A0A077YY78_TRITR Loading...

Zinc knuckle family protein

AlphaFold DB , UniProt , Accession A0A077YY78, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 180 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	D	40.4	Very low	37.4	Very low	204 Å²	204	151.4 Å²	151.4	100%	1.091	83%	0.834	S	S	*	*				0	83.3	0	-54.9	-29.2	0	0	0	111.4
2	W	32.8	Very low	37.7	Very low	263 Å²	263	149.8 Å²	149.8	100%	0.996	83%	0.832	S	S	*	*			trans	-104.8	110.2	173.3	-78.2	91.9	0	0	0	108.5
3	L	38.4	Very low	37.4	Very low	160 Å²	160	148.1 Å²	148.1	84%	0.838	83%	0.827	S	S	*	*			trans	-71.4	137.6	-177	-81.7	157.8	0	0	0	111.7
4	S	32.7	Very low	37.6	Very low	107 Å²	107	144.2 Å²	144.2	75%	0.748	82%	0.815	S	S	*	*			trans	-44.7	135.3	175.5	-177.2	0	0	0	0	114.7
5	W	33	Very low	37.5	Very low	242 Å²	242	140.5 Å²	140.5	92%	0.917	80%	0.802	S	S	*	*			trans	-107.6	108.9	160	-76.7	50.8	0	0	0	108.2	V7	W5-V7 PolarHBondContact O-N 2.87Å
6	S	34.6	Very low	37.3	Very low	104 Å²	104	141.8 Å²	141.8	73%	0.727	80%	0.798	S	S	*	*			trans	-78.4	105.7	168.4	51.6	0	0	0	0	109.7	S8	S6-S8 PolarHBondContact O-N 2.98Å
7	V	37.3	Very low	37.2	Very low	113 Å²	113	139.2 Å²	139.2	69%	0.685	79%	0.786	S	S	*	*			trans	-86.3	104.7	166.2	-179.8	0	0	0	0	107.8	W5 N9	W5-V7 PolarHBondContact O-N 2.87Å; V7-N9 PolarHBondContact O-N 2.72Å
8	S	42.3	Very low	37.1	Very low	112 Å²	112	138.2 Å²	138.2	78%	0.783	78%	0.783	S	S	*	*			trans	-83.2	97.7	166.8	-62	0	0	0	0	107.8	S6 S10	S6-S8 PolarHBondContact O-N 2.98Å; S8-S10 PolarHBondContact O-N 2.93Å
9	N	41.8	Very low	36.8	Very low	146 Å²	146	141.7 Å²	141.7	78%	0.781	78%	0.783	S	S	*	*			trans	-80.6	115.9	173.3	-99.4	-14.6	0	0	0	109.8	V7 A11	V7-N9 PolarHBondContact O-N 2.72Å; N9-A11 PolarHBondContact O-N 2.84Å
10	S	37.5	Very low	36.7	Very low	122 Å²	122	145.6 Å²	145.6	85%	0.853	79%	0.785	S	S	*	*			trans	-53.1	123.7	173.6	-57.4	0	0	0	0	111.6	S8	S8-S10 PolarHBondContact O-N 2.93Å
11	A	40.4	Very low	36.5	Very low	92 Å²	92	147.6 Å²	147.6	76%	0.76	79%	0.787	S	S	*	*			trans	-81.5	125.7	175.5	0	0	0	0	0	110.6	N9	N9-A11 PolarHBondContact O-N 2.84Å
12	V	40.7	Very low	36.3	Very low	132 Å²	132	144.2 Å²	144.2	80%	0.8	77%	0.768	S	S	*	*			trans	62.4	95.7	150.2	-159.9	0	0	0	0	117.3	S14	V12-S14 PolarHBondContact O-N 2.82Å
13	V	34.8	Very low	36.6	Very low	128 Å²	128	138.4 Å²	138.4	78%	0.776	76%	0.755	S	S	*	*			trans	-55.1	100.4	156.4	-174.2	0	0	0	0	109.2	S15	V13-S15 WeakPolarHBondContact CG1-OG 3.37Å; V13-S15 PolarHBondContact O-N 3.06Å
14	S	39.8	Very low	36.3	Very low	94 Å²	94	136 Å²	136	66%	0.657	75%	0.75	S	S	*	*			trans	-91.8	87.8	162.9	-167.9	0	0	0	0	108.3	V12 H16	V12-S14 PolarHBondContact O-N 2.82Å; S14-H16 PolarHBondContact O-N 3.02Å
15	S	36.4	Very low	36.6	Very low	88 Å²	88	138.1 Å²	138.1	62%	0.615	75%	0.748	S	S	*	*			trans	-71.8	78.5	172.5	-70.8	0	0	0	0	109.8	V13 V17	V13-S15 WeakPolarHBondContact CG1-OG 3.37Å; V13-S15 PolarHBondContact O-N 3.06Å; S15-V17 PolarHBondContact O-N 2.92Å
16	H	34.1	Very low	37.1	Very low	161 Å²	161	131.8 Å²	131.8	75%	0.745	74%	0.738	S	S	*	*			trans	-76.6	73.8	155.9	-83.3	-144.6	0	0	0	108.2	S14 V18	S14-H16 PolarHBondContact O-N 3.02Å; H16-V18 VanDerWaalsContact C-N 3.25Å; H16-V18 PolarHBondContact O-N 3.46Å
17	V	36.2	Very low	37.6	Very low	98 Å²	98	132.7 Å²	132.7	59%	0.594	74%	0.742	S	S	*	*			trans	-74.8	92.3	159.7	-172	0	0	0	0	105.5	S15 W19	S15-V17 PolarHBondContact O-N 2.92Å; V17-W19 HydrophobicContact CG1-CG 4.25Å; V17-W19 PolarHBondContact O-N 3.05Å
18	V	34.3	Very low	38.1	Very low	121 Å²	121	135.5 Å²	135.5	73%	0.733	75%	0.747	S	S	*	*			trans	-63.5	89.9	161.8	178.8	0	0	0	0	105.9	H16 R20	H16-V18 VanDerWaalsContact C-N 3.25Å; H16-V18 PolarHBondContact O-N 3.46Å; V18-R20 PolarHBondContact O-N 3.38Å
19	W	31.9	Very low	38	Very low	206 Å²	206	136.3 Å²	136.3	78%	0.78	75%	0.747	S	S	*	*			trans	-64.6	89.8	161.1	-84	75.8	0	0	0	106.1	V17 F21	V17-W19 HydrophobicContact CG1-CG 4.25Å; V17-W19 PolarHBondContact O-N 3.05Å; W19-F21 VanDerWaalsContact C-N 3.29Å; W19-F21 PolarHBondContact O-N 3.03Å
20	R	35.7	Very low	37.8	Very low	218 Å²	218	138 Å²	138	82%	0.823	75%	0.748	S	S	*	*			trans	-57.9	104.8	158.2	-136.6	172.3	176.9	169.5	-2.2	104.4	V18 I22	V18-R20 PolarHBondContact O-N 3.38Å; R20-I22 PolarHBondContact O-N 2.75Å
21	F	30.6	Very low	37.8	Very low	188 Å²	188	142.9 Å²	142.9	83%	0.825	75%	0.748	S	S	*	*			trans	-57.5	86.4	165	-85.8	-94.5	0	0	0	106.9	W19 I23	W19-F21 VanDerWaalsContact C-N 3.29Å; W19-F21 PolarHBondContact O-N 3.03Å; F21-I23 PolarHBondContact O-N 3.48Å
22	I	37.1	Very low	37.9	Very low	134 Å²	134	142.6 Å²	142.6	69%	0.687	74%	0.74	S	S	*	*			trans	-67.1	97.3	153.4	-64	177.1	0	0	0	102.7	R20 C24	R20-I22 PolarHBondContact O-N 2.75Å; I22-C24 PolarHBondContact O-N 3.49Å
23	I	39.2	Very low	38	Very low	141 Å²	141	140.7 Å²	140.7	72%	0.723	73%	0.731	S	S	*	*			trans	-58.3	86.3	160.2	-58.6	172.6	0	0	0	104.2	F21 Q25	F21-I23 PolarHBondContact O-N 3.48Å; I23-Q25 PolarHBondContact O-N 3.35Å
24	C	31.7	Very low	38.4	Very low	110 Å²	110	145.1 Å²	145.1	74%	0.743	73%	0.734	S	S	*	*			trans	-60.6	98.6	161.9	-87.4	0	0	0	0	104.4	I22	I22-C24 PolarHBondContact O-N 3.49Å
25	Q	40.1	Very low	38.4	Very low	151 Å²	151	145 Å²	145	71%	0.706	73%	0.733	S	S	*	*	P	Polyproline II helix	trans	-49.8	130.4	166.8	-64.9	-153.5	-27.4	0	0	107	I23	I23-Q25 PolarHBondContact O-N 3.35Å
26	P	42.6	Very low	38.4	Very low	109 Å²	109	151.8 Å²	151.8	71%	0.708	75%	0.745	S	S	*	*	P	Polyproline II helix	trans	-52.6	135	170.4	22.9	-31.2	0	0	0	106.9	Q28	P26-Q28 PolarHBondContact O-N 3.39Å
27	P	44.4	Very low	38.8	Very low	123 Å²	123	148 Å²	148	80%	0.799	73%	0.734	S	S	*	*	P	Polyproline II helix	trans	-53	125.2	176	23.2	-31.2	0	0	0	106.5	T29	P27-T29 PolarHBondContact O-N 2.81Å
28	Q	48.8	Very low	39.5	Very low	172 Å²	172	151 Å²	151	80%	0.804	75%	0.752	S	S	*	*			trans	-43.4	120.4	179.5	-60.9	-167.2	11	0	0	107.9	P26 F30	P26-Q28 PolarHBondContact O-N 3.39Å; Q28-F30 PolarHBondContact O-N 3.02Å
29	T	40.3	Very low	40.1	Very low	128 Å²	128	148.3 Å²	148.3	79%	0.785	75%	0.749	S	S	*	*			trans	-13.4	93	172.4	53.5	0	0	0	0	111.1	P27 R31	P27-T29 PolarHBondContact O-N 2.81Å; T29-R31 PolarHBondContact O-N 2.82Å
30	F	36.5	Very low	40.7	Very low	182 Å²	182	146.1 Å²	146.1	80%	0.798	75%	0.747	S	S	*	*			trans	-58.1	104.6	160.3	-175.9	-100.4	0	0	0	102.8	Q28 S32 P33	Q28-F30 PolarHBondContact O-N 3.02Å; F30-S32 VanDerWaalsContact C-N 3.32Å; F30-S32 PolarHBondContact O-N 2.96Å; F30-P33 HydrophobicContact CE1-CG 4.4Å
31	R	39.1	Very low	41.1	Very low	224 Å²	224	143.7 Å²	143.7	85%	0.845	75%	0.75	S	S	*	*			trans	-47.9	109.4	174.6	-84.7	-179	-176.1	-123	1.2	104.6	T29	T29-R31 PolarHBondContact O-N 2.82Å
32	S	41.3	Very low	41.9	Very low	86 Å²	86	143 Å²	143	60%	0.601	75%	0.749	S	S	*	*			trans	-39.9	121.7	166	164.7	0	0	0	0	105.6	F30 R34	F30-S32 VanDerWaalsContact C-N 3.32Å; F30-S32 PolarHBondContact O-N 2.96Å; S32-R34 PolarHBondContact O-N 2.78Å
33	P	42.6	Very low	42.2	Very low	92 Å²	92	148.4 Å²	148.4	60%	0.597	76%	0.761	S	S	*	*			trans	-53.6	120.2	165.1	-8.6	20.8	0	0	0	103.5	F30 S35	F30-P33 HydrophobicContact CE1-CG 4.4Å; P33-S35 PolarHBondContact O-N 3.1Å; P33-S35 VanDerWaalsContact O-N 3.1Å
34	R	43	Very low	42.4	Very low	221 Å²	221	152.1 Å²	152.1	83%	0.834	77%	0.766	S	S	*	*			trans	-18.1	115.2	-178.7	-75.7	173.5	-160.3	-143.8	0.4	109.8	S32 W36	S32-R34 PolarHBondContact O-N 2.78Å; R34-W36 VanDerWaalsContact C-N 3.31Å; R34-W36 PolarHBondContact O-N 2.77Å
35	S	40.8	Very low	43.4	Very low	93 Å²	93	151.3 Å²	151.3	65%	0.65	75%	0.754	S	S	*	*			trans	-35.5	104.2	160.5	166.1	0	0	0	0	107.5	P33 T37	P33-S35 PolarHBondContact O-N 3.1Å; P33-S35 VanDerWaalsContact O-N 3.1Å; S35-T37 PolarHBondContact O-N 2.74Å
36	W	37.2	Very low	44.8	Very low	229 Å²	229	147.4 Å²	147.4	87%	0.867	74%	0.743	S	S	*	*			trans	-74.1	91.6	172.6	-70.5	82.3	0	0	0	103.4	R34 V38	R34-W36 VanDerWaalsContact C-N 3.31Å; R34-W36 PolarHBondContact O-N 2.77Å; W36-V38 PolarHBondContact O-N 2.83Å; W36-V38 VanDerWaalsContact O-N 3.09Å
37	T	40.8	Very low	46.2	Very low	83 Å²	83	148.8 Å²	148.8	51%	0.509	74%	0.744	S	S	.	*			trans	-52.8	120.4	170.7	46.4	0	0	0	0	107.3	S35 G39	S35-T37 PolarHBondContact O-N 2.74Å; T37-G39 PolarHBondContact O-N 2.93Å
38	V	52.8	Low	47.6	Very low	159 Å²	159	147.9 Å²	147.9	96%	0.964	73%	0.729	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.1	38.4	174.3	-171.3	0	0	0	0	110.5	W36	W36-V38 PolarHBondContact O-N 2.83Å; W36-V38 VanDerWaalsContact O-N 3.09Å
39	G	46.1	Very low	48.6	Very low	66 Å²	66	144.2 Å²	144.2	68%	0.68	71%	0.712	S	S	*	*	T	Hydrogen-bonded Turn	trans	-138.1	3.2	-170.5	0	0	0	0	0	114.3	T37	T37-G39 PolarHBondContact O-N 2.93Å
