.	H	α-helix	trans	-58.7	-32.3	170.3	-70.8	176.4	-179.9	-178.8	0	111.5	I31 E103 A139 V140 G141 L145	I31-K143 HydrophobicContact CD1-CD 4.39Å; I31-K143 HydrophobicContact CD1-CG 4.34Å; E103-K143 VanDerWaalsContact CD-NZ 3.27Å; E103-K143 IonicContact OE1-NZ 3.65Å; E103-K143 PolarHBondContact OE1-NZ 3.29Å; E103-K143 IonicContact OE2-NZ 3.67Å; E103-K143 PolarHBondContact OE2-NZ 3.06Å; A139-K143 WeakPolarHBondContact O-CG 3.36Å; A139-K143 PolarHBondContact O-N 3.26Å; V140-K143 PolarHBondContact O-N 3.3Å; G141-K143 VanDerWaalsContact C-N 3.34Å; G141-K143 PolarHBondContact O-N 3.21Å; K143-L145 VanDerWaalsContact C-N 3.34Å
144	N	50.8	Low	57.2	Low	129 Å²	129	74.4 Å²	74.4	69%	0.69	43%	0.426	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.7	-4.8	-178.5	-59.7	-34.9	0	0	0	114.1	V140 G141 C142 L146	V140-N144 PolarHBondContact O-ND2 3.2Å; G141-N144 WeakPolarHBondContact O-CB 3.45Å; G141-N144 PolarHBondContact O-N 3.29Å; G141-N144 VanDerWaalsContact O-N 3.13Å; C142-N144 PolarHBondContact O-N 3.01Å; N144-L146 VanDerWaalsContact C-N 3.34Å
145	L	43.2	Very low	56.5	Low	130 Å²	130	77.5 Å²	77.5	68%	0.681	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.4	2.3	179.2	-70.7	172.8	0	0	0	113.6	C142 K143	C142-L145 PolarHBondContact O-N 2.82Å; K143-L145 VanDerWaalsContact C-N 3.34Å
146	L	33.5	Very low	55.7	Low	111 Å²	111	82.2 Å²	82.2	58%	0.581	46%	0.464	S	S	*	.	S	Bend	trans	-97.6	115.1	171.9	-68.9	172.5	0	0	0	109.2	N144 T148	N144-L146 VanDerWaalsContact C-N 3.34Å; L146-T148 PolarHBondContact O-N 2.77Å
147	P	39.2	Very low	54.7	Low	123 Å²	123	89.1 Å²	89.1	80%	0.799	50%	0.503	S	S	*	.			trans	-62.6	125.2	165.9	25.4	-29.2	0	0	0	108.3
148	T	38.1	Very low	53.5	Low	213 Å²	213	85.8 Å²	85.8	100%	1.307	50%	0.495	S	S	*	.			trans	-52.2	0	167.3	38.6	0	0	0	0	112.3	L146	L146-T148 PolarHBondContact O-N 2.77Å

Retrieved 148 of 148 residues in 194.4 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).