A0A077ZF62_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077ZF62, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 192 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	34.5	Very low	28.1	Very low	246 Å²	246	136.4 Å²	136.4	100%	1.212	82%	0.817	S	S	*	*				0	136.3	0	-72.7	179.9	121.4	0	0	108.1
2	S	31.4	Very low	28	Very low	120 Å²	120	132.8 Å²	132.8	84%	0.839	80%	0.803	S	S	*	*			trans	-21.8	152.3	177.2	-47.1	0	0	0	0	117.8
3	S	29.3	Very low	28	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	81%	0.807	S	S	*	*			cis	-171.1	143.5	1.1	31.2	0	0	0	0	107.7
4	S	28.4	Very low	28	Very low	105 Å²	105	136.4 Å²	136.4	73%	0.734	81%	0.808	S	S	*	*			trans	-63.6	147.6	163.9	-178.3	0	0	0	0	111.4
5	S	26.8	Very low	27.8	Very low	112 Å²	112	136.7 Å²	136.7	78%	0.783	80%	0.804	S	S	*	*			trans	-174.2	101.7	138.2	-72	0	0	0	0	110.6
6	V	25.4	Very low	27.6	Very low	134 Å²	134	139.7 Å²	139.7	81%	0.812	80%	0.804	S	S	*	*				86.1	112	105	-172.6	0	0	0	0	114.8
7	I	27.6	Very low	27.6	Very low	130 Å²	130	138.4 Å²	138.4	67%	0.667	80%	0.802	S	S	*	*			trans	-73	144.7	171.8	-61.5	166.7	0	0	0	110.5	N9	I7-N9 WeakPolarHBondContact CG2-OD1 3.38Å
8	L	25.7	Very low	27.4	Very low	169 Å²	169	136.8 Å²	136.8	89%	0.885	80%	0.796	S	S	*	*			trans	-140.6	112.4	138.1	-82.2	179.8	0	0	0	111.2
9	N	26.4	Very low	27.2	Very low	131 Å²	131	136.5 Å²	136.5	70%	0.701	80%	0.796	S	S	*	*			trans	-29.6	131.4	169.9	-55.2	-31.6	0	0	0	114.3	I7	I7-N9 WeakPolarHBondContact CG2-OD1 3.38Å
10	S	24.5	Very low	27.1	Very low	103 Å²	103	136.1 Å²	136.1	72%	0.72	79%	0.79	S	S	*	*				52.1	105.4	59.3	-177.8	0	0	0	0	114.6
11	T	28.7	Very low	26.8	Very low	138 Å²	138	140.5 Å²	140.5	85%	0.847	79%	0.793	S	S	*	*			trans	-140.9	95	133	47.8	0	0	0	0	109.4
12	S	27.4	Very low	26.3	Very low	93 Å²	93	134.6 Å²	134.6	65%	0.65	77%	0.77	S	S	*	*			trans	18.3	121.1	138.9	56	0	0	0	0	120.7
13	E	28.6	Very low	25.8	Very low	184 Å²	184	135.8 Å²	135.8	86%	0.86	77%	0.767	S	S	*	*				55.7	99.6	127.7	-62.9	-170.1	146.3	0	0	119.7
14	T	27.5	Very low	25.5	Very low	133 Å²	133	135.2 Å²	135.2	82%	0.816	77%	0.77	S	S	*	*				-156.8	125.4	122.8	-11.6	0	0	0	0	110.2
15	D	25.1	Very low	25.2	Very low	141 Å²	141	140.9 Å²	140.9	75%	0.754	78%	0.775	S	S	*	*			trans	46.4	111.3	158.7	-73.1	-53.9	0	0	0	120.8
16	K	23.8	Very low	25.2	Very low	184 Å²	184	147.1 Å²	147.1	80%	0.8	78%	0.781	S	S	*	*			trans	17.4	118.8	151	-65.4	174.2	-179.1	172.6	0	116.6
17	P	27.9	Very low	25.2	Very low	118 Å²	118	151.8 Å²	151.8	77%	0.766	78%	0.784	S	S	*	*			trans	-59.9	128.1	163.5	25.8	-30.6	0	0	0	108.2	V19	P17-V19 PolarHBondContact O-N 3.49Å; P17-V19 VanDerWaalsContact O-N 3.1Å
18	P	24.6	Very low	25	Very low	109 Å²	109	153.4 Å²	153.4	71%	0.708	79%	0.789	S	S	*	*			trans	-65.5	120.5	178.1	27.2	-30.6	0	0	0	107.2	I20	P18-I20 PolarHBondContact O-N 2.96Å
19	V	24.1	Very low	24.9	Very low	131 Å²	131	150 Å²	150	79%	0.794	78%	0.778	S	S	*	*			trans	-64.1	93.7	163.9	177.7	0	0	0	0	106.3	P17 R21	P17-V19 PolarHBondContact O-N 3.49Å; P17-V19 VanDerWaalsContact O-N 3.1Å; V19-R21 VanDerWaalsContact C-N 3.3Å; V19-R21 HydrophobicContact CG1-CG 4.46Å; V19-R21 PolarHBondContact O-N 2.87Å
20	I	23.9	Very low	24.7	Very low	129 Å²	129	150 Å²	150	66%	0.662	78%	0.778	S	S	*	*			trans	-69.5	94.6	171.3	-56.8	178.8	0	0	0	106.3	P18 V22	P18-I20 PolarHBondContact O-N 2.96Å; I20-V22 VanDerWaalsContact C-N 3.28Å; I20-V22 HydrophobicContact CG2-CG2 3.69Å; I20-V22 PolarHBondContact O-N 3.06Å
21	R	20.8	Very low	24.6	Very low	228 Å²	228	151.7 Å²	151.7	86%	0.86	78%	0.779	S	S	*	*			trans	-65.8	92.2	161.6	-76.1	-175.2	177.3	-176.4	-0.3	107.3	V19 N23	V19-R21 VanDerWaalsContact C-N 3.3Å; V19-R21 HydrophobicContact CG1-CG 4.46Å; V19-R21 PolarHBondContact O-N 2.87Å; R21-N23 VanDerWaalsContact C-N 3.32Å; R21-N23 PolarHBondContact O-N 2.69Å
22	V	23.8	Very low	24.4	Very low	122 Å²	122	151.4 Å²	151.4	74%	0.739	77%	0.772	S	S	*	*			trans	-71.2	96.5	171.2	-173.5	0	0	0	0	107.3	I20 A24	I20-V22 VanDerWaalsContact C-N 3.28Å; I20-V22 HydrophobicContact CG2-CG2 3.69Å; I20-V22 PolarHBondContact O-N 3.06Å; V22-A24 PolarHBondContact O-N 3.37Å
23	N	21.5	Very low	24.1	Very low	145 Å²	145	151.8 Å²	151.8	78%	0.775	78%	0.775	S	S	*	*			trans	-68.9	107.9	171.7	-143	-7.5	0	0	0	107	R21 R25	R21-N23 VanDerWaalsContact C-N 3.32Å; R21-N23 PolarHBondContact O-N 2.69Å; N23-R25 PolarHBondContact O-N 3.15Å
24	A	24.1	Very low	23.9	Very low	100 Å²	100	152.7 Å²	152.7	83%	0.826	78%	0.776	S	S	*	*			trans	-68.6	75.9	178	0	0	0	0	0	110.9	V22	V22-A24 PolarHBondContact O-N 3.37Å
25	R	22	Very low	23.9	Very low	224 Å²	224	152.5 Å²	152.5	85%	0.845	78%	0.776	S	S	*	*			trans	-145.4	108	165.5	-73.7	-164.3	177.4	-155.8	-0.5	110.7	N23	N23-R25 PolarHBondContact O-N 3.15Å
26	R	26.6	Very low	24	Very low	243 Å²	243	151.2 Å²	151.2	92%	0.917	78%	0.779	S	S	*	*			trans	24.8	126.5	151.8	-72.7	-176.2	175.7	-136.4	0.7	118.2
27	R	24.5	Very low	24.2	Very low	233 Å²	233	147 Å²	147	88%	0.879	77%	0.773	S	S	*	*				-179.2	125.7	114.4	-97.2	173.1	-162.4	-146.8	5.7	112.5
28	Q	23.1	Very low	24	Very low	164 Å²	164	148.9 Å²	148.9	77%	0.766	78%	0.776	S	S	*	*			trans	33.9	114	147.2	-77.2	165.4	-46.8	0	0	120	D30	Q28-D30 PolarHBondContact O-N 3.5Å
29	C	24.4	Very low	24.2	Very low	97 Å²	97	149.4 Å²	149.4	66%	0.655	78%	0.782	S	S	*	*			trans	-70.8	113.3	158.8	-53.4	0	0	0	0	109.5	D64	C29-D64 PolarHBondContact SG-OD2 3.29Å
30	D	22.3	Very low	24.2	Very low	131 Å²	131	153.4 Å²	153.4	70%	0.701	79%	0.789	S	S	*	*			trans	-110.7	118.3	169	-92.7	-45	0	0	0	110.9	Q28	Q28-D30 PolarHBondContact O-N 3.5Å
31	N	22.4	Very low	24.4	Very low	139 Å²	139	152.9 Å²	152.9	74%	0.743	80%	0.797	S	S	*	*			trans	33.5	111.6	152	-73.3	-57.2	0	0	0	120.5
32	L	24.8	Very low	24.6	Very low	131 Å²	131	147 Å²	147	69%	0.686	79%	0.79	S	S	*	*			trans	-111.2	108.7	158	-74.6	169.5	0	0	0	111.2	Q61	L32-Q61 HydrophobicContact CD1-CB 4.03Å; L32-Q61 HydrophobicContact CD1-CG 4.31Å; L32-Q61 WeakPolarHBondContact CD1-O 3.27Å
33	S	20.7	Very low	24.6	Very low	102 Å²	102	150.9 Å²	150.9	71%	0.713	80%	0.803	S	S	*	*			trans	-107.2	127.5	172.3	-61.7	0	0	0	0	110.8
34	K	24	Very low	24.6	Very low	203 Å²	203	147.3 Å²	147.3	88%	0.883	80%	0.8	S	S	*	*			trans	96.2	131.5	156.8	-61.9	-176	180	178.6	0	119.6
35	P	27.8	Very low	24.5	Very low	128 Å²	128	150.8 Å²	150.8	83%	0.831	80%	0.799	S	S	*	*			trans	-106.1	148.6	173.9	38.7	-28.5	0	0	0	113.3
36	S	26.4	Very low	24.5	Very low	115 Å²	115	149 Å²	149	80%	0.804	81%	0.806	S	S	*	*			trans	-167.8	152.2	159.4	66	0	0	0	0	107.6
37	S	27.7	Very low	24.3	Very low	96 Å²	96	145 Å²	145	67%	0.671	80%	0.797	S	S	*	*			cis	-176.7	154.4	-23.7	40	0	0	0	0	103.7
38	D	25.2	Very low	24.3	Very low	156 Å²	156	141.8 Å²	141.8	83%	0.834	80%	0.797	S	S	*	*			trans	72.8	100	163.4	-59.3	-34.8	0	0	0	120.1
39	S	27.6	Very low	24.4	Very low	120 Å²	120	137.3 Å²	137.3	84%	0.839	80%	0.795	S	S	*	*			trans	-157.7	136.8	131.8	66.2	0	0	0	0	111.3
40	K	23.9	Very low	24.5	Very low	216 Å²	216	139.6 Å²	139.6	94%	0.939	80%	0.796	S	S	*	*			trans	-77.1	120.6	172.5	-72	176.6	177	176.1	0	108.2
41	S	29.4	Very low	25.1	Very low	117 Å²	117	135.4 Å²	135.4	82%	0.818	77%	0.774	S	S	*	*			trans	-109	125.1	167.5	-173.2	0	0	0	0	110.8
42	S	23.7	Very low	25.8	Very low	104 Å²	104	132.3 Å²	132.3	73%	0.727	76%	0.76	S	S	*	*			trans	-70.4	145	-179	52.2	0	0	0	0	112.2	G44	S42-G44 PolarHBondContact O-N 3.3Å
43	M	23.9	Very low	26.5	Very low	205 Å²	205	131.3 Å²	131.3	100%	1.01	76%	0.764	S	S	*	*			trans	-48.8	113	167.3	-78.8	-166.6	-70.8	0	0	111.3
44	G	22.3	Very low	27.2	Very low	69 Å²	69	133.6 Å²	133.6	71%	0.711	76%	0.763	S	S	*	*			trans	-135	140.6	172.2	0	0	0	0	0	109.6	S42	S42-G44 PolarHBondContact O-N 3.3Å
45	Q	22.8	Very low	27.7	Very low	173 Å²	173	128.1 Å²	128.1	81%	0.808	74%	0.74	S	S	*	*			trans	-50.4	137.4	-166.9	-69.1	164.8	-31	0	0	114.9	Q47	Q45-Q47 PolarHBondContact O-N 3.5Å
46	L	21.6	Very low	28	Very low	188 Å²	188	123.9 Å²	123.9	98%	0.984	72%	0.716	S	S	*	*			trans	-58.6	97.9	167.8	-79.1	154.5	0	0	0	110.2
47	Q	21.8	Very low	28.4	Very low	158 Å²	158	124.2 Å²	124.2	74%	0.738	71%	0.705	S	S	*	*			trans	-110.5	124.5	163.1	-70.9	-173.4	1.2	0	0	107.7	Q45 G49	Q45-Q47 PolarHBondContact O-N 3.5Å; Q47-G49 PolarHBondContact O-N 3.24Å
48	N	24.4	Very low	28.6	Very low	165 Å²	165	122.9 Å²	122.9	88%	0.882	69%	0.693	S	S	*	*	S	Bend	trans	7.6	99.7	168.2	-59.1	-27.2	0	0	0	114.3	H50	N48-H50 PolarHBondContact O-N 3.31Å
49	G	25.9	Very low	28.9	Very low	70 Å²	70	116.1 Å²	116.1	72%	0.722	66%	0.658	S	S	*	*			trans	-56.4	93.4	-169.7	0	0	0	0	0	113.7	Q47	Q47-G49 PolarHBondContact O-N 3.24Å
50	H	26.9	Very low	29.2	Very low	146 Å²	146	118.9 Å²	118.9	68%	0.676	65%	0.649	S	S	*	*	P	Polyproline II helix	trans	-85.1	132.3	157	-160.9	-80.1	0	0	0	106.5	N48 T52	N48-H50 PolarHBondContact O-N 3.31Å; H50-T52 PolarHBondContact O-N 2.81Å; H50-T52 VanDerWaalsContact O-N 3.08Å
51	L	34.3	Very low	29.7	Very low	43 Å²	43	114.5 Å²	114.5	23%	0.225	63%	0.633	C	S	.	*	P	Polyproline II helix	trans	-58.7	119.6	165.9	-79.4	163.9	0	0	0	106.5	E55 A56 F171	L51-E55 HydrophobicContact CB-CB 4.44Å; L51-E55 HydrophobicContact CD2-CB 3.61Å; L51-A56 HydrophobicContact CB-CB 4.43Å; L51-F171 HydrophobicContact CD1-CD2 4.3Å; L51-F171 HydrophobicContact CD1-CE2 3.88Å; L51-F171 HydrophobicContact CD1-CZ 4.38Å