40	Q	44	Very low	50.2	Low	160 Å²	160	142.1 Å²	142.1	75%	0.748	70%	0.695	S	S	*	*			trans	-126.1	16.3	178.4	-73.5	-172.3	-76.7	0	0	114.7	Q42	Q40-Q42 PolarHBondContact O-N 2.98Å
41	L	43.8	Very low	51.9	Low	166 Å²	166	140.6 Å²	140.6	87%	0.869	68%	0.684	S	S	*	*			trans	-71	88.4	162.7	-141.3	87.3	0	0	0	107.2	R43	L41-R43 VanDerWaalsContact C-N 3.28Å; L41-R43 PolarHBondContact O-N 2.97Å
42	Q	47.7	Very low	53.5	Low	173 Å²	173	135 Å²	135	81%	0.808	67%	0.668	S	S	*	*			trans	-60.1	95.6	173	-77.2	-174.7	-45.9	0	0	108.2	Q40 R44	Q40-Q42 PolarHBondContact O-N 2.98Å; Q42-R44 PolarHBondContact O-N 3.09Å
43	R	42.8	Very low	54.8	Low	249 Å²	249	138.3 Å²	138.3	94%	0.94	68%	0.675	S	S	*	*	S	Bend	trans	6.1	35.8	135.1	-106.5	-171.9	-153.7	176.8	6.8	120.2	L41	L41-R43 VanDerWaalsContact C-N 3.28Å; L41-R43 PolarHBondContact O-N 2.97Å
44	R	44.6	Very low	56.3	Low	219 Å²	219	140.2 Å²	140.2	83%	0.826	68%	0.68	S	S	*	*			trans	-154.3	57.9	171.8	-83.1	-167.1	157.9	104.2	-3.3	109.6	Q42	Q42-R44 PolarHBondContact O-N 3.09Å
45	D	52.4	Low	57.4	Low	93 Å²	93	135.1 Å²	135.1	50%	0.497	66%	0.664	S	S	.	*			trans	-121.9	102.8	145.6	-68	-46.5	0	0	0	103.3	L47 I50	D45-L47 PolarHBondContact O-N 3.43Å; D45-I50 HydrophobicContact CB-CD1 4.13Å; D45-I50 HydrophobicContact CB-CG1 3.89Å
46	S	68.9	Low	58.6	Low	68 Å²	68	133.6 Å²	133.6	48%	0.476	65%	0.652	S	S	.	*			trans	-57.7	145.2	171.9	71.5	0	0	0	0	107.3	E48 E49 I50	S46-E48 PolarHBondContact O-N 2.85Å; S46-E49 WeakPolarHBondContact O-CA 3.14Å; S46-E49 VanDerWaalsContact O-CB 3.32Å; S46-E49 WeakPolarHBondContact O-CB 3.19Å; S46-E49 PolarHBondContact O-N 3.38Å; S46-E49 PolarHBondContact OG-N 3.42Å; S46-I50 PolarHBondContact O-N 2.86Å
47	L	71.3	Confident	60.3	Low	139 Å²	139	127 Å²	127	73%	0.728	64%	0.638	S	S	*	*	H	α-helix	trans	-53.2	-26.1	179.6	-149	127.4	0	0	0	112	D45 R51	D45-L47 PolarHBondContact O-N 3.43Å; L47-R51 WeakPolarHBondContact O-CB 3.4Å; L47-R51 PolarHBondContact O-N 3.36Å; L47-R51 VanDerWaalsContact O-N 3.16Å
48	E	74.8	Confident	62.1	Low	104 Å²	104	132.5 Å²	132.5	49%	0.486	65%	0.65	S	S	.	*	H	α-helix	trans	-70.1	-35.2	172.2	-71.7	-57.4	131.2	0	0	114	S46 R51 E52	S46-E48 PolarHBondContact O-N 2.85Å; E48-R51 CarbonylContact O-C 3.59Å; E48-R51 VanDerWaalsContact O-CB 3.28Å; E48-R51 WeakPolarHBondContact O-CB 3.31Å; E48-R51 PolarHBondContact O-N 3.46Å; E48-R51 IonicContact OE1-NH1 2.65Å; E48-R51 PolarHBondContact OE1-NH1 2.8Å; E48-E52 WeakPolarHBondContact O-CB 3.39Å; E48-E52 PolarHBondContact O-N 2.65Å
49	E	69.3	Low	63.6	Low	95 Å²	95	125.7 Å²	125.7	44%	0.444	61%	0.609	S	S	.	*	H	α-helix	trans	-69.2	-41.6	177.5	-164.3	162.1	-161.9	0	0	111.5	S46 R51 E52 M53	S46-E49 WeakPolarHBondContact O-CA 3.14Å; S46-E49 VanDerWaalsContact O-CB 3.32Å; S46-E49 WeakPolarHBondContact O-CB 3.19Å; S46-E49 PolarHBondContact O-N 3.38Å; S46-E49 PolarHBondContact OG-N 3.42Å; E49-R51 VanDerWaalsContact C-N 3.29Å; E49-R51 PolarHBondContact O-N 3.39Å; E49-E52 PolarHBondContact O-N 3.45Å; E49-M53 WeakPolarHBondContact O-CG 3.49Å; E49-M53 PolarHBondContact O-N 2.76Å
50	I	74.6	Confident	65.5	Low	83 Å²	83	126.1 Å²	126.1	43%	0.426	60%	0.6	S	S	.	*	H	α-helix	trans	-62.2	-41.5	170.7	-58	177.9	0	0	0	110	D45 S46 E52 M53 L54	D45-I50 HydrophobicContact CB-CD1 4.13Å; D45-I50 HydrophobicContact CB-CG1 3.89Å; S46-I50 PolarHBondContact O-N 2.86Å; I50-E52 VanDerWaalsContact C-N 3.33Å; I50-E52 PolarHBondContact O-N 3.35Å; I50-M53 PolarHBondContact O-N 3.13Å; I50-L54 HydrophobicContact CG2-CD1 3.83Å; I50-L54 HydrophobicContact CG2-CG 4.33Å; I50-L54 WeakPolarHBondContact O-CB 3.46Å; I50-L54 WeakPolarHBondContact O-CG 3.36Å; I50-L54 PolarHBondContact O-N 2.73Å
51	R	72.6	Confident	67.4	Low	151 Å²	151	125.2 Å²	125.2	57%	0.57	61%	0.607	S	S	*	*	H	α-helix	trans	-60.7	-42	175.5	-121.8	177.6	-174.1	165.7	0.9	112.1	L47 E48 E49 L54 K55	L47-R51 WeakPolarHBondContact O-CB 3.4Å; L47-R51 PolarHBondContact O-N 3.36Å; L47-R51 VanDerWaalsContact O-N 3.16Å; E48-R51 CarbonylContact O-C 3.59Å; E48-R51 VanDerWaalsContact O-CB 3.28Å; E48-R51 WeakPolarHBondContact O-CB 3.31Å; E48-R51 PolarHBondContact O-N 3.46Å; E48-R51 IonicContact OE1-NH1 2.65Å; E48-R51 PolarHBondContact OE1-NH1 2.8Å; E49-R51 VanDerWaalsContact C-N 3.29Å; E49-R51 PolarHBondContact O-N 3.39Å; R51-L54 PolarHBondContact O-N 3.37Å; R51-K55 WeakPolarHBondContact O-CG 3.19Å; R51-K55 PolarHBondContact O-N 2.86Å; R51-K55 VanDerWaalsContact O-N 3.1Å
52	E	71.8	Confident	69.3	Low	107 Å²	107	120.9 Å²	120.9	50%	0.5	60%	0.603	S	S	.	*	H	α-helix	trans	-65.1	-42.8	178.8	-154.5	69.5	-147.9	0	0	111	E48 E49 I50 L54 K55	E48-E52 WeakPolarHBondContact O-CB 3.39Å; E48-E52 PolarHBondContact O-N 2.65Å; E49-E52 PolarHBondContact O-N 3.45Å; I50-E52 VanDerWaalsContact C-N 3.33Å; I50-E52 PolarHBondContact O-N 3.35Å; E52-L54 VanDerWaalsContact C-N 3.3Å; E52-L54 PolarHBondContact O-N 3.07Å; E52-K55 WeakPolarHBondContact O-CB 3.32Å; E52-K55 PolarHBondContact O-N 2.95Å; E52-K55 IonicContact OE1-NZ 3.03Å; E52-K55 PolarHBondContact OE1-NZ 2.81Å; E52-K55 VanDerWaalsContact OE2-CE 3.3Å; E52-K55 WeakPolarHBondContact OE2-CE 3.45Å; E52-K55 IonicContact OE2-NZ 2.81Å; E52-K55 PolarHBondContact OE2-NZ 2.65Å
53	M	68	Low	71.2	Confident	154 Å²	154	115.4 Å²	115.4	76%	0.759	58%	0.576	S	S	*	*	H	α-helix	trans	-67.3	-29.7	175.5	-67.9	-176.2	84.1	0	0	113.1	E49 I50	E49-M53 WeakPolarHBondContact O-CG 3.49Å; E49-M53 PolarHBondContact O-N 2.76Å; I50-M53 PolarHBondContact O-N 3.13Å
54	L	74.4	Confident	73.3	Confident	133 Å²	133	106.8 Å²	106.8	70%	0.696	54%	0.543	S	S	*	.	H	α-helix	trans	-84	-8.6	177	-68.9	174	0	0	0	113.4	I50 R51 E52	I50-L54 HydrophobicContact CG2-CD1 3.83Å; I50-L54 HydrophobicContact CG2-CG 4.33Å; I50-L54 WeakPolarHBondContact O-CB 3.46Å; I50-L54 WeakPolarHBondContact O-CG 3.36Å; I50-L54 PolarHBondContact O-N 2.73Å; R51-L54 PolarHBondContact O-N 3.37Å; E52-L54 VanDerWaalsContact C-N 3.3Å; E52-L54 PolarHBondContact O-N 3.07Å
55	K	66.7	Low	75	Confident	113 Å²	113	96.3 Å²	96.3	49%	0.491	50%	0.504	S	S	.	.	S	Bend	trans	-59.9	126.1	173.2	-75.5	176.4	-170.9	172.6	0	108	R51 E52	R51-K55 WeakPolarHBondContact O-CG 3.19Å; R51-K55 PolarHBondContact O-N 2.86Å; R51-K55 VanDerWaalsContact O-N 3.1Å; E52-K55 WeakPolarHBondContact O-CB 3.32Å; E52-K55 PolarHBondContact O-N 2.95Å; E52-K55 IonicContact OE1-NZ 3.03Å; E52-K55 PolarHBondContact OE1-NZ 2.81Å; E52-K55 VanDerWaalsContact OE2-CE 3.3Å; E52-K55 WeakPolarHBondContact OE2-CE 3.45Å; E52-K55 IonicContact OE2-NZ 2.81Å; E52-K55 PolarHBondContact OE2-NZ 2.65Å
56	P	65	Low	76.2	Confident	62 Å²	62	95.3 Å²	95.3	40%	0.403	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-57.5	139.2	178.8	23.7	-32	0	0	0	108.5	R58 Y77	P56-R58 PolarHBondContact O-N 2.8Å; P56-Y77 HydrophobicContact CB-CD2 4.01Å; P56-Y77 HydrophobicContact CB-CE2 4.1Å; P56-Y77 HydrophobicContact CB-CG 4.24Å; P56-Y77 HydrophobicContact CG-CG 4.48Å
57	P	73.4	Confident	76.5	Confident	90 Å²	90	93.4 Å²	93.4	58%	0.584	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-52.5	136.1	-177.3	14.9	-26.4	0	0	0	110	Y74	P57-Y74 HydrophobicContact CB-CE2 4.36Å; P57-Y74 HydrophobicContact CG-CE2 4.11Å; P57-Y74 WeakPolarHBondContact O-CD2 3.28Å; P57-Y74 WeakPolarHBondContact O-CE2 3.49Å
58	R	79.3	Confident	76.8	Confident	198 Å²	198	88.7 Å²	88.7	75%	0.747	46%	0.46	S	S	*	.	P	Polyproline II helix	trans	-64.5	136.9	175.2	-78.9	-163.2	-93.2	-144.8	-3.6	109.1	P56	P56-R58 PolarHBondContact O-N 2.8Å
59	P	84.4	Confident	77.1	Confident	16 Å²	16	90.2 Å²	90.2	10%	0.104	47%	0.465	C	S	.	.	P	Polyproline II helix	trans	-58.9	155.3	177.6	-21.9	32.1	0	0	0	112.5	Y63 H73 Y74	P59-Y63 HydrophobicContact CB-CD1 3.22Å; P59-Y63 HydrophobicContact CB-CE1 4.06Å; P59-Y63 HydrophobicContact CB-CG 3.65Å; P59-Y63 HydrophobicContact CG-CD1 3.59Å; P59-Y63 HydrophobicContact CG-CE1 4.01Å; P59-Y63 HydrophobicContact CG-CG 4.47Å; P59-H73 VanDerWaalsContact CG-C 3.43Å; P59-Y74 HydrophobicContact CB-CD1 4.31Å; P59-Y74 HydrophobicContact CB-CE1 4.03Å; P59-Y74 HydrophobicContact CG-CD1 4.3Å; P59-Y74 HydrophobicContact CG-CD2 4.36Å; P59-Y74 HydrophobicContact CG-CE1 4.4Å; P59-Y74 HydrophobicContact CG-CE2 4.45Å; P59-Y74 HydrophobicContact CG-CG 4.3Å
60	P	85.6	Confident	77.8	Confident	76 Å²	76	87.4 Å²	87.4	49%	0.494	46%	0.456	S	S	.	.	P	Polyproline II helix	trans	-57.8	150.5	173.9	-21	32.4	0	0	0	111.4	G62 Y63	P60-G62 PolarHBondContact O-N 2.85Å; P60-Y63 WeakPolarHBondContact O-CB 3.44Å; P60-Y63 PolarHBondContact O-N 3.17Å
61	P	83.5	Confident	78.4	Confident	140 Å²	140	87.5 Å²	87.5	91%	0.909	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-52.5	127	173.4	-23.4	32.4	0	0	0	111.1
