G4M060_SCHMA Loading...

Large ribosomal subunit protein uL22m

AlphaFold DB , UniProt , Accession G4M060, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 245 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	39.6	Very low	47.6	Very low	244 Å²	244	141.9 Å²	141.9	100%	1.202	73%	0.728	S	S	*	*				0	44.3	0	-78.2	-71.7	-174.1	0	0	112.5
2	L	41.7	Very low	47.8	Very low	175 Å²	175	139.8 Å²	139.8	92%	0.916	73%	0.726	S	S	*	*			trans	-159.3	133.3	167.9	-83.7	162.8	0	0	0	105.9
3	S	46.1	Very low	47.6	Very low	71 Å²	71	139.5 Å²	139.5	50%	0.497	73%	0.726	S	S	.	*			cis	-159.8	126.7	-31.4	172.9	0	0	0	0	102.7	V5	S3-V5 PolarHBondContact O-N 3.48Å; S3-V5 VanDerWaalsContact OG-CB 3.28Å; S3-V5 WeakPolarHBondContact OG-CB 3.44Å; S3-V5 WeakPolarHBondContact OG-CG2 3.42Å
4	V	54.2	Low	47.7	Very low	138 Å²	138	137.6 Å²	137.6	84%	0.836	73%	0.73	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.1	5.4	178	174.8	0	0	0	0	111.9	S6	V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.47Å
5	V	47.1	Very low	47.6	Very low	80 Å²	80	134.7 Å²	134.7	49%	0.485	73%	0.733	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.2	-10.4	-179	175.6	0	0	0	0	114	S3 T8 L9	S3-V5 PolarHBondContact O-N 3.48Å; S3-V5 VanDerWaalsContact OG-CB 3.28Å; S3-V5 WeakPolarHBondContact OG-CB 3.44Å; S3-V5 WeakPolarHBondContact OG-CG2 3.42Å; V5-T8 PolarHBondContact O-OG1 3.3Å; V5-L9 HydrophobicContact CG1-CD1 4.12Å
6	S	53.7	Low	46.9	Very low	89 Å²	89	129.6 Å²	129.6	62%	0.622	72%	0.722	S	S	*	*	H	α-helix	trans	-76	-25.3	-179.3	73.3	0	0	0	0	114.7	V4	V4-S6 VanDerWaalsContact C-N 3.3Å; V4-S6 PolarHBondContact O-N 3.47Å
7	K	51.2	Low	46.4	Very low	177 Å²	177	129.2 Å²	129.2	77%	0.77	72%	0.718	S	S	*	*	H	α-helix	trans	-87.7	-22.9	-175.4	-69.2	-175.4	179.9	-179.3	0	113.8
8	T	51.6	Low	46.1	Very low	91 Å²	91	127.7 Å²	127.7	56%	0.558	73%	0.725	S	S	*	*	H	α-helix	trans	-78.6	-34.3	176.2	48.4	0	0	0	0	112	V5 W10 K11 V12	V5-T8 PolarHBondContact O-OG1 3.3Å; T8-W10 VanDerWaalsContact C-N 3.34Å; T8-W10 PolarHBondContact O-N 2.81Å; T8-K11 PolarHBondContact O-N 2.78Å; T8-V12 WeakPolarHBondContact O-CG2 3.47Å; T8-V12 PolarHBondContact O-N 3.12Å
9	L	43.7	Very low	45.8	Very low	105 Å²	105	130.8 Å²	130.8	55%	0.55	73%	0.725	S	S	.	*	H	α-helix	trans	-64.4	-33.5	179	-89	159.6	0	0	0	113.6	V5	V5-L9 HydrophobicContact CG1-CD1 4.12Å
10	W	46.9	Very low	45.5	Very low	219 Å²	219	128.5 Å²	128.5	83%	0.83	72%	0.718	S	S	*	*	H	α-helix	trans	-79.8	-24.3	179.7	-114.7	20.5	0	0	0	114.4	T8	T8-W10 VanDerWaalsContact C-N 3.34Å; T8-W10 PolarHBondContact O-N 2.81Å
11	K	47.6	Very low	45.1	Very low	172 Å²	172	126.8 Å²	126.8	75%	0.748	72%	0.715	S	S	*	*	H	α-helix	trans	-81.7	-24.2	178.5	-149.3	167.5	-175.2	177.6	0	112.8	T8	T8-K11 PolarHBondContact O-N 2.78Å
12	V	50.5	Low	45	Very low	116 Å²	116	124 Å²	124	70%	0.703	70%	0.696	S	S	*	*	H	α-helix	trans	-76.9	-30.8	174.4	177	0	0	0	0	111.9	T8	T8-V12 WeakPolarHBondContact O-CG2 3.47Å; T8-V12 PolarHBondContact O-N 3.12Å
13	L	45.3	Very low	44.7	Very low	137 Å²	137	124.4 Å²	124.4	72%	0.717	69%	0.687	S	S	*	*	H	α-helix	trans	-83	-18.8	-179.7	-75.6	164.5	0	0	0	114.5
14	S	48.6	Very low	44	Very low	113 Å²	113	130.5 Å²	130.5	79%	0.79	71%	0.705	S	S	*	*	H	α-helix	trans	-91.5	-16.4	-178	-162.6	0	0	0	0	114.1
15	A	46.4	Very low	43.1	Very low	93 Å²	93	130.2 Å²	130.2	77%	0.769	70%	0.697	S	S	*	*	S	Bend	trans	-101.3	0.6	-171.3	0	0	0	0	0	115.4
16	G	36.2	Very low	42.6	Very low	54 Å²	54	130.6 Å²	130.6	56%	0.557	70%	0.703	S	S	*	*	S	Bend	trans	-131.4	117.2	-174.7	0	0	0	0	0	112.7
17	N	39	Very low	41.9	Very low	122 Å²	122	130.8 Å²	130.8	65%	0.652	70%	0.701	S	S	*	*			trans	66.1	70.3	178	-68.4	1.1	0	0	0	115.7	Y19	N17-Y19 HydrophobicContact CB-CD2 4.27Å; N17-Y19 HydrophobicContact CB-CE2 4.22Å; N17-Y19 PolarHBondContact O-N 2.99Å
18	A	41.1	Very low	41.4	Very low	102 Å²	102	127.2 Å²	127.2	84%	0.843	70%	0.698	S	S	*	*				-47.2	98.5	121	0	0	0	0	0	107	S20	A18-S20 PolarHBondContact O-N 3.36Å
19	Y	40.1	Very low	40.9	Very low	188 Å²	188	127 Å²	127	74%	0.737	69%	0.693	S	S	*	*			trans	-57.8	99.8	164.9	-76.2	-89	0	0	0	104.8	N17 S21	N17-Y19 HydrophobicContact CB-CD2 4.27Å; N17-Y19 HydrophobicContact CB-CE2 4.22Å; N17-Y19 PolarHBondContact O-N 2.99Å; Y19-S21 PolarHBondContact O-N 3.21Å
20	S	38.6	Very low	40.4	Very low	83 Å²	83	124.3 Å²	124.3	58%	0.58	69%	0.69	S	S	*	*			trans	-42.3	114.4	160.7	175.8	0	0	0	0	104.5	A18 K22	A18-S20 PolarHBondContact O-N 3.36Å; S20-K22 PolarHBondContact O-N 3.15Å
21	S	38.6	Very low	40	Very low	93 Å²	93	119.1 Å²	119.1	65%	0.65	68%	0.678	S	S	*	*			trans	-44.9	114.2	176.8	48.6	0	0	0	0	104.3	Y19 Y23	Y19-S21 PolarHBondContact O-N 3.21Å; S21-Y23 PolarHBondContact O-N 3.44Å
22	K	36.1	Very low	39.5	Very low	185 Å²	185	118.9 Å²	118.9	80%	0.804	68%	0.679	S	S	*	*			trans	-50.6	104.9	-177	-69.4	175.7	-178.2	177.3	0	103.9	S20 F24	S20-K22 PolarHBondContact O-N 3.15Å; K22-F24 PolarHBondContact O-N 2.89Å
23	Y	36	Very low	39	Very low	185 Å²	185	121.6 Å²	121.6	73%	0.725	68%	0.682	S	S	*	*			trans	-49.8	112.7	166	-76.1	-89.8	0	0	0	100.9	S21 I25	S21-Y23 PolarHBondContact O-N 3.44Å; Y23-I25 PolarHBondContact O-N 3.21Å
