A0A077Z2N7_TRITR Loading...

Uncharacterized protein

AlphaFold DB , UniProt , Accession A0A077Z2N7, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 225 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	45.4	Very low	42.6	Very low	251 Å²	251	159.2 Å²	159.2	100%	1.236	87%	0.872	S	S	*	*				0	111	0	-70.9	-155.1	150.9	0	0	108
2	Q	40.3	Very low	43	Very low	203 Å²	203	157.1 Å²	157.1	95%	0.949	86%	0.857	S	S	*	*	P	Polyproline II helix	trans	-77.2	128	-163.4	-84.6	147.2	-8.4	0	0	112.1
3	G	37.8	Very low	43.3	Very low	72 Å²	72	152.6 Å²	152.6	74%	0.742	84%	0.844	S	S	*	*	P	Polyproline II helix	trans	-69.7	139.4	178.4	0	0	0	0	0	112.3	Q5	G3-Q5 PolarHBondContact O-N 3.33Å
4	R	43.9	Very low	43.6	Very low	251 Å²	251	147.9 Å²	147.9	95%	0.947	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-64.9	116.8	173.1	-72.5	179.8	177.5	-174.4	-1.3	110
5	Q	42.5	Very low	44.1	Very low	191 Å²	191	141.7 Å²	141.7	89%	0.893	80%	0.795	S	S	*	*	P	Polyproline II helix	trans	-79.1	121.5	162.6	-68.3	-179.7	1.2	0	0	108.8	G3	G3-Q5 PolarHBondContact O-N 3.33Å
6	S	45	Very low	44.5	Very low	117 Å²	117	140.4 Å²	140.4	82%	0.818	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-80.7	131.2	165.6	-72.2	0	0	0	0	109.4
7	P	43.8	Very low	44.7	Very low	111 Å²	111	142.2 Å²	142.2	72%	0.721	78%	0.78	S	S	*	*	P	Polyproline II helix	trans	-88.3	133.9	179.1	32.7	-29.3	0	0	0	112
8	L	43.9	Very low	44.7	Very low	164 Å²	164	139.3 Å²	139.3	86%	0.859	77%	0.772	S	S	*	*			trans	67.4	91	143.2	-58.6	166.7	0	0	0	117.7	L10	L8-L10 PolarHBondContact O-N 3.19Å
9	G	37.7	Very low	44.7	Very low	78 Å²	78	135.9 Å²	135.9	80%	0.804	75%	0.746	S	S	*	*			trans	-65	106.6	157.7	0	0	0	0	0	111	I11	G9-I11 PolarHBondContact O-N 3.42Å; G9-I11 VanDerWaalsContact O-N 3.11Å
10	L	44.8	Very low	44.7	Very low	160 Å²	160	137.7 Å²	137.7	84%	0.838	75%	0.749	S	S	*	*			trans	-67.5	101.8	167.3	-88.7	156.5	0	0	0	109.4	L8 I12	L8-L10 PolarHBondContact O-N 3.19Å; L10-I12 PolarHBondContact O-N 3.27Å; L10-I12 VanDerWaalsContact O-N 3.07Å
11	I	43.9	Very low	44.6	Very low	153 Å²	153	136.2 Å²	136.2	79%	0.785	75%	0.749	S	S	*	*			trans	-68.6	99.8	165.7	-61.3	173.3	0	0	0	107	G9 S13	G9-I11 PolarHBondContact O-N 3.42Å; G9-I11 VanDerWaalsContact O-N 3.11Å; I11-S13 PolarHBondContact O-N 3.36Å; I11-S13 VanDerWaalsContact O-N 3.16Å
12	I	46.7	Very low	44.3	Very low	134 Å²	134	131 Å²	131	69%	0.687	73%	0.731	S	S	*	*			trans	-79.4	95.2	172.7	-59.8	172.6	0	0	0	107.3	L10 S14	L10-I12 PolarHBondContact O-N 3.27Å; L10-I12 VanDerWaalsContact O-N 3.07Å; I12-S14 PolarHBondContact O-N 3.43Å
13	S	46.6	Very low	44	Very low	99 Å²	99	125.7 Å²	125.7	69%	0.692	72%	0.716	S	S	*	*			trans	-54.5	128	167.5	-59.9	0	0	0	0	109.8	I11 P15	I11-S13 PolarHBondContact O-N 3.36Å; I11-S13 VanDerWaalsContact O-N 3.16Å; S13-P15 WeakPolarHBondContact O-CD 3.41Å
14	S	48.3	Very low	43.8	Very low	86 Å²	86	129.3 Å²	129.3	60%	0.601	72%	0.718	S	S	*	*			trans	-56.6	120	178.1	50.4	0	0	0	0	111	I12 F16	I12-S14 PolarHBondContact O-N 3.43Å; S14-F16 PolarHBondContact O-N 3.05Å
15	P	50.8	Low	43.5	Very low	55 Å²	55	124 Å²	124	36%	0.357	72%	0.717	S	S	.	*			trans	-86.4	20.2	-176.4	35.8	-35.7	0	0	0	112.9	S13 Q17	S13-P15 WeakPolarHBondContact O-CD 3.41Å; P15-Q17 VanDerWaalsContact C-N 3.3Å; P15-Q17 PolarHBondContact O-N 3.45Å
16	F	50.9	Low	43.1	Very low	122 Å²	122	118 Å²	118	54%	0.535	70%	0.7	S	S	.	*	T	Hydrogen-bonded Turn	trans	-83	4.6	-171.8	-82.9	-93	0	0	0	114.5	S14 Q129	S14-F16 PolarHBondContact O-N 3.05Å; F16-Q129 HydrophobicContact CE1-CG 4.07Å; F16-Q129 HydrophobicContact CZ-CG 4.33Å
17	Q	48.2	Very low	43	Very low	170 Å²	170	118.5 Å²	118.5	79%	0.794	70%	0.698	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.4	-4.5	-170.4	-78.9	-170.8	-23.6	0	0	117.4	P15	P15-Q17 VanDerWaalsContact C-N 3.3Å; P15-Q17 PolarHBondContact O-N 3.45Å
18	S	43.5	Very low	42.4	Very low	91 Å²	91	119.8 Å²	119.8	64%	0.636	71%	0.706	S	S	*	*	S	Bend	trans	-116	24.5	-165.4	79.3	0	0	0	0	117
19	W	45.4	Very low	41.9	Very low	75 Å²	75	115.7 Å²	115.7	28%	0.284	70%	0.703	S	S	.	*	S	Bend	trans	-122.4	1.9	-176.9	-85.6	-9.7	0	0	0	116	P107 Q129	W19-P107 HydrophobicContact CH2-CB 3.85Å; W19-P107 HydrophobicContact CH2-CG 3.81Å; W19-P107 HydrophobicContact CZ2-CB 3.89Å; W19-P107 HydrophobicContact CZ2-CG 3.66Å; W19-Q129 HydrophobicContact CZ3-CB 4.19Å; W19-Q129 VanDerWaalsContact CZ3-CD 3.46Å; W19-Q129 HydrophobicContact CZ3-CG 3.88Å
20	E	45.4	Very low	41.7	Very low	171 Å²	171	115.4 Å²	115.4	80%	0.799	70%	0.701	S	S	*	*	S	Bend	trans	-95.9	-3.7	179.8	-71.5	172.4	146.2	0	0	113.1
21	S	42	Very low	41.4	Very low	107 Å²	107	115.6 Å²	115.6	75%	0.748	70%	0.702	S	S	*	*	S	Bend	trans	-96.1	8	-171.1	-49.8	0	0	0	0	116.2
22	V	38.6	Very low	41.2	Very low	142 Å²	142	113.6 Å²	113.6	86%	0.861	70%	0.702	S	S	*	*	S	Bend	trans	-140.1	60.6	-177.8	-164	0	0	0	0	111.7
23	S	33.9	Very low	41.2	Very low	91 Å²	91	112.8 Å²	112.8	64%	0.636	71%	0.706	S	S	*	*			trans	-163.6	94.6	160.8	55.5	0	0	0	0	109.7
24	N	35.2	Very low	41.1	Very low	148 Å²	148	114.1 Å²	114.1	79%	0.791	71%	0.71	S	S	*	*			trans	-177	92.5	147.2	-89.6	-18.5	0	0	0	109.5	A26	N24-A26 PolarHBondContact O-N 3.14Å
25	P	36.1	Very low	41.2	Very low	140 Å²	140	116.5 Å²	116.5	91%	0.909	72%	0.72	S	S	*	*			trans	-83.7	78.5	151.1	33.5	-24.6	0	0	0	106.9
26	A	34.3	Very low	40.8	Very low	65 Å²	65	122.9 Å²	122.9	54%	0.537	74%	0.742	S	S	.	*			trans	-146.4	101.5	175.9	0	0	0	0	0	110.5	N24	N24-A26 PolarHBondContact O-N 3.14Å
27	T	42.3	Very low	40.7	Very low	126 Å²	126	128.4 Å²	128.4	77%	0.773	76%	0.76	S	S	*	*			trans	60.5	121	148.6	38.9	0	0	0	0	119.6
28	P	32	Very low	40.6	Very low	138 Å²	138	128.8 Å²	128.8	90%	0.896	76%	0.763	S	S	*	*	S	Bend	trans	-76.9	124.5	166.1	32.2	-27.6	0	0	0	109.1
29	G	33	Very low	40.6	Very low	78 Å²	78	129.9 Å²	129.9	80%	0.804	77%	0.768	S	S	*	*			trans	109.4	104.8	173.3	0	0	0	0	0	113.1
30	G	34.7	Very low	40.6	Very low	73 Å²	73	136.4 Å²	136.4	75%	0.753	80%	0.799	S	S	*	*			trans	166.3	79.7	175.7	0	0	0	0	0	113.6	S32	G30-S32 PolarHBondContact O-N 3.47Å
31	N	38.6	Very low	40.9	Very low	163 Å²	163	132.3 Å²	132.3	87%	0.872	79%	0.794	S	S	*	*			trans	-15.5	113.8	164.6	-57.7	-31.5	0	0	0	116.3
32	S	38.6	Very low	41.3	Very low	112 Å²	112	132.9 Å²	132.9	78%	0.783	80%	0.796	S	S	*	*			trans	-57.4	127.3	165.5	-61.4	0	0	0	0	111.4	G30 V34	G30-S32 PolarHBondContact O-N 3.47Å; S32-V34 PolarHBondContact O-N 3.11Å
33	P	47.6	Very low	41.9	Very low	117 Å²	117	130.8 Å²	130.8	76%	0.76	79%	0.793	S	S	*	*			trans	-79.4	108.3	159.1	29.7	-26.3	0	0	0	108.2	V35	P33-V35 PolarHBondContact O-N 3.27Å; P33-V35 VanDerWaalsContact O-N 3.11Å
34	V	43.4	Very low	42.5	Very low	127 Å²	127	136.8 Å²	136.8	77%	0.77	80%	0.802	S	S	*	*			trans	-46	114.4	160.5	172.7	0	0	0	0	108.2	S32 K36	S32-V34 PolarHBondContact O-N 3.11Å; V34-K36 PolarHBondContact O-N 3.46Å
35	V	49.9	Very low	43.3	Very low	136 Å²	136	138.5 Å²	138.5	82%	0.824	81%	0.805	S	S	*	*			trans	-67.2	90.3	169.4	-178.3	0	0	0	0	107	P33 R37	P33-V35 PolarHBondContact O-N 3.27Å; P33-V35 VanDerWaalsContact O-N 3.11Å; V35-R37 PolarHBondContact O-N 2.95Å
36	K	44	Very low	44	Very low	188 Å²	188	136.9 Å²	136.9	82%	0.817	80%	0.797	S	S	*	*			trans	-55.7	110.5	164.7	-97.1	177.7	173.6	173.9	0	107.1	V34 M38	V34-K36 PolarHBondContact O-N 3.46Å; K36-M38 PolarHBondContact O-N 3Å
37	R	48.3	Very low	44.7	Very low	239 Å²	239	142.2 Å²	142.2	90%	0.902	81%	0.811	S	S	*	*			trans	-54.2	107	162.4	-77	-177.6	173.4	149.6	-1.5	107.5	V35	V35-R37 PolarHBondContact O-N 2.95Å
38	M	44.9	Very low	45	Very low	178 Å²	178	142.7 Å²	142.7	88%	0.877	81%	0.808	S	S	*	*			trans	-65	125.9	167.4	-112.9	166.8	141	0	0	107.6	K36	K36-M38 PolarHBondContact O-N 3Å
39	P	43.9	Very low	45.6	Very low	113 Å²	113	148.1 Å²	148.1	73%	0.734	81%	0.81	S	S	*	*			trans	-66.6	135.8	171.6	27	-30.3	0	0	0	108.6	A41	P39-A41 PolarHBondContact O-N 3.09Å
40	F	46.8	Very low	46.1	Very low	213 Å²	213	148 Å²	148	93%	0.934	81%	0.808	S	S	*	*			trans	-52.1	105.1	164.9	-99.8	-98.6	0	0	0	108.1
41	A	51.4	Low	46.5	Very low	84 Å²	84	147.6 Å²	147.6	69%	0.694	80%	0.798	S	S	*	*	P	Polyproline II helix	trans	-74.6	125.6	166.1	0	0	0	0	0	107.4	P39 A43	P39-A41 PolarHBondContact O-N 3.09Å; A41-A43 PolarHBondContact O-N 3.35Å
42	P	49.2	Very low	46.7	Very low	120 Å²	120	144 Å²	144	78%	0.779	79%	0.791	S	S	*	*	P	Polyproline II helix	trans	-61.6	128	169.8	1.9	6.9	0	0	0	108.1	R44	P42-R44 PolarHBondContact O-N 3.47Å; P42-R44 VanDerWaalsContact O-N 3.1Å
43	A	51.5	Low	47	Very low	97 Å²	97	142.9 Å²	142.9	80%	0.802	79%	0.789	S	S	*	*	P	Polyproline II helix	trans	-54	119.5	173.9	0	0	0	0	0	108.9	A41 E45	A41-A43 PolarHBondContact O-N 3.35Å; A43-E45 PolarHBondContact O-N 2.96Å
44	R	46.4	Very low	47	Very low	218 Å²	218	144.6 Å²	144.6	82%	0.823	79%	0.79	S	S	*	*	P	Polyproline II helix	trans	-61.9	126.7	173.2	-82.3	-177.1	159.8	174.5	-5.3	108.8	P42 S46	P42-R44 PolarHBondContact O-N 3.47Å; P42-R44 VanDerWaalsContact O-N 3.1Å; R44-S46 PolarHBondContact O-N 3.4Å
45	E	52.4	Low	47.5	Very low	183 Å²	183	144 Å²	144	86%	0.855	79%	0.787	S	S	*	*	G	3₁₀ helix	trans	-58.7	-5.1	-179.3	-69.2	172	151.5	0	0	114.6	A43	A43-E45 PolarHBondContact O-N 2.96Å
46	S	51.6	Low	47.4	Very low	107 Å²	107	142 Å²	142	75%	0.748	78%	0.776	S	S	*	*	G	3₁₀ helix	trans	-89.1	5.8	-176.4	97.2	0	0	0	0	115.6	R44	R44-S46 PolarHBondContact O-N 3.4Å
47	Q	47.5	Very low	47.8	Very low	177 Å²	177	136.2 Å²	136.2	83%	0.827	76%	0.76	S	S	*	*	G	3₁₀ helix	trans	-101.7	0.9	174	-73.2	-169.7	-12.4	0	0	114.5	R49	Q47-R49 PolarHBondContact O-N 3.25Å
48	L	48.7	Very low	48	Very low	135 Å²	135	132.7 Å²	132.7	71%	0.707	75%	0.754	S	S	*	*	T	Hydrogen-bonded Turn	trans	-89.3	12.7	-178.9	-72.8	169.8	0	0	0	114.9	G50 A51	L48-G50 VanDerWaalsContact C-N 3.35Å; L48-A51 HydrophobicContact CD2-CB 4.45Å
49	R	45.7	Very low	48.5	Very low	253 Å²	253	128.3 Å²	128.3	96%	0.955	74%	0.741	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.7	9.1	178.7	-138.1	176	-160.8	-121.5	2.8	115	Q47	Q47-R49 PolarHBondContact O-N 3.25Å
50	G	43.9	Very low	49	Very low	74 Å²	74	126.4 Å²	126.4	76%	0.763	73%	0.727	S	S	*	*	S	Bend	trans	-136.2	-1	176.6	0	0	0	0	0	114.9	L48 A52	L48-G50 VanDerWaalsContact C-N 3.35Å; G50-A52 PolarHBondContact O-N 2.92Å
51	A	41.6	Very low	49.2	Very low	65 Å²	65	118.7 Å²	118.7	54%	0.537	70%	0.703	S	S	.	*	S	Bend	trans	-86.2	97.7	171.5	0	0	0	0	0	107.6	L48 A53	L48-A51 HydrophobicContact CD2-CB 4.45Å; A51-A53 PolarHBondContact O-N 3.11Å
52	A	43.6	Very low	49.2	Very low	88 Å²	88	121.7 Å²	121.7	73%	0.727	70%	0.7	S	S	*	*			trans	-45.3	121.3	164.7	0	0	0	0	0	107.8	G50 I54	G50-A52 PolarHBondContact O-N 2.92Å; A52-I54 VanDerWaalsContact C-N 3.27Å; A52-I54 PolarHBondContact O-N 3.4Å