62	G	84.6	Confident	78.9	Confident	76 Å²	76	85.7 Å²	85.7	78%	0.784	46%	0.458	S	S	*	.	T	Hydrogen-bonded Turn	trans	95.8	-10.4	-177.4	0	0	0	0	0	115	P60	P60-G62 PolarHBondContact O-N 2.85Å
63	Y	87.9	Confident	79.5	Confident	57 Å²	57	81.6 Å²	81.6	22%	0.224	44%	0.439	C	S	.	.			trans	-75.7	139.2	167.5	178.8	-85.9	0	0	0	110.9	P59 P60 H73 Y74 I75	P59-Y63 HydrophobicContact CB-CD1 3.22Å; P59-Y63 HydrophobicContact CB-CE1 4.06Å; P59-Y63 HydrophobicContact CB-CG 3.65Å; P59-Y63 HydrophobicContact CG-CD1 3.59Å; P59-Y63 HydrophobicContact CG-CE1 4.01Å; P59-Y63 HydrophobicContact CG-CG 4.47Å; P60-Y63 WeakPolarHBondContact O-CB 3.44Å; P60-Y63 PolarHBondContact O-N 3.17Å; Y63-H73 WeakPolarHBondContact CE1-O 3.12Å; Y63-Y74 HydrophobicContact CE1-CD1 4.14Å; Y63-Y74 HydrophobicContact CE2-CD1 4.35Å; Y63-I75 WeakPolarHBondContact OH-CB 3.19Å; Y63-I75 PolarHBondContact OH-N 2.81Å
64	Y	85.7	Confident	80.2	Confident	68 Å²	68	77.8 Å²	77.8	27%	0.267	42%	0.417	S	S	.	.			trans	-134.2	141.8	166.9	59.9	-87.1	0	0	0	109.7	H66 F69 S70	Y64-H66 AromaticContact CD2-ND1 3.81Å; Y64-H66 AromaticContact CE2-CE1 3.72Å; Y64-H66 AromaticContact CE2-ND1 3.29Å; Y64-H66 VanDerWaalsContact CE2-ND1 3.29Å; Y64-H66 WeakPolarHBondContact CE2-ND1 3.5Å; Y64-H66 AromaticContact CZ-CE1 3.84Å; Y64-H66 AromaticContact CZ-ND1 3.86Å; Y64-H66 PolarHBondContact O-N 3.34Å; Y64-F69 AromaticContact CD2-CD1 3.55Å; Y64-F69 HydrophobicContact CD2-CD1 3.55Å; Y64-F69 HydrophobicContact CD2-CE1 4.21Å; Y64-F69 HydrophobicContact CD2-CG 4.42Å; Y64-F69 AromaticContact CE2-CD1 3.52Å; Y64-F69 HydrophobicContact CE2-CD1 3.52Å; Y64-F69 AromaticContact CE2-CE1 3.75Å; Y64-F69 HydrophobicContact CE2-CE1 3.75Å; Y64-S70 CarbonylContact C-O 3.57Å; Y64-S70 WeakPolarHBondContact CA-O 3.1Å
65	C	81.4	Confident	80.5	Confident	0 Å²	0	73.7 Å²	73.7	0%	0	40%	0.396	C	S	.	.			trans	-59.4	122.9	174.2	172.4	0	0	0	0	109.8	V67 C68 F69 S70 H73 C78	C65-V67 PolarHBondContact O-N 3.17Å; C65-V67 PolarHBondContact SG-N 3.5Å; C65-C68 VanDerWaalsContact SG-SG 3.63Å; C65-F69 WeakPolarHBondContact O-CA 3.38Å; C65-F69 PolarHBondContact O-N 3.33Å; C65-S70 WeakPolarHBondContact CB-O 3.36Å; C65-S70 PolarHBondContact N-O 2.93Å; C65-H73 WeakPolarHBondContact CB-NE2 3.45Å; C65-H73 PolarHBondContact SG-NE2 2.95Å; C65-C78 VanDerWaalsContact SG-SG 3.61Å
66	H	77.7	Confident	80.7	Confident	71 Å²	71	73 Å²	73	33%	0.329	40%	0.397	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.2	-2	-179	-58	-59.2	0	0	0	114.7	Y64 I75 H151	Y64-H66 AromaticContact CD2-ND1 3.81Å; Y64-H66 AromaticContact CE2-CE1 3.72Å; Y64-H66 AromaticContact CE2-ND1 3.29Å; Y64-H66 VanDerWaalsContact CE2-ND1 3.29Å; Y64-H66 WeakPolarHBondContact CE2-ND1 3.5Å; Y64-H66 AromaticContact CZ-CE1 3.84Å; Y64-H66 AromaticContact CZ-ND1 3.86Å; Y64-H66 PolarHBondContact O-N 3.34Å; H66-I75 HydrophobicContact CB-CD1 4.05Å; H66-H151 AromaticContact CD2-CE1 3.55Å; H66-H151 AromaticContact CD2-ND1 3.84Å; H66-H151 AromaticContact CG-CE1 3.61Å; H66-H151 AromaticContact ND1-CE1 3.95Å; H66-H151 AromaticContact NE2-CE1 3.86Å; H66-H151 AromaticContact NE2-ND1 3.72Å
67	V	74.9	Confident	81.3	Confident	28 Å²	28	76.4 Å²	76.4	17%	0.17	40%	0.403	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90.4	-48.2	175.1	175.1	0	0	0	0	111.4	C65 I75 C78 K91	C65-V67 PolarHBondContact O-N 3.17Å; C65-V67 PolarHBondContact SG-N 3.5Å; V67-I75 HydrophobicContact CG2-CD1 3.98Å; V67-I75 HydrophobicContact CG2-CG1 3.74Å; V67-C78 HydrophobicContact CB-CB 4.48Å; V67-K91 HydrophobicContact CG2-CB 4.44Å
68	C	78.2	Confident	81.5	Confident	40 Å²	40	72.3 Å²	72.3	27%	0.27	38%	0.376	S	S	.	.	T	Hydrogen-bonded Turn	trans	-118.8	-1.6	-174.9	68.4	0	0	0	0	113.9	C65 S70 H73 C78 V80	C65-C68 VanDerWaalsContact SG-SG 3.63Å; C68-S70 PolarHBondContact O-N 3.25Å; C68-S70 WeakPolarHBondContact SG-CB 3.49Å; C68-H73 PolarHBondContact SG-CE1 2.76Å; C68-H73 PolarHBondContact SG-NE2 3.23Å; C68-C78 VanDerWaalsContact SG-SG 3.64Å; C68-V80 HydrophobicContact CB-CB 4.04Å; C68-V80 HydrophobicContact CB-CG2 3.84Å
69	F	80.2	Confident	81.4	Confident	136 Å²	136	66.7 Å²	66.7	60%	0.596	37%	0.365	S	S	*	.			trans	61.7	17	-178.2	-57.6	-89.1	0	0	0	115.3	Y64 C65	Y64-F69 AromaticContact CD2-CD1 3.55Å; Y64-F69 HydrophobicContact CD2-CD1 3.55Å; Y64-F69 HydrophobicContact CD2-CE1 4.21Å; Y64-F69 HydrophobicContact CD2-CG 4.42Å; Y64-F69 AromaticContact CE2-CD1 3.52Å; Y64-F69 HydrophobicContact CE2-CD1 3.52Å; Y64-F69 AromaticContact CE2-CE1 3.75Å; Y64-F69 HydrophobicContact CE2-CE1 3.75Å; C65-F69 WeakPolarHBondContact O-CA 3.38Å; C65-F69 PolarHBondContact O-N 3.33Å
70	S	83.6	Confident	80.8	Confident	36 Å²	36	71.2 Å²	71.2	25%	0.252	39%	0.392	S	S	.	.			trans	-77.2	144.2	173.4	178.2	0	0	0	0	111.9	Y64 C65 C68 E72	Y64-S70 CarbonylContact C-O 3.57Å; Y64-S70 WeakPolarHBondContact CA-O 3.1Å; C65-S70 WeakPolarHBondContact CB-O 3.36Å; C65-S70 PolarHBondContact N-O 2.93Å; C68-S70 PolarHBondContact O-N 3.25Å; C68-S70 WeakPolarHBondContact SG-CB 3.49Å; S70-E72 VanDerWaalsContact C-N 3.33Å; S70-E72 WeakPolarHBondContact OG-CB 3.46Å; S70-E72 PolarHBondContact OG-N 3.31Å; S70-E72 VanDerWaalsContact OG-N 3.16Å
71	T	86.8	Confident	79.8	Confident	85 Å²	85	68.5 Å²	68.5	52%	0.521	38%	0.378	S	S	.	.	S	Bend	trans	-83.2	-6.9	172.5	49.8	0	0	0	0	113.6
72	E	84.2	Confident	78.5	Confident	113 Å²	113	67.9 Å²	67.9	53%	0.528	37%	0.367	S	S	.	.	S	Bend	trans	-84.9	-16.5	-164.5	-61.3	-52.2	104.9	0	0	114.7	S70	S70-E72 VanDerWaalsContact C-N 3.33Å; S70-E72 WeakPolarHBondContact OG-CB 3.46Å; S70-E72 PolarHBondContact OG-N 3.31Å; S70-E72 VanDerWaalsContact OG-N 3.16Å
73	H	84.7	Confident	77.1	Confident	21 Å²	21	68.7 Å²	68.7	10%	0.097	35%	0.353	C	S	.	.	S	Bend	trans	-148.6	153	-173.8	56.2	-92.5	0	0	0	111.5	P59 Y63 C65 C68 C78 P79	P59-H73 VanDerWaalsContact CG-C 3.43Å; Y63-H73 WeakPolarHBondContact CE1-O 3.12Å; C65-H73 WeakPolarHBondContact CB-NE2 3.45Å; C65-H73 PolarHBondContact SG-NE2 2.95Å; C68-H73 PolarHBondContact SG-CE1 2.76Å; C68-H73 PolarHBondContact SG-NE2 3.23Å; H73-C78 VanDerWaalsContact CD2-CA 3.41Å; H73-C78 WeakPolarHBondContact CD2-CA 3.37Å; H73-C78 WeakPolarHBondContact NE2-CA 3.37Å; H73-C78 PolarHBondContact NE2-SG 3.44Å; H73-C78 VanDerWaalsContact NE2-SG 3.43Å; H73-P79 VanDerWaalsContact CE1-CD 3.46Å; H73-P79 WeakPolarHBondContact CE1-CD 3.49Å
74	Y	83	Confident	75.5	Confident	74 Å²	74	71.2 Å²	71.2	29%	0.29	37%	0.374	S	S	.	.			trans	-68.7	149.9	164.9	-64.5	-78.4	0	0	0	110.7	P57 P59 Y63 N76 Y77	P57-Y74 HydrophobicContact CB-CE2 4.36Å; P57-Y74 HydrophobicContact CG-CE2 4.11Å; P57-Y74 WeakPolarHBondContact O-CD2 3.28Å; P57-Y74 WeakPolarHBondContact O-CE2 3.49Å; P59-Y74 HydrophobicContact CB-CD1 4.31Å; P59-Y74 HydrophobicContact CB-CE1 4.03Å; P59-Y74 HydrophobicContact CG-CD1 4.3Å; P59-Y74 HydrophobicContact CG-CD2 4.36Å; P59-Y74 HydrophobicContact CG-CE1 4.4Å; P59-Y74 HydrophobicContact CG-CE2 4.45Å; P59-Y74 HydrophobicContact CG-CG 4.3Å; Y63-Y74 HydrophobicContact CE1-CD1 4.14Å; Y63-Y74 HydrophobicContact CE2-CD1 4.35Å; Y74-N76 PolarHBondContact O-N 3.24Å; Y74-Y77 PolarHBondContact O-N 2.81Å
75	I	79.2	Confident	74.5	Confident	48 Å²	48	75.9 Å²	75.9	25%	0.246	40%	0.404	C	S	.	.	G	3₁₀ helix	trans	-49.2	-32.3	-178.5	-164.8	172.6	0	0	0	114.4	Y63 H66 V67 Y77 C78	Y63-I75 WeakPolarHBondContact OH-CB 3.19Å; Y63-I75 PolarHBondContact OH-N 2.81Å; H66-I75 HydrophobicContact CB-CD1 4.05Å; V67-I75 HydrophobicContact CG2-CD1 3.98Å; V67-I75 HydrophobicContact CG2-CG1 3.74Å; I75-Y77 VanDerWaalsContact C-N 3.26Å; I75-Y77 PolarHBondContact O-N 3.26Å; I75-C78 VanDerWaalsContact O-CB 3.26Å; I75-C78 WeakPolarHBondContact O-CB 3.31Å; I75-C78 PolarHBondContact O-N 3.44Å
76	N	72.4	Confident	73.8	Confident	97 Å²	97	76.6 Å²	76.6	52%	0.519	41%	0.409	S	S	.	.	G	3₁₀ helix	trans	-71.9	-17.6	179.2	-60.5	-14.2	0	0	0	113.9	Y74 N83	Y74-N76 PolarHBondContact O-N 3.24Å; N76-N83 PolarHBondContact O-ND2 3.16Å; N76-N83 PolarHBondContact O-OD1 3.37Å
77	Y	76.7	Confident	73.9	Confident	135 Å²	135	80.6 Å²	80.6	53%	0.529	43%	0.425	S	S	.	.	G	3₁₀ helix	trans	-110.1	19.1	176.9	-57.1	-74.3	0	0	0	111	P56 Y74 I75 P79	P56-Y77 HydrophobicContact CB-CD2 4.01Å; P56-Y77 HydrophobicContact CB-CE2 4.1Å; P56-Y77 HydrophobicContact CB-CG 4.24Å; P56-Y77 HydrophobicContact CG-CG 4.48Å; Y74-Y77 PolarHBondContact O-N 2.81Å; I75-Y77 VanDerWaalsContact C-N 3.26Å; I75-Y77 PolarHBondContact O-N 3.26Å; Y77-P79 WeakPolarHBondContact O-CD 3.48Å