24	F	31.9	Very low	38.7	Very low	199 Å²	199	123.2 Å²	123.2	87%	0.873	68%	0.683	S	S	*	*			trans	-58.7	89.5	162.3	-128.3	-92.5	0	0	0	100.5	K22 S26	K22-F24 PolarHBondContact O-N 2.89Å; F24-S26 PolarHBondContact O-N 3.42Å
25	I	35.4	Very low	38.3	Very low	132 Å²	132	123 Å²	123	68%	0.677	68%	0.679	S	S	*	*			trans	-64	86.2	159	-56.5	174.1	0	0	0	98.7	Y23 T27	Y23-I25 PolarHBondContact O-N 3.21Å; I25-T27 HydrophobicContact CG2-CG2 3.75Å; I25-T27 PolarHBondContact O-N 2.88Å
26	S	35.5	Very low	37.9	Very low	88 Å²	88	124.1 Å²	124.1	62%	0.615	67%	0.668	S	S	*	*			trans	-51.8	94.5	145.4	63.4	0	0	0	0	100.6	F24 S28	F24-S26 PolarHBondContact O-N 3.42Å; S26-S28 PolarHBondContact O-N 3.01Å
27	T	40	Very low	38.1	Very low	93 Å²	93	128.1 Å²	128.1	57%	0.571	68%	0.676	S	S	*	*			trans	-61.8	83.8	153.9	54	0	0	0	0	101	I25 I29	I25-T27 HydrophobicContact CG2-CG2 3.75Å; I25-T27 PolarHBondContact O-N 2.88Å; T27-I29 PolarHBondContact O-N 2.84Å
28	S	40.3	Very low	38.3	Very low	102 Å²	102	126.7 Å²	126.7	71%	0.713	68%	0.676	S	S	*	*				-49.1	85.5	129.5	47.1	0	0	0	0	102	S26 G30	S26-S28 PolarHBondContact O-N 3.01Å; S28-G30 PolarHBondContact O-N 3.12Å
29	I	41.8	Very low	38.3	Very low	86 Å²	86	127.7 Å²	127.7	44%	0.441	67%	0.667	S	S	.	*			trans	-57.7	95.4	155.7	-66.2	162.5	0	0	0	98.2	T27 L31 L169	T27-I29 PolarHBondContact O-N 2.84Å; I29-L31 PolarHBondContact O-N 3.36Å; I29-L169 HydrophobicContact CD1-CD1 3.19Å; I29-L169 HydrophobicContact CD1-CG 3.98Å
30	G	32.8	Very low	38.4	Very low	48 Å²	48	126.6 Å²	126.6	50%	0.495	67%	0.668	S	S	.	*			trans	-48.3	101.2	156.9	0	0	0	0	0	100.7	S28 H32	S28-G30 PolarHBondContact O-N 3.12Å; G30-H32 PolarHBondContact O-N 3.22Å
31	L	37.9	Very low	38.9	Very low	110 Å²	110	131.1 Å²	131.1	58%	0.576	69%	0.686	S	S	*	*			trans	-53.6	87.5	144.9	-69.7	171.1	0	0	0	100.5	I29 K33 P167	I29-L31 PolarHBondContact O-N 3.36Å; L31-K33 PolarHBondContact O-N 3.34Å; L31-P167 HydrophobicContact CD2-CG 4Å
32	H	37.1	Very low	39.5	Very low	168 Å²	168	128.9 Å²	128.9	78%	0.778	68%	0.677	S	S	*	*			trans	-52.2	93.4	152.1	-91.9	-90.8	0	0	0	100.8	G30 K34	G30-H32 PolarHBondContact O-N 3.22Å; H32-K34 PolarHBondContact O-N 3.31Å
33	K	39.7	Very low	40.6	Very low	173 Å²	173	124.5 Å²	124.5	75%	0.752	68%	0.676	S	S	*	*			trans	-45.1	99.4	143.8	-164.8	-180	-173.6	-173	0	100.1	L31 P35	L31-K33 PolarHBondContact O-N 3.34Å; K33-P35 VanDerWaalsContact C-N 3.31Å; K33-P35 WeakPolarHBondContact O-CD 3.46Å
34	K	38.6	Very low	41.9	Very low	171 Å²	171	119.7 Å²	119.7	74%	0.743	67%	0.666	S	S	*	*			trans	-46.4	113.9	169.1	-91	-176.9	173.4	-178.6	0	101.7	H32 E36	H32-K34 PolarHBondContact O-N 3.31Å; K34-E36 PolarHBondContact O-N 3.33Å
35	P	41.2	Very low	44.1	Very low	109 Å²	109	114.8 Å²	114.8	71%	0.708	65%	0.648	S	S	*	*			trans	-52.8	125	173.1	24	-30.7	0	0	0	102.6	K33 L37	K33-P35 VanDerWaalsContact C-N 3.31Å; K33-P35 WeakPolarHBondContact O-CD 3.46Å; P35-L37 PolarHBondContact O-N 2.91Å
36	E	37.9	Very low	46.5	Very low	116 Å²	116	113.3 Å²	113.3	54%	0.542	64%	0.64	S	S	.	*			trans	-30.1	118.2	-168.8	-52.1	-161.7	168.6	0	0	108.5	K34 S38 K53	K34-E36 PolarHBondContact O-N 3.33Å; E36-S38 WeakPolarHBondContact O-CA 3.45Å; E36-S38 PolarHBondContact O-N 3.32Å; E36-K53 IonicContact OE2-NZ 2.71Å; E36-K53 PolarHBondContact OE2-NZ 3.44Å
37	L	41.1	Very low	49	Very low	137 Å²	137	109.2 Å²	109.2	72%	0.717	61%	0.611	S	S	*	*			trans	-53.2	95.5	176.2	-175.1	73.2	0	0	0	104.7	P35 N39	P35-L37 PolarHBondContact O-N 2.91Å; L37-N39 PolarHBondContact O-N 2.97Å
38	S	42	Very low	51.3	Low	92 Å²	92	113.6 Å²	113.6	64%	0.643	62%	0.622	S	S	*	*			trans	-68.4	111.6	-172.3	48.8	0	0	0	0	102.4	E36 H40	E36-S38 WeakPolarHBondContact O-CA 3.45Å; E36-S38 PolarHBondContact O-N 3.32Å; S38-H40 VanDerWaalsContact C-N 3.32Å; S38-H40 PolarHBondContact O-N 2.95Å
39	N	42.6	Very low	53.5	Low	123 Å²	123	114.7 Å²	114.7	66%	0.658	63%	0.625	S	S	*	*			trans	-48.8	109.9	171.4	-73.4	-28.9	0	0	0	105.9	L37 N41 G42	L37-N39 PolarHBondContact O-N 2.97Å; N39-N41 PolarHBondContact O-N 2.91Å; N39-G42 PolarHBondContact O-N 3.33Å
40	H	41.1	Very low	55.7	Low	165 Å²	165	113.8 Å²	113.8	76%	0.764	62%	0.623	S	S	*	*	T	Hydrogen-bonded Turn	trans	-46.6	117	-173.7	-68.4	-91.6	0	0	0	108.6	S38 G42	S38-H40 VanDerWaalsContact C-N 3.32Å; S38-H40 PolarHBondContact O-N 2.95Å; H40-G42 VanDerWaalsContact C-N 3.3Å; H40-G42 PolarHBondContact O-N 2.9Å; H40-G42 VanDerWaalsContact O-N 3.14Å
41	N	49.9	Very low	58.2	Low	178 Å²	178	114 Å²	114	95%	0.952	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	62.7	10.3	173.3	-55.8	-12.1	0	0	0	118.6	N39	N39-N41 PolarHBondContact O-N 2.91Å
42	G	51.2	Low	60.6	Low	46 Å²	46	115 Å²	115	47%	0.474	63%	0.627	S	S	.	*	P	Polyproline II helix	trans	-95.5	127	-177.8	0	0	0	0	0	112.9	N39 H40 T44	N39-G42 PolarHBondContact O-N 3.33Å; H40-G42 VanDerWaalsContact C-N 3.3Å; H40-G42 PolarHBondContact O-N 2.9Å; H40-G42 VanDerWaalsContact O-N 3.14Å; G42-T44 PolarHBondContact O-N 2.86Å
43	A	59.4	Low	62.9	Low	94 Å²	94	112.9 Å²	112.9	78%	0.777	62%	0.616	S	S	*	*	P	Polyproline II helix	trans	-46.3	126.3	170.1	0	0	0	0	0	110.6	I45	A43-I45 PolarHBondContact O-N 3.39Å