52	T	37	Very low	29.9	Very low	74 Å²	74	114.8 Å²	114.8	45%	0.454	62%	0.619	S	S	.	*	P	Polyproline II helix	trans	-60.1	153.5	169.1	59.5	0	0	0	0	108.7	H50 E54 E55 A56	H50-T52 PolarHBondContact O-N 2.81Å; H50-T52 VanDerWaalsContact O-N 3.08Å; T52-E54 PolarHBondContact O-N 3.21Å; T52-E54 VanDerWaalsContact O-N 3.12Å; T52-E55 PolarHBondContact N-OE2 2.92Å; T52-E55 PolarHBondContact O-N 3.49Å; T52-E55 VanDerWaalsContact OG1-CD 3.23Å; T52-E55 WeakPolarHBondContact OG1-CG 3.42Å; T52-E55 PolarHBondContact OG1-N 2.79Å; T52-E55 PolarHBondContact OG1-OE2 3.38Å; T52-A56 PolarHBondContact O-N 2.73Å
53	S	38.8	Very low	30.5	Very low	109 Å²	109	110.6 Å²	110.6	76%	0.762	59%	0.59	S	S	*	*	H	α-helix	trans	-52.8	-36.9	-179.3	-52.6	0	0	0	0	112.1	E57	S53-E57 WeakPolarHBondContact O-CB 3.15Å; S53-E57 PolarHBondContact O-N 3.22Å
54	E	36.3	Very low	31.1	Very low	151 Å²	151	106 Å²	106	71%	0.706	57%	0.569	S	S	*	*	H	α-helix	trans	-64.8	-41.4	174.2	-74.8	-174.7	147.1	0	0	113.2	T52 E57 T58	T52-E54 PolarHBondContact O-N 3.21Å; T52-E54 VanDerWaalsContact O-N 3.12Å; E54-E57 PolarHBondContact O-N 3.13Å; E54-T58 WeakPolarHBondContact O-CB 3.16Å; E54-T58 PolarHBondContact O-N 3.44Å; E54-T58 PolarHBondContact O-OG1 3.19Å
55	E	33.5	Very low	31.9	Very low	87 Å²	87	104 Å²	104	41%	0.407	54%	0.544	S	S	.	.	H	α-helix	trans	-70.9	-37.3	178.7	-70.8	169.1	132.5	0	0	111.7	L51 T52 E57 T58 V59	L51-E55 HydrophobicContact CB-CB 4.44Å; L51-E55 HydrophobicContact CD2-CB 3.61Å; T52-E55 PolarHBondContact N-OE2 2.92Å; T52-E55 PolarHBondContact O-N 3.49Å; T52-E55 VanDerWaalsContact OG1-CD 3.23Å; T52-E55 WeakPolarHBondContact OG1-CG 3.42Å; T52-E55 PolarHBondContact OG1-N 2.79Å; T52-E55 PolarHBondContact OG1-OE2 3.38Å; E55-E57 VanDerWaalsContact C-N 3.31Å; E55-T58 PolarHBondContact O-N 3.08Å; E55-V59 VanDerWaalsContact O-CB 3.3Å; E55-V59 WeakPolarHBondContact O-CB 3.32Å; E55-V59 WeakPolarHBondContact O-CG2 3.32Å; E55-V59 PolarHBondContact O-N 3.06Å
56	A	35.4	Very low	32.8	Very low	39 Å²	39	98.4 Å²	98.4	32%	0.322	52%	0.515	S	S	.	.	H	α-helix	trans	-61.2	-42.4	171.5	0	0	0	0	0	110.7	L51 T52 V59 R60	L51-A56 HydrophobicContact CB-CB 4.43Å; T52-A56 PolarHBondContact O-N 2.73Å; A56-V59 PolarHBondContact O-N 3.32Å; A56-R60 VanDerWaalsContact O-CB 3.29Å; A56-R60 WeakPolarHBondContact O-CB 3.46Å; A56-R60 PolarHBondContact O-N 2.85Å
57	E	34.7	Very low	33.7	Very low	122 Å²	122	91.5 Å²	91.5	57%	0.57	48%	0.479	S	S	*	.	H	α-helix	trans	-68.7	-39.7	178.1	-162.3	166.4	-153.3	0	0	112.7	S53 E54 E55 V59 R60 Q61	S53-E57 WeakPolarHBondContact O-CB 3.15Å; S53-E57 PolarHBondContact O-N 3.22Å; E54-E57 PolarHBondContact O-N 3.13Å; E55-E57 VanDerWaalsContact C-N 3.31Å; E57-V59 VanDerWaalsContact C-N 3.3Å; E57-V59 PolarHBondContact O-N 3.37Å; E57-R60 WeakPolarHBondContact O-CB 3.37Å; E57-R60 PolarHBondContact O-N 3.43Å; E57-R60 VanDerWaalsContact O-N 3.17Å; E57-Q61 PolarHBondContact O-N 3Å
58	T	32.3	Very low	34.5	Very low	68 Å²	68	88.7 Å²	88.7	42%	0.417	48%	0.477	S	S	.	.	H	α-helix	trans	-62.2	-39.9	175.9	-57.1	0	0	0	0	111.9	E54 E55 K62	E54-T58 WeakPolarHBondContact O-CB 3.16Å; E54-T58 PolarHBondContact O-N 3.44Å; E54-T58 PolarHBondContact O-OG1 3.19Å; E55-T58 PolarHBondContact O-N 3.08Å; T58-K62 WeakPolarHBondContact O-CB 3.46Å; T58-K62 WeakPolarHBondContact O-CG 3.28Å; T58-K62 PolarHBondContact O-N 2.73Å; T58-K62 VanDerWaalsContact O-N 3.15Å
59	V	31.3	Very low	35.1	Very low	15 Å²	15	83.5 Å²	83.5	9%	0.091	45%	0.449	C	S	.	.	H	α-helix	trans	-69.4	-42.2	174.6	150.4	0	0	0	0	111.5	E55 A56 E57 Q61 K62 S63 R66	E55-V59 VanDerWaalsContact O-CB 3.3Å; E55-V59 WeakPolarHBondContact O-CB 3.32Å; E55-V59 WeakPolarHBondContact O-CG2 3.32Å; E55-V59 PolarHBondContact O-N 3.06Å; A56-V59 PolarHBondContact O-N 3.32Å; E57-V59 VanDerWaalsContact C-N 3.3Å; E57-V59 PolarHBondContact O-N 3.37Å; V59-Q61 VanDerWaalsContact C-N 3.34Å; V59-K62 CarbonylContact O-C 3.53Å; V59-K62 PolarHBondContact O-N 3.29Å; V59-S63 PolarHBondContact O-N 3.29Å; V59-S63 PolarHBondContact O-OG 3.32Å; V59-R66 HydrophobicContact CG1-CG 4.14Å
60	R	32.8	Very low	35.4	Very low	177 Å²	177	85.5 Å²	85.5	67%	0.668	45%	0.447	S	S	*	.	H	α-helix	trans	-63.3	-42.5	179	-148.6	177.1	-177	-177.4	0.5	110.5	A56 E57 K62	A56-R60 VanDerWaalsContact O-CB 3.29Å; A56-R60 WeakPolarHBondContact O-CB 3.46Å; A56-R60 PolarHBondContact O-N 2.85Å; E57-R60 WeakPolarHBondContact O-CB 3.37Å; E57-R60 PolarHBondContact O-N 3.43Å; E57-R60 VanDerWaalsContact O-N 3.17Å; R60-K62 VanDerWaalsContact C-N 3.29Å; R60-K62 PolarHBondContact O-N 3.15Å
61	Q	34.4	Very low	35.8	Very low	125 Å²	125	86 Å²	86	58%	0.584	46%	0.455	S	S	*	.	H	α-helix	trans	-61.6	-34.4	170.4	-82.8	-174.1	-5.2	0	0	112.6	L32 E57 V59	L32-Q61 HydrophobicContact CD1-CB 4.03Å; L32-Q61 HydrophobicContact CD1-CG 4.31Å; L32-Q61 WeakPolarHBondContact CD1-O 3.27Å; E57-Q61 PolarHBondContact O-N 3Å; V59-Q61 VanDerWaalsContact C-N 3.34Å
62	K	34.4	Very low	35.6	Very low	122 Å²	122	86.3 Å²	86.3	53%	0.53	47%	0.468	S	S	.	.	H	α-helix	trans	-91.2	-13.4	-174.1	-81.5	-179.5	179	176.7	0	115.3	T58 V59 R60 K181	T58-K62 WeakPolarHBondContact O-CB 3.46Å; T58-K62 WeakPolarHBondContact O-CG 3.28Å; T58-K62 PolarHBondContact O-N 2.73Å; T58-K62 VanDerWaalsContact O-N 3.15Å; V59-K62 CarbonylContact O-C 3.53Å; V59-K62 PolarHBondContact O-N 3.29Å; R60-K62 VanDerWaalsContact C-N 3.29Å; R60-K62 PolarHBondContact O-N 3.15Å; K62-K181 PolarHBondContact O-NZ 3.03Å; K62-K181 VanDerWaalsContact O-NZ 3.12Å
63	S	35.2	Very low	35.5	Very low	16 Å²	16	84.3 Å²	84.3	11%	0.112	46%	0.459	C	S	.	.			trans	-160	117	176.3	57.6	0	0	0	0	110.8	V59 C65	V59-S63 PolarHBondContact O-N 3.29Å; V59-S63 PolarHBondContact O-OG 3.32Å; S63-C65 PolarHBondContact O-N 3.45Å
64	D	38	Very low	35.4	Very low	110 Å²	110	80.7 Å²	80.7	59%	0.588	43%	0.43	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68.1	11.3	171.5	-71.6	-35.1	0	0	0	113.6	C29	C29-D64 PolarHBondContact SG-OD2 3.29Å
65	C	37.8	Very low	35.5	Very low	26 Å²	26	76.4 Å²	76.4	18%	0.176	42%	0.42	C	S	.	.	T	Hydrogen-bonded Turn	trans	-101.4	15.5	-167.3	-53.5	0	0	0	0	114.8	S63 M174 C175	S63-C65 PolarHBondContact O-N 3.45Å; C65-M174 PolarHBondContact O-N 3.05Å; C65-M174 VanDerWaalsContact O-N 3.08Å; C65-C175 HydrophobicContact CB-CB 3.78Å; C65-C175 WeakPolarHBondContact CB-SG 3.38Å; C65-C175 WeakPolarHBondContact SG-CB 3.36Å; C65-C175 CovalentContact SG-SG 2.04Å; C65-C175 PolarHBondContact SG-SG 3.4Å
66	R	41.9	Very low	35.9	Very low	55 Å²	55	76.4 Å²	76.4	21%	0.208	42%	0.423	C	S	.	.	B	Isolated β-bridge	trans	-113.1	135.1	-178	-57.1	-154	-165.9	175.7	6	111.5	V59	V59-R66 HydrophobicContact CG1-CG 4.14Å
67	I	41.3	Very low	36.2	Very low	43 Å²	43	76.7 Å²	76.7	22%	0.221	42%	0.417	C	S	.	.			trans	-98.1	119.9	169.4	-57.2	172.9	0	0	0	106.8	L69 F157 M174	I67-L69 HydrophobicContact CG2-CD2 4.27Å; I67-L69 PolarHBondContact O-N 3.16Å; I67-F157 HydrophobicContact CD1-CB 4.25Å; I67-F157 HydrophobicContact CD1-CD1 3.43Å; I67-F157 VanDerWaalsContact CD1-CD1 3.43Å; I67-F157 HydrophobicContact CD1-CD2 4.39Å; I67-F157 HydrophobicContact CD1-CE1 3.83Å; I67-F157 HydrophobicContact CD1-CG 3.76Å; I67-F157 HydrophobicContact CD1-CZ 4.47Å; I67-M174 HydrophobicContact CD1-CG 4.12Å; I67-M174 HydrophobicContact CD1-SD 3.62Å; I67-M174 HydrophobicContact CG1-CE 4.24Å; I67-M174 HydrophobicContact CG1-CG 4.24Å; I67-M174 HydrophobicContact CG1-SD 3.71Å
68	S	38.6	Very low	36.6	Very low	100 Å²	100	72.2 Å²	72.2	70%	0.699	40%	0.397	S	S	*	.			trans	-70.3	114.8	165.8	-63.1	0	0	0	0	108.2
69	L	35.3	Very low	37.2	Very low	56 Å²	56	73.3 Å²	73.3	29%	0.293	40%	0.397	S	S	.	.	P	Polyproline II helix	trans	-87.1	132.9	171.6	-66.9	172.8	0	0	0	108.3	I67 A73 F74 P172	I67-L69 HydrophobicContact CG2-CD2 4.27Å; I67-L69 PolarHBondContact O-N 3.16Å; L69-A73 HydrophobicContact CB-CB 4.23Å; L69-F74 HydrophobicContact CB-CB 4.4Å; L69-F74 HydrophobicContact CD1-CB 4.06Å; L69-F74 HydrophobicContact CD1-CD2 3.87Å; L69-F74 HydrophobicContact CD1-CG 4.43Å; L69-P172 HydrophobicContact CD1-CG 4.48Å
70	T	33.5	Very low	37.8	Very low	112 Å²	112	81 Å²	81	69%	0.687	43%	0.425	S	S	*	.	P	Polyproline II helix	trans	-59.9	153.6	173.8	43.2	0	0	0	0	111.2	G72 A73	T70-G72 PolarHBondContact O-N 3.48Å; T70-A73 VanDerWaalsContact O-CB 3.24Å; T70-A73 WeakPolarHBondContact O-CB 3.38Å; T70-A73 PolarHBondContact O-N 3.22Å
71	D	35.1	Very low	38.3	Very low	157 Å²	157	74.2 Å²	74.2	84%	0.84	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-46.6	130	176.1	-82.1	-27.7	0	0	0	111.5	A73	D71-A73 VanDerWaalsContact C-N 3.28Å; D71-A73 PolarHBondContact O-N 3.45Å
72	G	29.6	Very low	38.7	Very low	48 Å²	48	73.2 Å²	73.2	50%	0.495	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	83	-24.1	-176.7	0	0	0	0	0	115.9	T70 F74 A75 D76	T70-G72 PolarHBondContact O-N 3.48Å; G72-F74 VanDerWaalsContact C-N 3.25Å; G72-F74 PolarHBondContact O-N 3.23Å; G72-A75 WeakPolarHBondContact O-CB 3.36Å; G72-A75 PolarHBondContact O-N 2.72Å; G72-A75 VanDerWaalsContact O-N 3.11Å; G72-D76 PolarHBondContact O-N 3.07Å