78	C	77.5	Confident	74.2	Confident	4 Å²	4	79.4 Å²	79.4	3%	0.027	42%	0.418	C	S	.	.			trans	-65.5	118.7	-178	-175	0	0	0	0	111.1	C65 V67 C68 H73 I75 V80 G81 L82	C65-C78 VanDerWaalsContact SG-SG 3.61Å; V67-C78 HydrophobicContact CB-CB 4.48Å; C68-C78 VanDerWaalsContact SG-SG 3.64Å; H73-C78 VanDerWaalsContact CD2-CA 3.41Å; H73-C78 WeakPolarHBondContact CD2-CA 3.37Å; H73-C78 WeakPolarHBondContact NE2-CA 3.37Å; H73-C78 PolarHBondContact NE2-SG 3.44Å; H73-C78 VanDerWaalsContact NE2-SG 3.43Å; I75-C78 VanDerWaalsContact O-CB 3.26Å; I75-C78 WeakPolarHBondContact O-CB 3.31Å; I75-C78 PolarHBondContact O-N 3.44Å; C78-V80 VanDerWaalsContact C-N 3.27Å; C78-V80 PolarHBondContact O-N 3.46Å; C78-G81 PolarHBondContact O-N 3.31Å; C78-G81 PolarHBondContact SG-N 3.1Å; C78-L82 PolarHBondContact O-N 2.96Å
79	P	76.6	Confident	74	Confident	79 Å²	79	81 Å²	81	51%	0.513	43%	0.427	S	S	.	.	S	Bend	trans	-71.6	-24.4	179.4	29.9	-34.2	0	0	0	112	H73 Y77 L82	H73-P79 VanDerWaalsContact CE1-CD 3.46Å; H73-P79 WeakPolarHBondContact CE1-CD 3.49Å; Y77-P79 WeakPolarHBondContact O-CD 3.48Å; P79-L82 WeakPolarHBondContact O-CD1 3.36Å; P79-L82 WeakPolarHBondContact O-CG 3.33Å
80	V	73.4	Confident	73.6	Confident	111 Å²	111	75.9 Å²	75.9	67%	0.673	40%	0.404	S	S	*	.	S	Bend	trans	-83.6	-30.4	175.1	-169.7	0	0	0	0	110.9	C68 C78 L82	C68-V80 HydrophobicContact CB-CB 4.04Å; C68-V80 HydrophobicContact CB-CG2 3.84Å; C78-V80 VanDerWaalsContact C-N 3.27Å; C78-V80 PolarHBondContact O-N 3.46Å; V80-L82 PolarHBondContact O-N 3.32Å
81	G	63.3	Low	73.1	Confident	19 Å²	19	76.5 Å²	76.5	20%	0.196	40%	0.402	C	S	.	.	S	Bend	trans	-85.8	13	179.7	0	0	0	0	0	113.9	C78 N83	C78-G81 PolarHBondContact O-N 3.31Å; C78-G81 PolarHBondContact SG-N 3.1Å; G81-N83 PolarHBondContact O-N 3.4Å
82	L	56.1	Low	72.4	Confident	128 Å²	128	73 Å²	73	67%	0.67	38%	0.383	S	S	*	.			trans	-27.9	89.4	-170.5	-96.2	156.9	0	0	0	114	C78 P79 V80 V84	C78-L82 PolarHBondContact O-N 2.96Å; P79-L82 WeakPolarHBondContact O-CD1 3.36Å; P79-L82 WeakPolarHBondContact O-CG 3.33Å; V80-L82 PolarHBondContact O-N 3.32Å; L82-V84 VanDerWaalsContact C-N 3.25Å; L82-V84 PolarHBondContact O-N 3.05Å
83	N	56.5	Low	71.8	Confident	92 Å²	92	74.8 Å²	74.8	49%	0.492	39%	0.391	S	S	.	.				37.2	38	117	-85.4	-20.1	0	0	0	118.6	N76 G81	N76-N83 PolarHBondContact O-ND2 3.16Å; N76-N83 PolarHBondContact O-OD1 3.37Å; G81-N83 PolarHBondContact O-N 3.4Å
84	V	52.7	Low	71.2	Confident	110 Å²	110	78.3 Å²	78.3	67%	0.667	41%	0.407	S	S	*	.			trans	-60.8	148.2	147	-67.6	0	0	0	0	107.7	L82 C86	L82-V84 VanDerWaalsContact C-N 3.25Å; L82-V84 PolarHBondContact O-N 3.05Å; V84-C86 HydrophobicContact CG2-CB 4.25Å; V84-C86 PolarHBondContact O-N 2.85Å; V84-C86 PolarHBondContact O-SG 2.99Å
85	D	65.6	Low	71	Confident	167 Å²	167	79.2 Å²	79.2	89%	0.893	41%	0.412	S	S	*	.			trans	-61	65.6	175.7	-72.2	-48.6	0	0	0	112	K87	D85-K87 PolarHBondContact O-N 2.94Å
86	C	66.8	Low	71.2	Confident	15 Å²	15	76.9 Å²	76.9	10%	0.101	40%	0.4	C	S	.	.			trans	-79.9	112.1	-174.7	36.5	0	0	0	0	107	V84 T88 K91	V84-C86 HydrophobicContact CG2-CB 4.25Å; V84-C86 PolarHBondContact O-N 2.85Å; V84-C86 PolarHBondContact O-SG 2.99Å; C86-T88 PolarHBondContact O-N 3.37Å; C86-K91 HydrophobicContact CB-CD 4.34Å; C86-K91 PolarHBondContact O-NZ 3.23Å; C86-K91 WeakPolarHBondContact SG-CD 2.99Å; C86-K91 VanDerWaalsContact SG-CE 3.51Å; C86-K91 PolarHBondContact SG-NZ 2.99Å
87	K	80.5	Confident	71.8	Confident	155 Å²	155	73.4 Å²	73.4	67%	0.674	38%	0.381	S	S	*	.			trans	-69.6	0.3	179.9	-64.8	176.7	178.8	178	0	113.5	D85 F130	D85-K87 PolarHBondContact O-N 2.94Å; K87-F130 HydrophobicContact CB-CD1 3.76Å; K87-F130 HydrophobicContact CB-CD2 3.96Å; K87-F130 HydrophobicContact CB-CE1 3.67Å; K87-F130 HydrophobicContact CB-CE2 3.91Å; K87-F130 HydrophobicContact CB-CG 3.9Å; K87-F130 HydrophobicContact CB-CZ 3.77Å; K87-F130 HydrophobicContact CD-CD2 4.27Å; K87-F130 HydrophobicContact CD-CE1 4.15Å; K87-F130 HydrophobicContact CD-CE2 3.48Å; K87-F130 VanDerWaalsContact CD-CE2 3.48Å; K87-F130 HydrophobicContact CD-CZ 3.4Å; K87-F130 VanDerWaalsContact CD-CZ 3.4Å; K87-F130 HydrophobicContact CG-CE1 4.46Å; K87-F130 HydrophobicContact CG-CE2 4.33Å; K87-F130 HydrophobicContact CG-CZ 4.17Å
88	T	79.7	Confident	72.3	Confident	3 Å²	3	67 Å²	67	2%	0.018	36%	0.356	C	S	.	.	S	Bend	trans	-104	148.7	-177.3	66.8	0	0	0	0	112.1	C86 Y90 K91 A116 G117 M118 F130 P131	C86-T88 PolarHBondContact O-N 3.37Å; T88-Y90 PolarHBondContact O-N 2.91Å; T88-Y90 PolarHBondContact OG1-O 2.67Å; T88-K91 PolarHBondContact O-NZ 3.49Å; T88-A116 WeakPolarHBondContact OG1-CA 3.25Å; T88-G117 PolarHBondContact OG1-N 3.01Å; T88-M118 WeakPolarHBondContact CG2-O 3.22Å; T88-F130 HydrophobicContact CG2-CB 4.5Å; T88-F130 HydrophobicContact CG2-CD1 3.64Å; T88-F130 HydrophobicContact CG2-CE1 4.42Å; T88-P131 HydrophobicContact CG2-CG 4.35Å
89	P	73.9	Confident	72.8	Confident	72 Å²	72	69.5 Å²	69.5	47%	0.468	37%	0.369	S	S	.	.	S	Bend	trans	-62.3	-38.1	176.3	-23.9	32.8	0	0	0	114.1	P131	P89-P131 WeakPolarHBondContact CD-O 3.2Å; P89-P131 WeakPolarHBondContact CG-O 3.04Å
90	Y	73.1	Confident	73.5	Confident	30 Å²	30	65.8 Å²	65.8	12%	0.118	34%	0.344	C	S	.	.			trans	-80.8	134.6	176.5	170.7	-107.3	0	0	0	110.7	T88 G92 K94 A116 Q134 V136	T88-Y90 PolarHBondContact O-N 2.91Å; T88-Y90 PolarHBondContact OG1-O 2.67Å; Y90-G92 WeakPolarHBondContact CE1-O 3.49Å; Y90-G92 VanDerWaalsContact CZ-C 3.45Å; Y90-G92 VanDerWaalsContact OH-C 3.29Å; Y90-G92 WeakPolarHBondContact OH-CA 3.26Å; Y90-K94 WeakPolarHBondContact CE1-O 3.24Å; Y90-K94 VanDerWaalsContact CZ-O 3.27Å; Y90-K94 WeakPolarHBondContact OH-CA 3.3Å; Y90-K94 WeakPolarHBondContact OH-CB 3.37Å; Y90-K94 PolarHBondContact OH-N 3.05Å; Y90-K94 PolarHBondContact OH-O 3.22Å; Y90-A116 HydrophobicContact CD1-CB 4.21Å; Y90-A116 VanDerWaalsContact O-CB 3.29Å; Y90-A116 WeakPolarHBondContact O-CB 3.33Å; Y90-Q134 VanDerWaalsContact CB-CB 3.43Å; Y90-Q134 VanDerWaalsContact CB-OE1 3.3Å; Y90-Q134 HydrophobicContact CG-CB 4.34Å; Y90-V136 HydrophobicContact CD2-CG2 3.8Å; Y90-V136 HydrophobicContact CE2-CG2 3.27Å
91	K	73.2	Confident	74.3	Confident	48 Å²	48	62.4 Å²	62.4	21%	0.209	32%	0.324	C	S	.	.			trans	-116.4	8.3	-174.3	-54.1	-63.3	-172.8	-162.3	0	113.3	V67 C86 T88	V67-K91 HydrophobicContact CG2-CB 4.44Å; C86-K91 HydrophobicContact CB-CD 4.34Å; C86-K91 PolarHBondContact O-NZ 3.23Å; C86-K91 WeakPolarHBondContact SG-CD 2.99Å; C86-K91 VanDerWaalsContact SG-CE 3.51Å; C86-K91 PolarHBondContact SG-NZ 2.99Å; T88-K91 PolarHBondContact O-NZ 3.49Å
92	G	70.9	Confident	75.8	Confident	12 Å²	12	61.5 Å²	61.5	12%	0.124	32%	0.315	C	S	.	.	S	Bend	trans	-92.6	169.6	-176.2	0	0	0	0	0	113.9	Y90 A116	Y90-G92 WeakPolarHBondContact CE1-O 3.49Å; Y90-G92 VanDerWaalsContact CZ-C 3.45Å; Y90-G92 VanDerWaalsContact OH-C 3.29Å; Y90-G92 WeakPolarHBondContact OH-CA 3.26Å; G92-A116 WeakPolarHBondContact O-CB 3.47Å
93	H	71	Confident	77.4	Confident	150 Å²	150	59.1 Å²	59.1	69%	0.694	31%	0.307	S	S	*	.	S	Bend	trans	-87.1	-17.1	179.9	56.2	-90.9	0	0	0	113.8
94	K	73.4	Confident	79.3	Confident	96 Å²	96	62 Å²	62	42%	0.417	32%	0.315	S	S	.	.	S	Bend	trans	-79.7	157.1	179.6	-58.5	-176.8	179.8	177.3	0	111.9	Y90 V136	Y90-K94 WeakPolarHBondContact CE1-O 3.24Å; Y90-K94 VanDerWaalsContact CZ-O 3.27Å; Y90-K94 WeakPolarHBondContact OH-CA 3.3Å; Y90-K94 WeakPolarHBondContact OH-CB 3.37Å; Y90-K94 PolarHBondContact OH-N 3.05Å; Y90-K94 PolarHBondContact OH-O 3.22Å; K94-V136 HydrophobicContact CB-CG1 4.16Å; K94-V136 HydrophobicContact CD-CG1 4.26Å
95	K	78.8	Confident	81.4	Confident	92 Å²	92	59 Å²	59	40%	0.4	30%	0.298	S	S	.	.			trans	-61.6	145.4	170.1	-73	-175.1	178.4	-169.2	0	111.4	N113 Y115 I137	K95-N113 WeakPolarHBondContact CE-OD1 3.29Å; K95-N113 PolarHBondContact NZ-OD1 2.65Å; K95-Y115 VanDerWaalsContact CE-CZ 3.47Å; K95-Y115 WeakPolarHBondContact CE-OH 3.08Å; K95-Y115 HydrophobicContact CG-CD1 4.32Å; K95-Y115 HydrophobicContact CG-CE1 3.55Å; K95-Y115 HydrophobicContact CG-CE2 4.17Å; K95-I137 HydrophobicContact CB-CD1 4.01Å; K95-I137 PolarHBondContact O-N 3.45Å
96	S	82.9	Confident	82.7	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.5	152.7	175.5	64.9	0	0	0	0	110.8	G98 S114 Q134 V135	S96-G98 PolarHBondContact O-N 2.83Å; S96-S114 PolarHBondContact N-O 2.86Å; S96-S114 WeakPolarHBondContact O-CA 3.27Å; S96-S114 WeakPolarHBondContact O-CB 3.3Å; S96-S114 PolarHBondContact O-N 2.93Å; S96-S114 PolarHBondContact OG-O 3.16Å; S96-Q134 WeakPolarHBondContact OG-CG 3.5Å; S96-Q134 PolarHBondContact OG-NE2 3.45Å; S96-Q134 VanDerWaalsContact OG-NE2 3.11Å; S96-V135 CarbonylContact C-O 3.58Å; S96-V135 WeakPolarHBondContact CA-O 3.38Å; S96-V135 WeakPolarHBondContact CB-O 3.09Å