44	T	62.2	Low	65	Low	84 Å²	84	106.9 Å²	106.9	52%	0.515	59%	0.591	S	S	.	*	P	Polyproline II helix	trans	-67.6	117.8	172.5	-65.7	0	0	0	0	107.4	G42 I46 K53	G42-T44 PolarHBondContact O-N 2.86Å; T44-I46 PolarHBondContact O-N 3.34Å; T44-K53 HydrophobicContact CG2-CB 4.38Å; T44-K53 HydrophobicContact CG2-CD 3.62Å; T44-K53 HydrophobicContact CG2-CG 3.67Å
45	I	78.1	Confident	67.2	Low	95 Å²	95	101.2 Å²	101.2	49%	0.487	57%	0.569	S	S	.	*	P	Polyproline II helix	trans	-75.8	122.3	177.6	-52.9	-177	0	0	0	107.4	A43 L56 L59	A43-I45 PolarHBondContact O-N 3.39Å; I45-L56 HydrophobicContact CB-CD2 4.42Å; I45-L56 HydrophobicContact CD1-CD2 3.64Å; I45-L56 HydrophobicContact CG1-CD2 4.24Å; I45-L59 HydrophobicContact CB-CD1 3.7Å; I45-L59 HydrophobicContact CG2-CD1 3.53Å; I45-L59 HydrophobicContact CG2-CD2 4.07Å; I45-L59 HydrophobicContact CG2-CG 4.35Å
46	I	86.3	Confident	69.5	Low	101 Å²	101	100.5 Å²	100.5	52%	0.518	56%	0.558	S	S	.	*	P	Polyproline II helix	trans	-101.4	134.3	177.1	-58.7	173.5	0	0	0	106.4	T44 K48 G51	T44-I46 PolarHBondContact O-N 3.34Å; I46-K48 PolarHBondContact O-N 2.92Å; I46-G51 VanDerWaalsContact CG2-C 3.4Å; I46-G51 VanDerWaalsContact CG2-O 3.3Å; I46-G51 WeakPolarHBondContact CG2-O 3.3Å
47	S	88.4	Confident	72	Confident	2 Å²	2	96.8 Å²	96.8	1%	0.014	54%	0.539	C	S	.	.	P	Polyproline II helix	trans	-59.1	133.4	172.9	152.6	0	0	0	0	109.7	V49 T50 G51 Q52 E54 L59 E62	S47-V49 VanDerWaalsContact C-N 3.32Å; S47-V49 PolarHBondContact OG-N 3.4Å; S47-T50 WeakPolarHBondContact OG-CB 2.95Å; S47-T50 PolarHBondContact OG-N 3.36Å; S47-T50 PolarHBondContact OG-OG1 2.92Å; S47-G51 WeakPolarHBondContact O-CA 3.4Å; S47-G51 PolarHBondContact O-N 3.47Å; S47-Q52 PolarHBondContact N-O 3.28Å; S47-E54 WeakPolarHBondContact CB-OE2 3.41Å; S47-L59 VanDerWaalsContact CA-CD2 3.49Å; S47-E62 WeakPolarHBondContact CA-OE1 3.48Å; S47-E62 WeakPolarHBondContact CA-OE2 3.34Å; S47-E62 WeakPolarHBondContact CB-OE1 3.43Å; S47-E62 PolarHBondContact OG-OE1 2.71Å
48	K	87.1	Confident	74.4	Confident	185 Å²	185	93.8 Å²	93.8	80%	0.804	52%	0.522	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.4	-31.4	175.6	-66.4	178.2	-176.8	170.3	0	111.6	I46 E62	I46-K48 PolarHBondContact O-N 2.92Å; K48-E62 PolarHBondContact N-OE1 2.9Å; K48-E62 VanDerWaalsContact N-OE1 3.12Å; K48-E62 PolarHBondContact N-OE2 2.94Å
49	V	86.4	Confident	76.8	Confident	125 Å²	125	90 Å²	90	76%	0.758	49%	0.494	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.6	-54.9	-176.3	-179.3	0	0	0	0	110.3	S47 E62	S47-V49 VanDerWaalsContact C-N 3.32Å; S47-V49 PolarHBondContact OG-N 3.4Å; V49-E62 HydrophobicContact CG2-CG 4.28Å; V49-E62 WeakPolarHBondContact CG2-OE1 3.47Å; V49-E62 PolarHBondContact N-OE1 2.88Å; V49-E62 VanDerWaalsContact N-OE1 3.14Å
50	T	87.8	Confident	79.1	Confident	67 Å²	67	90.1 Å²	90.1	41%	0.411	49%	0.486	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.8	-22.7	-174.5	-46.6	0	0	0	0	111.8	S47 Q52 E54	S47-T50 WeakPolarHBondContact OG-CB 2.95Å; S47-T50 PolarHBondContact OG-N 3.36Å; S47-T50 PolarHBondContact OG-OG1 2.92Å; T50-Q52 HydrophobicContact CG2-CB 3.86Å; T50-Q52 HydrophobicContact CG2-CG 3.79Å; T50-Q52 PolarHBondContact O-N 3.35Å; T50-E54 WeakPolarHBondContact CB-OE1 3.47Å; T50-E54 PolarHBondContact OG1-OE1 3.24Å
51	G	87	Confident	81.7	Confident	54 Å²	54	84.3 Å²	84.3	56%	0.557	46%	0.461	S	S	*	.			trans	67.8	8.3	-172.2	0	0	0	0	0	113.4	I46 S47	I46-G51 VanDerWaalsContact CG2-C 3.4Å; I46-G51 VanDerWaalsContact CG2-O 3.3Å; I46-G51 WeakPolarHBondContact CG2-O 3.3Å; S47-G51 WeakPolarHBondContact O-CA 3.4Å; S47-G51 PolarHBondContact O-N 3.47Å
52	Q	87.4	Confident	83.7	Confident	129 Å²	129	77.6 Å²	77.6	60%	0.603	42%	0.424	S	S	*	.	S	Bend	trans	-104.3	160.7	-178.1	-68.1	-178.4	26.8	0	0	110.9	S47 T50 E54	S47-Q52 PolarHBondContact N-O 3.28Å; T50-Q52 HydrophobicContact CG2-CB 3.86Å; T50-Q52 HydrophobicContact CG2-CG 3.79Å; T50-Q52 PolarHBondContact O-N 3.35Å; Q52-E54 PolarHBondContact O-N 3.02Å; Q52-E54 VanDerWaalsContact O-N 3.13Å
53	K	84.6	Confident	85.6	Confident	124 Å²	124	78.5 Å²	78.5	54%	0.539	42%	0.42	S	S	.	.			trans	-72.3	105.1	170.7	-179.4	-177.6	-179.2	174.6	0	108.4	E36 T44	E36-K53 IonicContact OE2-NZ 2.71Å; E36-K53 PolarHBondContact OE2-NZ 3.44Å; T44-K53 HydrophobicContact CG2-CB 4.38Å; T44-K53 HydrophobicContact CG2-CD 3.62Å; T44-K53 HydrophobicContact CG2-CG 3.67Å
54	E	84.5	Confident	87	Confident	47 Å²	47	80.6 Å²	80.6	22%	0.22	42%	0.423	C	S	.	.			trans	-102.1	169.6	176	-68.4	-173.8	179.7	0	0	111.4	S47 T50 Q52 L59	S47-E54 WeakPolarHBondContact CB-OE2 3.41Å; T50-E54 WeakPolarHBondContact CB-OE1 3.47Å; T50-E54 PolarHBondContact OG1-OE1 3.24Å; Q52-E54 PolarHBondContact O-N 3.02Å; Q52-E54 VanDerWaalsContact O-N 3.13Å; E54-L59 HydrophobicContact CB-CD2 4.36Å; E54-L59 HydrophobicContact CB-CG 4.19Å