53	A	44.2	Very low	49.5	Very low	88 Å²	88	121.1 Å²	121.1	73%	0.727	69%	0.69	S	S	*	*			trans	-58.3	91.8	178.8	0	0	0	0	0	108.8	A51 T55	A51-A53 PolarHBondContact O-N 3.11Å; A53-T55 PolarHBondContact O-N 3.32Å
54	I	48.2	Very low	49.7	Very low	153 Å²	153	122 Å²	122	79%	0.785	68%	0.681	S	S	*	*			trans	-75.4	82.7	163.2	-56	174.1	0	0	0	104.5	A52 P56	A52-I54 VanDerWaalsContact C-N 3.27Å; A52-I54 PolarHBondContact O-N 3.4Å; I54-P56 WeakPolarHBondContact O-CD 3.38Å
55	T	53.7	Low	50.3	Low	115 Å²	115	115.6 Å²	115.6	71%	0.706	67%	0.666	S	S	*	*			trans	-63.5	112.7	157.9	48.9	0	0	0	0	105.6	A53 S57	A53-T55 PolarHBondContact O-N 3.32Å; T55-S57 PolarHBondContact O-N 3.11Å
56	P	48.9	Very low	50.7	Low	93 Å²	93	110.6 Å²	110.6	60%	0.604	65%	0.645	S	S	*	*			trans	-60.2	116.7	172	25.1	-30.1	0	0	0	106.3	I54 E58	I54-P56 WeakPolarHBondContact O-CD 3.38Å; P56-E58 PolarHBondContact O-N 3.43Å
57	S	50.5	Low	51.1	Low	68 Å²	68	110.9 Å²	110.9	48%	0.476	63%	0.634	S	S	.	*			trans	-57.3	141.3	168.1	69.4	0	0	0	0	106.9	T55 S59 T60	T55-S57 PolarHBondContact O-N 3.11Å; S57-S59 PolarHBondContact O-N 3.45Å; S57-T60 PolarHBondContact O-N 2.76Å; S57-T60 PolarHBondContact OG-OG1 2.74Å
58	E	54.2	Low	51.6	Low	165 Å²	165	109.7 Å²	109.7	77%	0.771	63%	0.629	S	S	*	*	H	α-helix	trans	-51.2	-27.7	-176.6	-65.5	179.3	150.4	0	0	111.9	P56 T60 A61 F62	P56-E58 PolarHBondContact O-N 3.43Å; E58-T60 PolarHBondContact O-N 3.28Å; E58-A61 PolarHBondContact O-N 3Å; E58-F62 WeakPolarHBondContact O-CD2 3.5Å; E58-F62 PolarHBondContact O-N 3.07Å
59	S	53.7	Low	52.1	Low	86 Å²	86	111.5 Å²	111.5	60%	0.601	63%	0.626	S	S	*	*	H	α-helix	trans	-59.1	-35.8	173.8	-163.4	0	0	0	0	114.6	S57 D63	S57-S59 PolarHBondContact O-N 3.45Å; S59-D63 PolarHBondContact O-N 3.27Å
60	T	55.5	Low	52.7	Low	73 Å²	73	108.5 Å²	108.5	45%	0.448	62%	0.615	S	S	.	*	H	α-helix	trans	-77	-29.8	-179.2	-44.2	0	0	0	0	112.1	S57 E58 L64	S57-T60 PolarHBondContact O-N 2.76Å; S57-T60 PolarHBondContact OG-OG1 2.74Å; E58-T60 PolarHBondContact O-N 3.28Å; T60-L64 HydrophobicContact CG2-CD1 4.39Å; T60-L64 WeakPolarHBondContact O-CG 3.34Å; T60-L64 PolarHBondContact O-N 2.69Å; T60-L64 VanDerWaalsContact O-N 3.16Å
61	A	50.4	Low	53.3	Low	51 Å²	51	112.9 Å²	112.9	42%	0.421	61%	0.609	S	S	.	*	H	α-helix	trans	-69	-40.5	178	0	0	0	0	0	111.8	E58 V65	E58-A61 PolarHBondContact O-N 3Å; A61-V65 VanDerWaalsContact O-CG2 3.27Å; A61-V65 WeakPolarHBondContact O-CG2 3.38Å; A61-V65 PolarHBondContact O-N 2.96Å
62	F	51.2	Low	54	Low	146 Å²	146	112.3 Å²	112.3	64%	0.64	60%	0.6	S	S	*	*	H	α-helix	trans	-67.7	-37.3	176.3	-75.5	-74.2	0	0	0	112.7	E58 V65 N66	E58-F62 WeakPolarHBondContact O-CD2 3.5Å; E58-F62 PolarHBondContact O-N 3.07Å; F62-V65 PolarHBondContact O-N 3.21Å; F62-N66 WeakPolarHBondContact O-CB 3.42Å; F62-N66 PolarHBondContact O-N 3.07Å; F62-N66 PolarHBondContact O-ND2 3.28Å
63	D	56.2	Low	54.4	Low	108 Å²	108	117.1 Å²	117.1	58%	0.578	60%	0.6	S	S	*	*	H	α-helix	trans	-69.4	-38	178.5	-99.5	-14.7	0	0	0	112.8	S59 V65 N66 H67	S59-D63 PolarHBondContact O-N 3.27Å; D63-V65 PolarHBondContact O-N 3.24Å; D63-N66 PolarHBondContact O-N 3.34Å; D63-H67 VanDerWaalsContact O-CB 3.3Å; D63-H67 WeakPolarHBondContact O-CB 3.39Å; D63-H67 PolarHBondContact O-N 3.16Å
64	L	55.5	Low	54.7	Low	116 Å²	116	116.9 Å²	116.9	61%	0.607	59%	0.593	S	S	*	*	H	α-helix	trans	-62.1	-42.6	174.2	-76.6	166.3	0	0	0	111.9	T60 H67 Q68	T60-L64 HydrophobicContact CG2-CD1 4.39Å; T60-L64 WeakPolarHBondContact O-CG 3.34Å; T60-L64 PolarHBondContact O-N 2.69Å; T60-L64 VanDerWaalsContact O-N 3.16Å; L64-H67 PolarHBondContact O-N 3.08Å; L64-Q68 WeakPolarHBondContact O-CB 3.45Å; L64-Q68 PolarHBondContact O-N 3.11Å
65	V	60.3	Low	54.9	Low	83 Å²	83	116.1 Å²	116.1	50%	0.503	59%	0.586	S	S	.	*	H	α-helix	trans	-65.1	-41	177.2	175.5	0	0	0	0	111.1	A61 F62 D63 R69	A61-V65 VanDerWaalsContact O-CG2 3.27Å; A61-V65 WeakPolarHBondContact O-CG2 3.38Å; A61-V65 PolarHBondContact O-N 2.96Å; F62-V65 PolarHBondContact O-N 3.21Å; D63-V65 PolarHBondContact O-N 3.24Å; V65-R69 PolarHBondContact O-N 2.82Å
66	N	60	Low	54.8	Low	79 Å²	79	118.3 Å²	118.3	42%	0.422	59%	0.586	S	S	.	*	H	α-helix	trans	-68.5	-40.1	176.9	-78.9	-30.6	0	0	0	112.4	F62 D63 Q68 R69 R70	F62-N66 WeakPolarHBondContact O-CB 3.42Å; F62-N66 PolarHBondContact O-N 3.07Å; F62-N66 PolarHBondContact O-ND2 3.28Å; D63-N66 PolarHBondContact O-N 3.34Å; N66-Q68 VanDerWaalsContact C-N 3.35Å; N66-R69 PolarHBondContact O-N 3.25Å; N66-R70 WeakPolarHBondContact O-CG 3.43Å; N66-R70 PolarHBondContact O-N 3.44Å
67	H	59.1	Low	55.1	Low	112 Å²	112	121.8 Å²	121.8	52%	0.519	59%	0.591	S	S	.	*	H	α-helix	trans	-65.2	-40.4	177.3	-144.1	74.6	0	0	0	111.1	D63 L64 R70 R71	D63-H67 VanDerWaalsContact O-CB 3.3Å; D63-H67 WeakPolarHBondContact O-CB 3.39Å; D63-H67 PolarHBondContact O-N 3.16Å; L64-H67 PolarHBondContact O-N 3.08Å; H67-R70 PolarHBondContact O-N 3.4Å; H67-R71 WeakPolarHBondContact O-CG 3.5Å; H67-R71 PolarHBondContact O-N 3.04Å
68	Q	58.5	Low	55.2	Low	153 Å²	153	121.6 Å²	121.6	72%	0.715	59%	0.587	S	S	*	*	H	α-helix	trans	-67.5	-40.3	175.4	-165.6	138.5	6.5	0	0	112.4	L64 N66 R70 R71 S72	L64-Q68 WeakPolarHBondContact O-CB 3.45Å; L64-Q68 PolarHBondContact O-N 3.11Å; N66-Q68 VanDerWaalsContact C-N 3.35Å; Q68-R70 PolarHBondContact O-N 3.34Å; Q68-R71 PolarHBondContact O-N 3.42Å; Q68-S72 PolarHBondContact O-N 3.24Å
69	R	58.9	Low	55.2	Low	172 Å²	172	117.2 Å²	117.2	65%	0.649	57%	0.571	S	S	*	*	H	α-helix	trans	-61.3	-42.8	172.5	-86.2	-174.2	177.4	-173.3	1.2	112.2	V65 N66 S72 R73	V65-R69 PolarHBondContact O-N 2.82Å; N66-R69 PolarHBondContact O-N 3.25Å; R69-S72 PolarHBondContact O-N 3.28Å; R69-S72 PolarHBondContact O-OG 3.17Å; R69-R73 PolarHBondContact O-N 2.94Å
70	R	58.2	Low	55.5	Low	190 Å²	190	115 Å²	115	72%	0.717	56%	0.563	S	S	*	*	H	α-helix	trans	-64.8	-42.7	177.7	-73.7	-175.9	-178.6	-166.8	2.6	112	N66 H67 Q68 S72 R73 S74	N66-R70 WeakPolarHBondContact O-CG 3.43Å; N66-R70 PolarHBondContact O-N 3.44Å; H67-R70 PolarHBondContact O-N 3.4Å; Q68-R70 PolarHBondContact O-N 3.34Å; R70-S72 VanDerWaalsContact C-N 3.32Å; R70-S72 PolarHBondContact O-N 2.84Å; R70-R73 PolarHBondContact O-N 3.2Å; R70-S74 PolarHBondContact O-N 3.17Å
71	R	56.6	Low	55.8	Low	167 Å²	167	116.4 Å²	116.4	63%	0.63	57%	0.567	S	S	*	*	H	α-helix	trans	-59.9	-40.3	174.2	-73.3	-174.1	179.6	-168.8	1	112.5	H67 Q68 R73 S74 Q75	H67-R71 WeakPolarHBondContact O-CG 3.5Å; H67-R71 PolarHBondContact O-N 3.04Å; Q68-R71 PolarHBondContact O-N 3.42Å; R71-R73 VanDerWaalsContact C-N 3.31Å; R71-R73 PolarHBondContact O-N 3.35Å; R71-S74 PolarHBondContact O-N 2.84Å; R71-Q75 PolarHBondContact O-N 2.83Å; R71-Q75 VanDerWaalsContact O-N 3.13Å
72	S	56.6	Low	57.1	Low	52 Å²	52	118.1 Å²	118.1	36%	0.364	56%	0.562	S	S	.	*	H	α-helix	trans	-63.4	-34.5	178	80.1	0	0	0	0	113.3	Q68 R69 R70 K76	Q68-S72 PolarHBondContact O-N 3.24Å; R69-S72 PolarHBondContact O-N 3.28Å; R69-S72 PolarHBondContact O-OG 3.17Å; R70-S72 VanDerWaalsContact C-N 3.32Å; R70-S72 PolarHBondContact O-N 2.84Å; S72-K76 WeakPolarHBondContact O-CG 3.43Å; S72-K76 PolarHBondContact O-N 3.33Å; S72-K76 VanDerWaalsContact O-N 3.09Å
73	R	52.8	Low	58.8	Low	190 Å²	190	111.2 Å²	111.2	72%	0.717	53%	0.532	S	S	*	.	H	α-helix	trans	-71	-42.2	179.3	-74.9	-175.6	174.1	-174.7	-1.1	112	R69 R70 R71 K76	R69-R73 PolarHBondContact O-N 2.94Å; R70-R73 PolarHBondContact O-N 3.2Å; R71-R73 VanDerWaalsContact C-N 3.31Å; R71-R73 PolarHBondContact O-N 3.35Å; R73-K76 PolarHBondContact O-N 2.84Å
74	S	50.6	Low	60.5	Low	82 Å²	82	112.2 Å²	112.2	57%	0.573	53%	0.531	S	S	*	.	H	α-helix	trans	-65.6	-41.9	177.2	-59.2	0	0	0	0	111.4	R70 R71 K76 K77 T78	R70-S74 PolarHBondContact O-N 3.17Å; R71-S74 PolarHBondContact O-N 2.84Å; S74-K76 PolarHBondContact O-N 3.44Å; S74-K77 PolarHBondContact O-N 3.04Å; S74-T78 PolarHBondContact O-N 3.5Å; S74-T78 PolarHBondContact O-OG1 2.98Å; S74-T78 VanDerWaalsContact O-OG1 3.11Å
75	Q	50.7	Low	62.2	Low	137 Å²	137	108.6 Å²	108.6	64%	0.64	51%	0.511	S	S	*	.	H	α-helix	trans	-65.4	-35.2	176.6	-72	-165.2	-17.4	0	0	113.1	R71 K77 T78 V79	R71-Q75 PolarHBondContact O-N 2.83Å; R71-Q75 VanDerWaalsContact O-N 3.13Å; Q75-K77 VanDerWaalsContact C-N 3.26Å; Q75-K77 PolarHBondContact O-N 3.44Å; Q75-T78 PolarHBondContact O-N 2.9Å; Q75-V79 WeakPolarHBondContact O-CB 3.38Å; Q75-V79 VanDerWaalsContact O-CG2 3.22Å; Q75-V79 WeakPolarHBondContact O-CG2 3.26Å; Q75-V79 PolarHBondContact O-N 3.3Å
76	K	52.7	Low	63.8	Low	162 Å²	162	104.6 Å²	104.6	70%	0.704	49%	0.487	S	S	*	.	H	α-helix	trans	-58.2	-37.2	175.9	-83.9	-179.7	179.5	-176.5	0	112.7	S72 R73 S74 G80	S72-K76 WeakPolarHBondContact O-CG 3.43Å; S72-K76 PolarHBondContact O-N 3.33Å; S72-K76 VanDerWaalsContact O-N 3.09Å; R73-K76 PolarHBondContact O-N 2.84Å; S74-K76 PolarHBondContact O-N 3.44Å; K76-G80 PolarHBondContact O-N 3.4Å
77	K	54.9	Low	65.5	Low	166 Å²	166	102.3 Å²	102.3	72%	0.722	47%	0.473	S	S	*	.	H	α-helix	trans	-69.5	-44.9	175.7	-70.1	-172.3	177.2	-175	0	111.6	S74 Q75 V79 G80 I81	S74-K77 PolarHBondContact O-N 3.04Å; Q75-K77 VanDerWaalsContact C-N 3.26Å; Q75-K77 PolarHBondContact O-N 3.44Å; K77-V79 VanDerWaalsContact C-N 3.33Å; K77-V79 PolarHBondContact O-N 2.74Å; K77-G80 PolarHBondContact O-N 3.44Å; K77-I81 WeakPolarHBondContact O-CG1 3.45Å; K77-I81 PolarHBondContact O-N 3.39Å
78	T	52.7	Low	67.2	Low	64 Å²	64	99.8 Å²	99.8	39%	0.393	46%	0.461	S	S	.	.	H	α-helix	trans	-65.5	-35.1	-179.3	-38	0	0	0	0	112.7	S74 Q75 G80 I81 R82	S74-T78 PolarHBondContact O-N 3.5Å; S74-T78 PolarHBondContact O-OG1 2.98Å; S74-T78 VanDerWaalsContact O-OG1 3.11Å; Q75-T78 PolarHBondContact O-N 2.9Å; T78-G80 VanDerWaalsContact C-N 3.31Å; T78-G80 PolarHBondContact O-N 3.33Å; T78-I81 PolarHBondContact O-N 3.21Å; T78-R82 WeakPolarHBondContact O-CG 3.44Å; T78-R82 PolarHBondContact O-N 2.89Å; T78-R82 VanDerWaalsContact O-N 3.08Å
79	V	54.4	Low	69	Low	72 Å²	72	93.4 Å²	93.4	44%	0.436	43%	0.432	S	S	.	.	H	α-helix	trans	-68.8	-30.3	177.1	172.1	0	0	0	0	112	Q75 K77 G83	Q75-V79 WeakPolarHBondContact O-CB 3.38Å; Q75-V79 VanDerWaalsContact O-CG2 3.22Å; Q75-V79 WeakPolarHBondContact O-CG2 3.26Å; Q75-V79 PolarHBondContact O-N 3.3Å; K77-V79 VanDerWaalsContact C-N 3.33Å; K77-V79 PolarHBondContact O-N 2.74Å; V79-G83 PolarHBondContact O-N 2.99Å
80	G	59.8	Low	70.8	Confident	41 Å²	41	85.2 Å²	85.2	42%	0.423	40%	0.401	S	S	.	.	H	α-helix	trans	-70.3	-42.2	173.6	0	0	0	0	0	112.6	K76 K77 T78	K76-G80 PolarHBondContact O-N 3.4Å; K77-G80 PolarHBondContact O-N 3.44Å; T78-G80 VanDerWaalsContact C-N 3.31Å; T78-G80 PolarHBondContact O-N 3.33Å
81	I	61.5	Low	72.6	Confident	102 Å²	102	80 Å²	80	52%	0.523	38%	0.381	S	S	.	.	H	α-helix	trans	-59.1	-61	176.3	-63.8	167.3	0	0	0	108.3	K77 T78 G83 K84 E85	K77-I81 WeakPolarHBondContact O-CG1 3.45Å; K77-I81 PolarHBondContact O-N 3.39Å; T78-I81 PolarHBondContact O-N 3.21Å; I81-G83 VanDerWaalsContact C-N 3.26Å; I81-G83 PolarHBondContact O-N 2.76Å; I81-K84 WeakPolarHBondContact O-CB 3.21Å; I81-K84 PolarHBondContact O-N 2.98Å; I81-E85 WeakPolarHBondContact CG2-OE1 3.03Å