73	A	34.6	Very low	39.1	Very low	32 Å²	32	75 Å²	75	26%	0.264	40%	0.398	S	S	.	.	H	α-helix	trans	-67.3	-28.8	179.7	0	0	0	0	0	112.5	L69 T70 D71 F77	L69-A73 HydrophobicContact CB-CB 4.23Å; T70-A73 VanDerWaalsContact O-CB 3.24Å; T70-A73 WeakPolarHBondContact O-CB 3.38Å; T70-A73 PolarHBondContact O-N 3.22Å; D71-A73 VanDerWaalsContact C-N 3.28Å; D71-A73 PolarHBondContact O-N 3.45Å; A73-F77 VanDerWaalsContact O-CB 3.24Å; A73-F77 WeakPolarHBondContact O-CB 3.4Å; A73-F77 PolarHBondContact O-N 3.43Å
74	F	37.8	Very low	39.1	Very low	33 Å²	33	83 Å²	83	15%	0.145	43%	0.426	C	S	.	.	H	α-helix	trans	-76.4	-33.8	172.9	-175.2	-114.3	0	0	0	112.7	L69 G72 F77 L78 E168 S170	L69-F74 HydrophobicContact CB-CB 4.4Å; L69-F74 HydrophobicContact CD1-CB 4.06Å; L69-F74 HydrophobicContact CD1-CD2 3.87Å; L69-F74 HydrophobicContact CD1-CG 4.43Å; G72-F74 VanDerWaalsContact C-N 3.25Å; G72-F74 PolarHBondContact O-N 3.23Å; F74-F77 HydrophobicContact CD2-CB 4.46Å; F74-F77 AromaticContact CD2-CD1 3.84Å; F74-F77 HydrophobicContact CD2-CD1 3.84Å; F74-F77 AromaticContact CE2-CD1 3.8Å; F74-F77 HydrophobicContact CE2-CD1 3.8Å; F74-F77 HydrophobicContact CE2-CE1 4.25Å; F74-F77 WeakPolarHBondContact O-CB 3.34Å; F74-F77 PolarHBondContact O-N 2.98Å; F74-L78 HydrophobicContact CD1-CD1 3.86Å; F74-L78 HydrophobicContact CD1-CG 4.28Å; F74-L78 HydrophobicContact CE1-CD1 3.51Å; F74-L78 HydrophobicContact CE1-CD2 4.39Å; F74-L78 HydrophobicContact CE1-CG 3.91Å; F74-L78 HydrophobicContact CE2-CD2 4.43Å; F74-L78 HydrophobicContact CE2-CG 4.19Å; F74-L78 HydrophobicContact CZ-CD1 3.93Å; F74-L78 HydrophobicContact CZ-CD2 3.94Å; F74-L78 HydrophobicContact CZ-CG 3.82Å; F74-L78 WeakPolarHBondContact O-CB 3.35Å; F74-L78 WeakPolarHBondContact O-CG 3.11Å; F74-L78 PolarHBondContact O-N 2.72Å; F74-E168 WeakPolarHBondContact CE1-O 3.45Å; F74-E168 WeakPolarHBondContact CZ-O 3.46Å; F74-S170 WeakPolarHBondContact CE2-O 3.25Å; F74-S170 WeakPolarHBondContact CZ-O 3.28Å
75	A	37.5	Very low	38.9	Very low	61 Å²	61	82.2 Å²	82.2	50%	0.504	42%	0.421	S	S	.	.	H	α-helix	trans	-64.2	-43.9	171.5	0	0	0	0	0	110.7	G72 F77 L78 E79	G72-A75 WeakPolarHBondContact O-CB 3.36Å; G72-A75 PolarHBondContact O-N 2.72Å; G72-A75 VanDerWaalsContact O-N 3.11Å; A75-F77 VanDerWaalsContact C-N 3.33Å; A75-F77 PolarHBondContact O-N 2.88Å; A75-L78 PolarHBondContact O-N 3.46Å; A75-E79 WeakPolarHBondContact O-CB 3.19Å; A75-E79 PolarHBondContact O-N 2.76Å
76	D	42.6	Very low	38.6	Very low	88 Å²	88	87.1 Å²	87.1	47%	0.471	45%	0.45	S	S	.	.	H	α-helix	trans	-62.1	-38.5	171.7	-95.3	8.1	0	0	0	112.5	G72 E79 R80	G72-D76 PolarHBondContact O-N 3.07Å; D76-E79 PolarHBondContact O-N 3.32Å; D76-R80 WeakPolarHBondContact O-CB 3.35Å; D76-R80 WeakPolarHBondContact O-CG 3.2Å; D76-R80 PolarHBondContact O-N 3.45Å
77	F	42.5	Very low	37.9	Very low	44 Å²	44	95.4 Å²	95.4	19%	0.193	48%	0.481	C	S	.	.	H	α-helix	trans	-65.1	-45.1	175	175.2	-99	0	0	0	111.6	A73 F74 A75 R80 M81 I152 V162 P172	A73-F77 VanDerWaalsContact O-CB 3.24Å; A73-F77 WeakPolarHBondContact O-CB 3.4Å; A73-F77 PolarHBondContact O-N 3.43Å; F74-F77 HydrophobicContact CD2-CB 4.46Å; F74-F77 AromaticContact CD2-CD1 3.84Å; F74-F77 HydrophobicContact CD2-CD1 3.84Å; F74-F77 AromaticContact CE2-CD1 3.8Å; F74-F77 HydrophobicContact CE2-CD1 3.8Å; F74-F77 HydrophobicContact CE2-CE1 4.25Å; F74-F77 WeakPolarHBondContact O-CB 3.34Å; F74-F77 PolarHBondContact O-N 2.98Å; A75-F77 VanDerWaalsContact C-N 3.33Å; A75-F77 PolarHBondContact O-N 2.88Å; F77-R80 PolarHBondContact O-N 3.34Å; F77-M81 HydrophobicContact CE1-CE 4.27Å; F77-M81 HydrophobicContact CE1-CG 4.28Å; F77-M81 HydrophobicContact CZ-CG 4.33Å; F77-M81 WeakPolarHBondContact O-CB 3.34Å; F77-M81 PolarHBondContact O-N 3.3Å; F77-I152 HydrophobicContact CZ-CD1 4.02Å; F77-V162 HydrophobicContact CZ-CG2 4.5Å; F77-P172 HydrophobicContact CZ-CB 4.49Å; F77-P172 HydrophobicContact CZ-CG 4.49Å
78	L	42	Very low	37.3	Very low	29 Å²	29	94.5 Å²	94.5	15%	0.152	48%	0.482	C	S	.	.	H	α-helix	trans	-64.4	-38.9	173.4	-76.5	170.5	0	0	0	111.8	F74 A75 M81 K82 E168	F74-L78 HydrophobicContact CD1-CD1 3.86Å; F74-L78 HydrophobicContact CD1-CG 4.28Å; F74-L78 HydrophobicContact CE1-CD1 3.51Å; F74-L78 HydrophobicContact CE1-CD2 4.39Å; F74-L78 HydrophobicContact CE1-CG 3.91Å; F74-L78 HydrophobicContact CE2-CD2 4.43Å; F74-L78 HydrophobicContact CE2-CG 4.19Å; F74-L78 HydrophobicContact CZ-CD1 3.93Å; F74-L78 HydrophobicContact CZ-CD2 3.94Å; F74-L78 HydrophobicContact CZ-CG 3.82Å; F74-L78 WeakPolarHBondContact O-CB 3.35Å; F74-L78 WeakPolarHBondContact O-CG 3.11Å; F74-L78 PolarHBondContact O-N 2.72Å; A75-L78 PolarHBondContact O-N 3.46Å; L78-M81 CarbonylContact O-C 3.52Å; L78-M81 WeakPolarHBondContact O-CB 3.45Å; L78-M81 PolarHBondContact O-N 3.44Å; L78-K82 WeakPolarHBondContact O-CB 3.33Å; L78-K82 WeakPolarHBondContact O-CG 3.39Å; L78-K82 PolarHBondContact O-N 2.88Å; L78-E168 HydrophobicContact CD1-CB 4.37Å; L78-E168 WeakPolarHBondContact CD1-O 3.47Å
79	E	45.3	Very low	36.8	Very low	90 Å²	90	95 Å²	95	42%	0.421	48%	0.477	S	S	.	.	H	α-helix	trans	-68.8	-39.7	178.1	-139.1	-146.7	149.2	0	0	110.7	A75 D76 K82 R83	A75-E79 WeakPolarHBondContact O-CB 3.19Å; A75-E79 PolarHBondContact O-N 2.76Å; D76-E79 PolarHBondContact O-N 3.32Å; E79-K82 PolarHBondContact O-N 3.47Å; E79-R83 WeakPolarHBondContact O-CB 3.15Å; E79-R83 WeakPolarHBondContact O-CG 2.94Å; E79-R83 PolarHBondContact O-N 3.11Å; E79-R83 IonicContact OE1-CZ 3.89Å; E79-R83 IonicContact OE1-NE 3.41Å; E79-R83 PolarHBondContact OE1-NE 3.08Å; E79-R83 IonicContact OE1-NH2 2.98Å; E79-R83 PolarHBondContact OE1-NH2 2.87Å; E79-R83 IonicContact OE2-CZ 2.79Å; E79-R83 IonicContact OE2-NH2 3.29Å; E79-R83 PolarHBondContact OE2-NH2 2.78Å
80	R	44.4	Very low	36.6	Very low	177 Å²	177	96.7 Å²	96.7	67%	0.668	50%	0.499	S	S	*	.	H	α-helix	trans	-62.5	-42.4	169.4	-79.7	-179.3	-155	-173.3	7.5	111.8	D76 F77 R84	D76-R80 WeakPolarHBondContact O-CB 3.35Å; D76-R80 WeakPolarHBondContact O-CG 3.2Å; D76-R80 PolarHBondContact O-N 3.45Å; F77-R80 PolarHBondContact O-N 3.34Å; R80-R84 WeakPolarHBondContact O-CB 2.99Å; R80-R84 WeakPolarHBondContact O-CG 3.45Å; R80-R84 PolarHBondContact O-N 3.44Å
81	M	42.8	Very low	36.6	Very low	35 Å²	35	100 Å²	100	17%	0.172	50%	0.504	C	S	.	.	H	α-helix	trans	-62.4	-47.7	175.2	-99.4	-119.1	-75.2	0	0	111.2	F77 L78 R84 L85 I152 V162	F77-M81 HydrophobicContact CE1-CE 4.27Å; F77-M81 HydrophobicContact CE1-CG 4.28Å; F77-M81 HydrophobicContact CZ-CG 4.33Å; F77-M81 WeakPolarHBondContact O-CB 3.34Å; F77-M81 PolarHBondContact O-N 3.3Å; L78-M81 CarbonylContact O-C 3.52Å; L78-M81 WeakPolarHBondContact O-CB 3.45Å; L78-M81 PolarHBondContact O-N 3.44Å; M81-R84 CarbonylContact O-C 3.59Å; M81-R84 PolarHBondContact O-N 3.29Å; M81-L85 HydrophobicContact CB-CD1 4.46Å; M81-L85 VanDerWaalsContact O-CB 3.27Å; M81-L85 WeakPolarHBondContact O-CB 3.47Å; M81-L85 WeakPolarHBondContact O-CG 3.16Å; M81-L85 PolarHBondContact O-N 2.72Å; M81-L85 HydrophobicContact SD-CD1 4.04Å; M81-I152 HydrophobicContact CE-CD1 4.09Å; M81-I152 HydrophobicContact CG-CD1 4.12Å; M81-I152 HydrophobicContact SD-CD1 3.3Å; M81-I152 WeakPolarHBondContact SD-CD1 3.19Å; M81-I152 HydrophobicContact SD-CG1 4.38Å; M81-V162 HydrophobicContact CE-CG1 4.21Å
82	K	42.6	Very low	36.4	Very low	103 Å²	103	98.1 Å²	98.1	45%	0.448	49%	0.494	S	S	.	.	H	α-helix	trans	-60.7	-46.9	176.2	-78.2	178.1	177.3	179	0	111	L78 E79 R84 L85 V86 E168	L78-K82 WeakPolarHBondContact O-CB 3.33Å; L78-K82 WeakPolarHBondContact O-CG 3.39Å; L78-K82 PolarHBondContact O-N 2.88Å; E79-K82 PolarHBondContact O-N 3.47Å; K82-R84 VanDerWaalsContact C-N 3.27Å; K82-R84 PolarHBondContact O-N 3.49Å; K82-L85 PolarHBondContact O-N 3.41Å; K82-V86 WeakPolarHBondContact O-CB 3.4Å; K82-V86 WeakPolarHBondContact O-CG2 3.49Å; K82-V86 PolarHBondContact O-N 3.49Å; K82-E168 WeakPolarHBondContact CE-OE1 3.43Å; K82-E168 IonicContact NZ-OE1 3.65Å; K82-E168 PolarHBondContact NZ-OE1 3.24Å
83	R	42.9	Very low	36.5	Very low	161 Å²	161	99.3 Å²	99.3	61%	0.608	48%	0.484	S	S	*	.	H	α-helix	trans	-62.6	-31.6	176.5	-74.5	-175.8	-152.6	-179	10.6	113.2	E79	E79-R83 WeakPolarHBondContact O-CB 3.15Å; E79-R83 WeakPolarHBondContact O-CG 2.94Å; E79-R83 PolarHBondContact O-N 3.11Å; E79-R83 IonicContact OE1-CZ 3.89Å; E79-R83 IonicContact OE1-NE 3.41Å; E79-R83 PolarHBondContact OE1-NE 3.08Å; E79-R83 IonicContact OE1-NH2 2.98Å; E79-R83 PolarHBondContact OE1-NH2 2.87Å; E79-R83 IonicContact OE2-CZ 2.79Å; E79-R83 IonicContact OE2-NH2 3.29Å; E79-R83 PolarHBondContact OE2-NH2 2.78Å
84	R	35.3	Very low	36.2	Very low	184 Å²	184	104.4 Å²	104.4	69%	0.694	50%	0.502	S	S	*	.	H	α-helix	trans	-83	-37.9	175.5	-76.7	-170.7	177.2	-167.3	0.3	113.3	R80 M81 K82 R87 G88	R80-R84 WeakPolarHBondContact O-CB 2.99Å; R80-R84 WeakPolarHBondContact O-CG 3.45Å; R80-R84 PolarHBondContact O-N 3.44Å; M81-R84 CarbonylContact O-C 3.59Å; M81-R84 PolarHBondContact O-N 3.29Å; K82-R84 VanDerWaalsContact C-N 3.27Å; K82-R84 PolarHBondContact O-N 3.49Å; R84-R87 CarbonylContact O-C 3.58Å; R84-R87 PolarHBondContact O-N 2.93Å; R84-G88 WeakPolarHBondContact O-CA 3.42Å; R84-G88 PolarHBondContact O-N 3.11Å