55	D	85.9	Confident	88.3	Confident	53 Å²	53	80.7 Å²	80.7	28%	0.283	41%	0.414	S	S	.	.			trans	-72.9	146.5	174.5	-172.8	56	0	0	0	111.2	W57 Q58 L59 R89	D55-W57 PolarHBondContact O-N 3.13Å; D55-W57 VanDerWaalsContact OD2-CB 3.24Å; D55-W57 WeakPolarHBondContact OD2-CB 3.22Å; D55-W57 PolarHBondContact OD2-N 2.75Å; D55-Q58 PolarHBondContact O-N 2.65Å; D55-L59 WeakPolarHBondContact O-CG 3.26Å; D55-L59 PolarHBondContact O-N 2.91Å; D55-R89 IonicContact OD1-CZ 3.46Å; D55-R89 IonicContact OD1-NH1 3.69Å; D55-R89 PolarHBondContact OD1-NH1 3.42Å; D55-R89 VanDerWaalsContact OD2-CD 3.31Å; D55-R89 WeakPolarHBondContact OD2-CD 3.46Å; D55-R89 IonicContact OD2-CZ 3.11Å; D55-R89 IonicContact OD2-NE 2.64Å; D55-R89 IonicContact OD2-NH1 2.78Å; D55-R89 PolarHBondContact OD2-NH1 2.85Å
56	L	88.9	Confident	88.9	Confident	93 Å²	93	81 Å²	81	49%	0.487	42%	0.423	S	S	.	.	T	Hydrogen-bonded Turn	trans	-54.7	-30.9	177.2	-67.3	177.6	0	0	0	112.4	I45 L59 Y60	I45-L56 HydrophobicContact CB-CD2 4.42Å; I45-L56 HydrophobicContact CD1-CD2 3.64Å; I45-L56 HydrophobicContact CG1-CD2 4.24Å; L56-L59 HydrophobicContact CD2-CD1 4.18Å; L56-Y60 WeakPolarHBondContact O-CD2 3.31Å
57	W	91	Very high	88.9	Confident	38 Å²	38	82 Å²	82	14%	0.144	44%	0.436	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-47.9	177.6	-163.7	-104.5	0	0	0	112.3	D55 L59 Y60 T87 H88 Y188 I189 R190	D55-W57 PolarHBondContact O-N 3.13Å; D55-W57 VanDerWaalsContact OD2-CB 3.24Å; D55-W57 WeakPolarHBondContact OD2-CB 3.22Å; D55-W57 PolarHBondContact OD2-N 2.75Å; W57-L59 VanDerWaalsContact C-N 3.3Å; W57-L59 PolarHBondContact O-N 3.39Å; W57-Y60 HydrophobicContact CE3-CD2 4.14Å; W57-Y60 HydrophobicContact CE3-CE2 4.17Å; W57-Y60 WeakPolarHBondContact O-CB 3.04Å; W57-Y60 PolarHBondContact O-N 3.03Å; W57-T87 HydrophobicContact CZ2-CG2 4.18Å; W57-T87 PolarHBondContact O-OG1 2.73Å; W57-H88 PolarHBondContact NE1-O 3.41Å; W57-Y188 HydrophobicContact CB-CD1 3.88Å; W57-Y188 HydrophobicContact CB-CE1 4.18Å; W57-Y188 AromaticContact CD1-CD1 3.94Å; W57-Y188 AromaticContact CD2-CD1 3.9Å; W57-Y188 HydrophobicContact CD2-CD1 3.9Å; W57-Y188 HydrophobicContact CE3-CD1 4.49Å; W57-Y188 AromaticContact CG-CD1 3.62Å; W57-Y188 HydrophobicContact CG-CD1 3.62Å; W57-Y188 HydrophobicContact CG-CE1 4.4Å; W57-I189 PolarHBondContact NE1-O 3.19Å; W57-I189 VanDerWaalsContact NE1-O 3.14Å; W57-R190 HydrophobicContact CH2-CB 4.34Å; W57-R190 HydrophobicContact CZ2-CB 3.89Å
58	Q	90.6	Very high	88.7	Confident	75 Å²	75	85.8 Å²	85.8	35%	0.35	46%	0.458	S	S	.	.	G	3₁₀ helix	trans	-65.7	-36.1	178.1	-72.5	173.9	-19	0	0	111.8	D55 Y60 N61	D55-Q58 PolarHBondContact O-N 2.65Å; Q58-Y60 PolarHBondContact O-N 2.92Å; Q58-Y60 VanDerWaalsContact O-N 3.1Å; Q58-N61 WeakPolarHBondContact O-CB 3.42Å; Q58-N61 PolarHBondContact O-N 3.16Å
59	L	91.8	Very high	88.4	Confident	13 Å²	13	81.8 Å²	81.8	7%	0.068	45%	0.451	C	S	.	.	G	3₁₀ helix	trans	-60.7	-19.1	176.7	-71.8	164.2	0	0	0	113.6	I45 S47 E54 D55 L56 W57 N61 E62	I45-L59 HydrophobicContact CB-CD1 3.7Å; I45-L59 HydrophobicContact CG2-CD1 3.53Å; I45-L59 HydrophobicContact CG2-CD2 4.07Å; I45-L59 HydrophobicContact CG2-CG 4.35Å; S47-L59 VanDerWaalsContact CA-CD2 3.49Å; E54-L59 HydrophobicContact CB-CD2 4.36Å; E54-L59 HydrophobicContact CB-CG 4.19Å; D55-L59 WeakPolarHBondContact O-CG 3.26Å; D55-L59 PolarHBondContact O-N 2.91Å; L56-L59 HydrophobicContact CD2-CD1 4.18Å; W57-L59 VanDerWaalsContact C-N 3.3Å; W57-L59 PolarHBondContact O-N 3.39Å; L59-N61 PolarHBondContact O-N 3.49Å; L59-E62 PolarHBondContact O-N 3.38Å
60	Y	92.6	Very high	87.7	Confident	125 Å²	125	85.9 Å²	85.9	49%	0.49	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-64.7	-26.8	173.3	-78.1	-64.7	0	0	0	113	L56 W57 Q58 E62 V63	L56-Y60 WeakPolarHBondContact O-CD2 3.31Å; W57-Y60 HydrophobicContact CE3-CD2 4.14Å; W57-Y60 HydrophobicContact CE3-CE2 4.17Å; W57-Y60 WeakPolarHBondContact O-CB 3.04Å; W57-Y60 PolarHBondContact O-N 3.03Å; Q58-Y60 PolarHBondContact O-N 2.92Å; Q58-Y60 VanDerWaalsContact O-N 3.1Å; Y60-E62 PolarHBondContact O-N 2.76Å; Y60-V63 HydrophobicContact CD1-CG2 4.3Å; Y60-V63 WeakPolarHBondContact O-CB 3.47Å; Y60-V63 PolarHBondContact O-N 3.35Å
61	N	93.9	Very high	86.9	Confident	42 Å²	42	85.7 Å²	85.7	23%	0.225	46%	0.458	C	S	.	.	G	3₁₀ helix	trans	-66.6	-27.6	175.5	-69.3	-12.6	0	0	0	112.1	Q58 L59 V63 T87 H145	Q58-N61 WeakPolarHBondContact O-CB 3.42Å; Q58-N61 PolarHBondContact O-N 3.16Å; L59-N61 PolarHBondContact O-N 3.49Å; N61-V63 VanDerWaalsContact C-N 3.26Å; N61-V63 PolarHBondContact O-N 3.3Å; N61-T87 VanDerWaalsContact CG-OG1 3.28Å; N61-T87 PolarHBondContact ND2-O 2.99Å; N61-T87 WeakPolarHBondContact OD1-CA 3.4Å; N61-T87 PolarHBondContact OD1-N 2.62Å; N61-T87 PolarHBondContact OD1-O 2.71Å; N61-T87 PolarHBondContact OD1-OG1 2.72Å; N61-H145 VanDerWaalsContact CB-NE2 3.33Å; N61-H145 WeakPolarHBondContact CB-NE2 2.98Å
62	E	92	Very high	86	Confident	38 Å²	38	89.2 Å²	89.2	18%	0.178	47%	0.473	C	S	.	.	G	3₁₀ helix	trans	-80.9	-4.8	177.9	-54	-168.6	153.9	0	0	113.5	S47 K48 V49 L59 Y60 V64	S47-E62 WeakPolarHBondContact CA-OE1 3.48Å; S47-E62 WeakPolarHBondContact CA-OE2 3.34Å; S47-E62 WeakPolarHBondContact CB-OE1 3.43Å; S47-E62 PolarHBondContact OG-OE1 2.71Å; K48-E62 PolarHBondContact N-OE1 2.9Å; K48-E62 VanDerWaalsContact N-OE1 3.12Å; K48-E62 PolarHBondContact N-OE2 2.94Å; V49-E62 HydrophobicContact CG2-CG 4.28Å; V49-E62 WeakPolarHBondContact CG2-OE1 3.47Å; V49-E62 PolarHBondContact N-OE1 2.88Å; V49-E62 VanDerWaalsContact N-OE1 3.14Å; L59-E62 PolarHBondContact O-N 3.38Å; Y60-E62 PolarHBondContact O-N 2.76Å; E62-V64 PolarHBondContact O-N 3.04Å; E62-V64 VanDerWaalsContact O-N 3.1Å