82	R	78.8	Confident	74.5	Confident	86 Å²	86	76.8 Å²	76.8	33%	0.325	38%	0.376	S	S	.	.	H	α-helix	trans	-51.8	-39.7	-174.3	-70.4	-175.4	-178.9	-152.6	0.3	114.4	T78 K84 E85 V86 L120 W123	T78-R82 WeakPolarHBondContact O-CG 3.44Å; T78-R82 PolarHBondContact O-N 2.89Å; T78-R82 VanDerWaalsContact O-N 3.08Å; R82-K84 PolarHBondContact O-N 2.64Å; R82-E85 WeakPolarHBondContact CA-OE2 3.34Å; R82-E85 PolarHBondContact N-OE2 3.27Å; R82-E85 PolarHBondContact O-N 2.98Å; R82-V86 PolarHBondContact O-N 2.68Å; R82-L120 HydrophobicContact CB-CD2 4.44Å; R82-L120 HydrophobicContact CG-CD2 4.25Å; R82-W123 HydrophobicContact CB-CH2 3.78Å; R82-W123 HydrophobicContact CB-CZ2 4.17Å; R82-W123 HydrophobicContact CB-CZ3 4.33Å; R82-W123 WeakPolarHBondContact O-CH2 3.4Å; R82-W123 WeakPolarHBondContact O-CZ3 3.43Å
83	G	86.7	Confident	76.4	Confident	1 Å²	1	75.2 Å²	75.2	1%	0.01	36%	0.364	C	S	.	.	H	α-helix	trans	-63.4	-24.1	179.6	0	0	0	0	0	114.1	V79 I81 Y87 E131 R140	V79-G83 PolarHBondContact O-N 2.99Å; I81-G83 VanDerWaalsContact C-N 3.26Å; I81-G83 PolarHBondContact O-N 2.76Å; G83-Y87 WeakPolarHBondContact O-CB 3.48Å; G83-Y87 PolarHBondContact O-N 3.28Å; G83-E131 WeakPolarHBondContact CA-OE1 3.3Å; G83-R140 PolarHBondContact O-NH1 3.31Å
84	K	90.8	Very high	78.5	Confident	130 Å²	130	66.2 Å²	66.2	57%	0.565	33%	0.33	S	S	*	.	H	α-helix	trans	-70.9	-41.1	175.4	-171.4	-175.5	175.8	-171.7	0	111.1	I81 R82 Y87 E88	I81-K84 WeakPolarHBondContact O-CB 3.21Å; I81-K84 PolarHBondContact O-N 2.98Å; R82-K84 PolarHBondContact O-N 2.64Å; K84-Y87 WeakPolarHBondContact O-CA 3.5Å; K84-Y87 VanDerWaalsContact O-CB 3.31Å; K84-Y87 WeakPolarHBondContact O-CB 3.33Å; K84-Y87 PolarHBondContact O-N 3.37Å; K84-Y87 VanDerWaalsContact O-N 3.11Å; K84-E88 PolarHBondContact O-N 2.95Å
85	E	91.6	Very high	80.6	Confident	39 Å²	39	64.2 Å²	64.2	18%	0.182	31%	0.312	C	S	.	.	H	α-helix	trans	-69.5	-37.1	-178.2	-65	79	-167.1	0	0	112.1	I81 R82 Y87 E88 I89 V119 L120	I81-E85 WeakPolarHBondContact CG2-OE1 3.03Å; R82-E85 WeakPolarHBondContact CA-OE2 3.34Å; R82-E85 PolarHBondContact N-OE2 3.27Å; R82-E85 PolarHBondContact O-N 2.98Å; E85-Y87 PolarHBondContact O-N 2.92Å; E85-E88 PolarHBondContact O-N 3.42Å; E85-I89 VanDerWaalsContact O-CG1 3.29Å; E85-I89 WeakPolarHBondContact O-CG1 3.29Å; E85-I89 PolarHBondContact O-N 3.33Å; E85-V119 HydrophobicContact CG-CB 4.37Å; E85-V119 HydrophobicContact CG-CG1 3.75Å; E85-L120 HydrophobicContact CB-CD1 3.7Å; E85-L120 HydrophobicContact CB-CD2 4.18Å; E85-L120 HydrophobicContact CB-CG 4.15Å
86	V	94.3	Very high	82.6	Confident	0 Å²	0	59.6 Å²	59.6	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-61.4	-41.2	169.9	-174.8	0	0	0	0	110.2	R82 E88 I89 V90 I110 I114 W123 L128 E131 L132	R82-V86 PolarHBondContact O-N 2.68Å; V86-E88 VanDerWaalsContact C-N 3.33Å; V86-E88 PolarHBondContact O-N 2.82Å; V86-I89 PolarHBondContact O-N 3.03Å; V86-V90 HydrophobicContact CG1-CG2 4.01Å; V86-V90 WeakPolarHBondContact O-CB 3.29Å; V86-V90 VanDerWaalsContact O-CG2 3.27Å; V86-V90 WeakPolarHBondContact O-CG2 3.4Å; V86-V90 PolarHBondContact O-N 3.1Å; V86-I110 HydrophobicContact CG1-CG2 4.15Å; V86-I114 HydrophobicContact CG2-CD1 4.08Å; V86-W123 HydrophobicContact CB-CH2 4.26Å; V86-W123 HydrophobicContact CB-CZ3 4.32Å; V86-W123 HydrophobicContact CG2-CE3 3.84Å; V86-W123 HydrophobicContact CG2-CH2 2.93Å; V86-W123 HydrophobicContact CG2-CZ2 3.81Å; V86-W123 HydrophobicContact CG2-CZ3 2.93Å; V86-L128 HydrophobicContact CG1-CD1 3.83Å; V86-L128 HydrophobicContact CG2-CD1 4.49Å; V86-E131 HydrophobicContact CB-CG 4.4Å; V86-E131 HydrophobicContact CG2-CG 4.21Å; V86-L132 HydrophobicContact CG1-CD2 4.39Å
87	Y	95.7	Very high	84.4	Confident	30 Å²	30	57 Å²	57	12%	0.118	30%	0.295	C	S	.	.	H	α-helix	trans	-60.1	-47.3	-179.6	-178.3	-94.5	0	0	0	110.7	G83 K84 E85 V90 R91 R140 Y141 T151 E153	G83-Y87 WeakPolarHBondContact O-CB 3.48Å; G83-Y87 PolarHBondContact O-N 3.28Å; K84-Y87 WeakPolarHBondContact O-CA 3.5Å; K84-Y87 VanDerWaalsContact O-CB 3.31Å; K84-Y87 WeakPolarHBondContact O-CB 3.33Å; K84-Y87 PolarHBondContact O-N 3.37Å; K84-Y87 VanDerWaalsContact O-N 3.11Å; E85-Y87 PolarHBondContact O-N 2.92Å; Y87-V90 PolarHBondContact O-N 3.47Å; Y87-R91 WeakPolarHBondContact O-CB 3.36Å; Y87-R91 PolarHBondContact O-N 2.83Å; Y87-R140 HydrophobicContact CD2-CB 4.13Å; Y87-R140 HydrophobicContact CE2-CB 4.09Å; Y87-Y141 VanDerWaalsContact CA-OH 3.22Å; Y87-Y141 WeakPolarHBondContact CA-OH 3.42Å; Y87-Y141 HydrophobicContact CD2-CD1 4.28Å; Y87-Y141 AromaticContact CD2-CE1 3.59Å; Y87-Y141 HydrophobicContact CD2-CE1 3.59Å; Y87-Y141 HydrophobicContact CE2-CE1 4.37Å; Y87-Y141 HydrophobicContact CG-CE1 4.4Å; Y87-Y141 PolarHBondContact N-OH 3.49Å; Y87-Y141 VanDerWaalsContact N-OH 3.16Å; Y87-T151 HydrophobicContact CD2-CG2 4.03Å; Y87-T151 HydrophobicContact CE2-CG2 3.61Å; Y87-E153 VanDerWaalsContact OH-CD 3.22Å; Y87-E153 PolarHBondContact OH-OE1 3.31Å
88	E	95.3	Very high	86.2	Confident	59 Å²	59	56.6 Å²	56.6	28%	0.276	30%	0.296	S	S	.	.	H	α-helix	trans	-63.6	-41.5	176	-65.2	-54.6	149.2	0	0	112.3	K84 E85 V86 V90 R91 N92	K84-E88 PolarHBondContact O-N 2.95Å; E85-E88 PolarHBondContact O-N 3.42Å; V86-E88 VanDerWaalsContact C-N 3.33Å; V86-E88 PolarHBondContact O-N 2.82Å; E88-V90 PolarHBondContact O-N 2.92Å; E88-R91 PolarHBondContact O-N 3.18Å; E88-R91 IonicContact OE2-NH1 3.97Å; E88-R91 PolarHBondContact OE2-NH1 3.18Å; E88-N92 WeakPolarHBondContact O-CB 3.17Å; E88-N92 PolarHBondContact O-N 3.39Å; E88-N92 PolarHBondContact O-ND2 2.96Å; E88-N92 PolarHBondContact O-OD1 3.44Å
89	I	95.4	Very high	88.1	Confident	20 Å²	20	54.2 Å²	54.2	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-57.7	-50.6	174.6	-71.3	167.8	0	0	0	110.5	E85 V86 R91 N92 L93 I110 E113 I114 L120	E85-I89 VanDerWaalsContact O-CG1 3.29Å; E85-I89 WeakPolarHBondContact O-CG1 3.29Å; E85-I89 PolarHBondContact O-N 3.33Å; V86-I89 PolarHBondContact O-N 3.03Å; I89-R91 VanDerWaalsContact C-N 3.33Å; I89-R91 PolarHBondContact O-N 3.36Å; I89-N92 PolarHBondContact O-N 3.49Å; I89-L93 HydrophobicContact CG2-CD1 3.76Å; I89-L93 WeakPolarHBondContact O-CB 3.35Å; I89-L93 WeakPolarHBondContact O-CG 3.45Å; I89-L93 PolarHBondContact O-N 3.25Å; I89-I110 HydrophobicContact CG2-CG2 4.28Å; I89-E113 HydrophobicContact CG2-CB 3.85Å; I89-E113 HydrophobicContact CG2-CG 3.79Å; I89-I114 HydrophobicContact CD1-CG1 3.67Å; I89-L120 HydrophobicContact CD1-CD1 3.85Å
90	V	96.5	Very high	90	Very high	0 Å²	0	58.2 Å²	58.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-63.6	-41.1	178.7	177	0	0	0	0	110.6	V86 Y87 E88 L93 T94 V105 I110 Y141 T151	V86-V90 HydrophobicContact CG1-CG2 4.01Å; V86-V90 WeakPolarHBondContact O-CB 3.29Å; V86-V90 VanDerWaalsContact O-CG2 3.27Å; V86-V90 WeakPolarHBondContact O-CG2 3.4Å; V86-V90 PolarHBondContact O-N 3.1Å; Y87-V90 PolarHBondContact O-N 3.47Å; E88-V90 PolarHBondContact O-N 2.92Å; V90-L93 PolarHBondContact O-N 2.85Å; V90-T94 HydrophobicContact CG1-CG2 4.39Å; V90-T94 WeakPolarHBondContact O-CB 3.13Å; V90-T94 WeakPolarHBondContact O-CG2 3.17Å; V90-T94 PolarHBondContact O-N 2.98Å; V90-T94 PolarHBondContact O-OG1 3.37Å; V90-V105 HydrophobicContact CG1-CG1 4.16Å; V90-I110 HydrophobicContact CG2-CD1 3.74Å; V90-I110 HydrophobicContact CG2-CG1 3.99Å; V90-I110 HydrophobicContact CG2-CG2 4.13Å; V90-Y141 HydrophobicContact CB-CE1 4.11Å; V90-Y141 HydrophobicContact CG1-CD1 4.21Å; V90-Y141 HydrophobicContact CG1-CE1 4.2Å; V90-Y141 HydrophobicContact CG2-CE1 4.22Å; V90-T151 HydrophobicContact CB-CG2 4.33Å; V90-T151 HydrophobicContact CG1-CG2 3.97Å
91	R	96.5	Very high	91.7	Very high	79 Å²	79	60 Å²	60	30%	0.298	30%	0.295	S	S	.	.	H	α-helix	trans	-62.5	-44.4	179.1	-171	-179.1	-174	-137	0.2	112	Y87 E88 I89 T94 H95 T151 E153 N154	Y87-R91 WeakPolarHBondContact O-CB 3.36Å; Y87-R91 PolarHBondContact O-N 2.83Å; E88-R91 PolarHBondContact O-N 3.18Å; E88-R91 IonicContact OE2-NH1 3.97Å; E88-R91 PolarHBondContact OE2-NH1 3.18Å; I89-R91 VanDerWaalsContact C-N 3.33Å; I89-R91 PolarHBondContact O-N 3.36Å; R91-T94 PolarHBondContact O-N 3.38Å; R91-H95 PolarHBondContact O-N 3.49Å; R91-H95 VanDerWaalsContact O-N 3.07Å; R91-T151 HydrophobicContact CB-CG2 3.81Å; R91-T151 HydrophobicContact CG-CG2 4.37Å; R91-E153 IonicContact CZ-OE2 3.38Å; R91-E153 IonicContact NE-OE2 2.88Å; R91-E153 PolarHBondContact NE-OE2 3.5Å; R91-E153 IonicContact NH2-OE2 3.83Å; R91-E153 PolarHBondContact NH2-OE2 3.35Å; R91-N154 PolarHBondContact O-ND2 2.84Å
92	N	96.4	Very high	93.2	Very high	100 Å²	100	57.3 Å²	57.3	54%	0.535	28%	0.284	S	S	.	.	H	α-helix	trans	-69.3	-44.4	179.6	-66.6	-12.3	0	0	0	110.6	E88 I89 T94 H95 G99	E88-N92 WeakPolarHBondContact O-CB 3.17Å; E88-N92 PolarHBondContact O-N 3.39Å; E88-N92 PolarHBondContact O-ND2 2.96Å; E88-N92 PolarHBondContact O-OD1 3.44Å; I89-N92 PolarHBondContact O-N 3.49Å; N92-T94 PolarHBondContact O-N 3.2Å; N92-H95 PolarHBondContact O-N 3.47Å; N92-G99 VanDerWaalsContact O-CA 3.27Å; N92-G99 WeakPolarHBondContact O-CA 3.17Å
93	L	96.4	Very high	93.7	Very high	20 Å²	20	57 Å²	57	11%	0.105	29%	0.294	C	S	.	.	H	α-helix	trans	-62.9	-30.3	178.1	-70.3	172.2	0	0	0	112.9	I89 V90 G99 H100 F101 V105 E113	I89-L93 HydrophobicContact CG2-CD1 3.76Å; I89-L93 WeakPolarHBondContact O-CB 3.35Å; I89-L93 WeakPolarHBondContact O-CG 3.45Å; I89-L93 PolarHBondContact O-N 3.25Å; V90-L93 PolarHBondContact O-N 2.85Å; L93-G99 CarbonylContact O-C 3.52Å; L93-G99 WeakPolarHBondContact O-CA 3.48Å; L93-H100 PolarHBondContact O-N 3.26Å; L93-F101 HydrophobicContact CB-CD2 4.42Å; L93-F101 HydrophobicContact CD2-CD2 4.27Å; L93-F101 HydrophobicContact CD2-CE2 4.41Å; L93-F101 CarbonylContact O-C 3.51Å; L93-F101 WeakPolarHBondContact O-CA 3.48Å; L93-F101 PolarHBondContact O-N 2.93Å; L93-V105 HydrophobicContact CB-CG2 4.48Å; L93-V105 HydrophobicContact CD1-CG2 4.1Å; L93-E113 HydrophobicContact CD1-CB 4.42Å
94	T	96.6	Very high	94.1	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	30%	0.298	C	S	.	.	T	Hydrogen-bonded Turn	trans	-106.5	11.1	-175.6	62	0	0	0	0	114.2	V90 R91 N92 F101 V105 N154	V90-T94 HydrophobicContact CG1-CG2 4.39Å; V90-T94 WeakPolarHBondContact O-CB 3.13Å; V90-T94 WeakPolarHBondContact O-CG2 3.17Å; V90-T94 PolarHBondContact O-N 2.98Å; V90-T94 PolarHBondContact O-OG1 3.37Å; R91-T94 PolarHBondContact O-N 3.38Å; N92-T94 PolarHBondContact O-N 3.2Å; T94-F101 WeakPolarHBondContact CA-O 3.22Å; T94-F101 WeakPolarHBondContact CG2-O 3.39Å; T94-V105 HydrophobicContact CG2-CB 4.05Å; T94-V105 HydrophobicContact CG2-CG1 3.7Å; T94-N154 VanDerWaalsContact C-ND2 3.34Å; T94-N154 WeakPolarHBondContact O-CB 3.48Å; T94-N154 PolarHBondContact O-ND2 3.44Å; T94-N154 PolarHBondContact OG1-ND2 3.16Å