85	L	33.1	Very low	35.8	Very low	93 Å²	93	108 Å²	108	49%	0.487	53%	0.527	S	S	.	.	H	α-helix	trans	-68.5	-32.7	176	-83.7	157.6	0	0	0	112.2	M81 K82 R87 Y93	M81-L85 HydrophobicContact CB-CD1 4.46Å; M81-L85 VanDerWaalsContact O-CB 3.27Å; M81-L85 WeakPolarHBondContact O-CB 3.47Å; M81-L85 WeakPolarHBondContact O-CG 3.16Å; M81-L85 PolarHBondContact O-N 2.72Å; M81-L85 HydrophobicContact SD-CD1 4.04Å; K82-L85 PolarHBondContact O-N 3.41Å; L85-R87 VanDerWaalsContact C-N 3.27Å; L85-R87 PolarHBondContact O-N 2.74Å; L85-Y93 HydrophobicContact CD2-CE2 4.21Å; L85-Y93 VanDerWaalsContact CD2-OH 3.32Å; L85-Y93 WeakPolarHBondContact CD2-OH 3.42Å; L85-Y93 WeakPolarHBondContact CG-OH 3.39Å
86	V	31.1	Very low	35.6	Very low	129 Å²	129	108.1 Å²	108.1	78%	0.782	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.3	-17.2	174.9	176.5	0	0	0	0	112	K82	K82-V86 WeakPolarHBondContact O-CB 3.4Å; K82-V86 WeakPolarHBondContact O-CG2 3.49Å; K82-V86 PolarHBondContact O-N 3.49Å
87	R	28	Very low	35	Very low	229 Å²	229	109.8 Å²	109.8	86%	0.864	54%	0.541	S	S	*	.	T	Hydrogen-bonded Turn	trans	-110.1	-14.1	177.2	-82.5	-173.1	169.7	-170	-2	115	R84 L85	R84-R87 CarbonylContact O-C 3.58Å; R84-R87 PolarHBondContact O-N 2.93Å; L85-R87 VanDerWaalsContact C-N 3.27Å; L85-R87 PolarHBondContact O-N 2.74Å
88	G	28.1	Very low	34.2	Very low	23 Å²	23	112.4 Å²	112.4	24%	0.237	56%	0.56	C	S	.	*			trans	-88.4	118.6	-173	0	0	0	0	0	111	R84	R84-G88 WeakPolarHBondContact O-CA 3.42Å; R84-G88 PolarHBondContact O-N 3.11Å
89	N	28.3	Very low	33.8	Very low	112 Å²	112	114.9 Å²	114.9	60%	0.599	59%	0.585	S	S	*	*			trans	-62.4	142.5	162.3	-79	-54	0	0	0	107.1	K91 D92	N89-K91 HydrophobicContact CB-CB 4.47Å; N89-K91 HydrophobicContact CB-CD 4.45Å; N89-K91 HydrophobicContact CB-CG 4.2Å; N89-K91 PolarHBondContact O-N 3.25Å; N89-D92 PolarHBondContact N-OD2 3.34Å; N89-D92 PolarHBondContact O-N 2.67Å
90	A	30.9	Very low	33.2	Very low	90 Å²	90	114.8 Å²	114.8	74%	0.744	59%	0.592	S	S	*	*	G	3₁₀ helix	trans	-50.1	-14.7	178.8	0	0	0	0	0	115	D92 Y93	A90-D92 VanDerWaalsContact C-N 3.26Å; A90-D92 PolarHBondContact O-N 3.48Å; A90-Y93 PolarHBondContact O-N 3.21Å
91	K	33.4	Very low	32.6	Very low	182 Å²	182	115.4 Å²	115.4	79%	0.791	60%	0.6	S	S	*	*	G	3₁₀ helix	trans	-65.3	-21.6	174.7	-47.2	-177.8	-173.5	-175.3	0	114	N89 Y93	N89-K91 HydrophobicContact CB-CB 4.47Å; N89-K91 HydrophobicContact CB-CD 4.45Å; N89-K91 HydrophobicContact CB-CG 4.2Å; N89-K91 PolarHBondContact O-N 3.25Å; K91-Y93 VanDerWaalsContact C-N 3.27Å; K91-Y93 PolarHBondContact O-N 3.27Å
92	D	31.6	Very low	32.2	Very low	118 Å²	118	118.7 Å²	118.7	63%	0.631	63%	0.626	S	S	*	*	G	3₁₀ helix	trans	-83.6	-5.4	-177.4	-59.5	-38.6	0	0	0	112.9	N89 A90	N89-D92 PolarHBondContact N-OD2 3.34Å; N89-D92 PolarHBondContact O-N 2.67Å; A90-D92 VanDerWaalsContact C-N 3.26Å; A90-D92 PolarHBondContact O-N 3.48Å
93	Y	30.8	Very low	31.5	Very low	73 Å²	73	118.9 Å²	118.9	29%	0.286	63%	0.632	S	S	.	*			trans	-108.8	97.7	178.1	-60.4	-86.8	0	0	0	109.2	L85 A90 K91 V95 V150	L85-Y93 HydrophobicContact CD2-CE2 4.21Å; L85-Y93 VanDerWaalsContact CD2-OH 3.32Å; L85-Y93 WeakPolarHBondContact CD2-OH 3.42Å; L85-Y93 WeakPolarHBondContact CG-OH 3.39Å; A90-Y93 PolarHBondContact O-N 3.21Å; K91-Y93 VanDerWaalsContact C-N 3.27Å; K91-Y93 PolarHBondContact O-N 3.27Å; Y93-V95 PolarHBondContact O-N 2.91Å; Y93-V95 VanDerWaalsContact O-N 3.15Å; Y93-V150 HydrophobicContact CD1-CG1 4.29Å
94	E	28.9	Very low	31.3	Very low	138 Å²	138	117 Å²	117	65%	0.645	64%	0.64	S	S	*	*			trans	-69.5	106.9	167.2	-83.2	-171.1	144.3	0	0	108.9	R153	E94-R153 IonicContact OE2-CZ 3.67Å; E94-R153 IonicContact OE2-NH1 3.4Å; E94-R153 PolarHBondContact OE2-NH1 2.98Å; E94-R153 IonicContact OE2-NH2 2.88Å
95	V	30.6	Very low	31.1	Very low	110 Å²	110	115.6 Å²	115.6	67%	0.667	65%	0.647	S	S	*	*			trans	-61.2	132.2	159.6	-175.7	0	0	0	0	106.6	Y93 S97	Y93-V95 PolarHBondContact O-N 2.91Å; Y93-V95 VanDerWaalsContact O-N 3.15Å; V95-S97 PolarHBondContact O-N 3.12Å
96	P	32.5	Very low	30.7	Very low	63 Å²	63	114.3 Å²	114.3	41%	0.409	65%	0.646	S	S	.	*			trans	-52.6	113.1	177.5	-22.9	31.3	0	0	0	109.4	V98 V151	P96-V98 PolarHBondContact O-N 2.8Å; P96-V151 HydrophobicContact CG-CG2 4.07Å
97	S	29.4	Very low	30.5	Very low	123 Å²	123	113.1 Å²	113.1	86%	0.86	64%	0.641	S	S	*	*	S	Bend	trans	-68.3	-3.8	-171.4	-167.8	0	0	0	0	113.5	V95	V95-S97 PolarHBondContact O-N 3.12Å
98	V	26	Very low	30.3	Very low	99 Å²	99	108.3 Å²	108.3	60%	0.6	64%	0.639	S	S	*	*			trans	-133.4	103.2	-175.8	-172.2	0	0	0	0	108	P96	P96-V98 PolarHBondContact O-N 2.8Å
99	A	33.2	Very low	30.2	Very low	81 Å²	81	115.9 Å²	115.9	67%	0.669	66%	0.66	S	S	*	*	P	Polyproline II helix	trans	-55.9	135.4	154.7	0	0	0	0	0	107.2	K101	A99-K101 PolarHBondContact O-N 2.95Å
100	P	34.1	Very low	30	Very low	88 Å²	88	121.4 Å²	121.4	57%	0.571	67%	0.673	S	S	*	*	P	Polyproline II helix	trans	-50.5	122.7	-178.9	17.9	-29	0	0	0	108.7	S102	P100-S102 PolarHBondContact O-N 2.87Å
101	K	30.8	Very low	29.6	Very low	190 Å²	190	123.2 Å²	123.2	83%	0.826	68%	0.677	S	S	*	*	P	Polyproline II helix	trans	-50.2	116	-177.5	-74.3	-179.2	177.8	178.1	0	107.6	A99 D103	A99-K101 PolarHBondContact O-N 2.95Å; K101-D103 PolarHBondContact O-N 3.12Å
102	S	34.8	Very low	29.3	Very low	104 Å²	104	121 Å²	121	73%	0.727	68%	0.679	S	S	*	*	P	Polyproline II helix	trans	-56.5	124.1	171.4	-27.1	0	0	0	0	106.7	P100 P104	P100-S102 PolarHBondContact O-N 2.87Å; S102-P104 WeakPolarHBondContact O-CD 3.24Å
103	D	27.9	Very low	28.8	Very low	107 Å²	107	122.2 Å²	122.2	57%	0.572	69%	0.69	S	S	*	*	P	Polyproline II helix	trans	-55.9	123	174.5	-151.6	-21.4	0	0	0	108.1	K101 D105 S106	K101-D103 PolarHBondContact O-N 3.12Å; D103-D105 PolarHBondContact O-N 3.34Å; D103-S106 WeakPolarHBondContact O-CB 3.42Å; D103-S106 PolarHBondContact O-N 2.86Å; D103-S106 PolarHBondContact O-OG 3.17Å
104	P	38.6	Very low	28.5	Very low	121 Å²	121	126.4 Å²	126.4	79%	0.786	71%	0.706	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-13.8	-175.6	20.6	-31.6	0	0	0	114.2	S102 S106	S102-P104 WeakPolarHBondContact O-CD 3.24Å; P104-S106 PolarHBondContact O-N 3.42Å
105	D	31.5	Very low	28.3	Very low	154 Å²	154	124.8 Å²	124.8	82%	0.824	71%	0.71	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	4.5	170.2	-74.9	-41.5	0	0	0	113.8	D103	D103-D105 PolarHBondContact O-N 3.34Å
106	S	24.9	Very low	28.1	Very low	67 Å²	67	126.3 Å²	126.3	47%	0.469	71%	0.713	S	S	.	*	S	Bend	trans	-85.1	121.7	174.9	-48	0	0	0	0	110.6	D103 P104	D103-S106 WeakPolarHBondContact O-CB 3.42Å; D103-S106 PolarHBondContact O-N 2.86Å; D103-S106 PolarHBondContact O-OG 3.17Å; P104-S106 PolarHBondContact O-N 3.42Å
107	P	26.4	Very low	27.6	Very low	104 Å²	104	129.9 Å²	129.9	68%	0.675	74%	0.738	S	S	*	*	P	Polyproline II helix	trans	-65.9	138.4	-179.6	25.1	-31.5	0	0	0	111.1
108	P	23.6	Very low	27.5	Very low	128 Å²	128	133 Å²	133	83%	0.831	74%	0.736	S	S	*	*	P	Polyproline II helix	trans	-70.2	134.4	-171.8	28.4	-33.6	0	0	0	110.6
109	R	26.8	Very low	27.4	Very low	181 Å²	181	132 Å²	132	68%	0.683	75%	0.746	S	S	*	*			trans	-115.6	127	175.1	-74.7	-179	176.8	-120	7.5	112.2	T139	R109-T139 PolarHBondContact NH1-OG1 3.45Å; R109-T139 PolarHBondContact NH2-OG1 3.19Å
110	R	24	Very low	27	Very low	228 Å²	228	138.1 Å²	138.1	86%	0.86	76%	0.758	S	S	*	*			trans	-64.8	152.6	-169.9	-76.3	179.6	172.3	-171.8	-2.7	113.4
111	P	22.9	Very low	26.6	Very low	128 Å²	128	140.5 Å²	140.5	83%	0.831	78%	0.775	S	S	*	*			trans	-67.8	141.2	175	30.1	-34.3	0	0	0	110.3
112	V	25.2	Very low	26.4	Very low	137 Å²	137	139 Å²	139	83%	0.83	78%	0.775	S	S	*	*			trans	-122	123.2	172.1	-164.6	0	0	0	0	109.7
113	T	22.2	Very low	25.9	Very low	143 Å²	143	140.5 Å²	140.5	88%	0.877	78%	0.775	S	S	*	*			trans	-63.3	135.7	-173.1	-23.2	0	0	0	0	112.1
114	R	24.5	Very low	25.9	Very low	160 Å²	160	144.1 Å²	144.1	60%	0.604	79%	0.788	S	S	*	*			trans	-101.7	141	-179.2	-122.6	-178.6	-179.4	-170.2	1.4	112.2	Q192	R114-Q192 PolarHBondContact NH2-OXT 2.82Å
115	S	24.7	Very low	25.2	Very low	105 Å²	105	143.4 Å²	143.4	73%	0.734	79%	0.786	S	S	*	*			trans	79.2	141.5	161.6	83.1	0	0	0	0	117.1
116	L	25.5	Very low	25	Very low	141 Å²	141	141.1 Å²	141.1	74%	0.738	78%	0.782	S	S	*	*				-148.8	134.4	50.3	-80	139.8	0	0	0	113.7
117	C	21.8	Very low	25	Very low	138 Å²	138	142.9 Å²	142.9	93%	0.932	80%	0.801	S	S	*	*			trans	-90.2	112.7	148.9	-84.1	0	0	0	0	108.4
118	K	27.6	Very low	25.2	Very low	188 Å²	188	145.9 Å²	145.9	82%	0.817	81%	0.81	S	S	*	*			trans	-142.1	119.1	163.5	-108	-174.2	179	-179.9	0	109
119	G	23.6	Very low	25.9	Very low	78 Å²	78	145 Å²	145	80%	0.804	80%	0.804	S	S	*	*			trans	76.8	116.6	141.4	0	0	0	0	0	119.2
120	K	26.2	Very low	26.2	Very low	211 Å²	211	146.2 Å²	146.2	92%	0.917	82%	0.815	S	S	*	*			trans	2.6	129.6	152	-62.9	179	176.6	-176.3	0	118.4
121	C	25	Very low	26.5	Very low	138 Å²	138	145.5 Å²	145.5	93%	0.932	82%	0.818	S	S	*	*			trans	-155.2	145.9	137.3	-120.2	0	0	0	0	112.1
122	L	26	Very low	26.9	Very low	157 Å²	157	147.9 Å²	147.9	82%	0.822	82%	0.823	S	S	*	*			trans	-68.5	153.3	-179.8	-97	95.6	0	0	0	113.6