63	V	91.1	Very high	85	Confident	65 Å²	65	85.8 Å²	85.8	39%	0.394	46%	0.464	S	S	.	.			trans	-74.9	105.2	-176.3	177.8	0	0	0	0	109.7	Y60 N61 Y65	Y60-V63 HydrophobicContact CD1-CG2 4.3Å; Y60-V63 WeakPolarHBondContact O-CB 3.47Å; Y60-V63 PolarHBondContact O-N 3.35Å; N61-V63 VanDerWaalsContact C-N 3.26Å; N61-V63 PolarHBondContact O-N 3.3Å; V63-Y65 HydrophobicContact CG1-CD1 4.2Å; V63-Y65 HydrophobicContact CG1-CE1 3.68Å; V63-Y65 HydrophobicContact CG1-CE2 4.37Å
64	V	90.5	Very high	83.9	Confident	137 Å²	137	83.7 Å²	83.7	83%	0.83	47%	0.465	S	S	*	.	P	Polyproline II helix	trans	-86.8	122.2	171.9	-177	0	0	0	0	109.8	E62	E62-V64 PolarHBondContact O-N 3.04Å; E62-V64 VanDerWaalsContact O-N 3.1Å
65	Y	88.7	Confident	83	Confident	87 Å²	87	87.4 Å²	87.4	34%	0.341	49%	0.49	S	S	.	.	P	Polyproline II helix	trans	-85	152	177.2	-63.9	-67.3	0	0	0	112.3	V63 R82 E85	V63-Y65 HydrophobicContact CG1-CD1 4.2Å; V63-Y65 HydrophobicContact CG1-CE1 3.68Å; V63-Y65 HydrophobicContact CG1-CE2 4.37Å; Y65-R82 VanDerWaalsContact CD1-NH2 3.35Å; Y65-R82 VanDerWaalsContact CD2-CZ 3.49Å; Y65-R82 PolarHBondContact OH-NH1 3.17Å; Y65-E85 WeakPolarHBondContact CE2-OE1 3.47Å; Y65-E85 VanDerWaalsContact CZ-OE1 3.27Å; Y65-E85 PolarHBondContact OH-OE1 3.21Å
66	P	90.8	Very high	81.5	Confident	102 Å²	102	89 Å²	89	66%	0.662	50%	0.499	S	S	*	.	P	Polyproline II helix	trans	-65.8	150.2	174.1	28.9	-35.1	0	0	0	111	V68	P66-V68 PolarHBondContact O-N 2.71Å
67	P	86.7	Confident	80	Confident	122 Å²	122	90.5 Å²	90.5	79%	0.792	50%	0.498	S	S	*	.	P	Polyproline II helix	trans	-63	136.9	178.8	26.4	-34	0	0	0	111
68	V	83	Confident	78.8	Confident	80 Å²	80	93.6 Å²	93.6	49%	0.485	52%	0.517	S	S	.	.	P	Polyproline II helix	trans	-69.2	130.9	175.9	-178.7	0	0	0	0	108.8	P66 K70	P66-V68 PolarHBondContact O-N 2.71Å; V68-K70 PolarHBondContact O-N 3.37Å
69	P	80.4	Confident	77.7	Confident	102 Å²	102	95.1 Å²	95.1	66%	0.662	53%	0.532	S	S	*	.	P	Polyproline II helix	trans	-61.4	134.6	177.6	24.6	-32.9	0	0	0	110.1	V71	P69-V71 PolarHBondContact O-N 2.89Å
70	K	72.1	Confident	76.9	Confident	210 Å²	210	98.6 Å²	98.6	91%	0.913	55%	0.551	S	S	*	*			trans	-64.7	100.4	176.8	-63.6	-177.3	-179.3	-177.3	0	109.1	V68	V68-K70 PolarHBondContact O-N 3.37Å
71	V	71.3	Confident	76.4	Confident	64 Å²	64	97.4 Å²	97.4	39%	0.388	55%	0.551	S	S	.	*			trans	-72.3	131.2	170.4	-177.3	0	0	0	0	107.5	P69 S73 L76	P69-V71 PolarHBondContact O-N 2.89Å; V71-S73 PolarHBondContact O-N 3.28Å; V71-L76 HydrophobicContact CG1-CB 4.35Å; V71-L76 HydrophobicContact CG1-CD1 4.31Å
72	S	68.2	Low	76.1	Confident	127 Å²	127	101 Å²	101	89%	0.888	56%	0.562	S	S	*	*	S	Bend	trans	-60.7	-15.8	-173.8	53.2	0	0	0	0	114.9
73	S	67.2	Low	76	Confident	57 Å²	57	101.6 Å²	101.6	40%	0.399	57%	0.569	S	S	.	*			trans	-94.6	119.1	-177	-60.6	0	0	0	0	111.4	V71 V75 L76 W77	V71-S73 PolarHBondContact O-N 3.28Å; S73-V75 VanDerWaalsContact C-N 3.29Å; S73-V75 PolarHBondContact O-N 3.09Å; S73-L76 PolarHBondContact O-N 3.15Å; S73-L76 VanDerWaalsContact O-N 3.13Å; S73-W77 PolarHBondContact O-N 3.42Å
74	S	60.8	Low	76	Confident	81 Å²	81	99.7 Å²	99.7	57%	0.566	56%	0.563	S	S	*	*	H	α-helix	trans	-56	-39.4	-175.7	-159.3	0	0	0	0	113.6	L76 W77	S74-L76 VanDerWaalsContact C-N 3.31Å; S74-L76 PolarHBondContact O-N 3.4Å; S74-W77 VanDerWaalsContact C-NE1 3.31Å; S74-W77 VanDerWaalsContact O-CE2 3.24Å; S74-W77 VanDerWaalsContact O-CG 3.29Å; S74-W77 PolarHBondContact O-NE1 3.21Å; S74-W77 PolarHBondContact OG-NE1 3.48Å
75	V	65.1	Low	76.2	Confident	124 Å²	124	94.8 Å²	94.8	75%	0.752	53%	0.531	S	S	*	.	H	α-helix	trans	-73.6	-26.8	-176.3	-176.5	0	0	0	0	112.3	S73	S73-V75 VanDerWaalsContact C-N 3.29Å; S73-V75 PolarHBondContact O-N 3.09Å
76	L	55.5	Low	76.5	Confident	88 Å²	88	90.7 Å²	90.7	46%	0.461	52%	0.515	S	S	.	.	H	α-helix	trans	-81	-27.7	-179.3	-68.1	175	0	0	0	112.2	V71 S73 S74 T79 N80	V71-L76 HydrophobicContact CG1-CB 4.35Å; V71-L76 HydrophobicContact CG1-CD1 4.31Å; S73-L76 PolarHBondContact O-N 3.15Å; S73-L76 VanDerWaalsContact O-N 3.13Å; S74-L76 VanDerWaalsContact C-N 3.31Å; S74-L76 PolarHBondContact O-N 3.4Å; L76-T79 PolarHBondContact O-OG1 3.44Å; L76-N80 PolarHBondContact O-N 3.3Å; L76-N80 PolarHBondContact O-ND2 3.22Å
77	W	55.8	Low	76.8	Confident	124 Å²	124	86 Å²	86	47%	0.47	49%	0.485	S	S	.	.	H	α-helix	trans	-63.8	-46.2	-176.5	62.3	-108.8	0	0	0	112.3	S73 S74 T79 N80 I81	S73-W77 PolarHBondContact O-N 3.42Å; S74-W77 VanDerWaalsContact C-NE1 3.31Å; S74-W77 VanDerWaalsContact O-CE2 3.24Å; S74-W77 VanDerWaalsContact O-CG 3.29Å; S74-W77 PolarHBondContact O-NE1 3.21Å; S74-W77 PolarHBondContact OG-NE1 3.48Å; W77-T79 VanDerWaalsContact C-N 3.32Å; W77-T79 PolarHBondContact O-N 3.45Å; W77-N80 PolarHBondContact O-N 3.04Å; W77-I81 HydrophobicContact CE3-CD1 3.8Å; W77-I81 HydrophobicContact CZ3-CD1 4.08Å; W77-I81 PolarHBondContact O-N 3.18Å
78	D	66.7	Low	77.2	Confident	103 Å²	103	81.2 Å²	81.2	55%	0.551	45%	0.452	S	S	*	.	H	α-helix	trans	-61.1	-43.6	-174.2	-160.7	15.8	0	0	0	111	N80 I81	D78-N80 PolarHBondContact O-N 3.49Å; D78-I81 PolarHBondContact O-N 2.78Å