95	H	95.5	Very high	94.4	Very high	41 Å²	41	51.2 Å²	51.2	19%	0.19	27%	0.271	C	S	.	.			trans	-61.3	133.1	177.4	-163.9	-100	0	0	0	109.8	R91 N92 S97 E98 G99 N154	R91-H95 PolarHBondContact O-N 3.49Å; R91-H95 VanDerWaalsContact O-N 3.07Å; N92-H95 PolarHBondContact O-N 3.47Å; H95-S97 VanDerWaalsContact C-N 3.26Å; H95-S97 PolarHBondContact O-N 3.11Å; H95-E98 HydrophobicContact CB-CB 4.29Å; H95-E98 PolarHBondContact ND1-N 2.79Å; H95-G99 WeakPolarHBondContact O-CA 3.31Å; H95-G99 PolarHBondContact O-N 3.34Å; H95-N154 PolarHBondContact N-ND2 2.82Å
96	P	92.6	Very high	94.7	Very high	40 Å²	40	51 Å²	51	26%	0.26	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-30.9	-172.3	21.2	-33.5	0	0	0	114	K157	P96-K157 HydrophobicContact CG-CB 4.05Å
97	S	90.4	Very high	94.7	Very high	106 Å²	106	51.4 Å²	51.4	74%	0.741	28%	0.278	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.5	-27.4	-175.7	-51.7	0	0	0	0	114	H95	H95-S97 VanDerWaalsContact C-N 3.26Å; H95-S97 PolarHBondContact O-N 3.11Å
98	E	92.1	Very high	94.7	Very high	158 Å²	158	58.4 Å²	58.4	74%	0.738	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	-13.5	-171.2	-62.4	174.1	-170.2	0	0	112.1	H95	H95-E98 HydrophobicContact CB-CB 4.29Å; H95-E98 PolarHBondContact ND1-N 2.79Å
99	G	92.6	Very high	94.7	Very high	15 Å²	15	58.7 Å²	58.7	16%	0.155	31%	0.312	C	S	.	.			trans	-82.7	145.1	-175.8	0	0	0	0	0	111.5	N92 L93 H95 F101	N92-G99 VanDerWaalsContact O-CA 3.27Å; N92-G99 WeakPolarHBondContact O-CA 3.17Å; L93-G99 CarbonylContact O-C 3.52Å; L93-G99 WeakPolarHBondContact O-CA 3.48Å; H95-G99 WeakPolarHBondContact O-CA 3.31Å; H95-G99 PolarHBondContact O-N 3.34Å; G99-F101 PolarHBondContact O-N 3.42Å
100	H	94.5	Very high	94.7	Very high	155 Å²	155	57.7 Å²	57.7	72%	0.718	31%	0.307	S	S	*	.	S	Bend	trans	-72.1	-21.3	175.4	-66.1	76.2	0	0	0	112.2	L93	L93-H100 PolarHBondContact O-N 3.26Å
101	F	95.1	Very high	94.7	Very high	79 Å²	79	60.9 Å²	60.9	35%	0.346	32%	0.319	S	S	.	.			trans	-133.6	63.8	-173.6	-56.1	-77.6	0	0	0	111.6	L93 T94 G99 C103 G104 V105 I109	L93-F101 HydrophobicContact CB-CD2 4.42Å; L93-F101 HydrophobicContact CD2-CD2 4.27Å; L93-F101 HydrophobicContact CD2-CE2 4.41Å; L93-F101 CarbonylContact O-C 3.51Å; L93-F101 WeakPolarHBondContact O-CA 3.48Å; L93-F101 PolarHBondContact O-N 2.93Å; T94-F101 WeakPolarHBondContact CA-O 3.22Å; T94-F101 WeakPolarHBondContact CG2-O 3.39Å; G99-F101 PolarHBondContact O-N 3.42Å; F101-C103 PolarHBondContact O-N 3.16Å; F101-C103 VanDerWaalsContact O-N 3.1Å; F101-G104 PolarHBondContact O-N 2.84Å; F101-V105 HydrophobicContact CB-CB 4.11Å; F101-V105 HydrophobicContact CD2-CB 4.48Å; F101-V105 HydrophobicContact CD2-CG2 4.03Å; F101-V105 HydrophobicContact CG-CB 4.41Å; F101-V105 HydrophobicContact CG-CG2 4.31Å; F101-I109 HydrophobicContact CD2-CG2 4.43Å; F101-I109 HydrophobicContact CE2-CG2 3.72Å; F101-I109 HydrophobicContact CZ-CG2 4.12Å
102	P	92.7	Very high	94.6	Very high	46 Å²	46	58.7 Å²	58.7	30%	0.299	32%	0.318	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-22.7	-174.1	25.9	-35.7	0	0	0	113.9
103	C	91	Very high	94.5	Very high	80 Å²	80	57.5 Å²	57.5	54%	0.541	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.6	5.1	177.6	-61	0	0	0	0	113.8	F101 V144	F101-C103 PolarHBondContact O-N 3.16Å; F101-C103 VanDerWaalsContact O-N 3.1Å; C103-V144 WeakPolarHBondContact O-CG1 3.29Å
104	G	94.8	Very high	94.3	Very high	8 Å²	8	56.6 Å²	56.6	8%	0.082	31%	0.305	C	S	.	.			trans	114	154	-179.7	0	0	0	0	0	113.1	F101 Y149	F101-G104 PolarHBondContact O-N 2.84Å; G104-Y149 CarbonylContact C-O 3.55Å; G104-Y149 VanDerWaalsContact CA-O 3.29Å; G104-Y149 WeakPolarHBondContact CA-O 3.4Å
105	V	97.1	Very high	94.1	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.006	33%	0.331	C	S	.	.	B	Isolated β-bridge	trans	-121.5	141.1	-171.4	63.4	0	0	0	0	111.5	V90 L93 T94 F101 I109 I110 Y149	V90-V105 HydrophobicContact CG1-CG1 4.16Å; L93-V105 HydrophobicContact CB-CG2 4.48Å; L93-V105 HydrophobicContact CD1-CG2 4.1Å; T94-V105 HydrophobicContact CG2-CB 4.05Å; T94-V105 HydrophobicContact CG2-CG1 3.7Å; F101-V105 HydrophobicContact CB-CB 4.11Å; F101-V105 HydrophobicContact CD2-CB 4.48Å; F101-V105 HydrophobicContact CD2-CG2 4.03Å; F101-V105 HydrophobicContact CG-CB 4.41Å; F101-V105 HydrophobicContact CG-CG2 4.31Å; V105-I109 HydrophobicContact CG2-CB 3.78Å; V105-I109 HydrophobicContact CG2-CG2 3.8Å; V105-I110 HydrophobicContact CB-CG1 4.47Å; V105-I110 HydrophobicContact CG1-CD1 3.77Å; V105-I110 HydrophobicContact CG1-CG1 3.68Å; V105-I110 HydrophobicContact CG2-CG1 4Å; V105-Y149 WeakPolarHBondContact CG1-O 3.3Å; V105-Y149 PolarHBondContact N-O 3.09Å; V105-Y149 PolarHBondContact O-N 3.25Å
106	A	96.5	Very high	93.8	Very high	33 Å²	33	68.2 Å²	68.2	27%	0.273	35%	0.354	S	S	.	.			trans	-79.2	145.3	178.1	0	0	0	0	0	111.9	K108 I109 I110 L148	A106-K108 PolarHBondContact O-N 3.44Å; A106-K108 VanDerWaalsContact O-N 3.1Å; A106-I109 HydrophobicContact CB-CG1 4.47Å; A106-I109 WeakPolarHBondContact O-CB 3.27Å; A106-I109 PolarHBondContact O-N 3.45Å; A106-I110 PolarHBondContact O-N 3.07Å; A106-I110 VanDerWaalsContact O-N 3.14Å; A106-L148 HydrophobicContact CB-CD2 4.09Å
107	P	95.6	Very high	93.6	Very high	10 Å²	10	67.8 Å²	67.8	7%	0.065	35%	0.352	C	S	.	.	H	α-helix	trans	-55.2	-30.7	178.2	-33.2	39.9	0	0	0	115	W19 I109 I110 Y111 L132 A147 Y149	W19-P107 HydrophobicContact CH2-CB 3.85Å; W19-P107 HydrophobicContact CH2-CG 3.81Å; W19-P107 HydrophobicContact CZ2-CB 3.89Å; W19-P107 HydrophobicContact CZ2-CG 3.66Å; P107-I109 VanDerWaalsContact C-N 3.32Å; P107-I109 PolarHBondContact O-N 3.46Å; P107-I110 PolarHBondContact O-N 3.41Å; P107-Y111 WeakPolarHBondContact O-CB 3.47Å; P107-Y111 PolarHBondContact O-N 3.27Å; P107-L132 HydrophobicContact CB-CD1 4.02Å; P107-L132 HydrophobicContact CG-CD1 3.84Å; P107-A147 WeakPolarHBondContact CD-O 3.19Å; P107-Y149 HydrophobicContact CG-CD2 3.74Å; P107-Y149 HydrophobicContact CG-CE2 3.46Å; P107-Y149 VanDerWaalsContact CG-CE2 3.46Å
108	K	95.3	Very high	93.3	Very high	176 Å²	176	68 Å²	68	77%	0.765	35%	0.354	S	S	*	.	H	α-helix	trans	-61.7	-40.8	175.2	-175.8	177.5	178.6	-178.9	0	111.8	A106 A112	A106-K108 PolarHBondContact O-N 3.44Å; A106-K108 VanDerWaalsContact O-N 3.1Å; K108-A112 PolarHBondContact O-N 3.25Å
109	I	95.8	Very high	92.9	Very high	65 Å²	65	64.5 Å²	64.5	33%	0.333	34%	0.343	S	S	.	.	H	α-helix	trans	-72.6	-43.5	178.8	-57.3	-58.4	0	0	0	110.3	F101 V105 A106 P107 Y111 A112 E113	F101-I109 HydrophobicContact CD2-CG2 4.43Å; F101-I109 HydrophobicContact CE2-CG2 3.72Å; F101-I109 HydrophobicContact CZ-CG2 4.12Å; V105-I109 HydrophobicContact CG2-CB 3.78Å; V105-I109 HydrophobicContact CG2-CG2 3.8Å; A106-I109 HydrophobicContact CB-CG1 4.47Å; A106-I109 WeakPolarHBondContact O-CB 3.27Å; A106-I109 PolarHBondContact O-N 3.45Å; P107-I109 VanDerWaalsContact C-N 3.32Å; P107-I109 PolarHBondContact O-N 3.46Å; I109-Y111 VanDerWaalsContact C-N 3.26Å; I109-Y111 PolarHBondContact O-N 2.88Å; I109-A112 WeakPolarHBondContact O-CB 3.41Å; I109-A112 PolarHBondContact O-N 3.43Å; I109-E113 PolarHBondContact O-N 3.46Å
110	I	95.6	Very high	92.6	Very high	0 Å²	0	63.8 Å²	63.8	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-56.4	-45.6	174.1	-59.6	163	0	0	0	110.1	V86 I89 V90 V105 A106 P107 A112 E113 I114 L128 L132	V86-I110 HydrophobicContact CG1-CG2 4.15Å; I89-I110 HydrophobicContact CG2-CG2 4.28Å; V90-I110 HydrophobicContact CG2-CD1 3.74Å; V90-I110 HydrophobicContact CG2-CG1 3.99Å; V90-I110 HydrophobicContact CG2-CG2 4.13Å; V105-I110 HydrophobicContact CB-CG1 4.47Å; V105-I110 HydrophobicContact CG1-CD1 3.77Å; V105-I110 HydrophobicContact CG1-CG1 3.68Å; V105-I110 HydrophobicContact CG2-CG1 4Å; A106-I110 PolarHBondContact O-N 3.07Å; A106-I110 VanDerWaalsContact O-N 3.14Å; P107-I110 PolarHBondContact O-N 3.41Å; I110-A112 PolarHBondContact O-N 3.48Å; I110-E113 PolarHBondContact O-N 3.02Å; I110-I114 HydrophobicContact CG2-CD1 3.88Å; I110-I114 HydrophobicContact CG2-CG1 4.42Å; I110-I114 VanDerWaalsContact O-CG1 3.3Å; I110-I114 WeakPolarHBondContact O-CG1 3.22Å; I110-I114 PolarHBondContact O-N 3.24Å; I110-L128 HydrophobicContact CB-CD2 4.25Å; I110-L128 HydrophobicContact CG2-CD1 3.74Å; I110-L128 HydrophobicContact CG2-CD2 4.12Å; I110-L132 HydrophobicContact CD1-CD1 4.17Å; I110-L132 HydrophobicContact CD1-CD2 4.13Å
111	Y	95.3	Very high	91.7	Very high	66 Å²	66	60.6 Å²	60.6	26%	0.259	33%	0.329	S	S	.	.	H	α-helix	trans	-63.5	-41.8	178.8	-170.5	-113.6	0	0	0	112.4	P107 I109 E113 I114 L115 W123 R125 L128	P107-Y111 WeakPolarHBondContact O-CB 3.47Å; P107-Y111 PolarHBondContact O-N 3.27Å; I109-Y111 VanDerWaalsContact C-N 3.26Å; I109-Y111 PolarHBondContact O-N 2.88Å; Y111-E113 PolarHBondContact O-N 2.86Å; Y111-I114 WeakPolarHBondContact O-CB 3.5Å; Y111-I114 PolarHBondContact O-N 3.42Å; Y111-L115 HydrophobicContact CD1-CD1 4.02Å; Y111-L115 HydrophobicContact CD1-CG 4.34Å; Y111-L115 HydrophobicContact CE1-CD1 3.69Å; Y111-L115 HydrophobicContact CE1-CD2 4.24Å; Y111-L115 HydrophobicContact CE1-CG 4.04Å; Y111-L115 HydrophobicContact CE2-CD2 4.5Å; Y111-L115 WeakPolarHBondContact O-CG 3.27Å; Y111-L115 PolarHBondContact O-N 3.16Å; Y111-W123 WeakPolarHBondContact CE2-O 3.34Å; Y111-W123 PolarHBondContact OH-O 3.32Å; Y111-R125 HydrophobicContact CE2-CB 4.2Å; Y111-R125 VanDerWaalsContact CE2-N 3.31Å; Y111-L128 HydrophobicContact CD2-CD2 4.06Å; Y111-L128 HydrophobicContact CG-CD2 4.32Å
112	A	94.8	Very high	91.2	Very high	33 Å²	33	63 Å²	63	27%	0.273	35%	0.345	S	S	.	.	H	α-helix	trans	-59.7	-38	175.4	0	0	0	0	0	111.9	K108 I109 I110 L115 R116	K108-A112 PolarHBondContact O-N 3.25Å; I109-A112 WeakPolarHBondContact O-CB 3.41Å; I109-A112 PolarHBondContact O-N 3.43Å; I110-A112 PolarHBondContact O-N 3.48Å; A112-L115 PolarHBondContact O-N 2.95Å; A112-R116 PolarHBondContact O-N 3.41Å
113	E	93.9	Very high	91.1	Very high	76 Å²	76	61.4 Å²	61.4	36%	0.355	33%	0.333	S	S	.	.	H	α-helix	trans	-72	-36.7	176.7	-161.4	57.7	-159.8	0	0	112.6	I89 L93 I109 I110 Y111 L115 R116 S117	I89-E113 HydrophobicContact CG2-CB 3.85Å; I89-E113 HydrophobicContact CG2-CG 3.79Å; L93-E113 HydrophobicContact CD1-CB 4.42Å; I109-E113 PolarHBondContact O-N 3.46Å; I110-E113 PolarHBondContact O-N 3.02Å; Y111-E113 PolarHBondContact O-N 2.86Å; E113-L115 VanDerWaalsContact C-N 3.31Å; E113-L115 PolarHBondContact O-N 3.41Å; E113-R116 PolarHBondContact O-N 3Å; E113-R116 VanDerWaalsContact O-N 3.13Å; E113-R116 IonicContact OE2-NH1 3.55Å; E113-S117 PolarHBondContact O-N 2.84Å; E113-S117 VanDerWaalsContact O-N 3.1Å