123	D	25.8	Very low	27	Very low	137 Å²	137	145.1 Å²	145.1	73%	0.733	82%	0.815	S	S	*	*			trans	40.5	112.7	143.1	-94.3	-24.9	0	0	0	121
124	Q	26.6	Very low	27.3	Very low	182 Å²	182	148.5 Å²	148.5	85%	0.85	82%	0.817	S	S	*	*				157.2	124.3	113.6	-88.9	178.5	15.1	0	0	114.2
125	S	24.2	Very low	27.5	Very low	106 Å²	106	147.5 Å²	147.5	74%	0.741	83%	0.829	S	S	*	*			trans	68.5	114.3	139.1	-133.8	0	0	0	0	123.5
126	S	26.7	Very low	27.7	Very low	106 Å²	106	147.7 Å²	147.7	74%	0.741	83%	0.83	S	S	*	*			trans	49.1	113.7	130.1	64.9	0	0	0	0	122
127	A	25.8	Very low	27.8	Very low	104 Å²	104	150 Å²	150	86%	0.86	83%	0.834	S	S	*	*				165.1	127.8	114.4	0	0	0	0	0	113
128	L	29.7	Very low	28.3	Very low	167 Å²	167	149.6 Å²	149.6	87%	0.874	83%	0.833	S	S	*	*			trans	-79.8	175.1	163.9	-85.4	150.1	0	0	0	110.5
129	P	39.1	Very low	28.7	Very low	109 Å²	109	143.9 Å²	143.9	71%	0.708	81%	0.814	S	S	*	*				-129.1	156.6	-58.8	33.4	-15.8	0	0	0	111.6
130	K	32.9	Very low	29.4	Very low	208 Å²	208	144.7 Å²	144.7	90%	0.904	81%	0.813	S	S	*	*			trans	-125.7	125.6	165.9	-85.4	-177.4	-179.9	174.3	0	112.1	L132	K130-L132 PolarHBondContact O-N 2.82Å
131	K	31.4	Very low	30.2	Very low	212 Å²	212	141 Å²	141	92%	0.922	80%	0.799	S	S	*	*			trans	-34.9	125.2	172.5	-66.4	172.5	175.4	176.1	0	112.6
132	L	30.8	Very low	31.1	Very low	178 Å²	178	142.5 Å²	142.5	93%	0.932	79%	0.793	S	S	*	*			trans	-135.2	144.5	159.3	-102.6	155.5	0	0	0	109.9	K130	K130-L132 PolarHBondContact O-N 2.82Å
133	A	27.4	Very low	32.3	Very low	80 Å²	80	136.6 Å²	136.6	66%	0.661	76%	0.763	S	S	*	*			trans	-75	154.3	-148.2	0	0	0	0	0	115	T135	A133-T135 PolarHBondContact O-N 2.91Å
134	K	27.9	Very low	34.1	Very low	213 Å²	213	133.2 Å²	133.2	93%	0.926	75%	0.745	S	S	*	*			trans	-48.5	109	163.2	-68.3	174.6	177.2	177.7	0	109.7
135	T	29.9	Very low	35.7	Very low	140 Å²	140	125.5 Å²	125.5	86%	0.859	71%	0.708	S	S	*	*			trans	-128.2	135.1	156.3	33	0	0	0	0	109.6	A133	A133-T135 PolarHBondContact O-N 2.91Å
136	S	27.7	Very low	37.6	Very low	109 Å²	109	123.4 Å²	123.4	76%	0.762	69%	0.691	S	S	*	*			trans	-85.3	141.6	-156.3	43.4	0	0	0	0	113.3
137	K	28.6	Very low	39.5	Very low	189 Å²	189	126.1 Å²	126.1	82%	0.822	69%	0.685	S	S	*	*			trans	55.4	97.9	150	-68.6	-177.4	177.1	-179	0	116.9	T139	K137-T139 PolarHBondContact O-N 3.44Å; K137-T139 PolarHBondContact O-OG1 2.94Å; K137-T139 VanDerWaalsContact O-OG1 3.11Å
138	S	32.2	Very low	41.6	Very low	130 Å²	130	122.7 Å²	122.7	91%	0.909	65%	0.65	S	S	*	*			trans	-32.5	123.7	154.8	173.5	0	0	0	0	111.1
139	T	35.7	Very low	43.4	Very low	67 Å²	67	115.3 Å²	115.3	41%	0.411	61%	0.614	S	S	.	*			trans	-121.2	122.1	175.4	-35	0	0	0	0	105.8	R109 K137 Q141	R109-T139 PolarHBondContact NH1-OG1 3.45Å; R109-T139 PolarHBondContact NH2-OG1 3.19Å; K137-T139 PolarHBondContact O-N 3.44Å; K137-T139 PolarHBondContact O-OG1 2.94Å; K137-T139 VanDerWaalsContact O-OG1 3.11Å; T139-Q141 PolarHBondContact O-N 3.45Å; T139-Q141 VanDerWaalsContact O-N 3.17Å
140	A	38.4	Very low	44.6	Very low	96 Å²	96	112.8 Å²	112.8	79%	0.793	60%	0.597	S	S	*	*			trans	-47.4	119	-174.9	0	0	0	0	0	111	Q142	A140-Q142 PolarHBondContact O-N 3.44Å
141	Q	41.8	Very low	46.1	Very low	133 Å²	133	104.2 Å²	104.2	62%	0.621	56%	0.562	S	S	*	*			trans	-57.9	122.3	172.4	-94.8	169.7	-47.8	0	0	108.5	T139 V143 Q192	T139-Q141 PolarHBondContact O-N 3.45Å; T139-Q141 VanDerWaalsContact O-N 3.17Å; Q141-V143 PolarHBondContact O-N 3.18Å; Q141-V143 VanDerWaalsContact O-N 3.12Å; Q141-Q192 PolarHBondContact NE2-O 2.94Å; Q141-Q192 VanDerWaalsContact NE2-O 3.08Å
142	Q	43.8	Very low	47.6	Very low	170 Å²	170	95.5 Å²	95.5	79%	0.794	53%	0.525	S	S	*	.			trans	-73.1	104.4	174	-150.1	179.1	16.9	0	0	107.7	A140 D144	A140-Q142 PolarHBondContact O-N 3.44Å; Q142-D144 PolarHBondContact O-N 2.93Å
143	V	51.5	Low	48.8	Very low	32 Å²	32	95.2 Å²	95.2	19%	0.194	51%	0.511	C	S	.	.			trans	-61.9	120.5	179.5	177	0	0	0	0	109.7	Q141 W145 Y148 L183 T191	Q141-V143 PolarHBondContact O-N 3.18Å; Q141-V143 VanDerWaalsContact O-N 3.12Å; V143-W145 PolarHBondContact O-N 2.78Å; V143-Y148 HydrophobicContact CG1-CD2 4.4Å; V143-Y148 HydrophobicContact CG1-CE2 4.29Å; V143-L183 HydrophobicContact CG1-CD1 3.98Å; V143-T191 HydrophobicContact CG1-CG2 3.63Å
144	D	65.1	Low	50.1	Low	67 Å²	67	93 Å²	93	36%	0.358	49%	0.491	S	S	.	.			trans	-72.4	77.4	169.2	-177.2	10.4	0	0	0	109.5	Q142 T146 R147 Y148	Q142-D144 PolarHBondContact O-N 2.93Å; D144-T146 PolarHBondContact O-N 3.26Å; D144-T146 PolarHBondContact OD1-N 2.9Å; D144-T146 PolarHBondContact OD1-OG1 3.32Å; D144-R147 PolarHBondContact O-N 3.01Å; D144-R147 IonicContact OD2-CZ 2.69Å; D144-R147 IonicContact OD2-NE 3.68Å; D144-R147 PolarHBondContact OD2-NE 3.3Å; D144-R147 IonicContact OD2-NH2 3.62Å; D144-Y148 WeakPolarHBondContact O-CD2 3.33Å; D144-Y148 WeakPolarHBondContact O-CE2 3.36Å
145	W	58.9	Low	51.2	Low	19 Å²	19	88.5 Å²	88.5	7%	0.072	49%	0.494	C	S	.	.	G	3₁₀ helix	trans	-60.6	-25	-176.3	61.2	-88.9	0	0	0	112.7	V143 R147 Y148 G149 I176 F179 R180 L183	V143-W145 PolarHBondContact O-N 2.78Å; W145-R147 PolarHBondContact O-N 2.98Å; W145-R147 VanDerWaalsContact O-N 3.11Å; W145-Y148 PolarHBondContact O-N 3.28Å; W145-G149 PolarHBondContact O-N 3.28Å; W145-G149 VanDerWaalsContact O-N 3.12Å; W145-I176 HydrophobicContact CD2-CG2 4.08Å; W145-I176 HydrophobicContact CE3-CG2 4.46Å; W145-I176 HydrophobicContact CH2-CD1 3.78Å; W145-I176 HydrophobicContact CH2-CG1 4.11Å; W145-I176 HydrophobicContact CH2-CG2 4.35Å; W145-I176 HydrophobicContact CZ2-CD1 3.97Å; W145-I176 HydrophobicContact CZ2-CG1 4.43Å; W145-I176 HydrophobicContact CZ2-CG2 3.96Å; W145-I176 HydrophobicContact CZ3-CG1 4.4Å; W145-F179 HydrophobicContact CB-CD1 4.14Å; W145-F179 HydrophobicContact CB-CE1 3.86Å; W145-F179 HydrophobicContact CE3-CD1 4.03Å; W145-F179 HydrophobicContact CE3-CE1 4.04Å; W145-F179 WeakPolarHBondContact O-CE1 3.4Å; W145-R180 HydrophobicContact CB-CG 4.12Å; W145-R180 VanDerWaalsContact CD1-NE 3.3Å; W145-R180 HydrophobicContact CG-CG 4.13Å; W145-L183 HydrophobicContact CB-CD1 3.7Å
146	T	64.2	Low	52.1	Low	63 Å²	63	89.4 Å²	89.4	39%	0.387	49%	0.488	S	S	.	.	G	3₁₀ helix	trans	-62.3	-22	-178.1	65.8	0	0	0	0	113	D144 Y148	D144-T146 PolarHBondContact O-N 3.26Å; D144-T146 PolarHBondContact OD1-N 2.9Å; D144-T146 PolarHBondContact OD1-OG1 3.32Å; T146-Y148 VanDerWaalsContact C-N 3.32Å
147	R	67.5	Low	53.1	Low	163 Å²	163	88.5 Å²	88.5	62%	0.615	47%	0.471	S	S	*	.	G	3₁₀ helix	trans	-74.7	-23.6	175.1	-63	-177.3	-174	-154	-4.9	113.8	D144 W145	D144-R147 PolarHBondContact O-N 3.01Å; D144-R147 IonicContact OD2-CZ 2.69Å; D144-R147 IonicContact OD2-NE 3.68Å; D144-R147 PolarHBondContact OD2-NE 3.3Å; D144-R147 IonicContact OD2-NH2 3.62Å; W145-R147 PolarHBondContact O-N 2.98Å; W145-R147 VanDerWaalsContact O-N 3.11Å
148	Y	68.4	Low	54.6	Low	31 Å²	31	81.1 Å²	81.1	12%	0.122	45%	0.449	C	S	.	.	T	Hydrogen-bonded Turn	trans	-111	-4.6	-171.2	-49.9	-65.3	0	0	0	111.8	V143 D144 W145 T146 C163 T164 L165 F179 L183 E190 T191	V143-Y148 HydrophobicContact CG1-CD2 4.4Å; V143-Y148 HydrophobicContact CG1-CE2 4.29Å; D144-Y148 WeakPolarHBondContact O-CD2 3.33Å; D144-Y148 WeakPolarHBondContact O-CE2 3.36Å; W145-Y148 PolarHBondContact O-N 3.28Å; T146-Y148 VanDerWaalsContact C-N 3.32Å; Y148-C163 CarbonylContact O-C 3.57Å; Y148-C163 WeakPolarHBondContact O-CA 3.36Å; Y148-T164 WeakPolarHBondContact CA-OG1 3.37Å; Y148-T164 PolarHBondContact O-N 2.91Å; Y148-T164 PolarHBondContact O-OG1 2.84Å; Y148-T164 VanDerWaalsContact O-OG1 3.13Å; Y148-L165 HydrophobicContact CD1-CD1 3.59Å; Y148-L165 HydrophobicContact CD1-CD2 3.93Å; Y148-L165 HydrophobicContact CD1-CG 3.82Å; Y148-L165 HydrophobicContact CE1-CD1 4.2Å; Y148-L165 HydrophobicContact CE1-CD2 4.44Å; Y148-L165 HydrophobicContact CG-CD1 4.02Å; Y148-L165 HydrophobicContact CG-CG 4.4Å; Y148-F179 VanDerWaalsContact C-CZ 3.48Å; Y148-F179 WeakPolarHBondContact O-CZ 3.37Å; Y148-L183 HydrophobicContact CD2-CD1 3.98Å; Y148-L183 HydrophobicContact CD2-CD2 4.38Å; Y148-L183 HydrophobicContact CG-CD1 4.41Å; Y148-L183 HydrophobicContact CG-CD2 4.14Å; Y148-E190 PolarHBondContact OH-O 2.96Å; Y148-T191 HydrophobicContact CD2-CG2 3.92Å; Y148-T191 HydrophobicContact CE2-CG2 3.67Å
149	G	68.5	Low	56	Low	12 Å²	12	79 Å²	79	12%	0.124	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.1	132.4	-174.2	0	0	0	0	0	112.2	W145 V162 F179	W145-G149 PolarHBondContact O-N 3.28Å; W145-G149 VanDerWaalsContact O-N 3.12Å; G149-V162 CarbonylContact C-O 3.58Å; G149-V162 VanDerWaalsContact CA-O 3.24Å; G149-V162 WeakPolarHBondContact CA-O 3.3Å; G149-F179 VanDerWaalsContact CA-CZ 3.44Å
150	V	64.1	Low	57.3	Low	56 Å²	56	76 Å²	76	34%	0.339	41%	0.409	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	127.8	166.2	179.1	0	0	0	0	108.6	Y93 I152 T161 V162 T164	Y93-V150 HydrophobicContact CD1-CG1 4.29Å; V150-I152 HydrophobicContact CG1-CG1 4.27Å; V150-T161 CarbonylContact O-C 2.95Å; V150-T161 WeakPolarHBondContact O-CA 3.35Å; V150-V162 PolarHBondContact N-O 2.94Å; V150-V162 PolarHBondContact O-N 3.06Å; V150-T164 HydrophobicContact CG2-CG2 3.69Å