79	T	68.2	Low	77.8	Confident	106 Å²	106	79 Å²	79	65%	0.65	44%	0.435	S	S	*	.	H	α-helix	trans	-67.8	-19	178	61.1	0	0	0	0	115	L76 W77	L76-T79 PolarHBondContact O-OG1 3.44Å; W77-T79 VanDerWaalsContact C-N 3.32Å; W77-T79 PolarHBondContact O-N 3.45Å
80	N	73.7	Confident	78.5	Confident	87 Å²	87	79.6 Å²	79.6	47%	0.465	42%	0.423	S	S	.	.	H	α-helix	trans	-98.8	-5	-178.1	-76	-59	0	0	0	112.8	L76 W77 D78 R82	L76-N80 PolarHBondContact O-N 3.3Å; L76-N80 PolarHBondContact O-ND2 3.22Å; W77-N80 PolarHBondContact O-N 3.04Å; D78-N80 PolarHBondContact O-N 3.49Å; N80-R82 PolarHBondContact O-N 2.51Å
81	I	82.8	Confident	79.6	Confident	99 Å²	99	72.7 Å²	72.7	51%	0.508	40%	0.397	S	S	.	.	S	Bend	trans	-68.6	133.4	173.8	-66.2	169.3	0	0	0	108.3	W77 D78	W77-I81 HydrophobicContact CE3-CD1 3.8Å; W77-I81 HydrophobicContact CZ3-CD1 4.08Å; W77-I81 PolarHBondContact O-N 3.18Å; D78-I81 PolarHBondContact O-N 2.78Å
82	R	86.6	Confident	80.7	Confident	117 Å²	117	73 Å²	73	44%	0.442	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-70.9	127.6	174.5	-177.7	-172.5	-57.7	-124.6	2	108.2	Y65 N80	Y65-R82 VanDerWaalsContact CD1-NH2 3.35Å; Y65-R82 VanDerWaalsContact CD2-CZ 3.49Å; Y65-R82 PolarHBondContact OH-NH1 3.17Å; N80-R82 PolarHBondContact O-N 2.51Å
83	P	89.9	Confident	82	Confident	51 Å²	51	67.5 Å²	67.5	33%	0.331	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-64	148.8	174.7	28.1	-34.6	0	0	0	110.2	E85 E193	P83-E85 PolarHBondContact O-N 2.67Å; P83-E193 HydrophobicContact CB-CB 4.48Å; P83-E193 WeakPolarHBondContact CB-O 3.3Å
84	G	91.7	Very high	83.4	Confident	26 Å²	26	68.6 Å²	68.6	27%	0.268	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-53.3	136.5	169.8	0	0	0	0	0	110.4	F147 R192 E193	G84-F147 WeakPolarHBondContact O-CZ 3.48Å; G84-R192 CarbonylContact O-C 3.54Å; G84-R192 VanDerWaalsContact O-CA 3.28Å; G84-R192 WeakPolarHBondContact O-CA 3.42Å; G84-E193 PolarHBondContact O-N 3.48Å
85	E	94.1	Very high	85.1	Confident	34 Å²	34	66.2 Å²	66.2	16%	0.159	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-133.8	139.6	177.2	69.5	-175.8	168.4	0	0	110.2	Y65 P83 L191 R192	Y65-E85 WeakPolarHBondContact CE2-OE1 3.47Å; Y65-E85 VanDerWaalsContact CZ-OE1 3.27Å; Y65-E85 PolarHBondContact OH-OE1 3.21Å; P83-E85 PolarHBondContact O-N 2.67Å; E85-L191 VanDerWaalsContact CA-O 3.3Å; E85-L191 WeakPolarHBondContact CA-O 3.26Å; E85-R192 HydrophobicContact CB-CG 3.93Å; E85-R192 IonicContact OE2-CZ 3.84Å; E85-R192 IonicContact OE2-NE 3.82Å; E85-R192 PolarHBondContact OE2-NE 2.96Å; E85-R192 IonicContact OE2-NH2 2.65Å; E85-R192 PolarHBondContact OE2-NH2 3.31Å
86	V	96.2	Very high	86.5	Confident	1 Å²	1	63 Å²	63	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.7	132.8	-178	174.1	0	0	0	0	108.9	L140 A141 H145 F147 R190 L191	V86-L140 HydrophobicContact CG1-CB 4.33Å; V86-A141 HydrophobicContact CB-CB 4.2Å; V86-A141 HydrophobicContact CG1-CB 4.33Å; V86-A141 HydrophobicContact CG2-CB 3.79Å; V86-H145 HydrophobicContact CG2-CB 3.6Å; V86-H145 VanDerWaalsContact CG2-CG 3.48Å; V86-F147 HydrophobicContact CB-CE2 4.4Å; V86-F147 HydrophobicContact CB-CZ 4.35Å; V86-F147 HydrophobicContact CG2-CD2 4.18Å; V86-F147 HydrophobicContact CG2-CE2 3.33Å; V86-F147 HydrophobicContact CG2-CZ 3.72Å; V86-R190 CarbonylContact O-C 3.53Å; V86-R190 VanDerWaalsContact O-CA 3.24Å; V86-R190 WeakPolarHBondContact O-CA 3.45Å; V86-L191 PolarHBondContact N-O 3.06Å; V86-L191 PolarHBondContact O-N 2.63Å
87	T	96.1	Very high	88.5	Confident	4 Å²	4	59.8 Å²	59.8	3%	0.025	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	128.6	175	58.3	0	0	0	0	110.1	W57 N61 I189 R190	W57-T87 HydrophobicContact CZ2-CG2 4.18Å; W57-T87 PolarHBondContact O-OG1 2.73Å; N61-T87 VanDerWaalsContact CG-OG1 3.28Å; N61-T87 PolarHBondContact ND2-O 2.99Å; N61-T87 WeakPolarHBondContact OD1-CA 3.4Å; N61-T87 PolarHBondContact OD1-N 2.62Å; N61-T87 PolarHBondContact OD1-O 2.71Å; N61-T87 PolarHBondContact OD1-OG1 2.72Å; T87-I189 WeakPolarHBondContact CA-O 3.08Å; T87-R190 HydrophobicContact CG2-CB 4.23Å; T87-R190 HydrophobicContact CG2-CG 3.81Å
88	H	96.8	Very high	90.4	Very high	21 Å²	21	61.4 Å²	61.4	10%	0.097	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	149.3	174.4	-176.4	44.2	0	0	0	110.4	W57 V133 E136 A137 L140 I189	W57-H88 PolarHBondContact NE1-O 3.41Å; H88-V133 PolarHBondContact CD2-O 2.63Å; H88-E136 IonicContact CD2-OE2 2.99Å; H88-E136 IonicContact CE1-OE2 3.11Å; H88-E136 PolarHBondContact CE1-OE2 2.58Å; H88-E136 VanDerWaalsContact NE2-CB 3.33Å; H88-E136 WeakPolarHBondContact NE2-CB 3.34Å; H88-E136 IonicContact NE2-OE2 2.62Å; H88-E136 PolarHBondContact NE2-OE2 3.34Å; H88-A137 HydrophobicContact CB-CB 3.67Å; H88-L140 HydrophobicContact CB-CD1 4.35Å; H88-L140 WeakPolarHBondContact ND1-CD1 3.38Å; H88-I189 PolarHBondContact N-O 2.99Å; H88-I189 PolarHBondContact O-N 3.13Å; H88-I189 VanDerWaalsContact O-O 3.11Å