114	I	93.3	Very high	91	Very high	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-41.6	172.7	-71.7	170.6	0	0	0	111.2	V86 I89 I110 Y111 R116 S117 L120 W123 L128	V86-I114 HydrophobicContact CG2-CD1 4.08Å; I89-I114 HydrophobicContact CD1-CG1 3.67Å; I110-I114 HydrophobicContact CG2-CD1 3.88Å; I110-I114 HydrophobicContact CG2-CG1 4.42Å; I110-I114 VanDerWaalsContact O-CG1 3.3Å; I110-I114 WeakPolarHBondContact O-CG1 3.22Å; I110-I114 PolarHBondContact O-N 3.24Å; Y111-I114 WeakPolarHBondContact O-CB 3.5Å; Y111-I114 PolarHBondContact O-N 3.42Å; I114-R116 PolarHBondContact O-N 3.49Å; I114-S117 VanDerWaalsContact O-CB 3.31Å; I114-S117 WeakPolarHBondContact O-CB 3.39Å; I114-S117 PolarHBondContact O-N 2.85Å; I114-L120 HydrophobicContact CG1-CD1 4.09Å; I114-L120 HydrophobicContact CG2-CB 3.79Å; I114-L120 HydrophobicContact CG2-CD1 4.18Å; I114-W123 HydrophobicContact CD1-CE3 4.01Å; I114-W123 HydrophobicContact CG1-CE3 4.42Å; I114-W123 HydrophobicContact CG2-CB 3.61Å; I114-W123 HydrophobicContact CG2-CD2 4.36Å; I114-W123 HydrophobicContact CG2-CE3 3.92Å; I114-W123 HydrophobicContact CG2-CG 4.25Å; I114-L128 HydrophobicContact CD1-CD1 3.72Å; I114-L128 HydrophobicContact CD1-CD2 4.2Å; I114-L128 HydrophobicContact CD1-CG 4.35Å
115	L	91.4	Very high	91	Very high	105 Å²	105	65.7 Å²	65.7	55%	0.55	34%	0.343	S	S	.	.	H	α-helix	trans	-64.4	-24.8	177.2	-69	178.3	0	0	0	113.2	Y111 A112 E113	Y111-L115 HydrophobicContact CD1-CD1 4.02Å; Y111-L115 HydrophobicContact CD1-CG 4.34Å; Y111-L115 HydrophobicContact CE1-CD1 3.69Å; Y111-L115 HydrophobicContact CE1-CD2 4.24Å; Y111-L115 HydrophobicContact CE1-CG 4.04Å; Y111-L115 HydrophobicContact CE2-CD2 4.5Å; Y111-L115 WeakPolarHBondContact O-CG 3.27Å; Y111-L115 PolarHBondContact O-N 3.16Å; A112-L115 PolarHBondContact O-N 2.95Å; E113-L115 VanDerWaalsContact C-N 3.31Å; E113-L115 PolarHBondContact O-N 3.41Å
116	R	90.4	Very high	90.8	Very high	181 Å²	181	71 Å²	71	68%	0.683	37%	0.371	S	S	*	.	H	α-helix	trans	-84.5	-17.2	173.1	-65.1	-176.5	-177.9	103	2.6	112.8	A112 E113 I114	A112-R116 PolarHBondContact O-N 3.41Å; E113-R116 PolarHBondContact O-N 3Å; E113-R116 VanDerWaalsContact O-N 3.13Å; E113-R116 IonicContact OE2-NH1 3.55Å; I114-R116 PolarHBondContact O-N 3.49Å
117	S	87.1	Confident	90.6	Very high	30 Å²	30	73.4 Å²	73.4	21%	0.21	38%	0.377	C	S	.	.			trans	-76.5	124.3	-178.3	-174.8	0	0	0	0	111.4	E113 I114 V119 L120	E113-S117 PolarHBondContact O-N 2.84Å; E113-S117 VanDerWaalsContact O-N 3.1Å; I114-S117 VanDerWaalsContact O-CB 3.31Å; I114-S117 WeakPolarHBondContact O-CB 3.39Å; I114-S117 PolarHBondContact O-N 2.85Å; S117-V119 PolarHBondContact O-N 2.96Å; S117-V119 PolarHBondContact OG-N 2.95Å; S117-L120 PolarHBondContact O-N 3.28Å
118	S	85.1	Confident	90.5	Very high	112 Å²	112	73.1 Å²	73.1	78%	0.783	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.3	-19.8	172.3	57.4	0	0	0	0	113.3
119	V	83.6	Confident	90.4	Very high	84 Å²	84	66.1 Å²	66.1	51%	0.509	34%	0.344	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.6	-22	-176.7	-168.1	0	0	0	0	111.6	E85 S117 P121	E85-V119 HydrophobicContact CG-CB 4.37Å; E85-V119 HydrophobicContact CG-CG1 3.75Å; S117-V119 PolarHBondContact O-N 2.96Å; S117-V119 PolarHBondContact OG-N 2.95Å; V119-P121 WeakPolarHBondContact O-CD 3.44Å
120	L	85.2	Confident	90.3	Very high	0 Å²	0	67.3 Å²	67.3	0%	0	35%	0.354	C	S	.	.			trans	-124.4	45.8	-171.8	-59.3	166.1	0	0	0	113.2	R82 E85 I89 I114 S117 N122 W123	R82-L120 HydrophobicContact CB-CD2 4.44Å; R82-L120 HydrophobicContact CG-CD2 4.25Å; E85-L120 HydrophobicContact CB-CD1 3.7Å; E85-L120 HydrophobicContact CB-CD2 4.18Å; E85-L120 HydrophobicContact CB-CG 4.15Å; I89-L120 HydrophobicContact CD1-CD1 3.85Å; I114-L120 HydrophobicContact CG1-CD1 4.09Å; I114-L120 HydrophobicContact CG2-CB 3.79Å; I114-L120 HydrophobicContact CG2-CD1 4.18Å; S117-L120 PolarHBondContact O-N 3.28Å; L120-N122 PolarHBondContact O-N 3.14Å; L120-W123 HydrophobicContact CB-CB 4.45Å; L120-W123 HydrophobicContact CB-CE3 3.82Å; L120-W123 HydrophobicContact CB-CZ3 4.49Å; L120-W123 HydrophobicContact CD1-CE3 3.44Å; L120-W123 VanDerWaalsContact CD1-CE3 3.44Å; L120-W123 HydrophobicContact CD1-CZ3 3.43Å; L120-W123 VanDerWaalsContact CD1-CZ3 3.43Å; L120-W123 HydrophobicContact CD2-CD2 4.31Å; L120-W123 HydrophobicContact CD2-CE3 3.34Å; L120-W123 HydrophobicContact CD2-CH2 4.27Å; L120-W123 HydrophobicContact CD2-CZ3 3.26Å; L120-W123 HydrophobicContact CG-CE3 3.65Å; L120-W123 HydrophobicContact CG-CZ3 3.82Å; L120-W123 PolarHBondContact O-N 2.95Å
121	P	76.8	Confident	90.2	Very high	88 Å²	88	67.8 Å²	67.8	57%	0.571	36%	0.357	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.6	-21.3	-164.9	27.8	-36.5	0	0	0	114.4	V119	V119-P121 WeakPolarHBondContact O-CD 3.44Å
122	N	84.4	Confident	90.1	Very high	128 Å²	128	64.6 Å²	64.6	68%	0.684	34%	0.344	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120	24.5	-173.9	-62.9	-32.7	0	0	0	112.6	L120 T124	L120-N122 PolarHBondContact O-N 3.14Å; N122-T124 PolarHBondContact O-N 3.1Å
123	W	89.4	Confident	90	Very high	14 Å²	14	67.2 Å²	67.2	5%	0.053	35%	0.347	C	S	.	.			trans	-78.7	125.9	-177.9	-143.3	-22.1	0	0	0	110.9	R82 V86 Y111 I114 L120 E131	R82-W123 HydrophobicContact CB-CH2 3.78Å; R82-W123 HydrophobicContact CB-CZ2 4.17Å; R82-W123 HydrophobicContact CB-CZ3 4.33Å; R82-W123 WeakPolarHBondContact O-CH2 3.4Å; R82-W123 WeakPolarHBondContact O-CZ3 3.43Å; V86-W123 HydrophobicContact CB-CH2 4.26Å; V86-W123 HydrophobicContact CB-CZ3 4.32Å; V86-W123 HydrophobicContact CG2-CE3 3.84Å; V86-W123 HydrophobicContact CG2-CH2 2.93Å; V86-W123 HydrophobicContact CG2-CZ2 3.81Å; V86-W123 HydrophobicContact CG2-CZ3 2.93Å; Y111-W123 WeakPolarHBondContact CE2-O 3.34Å; Y111-W123 PolarHBondContact OH-O 3.32Å; I114-W123 HydrophobicContact CD1-CE3 4.01Å; I114-W123 HydrophobicContact CG1-CE3 4.42Å; I114-W123 HydrophobicContact CG2-CB 3.61Å; I114-W123 HydrophobicContact CG2-CD2 4.36Å; I114-W123 HydrophobicContact CG2-CE3 3.92Å; I114-W123 HydrophobicContact CG2-CG 4.25Å; L120-W123 HydrophobicContact CB-CB 4.45Å; L120-W123 HydrophobicContact CB-CE3 3.82Å; L120-W123 HydrophobicContact CB-CZ3 4.49Å; L120-W123 HydrophobicContact CD1-CE3 3.44Å; L120-W123 VanDerWaalsContact CD1-CE3 3.44Å; L120-W123 HydrophobicContact CD1-CZ3 3.43Å; L120-W123 VanDerWaalsContact CD1-CZ3 3.43Å; L120-W123 HydrophobicContact CD2-CD2 4.31Å; L120-W123 HydrophobicContact CD2-CE3 3.34Å; L120-W123 HydrophobicContact CD2-CH2 4.27Å; L120-W123 HydrophobicContact CD2-CZ3 3.26Å; L120-W123 HydrophobicContact CG-CE3 3.65Å; L120-W123 HydrophobicContact CG-CZ3 3.82Å; L120-W123 PolarHBondContact O-N 2.95Å; W123-E131 HydrophobicContact CH2-CG 4.46Å; W123-E131 HydrophobicContact CZ2-CB 4.22Å; W123-E131 HydrophobicContact CZ2-CG 4.35Å
124	T	90.6	Very high	90	Very high	64 Å²	64	67.7 Å²	67.7	39%	0.393	35%	0.346	S	S	.	.			trans	-87.2	155	173.7	74.1	0	0	0	0	112.3	N122 N126 Q127 L128	N122-T124 PolarHBondContact O-N 3.1Å; T124-N126 PolarHBondContact O-N 2.94Å; T124-Q127 PolarHBondContact O-N 3.37Å; T124-Q127 VanDerWaalsContact O-N 3.09Å; T124-Q127 VanDerWaalsContact OG1-CG 3.31Å; T124-Q127 WeakPolarHBondContact OG1-CG 3.39Å; T124-Q127 PolarHBondContact OG1-N 3.49Å; T124-Q127 PolarHBondContact OG1-OE1 3.21Å; T124-L128 PolarHBondContact O-N 3.24Å
125	R	92.7	Very high	90	Very high	114 Å²	114	67.7 Å²	67.7	43%	0.43	35%	0.346	S	S	.	.	H	α-helix	trans	-52.2	-40.8	173	-172.5	-175.6	-176.6	-162.8	6.6	112.6	Y111 Q127 L128 Q129	Y111-R125 HydrophobicContact CE2-CB 4.2Å; Y111-R125 VanDerWaalsContact CE2-N 3.31Å; R125-Q127 PolarHBondContact O-N 3.36Å; R125-L128 WeakPolarHBondContact O-CB 3.5Å; R125-L128 PolarHBondContact O-N 3.38Å; R125-Q129 PolarHBondContact O-N 3.4Å
126	N	93.4	Very high	90.1	Very high	112 Å²	112	65 Å²	65	60%	0.599	33%	0.334	S	S	*	.	H	α-helix	trans	-64.6	-41	179.2	-70.2	-5	0	0	0	111.8	T124 Q129 V130	T124-N126 PolarHBondContact O-N 2.94Å; N126-Q129 WeakPolarHBondContact O-CB 3.47Å; N126-Q129 PolarHBondContact O-N 3.02Å; N126-V130 WeakPolarHBondContact O-CG2 3.44Å; N126-V130 PolarHBondContact O-N 3.4Å
127	Q	92.5	Very high	90.3	Very high	84 Å²	84	63.3 Å²	63.3	39%	0.393	33%	0.331	S	S	.	.	H	α-helix	trans	-70.6	-34.5	178.2	-64.9	169	-38.6	0	0	111.4	T124 R125 Q129 V130 E131	T124-Q127 PolarHBondContact O-N 3.37Å; T124-Q127 VanDerWaalsContact O-N 3.09Å; T124-Q127 VanDerWaalsContact OG1-CG 3.31Å; T124-Q127 WeakPolarHBondContact OG1-CG 3.39Å; T124-Q127 PolarHBondContact OG1-N 3.49Å; T124-Q127 PolarHBondContact OG1-OE1 3.21Å; R125-Q127 PolarHBondContact O-N 3.36Å; Q127-Q129 VanDerWaalsContact C-N 3.34Å; Q127-V130 PolarHBondContact O-N 3.3Å; Q127-E131 WeakPolarHBondContact O-CB 3.48Å; Q127-E131 PolarHBondContact O-N 2.68Å
128	L	94.3	Very high	90.6	Very high	3 Å²	3	66.9 Å²	66.9	2%	0.016	35%	0.348	C	S	.	.	H	α-helix	trans	-59.2	-46.8	168.9	170.3	61.8	0	0	0	110.7	V86 I110 Y111 I114 T124 R125 V130 E131 L132	V86-L128 HydrophobicContact CG1-CD1 3.83Å; V86-L128 HydrophobicContact CG2-CD1 4.49Å; I110-L128 HydrophobicContact CB-CD2 4.25Å; I110-L128 HydrophobicContact CG2-CD1 3.74Å; I110-L128 HydrophobicContact CG2-CD2 4.12Å; Y111-L128 HydrophobicContact CD2-CD2 4.06Å; Y111-L128 HydrophobicContact CG-CD2 4.32Å; I114-L128 HydrophobicContact CD1-CD1 3.72Å; I114-L128 HydrophobicContact CD1-CD2 4.2Å; I114-L128 HydrophobicContact CD1-CG 4.35Å; T124-L128 PolarHBondContact O-N 3.24Å; R125-L128 WeakPolarHBondContact O-CB 3.5Å; R125-L128 PolarHBondContact O-N 3.38Å; L128-V130 VanDerWaalsContact C-N 3.33Å; L128-V130 PolarHBondContact O-N 3.33Å; L128-E131 PolarHBondContact O-N 3.43Å; L128-E131 VanDerWaalsContact O-N 3.16Å; L128-L132 HydrophobicContact CD1-CD1 3.94Å; L128-L132 HydrophobicContact CD1-CD2 4.33Å; L128-L132 HydrophobicContact CD1-CG 3.81Å; L128-L132 HydrophobicContact CG-CD1 4.03Å; L128-L132 HydrophobicContact CG-CG 4.31Å; L128-L132 WeakPolarHBondContact O-CG 3.35Å; L128-L132 PolarHBondContact O-N 3.38Å
129	Q	92.8	Very high	91	Very high	30 Å²	30	63.7 Å²	63.7	14%	0.14	33%	0.333	C	S	.	.	H	α-helix	trans	-59.7	-43.6	178.6	-179.2	170.3	5.3	0	0	112.2	F16 W19 R125 N126 Q127 L132 Y133	F16-Q129 HydrophobicContact CE1-CG 4.07Å; F16-Q129 HydrophobicContact CZ-CG 4.33Å; W19-Q129 HydrophobicContact CZ3-CB 4.19Å; W19-Q129 VanDerWaalsContact CZ3-CD 3.46Å; W19-Q129 HydrophobicContact CZ3-CG 3.88Å; R125-Q129 PolarHBondContact O-N 3.4Å; N126-Q129 WeakPolarHBondContact O-CB 3.47Å; N126-Q129 PolarHBondContact O-N 3.02Å; Q127-Q129 VanDerWaalsContact C-N 3.34Å; Q129-L132 PolarHBondContact O-N 3.09Å; Q129-Y133 WeakPolarHBondContact O-CB 3.06Å; Q129-Y133 PolarHBondContact O-N 3.13Å