97	I	85.1	Confident	83.9	Confident	23 Å²	23	63.1 Å²	63.1	12%	0.118	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.2	113.4	163.3	-68.5	161.5	0	0	0	107.8	S111 N112 Q134 V135 I137 L148	I97-S111 CarbonylContact C-O 3.37Å; I97-S111 WeakPolarHBondContact CA-O 3.33Å; I97-N112 VanDerWaalsContact CD1-OD1 3.25Å; I97-N112 WeakPolarHBondContact CD1-OD1 3.43Å; I97-N112 HydrophobicContact CG1-CB 4.31Å; I97-N112 WeakPolarHBondContact CG1-OD1 3.29Å; I97-Q134 CarbonylContact O-C 3.59Å; I97-Q134 VanDerWaalsContact O-CA 3.31Å; I97-Q134 WeakPolarHBondContact O-CA 3.17Å; I97-V135 PolarHBondContact N-O 3.45Å; I97-V135 PolarHBondContact O-N 2.88Å; I97-I137 HydrophobicContact CD1-CG1 4.05Å; I97-I137 HydrophobicContact CG1-CD1 4.06Å; I97-I137 HydrophobicContact CG1-CG1 3.83Å; I97-L148 HydrophobicContact CB-CD2 3.84Å; I97-L148 HydrophobicContact CD1-CD1 4.13Å; I97-L148 HydrophobicContact CD1-CD2 3.23Å; I97-L148 HydrophobicContact CD1-CG 3.47Å; I97-L148 VanDerWaalsContact CD1-CG 3.47Å; I97-L148 HydrophobicContact CG1-CD2 4.07Å; I97-L148 HydrophobicContact CG2-CD2 3.98Å
98	G	87.6	Confident	84.5	Confident	0 Å²	0	64.2 Å²	64.2	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	133.4	175.3	0	0	0	0	0	111.6	S96 F100 T110 S111 S114	S96-G98 PolarHBondContact O-N 2.83Å; G98-F100 WeakPolarHBondContact O-CD2 3.4Å; G98-F100 WeakPolarHBondContact O-CE2 3.43Å; G98-T110 CarbonylContact O-C 3.59Å; G98-T110 VanDerWaalsContact O-CA 3.27Å; G98-T110 WeakPolarHBondContact O-CA 3.49Å; G98-S111 PolarHBondContact N-O 3.11Å; G98-S111 PolarHBondContact O-N 2.93Å; G98-S114 VanDerWaalsContact CA-OG 3.3Å; G98-S114 WeakPolarHBondContact CA-OG 3.01Å; G98-S114 PolarHBondContact N-OG 3.28Å
99	L	88.5	Confident	85	Confident	57 Å²	57	66 Å²	66	30%	0.298	31%	0.31	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102	110.3	169.5	-175.8	72.6	0	0	0	108.9	T110 P131 K132 K133	L99-T110 HydrophobicContact CD1-CG2 3.47Å; L99-T110 VanDerWaalsContact CD1-CG2 3.47Å; L99-P131 CarbonylContact O-C 3.58Å; L99-K132 PolarHBondContact O-N 3.26Å; L99-K133 HydrophobicContact CB-CB 4.24Å; L99-K133 PolarHBondContact N-O 3.4Å; L99-K133 PolarHBondContact O-N 3.3Å
100	F	91.2	Very high	85.8	Confident	1 Å²	1	67.2 Å²	67.2	0%	0.004	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	149.2	-173.2	-64	-103.1	0	0	0	111.7	G98 R108 W109 S114 E120 T129 P131	G98-F100 WeakPolarHBondContact O-CD2 3.4Å; G98-F100 WeakPolarHBondContact O-CE2 3.43Å; F100-R108 VanDerWaalsContact O-CA 3.31Å; F100-R108 WeakPolarHBondContact O-CA 3.42Å; F100-W109 HydrophobicContact CB-CD2 3.54Å; F100-W109 HydrophobicContact CB-CE3 3.91Å; F100-W109 HydrophobicContact CB-CG 4.13Å; F100-W109 HydrophobicContact CB-CH2 3.81Å; F100-W109 HydrophobicContact CB-CZ2 3.41Å; F100-W109 VanDerWaalsContact CB-CZ2 3.41Å; F100-W109 HydrophobicContact CB-CZ3 4.03Å; F100-W109 AromaticContact CD1-CZ2 3.88Å; F100-W109 HydrophobicContact CD1-CZ2 3.88Å; F100-W109 AromaticContact CD2-CD1 3.98Å; F100-W109 AromaticContact CD2-NE1 3.59Å; F100-W109 HydrophobicContact CG-CD2 4.31Å; F100-W109 AromaticContact CG-CE2 3.6Å; F100-W109 AromaticContact CG-CZ2 3.76Å; F100-W109 HydrophobicContact CG-CZ2 3.76Å; F100-W109 AromaticContact CG-NE1 3.56Å; F100-W109 PolarHBondContact N-O 3.34Å; F100-W109 PolarHBondContact O-N 3.12Å; F100-S114 VanDerWaalsContact CE2-OG 3.24Å; F100-S114 WeakPolarHBondContact CE2-OG 3.2Å; F100-S114 WeakPolarHBondContact CZ-OG 3.46Å; F100-E120 HydrophobicContact CD1-CB 4.3Å; F100-E120 HydrophobicContact CE1-CB 3.77Å; F100-E120 HydrophobicContact CE1-CG 3.93Å; F100-E120 HydrophobicContact CE2-CG 4.41Å; F100-E120 HydrophobicContact CZ-CB 4Å; F100-E120 HydrophobicContact CZ-CG 3.67Å; F100-T129 HydrophobicContact CB-CG2 4.3Å; F100-T129 HydrophobicContact CD1-CG2 4.21Å; F100-T129 VanDerWaalsContact CD1-O 3.25Å; F100-T129 WeakPolarHBondContact CD1-O 3.42Å; F100-T129 VanDerWaalsContact CE1-O 3.22Å; F100-T129 WeakPolarHBondContact CE1-O 3.25Å; F100-P131 HydrophobicContact CD1-CB 4.47Å; F100-P131 HydrophobicContact CD1-CG 4.23Å; F100-P131 HydrophobicContact CE1-CB 4.25Å; F100-P131 VanDerWaalsContact CE1-CD 3.43Å; F100-P131 HydrophobicContact CE1-CG 3.56Å; F100-P131 HydrophobicContact CE2-CB 4.41Å; F100-P131 HydrophobicContact CE2-CG 4.09Å; F100-P131 HydrophobicContact CZ-CB 4.24Å; F100-P131 HydrophobicContact CZ-CG 3.49Å; F100-P131 VanDerWaalsContact CZ-CG 3.49Å
101	V	90.5	Very high	86.3	Confident	41 Å²	41	66.8 Å²	66.8	25%	0.248	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	115.9	171.7	-175.6	0	0	0	0	108.3	R107 R108 T129 K132	V101-R107 CarbonylContact C-O 3.47Å; V101-R107 WeakPolarHBondContact CA-O 3.41Å; V101-R108 HydrophobicContact CG1-CG 4.45Å; V101-R108 HydrophobicContact CG2-CG 4.18Å; V101-T129 WeakPolarHBondContact O-CG2 3.38Å; V101-K132 HydrophobicContact CG2-CD 4.25Å
102	C	93.7	Very high	86.9	Confident	0 Å²	0	68.4 Å²	68.4	0%	0	33%	0.328	C	S	.	.			trans	-62.8	128.1	-179.8	177.5	0	0	0	0	110.3	K104 C105 K106 R107 W109 C122	C102-K104 VanDerWaalsContact C-N 3.28Å; C102-K104 PolarHBondContact O-N 2.89Å; C102-K104 PolarHBondContact SG-N 3.23Å; C102-K104 VanDerWaalsContact SG-N 3.43Å; C102-C105 VanDerWaalsContact CB-SG 3.6Å; C102-C105 PolarHBondContact SG-N 2.87Å; C102-C105 VanDerWaalsContact SG-N 3.42Å; C102-C105 PolarHBondContact SG-SG 3.5Å; C102-K106 WeakPolarHBondContact O-CA 3.26Å; C102-K106 PolarHBondContact O-N 2.97Å; C102-R107 HydrophobicContact CB-CB 4.49Å; C102-R107 PolarHBondContact N-O 3.2Å; C102-W109 HydrophobicContact CB-CH2 4.27Å; C102-W109 HydrophobicContact CB-CZ3 3.87Å; C102-C122 HydrophobicContact CB-CB 4.13Å; C102-C122 VanDerWaalsContact SG-SG 3.64Å
103	P	90.6	Very high	87.4	Confident	78 Å²	78	71.7 Å²	71.7	51%	0.506	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.7	-29.6	179.4	26	-33.5	0	0	0	112.5	K106	P103-K106 PolarHBondContact O-NZ 3.09Å
104	K	95.7	Very high	87.9	Confident	151 Å²	151	64.8 Å²	64.8	66%	0.657	31%	0.311	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.6	-64	-179	-64.5	-173.1	179.2	-175.4	0	112.5	C102 C125 C127	C102-K104 VanDerWaalsContact C-N 3.28Å; C102-K104 PolarHBondContact O-N 2.89Å; C102-K104 PolarHBondContact SG-N 3.23Å; C102-K104 VanDerWaalsContact SG-N 3.43Å; K104-C125 HydrophobicContact CB-CB 4.36Å; K104-C125 HydrophobicContact CD-CB 4.22Å; K104-C127 HydrophobicContact CD-CB 4.34Å
105	C	95.8	Very high	88.3	Confident	47 Å²	47	63.9 Å²	63.9	32%	0.318	31%	0.306	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.9	0.3	-174.5	68.1	0	0	0	0	114.9	C102 R107 C122 C125	C102-C105 VanDerWaalsContact CB-SG 3.6Å; C102-C105 PolarHBondContact SG-N 2.87Å; C102-C105 VanDerWaalsContact SG-N 3.42Å; C102-C105 PolarHBondContact SG-SG 3.5Å; C105-R107 PolarHBondContact O-N 3.43Å; C105-R107 VanDerWaalsContact SG-CB 3.59Å; C105-C122 VanDerWaalsContact SG-SG 3.61Å; C105-C125 VanDerWaalsContact CB-SG 3.51Å
106	K	94.4	Very high	88.3	Confident	143 Å²	143	61.1 Å²	61.1	62%	0.622	30%	0.3	S	S	*	.			trans	60.6	6.7	-179.3	-47.9	-54.1	-174.2	-165.8	0	116	C102 P103	C102-K106 WeakPolarHBondContact O-CA 3.26Å; C102-K106 PolarHBondContact O-N 2.97Å; P103-K106 PolarHBondContact O-NZ 3.09Å
107	R	91.4	Very high	88.1	Confident	126 Å²	126	62.7 Å²	62.7	48%	0.475	32%	0.317	S	S	.	.			trans	-55.1	138.9	172.5	178.6	173.7	164.2	72.1	3.5	110.8	V101 C102 C105 W109 S123	V101-R107 CarbonylContact C-O 3.47Å; V101-R107 WeakPolarHBondContact CA-O 3.41Å; C102-R107 HydrophobicContact CB-CB 4.49Å; C102-R107 PolarHBondContact N-O 3.2Å; C105-R107 PolarHBondContact O-N 3.43Å; C105-R107 VanDerWaalsContact SG-CB 3.59Å; R107-W109 HydrophobicContact CG-CE3 4.36Å; R107-W109 WeakPolarHBondContact O-CZ3 3.11Å; R107-S123 PolarHBondContact NE-OG 3.28Å
108	R	92.2	Very high	88.2	Confident	179 Å²	179	67 Å²	67	68%	0.675	34%	0.338	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-110.6	141.5	178.8	-50.1	174.2	86.2	164.4	1.3	109.6	F100 V101	F100-R108 VanDerWaalsContact O-CA 3.31Å; F100-R108 WeakPolarHBondContact O-CA 3.42Å; V101-R108 HydrophobicContact CG1-CG 4.45Å; V101-R108 HydrophobicContact CG2-CG 4.18Å
109	W	92.2	Very high	88.3	Confident	39 Å²	39	69 Å²	69	15%	0.148	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-154	164.4	172.5	68.7	100.1	0	0	0	110.9	F100 C102 R107 E120 C122 T129	F100-W109 HydrophobicContact CB-CD2 3.54Å; F100-W109 HydrophobicContact CB-CE3 3.91Å; F100-W109 HydrophobicContact CB-CG 4.13Å; F100-W109 HydrophobicContact CB-CH2 3.81Å; F100-W109 HydrophobicContact CB-CZ2 3.41Å; F100-W109 VanDerWaalsContact CB-CZ2 3.41Å; F100-W109 HydrophobicContact CB-CZ3 4.03Å; F100-W109 AromaticContact CD1-CZ2 3.88Å; F100-W109 HydrophobicContact CD1-CZ2 3.88Å; F100-W109 AromaticContact CD2-CD1 3.98Å; F100-W109 AromaticContact CD2-NE1 3.59Å; F100-W109 HydrophobicContact CG-CD2 4.31Å; F100-W109 AromaticContact CG-CE2 3.6Å; F100-W109 AromaticContact CG-CZ2 3.76Å; F100-W109 HydrophobicContact CG-CZ2 3.76Å; F100-W109 AromaticContact CG-NE1 3.56Å; F100-W109 PolarHBondContact N-O 3.34Å; F100-W109 PolarHBondContact O-N 3.12Å; C102-W109 HydrophobicContact CB-CH2 4.27Å; C102-W109 HydrophobicContact CB-CZ3 3.87Å; R107-W109 HydrophobicContact CG-CE3 4.36Å; R107-W109 WeakPolarHBondContact O-CZ3 3.11Å; W109-E120 HydrophobicContact CZ2-CB 4.42Å; W109-E120 PolarHBondContact NE1-OE2 3.29Å; W109-E120 VanDerWaalsContact NE1-OE2 3.09Å; W109-C122 HydrophobicContact CH2-CB 3.98Å; W109-C122 HydrophobicContact CZ3-CB 4.4Å; W109-T129 HydrophobicContact CH2-CG2 3.64Å; W109-T129 HydrophobicContact CZ2-CG2 4.17Å; W109-T129 HydrophobicContact CZ3-CG2 4.45Å