151	V	65.3	Low	58.7	Low	29 Å²	29	71.7 Å²	71.7	18%	0.176	37%	0.372	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.8	128	172.7	-177.3	0	0	0	0	109.1	P96 D159 L160	P96-V151 HydrophobicContact CG-CG2 4.07Å; V151-D159 HydrophobicContact CG1-CB 3.88Å; V151-L160 CarbonylContact C-O 3.59Å; V151-L160 WeakPolarHBondContact CA-O 3.12Å
152	I	62.2	Low	60.1	Low	29 Å²	29	65.9 Å²	65.9	15%	0.149	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.3	122.5	179	-52.5	171.3	0	0	0	107.3	F77 M81 V150 S154 L160 V162	F77-I152 HydrophobicContact CZ-CD1 4.02Å; M81-I152 HydrophobicContact CE-CD1 4.09Å; M81-I152 HydrophobicContact CG-CD1 4.12Å; M81-I152 HydrophobicContact SD-CD1 3.3Å; M81-I152 WeakPolarHBondContact SD-CD1 3.19Å; M81-I152 HydrophobicContact SD-CG1 4.38Å; V150-I152 HydrophobicContact CG1-CG1 4.27Å; I152-S154 PolarHBondContact O-N 2.93Å; I152-L160 PolarHBondContact N-O 3.45Å; I152-L160 PolarHBondContact O-N 3.42Å; I152-V162 HydrophobicContact CD1-CB 4.34Å; I152-V162 HydrophobicContact CD1-CG2 3.48Å; I152-V162 VanDerWaalsContact CD1-CG2 3.48Å; I152-V162 HydrophobicContact CG1-CG2 4.35Å
153	R	55.1	Low	61.6	Low	171 Å²	171	57.8 Å²	57.8	65%	0.645	31%	0.308	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76.2	115.2	172.2	-93.2	176.5	180	157.6	6.7	110.7	E94 D159	E94-R153 IonicContact OE2-CZ 3.67Å; E94-R153 IonicContact OE2-NH1 3.4Å; E94-R153 PolarHBondContact OE2-NH1 2.98Å; E94-R153 IonicContact OE2-NH2 2.88Å; R153-D159 WeakPolarHBondContact CG-OD1 3.43Å; R153-D159 IonicContact NE-OD1 2.72Å; R153-D159 PolarHBondContact NE-OD1 2.73Å
154	S	55.2	Low	62.5	Low	33 Å²	33	59.8 Å²	59.8	23%	0.231	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	129.9	167.5	177.8	0	0	0	0	110.1	I152 E156 F157 G158	I152-S154 PolarHBondContact O-N 2.93Å; S154-E156 PolarHBondContact O-N 3.49Å; S154-E156 PolarHBondContact OG-N 2.9Å; S154-F157 PolarHBondContact OG-N 2.84Å; S154-F157 VanDerWaalsContact OG-N 3.17Å; S154-G158 WeakPolarHBondContact CA-O 3.48Å; S154-G158 WeakPolarHBondContact CB-O 3.48Å; S154-G158 PolarHBondContact N-O 3.12Å; S154-G158 VanDerWaalsContact O-CA 3.27Å; S154-G158 WeakPolarHBondContact O-CA 3.49Å; S154-G158 PolarHBondContact O-N 3.15Å
155	A	50.9	Low	62.8	Low	120 Å²	120	59.7 Å²	59.7	99%	0.992	32%	0.32	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-24.2	173	0	0	0	0	0	112.6
156	E	48.6	Very low	63.2	Low	158 Å²	158	60.6 Å²	60.6	74%	0.738	33%	0.329	S	S	*	.	T	Hydrogen-bonded Turn	trans	-94.6	-33.2	-176.4	-167.7	174.5	-174.8	0	0	112.4	S154	S154-E156 PolarHBondContact O-N 3.49Å; S154-E156 PolarHBondContact OG-N 2.9Å
157	F	49.8	Very low	62.8	Low	90 Å²	90	59.8 Å²	59.8	40%	0.395	33%	0.332	S	S	.	.	T	Hydrogen-bonded Turn	trans	-120.5	-0.2	-171.4	-55.7	-65.7	0	0	0	114.4	I67 S154 L160	I67-F157 HydrophobicContact CD1-CB 4.25Å; I67-F157 HydrophobicContact CD1-CD1 3.43Å; I67-F157 VanDerWaalsContact CD1-CD1 3.43Å; I67-F157 HydrophobicContact CD1-CD2 4.39Å; I67-F157 HydrophobicContact CD1-CE1 3.83Å; I67-F157 HydrophobicContact CD1-CG 3.76Å; I67-F157 HydrophobicContact CD1-CZ 4.47Å; S154-F157 PolarHBondContact OG-N 2.84Å; S154-F157 VanDerWaalsContact OG-N 3.17Å; F157-L160 HydrophobicContact CB-CD1 4.2Å; F157-L160 HydrophobicContact CB-CD2 4.06Å; F157-L160 HydrophobicContact CB-CG 4.31Å
158	G	59.1	Low	62	Low	35 Å²	35	57.5 Å²	57.5	36%	0.361	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	74.6	-154.8	-173.5	0	0	0	0	0	113	S154 L160	S154-G158 WeakPolarHBondContact CA-O 3.48Å; S154-G158 WeakPolarHBondContact CB-O 3.48Å; S154-G158 PolarHBondContact N-O 3.12Å; S154-G158 VanDerWaalsContact O-CA 3.27Å; S154-G158 WeakPolarHBondContact O-CA 3.49Å; S154-G158 PolarHBondContact O-N 3.15Å; G158-L160 PolarHBondContact O-N 2.7Å
159	D	61.6	Low	60.9	Low	84 Å²	84	61.3 Å²	61.3	45%	0.449	35%	0.351	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	117.5	179.5	-70.1	-7.3	0	0	0	110.3	V151 R153	V151-D159 HydrophobicContact CG1-CB 3.88Å; R153-D159 WeakPolarHBondContact CG-OD1 3.43Å; R153-D159 IonicContact NE-OD1 2.72Å; R153-D159 PolarHBondContact NE-OD1 2.73Å
160	L	63.3	Low	60.4	Low	6 Å²	6	60.8 Å²	60.8	3%	0.031	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.1	131.2	176.7	-64.1	176	0	0	0	109.8	V151 I152 F157 G158 P172 F173 M174	V151-L160 CarbonylContact C-O 3.59Å; V151-L160 WeakPolarHBondContact CA-O 3.12Å; I152-L160 PolarHBondContact N-O 3.45Å; I152-L160 PolarHBondContact O-N 3.42Å; F157-L160 HydrophobicContact CB-CD1 4.2Å; F157-L160 HydrophobicContact CB-CD2 4.06Å; F157-L160 HydrophobicContact CB-CG 4.31Å; G158-L160 PolarHBondContact O-N 2.7Å; L160-P172 HydrophobicContact CB-CB 4.08Å; L160-P172 HydrophobicContact CD1-CB 4.18Å; L160-P172 HydrophobicContact CD2-CB 4.46Å; L160-P172 HydrophobicContact CG-CB 4.49Å; L160-F173 CarbonylContact C-O 3.53Å; L160-F173 WeakPolarHBondContact CA-O 3.37Å; L160-M174 HydrophobicContact CD2-CB 4.41Å; L160-M174 HydrophobicContact CD2-CG 3.7Å
161	T	68.4	Low	60.3	Low	4 Å²	4	61.6 Å²	61.6	3%	0.025	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	129.1	175.4	-52.5	0	0	0	0	110.2	V150 P172 F173 F179	V150-T161 CarbonylContact O-C 2.95Å; V150-T161 WeakPolarHBondContact O-CA 3.35Å; T161-P172 CarbonylContact O-C 3.54Å; T161-P172 WeakPolarHBondContact O-CA 3.47Å; T161-F173 PolarHBondContact N-O 3.33Å; T161-F173 WeakPolarHBondContact O-CD2 3.24Å; T161-F173 PolarHBondContact O-N 3.11Å; T161-F179 HydrophobicContact CG2-CB 4.18Å; T161-F179 HydrophobicContact CG2-CD1 3.51Å; T161-F179 HydrophobicContact CG2-CD2 4.04Å; T161-F179 HydrophobicContact CG2-CE1 3.86Å; T161-F179 HydrophobicContact CG2-CE2 4.39Å; T161-F179 HydrophobicContact CG2-CG 3.61Å; T161-F179 HydrophobicContact CG2-CZ 4.32Å
162	V	69.9	Low	60.3	Low	11 Å²	11	60.6 Å²	60.6	7%	0.067	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	130.3	-178.7	179.1	0	0	0	0	109.6	F77 M81 G149 V150 I152 T164 S170 P172	F77-V162 HydrophobicContact CZ-CG2 4.5Å; M81-V162 HydrophobicContact CE-CG1 4.21Å; G149-V162 CarbonylContact C-O 3.58Å; G149-V162 VanDerWaalsContact CA-O 3.24Å; G149-V162 WeakPolarHBondContact CA-O 3.3Å; V150-V162 PolarHBondContact N-O 2.94Å; V150-V162 PolarHBondContact O-N 3.06Å; I152-V162 HydrophobicContact CD1-CB 4.34Å; I152-V162 HydrophobicContact CD1-CG2 3.48Å; I152-V162 VanDerWaalsContact CD1-CG2 3.48Å; I152-V162 HydrophobicContact CG1-CG2 4.35Å; V162-T164 PolarHBondContact O-N 2.75Å; V162-S170 WeakPolarHBondContact CG1-OG 3Å; V162-P172 HydrophobicContact CG2-CB 4.05Å
163	C	75.5	Confident	60.6	Low	1 Å²	1	59.4 Å²	59.4	1%	0.007	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.9	118.3	177.7	-170.3	0	0	0	0	111.6	Y148 L165 C166 S170 F179 H182	Y148-C163 CarbonylContact O-C 3.57Å; Y148-C163 WeakPolarHBondContact O-CA 3.36Å; C163-L165 VanDerWaalsContact C-N 3.32Å; C163-C166 HydrophobicContact CB-CB 4.08Å; C163-S170 WeakPolarHBondContact CA-OG 3.24Å; C163-S170 WeakPolarHBondContact CB-OG 3.36Å; C163-S170 PolarHBondContact N-OG 3.12Å; C163-S170 WeakPolarHBondContact O-CB 3.19Å; C163-S170 PolarHBondContact O-OG 2.82Å; C163-F179 HydrophobicContact CB-CD2 4.46Å; C163-F179 HydrophobicContact CB-CE2 3.67Å; C163-H182 WeakPolarHBondContact CB-NE2 3.24Å; C163-H182 PolarHBondContact SG-NE2 3.38Å
164	T	71.8	Confident	60.9	Low	73 Å²	73	55.1 Å²	55.1	45%	0.448	32%	0.321	S	S	.	.	S	Bend	trans	-74.9	-23.9	176.7	58	0	0	0	0	112.7	Y148 V150 V162 G167	Y148-T164 WeakPolarHBondContact CA-OG1 3.37Å; Y148-T164 PolarHBondContact O-N 2.91Å; Y148-T164 PolarHBondContact O-OG1 2.84Å; Y148-T164 VanDerWaalsContact O-OG1 3.13Å; V150-T164 HydrophobicContact CG2-CG2 3.69Å; V162-T164 PolarHBondContact O-N 2.75Å; T164-G167 PolarHBondContact O-N 3.48Å
165	L	69.8	Low	61.4	Low	65 Å²	65	55.1 Å²	55.1	34%	0.34	32%	0.321	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.3	-28.6	178.6	-60.8	178.6	0	0	0	112.8	Y148 C163 G167 L183 H187 E190	Y148-L165 HydrophobicContact CD1-CD1 3.59Å; Y148-L165 HydrophobicContact CD1-CD2 3.93Å; Y148-L165 HydrophobicContact CD1-CG 3.82Å; Y148-L165 HydrophobicContact CE1-CD1 4.2Å; Y148-L165 HydrophobicContact CE1-CD2 4.44Å; Y148-L165 HydrophobicContact CG-CD1 4.02Å; Y148-L165 HydrophobicContact CG-CG 4.4Å; C163-L165 VanDerWaalsContact C-N 3.32Å; L165-G167 PolarHBondContact O-N 2.8Å; L165-L183 HydrophobicContact CD1-CD2 4.12Å; L165-H187 HydrophobicContact CD1-CB 3.61Å; L165-E190 HydrophobicContact CD1-CB 3.91Å; L165-E190 HydrophobicContact CD1-CG 4.32Å
166	C	67.8	Low	62.1	Low	39 Å²	39	52.7 Å²	52.7	26%	0.264	29%	0.29	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.9	-10	174.1	-75	0	0	0	0	113.3	C163 E168 N169 H182 H187	C163-C166 HydrophobicContact CB-CB 4.08Å; C166-E168 PolarHBondContact O-N 3.4Å; C166-N169 PolarHBondContact O-N 3.46Å; C166-H182 PolarHBondContact SG-CE1 2.77Å; C166-H182 PolarHBondContact SG-NE2 3.19Å; C166-H187 PolarHBondContact SG-NE2 3.25Å
167	G	57.3	Low	62.9	Low	45 Å²	45	50.6 Å²	50.6	46%	0.464	28%	0.284	S	S	.	.	G	3₁₀ helix	trans	58.4	-136.1	-178	0	0	0	0	0	112.2	T164 L165 N169 S170	T164-G167 PolarHBondContact O-N 3.48Å; L165-G167 PolarHBondContact O-N 2.8Å; G167-N169 PolarHBondContact O-N 3.23Å; G167-N169 VanDerWaalsContact O-N 3.15Å; G167-S170 PolarHBondContact O-N 2.97Å