130	V	93	Very high	91.5	Very high	89 Å²	89	62.6 Å²	62.6	54%	0.539	32%	0.32	S	S	.	.	H	α-helix	trans	-61.7	-43.7	174.8	170.9	0	0	0	0	111	N126 Q127 L128 Y133 R134	N126-V130 WeakPolarHBondContact O-CG2 3.44Å; N126-V130 PolarHBondContact O-N 3.4Å; Q127-V130 PolarHBondContact O-N 3.3Å; L128-V130 VanDerWaalsContact C-N 3.33Å; L128-V130 PolarHBondContact O-N 3.33Å; V130-Y133 PolarHBondContact O-N 3.11Å; V130-R134 WeakPolarHBondContact O-CB 3.43Å; V130-R134 PolarHBondContact O-N 3.33Å
131	E	93.5	Very high	92	Very high	10 Å²	10	62.8 Å²	62.8	5%	0.047	32%	0.32	C	S	.	.	H	α-helix	trans	-68.5	-39.3	-179.6	-176.6	56.1	-158	0	0	112.4	G83 V86 W123 Q127 L128 R134 G135 R140	G83-E131 WeakPolarHBondContact CA-OE1 3.3Å; V86-E131 HydrophobicContact CB-CG 4.4Å; V86-E131 HydrophobicContact CG2-CG 4.21Å; W123-E131 HydrophobicContact CH2-CG 4.46Å; W123-E131 HydrophobicContact CZ2-CB 4.22Å; W123-E131 HydrophobicContact CZ2-CG 4.35Å; Q127-E131 WeakPolarHBondContact O-CB 3.48Å; Q127-E131 PolarHBondContact O-N 2.68Å; L128-E131 PolarHBondContact O-N 3.43Å; L128-E131 VanDerWaalsContact O-N 3.16Å; E131-R134 PolarHBondContact O-N 3.28Å; E131-R134 IonicContact OE1-NH1 2.68Å; E131-R134 IonicContact OE2-CZ 2.9Å; E131-R134 IonicContact OE2-NH1 3.23Å; E131-R134 PolarHBondContact OE2-NH1 2.92Å; E131-G135 PolarHBondContact O-N 3.19Å; E131-R140 IonicContact OE1-CZ 3.83Å; E131-R140 VanDerWaalsContact OE1-CZ 3.23Å; E131-R140 IonicContact OE1-NH1 2.76Å; E131-R140 PolarHBondContact OE1-NH1 3.42Å; E131-R140 IonicContact OE1-NH2 3.44Å; E131-R140 PolarHBondContact OE1-NH2 3.47Å; E131-R140 IonicContact OE2-NH2 3.4Å
132	L	94.5	Very high	92.8	Very high	0 Å²	0	61 Å²	61	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-63.2	-47	173.3	-70.5	177.5	0	0	0	111	V86 P107 I110 L128 Q129 R134 G135 V136 Y141 Y149	V86-L132 HydrophobicContact CG1-CD2 4.39Å; P107-L132 HydrophobicContact CB-CD1 4.02Å; P107-L132 HydrophobicContact CG-CD1 3.84Å; I110-L132 HydrophobicContact CD1-CD1 4.17Å; I110-L132 HydrophobicContact CD1-CD2 4.13Å; L128-L132 HydrophobicContact CD1-CD1 3.94Å; L128-L132 HydrophobicContact CD1-CD2 4.33Å; L128-L132 HydrophobicContact CD1-CG 3.81Å; L128-L132 HydrophobicContact CG-CD1 4.03Å; L128-L132 HydrophobicContact CG-CG 4.31Å; L128-L132 WeakPolarHBondContact O-CG 3.35Å; L128-L132 PolarHBondContact O-N 3.38Å; Q129-L132 PolarHBondContact O-N 3.09Å; L132-R134 PolarHBondContact O-N 3.42Å; L132-G135 PolarHBondContact O-N 3.18Å; L132-V136 WeakPolarHBondContact O-CG2 3.44Å; L132-V136 PolarHBondContact O-N 3.08Å; L132-Y141 HydrophobicContact CD2-CD2 4.12Å; L132-Y141 HydrophobicContact CD2-CE2 4.04Å; L132-Y149 HydrophobicContact CB-CD1 4.35Å; L132-Y149 HydrophobicContact CB-CE1 3.91Å; L132-Y149 HydrophobicContact CD1-CD2 4.23Å; L132-Y149 HydrophobicContact CD1-CE1 4.49Å; L132-Y149 HydrophobicContact CD1-CE2 4.12Å; L132-Y149 HydrophobicContact CD1-CG 4.48Å; L132-Y149 HydrophobicContact CD2-CD1 4.18Å; L132-Y149 HydrophobicContact CD2-CG 4.31Å
133	Y	92.7	Very high	93.3	Very high	87 Å²	87	60 Å²	60	34%	0.341	29%	0.292	S	S	.	.	H	α-helix	trans	-60.5	-46.6	176.7	177	-102.4	0	0	0	112	Q129 V130 V136 K137	Q129-Y133 WeakPolarHBondContact O-CB 3.06Å; Q129-Y133 PolarHBondContact O-N 3.13Å; V130-Y133 PolarHBondContact O-N 3.11Å; Y133-V136 PolarHBondContact O-N 3.36Å; Y133-K137 HydrophobicContact CD1-CD 4.34Å; Y133-K137 HydrophobicContact CE1-CD 3.66Å; Y133-K137 HydrophobicContact CE1-CG 4.44Å; Y133-K137 VanDerWaalsContact CZ-CE 3.4Å; Y133-K137 PolarHBondContact O-N 3.39Å; Y133-K137 WeakPolarHBondContact OH-CE 3.22Å; Y133-K137 PolarHBondContact OH-NZ 3.22Å
134	R	93.3	Very high	93.4	Very high	86 Å²	86	61.5 Å²	61.5	33%	0.325	30%	0.303	S	S	.	.	H	α-helix	trans	-61.5	-43.2	175.7	177.1	-177.7	163.9	-142.5	3.5	111.2	V130 E131 L132 K137 L138	V130-R134 WeakPolarHBondContact O-CB 3.43Å; V130-R134 PolarHBondContact O-N 3.33Å; E131-R134 PolarHBondContact O-N 3.28Å; E131-R134 IonicContact OE1-NH1 2.68Å; E131-R134 IonicContact OE2-CZ 2.9Å; E131-R134 IonicContact OE2-NH1 3.23Å; E131-R134 PolarHBondContact OE2-NH1 2.92Å; L132-R134 PolarHBondContact O-N 3.42Å; R134-K137 PolarHBondContact O-N 3.4Å; R134-L138 HydrophobicContact CG-CD1 3.81Å; R134-L138 HydrophobicContact CG-CG 4.4Å; R134-L138 WeakPolarHBondContact O-CB 3.48Å; R134-L138 VanDerWaalsContact O-CG 3.26Å; R134-L138 WeakPolarHBondContact O-CG 3.41Å; R134-L138 PolarHBondContact O-N 3.06Å
135	G	93.7	Very high	93.3	Very high	0 Å²	0	60.3 Å²	60.3	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-67.6	-33.2	179.5	0	0	0	0	0	113.1	E131 L132 L138 G139 R140 Y141	E131-G135 PolarHBondContact O-N 3.19Å; L132-G135 PolarHBondContact O-N 3.18Å; G135-L138 PolarHBondContact O-N 3.47Å; G135-G139 PolarHBondContact O-N 3.27Å; G135-G139 VanDerWaalsContact O-N 3.17Å; G135-R140 PolarHBondContact O-N 3.33Å; G135-Y141 VanDerWaalsContact CA-CD2 3.44Å; G135-Y141 PolarHBondContact O-N 3.3Å
136	V	93.9	Very high	92.9	Very high	49 Å²	49	61.1 Å²	61.1	30%	0.297	32%	0.319	S	S	.	.	H	α-helix	trans	-63.9	-48.3	169	172.5	0	0	0	0	110.6	L132 Y133 L138 G139 R143 Y149	L132-V136 WeakPolarHBondContact O-CG2 3.44Å; L132-V136 PolarHBondContact O-N 3.08Å; Y133-V136 PolarHBondContact O-N 3.36Å; V136-L138 PolarHBondContact O-N 2.94Å; V136-G139 PolarHBondContact O-N 3.42Å; V136-R143 HydrophobicContact CG2-CG 4.11Å; V136-Y149 HydrophobicContact CG2-CD1 4.11Å; V136-Y149 HydrophobicContact CG2-CE1 3.79Å
137	K	93.4	Very high	92.6	Very high	145 Å²	145	57.8 Å²	57.8	63%	0.63	31%	0.307	S	S	*	.	H	α-helix	trans	-59.4	-32.3	176.9	-81.9	-170.7	157.7	178.3	0	113.7	Y133 R134	Y133-K137 HydrophobicContact CD1-CD 4.34Å; Y133-K137 HydrophobicContact CE1-CD 3.66Å; Y133-K137 HydrophobicContact CE1-CG 4.44Å; Y133-K137 VanDerWaalsContact CZ-CE 3.4Å; Y133-K137 PolarHBondContact O-N 3.39Å; Y133-K137 WeakPolarHBondContact OH-CE 3.22Å; Y133-K137 PolarHBondContact OH-NZ 3.22Å; R134-K137 PolarHBondContact O-N 3.4Å
138	L	92.9	Very high	92.7	Very high	105 Å²	105	56.5 Å²	56.5	55%	0.55	30%	0.303	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.7	2.6	178.5	-66.1	174.7	0	0	0	113.5	R134 G135 V136 R140	R134-L138 HydrophobicContact CG-CD1 3.81Å; R134-L138 HydrophobicContact CG-CG 4.4Å; R134-L138 WeakPolarHBondContact O-CB 3.48Å; R134-L138 VanDerWaalsContact O-CG 3.26Å; R134-L138 WeakPolarHBondContact O-CG 3.41Å; R134-L138 PolarHBondContact O-N 3.06Å; G135-L138 PolarHBondContact O-N 3.47Å; V136-L138 PolarHBondContact O-N 2.94Å; L138-R140 VanDerWaalsContact C-N 3.27Å; L138-R140 PolarHBondContact O-N 2.99Å
139	G	93.8	Very high	92.8	Very high	46 Å²	46	56.8 Å²	56.8	47%	0.474	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.3	14.9	-179.7	0	0	0	0	0	115.2	G135 V136 T152	G135-G139 PolarHBondContact O-N 3.27Å; G135-G139 VanDerWaalsContact O-N 3.17Å; V136-G139 PolarHBondContact O-N 3.42Å; G139-T152 WeakPolarHBondContact O-CB 3.31Å; G139-T152 PolarHBondContact O-OG1 3.38Å
140	R	94.4	Very high	93	Very high	61 Å²	61	55.4 Å²	55.4	23%	0.23	30%	0.297	C	S	.	.	S	Bend	trans	-79.9	-37.9	174.6	-70.2	-173.5	-73.7	151.9	2.9	112.1	G83 Y87 E131 G135 L138 T152	G83-R140 PolarHBondContact O-NH1 3.31Å; Y87-R140 HydrophobicContact CD2-CB 4.13Å; Y87-R140 HydrophobicContact CE2-CB 4.09Å; E131-R140 IonicContact OE1-CZ 3.83Å; E131-R140 VanDerWaalsContact OE1-CZ 3.23Å; E131-R140 IonicContact OE1-NH1 2.76Å; E131-R140 PolarHBondContact OE1-NH1 3.42Å; E131-R140 IonicContact OE1-NH2 3.44Å; E131-R140 PolarHBondContact OE1-NH2 3.47Å; E131-R140 IonicContact OE2-NH2 3.4Å; G135-R140 PolarHBondContact O-N 3.33Å; L138-R140 VanDerWaalsContact C-N 3.27Å; L138-R140 PolarHBondContact O-N 2.99Å; R140-T152 PolarHBondContact O-N 3.49Å; R140-T152 VanDerWaalsContact O-N 3.08Å; R140-T152 PolarHBondContact O-OG1 3.02Å
141	Y	95.8	Very high	93.2	Very high	4 Å²	4	51.1 Å²	51.1	2%	0.016	27%	0.271	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	149.1	178.6	-52.4	-56.3	0	0	0	111	Y87 V90 L132 G135 S150 T151	Y87-Y141 VanDerWaalsContact CA-OH 3.22Å; Y87-Y141 WeakPolarHBondContact CA-OH 3.42Å; Y87-Y141 HydrophobicContact CD2-CD1 4.28Å; Y87-Y141 AromaticContact CD2-CE1 3.59Å; Y87-Y141 HydrophobicContact CD2-CE1 3.59Å; Y87-Y141 HydrophobicContact CE2-CE1 4.37Å; Y87-Y141 HydrophobicContact CG-CE1 4.4Å; Y87-Y141 PolarHBondContact N-OH 3.49Å; Y87-Y141 VanDerWaalsContact N-OH 3.16Å; V90-Y141 HydrophobicContact CB-CE1 4.11Å; V90-Y141 HydrophobicContact CG1-CD1 4.21Å; V90-Y141 HydrophobicContact CG1-CE1 4.2Å; V90-Y141 HydrophobicContact CG2-CE1 4.22Å; L132-Y141 HydrophobicContact CD2-CD2 4.12Å; L132-Y141 HydrophobicContact CD2-CE2 4.04Å; G135-Y141 VanDerWaalsContact CA-CD2 3.44Å; G135-Y141 PolarHBondContact O-N 3.3Å; Y141-S150 CarbonylContact C-O 3.57Å; Y141-S150 VanDerWaalsContact CA-O 3.29Å; Y141-S150 WeakPolarHBondContact CA-O 2.96Å; Y141-T151 HydrophobicContact CD1-CG2 4.4Å; Y141-T151 HydrophobicContact CE1-CG2 4.45Å
142	I	94.7	Very high	93.3	Very high	51 Å²	51	52.1 Å²	52.1	26%	0.262	28%	0.278	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	140	168.5	-64.5	176.3	0	0	0	108	V144 Y149 S150 T152 W155	I142-V144 PolarHBondContact O-N 2.97Å; I142-Y149 WeakPolarHBondContact O-CA 3.38Å; I142-S150 PolarHBondContact N-O 3.28Å; I142-S150 PolarHBondContact O-N 3.22Å; I142-T152 HydrophobicContact CD1-CG2 4.11Å; I142-W155 HydrophobicContact CD1-CB 3.99Å; I142-W155 HydrophobicContact CD1-CG 3.9Å
143	R	94.7	Very high	93.2	Very high	107 Å²	107	56 Å²	56	40%	0.404	30%	0.296	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.4	106.2	166.1	-73.2	-178.7	171.5	-170.7	-2.2	108.2	V136 L148 Y149	V136-R143 HydrophobicContact CG2-CG 4.11Å; R143-L148 CarbonylContact C-O 3.55Å; R143-L148 WeakPolarHBondContact CA-O 3.05Å; R143-Y149 HydrophobicContact CG-CD1 4.13Å; R143-Y149 HydrophobicContact CG-CE1 3.76Å; R143-Y149 PolarHBondContact NE-OH 3.34Å; R143-Y149 PolarHBondContact NH2-OH 2.87Å
144	V	91.2	Very high	93.3	Very high	45 Å²	45	51.9 Å²	51.9	27%	0.273	28%	0.28	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	-37.4	-178.2	-179	0	0	0	0	110.7	C103 I142 L148 W155	C103-V144 WeakPolarHBondContact O-CG1 3.29Å; I142-V144 PolarHBondContact O-N 2.97Å; V144-L148 HydrophobicContact CB-CB 4.48Å; V144-L148 PolarHBondContact N-O 2.97Å; V144-W155 HydrophobicContact CB-CZ3 4.29Å; V144-W155 HydrophobicContact CG1-CE3 4.1Å; V144-W155 HydrophobicContact CG1-CH2 3.83Å; V144-W155 HydrophobicContact CG1-CZ3 3.4Å; V144-W155 HydrophobicContact CG2-CD2 4.4Å; V144-W155 HydrophobicContact CG2-CE3 3.71Å; V144-W155 HydrophobicContact CG2-CZ3 3.92Å
145	A	88.7	Confident	93.2	Very high	38 Å²	38	50.9 Å²	50.9	31%	0.314	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	173.5	178.3	0	0	0	0	0	109.2	A147 L148	A145-A147 PolarHBondContact O-N 3.03Å; A145-L148 HydrophobicContact CB-CB 4.13Å; A145-L148 HydrophobicContact CB-CD1 3.97Å; A145-L148 HydrophobicContact CB-CG 4.18Å; A145-L148 PolarHBondContact O-N 3.05Å