110	T	88.9	Confident	88.5	Confident	99 Å²	99	68.7 Å²	68.7	61%	0.607	35%	0.349	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-117.9	142.8	174.3	48.7	0	0	0	0	110	G98 L99	G98-T110 CarbonylContact O-C 3.59Å; G98-T110 VanDerWaalsContact O-CA 3.27Å; G98-T110 WeakPolarHBondContact O-CA 3.49Å; L99-T110 HydrophobicContact CD1-CG2 3.47Å; L99-T110 VanDerWaalsContact CD1-CG2 3.47Å
111	S	85	Confident	88.7	Confident	20 Å²	20	75.4 Å²	75.4	14%	0.14	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131	135.8	171.7	167.3	0	0	0	0	110.5	I97 G98 N113 E120	I97-S111 CarbonylContact C-O 3.37Å; I97-S111 WeakPolarHBondContact CA-O 3.33Å; G98-S111 PolarHBondContact N-O 3.11Å; G98-S111 PolarHBondContact O-N 2.93Å; S111-N113 PolarHBondContact O-N 3.17Å; S111-N113 PolarHBondContact OG-N 3.03Å; S111-E120 VanDerWaalsContact CB-CD 3.46Å; S111-E120 WeakPolarHBondContact CB-OE1 3.46Å; S111-E120 VanDerWaalsContact CB-OE2 3.26Å; S111-E120 WeakPolarHBondContact CB-OE2 3.03Å; S111-E120 PolarHBondContact OG-OE1 3.37Å
112	N	84.9	Confident	88.8	Confident	83 Å²	83	73.5 Å²	73.5	44%	0.444	37%	0.366	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	5.4	178.3	-156.1	24.6	0	0	0	113.1	I97 I137	I97-N112 VanDerWaalsContact CD1-OD1 3.25Å; I97-N112 WeakPolarHBondContact CD1-OD1 3.43Å; I97-N112 HydrophobicContact CG1-CB 4.31Å; I97-N112 WeakPolarHBondContact CG1-OD1 3.29Å; N112-I137 WeakPolarHBondContact O-CD1 3.35Å; N112-I137 WeakPolarHBondContact OD1-CD1 3.34Å
113	N	81.2	Confident	88.9	Confident	81 Å²	81	77.2 Å²	77.2	43%	0.433	39%	0.393	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	39	-174.9	-163.6	50.9	0	0	0	112.1	K95 S111	K95-N113 WeakPolarHBondContact CE-OD1 3.29Å; K95-N113 PolarHBondContact NZ-OD1 2.65Å; S111-N113 PolarHBondContact O-N 3.17Å; S111-N113 PolarHBondContact OG-N 3.03Å
114	S	81.4	Confident	89	Confident	4 Å²	4	79 Å²	79	3%	0.028	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	128.8	177.7	-58	0	0	0	0	111	S96 G98 F100	S96-S114 PolarHBondContact N-O 2.86Å; S96-S114 WeakPolarHBondContact O-CA 3.27Å; S96-S114 WeakPolarHBondContact O-CB 3.3Å; S96-S114 PolarHBondContact O-N 2.93Å; S96-S114 PolarHBondContact OG-O 3.16Å; G98-S114 VanDerWaalsContact CA-OG 3.3Å; G98-S114 WeakPolarHBondContact CA-OG 3.01Å; G98-S114 PolarHBondContact N-OG 3.28Å; F100-S114 VanDerWaalsContact CE2-OG 3.24Å; F100-S114 WeakPolarHBondContact CE2-OG 3.2Å; F100-S114 WeakPolarHBondContact CZ-OG 3.46Å
115	Y	82.1	Confident	88.9	Confident	77 Å²	77	73.7 Å²	73.7	30%	0.302	38%	0.379	S	S	.	.			trans	-110.4	164.1	174.1	-68.2	-89.2	0	0	0	111.3	K95 G117 M118 Q134	K95-Y115 VanDerWaalsContact CE-CZ 3.47Å; K95-Y115 WeakPolarHBondContact CE-OH 3.08Å; K95-Y115 HydrophobicContact CG-CD1 4.32Å; K95-Y115 HydrophobicContact CG-CE1 3.55Å; K95-Y115 HydrophobicContact CG-CE2 4.17Å; Y115-G117 PolarHBondContact O-N 3.22Å; Y115-M118 HydrophobicContact CD2-SD 3.86Å; Y115-M118 HydrophobicContact CG-SD 4.14Å; Y115-M118 PolarHBondContact O-N 3.43Å; Y115-Q134 PolarHBondContact O-NE2 2.72Å
116	A	78.9	Confident	88.9	Confident	34 Å²	34	77.6 Å²	77.6	28%	0.281	39%	0.392	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	133.8	171.6	0	0	0	0	0	110.4	T88 Y90 G92 M118	T88-A116 WeakPolarHBondContact OG1-CA 3.25Å; Y90-A116 HydrophobicContact CD1-CB 4.21Å; Y90-A116 VanDerWaalsContact O-CB 3.29Å; Y90-A116 WeakPolarHBondContact O-CB 3.33Å; G92-A116 WeakPolarHBondContact O-CB 3.47Å; A116-M118 VanDerWaalsContact C-N 3.26Å; A116-M118 PolarHBondContact O-N 3.3Å
117	G	79.2	Confident	88.8	Confident	34 Å²	34	71.9 Å²	71.9	35%	0.351	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.9	-2	178.2	0	0	0	0	0	116	T88 Y115	T88-G117 PolarHBondContact OG1-N 3.01Å; Y115-G117 PolarHBondContact O-N 3.22Å
118	M	86.6	Confident	88.9	Confident	112 Å²	112	70.4 Å²	70.4	55%	0.552	37%	0.372	S	S	*	.			trans	-99.2	142.4	-177.8	-64.3	-169.8	-177.9	0	0	113.1	T88 Y115 A116 F130	T88-M118 WeakPolarHBondContact CG2-O 3.22Å; Y115-M118 HydrophobicContact CD2-SD 3.86Å; Y115-M118 HydrophobicContact CG-SD 4.14Å; Y115-M118 PolarHBondContact O-N 3.43Å; A116-M118 VanDerWaalsContact C-N 3.26Å; A116-M118 PolarHBondContact O-N 3.3Å; M118-F130 WeakPolarHBondContact O-CD1 3.05Å
119	S	90.8	Very high	88.8	Confident	42 Å²	42	62.1 Å²	62.1	29%	0.294	34%	0.341	S	S	.	.			trans	-105.3	159.4	172.1	52.7	0	0	0	0	111.8	T129	S119-T129 WeakPolarHBondContact CA-O 2.9Å; S119-T129 WeakPolarHBondContact CB-O 3.33Å
120	E	91.9	Very high	88.8	Confident	52 Å²	52	63.1 Å²	63.1	24%	0.243	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.5	148.1	167	-70.9	-171.2	174.6	0	0	110.7	F100 W109 S111 T129	F100-E120 HydrophobicContact CD1-CB 4.3Å; F100-E120 HydrophobicContact CE1-CB 3.77Å; F100-E120 HydrophobicContact CE1-CG 3.93Å; F100-E120 HydrophobicContact CE2-CG 4.41Å; F100-E120 HydrophobicContact CZ-CB 4Å; F100-E120 HydrophobicContact CZ-CG 3.67Å; W109-E120 HydrophobicContact CZ2-CB 4.42Å; W109-E120 PolarHBondContact NE1-OE2 3.29Å; W109-E120 VanDerWaalsContact NE1-OE2 3.09Å; S111-E120 VanDerWaalsContact CB-CD 3.46Å; S111-E120 WeakPolarHBondContact CB-OE1 3.46Å; S111-E120 VanDerWaalsContact CB-OE2 3.26Å; S111-E120 WeakPolarHBondContact CB-OE2 3.03Å; S111-E120 PolarHBondContact OG-OE1 3.37Å; E120-T129 PolarHBondContact N-O 2.73Å; E120-T129 PolarHBondContact O-N 2.59Å
121	K	94.5	Very high	88.7	Confident	142 Å²	142	58.7 Å²	58.7	62%	0.617	32%	0.319	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-77.1	130.4	177.5	-70	-164.5	176.4	-170.4	0	110.7	S123	K121-S123 PolarHBondContact O-N 3.33Å
122	C	94.2	Very high	88.7	Confident	0 Å²	0	65 Å²	65	0%	0	34%	0.344	C	S	.	.			trans	-61.4	129	168.6	-179.9	0	0	0	0	110	C102 C105 W109 N124 C125 H126 C127	C102-C122 HydrophobicContact CB-CB 4.13Å; C102-C122 VanDerWaalsContact SG-SG 3.64Å; C105-C122 VanDerWaalsContact SG-SG 3.61Å; W109-C122 HydrophobicContact CH2-CB 3.98Å; W109-C122 HydrophobicContact CZ3-CB 4.4Å; C122-N124 PolarHBondContact O-N 3.41Å; C122-N124 VanDerWaalsContact O-N 3.17Å; C122-C125 HydrophobicContact CB-CB 4.24Å; C122-H126 WeakPolarHBondContact O-CA 3Å; C122-H126 PolarHBondContact O-N 3.26Å; C122-C127 PolarHBondContact N-O 2.99Å; C122-C127 VanDerWaalsContact N-O 3.07Å
123	S	94.2	Very high	88.6	Confident	79 Å²	79	67.7 Å²	67.7	55%	0.552	35%	0.352	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.9	-20.6	-179.3	62.7	0	0	0	0	114.7	R107 K121	R107-S123 PolarHBondContact NE-OG 3.28Å; K121-S123 PolarHBondContact O-N 3.33Å
124	N	92.6	Very high	88.6	Confident	114 Å²	114	64.8 Å²	64.8	61%	0.61	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.1	-42.1	179.7	-167	23.3	0	0	0	112.3	C122	C122-N124 PolarHBondContact O-N 3.41Å; C122-N124 VanDerWaalsContact O-N 3.17Å
125	C	95.1	Very high	88.5	Confident	40 Å²	40	65.6 Å²	65.6	27%	0.27	34%	0.341	S	S	.	.	T	Hydrogen-bonded Turn	trans	-100.5	-12	-174.3	-59.6	0	0	0	0	114.4	K104 C105 C122 C127	K104-C125 HydrophobicContact CB-CB 4.36Å; K104-C125 HydrophobicContact CD-CB 4.22Å; C105-C125 VanDerWaalsContact CB-SG 3.51Å; C122-C125 HydrophobicContact CB-CB 4.24Å; C125-C127 PolarHBondContact O-N 2.79Å
126	H	95.1	Very high	88.1	Confident	129 Å²	129	63.2 Å²	63.2	60%	0.597	33%	0.334	S	S	*	.			trans	53.7	14.6	-174.3	-55.6	-64.6	0	0	0	116.3	C122	C122-H126 WeakPolarHBondContact O-CA 3Å; C122-H126 PolarHBondContact O-N 3.26Å
127	C	93.1	Very high	87.7	Confident	23 Å²	23	62.1 Å²	62.1	16%	0.155	32%	0.324	C	S	.	.			trans	-84.9	146.3	174.6	60.4	0	0	0	0	111.8	K104 C122 C125 T129	K104-C127 HydrophobicContact CD-CB 4.34Å; C122-C127 PolarHBondContact N-O 2.99Å; C122-C127 VanDerWaalsContact N-O 3.07Å; C125-C127 PolarHBondContact O-N 2.79Å; C127-T129 PolarHBondContact O-N 2.78Å; C127-T129 PolarHBondContact O-OG1 3.17Å
128	D	93.5	Very high	86.9	Confident	95 Å²	95	65.3 Å²	65.3	51%	0.508	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64	124.1	174.4	-67.3	-48.9	0	0	0	110.8