168	E	48.7	Very low	63.8	Low	116 Å²	116	46.4 Å²	46.4	54%	0.542	27%	0.266	S	S	.	.	G	3₁₀ helix	trans	-62.7	-20.9	-178.3	-60.3	-168.2	152.5	0	0	112.6	F74 L78 K82 C166 S170	F74-E168 WeakPolarHBondContact CE1-O 3.45Å; F74-E168 WeakPolarHBondContact CZ-O 3.46Å; L78-E168 HydrophobicContact CD1-CB 4.37Å; L78-E168 WeakPolarHBondContact CD1-O 3.47Å; K82-E168 WeakPolarHBondContact CE-OE1 3.43Å; K82-E168 IonicContact NZ-OE1 3.65Å; K82-E168 PolarHBondContact NZ-OE1 3.24Å; C166-E168 PolarHBondContact O-N 3.4Å; E168-S170 PolarHBondContact O-N 2.82Å
169	N	47.1	Very low	64.5	Low	110 Å²	110	44.8 Å²	44.8	59%	0.588	25%	0.249	S	C	*	.	G	3₁₀ helix	trans	-93.4	15.2	-177	-63.1	-34.8	0	0	0	114.2	C166 G167 F171	C166-N169 PolarHBondContact O-N 3.46Å; G167-N169 PolarHBondContact O-N 3.23Å; G167-N169 VanDerWaalsContact O-N 3.15Å; N169-F171 PolarHBondContact O-N 3.28Å
170	S	57.5	Low	64.9	Low	2 Å²	2	44.2 Å²	44.2	1%	0.014	24%	0.241	C	C	.	.	P	Polyproline II helix	trans	-71.7	120.2	-177.5	176.7	0	0	0	0	113.4	F74 V162 C163 G167 E168	F74-S170 WeakPolarHBondContact CE2-O 3.25Å; F74-S170 WeakPolarHBondContact CZ-O 3.28Å; V162-S170 WeakPolarHBondContact CG1-OG 3Å; C163-S170 WeakPolarHBondContact CA-OG 3.24Å; C163-S170 WeakPolarHBondContact CB-OG 3.36Å; C163-S170 PolarHBondContact N-OG 3.12Å; C163-S170 WeakPolarHBondContact O-CB 3.19Å; C163-S170 PolarHBondContact O-OG 2.82Å; G167-S170 PolarHBondContact O-N 2.97Å; E168-S170 PolarHBondContact O-N 2.82Å
171	F	61.6	Low	65.2	Low	73 Å²	73	48 Å²	48	32%	0.32	26%	0.257	S	S	.	.	P	Polyproline II helix	trans	-72.3	138.5	165.9	-74.5	-88.2	0	0	0	111.9	L51 N169 F173	L51-F171 HydrophobicContact CD1-CD2 4.3Å; L51-F171 HydrophobicContact CD1-CE2 3.88Å; L51-F171 HydrophobicContact CD1-CZ 4.38Å; N169-F171 PolarHBondContact O-N 3.28Å; F171-F173 VanDerWaalsContact O-CD2 3.24Å; F171-F173 WeakPolarHBondContact O-CD2 3.42Å; F171-F173 WeakPolarHBondContact O-CE2 3.33Å
172	P	66.2	Low	65.7	Low	8 Å²	8	48.2 Å²	48.2	5%	0.052	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.6	134	171	27.2	-30	0	0	0	111.2	L69 F77 L160 T161 V162	L69-P172 HydrophobicContact CD1-CG 4.48Å; F77-P172 HydrophobicContact CZ-CB 4.49Å; F77-P172 HydrophobicContact CZ-CG 4.49Å; L160-P172 HydrophobicContact CB-CB 4.08Å; L160-P172 HydrophobicContact CD1-CB 4.18Å; L160-P172 HydrophobicContact CD2-CB 4.46Å; L160-P172 HydrophobicContact CG-CB 4.49Å; T161-P172 CarbonylContact O-C 3.54Å; T161-P172 WeakPolarHBondContact O-CA 3.47Å; V162-P172 HydrophobicContact CG2-CB 4.05Å
173	F	67.4	Low	65.8	Low	3 Å²	3	47.7 Å²	47.7	1%	0.013	26%	0.255	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	127.6	177.8	-62.9	-94	0	0	0	110	L160 T161 F171 C175 F179 H182	L160-F173 CarbonylContact C-O 3.53Å; L160-F173 WeakPolarHBondContact CA-O 3.37Å; T161-F173 PolarHBondContact N-O 3.33Å; T161-F173 WeakPolarHBondContact O-CD2 3.24Å; T161-F173 PolarHBondContact O-N 3.11Å; F171-F173 VanDerWaalsContact O-CD2 3.24Å; F171-F173 WeakPolarHBondContact O-CD2 3.42Å; F171-F173 WeakPolarHBondContact O-CE2 3.33Å; F173-C175 VanDerWaalsContact C-N 3.26Å; F173-C175 PolarHBondContact O-N 3.26Å; F173-F179 HydrophobicContact CB-CB 4.02Å; F173-F179 HydrophobicContact CD1-CB 4.43Å; F173-F179 HydrophobicContact CD2-CB 4.16Å; F173-F179 AromaticContact CD2-CD2 3.71Å; F173-F179 HydrophobicContact CD2-CD2 3.71Å; F173-F179 HydrophobicContact CD2-CG 4.39Å; F173-F179 AromaticContact CE2-CD2 3.9Å; F173-F179 HydrophobicContact CE2-CD2 3.9Å; F173-F179 HydrophobicContact CG-CB 3.95Å; F173-F179 HydrophobicContact CG-CD2 4.36Å; F173-H182 HydrophobicContact CE1-CB 3.62Å; F173-H182 HydrophobicContact CE2-CB 4.24Å; F173-H182 AromaticContact CE2-CD2 3.89Å; F173-H182 AromaticContact CE2-CG 3.99Å; F173-H182 HydrophobicContact CZ-CB 3.37Å; F173-H182 AromaticContact CZ-CD2 3.74Å; F173-H182 AromaticContact CZ-CG 3.34Å; F173-H182 AromaticContact CZ-ND1 3.86Å
174	M	61.9	Low	65.5	Low	81 Å²	81	53.9 Å²	53.9	40%	0.399	28%	0.284	S	S	.	.	S	Bend	trans	-77.4	-11.9	175.6	-61.4	-170.8	-60	0	0	113.4	C65 I67 L160	C65-M174 PolarHBondContact O-N 3.05Å; C65-M174 VanDerWaalsContact O-N 3.08Å; I67-M174 HydrophobicContact CD1-CG 4.12Å; I67-M174 HydrophobicContact CD1-SD 3.62Å; I67-M174 HydrophobicContact CG1-CE 4.24Å; I67-M174 HydrophobicContact CG1-CG 4.24Å; I67-M174 HydrophobicContact CG1-SD 3.71Å; L160-M174 HydrophobicContact CD2-CB 4.41Å; L160-M174 HydrophobicContact CD2-CG 3.7Å
175	C	64.3	Low	65.4	Low	33 Å²	33	54.4 Å²	54.4	22%	0.223	29%	0.287	C	S	.	.	S	Bend	trans	-137.5	140.1	-178.4	79.5	0	0	0	0	111.5	C65 F173 D177 G178 F179	C65-C175 HydrophobicContact CB-CB 3.78Å; C65-C175 WeakPolarHBondContact CB-SG 3.38Å; C65-C175 WeakPolarHBondContact SG-CB 3.36Å; C65-C175 CovalentContact SG-SG 2.04Å; C65-C175 PolarHBondContact SG-SG 3.4Å; F173-C175 VanDerWaalsContact C-N 3.26Å; F173-C175 PolarHBondContact O-N 3.26Å; C175-D177 VanDerWaalsContact C-N 3.25Å; C175-D177 PolarHBondContact O-N 3.15Å; C175-G178 PolarHBondContact O-N 2.93Å; C175-G178 PolarHBondContact SG-N 2.91Å; C175-F179 PolarHBondContact O-N 3.17Å
176	I	65.8	Low	65.4	Low	69 Å²	69	56 Å²	56	35%	0.354	29%	0.291	S	S	.	.	H	α-helix	trans	-62.1	-34.1	-179.3	-68.4	165.6	0	0	0	111.1	W145 F179 R180	W145-I176 HydrophobicContact CD2-CG2 4.08Å; W145-I176 HydrophobicContact CE3-CG2 4.46Å; W145-I176 HydrophobicContact CH2-CD1 3.78Å; W145-I176 HydrophobicContact CH2-CG1 4.11Å; W145-I176 HydrophobicContact CH2-CG2 4.35Å; W145-I176 HydrophobicContact CZ2-CD1 3.97Å; W145-I176 HydrophobicContact CZ2-CG1 4.43Å; W145-I176 HydrophobicContact CZ2-CG2 3.96Å; W145-I176 HydrophobicContact CZ3-CG1 4.4Å; I176-F179 WeakPolarHBondContact O-CB 3.47Å; I176-F179 PolarHBondContact O-N 2.98Å; I176-R180 HydrophobicContact CG2-CG 4.28Å; I176-R180 WeakPolarHBondContact O-CB 3.48Å; I176-R180 WeakPolarHBondContact O-CG 3.5Å; I176-R180 PolarHBondContact O-N 2.85Å
177	D	66.7	Low	65.8	Low	115 Å²	115	55 Å²	55	62%	0.615	28%	0.282	S	S	*	.	H	α-helix	trans	-66.8	-39.3	179.1	-64.9	-29.3	0	0	0	112.1	C175 F179 R180 K181	C175-D177 VanDerWaalsContact C-N 3.25Å; C175-D177 PolarHBondContact O-N 3.15Å; D177-F179 VanDerWaalsContact C-N 3.31Å; D177-F179 PolarHBondContact O-N 3.32Å; D177-R180 PolarHBondContact O-N 2.83Å; D177-K181 WeakPolarHBondContact O-CB 3.41Å; D177-K181 PolarHBondContact O-N 2.97Å
178	G	68.7	Low	66.5	Low	2 Å²	2	55.2 Å²	55.2	2%	0.021	28%	0.276	C	S	.	.	H	α-helix	trans	-63	-39.7	173.2	0	0	0	0	0	111.7	C175 H182	C175-G178 PolarHBondContact O-N 2.93Å; C175-G178 PolarHBondContact SG-N 2.91Å; G178-H182 WeakPolarHBondContact O-CB 3.3Å; G178-H182 PolarHBondContact O-N 3.4Å
179	F	74	Confident	67.4	Low	0 Å²	0	53.9 Å²	53.9	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-67.1	-44.5	175.7	178.1	-118.1	0	0	0	112.5	W145 Y148 G149 T161 C163 F173 C175 I176 D177 K181 H182 L183	W145-F179 HydrophobicContact CB-CD1 4.14Å; W145-F179 HydrophobicContact CB-CE1 3.86Å; W145-F179 HydrophobicContact CE3-CD1 4.03Å; W145-F179 HydrophobicContact CE3-CE1 4.04Å; W145-F179 WeakPolarHBondContact O-CE1 3.4Å; Y148-F179 VanDerWaalsContact C-CZ 3.48Å; Y148-F179 WeakPolarHBondContact O-CZ 3.37Å; G149-F179 VanDerWaalsContact CA-CZ 3.44Å; T161-F179 HydrophobicContact CG2-CB 4.18Å; T161-F179 HydrophobicContact CG2-CD1 3.51Å; T161-F179 HydrophobicContact CG2-CD2 4.04Å; T161-F179 HydrophobicContact CG2-CE1 3.86Å; T161-F179 HydrophobicContact CG2-CE2 4.39Å; T161-F179 HydrophobicContact CG2-CG 3.61Å; T161-F179 HydrophobicContact CG2-CZ 4.32Å; C163-F179 HydrophobicContact CB-CD2 4.46Å; C163-F179 HydrophobicContact CB-CE2 3.67Å; F173-F179 HydrophobicContact CB-CB 4.02Å; F173-F179 HydrophobicContact CD1-CB 4.43Å; F173-F179 HydrophobicContact CD2-CB 4.16Å; F173-F179 AromaticContact CD2-CD2 3.71Å; F173-F179 HydrophobicContact CD2-CD2 3.71Å; F173-F179 HydrophobicContact CD2-CG 4.39Å; F173-F179 AromaticContact CE2-CD2 3.9Å; F173-F179 HydrophobicContact CE2-CD2 3.9Å; F173-F179 HydrophobicContact CG-CB 3.95Å; F173-F179 HydrophobicContact CG-CD2 4.36Å; C175-F179 PolarHBondContact O-N 3.17Å; I176-F179 WeakPolarHBondContact O-CB 3.47Å; I176-F179 PolarHBondContact O-N 2.98Å; D177-F179 VanDerWaalsContact C-N 3.31Å; D177-F179 PolarHBondContact O-N 3.32Å; F179-K181 PolarHBondContact O-N 3.49Å; F179-H182 WeakPolarHBondContact O-CB 3.46Å; F179-H182 PolarHBondContact O-N 3.41Å; F179-L183 HydrophobicContact CD1-CD1 4.3Å; F179-L183 HydrophobicContact CE1-CD1 3.67Å; F179-L183 HydrophobicContact CE1-CG 4.24Å; F179-L183 HydrophobicContact CE2-CD1 4.37Å; F179-L183 HydrophobicContact CE2-CD2 4.16Å; F179-L183 HydrophobicContact CE2-CG 4.06Å; F179-L183 HydrophobicContact CZ-CD1 3.68Å; F179-L183 HydrophobicContact CZ-CD2 3.96Å; F179-L183 HydrophobicContact CZ-CG 3.84Å; F179-L183 PolarHBondContact O-N 3.17Å