146	P	83.8	Confident	93.1	Very high	131 Å²	131	57.3 Å²	57.3	85%	0.851	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-50.2	115.9	168.6	-26.4	36	0	0	0	110.3	L148	P146-L148 VanDerWaalsContact C-N 3.33Å; P146-L148 PolarHBondContact O-N 3.32Å
147	A	86.7	Confident	93	Very high	42 Å²	42	59.4 Å²	59.4	35%	0.347	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	15.6	-178.3	0	0	0	0	0	117.7	P107 A145	P107-A147 WeakPolarHBondContact CD-O 3.19Å; A145-A147 PolarHBondContact O-N 3.03Å
148	L	95.3	Very high	92.6	Very high	58 Å²	58	53.1 Å²	53.1	30%	0.304	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	133	169.2	-63	-176.5	0	0	0	111.5	A106 R143 V144 A145 P146	A106-L148 HydrophobicContact CB-CD2 4.09Å; R143-L148 CarbonylContact C-O 3.55Å; R143-L148 WeakPolarHBondContact CA-O 3.05Å; V144-L148 HydrophobicContact CB-CB 4.48Å; V144-L148 PolarHBondContact N-O 2.97Å; A145-L148 HydrophobicContact CB-CB 4.13Å; A145-L148 HydrophobicContact CB-CD1 3.97Å; A145-L148 HydrophobicContact CB-CG 4.18Å; A145-L148 PolarHBondContact O-N 3.05Å; P146-L148 VanDerWaalsContact C-N 3.33Å; P146-L148 PolarHBondContact O-N 3.32Å
149	Y	96.9	Very high	92.3	Very high	9 Å²	9	51.2 Å²	51.2	4%	0.035	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.6	142.4	-179.1	-66.4	-99	0	0	0	110.6	G104 V105 P107 L132 V136 I142 R143	G104-Y149 CarbonylContact C-O 3.55Å; G104-Y149 VanDerWaalsContact CA-O 3.29Å; G104-Y149 WeakPolarHBondContact CA-O 3.4Å; V105-Y149 WeakPolarHBondContact CG1-O 3.3Å; V105-Y149 PolarHBondContact N-O 3.09Å; V105-Y149 PolarHBondContact O-N 3.25Å; P107-Y149 HydrophobicContact CG-CD2 3.74Å; P107-Y149 HydrophobicContact CG-CE2 3.46Å; P107-Y149 VanDerWaalsContact CG-CE2 3.46Å; L132-Y149 HydrophobicContact CB-CD1 4.35Å; L132-Y149 HydrophobicContact CB-CE1 3.91Å; L132-Y149 HydrophobicContact CD1-CD2 4.23Å; L132-Y149 HydrophobicContact CD1-CE1 4.49Å; L132-Y149 HydrophobicContact CD1-CE2 4.12Å; L132-Y149 HydrophobicContact CD1-CG 4.48Å; L132-Y149 HydrophobicContact CD2-CD1 4.18Å; L132-Y149 HydrophobicContact CD2-CG 4.31Å; V136-Y149 HydrophobicContact CG2-CD1 4.11Å; V136-Y149 HydrophobicContact CG2-CE1 3.79Å; I142-Y149 WeakPolarHBondContact O-CA 3.38Å; R143-Y149 HydrophobicContact CG-CD1 4.13Å; R143-Y149 HydrophobicContact CG-CE1 3.76Å; R143-Y149 PolarHBondContact NE-OH 3.34Å; R143-Y149 PolarHBondContact NH2-OH 2.87Å
150	S	96.6	Very high	91.6	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	161.3	166.9	-171.8	0	0	0	0	109.6	Y141 I142	Y141-S150 CarbonylContact C-O 3.57Å; Y141-S150 VanDerWaalsContact CA-O 3.29Å; Y141-S150 WeakPolarHBondContact CA-O 2.96Å; I142-S150 PolarHBondContact N-O 3.28Å; I142-S150 PolarHBondContact O-N 3.22Å
151	T	96.7	Very high	91	Very high	0 Å²	0	52 Å²	52	0%	0	28%	0.282	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	147.7	168.8	64.9	0	0	0	0	109.7	Y87 V90 R91 Y141 E153 N154 W155	Y87-T151 HydrophobicContact CD2-CG2 4.03Å; Y87-T151 HydrophobicContact CE2-CG2 3.61Å; V90-T151 HydrophobicContact CB-CG2 4.33Å; V90-T151 HydrophobicContact CG1-CG2 3.97Å; R91-T151 HydrophobicContact CB-CG2 3.81Å; R91-T151 HydrophobicContact CG-CG2 4.37Å; Y141-T151 HydrophobicContact CD1-CG2 4.4Å; Y141-T151 HydrophobicContact CE1-CG2 4.45Å; T151-E153 PolarHBondContact O-N 3.17Å; T151-N154 PolarHBondContact O-N 3.35Å; T151-N154 VanDerWaalsContact OG1-CB 3.3Å; T151-N154 WeakPolarHBondContact OG1-CB 3.27Å; T151-N154 VanDerWaalsContact OG1-CG 3.24Å; T151-N154 PolarHBondContact OG1-N 2.9Å; T151-N154 PolarHBondContact OG1-ND2 3.4Å; T151-W155 WeakPolarHBondContact O-CB 3.49Å; T151-W155 PolarHBondContact O-N 3.07Å
152	T	94.5	Very high	90.4	Very high	30 Å²	30	56.2 Å²	56.2	18%	0.184	30%	0.3	C	S	.	.	H	α-helix	trans	-57.4	-36.1	177.4	-59.8	0	0	0	0	111.9	G139 R140 I142 K156	G139-T152 WeakPolarHBondContact O-CB 3.31Å; G139-T152 PolarHBondContact O-OG1 3.38Å; R140-T152 PolarHBondContact O-N 3.49Å; R140-T152 VanDerWaalsContact O-N 3.08Å; R140-T152 PolarHBondContact O-OG1 3.02Å; I142-T152 HydrophobicContact CD1-CG2 4.11Å; T152-K156 WeakPolarHBondContact O-CG 3.31Å; T152-K156 PolarHBondContact O-N 3.44Å
153	E	94.1	Very high	89.7	Confident	82 Å²	82	58.9 Å²	58.9	38%	0.383	31%	0.314	S	S	.	.	H	α-helix	trans	-63.9	-52.2	176.2	-70	172	-148.8	0	0	112.1	Y87 R91 T151 K156 K157	Y87-E153 VanDerWaalsContact OH-CD 3.22Å; Y87-E153 PolarHBondContact OH-OE1 3.31Å; R91-E153 IonicContact CZ-OE2 3.38Å; R91-E153 IonicContact NE-OE2 2.88Å; R91-E153 PolarHBondContact NE-OE2 3.5Å; R91-E153 IonicContact NH2-OE2 3.83Å; R91-E153 PolarHBondContact NH2-OE2 3.35Å; T151-E153 PolarHBondContact O-N 3.17Å; E153-K156 PolarHBondContact O-N 3.48Å; E153-K157 WeakPolarHBondContact O-CG 3.3Å; E153-K157 PolarHBondContact O-N 3.04Å
154	N	94.2	Very high	88.9	Confident	0 Å²	0	60.7 Å²	60.7	0%	0	33%	0.325	C	S	.	.	H	α-helix	trans	-69.1	-38.3	-176	-72.4	-11.6	0	0	0	111.5	R91 T94 H95 T151 K156 K157 S158	R91-N154 PolarHBondContact O-ND2 2.84Å; T94-N154 VanDerWaalsContact C-ND2 3.34Å; T94-N154 WeakPolarHBondContact O-CB 3.48Å; T94-N154 PolarHBondContact O-ND2 3.44Å; T94-N154 PolarHBondContact OG1-ND2 3.16Å; H95-N154 PolarHBondContact N-ND2 2.82Å; T151-N154 PolarHBondContact O-N 3.35Å; T151-N154 VanDerWaalsContact OG1-CB 3.3Å; T151-N154 WeakPolarHBondContact OG1-CB 3.27Å; T151-N154 VanDerWaalsContact OG1-CG 3.24Å; T151-N154 PolarHBondContact OG1-N 2.9Å; T151-N154 PolarHBondContact OG1-ND2 3.4Å; N154-K156 VanDerWaalsContact C-N 3.32Å; N154-K156 PolarHBondContact O-N 3.31Å; N154-K157 PolarHBondContact O-N 3.46Å; N154-K157 VanDerWaalsContact O-N 3.17Å; N154-S158 WeakPolarHBondContact O-CB 3.33Å; N154-S158 PolarHBondContact O-N 3.01Å; N154-S158 PolarHBondContact O-OG 3.22Å; N154-S158 VanDerWaalsContact O-OG 3.11Å
155	W	90.9	Very high	88.2	Confident	66 Å²	66	62.2 Å²	62.2	25%	0.25	34%	0.337	C	S	.	.	H	α-helix	trans	-55.7	-47.8	174.1	178.5	-107.3	0	0	0	111.7	I142 V144 T151 K157 S158 E159	I142-W155 HydrophobicContact CD1-CB 3.99Å; I142-W155 HydrophobicContact CD1-CG 3.9Å; V144-W155 HydrophobicContact CB-CZ3 4.29Å; V144-W155 HydrophobicContact CG1-CE3 4.1Å; V144-W155 HydrophobicContact CG1-CH2 3.83Å; V144-W155 HydrophobicContact CG1-CZ3 3.4Å; V144-W155 HydrophobicContact CG2-CD2 4.4Å; V144-W155 HydrophobicContact CG2-CE3 3.71Å; V144-W155 HydrophobicContact CG2-CZ3 3.92Å; T151-W155 WeakPolarHBondContact O-CB 3.49Å; T151-W155 PolarHBondContact O-N 3.07Å; W155-K157 PolarHBondContact O-N 3.43Å; W155-S158 PolarHBondContact O-N 3.29Å; W155-E159 HydrophobicContact CD2-CG 4.17Å; W155-E159 HydrophobicContact CH2-CG 4.38Å; W155-E159 WeakPolarHBondContact CH2-OE1 3.43Å; W155-E159 HydrophobicContact CZ2-CG 3.82Å; W155-E159 WeakPolarHBondContact O-CG 3.49Å; W155-E159 PolarHBondContact O-N 2.94Å
156	K	91.5	Very high	87.5	Confident	135 Å²	135	66.7 Å²	66.7	59%	0.587	35%	0.354	S	S	*	.	H	α-helix	trans	-60.6	-43.6	176	-72.2	176.5	-179.7	-175.3	0	112.2	T152 E153 N154 E159 C160	T152-K156 WeakPolarHBondContact O-CG 3.31Å; T152-K156 PolarHBondContact O-N 3.44Å; E153-K156 PolarHBondContact O-N 3.48Å; N154-K156 VanDerWaalsContact C-N 3.32Å; N154-K156 PolarHBondContact O-N 3.31Å; K156-E159 PolarHBondContact O-N 3.13Å; K156-C160 WeakPolarHBondContact O-CB 3.37Å; K156-C160 PolarHBondContact O-N 2.98Å; K156-C160 PolarHBondContact O-SG 3.01Å
157	K	91.3	Very high	86.9	Confident	93 Å²	93	66.3 Å²	66.3	40%	0.404	35%	0.345	S	S	.	.	H	α-helix	trans	-62.1	-43.4	176.9	-69.3	175.3	179.6	-179.2	0	111.8	P96 E153 N154 W155 C160 A161	P96-K157 HydrophobicContact CG-CB 4.05Å; E153-K157 WeakPolarHBondContact O-CG 3.3Å; E153-K157 PolarHBondContact O-N 3.04Å; N154-K157 PolarHBondContact O-N 3.46Å; N154-K157 VanDerWaalsContact O-N 3.17Å; W155-K157 PolarHBondContact O-N 3.43Å; K157-C160 PolarHBondContact O-N 3.44Å; K157-A161 WeakPolarHBondContact O-CB 3.38Å; K157-A161 PolarHBondContact O-N 3.49Å
158	S	86.6	Confident	85.7	Confident	12 Å²	12	72 Å²	72	8%	0.084	36%	0.364	C	S	.	.	H	α-helix	trans	-64.6	-42.4	178.4	-64.6	0	0	0	0	112	N154 W155 A161 K162	N154-S158 WeakPolarHBondContact O-CB 3.33Å; N154-S158 PolarHBondContact O-N 3.01Å; N154-S158 PolarHBondContact O-OG 3.22Å; N154-S158 VanDerWaalsContact O-OG 3.11Å; W155-S158 PolarHBondContact O-N 3.29Å; S158-A161 PolarHBondContact O-N 3.5Å; S158-K162 WeakPolarHBondContact O-CG 3.46Å; S158-K162 PolarHBondContact O-N 3.36Å
159	E	85	Confident	83.7	Confident	66 Å²	66	71.7 Å²	71.7	31%	0.308	38%	0.375	S	S	.	.	H	α-helix	trans	-65.2	-42.1	175.7	-69	-63.6	111.3	0	0	111.6	W155 K156 A161 K162 L163	W155-E159 HydrophobicContact CD2-CG 4.17Å; W155-E159 HydrophobicContact CH2-CG 4.38Å; W155-E159 WeakPolarHBondContact CH2-OE1 3.43Å; W155-E159 HydrophobicContact CZ2-CG 3.82Å; W155-E159 WeakPolarHBondContact O-CG 3.49Å; W155-E159 PolarHBondContact O-N 2.94Å; K156-E159 PolarHBondContact O-N 3.13Å; E159-A161 VanDerWaalsContact C-N 3.31Å; E159-A161 PolarHBondContact O-N 3.39Å; E159-K162 PolarHBondContact O-N 3.35Å; E159-K162 IonicContact OE1-NZ 3.95Å; E159-K162 PolarHBondContact OE1-NZ 3.1Å; E159-L163 WeakPolarHBondContact O-CG 3.4Å; E159-L163 PolarHBondContact O-N 3.3Å; E159-L163 VanDerWaalsContact O-N 3.09Å
160	C	80.3	Confident	81.7	Confident	74 Å²	74	76.3 Å²	76.3	50%	0.5	40%	0.404	S	S	.	.	H	α-helix	trans	-61	-38.5	172.5	-70.4	0	0	0	0	112.5	K156 K157 K164	K156-C160 WeakPolarHBondContact O-CB 3.37Å; K156-C160 PolarHBondContact O-N 2.98Å; K156-C160 PolarHBondContact O-SG 3.01Å; K157-C160 PolarHBondContact O-N 3.44Å; C160-K164 WeakPolarHBondContact O-CG 3.2Å; C160-K164 PolarHBondContact O-N 3.45Å; C160-K164 VanDerWaalsContact O-N 3.11Å
161	A	81.9	Confident	79.5	Confident	50 Å²	50	83.6 Å²	83.6	41%	0.413	44%	0.443	S	S	.	.	H	α-helix	trans	-67.6	-41.8	178.1	0	0	0	0	0	112	K157 S158 E159 L163 K164 S165	K157-A161 WeakPolarHBondContact O-CB 3.38Å; K157-A161 PolarHBondContact O-N 3.49Å; S158-A161 PolarHBondContact O-N 3.5Å; E159-A161 VanDerWaalsContact C-N 3.31Å; E159-A161 PolarHBondContact O-N 3.39Å; A161-L163 PolarHBondContact O-N 3.1Å; A161-K164 PolarHBondContact O-N 3.06Å; A161-S165 PolarHBondContact O-N 2.82Å; A161-S165 PolarHBondContact O-OG 3.4Å
162	K	83.7	Confident	77.1	Confident	91 Å²	91	88.4 Å²	88.4	40%	0.396	48%	0.477	S	S	.	.	H	α-helix	trans	-59.4	-45.4	174.7	-72	174.4	-172.4	170.1	0	111.7	S158 E159 K164 S165 M166	S158-K162 WeakPolarHBondContact O-CG 3.46Å; S158-K162 PolarHBondContact O-N 3.36Å; E159-K162 PolarHBondContact O-N 3.35Å; E159-K162 IonicContact OE1-NZ 3.95Å; E159-K162 PolarHBondContact OE1-NZ 3.1Å; K162-K164 VanDerWaalsContact C-N 3.34Å; K162-K164 PolarHBondContact O-N 3.11Å; K162-S165 PolarHBondContact O-N 3.25Å; K162-S165 PolarHBondContact O-OG 2.95Å; K162-M166 PolarHBondContact O-N 2.76Å; K162-M166 VanDerWaalsContact O-N 3.11Å