89	R	94.8	Very high	91.8	Very high	34 Å²	34	63.4 Å²	63.4	13%	0.128	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.6	134.9	179	179.7	-174.1	170.8	172.9	-27.4	110.7	D55 D91 N186 L187 Y188	D55-R89 IonicContact OD1-CZ 3.46Å; D55-R89 IonicContact OD1-NH1 3.69Å; D55-R89 PolarHBondContact OD1-NH1 3.42Å; D55-R89 VanDerWaalsContact OD2-CD 3.31Å; D55-R89 WeakPolarHBondContact OD2-CD 3.46Å; D55-R89 IonicContact OD2-CZ 3.11Å; D55-R89 IonicContact OD2-NE 2.64Å; D55-R89 IonicContact OD2-NH1 2.78Å; D55-R89 PolarHBondContact OD2-NH1 2.85Å; R89-D91 IonicContact CZ-OD1 3.31Å; R89-D91 IonicContact CZ-OD2 3.98Å; R89-D91 VanDerWaalsContact CZ-OD2 3.31Å; R89-D91 VanDerWaalsContact NE-CG 3.29Å; R89-D91 IonicContact NE-OD1 3.25Å; R89-D91 PolarHBondContact NE-OD1 3.12Å; R89-D91 IonicContact NE-OD2 2.63Å; R89-D91 PolarHBondContact NE-OD2 3.02Å; R89-D91 IonicContact NH2-OD1 2.78Å; R89-D91 PolarHBondContact NH2-OD1 3.41Å; R89-D91 IonicContact NH2-OD2 2.87Å; R89-D91 PolarHBondContact NH2-OD2 2.95Å; R89-N186 PolarHBondContact NH2-ND2 3.35Å; R89-L187 CarbonylContact C-O 3.52Å; R89-L187 VanDerWaalsContact CA-O 3.23Å; R89-L187 WeakPolarHBondContact CA-O 3.42Å; R89-L187 WeakPolarHBondContact CG-O 3.43Å; R89-Y188 HydrophobicContact CB-CD1 4.23Å; R89-Y188 HydrophobicContact CG-CD1 3.76Å; R89-Y188 HydrophobicContact CG-CE1 3.78Å; R89-Y188 HydrophobicContact CG-CG 4.37Å; R89-Y188 PolarHBondContact NE-OH 3.45Å; R89-Y188 PolarHBondContact NH1-OH 2.9Å; R89-Y188 PolarHBondContact NH2-OH 3.24Å
90	R	95.7	Very high	93.2	Very high	113 Å²	113	58.4 Å²	58.4	43%	0.426	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	126	170.4	-166.1	74.9	162.7	103.8	0.5	110.7	I93 V133 E136 N186 L187	R90-I93 HydrophobicContact CB-CD1 4.14Å; R90-I93 HydrophobicContact CG-CD1 4.05Å; R90-I93 HydrophobicContact CG-CG1 4.11Å; R90-V133 HydrophobicContact CB-CB 4.46Å; R90-V133 HydrophobicContact CB-CG1 3.92Å; R90-V133 HydrophobicContact CB-CG2 3.56Å; R90-V133 HydrophobicContact CG-CG2 3.63Å; R90-E136 WeakPolarHBondContact CD-OE2 3.17Å; R90-E136 IonicContact NE-OE1 3.35Å; R90-E136 PolarHBondContact NE-OE1 3.14Å; R90-E136 IonicContact NE-OE2 3.78Å; R90-N186 CarbonylContact O-C 3.6Å; R90-N186 WeakPolarHBondContact O-CA 3.33Å; R90-L187 HydrophobicContact CB-CB 4.44Å; R90-L187 PolarHBondContact N-O 3.25Å; R90-L187 PolarHBondContact O-N 2.78Å
91	D	93.7	Very high	94.3	Very high	66 Å²	66	60.6 Å²	60.6	35%	0.353	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.9	163.9	-178	-80.2	-19.2	0	0	0	114	R89 I93 N186	R89-D91 IonicContact CZ-OD1 3.31Å; R89-D91 IonicContact CZ-OD2 3.98Å; R89-D91 VanDerWaalsContact CZ-OD2 3.31Å; R89-D91 VanDerWaalsContact NE-CG 3.29Å; R89-D91 IonicContact NE-OD1 3.25Å; R89-D91 PolarHBondContact NE-OD1 3.12Å; R89-D91 IonicContact NE-OD2 2.63Å; R89-D91 PolarHBondContact NE-OD2 3.02Å; R89-D91 IonicContact NH2-OD1 2.78Å; R89-D91 PolarHBondContact NH2-OD1 3.41Å; R89-D91 IonicContact NH2-OD2 2.87Å; R89-D91 PolarHBondContact NH2-OD2 2.95Å; D91-I93 VanDerWaalsContact C-N 3.26Å; D91-I93 PolarHBondContact O-N 2.98Å; D91-N186 VanDerWaalsContact OD1-CB 3.26Å; D91-N186 WeakPolarHBondContact OD1-CB 3.23Å; D91-N186 PolarHBondContact OD1-ND2 3.09Å; D91-N186 PolarHBondContact OD1-OD1 2.78Å
92	D	94.1	Very high	94.9	Very high	70 Å²	70	60.6 Å²	60.6	37%	0.374	29%	0.285	S	S	.	.	E	Extended strand (participates in β ladder)	trans	56.8	38.5	170.4	-82.3	-14	0	0	0	113.6	L94 R164 Y184 T185 N186	D92-L94 PolarHBondContact O-N 3.39Å; D92-R164 VanDerWaalsContact CG-NE 3.28Å; D92-R164 WeakPolarHBondContact OD1-CG 3.34Å; D92-R164 IonicContact OD1-CZ 3.89Å; D92-R164 IonicContact OD1-NE 2.93Å; D92-R164 PolarHBondContact OD1-NE 2.95Å; D92-R164 IonicContact OD1-NH2 3.95Å; D92-R164 IonicContact OD2-CZ 3.26Å; D92-R164 VanDerWaalsContact OD2-CZ 3.26Å; D92-R164 IonicContact OD2-NE 2.96Å; D92-R164 PolarHBondContact OD2-NE 3.16Å; D92-R164 IonicContact OD2-NH2 2.77Å; D92-R164 PolarHBondContact OD2-NH2 2.95Å; D92-Y184 HydrophobicContact CB-CD1 4.26Å; D92-Y184 VanDerWaalsContact O-CD1 3.27Å; D92-Y184 WeakPolarHBondContact O-CD1 3.41Å; D92-T185 PolarHBondContact N-O 3.45Å; D92-N186 PolarHBondContact N-OD1 2.64Å
93	I	96.8	Very high	95.4	Very high	12 Å²	12	55.3 Å²	55.3	6%	0.062	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.8	119.1	173.6	-60.7	168.2	0	0	0	108.9	R90 D91 Y95 L100 I129 Y184 T185 L187	R90-I93 HydrophobicContact CB-CD1 4.14Å; R90-I93 HydrophobicContact CG-CD1 4.05Å; R90-I93 HydrophobicContact CG-CG1 4.11Å; D91-I93 VanDerWaalsContact C-N 3.26Å; D91-I93 PolarHBondContact O-N 2.98Å; I93-Y95 VanDerWaalsContact C-N 3.3Å; I93-Y95 PolarHBondContact O-N 3.1Å; I93-L100 HydrophobicContact CD1-CD2 4.31Å; I93-I129 HydrophobicContact CD1-CG2 3.95Å; I93-I129 HydrophobicContact CG1-CG2 4.29Å; I93-I129 HydrophobicContact CG2-CD1 3.92Å; I93-I129 HydrophobicContact CG2-CG2 3.95Å; I93-Y184 CarbonylContact O-C 3.56Å; I93-Y184 WeakPolarHBondContact O-CA 3.32Å; I93-T185 WeakPolarHBondContact CB-O 2.9Å; I93-T185 WeakPolarHBondContact CB-OG1 3.41Å; I93-T185 PolarHBondContact N-O 2.94Å; I93-T185 PolarHBondContact O-N 3.13Å; I93-T185 PolarHBondContact O-OG1 2.86Å; I93-L187 HydrophobicContact CD1-CB 3.69Å; I93-L187 HydrophobicContact CD1-CD1 3.98Å