180	R	68.8	Low	68.4	Low	73 Å²	73	52.5 Å²	52.5	28%	0.275	27%	0.27	S	S	.	.	H	α-helix	trans	-59.1	-45.1	175.1	-79.3	178.3	139.5	169.9	-2.5	112.2	W145 I176 D177 H182 L183 E184	W145-R180 HydrophobicContact CB-CG 4.12Å; W145-R180 VanDerWaalsContact CD1-NE 3.3Å; W145-R180 HydrophobicContact CG-CG 4.13Å; I176-R180 HydrophobicContact CG2-CG 4.28Å; I176-R180 WeakPolarHBondContact O-CB 3.48Å; I176-R180 WeakPolarHBondContact O-CG 3.5Å; I176-R180 PolarHBondContact O-N 2.85Å; D177-R180 PolarHBondContact O-N 2.83Å; R180-H182 VanDerWaalsContact C-N 3.29Å; R180-H182 PolarHBondContact O-N 2.88Å; R180-L183 WeakPolarHBondContact O-CB 3.46Å; R180-L183 PolarHBondContact O-N 3.33Å; R180-E184 PolarHBondContact O-N 3.37Å
181	K	69.5	Low	68.7	Low	84 Å²	84	53.1 Å²	53.1	37%	0.365	27%	0.274	S	S	.	.	H	α-helix	trans	-66	-34.4	177.6	-164.2	168.7	-175	176.9	0	111.9	K62 D177 F179 E184 V185	K62-K181 PolarHBondContact O-NZ 3.03Å; K62-K181 VanDerWaalsContact O-NZ 3.12Å; D177-K181 WeakPolarHBondContact O-CB 3.41Å; D177-K181 PolarHBondContact O-N 2.97Å; F179-K181 PolarHBondContact O-N 3.49Å; K181-E184 PolarHBondContact O-N 3.34Å; K181-V185 WeakPolarHBondContact O-CB 3.29Å; K181-V185 VanDerWaalsContact O-CG2 3.25Å; K181-V185 WeakPolarHBondContact O-CG2 3.4Å; K181-V185 PolarHBondContact O-N 2.99Å
182	H	78.5	Confident	68.4	Low	10 Å²	10	56.7 Å²	56.7	5%	0.046	29%	0.292	C	S	.	.	H	α-helix	trans	-62.7	-46.3	171.1	162.3	74.6	0	0	0	111.7	C163 C166 F173 G178 F179 R180 E184 V185 F186 H187	C163-H182 WeakPolarHBondContact CB-NE2 3.24Å; C163-H182 PolarHBondContact SG-NE2 3.38Å; C166-H182 PolarHBondContact SG-CE1 2.77Å; C166-H182 PolarHBondContact SG-NE2 3.19Å; F173-H182 HydrophobicContact CE1-CB 3.62Å; F173-H182 HydrophobicContact CE2-CB 4.24Å; F173-H182 AromaticContact CE2-CD2 3.89Å; F173-H182 AromaticContact CE2-CG 3.99Å; F173-H182 HydrophobicContact CZ-CB 3.37Å; F173-H182 AromaticContact CZ-CD2 3.74Å; F173-H182 AromaticContact CZ-CG 3.34Å; F173-H182 AromaticContact CZ-ND1 3.86Å; G178-H182 WeakPolarHBondContact O-CB 3.3Å; G178-H182 PolarHBondContact O-N 3.4Å; F179-H182 WeakPolarHBondContact O-CB 3.46Å; F179-H182 PolarHBondContact O-N 3.41Å; R180-H182 VanDerWaalsContact C-N 3.29Å; R180-H182 PolarHBondContact O-N 2.88Å; H182-E184 VanDerWaalsContact C-N 3.33Å; H182-E184 PolarHBondContact O-N 3.08Å; H182-V185 PolarHBondContact O-N 3.22Å; H182-F186 AromaticContact ND1-CD2 3.37Å; H182-F186 WeakPolarHBondContact ND1-CD2 3.39Å; H182-F186 AromaticContact ND1-CG 3.97Å; H182-F186 WeakPolarHBondContact O-CB 3.47Å; H182-F186 WeakPolarHBondContact O-CD2 3.14Å; H182-F186 PolarHBondContact O-N 2.04Å; H182-H187 AromaticContact CE1-CD2 3.93Å; H182-H187 AromaticContact CE1-NE2 3.78Å; H182-H187 AromaticContact NE2-CD2 3.45Å; H182-H187 PolarHBondContact NE2-CD2 3.1Å; H182-H187 AromaticContact NE2-NE2 3.48Å; H182-H187 PolarHBondContact NE2-NE2 3.45Å
183	L	71.9	Confident	68.5	Low	0 Å²	0	59.2 Å²	59.2	0%	0	30%	0.304	C	S	.	.	H	α-helix	trans	-59.4	-44.1	174.9	-71.5	177.7	0	0	0	112.1	V143 W145 Y148 L165 F179 R180 V185 H187 S188 T191	V143-L183 HydrophobicContact CG1-CD1 3.98Å; W145-L183 HydrophobicContact CB-CD1 3.7Å; Y148-L183 HydrophobicContact CD2-CD1 3.98Å; Y148-L183 HydrophobicContact CD2-CD2 4.38Å; Y148-L183 HydrophobicContact CG-CD1 4.41Å; Y148-L183 HydrophobicContact CG-CD2 4.14Å; L165-L183 HydrophobicContact CD1-CD2 4.12Å; F179-L183 HydrophobicContact CD1-CD1 4.3Å; F179-L183 HydrophobicContact CE1-CD1 3.67Å; F179-L183 HydrophobicContact CE1-CG 4.24Å; F179-L183 HydrophobicContact CE2-CD1 4.37Å; F179-L183 HydrophobicContact CE2-CD2 4.16Å; F179-L183 HydrophobicContact CE2-CG 4.06Å; F179-L183 HydrophobicContact CZ-CD1 3.68Å; F179-L183 HydrophobicContact CZ-CD2 3.96Å; F179-L183 HydrophobicContact CZ-CG 3.84Å; F179-L183 PolarHBondContact O-N 3.17Å; R180-L183 WeakPolarHBondContact O-CB 3.46Å; R180-L183 PolarHBondContact O-N 3.33Å; L183-V185 PolarHBondContact O-N 2.89Å; L183-H187 HydrophobicContact CD2-CB 4.18Å; L183-H187 CarbonylContact O-C 3.55Å; L183-H187 WeakPolarHBondContact O-CA 2.91Å; L183-H187 WeakPolarHBondContact O-CB 3.27Å; L183-H187 PolarHBondContact O-N 2.93Å; L183-S188 PolarHBondContact O-N 2.84Å; L183-T191 HydrophobicContact CB-CG2 4.14Å; L183-T191 HydrophobicContact CD2-CG2 4.31Å
184	E	70.5	Confident	68.6	Low	131 Å²	131	62.1 Å²	62.1	61%	0.612	32%	0.319	S	S	*	.	H	α-helix	trans	-63.7	-39.7	179	-172.7	-179	-173.6	0	0	112.5	R180 K181 H182 S188	R180-E184 PolarHBondContact O-N 3.37Å; K181-E184 PolarHBondContact O-N 3.34Å; H182-E184 VanDerWaalsContact C-N 3.33Å; H182-E184 PolarHBondContact O-N 3.08Å; E184-S188 WeakPolarHBondContact O-CB 3.35Å; E184-S188 PolarHBondContact O-OG 2.87Å
185	V	69.5	Low	69	Low	84 Å²	84	61.1 Å²	61.1	51%	0.509	31%	0.314	S	S	.	.	H	α-helix	trans	-80.3	-45.6	-177	173.6	0	0	0	0	112	K181 H182 L183	K181-V185 WeakPolarHBondContact O-CB 3.29Å; K181-V185 VanDerWaalsContact O-CG2 3.25Å; K181-V185 WeakPolarHBondContact O-CG2 3.4Å; K181-V185 PolarHBondContact O-N 2.99Å; H182-V185 PolarHBondContact O-N 3.22Å; L183-V185 PolarHBondContact O-N 2.89Å
186	F	69.4	Low	69.2	Low	97 Å²	97	62.7 Å²	62.7	43%	0.425	32%	0.32	S	S	.	.	H	α-helix	trans	-103.7	-20.9	-168.4	-65.3	-81.9	0	0	0	113.9	H182	H182-F186 AromaticContact ND1-CD2 3.37Å; H182-F186 WeakPolarHBondContact ND1-CD2 3.39Å; H182-F186 AromaticContact ND1-CG 3.97Å; H182-F186 WeakPolarHBondContact O-CB 3.47Å; H182-F186 WeakPolarHBondContact O-CD2 3.14Å; H182-F186 PolarHBondContact O-N 2.04Å
187	H	76.4	Confident	69.5	Low	19 Å²	19	62.3 Å²	62.3	9%	0.088	32%	0.318	C	S	.	.	S	Bend	trans	-129.3	29.8	-176.4	-60.5	-59.3	0	0	0	111.7	L165 C166 H182 L183 S189 E190 T191	L165-H187 HydrophobicContact CD1-CB 3.61Å; C166-H187 PolarHBondContact SG-NE2 3.25Å; H182-H187 AromaticContact CE1-CD2 3.93Å; H182-H187 AromaticContact CE1-NE2 3.78Å; H182-H187 AromaticContact NE2-CD2 3.45Å; H182-H187 PolarHBondContact NE2-CD2 3.1Å; H182-H187 AromaticContact NE2-NE2 3.48Å; H182-H187 PolarHBondContact NE2-NE2 3.45Å; L183-H187 HydrophobicContact CD2-CB 4.18Å; L183-H187 CarbonylContact O-C 3.55Å; L183-H187 WeakPolarHBondContact O-CA 2.91Å; L183-H187 WeakPolarHBondContact O-CB 3.27Å; L183-H187 PolarHBondContact O-N 2.93Å; H187-S189 PolarHBondContact O-N 3.06Å; H187-E190 VanDerWaalsContact C-OE2 3.27Å; H187-E190 WeakPolarHBondContact CA-OE2 3.48Å; H187-E190 HydrophobicContact CB-CB 4.39Å; H187-E190 PolarHBondContact O-N 2.73Å; H187-E190 VanDerWaalsContact O-N 3.15Å; H187-T191 HydrophobicContact CB-CG2 4.47Å; H187-T191 WeakPolarHBondContact O-CB 3.1Å; H187-T191 VanDerWaalsContact O-CG2 3.28Å; H187-T191 WeakPolarHBondContact O-CG2 2.92Å; H187-T191 PolarHBondContact O-N 2.91Å; H187-T191 PolarHBondContact O-OG1 2.86Å
188	S	71.1	Confident	69.6	Low	49 Å²	49	58.8 Å²	58.8	34%	0.343	30%	0.298	S	S	.	.	H	α-helix	trans	-59.5	-34.8	179.1	37.9	0	0	0	0	111.8	L183 E184 E190 T191 Q192	L183-S188 PolarHBondContact O-N 2.84Å; E184-S188 WeakPolarHBondContact O-CB 3.35Å; E184-S188 PolarHBondContact O-OG 2.87Å; S188-E190 VanDerWaalsContact C-N 3.34Å; S188-E190 PolarHBondContact O-N 3.08Å; S188-T191 WeakPolarHBondContact CA-OG1 3.02Å; S188-T191 PolarHBondContact O-N 2.8Å; S188-T191 PolarHBondContact O-OG1 3.19Å; S188-Q192 VanDerWaalsContact O-CG 3.28Å; S188-Q192 WeakPolarHBondContact O-CG 3.47Å; S188-Q192 PolarHBondContact O-N 3.47Å
189	S	69	Low	69.7	Low	88 Å²	88	62.9 Å²	62.9	62%	0.615	32%	0.318	S	S	*	.	H	α-helix	trans	-64.9	-35.6	176.4	31.9	0	0	0	0	113.5	H187	H187-S189 PolarHBondContact O-N 3.06Å
190	E	68.4	Low	69.4	Low	81 Å²	81	67.7 Å²	67.7	38%	0.379	34%	0.342	S	S	.	.	H	α-helix	trans	-83.9	-23.8	-178.2	-65.4	82.8	168.9	0	0	111.5	Y148 L165 H187 S188	Y148-E190 PolarHBondContact OH-O 2.96Å; L165-E190 HydrophobicContact CD1-CB 3.91Å; L165-E190 HydrophobicContact CD1-CG 4.32Å; H187-E190 VanDerWaalsContact C-OE2 3.27Å; H187-E190 WeakPolarHBondContact CA-OE2 3.48Å; H187-E190 HydrophobicContact CB-CB 4.39Å; H187-E190 PolarHBondContact O-N 2.73Å; H187-E190 VanDerWaalsContact O-N 3.15Å; S188-E190 VanDerWaalsContact C-N 3.34Å; S188-E190 PolarHBondContact O-N 3.08Å
191	T	62.5	Low	69.4	Low	16 Å²	16	67.3 Å²	67.3	10%	0.098	35%	0.348	C	S	.	.	H	α-helix	trans	-96.9	1.3	-174.3	55.4	0	0	0	0	115	V143 Y148 L183 H187 S188	V143-T191 HydrophobicContact CG1-CG2 3.63Å; Y148-T191 HydrophobicContact CD2-CG2 3.92Å; Y148-T191 HydrophobicContact CE2-CG2 3.67Å; L183-T191 HydrophobicContact CB-CG2 4.14Å; L183-T191 HydrophobicContact CD2-CG2 4.31Å; H187-T191 HydrophobicContact CB-CG2 4.47Å; H187-T191 WeakPolarHBondContact O-CB 3.1Å; H187-T191 VanDerWaalsContact O-CG2 3.28Å; H187-T191 WeakPolarHBondContact O-CG2 2.92Å; H187-T191 PolarHBondContact O-N 2.91Å; H187-T191 PolarHBondContact O-OG1 2.86Å; S188-T191 WeakPolarHBondContact CA-OG1 3.02Å; S188-T191 PolarHBondContact O-N 2.8Å; S188-T191 PolarHBondContact O-OG1 3.19Å
192	Q	56.6	Low	69.4	Low	148 Å²	148	65.7 Å²	65.7	69%	0.692	35%	0.346	S	S	*	.			trans	-87.1	0	170.8	-75.2	173.9	10.9	0	0	113.6	R114 Q141 S188	R114-Q192 PolarHBondContact NH2-OXT 2.82Å; Q141-Q192 PolarHBondContact NE2-O 2.94Å; Q141-Q192 VanDerWaalsContact NE2-O 3.08Å; S188-Q192 VanDerWaalsContact O-CG 3.28Å; S188-Q192 WeakPolarHBondContact O-CG 3.47Å; S188-Q192 PolarHBondContact O-N 3.47Å

Retrieved 192 of 192 residues in 167 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).