163	L	79.6	Confident	74.5	Confident	107 Å²	107	93 Å²	93	56%	0.56	51%	0.505	S	S	*	.	H	α-helix	trans	-62.8	-39.4	177.7	-69.5	172.2	0	0	0	112.3	E159 A161 M166 N167	E159-L163 WeakPolarHBondContact O-CG 3.4Å; E159-L163 PolarHBondContact O-N 3.3Å; E159-L163 VanDerWaalsContact O-N 3.09Å; A161-L163 PolarHBondContact O-N 3.1Å; L163-M166 PolarHBondContact O-N 2.92Å; L163-N167 PolarHBondContact O-N 2.97Å
164	K	76.7	Confident	72	Confident	146 Å²	146	95.3 Å²	95.3	64%	0.635	52%	0.524	S	S	*	.	H	α-helix	trans	-63.2	-45.1	174.6	-73.5	179.7	178.8	-169.1	0	112.2	C160 A161 K162 M166 N167 E168	C160-K164 WeakPolarHBondContact O-CG 3.2Å; C160-K164 PolarHBondContact O-N 3.45Å; C160-K164 VanDerWaalsContact O-N 3.11Å; A161-K164 PolarHBondContact O-N 3.06Å; K162-K164 VanDerWaalsContact C-N 3.34Å; K162-K164 PolarHBondContact O-N 3.11Å; K164-M166 VanDerWaalsContact C-N 3.27Å; K164-M166 PolarHBondContact O-N 3.31Å; K164-N167 PolarHBondContact O-N 2.89Å; K164-N167 VanDerWaalsContact O-N 3.14Å; K164-E168 PolarHBondContact O-N 3.27Å
165	S	78.2	Confident	69.8	Low	76 Å²	76	103.2 Å²	103.2	53%	0.531	56%	0.561	S	S	.	*	H	α-helix	trans	-64.1	-29.7	178.8	61.2	0	0	0	0	113.9	A161 K162 G169	A161-S165 PolarHBondContact O-N 2.82Å; A161-S165 PolarHBondContact O-OG 3.4Å; K162-S165 PolarHBondContact O-N 3.25Å; K162-S165 PolarHBondContact O-OG 2.95Å; S165-G169 PolarHBondContact O-N 3.39Å
166	M	73.6	Confident	67.5	Low	133 Å²	133	106.5 Å²	106.5	66%	0.655	58%	0.584	S	S	*	*	H	α-helix	trans	-72.8	-34.1	175.2	-73.2	178	70.5	0	0	112	K162 L163 K164 T170	K162-M166 PolarHBondContact O-N 2.76Å; K162-M166 VanDerWaalsContact O-N 3.11Å; L163-M166 PolarHBondContact O-N 2.92Å; K164-M166 VanDerWaalsContact C-N 3.27Å; K164-M166 PolarHBondContact O-N 3.31Å; M166-T170 PolarHBondContact O-OG1 3.45Å
167	N	70.3	Confident	65.1	Low	123 Å²	123	109.4 Å²	109.4	66%	0.658	60%	0.599	S	S	*	*	H	α-helix	trans	-78.2	-35.2	-179.9	-69	-12.2	0	0	0	112.6	L163 K164 G169	L163-N167 PolarHBondContact O-N 2.97Å; K164-N167 PolarHBondContact O-N 2.89Å; K164-N167 VanDerWaalsContact O-N 3.14Å; N167-G169 VanDerWaalsContact C-N 3.29Å; N167-G169 PolarHBondContact O-N 3.05Å
168	E	61.1	Low	62.7	Low	160 Å²	160	111.2 Å²	111.2	75%	0.748	62%	0.618	S	S	*	*	H	α-helix	trans	-73.8	-17	176.1	-82.7	176.8	156.4	0	0	113.7	K164 T170	K164-E168 PolarHBondContact O-N 3.27Å; E168-T170 VanDerWaalsContact C-N 3.35Å; E168-T170 PolarHBondContact O-N 3.3Å
169	G	54.6	Low	60.6	Low	53 Å²	53	115 Å²	115	55%	0.546	65%	0.651	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.7	-0.8	-179.5	0	0	0	0	0	115.9	S165 N167	S165-G169 PolarHBondContact O-N 3.39Å; N167-G169 VanDerWaalsContact C-N 3.29Å; N167-G169 PolarHBondContact O-N 3.05Å
170	T	54	Low	58.5	Low	106 Å²	106	116.5 Å²	116.5	65%	0.65	68%	0.675	S	S	*	*	S	Bend	trans	-103.2	-12.5	-173.9	-37.6	0	0	0	0	113.6	M166 E168	M166-T170 PolarHBondContact O-OG1 3.45Å; E168-T170 VanDerWaalsContact C-N 3.35Å; E168-T170 PolarHBondContact O-N 3.3Å
171	D	50.1	Low	56.7	Low	153 Å²	153	117.7 Å²	117.7	82%	0.818	69%	0.69	S	S	*	*	S	Bend	trans	-105.3	8.8	-174.5	-70.9	-17.8	0	0	0	114.9
172	S	46.2	Very low	55.2	Low	100 Å²	100	120.7 Å²	120.7	70%	0.699	71%	0.707	S	S	*	*			trans	-108.2	20.7	-178.4	77.7	0	0	0	0	115.4
173	V	41.7	Very low	53.2	Low	128 Å²	128	122.2 Å²	122.2	78%	0.776	73%	0.729	S	S	*	*			trans	-104.5	80.6	168.3	178.6	0	0	0	0	107.8
174	T	40.9	Very low	51.6	Low	129 Å²	129	120.3 Å²	120.3	79%	0.791	74%	0.736	S	S	*	*			trans	-175.2	140	145.8	-51.7	0	0	0	0	108.9
175	Q	47	Very low	49.9	Very low	167 Å²	167	119.7 Å²	119.7	78%	0.78	75%	0.745	S	S	*	*			trans	95.5	96.5	164.6	-90.9	168.6	-10.5	0	0	120.1
176	D	42.6	Very low	48	Very low	135 Å²	135	123.4 Å²	123.4	72%	0.722	76%	0.758	S	S	*	*			trans	92.8	88.1	133.1	-61.6	-11.5	0	0	0	119.8
177	Q	41.4	Very low	46.6	Very low	195 Å²	195	122.9 Å²	122.9	91%	0.911	76%	0.762	S	S	*	*			trans	-63.5	117.8	144.3	-69.7	176.6	24.6	0	0	109.6
178	T	41.5	Very low	45.3	Very low	131 Å²	131	122.8 Å²	122.8	80%	0.804	77%	0.766	S	S	*	*			trans	-155	117.3	147	20	0	0	0	0	111.2
179	A	41.7	Very low	44.5	Very low	93 Å²	93	125.8 Å²	125.8	77%	0.769	77%	0.77	S	S	*	*			trans	58.8	112.1	140.6	0	0	0	0	0	122.4
180	A	41.9	Very low	43.9	Very low	97 Å²	97	132 Å²	132	80%	0.802	79%	0.785	S	S	*	*				81	112.2	121.2	0	0	0	0	0	121.9
181	A	42.7	Very low	43.1	Very low	99 Å²	99	130.5 Å²	130.5	82%	0.818	79%	0.791	S	S	*	*			trans	75.4	112.6	131.9	0	0	0	0	0	120.7
182	S	48.8	Very low	42.6	Very low	112 Å²	112	135.1 Å²	135.1	78%	0.783	80%	0.797	S	S	*	*				142.3	116.8	104.5	-164.9	0	0	0	0	114.3
183	S	42.9	Very low	42.5	Very low	123 Å²	123	139.1 Å²	139.1	86%	0.86	80%	0.804	S	S	*	*			trans	33.8	127.4	147.2	-71.9	0	0	0	0	123.3
184	G	44.8	Very low	42.8	Very low	68 Å²	68	140.4 Å²	140.4	70%	0.701	81%	0.806	S	S	*	*			trans	174.3	70.1	156.4	0	0	0	0	0	117
185	T	40.9	Very low	43.1	Very low	133 Å²	133	141.2 Å²	141.2	82%	0.816	80%	0.804	S	S	*	*			trans	61.6	109.3	134.4	-48.1	0	0	0	0	121.6
186	L	39.3	Very low	42.9	Very low	153 Å²	153	142.3 Å²	142.3	80%	0.801	81%	0.809	S	S	*	*				61.9	114.2	126.3	-145.8	92.9	0	0	0	119.6
187	V	44.5	Very low	43.1	Very low	122 Å²	122	143.8 Å²	143.8	74%	0.739	81%	0.812	S	S	*	*				178.3	111.3	101.2	165.9	0	0	0	0	109.5
188	T	42.8	Very low	43.1	Very low	122 Å²	122	142.7 Å²	142.7	75%	0.748	81%	0.807	S	S	*	*			trans	-4.4	133.6	148.5	5.7	0	0	0	0	119.3
189	R	43.5	Very low	43.1	Very low	222 Å²	222	144.7 Å²	144.7	84%	0.838	81%	0.811	S	S	*	*				170.1	104.1	95.1	-160.6	171.9	-172.3	178.3	1.9	112.5
190	E	41.9	Very low	43.3	Very low	184 Å²	184	149.4 Å²	149.4	86%	0.86	82%	0.815	S	S	*	*			trans	40.4	131.1	138.5	-55.8	-173.3	153.3	0	0	122.1
191	G	37.2	Very low	43.3	Very low	75 Å²	75	150.3 Å²	150.3	77%	0.773	81%	0.812	S	S	*	*			trans	148.8	36.6	151.2	0	0	0	0	0	118.1
192	R	40.6	Very low	44	Very low	249 Å²	249	155 Å²	155	94%	0.94	81%	0.814	S	S	*	*			trans	-137.7	93.7	167.4	-72.7	-169.2	-177.6	-168.6	2.1	111.7
193	Q	44	Very low	43.7	Very low	184 Å²	184	157.3 Å²	157.3	86%	0.86	82%	0.817	S	S	*	*			trans	-144.3	120.3	152.3	-70.9	-170.3	22.4	0	0	106.9
194	L	47.3	Very low	44.2	Very low	156 Å²	156	157.1 Å²	157.1	82%	0.817	82%	0.816	S	S	*	*				160.6	125.4	125	-87.3	163.6	0	0	0	111.8
195	I	47.9	Very low	43.8	Very low	146 Å²	146	159.4 Å²	159.4	75%	0.749	82%	0.82	S	S	*	*			trans	91.2	70.4	156	-47.8	146	0	0	0	115.4	H197	I195-H197 HydrophobicContact CG2-CB 4.5Å
196	E	43.2	Very low	43.8	Very low	190 Å²	190	161.2 Å²	161.2	89%	0.888	82%	0.819	S	S	*	*				-80.2	109.9	129.9	-79.4	-174.8	143.1	0	0	107.1
197	H	46.5	Very low	43.8	Very low	166 Å²	166	161.4 Å²	161.4	77%	0.769	82%	0.816	S	S	*	*			trans	-149.6	125.3	155.1	-121.1	-94.9	0	0	0	109.1	I195	I195-H197 HydrophobicContact CG2-CB 4.5Å
198	E	40.6	Very low	43.6	Very low	172 Å²	172	159.9 Å²	159.9	80%	0.804	82%	0.816	S	S	*	*			trans	89.6	73.3	147.8	-134.6	166.5	131.3	0	0	118.8
199	L	41.8	Very low	43.9	Very low	173 Å²	173	159 Å²	159	91%	0.906	82%	0.821	S	S	*	*			trans	-119.2	103.2	141.9	-76	169.4	0	0	0	108.4
200	K	47	Very low	44.2	Very low	192 Å²	192	152.9 Å²	152.9	84%	0.835	82%	0.818	S	S	*	*			trans	-137.7	107	158.6	-87	-171.1	178.7	173.9	0	109.2
201	P	41.7	Very low	44.5	Very low	116 Å²	116	152.7 Å²	152.7	75%	0.753	82%	0.817	S	S	*	*			trans	-85.4	125.2	162	32.1	-25.2	0	0	0	108.6
202	K	57.3	Low	45.4	Very low	198 Å²	198	155.2 Å²	155.2	86%	0.861	82%	0.82	S	S	*	*			trans	-124	114.9	165.7	-96.6	-175.4	173.3	-175.8	0	109
203	N	43	Very low	45.6	Very low	159 Å²	159	148.4 Å²	148.4	85%	0.85	81%	0.811	S	S	*	*			trans	-71.2	133.6	169.6	-51	-23	0	0	0	109.2
204	S	51.5	Low	46.1	Very low	119 Å²	119	149 Å²	149	83%	0.832	81%	0.813	S	S	*	*			trans	-168.2	138.4	141.4	67.6	0	0	0	0	111.6
205	C	37.2	Very low	46.1	Very low	117 Å²	117	146 Å²	146	79%	0.791	81%	0.811	S	S	*	*			trans	-78.8	-178.5	-170.8	-56.5	0	0	0	0	115.8
206	H	42.1	Very low	46.4	Very low	171 Å²	171	143.8 Å²	143.8	79%	0.792	81%	0.814	S	S	*	*			trans	93.6	137.7	174.1	-67.6	-79.2	0	0	0	115.5
207	E	39.4	Very low	46.6	Very low	157 Å²	157	142.5 Å²	142.5	73%	0.734	81%	0.811	S	S	*	*			cis	-179	143	-11.4	175.7	162.3	175.5	0	0	106.7
208	A	40.2	Very low	47	Very low	89 Å²	89	141.1 Å²	141.1	74%	0.736	81%	0.807	S	S	*	*			trans	63	144.3	151.6	0	0	0	0	0	125.2
209	A	48.4	Very low	47.4	Very low	103 Å²	103	138.2 Å²	138.2	85%	0.851	80%	0.803	S	S	*	*			trans	82	131.2	158	0	0	0	0	0	117
210	A	49.3	Very low	47.9	Very low	95 Å²	95	135.8 Å²	135.8	79%	0.785	80%	0.796	S	S	*	*			cis	-164.4	148.4	0	0	0	0	0	0	108
211	Q	49.5	Very low	48.6	Very low	180 Å²	180	132.9 Å²	132.9	84%	0.841	79%	0.794	S	S	*	*			trans	-77.4	161.2	165.3	-76.8	-141.5	-57.2	0	0	110.9
212	P	55.9	Low	49.1	Very low	128 Å²	128	136.5 Å²	136.5	83%	0.831	80%	0.798	S	S	*	*				-133.5	142.1	122.8	31.1	-17	0	0	0	113.4
213	S	44.2	Very low	49.5	Very low	106 Å²	106	134.9 Å²	134.9	74%	0.741	80%	0.798	S	S	*	*			trans	-87.1	131.3	167.3	156.6	0	0	0	0	108.7
214	E	54.4	Low	50.1	Low	196 Å²	196	138.8 Å²	138.8	92%	0.916	80%	0.801	S	S	*	*			trans	-153.9	136.2	150.6	-148.7	168.4	179	0	0	112.4
215	A	47.5	Very low	50.4	Low	94 Å²	94	145.7 Å²	145.7	78%	0.777	82%	0.819	S	S	*	*			trans	-101.3	139.7	-175.6	0	0	0	0	0	110.7
216	A	53	Low	51.1	Low	98 Å²	98	147.1 Å²	147.1	81%	0.81	82%	0.821	S	S	*	*			trans	-169.7	98.4	156.2	0	0	0	0	0	108.3
217	M	47.6	Very low	51.6	Low	164 Å²	164	145.8 Å²	145.8	81%	0.808	82%	0.822	S	S	*	*				64	100.7	90.3	-88	-169.2	61.7	0	0	118.1
218	I	56.4	Low	52.2	Low	137 Å²	137	145.2 Å²	145.2	70%	0.703	83%	0.827	S	S	*	*				70.3	154.8	129.1	-46.9	-176.3	0	0	0	119.2
219	P	48.9	Very low	53	Low	111 Å²	111	148.5 Å²	148.5	72%	0.721	83%	0.833	S	S	*	*			cis	-128.9	167.6	-29.5	31.2	-14.1	0	0	0	115
220	T	50.8	Low	53.2	Low	121 Å²	121	151.4 Å²	151.4	74%	0.742	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-59.2	135.2	162.3	-51.2	0	0	0	0	114.6	F222	T220-F222 HydrophobicContact CG2-CD2 4.39Å
221	T	63.1	Low	53.5	Low	131 Å²	131	155.1 Å²	155.1	80%	0.804	84%	0.835	S	S	*	*	P	Polyproline II helix	trans	-95.1	117.3	164.8	-0.3	0	0	0	0	110.6
222	F	51.7	Low	53.8	Low	192 Å²	192	153.4 Å²	153.4	84%	0.842	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-84.6	127	159.3	-93.2	-96	0	0	0	108.3	T220	T220-F222 HydrophobicContact CG2-CD2 4.39Å
223	I	64.8	Low	53.6	Low	165 Å²	165	155.3 Å²	155.3	85%	0.846	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-95.4	127.5	166.4	-62.6	175.7	0	0	0	107.4
224	R	55.9	Low	54.4	Low	241 Å²	241	159.4 Å²	159.4	91%	0.909	84%	0.842	S	S	*	*			trans	-129	110.3	173.8	-167.2	-174.8	-166.8	-177.2	3.8	106.9
225	E	58.7	Low	54.4	Low	263 Å²	263	156.1 Å²	156.1	100%	1.229	84%	0.836	S	S	*	*			trans	-150.7	0	146.8	-101.2	-173.3	170.1	0	0	107.5

Retrieved 225 of 225 residues in 406.2 ms (Link to these results)

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