129	T	89.7	Confident	85.3	Confident	5 Å²	5	66.1 Å²	66.1	3%	0.031	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.5	127	179.6	-55	0	0	0	0	108.6	F100 V101 W109 S119 E120 C127	F100-T129 HydrophobicContact CB-CG2 4.3Å; F100-T129 HydrophobicContact CD1-CG2 4.21Å; F100-T129 VanDerWaalsContact CD1-O 3.25Å; F100-T129 WeakPolarHBondContact CD1-O 3.42Å; F100-T129 VanDerWaalsContact CE1-O 3.22Å; F100-T129 WeakPolarHBondContact CE1-O 3.25Å; V101-T129 WeakPolarHBondContact O-CG2 3.38Å; W109-T129 HydrophobicContact CH2-CG2 3.64Å; W109-T129 HydrophobicContact CZ2-CG2 4.17Å; W109-T129 HydrophobicContact CZ3-CG2 4.45Å; S119-T129 WeakPolarHBondContact CA-O 2.9Å; S119-T129 WeakPolarHBondContact CB-O 3.33Å; E120-T129 PolarHBondContact N-O 2.73Å; E120-T129 PolarHBondContact O-N 2.59Å; C127-T129 PolarHBondContact O-N 2.78Å; C127-T129 PolarHBondContact O-OG1 3.17Å
130	F	91.4	Very high	83.3	Confident	61 Å²	61	67 Å²	67	27%	0.268	34%	0.336	S	S	.	.			trans	-87.2	150.5	173	-67.4	-80.5	0	0	0	110.6	K87 T88 M118 K132	K87-F130 HydrophobicContact CB-CD1 3.76Å; K87-F130 HydrophobicContact CB-CD2 3.96Å; K87-F130 HydrophobicContact CB-CE1 3.67Å; K87-F130 HydrophobicContact CB-CE2 3.91Å; K87-F130 HydrophobicContact CB-CG 3.9Å; K87-F130 HydrophobicContact CB-CZ 3.77Å; K87-F130 HydrophobicContact CD-CD2 4.27Å; K87-F130 HydrophobicContact CD-CE1 4.15Å; K87-F130 HydrophobicContact CD-CE2 3.48Å; K87-F130 VanDerWaalsContact CD-CE2 3.48Å; K87-F130 HydrophobicContact CD-CZ 3.4Å; K87-F130 VanDerWaalsContact CD-CZ 3.4Å; K87-F130 HydrophobicContact CG-CE1 4.46Å; K87-F130 HydrophobicContact CG-CE2 4.33Å; K87-F130 HydrophobicContact CG-CZ 4.17Å; T88-F130 HydrophobicContact CG2-CB 4.5Å; T88-F130 HydrophobicContact CG2-CD1 3.64Å; T88-F130 HydrophobicContact CG2-CE1 4.42Å; M118-F130 WeakPolarHBondContact O-CD1 3.05Å; F130-K132 PolarHBondContact O-N 3.46Å
131	P	87.3	Confident	80.9	Confident	5 Å²	5	72 Å²	72	3%	0.032	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.6	135.5	174	-16.1	25.8	0	0	0	111.2	T88 P89 L99 F100 Q134	T88-P131 HydrophobicContact CG2-CG 4.35Å; P89-P131 WeakPolarHBondContact CD-O 3.2Å; P89-P131 WeakPolarHBondContact CG-O 3.04Å; L99-P131 CarbonylContact O-C 3.58Å; F100-P131 HydrophobicContact CD1-CB 4.47Å; F100-P131 HydrophobicContact CD1-CG 4.23Å; F100-P131 HydrophobicContact CE1-CB 4.25Å; F100-P131 VanDerWaalsContact CE1-CD 3.43Å; F100-P131 HydrophobicContact CE1-CG 3.56Å; F100-P131 HydrophobicContact CE2-CB 4.41Å; F100-P131 HydrophobicContact CE2-CG 4.09Å; F100-P131 HydrophobicContact CZ-CB 4.24Å; F100-P131 HydrophobicContact CZ-CG 3.49Å; F100-P131 VanDerWaalsContact CZ-CG 3.49Å; P131-Q134 HydrophobicContact CB-CG 3.57Å; P131-Q134 HydrophobicContact CG-CG 3.83Å
132	K	84.7	Confident	78.3	Confident	152 Å²	152	68.9 Å²	68.9	66%	0.661	38%	0.378	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.4	-31.6	170.5	-169.2	176.1	-176.4	178.5	0	111.8	L99 V101 F130	L99-K132 PolarHBondContact O-N 3.26Å; V101-K132 HydrophobicContact CG2-CD 4.25Å; F130-K132 PolarHBondContact O-N 3.46Å
133	K	82	Confident	75.8	Confident	141 Å²	141	72.2 Å²	72.2	61%	0.613	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.3	148.8	172.3	-66.2	-174.6	176.9	-174.9	0	108.7	L99	L99-K133 HydrophobicContact CB-CB 4.24Å; L99-K133 PolarHBondContact N-O 3.4Å; L99-K133 PolarHBondContact O-N 3.3Å
134	Q	81.1	Confident	73.4	Confident	19 Å²	19	77.8 Å²	77.8	9%	0.089	42%	0.416	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	138.7	174.2	-86.2	165.7	-63.6	0	0	109.6	Y90 S96 I97 Y115 P131	Y90-Q134 VanDerWaalsContact CB-CB 3.43Å; Y90-Q134 VanDerWaalsContact CB-OE1 3.3Å; Y90-Q134 HydrophobicContact CG-CB 4.34Å; S96-Q134 WeakPolarHBondContact OG-CG 3.5Å; S96-Q134 PolarHBondContact OG-NE2 3.45Å; S96-Q134 VanDerWaalsContact OG-NE2 3.11Å; I97-Q134 CarbonylContact O-C 3.59Å; I97-Q134 VanDerWaalsContact O-CA 3.31Å; I97-Q134 WeakPolarHBondContact O-CA 3.17Å; Y115-Q134 PolarHBondContact O-NE2 2.72Å; P131-Q134 HydrophobicContact CB-CG 3.57Å; P131-Q134 HydrophobicContact CG-CG 3.83Å
135	V	80.2	Confident	70.9	Confident	22 Å²	22	78.7 Å²	78.7	13%	0.133	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	122.3	-179.4	167.2	0	0	0	0	108.3	S96 I97 I137 L148 H149	S96-V135 CarbonylContact C-O 3.58Å; S96-V135 WeakPolarHBondContact CA-O 3.38Å; S96-V135 WeakPolarHBondContact CB-O 3.09Å; I97-V135 PolarHBondContact N-O 3.45Å; I97-V135 PolarHBondContact O-N 2.88Å; V135-I137 PolarHBondContact O-N 2.73Å; V135-L148 HydrophobicContact CB-CD2 3.96Å; V135-L148 HydrophobicContact CG1-CD2 3.63Å; V135-L148 HydrophobicContact CG2-CD2 4.41Å; V135-H149 WeakPolarHBondContact CG1-O 2.82Å
136	V	74.4	Confident	68.4	Low	27 Å²	27	78.8 Å²	78.8	16%	0.164	42%	0.42	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.5	134.9	177.8	-172.4	0	0	0	0	109.5	Y90 K94 H138	Y90-V136 HydrophobicContact CD2-CG2 3.8Å; Y90-V136 HydrophobicContact CE2-CG2 3.27Å; K94-V136 HydrophobicContact CB-CG1 4.16Å; K94-V136 HydrophobicContact CD-CG1 4.26Å; V136-H138 PolarHBondContact O-N 3.17Å
137	I	70.2	Confident	66	Low	11 Å²	11	75.5 Å²	75.5	6%	0.056	41%	0.408	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	113.8	173.7	-58	159.7	0	0	0	107.6	K95 I97 N112 V135 F139 P146	K95-I137 HydrophobicContact CB-CD1 4.01Å; K95-I137 PolarHBondContact O-N 3.45Å; I97-I137 HydrophobicContact CD1-CG1 4.05Å; I97-I137 HydrophobicContact CG1-CD1 4.06Å; I97-I137 HydrophobicContact CG1-CG1 3.83Å; N112-I137 WeakPolarHBondContact O-CD1 3.35Å; N112-I137 WeakPolarHBondContact OD1-CD1 3.34Å; V135-I137 PolarHBondContact O-N 2.73Å; I137-F139 HydrophobicContact CB-CE2 4.42Å; I137-F139 HydrophobicContact CG2-CD2 3.96Å; I137-F139 HydrophobicContact CG2-CE1 4.2Å; I137-F139 HydrophobicContact CG2-CE2 3.53Å; I137-F139 HydrophobicContact CG2-CG 4.47Å; I137-F139 HydrophobicContact CG2-CZ 3.67Å; I137-P146 HydrophobicContact CG2-CB 3.42Å; I137-P146 VanDerWaalsContact CG2-CB 3.42Å
138	H	62.9	Low	63.7	Low	100 Å²	100	79.4 Å²	79.4	46%	0.463	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	120.2	165.5	-104.9	-97	0	0	0	108.6	V136 V147	V136-H138 PolarHBondContact O-N 3.17Å; H138-V147 PolarHBondContact O-N 2.95Å
139	F	51.3	Low	61.3	Low	129 Å²	129	79.9 Å²	79.9	57%	0.566	43%	0.426	S	S	*	.			trans	-88.9	108.9	167	-67.1	-81.4	0	0	0	107.5	I137 P146	I137-F139 HydrophobicContact CB-CE2 4.42Å; I137-F139 HydrophobicContact CG2-CD2 3.96Å; I137-F139 HydrophobicContact CG2-CE1 4.2Å; I137-F139 HydrophobicContact CG2-CE2 3.53Å; I137-F139 HydrophobicContact CG2-CG 4.47Å; I137-F139 HydrophobicContact CG2-CZ 3.67Å; F139-P146 HydrophobicContact CE1-CB 4.42Å
140	S	49.5	Very low	58.9	Low	60 Å²	60	83.2 Å²	83.2	42%	0.42	45%	0.45	S	S	.	.			trans	-67.8	127.8	161.5	34.6	0	0	0	0	108.2	G142 T143	S140-G142 PolarHBondContact O-N 3.34Å; S140-G142 VanDerWaalsContact O-N 3.08Å; S140-T143 PolarHBondContact O-N 3.2Å; S140-T143 PolarHBondContact OG-OG1 2.54Å
141	V	41.2	Very low	56.5	Low	157 Å²	157	86 Å²	86	95%	0.952	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56	117	173.8	-173	0	0	0	0	107.8
142	G	40.9	Very low	53.8	Low	78 Å²	78	92.5 Å²	92.5	80%	0.804	49%	0.493	S	S	*	.	T	Hydrogen-bonded Turn	trans	112.1	-8.1	177.4	0	0	0	0	0	116.5	S140	S140-G142 PolarHBondContact O-N 3.34Å; S140-G142 VanDerWaalsContact O-N 3.08Å
143	T	41	Very low	51.4	Low	70 Å²	70	91.4 Å²	91.4	43%	0.429	50%	0.502	S	S	.	.			trans	-124.8	118.2	172.5	53.9	0	0	0	0	110.1	S140 L145	S140-T143 PolarHBondContact O-N 3.2Å; S140-T143 PolarHBondContact OG-OG1 2.54Å; T143-L145 PolarHBondContact O-N 3.21Å
144	H	43.4	Very low	49.1	Very low	196 Å²	196	89.6 Å²	89.6	91%	0.907	50%	0.503	S	S	*	.	S	Bend	trans	-64.7	6.6	174.8	-85	-88.3	0	0	0	114.2
145	L	40.6	Very low	46.8	Very low	133 Å²	133	98.1 Å²	98.1	70%	0.696	54%	0.54	S	S	*	.	S	Bend	trans	-104	126.8	-178.2	-83.1	135.3	0	0	0	111.1	T143 V147	T143-L145 PolarHBondContact O-N 3.21Å; L145-V147 PolarHBondContact O-N 3.37Å
146	P	42.3	Very low	44.6	Very low	42 Å²	42	101.4 Å²	101.4	27%	0.273	56%	0.563	S	S	.	*			trans	-67.4	121.6	173.3	27.2	-32	0	0	0	109.8	I137 F139 L148	I137-P146 HydrophobicContact CG2-CB 3.42Å; I137-P146 VanDerWaalsContact CG2-CB 3.42Å; F139-P146 HydrophobicContact CE1-CB 4.42Å; P146-L148 PolarHBondContact O-N 3.19Å
147	V	45.3	Very low	42.5	Very low	59 Å²	59	103.7 Å²	103.7	36%	0.358	58%	0.579	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-80.6	114	173	-173.7	0	0	0	0	108.4	H138 L145 H149	H138-V147 PolarHBondContact O-N 2.95Å; L145-V147 PolarHBondContact O-N 3.37Å; V147-H149 VanDerWaalsContact CG1-NE2 3.33Å; V147-H149 WeakPolarHBondContact CG1-NE2 3.09Å; V147-H149 PolarHBondContact O-N 2.78Å
148	L	44.4	Very low	40.9	Very low	105 Å²	105	108.3 Å²	108.3	55%	0.55	61%	0.609	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-73.3	95.9	174.2	-93.7	165.8	0	0	0	109.5	I97 V135 P146 S150	I97-L148 HydrophobicContact CB-CD2 3.84Å; I97-L148 HydrophobicContact CD1-CD1 4.13Å; I97-L148 HydrophobicContact CD1-CD2 3.23Å; I97-L148 HydrophobicContact CD1-CG 3.47Å; I97-L148 VanDerWaalsContact CD1-CG 3.47Å; I97-L148 HydrophobicContact CG1-CD2 4.07Å; I97-L148 HydrophobicContact CG2-CD2 3.98Å; V135-L148 HydrophobicContact CB-CD2 3.96Å; V135-L148 HydrophobicContact CG1-CD2 3.63Å; V135-L148 HydrophobicContact CG2-CD2 4.41Å; P146-L148 PolarHBondContact O-N 3.19Å; L148-S150 PolarHBondContact O-N 2.95Å
149	H	44	Very low	39.8	Very low	105 Å²	105	108 Å²	108	49%	0.486	62%	0.624	S	S	.	*			trans	-88.9	88.2	166.8	-73.2	-86.1	0	0	0	109.9	V135 V147 H151	V135-H149 WeakPolarHBondContact CG1-O 2.82Å; V147-H149 VanDerWaalsContact CG1-NE2 3.33Å; V147-H149 WeakPolarHBondContact CG1-NE2 3.09Å; V147-H149 PolarHBondContact O-N 2.78Å; H149-H151 PolarHBondContact O-N 2.72Å
150	S	39.2	Very low	39.2	Very low	76 Å²	76	113 Å²	113	53%	0.531	64%	0.639	S	S	.	*			trans	-52.4	128.1	154.5	39.6	0	0	0	0	107	L148 E152	L148-S150 PolarHBondContact O-N 2.95Å; S150-E152 PolarHBondContact O-N 2.94Å
151	H	39.9	Very low	38.8	Very low	120 Å²	120	113.7 Å²	113.7	56%	0.556	64%	0.638	S	S	*	*			trans	-61.6	77.4	166.8	-78.8	-96.7	0	0	0	108.3	H66 H149	H66-H151 AromaticContact CD2-CE1 3.55Å; H66-H151 AromaticContact CD2-ND1 3.84Å; H66-H151 AromaticContact CG-CE1 3.61Å; H66-H151 AromaticContact ND1-CE1 3.95Å; H66-H151 AromaticContact NE2-CE1 3.86Å; H66-H151 AromaticContact NE2-ND1 3.72Å; H149-H151 PolarHBondContact O-N 2.72Å
152	E	31.7	Very low	38.8	Very low	140 Å²	140	110.2 Å²	110.2	65%	0.654	62%	0.62	S	S	*	*			trans	-76	144.7	141.7	-105.3	-174.4	102.8	0	0	106.6	S150 T154	S150-E152 PolarHBondContact O-N 2.94Å; E152-T154 PolarHBondContact O-N 2.91Å; E152-T154 PolarHBondContact O-OG1 3.42Å
153	P	34.6	Very low	38.8	Very low	129 Å²	129	112.6 Å²	112.6	84%	0.838	61%	0.614	S	S	*	*			trans	-72	67.8	176.6	32.2	-33.2	0	0	0	109.4	F155	P153-F155 VanDerWaalsContact C-N 3.34Å; P153-F155 PolarHBondContact O-N 2.79Å; P153-F155 VanDerWaalsContact O-N 3.13Å
154	T	33.7	Very low	38.7	Very low	104 Å²	104	116.5 Å²	116.5	64%	0.638	63%	0.625	S	S	*	*			trans	-81.9	90.6	166.8	15.6	0	0	0	0	107.7	E152 C156	E152-T154 PolarHBondContact O-N 2.91Å; E152-T154 PolarHBondContact O-OG1 3.42Å; T154-C156 PolarHBondContact O-N 3.35Å; T154-C156 VanDerWaalsContact O-N 3.12Å
155	F	32	Very low	38.4	Very low	197 Å²	197	114.3 Å²	114.3	86%	0.864	61%	0.613	S	S	*	*			trans	9.9	94	139.9	-126.3	-97.4	0	0	0	113.8	P153	P153-F155 VanDerWaalsContact C-N 3.34Å; P153-F155 PolarHBondContact O-N 2.79Å; P153-F155 VanDerWaalsContact O-N 3.13Å
156	C	34.5	Very low	38.5	Very low	92 Å²	92	113.6 Å²	113.6	62%	0.622	61%	0.609	S	S	*	*			trans	-106.2	105.8	160.9	-148.5	0	0	0	0	106.3	T154	T154-C156 PolarHBondContact O-N 3.35Å; T154-C156 VanDerWaalsContact O-N 3.12Å
157	P	30.8	Very low	38.3	Very low	75 Å²	75	119.3 Å²	119.3	49%	0.487	63%	0.63	S	S	.	*			trans	-65.9	154.4	-177.9	28.1	-31.5	0	0	0	109.9
158	P	36.6	Very low	38.1	Very low	108 Å²	108	121.4 Å²	121.4	70%	0.701	64%	0.638	S	S	*	*			trans	-61.6	142.9	-169.5	25.6	-33.8	0	0	0	111.2	R160	P158-R160 PolarHBondContact O-N 3.36Å
159	A	39.4	Very low	37.8	Very low	94 Å²	94	119.3 Å²	119.3	78%	0.777	63%	0.632	S	S	*	*	S	Bend	trans	-65.2	59.7	178.8	0	0	0	0	0	113.8	L161	A159-L161 VanDerWaalsContact C-N 3.27Å
160	R	39.2	Very low	37.5	Very low	232 Å²	232	119.9 Å²	119.9	88%	0.875	64%	0.635	S	S	*	*			trans	-95.7	31.3	151.4	-66	-167.5	-165.5	-168.8	4.9	110.9	P158	P158-R160 PolarHBondContact O-N 3.36Å
161	L	40.1	Very low	37.5	Very low	75 Å²	75	123.6 Å²	123.6	39%	0.393	64%	0.642	S	S	.	*			trans	-129.1	13.1	-176.5	-73.7	173	0	0	0	113.8	A159 D163 K164	A159-L161 VanDerWaalsContact C-N 3.27Å; L161-D163 PolarHBondContact O-N 3.3Å; L161-K164 HydrophobicContact CD2-CB 4.08Å; L161-K164 HydrophobicContact CD2-CD 3.77Å; L161-K164 HydrophobicContact CD2-CG 4.28Å; L161-K164 PolarHBondContact O-N 3.33Å
162	C	40.5	Very low	37.6	Very low	85 Å²	85	123 Å²	123	57%	0.574	65%	0.646	S	S	*	*	H	α-helix	trans	-59.7	-31.7	167.8	41.6	0	0	0	0	112
163	D	40.7	Very low	38.1	Very low	128 Å²	128	124 Å²	124	68%	0.684	65%	0.651	S	S	*	*	H	α-helix	trans	-80.9	-16.1	-179.9	-67.3	-39	0	0	0	115.1	L161	L161-D163 PolarHBondContact O-N 3.3Å
164	K	39.3	Very low	38.3	Very low	151 Å²	151	127 Å²	127	66%	0.657	65%	0.646	S	S	*	*	H	α-helix	trans	-92.1	-24.8	178.6	-82	-174.2	179.9	176.2	0	113.6	L161	L161-K164 HydrophobicContact CD2-CB 4.08Å; L161-K164 HydrophobicContact CD2-CD 3.77Å; L161-K164 HydrophobicContact CD2-CG 4.28Å; L161-K164 PolarHBondContact O-N 3.33Å
165	F	36.8	Very low	38.5	Very low	151 Å²	151	128.5 Å²	128.5	66%	0.662	65%	0.645	S	S	*	*	H	α-helix	trans	-76.5	-27.9	176.1	-91.7	-85.4	0	0	0	113.4	K167 I168	F165-K167 VanDerWaalsContact C-N 3.26Å; F165-K167 PolarHBondContact O-N 3.08Å; F165-I168 PolarHBondContact O-N 2.98Å
166	L	43.2	Very low	38.9	Very low	117 Å²	117	124.1 Å²	124.1	61%	0.613	64%	0.637	S	S	*	*	H	α-helix	trans	-63.4	-27.9	174.5	-99.3	135.8	0	0	0	113.5	S169	L166-S169 PolarHBondContact O-OG 3.27Å
167	K	37.8	Very low	39.2	Very low	162 Å²	162	128 Å²	128	70%	0.704	65%	0.651	S	S	*	*	H	α-helix	trans	-81.6	-15.8	179	-74.8	-172.3	175.5	-177.7	0	114.7	F165	F165-K167 VanDerWaalsContact C-N 3.26Å; F165-K167 PolarHBondContact O-N 3.08Å
168	I	41.6	Very low	39.6	Very low	103 Å²	103	136.1 Å²	136.1	53%	0.528	67%	0.671	S	S	.	*	H	α-helix	trans	-86.9	-34.5	178.6	-59.5	172.2	0	0	0	110.4	F165 E170 F171 V172	F165-I168 PolarHBondContact O-N 2.98Å; I168-E170 PolarHBondContact O-N 3.31Å; I168-F171 PolarHBondContact O-N 3.42Å; I168-V172 PolarHBondContact O-N 3.32Å
169	S	39.1	Very low	39.7	Very low	61 Å²	61	136.1 Å²	136.1	43%	0.427	67%	0.674	S	S	.	*	H	α-helix	trans	-63.5	-28	174	45.2	0	0	0	0	113.3	L166 Q173	L166-S169 PolarHBondContact O-OG 3.27Å; S169-Q173 VanDerWaalsContact O-CG 3.31Å; S169-Q173 WeakPolarHBondContact O-CG 3.31Å
170	E	37	Very low	39.5	Very low	117 Å²	117	143.4 Å²	143.4	55%	0.547	70%	0.7	S	S	.	*	H	α-helix	trans	-80.7	-22.1	179.6	-123.2	179.1	165.7	0	0	113.8	I168	I168-E170 PolarHBondContact O-N 3.31Å
171	F	39.1	Very low	39.5	Very low	155 Å²	155	139 Å²	139	68%	0.68	69%	0.691	S	S	*	*	H	α-helix	trans	-86.3	-30.4	179.4	-165.5	-100.7	0	0	0	112.6	I168	I168-F171 PolarHBondContact O-N 3.42Å
172	V	42.3	Very low	39.5	Very low	106 Å²	106	142.3 Å²	142.3	64%	0.642	71%	0.707	S	S	*	*	H	α-helix	trans	-80.1	-23.6	178.2	179.8	0	0	0	0	112.3	I168 R174	I168-V172 PolarHBondContact O-N 3.32Å; V172-R174 VanDerWaalsContact C-N 3.28Å; V172-R174 PolarHBondContact O-N 3.38Å
173	Q	42.3	Very low	39.4	Very low	161 Å²	161	145.5 Å²	145.5	75%	0.752	71%	0.714	S	S	*	*	T	Hydrogen-bonded Turn	trans	-74.4	-11	175.8	-76	177.9	-10.6	0	0	114.5	S169	S169-Q173 VanDerWaalsContact O-CG 3.31Å; S169-Q173 WeakPolarHBondContact O-CG 3.31Å
174	R	39.2	Very low	39.4	Very low	193 Å²	193	146.5 Å²	146.5	73%	0.728	72%	0.716	S	S	*	*	T	Hydrogen-bonded Turn	trans	-96.9	1.1	-178.8	-70	-172.3	-176.8	166.6	4.6	115	V172 P176	V172-R174 VanDerWaalsContact C-N 3.28Å; V172-R174 PolarHBondContact O-N 3.38Å; R174-P176 VanDerWaalsContact O-CD 3.26Å; R174-P176 WeakPolarHBondContact O-CD 3.26Å
175	Q	36	Very low	39.4	Very low	136 Å²	136	146.3 Å²	146.3	64%	0.636	72%	0.719	S	S	*	*	S	Bend	trans	-93.2	107.6	174.4	-66.4	-70.1	-24.4	0	0	108.7	L177	Q175-L177 PolarHBondContact O-N 2.88Å
176	P	41.4	Very low	39.6	Very low	105 Å²	105	145.9 Å²	145.9	68%	0.682	72%	0.723	S	S	*	*			trans	-63.5	123.7	170.2	25.8	-30.5	0	0	0	108.2	R174 R178	R174-P176 VanDerWaalsContact O-CD 3.26Å; R174-P176 WeakPolarHBondContact O-CD 3.26Å; P176-R178 VanDerWaalsContact C-N 3.34Å; P176-R178 PolarHBondContact O-N 3.22Å
177	L	39.9	Very low	39.3	Very low	174 Å²	174	148 Å²	148	91%	0.911	73%	0.731	S	S	*	*			trans	-58	100	164.5	-66.9	170.4	0	0	0	107.2	Q175 S179	Q175-L177 PolarHBondContact O-N 2.88Å; L177-S179 PolarHBondContact O-N 3.06Å
178	R	40.3	Very low	39.4	Very low	244 Å²	244	146.9 Å²	146.9	92%	0.921	73%	0.733	S	S	*	*			trans	-66.4	103.9	163.7	-81.6	-172.5	178.1	-163	-0.1	107	P176	P176-R178 VanDerWaalsContact C-N 3.34Å; P176-R178 PolarHBondContact O-N 3.22Å
179	S	39.5	Very low	39.2	Very low	109 Å²	109	150.6 Å²	150.6	76%	0.762	75%	0.75	S	S	*	*			trans	-70.5	134.8	159.2	55.1	0	0	0	0	109.2	L177	L177-S179 PolarHBondContact O-N 3.06Å
180	N	34.6	Very low	39.2	Very low	246 Å²	246	158.7 Å²	158.7	100%	1.316	78%	0.78	S	S	*	*			trans	30.3	0	165.3	-93.4	-11.5	0	0	0	118.3

Retrieved 180 of 180 residues in 38.8 ms (Link to these results)

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