94	L	95.9	Very high	95.8	Very high	79 Å²	79	53 Å²	53	41%	0.414	25%	0.25	S	C	.	.			trans	-79.2	80.5	173.3	-173.9	64.2	0	0	0	110.4	D92 F182 Y184	D92-L94 PolarHBondContact O-N 3.39Å; L94-F182 HydrophobicContact CD1-CB 4.2Å; L94-F182 HydrophobicContact CD1-CD1 4.29Å; L94-Y184 HydrophobicContact CB-CD1 4.12Å; L94-Y184 HydrophobicContact CB-CE1 3.83Å; L94-Y184 HydrophobicContact CD1-CD1 4.31Å; L94-Y184 HydrophobicContact CD1-CE1 4Å; L94-Y184 HydrophobicContact CD1-CE2 4.41Å; L94-Y184 HydrophobicContact CG-CE1 4.42Å
95	Y	96.7	Very high	95.9	Very high	31 Å²	31	55.1 Å²	55.1	12%	0.122	25%	0.253	C	S	.	.	S	Bend	trans	-155.4	163.1	176.6	-161.7	-114.9	0	0	0	111.1	I93 S97 R99 L100 K125 T185	I93-Y95 VanDerWaalsContact C-N 3.3Å; I93-Y95 PolarHBondContact O-N 3.1Å; Y95-S97 PolarHBondContact O-N 3.19Å; Y95-R99 HydrophobicContact CD1-CB 4.41Å; Y95-R99 HydrophobicContact CE1-CB 3.56Å; Y95-L100 HydrophobicContact CD1-CB 4Å; Y95-L100 HydrophobicContact CD1-CD1 4.13Å; Y95-L100 HydrophobicContact CE1-CB 4.47Å; Y95-K125 HydrophobicContact CD2-CD 4.46Å; Y95-K125 HydrophobicContact CE2-CB 4.16Å; Y95-T185 WeakPolarHBondContact O-CG2 3.47Å
96	S	95.3	Very high	95.9	Very high	57 Å²	57	56.2 Å²	56.2	40%	0.399	26%	0.26	S	S	.	.			trans	-73.8	125.7	-179.8	-179.2	0	0	0	0	110.9	K98 R99 L100	S96-K98 PolarHBondContact O-N 3.18Å; S96-R99 PolarHBondContact O-N 3.41Å; S96-R99 VanDerWaalsContact O-N 3.09Å; S96-L100 PolarHBondContact O-N 2.84Å
97	S	96	Very high	95.9	Very high	21 Å²	21	56.2 Å²	56.2	15%	0.147	26%	0.259	C	S	.	.	H	α-helix	trans	-59.2	-37.6	-178.2	-21	0	0	0	0	112.1	Y95 W101 T185	Y95-S97 PolarHBondContact O-N 3.19Å; S97-W101 WeakPolarHBondContact O-CB 3.36Å; S97-W101 PolarHBondContact O-N 3.35Å; S97-T185 VanDerWaalsContact CA-CG2 3.48Å; S97-T185 WeakPolarHBondContact OG-CG2 3.33Å
98	K	96.1	Very high	95.9	Very high	157 Å²	157	59.1 Å²	59.1	68%	0.683	27%	0.27	S	S	*	.	H	α-helix	trans	-67.3	-40.2	179.2	-173.5	176.1	-179.8	179.7	0	111.6	S96 M102	S96-K98 PolarHBondContact O-N 3.18Å; K98-M102 WeakPolarHBondContact O-CG 3.33Å; K98-M102 PolarHBondContact O-N 2.95Å
99	R	96.6	Very high	95.8	Very high	146 Å²	146	58.4 Å²	58.4	55%	0.551	27%	0.268	S	S	*	.	H	α-helix	trans	-68.8	-45.8	177	-68.3	-171.7	177.7	175.9	-2	111.3	Y95 S96 W101 M102 L103	Y95-R99 HydrophobicContact CD1-CB 4.41Å; Y95-R99 HydrophobicContact CE1-CB 3.56Å; S96-R99 PolarHBondContact O-N 3.41Å; S96-R99 VanDerWaalsContact O-N 3.09Å; R99-W101 VanDerWaalsContact C-N 3.28Å; R99-W101 PolarHBondContact O-N 3.23Å; R99-M102 HydrophobicContact CB-CE 4.39Å; R99-M102 HydrophobicContact CG-CE 4.17Å; R99-M102 PolarHBondContact O-N 2.91Å; R99-L103 PolarHBondContact O-N 2.83Å
100	L	96.9	Very high	95.8	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	28%	0.28	C	S	.	.	H	α-helix	trans	-60.4	-41	176.2	-160.1	59.8	0	0	0	111.6	I93 Y95 S96 M102 L103 V104 V160 L187	I93-L100 HydrophobicContact CD1-CD2 4.31Å; Y95-L100 HydrophobicContact CD1-CB 4Å; Y95-L100 HydrophobicContact CD1-CD1 4.13Å; Y95-L100 HydrophobicContact CE1-CB 4.47Å; S96-L100 PolarHBondContact O-N 2.84Å; L100-M102 VanDerWaalsContact C-N 3.3Å; L100-M102 PolarHBondContact O-N 2.74Å; L100-L103 PolarHBondContact O-N 2.96Å; L100-V104 HydrophobicContact CG-CG2 4.49Å; L100-V104 WeakPolarHBondContact O-CB 3.33Å; L100-V104 WeakPolarHBondContact O-CG2 3.4Å; L100-V104 PolarHBondContact O-N 3.41Å; L100-V160 HydrophobicContact CB-CG1 4.15Å; L100-V160 HydrophobicContact CB-CG2 4.09Å; L100-V160 HydrophobicContact CD2-CG1 4.05Å; L100-V160 HydrophobicContact CD2-CG2 4.1Å; L100-V160 HydrophobicContact CG-CG1 4.42Å; L100-V160 HydrophobicContact CG-CG2 3.88Å; L100-L187 HydrophobicContact CD1-CD1 4.37Å; L100-L187 HydrophobicContact CD2-CD1 3.99Å; L100-L187 HydrophobicContact CD2-CG 4.42Å; L100-L187 HydrophobicContact CG-CD1 4.35Å
101	W	96.6	Very high	95.9	Very high	133 Å²	133	58 Å²	58	50%	0.504	27%	0.272	S	S	.	.	H	α-helix	trans	-61.3	-36.5	177.8	178.6	77.3	0	0	0	112.9	S97 R99 V104 H105 V160	S97-W101 WeakPolarHBondContact O-CB 3.36Å; S97-W101 PolarHBondContact O-N 3.35Å; R99-W101 VanDerWaalsContact C-N 3.28Å; R99-W101 PolarHBondContact O-N 3.23Å; W101-V104 PolarHBondContact O-N 3.3Å; W101-H105 VanDerWaalsContact O-CB 3.27Å; W101-H105 WeakPolarHBondContact O-CB 3.18Å; W101-H105 PolarHBondContact O-N 2.97Å; W101-V160 HydrophobicContact CB-CB 4.25Å; W101-V160 HydrophobicContact CB-CG2 4.36Å
102	M	96.6	Very high	96	Very high	99 Å²	99	55.3 Å²	55.3	49%	0.488	26%	0.258	S	S	.	.	H	α-helix	trans	-65.3	-41.1	175.1	-67.7	-175.6	-62.6	0	0	112	K98 R99 L100 H105 L106	K98-M102 WeakPolarHBondContact O-CG 3.33Å; K98-M102 PolarHBondContact O-N 2.95Å; R99-M102 HydrophobicContact CB-CE 4.39Å; R99-M102 HydrophobicContact CG-CE 4.17Å; R99-M102 PolarHBondContact O-N 2.91Å; L100-M102 VanDerWaalsContact C-N 3.3Å; L100-M102 PolarHBondContact O-N 2.74Å; M102-H105 PolarHBondContact O-N 3.25Å; M102-L106 PolarHBondContact O-N 3.39Å
103	L	97.1	Very high	96.1	Very high	7 Å²	7	57.2 Å²	57.2	4%	0.037	27%	0.268	C	S	.	.	H	α-helix	trans	-66.6	-43.3	175.3	-66.3	170.5	0	0	0	111.6	R99 L100 H105 L106 I107 R122 A127 L130	R99-L103 PolarHBondContact O-N 2.83Å; L100-L103 PolarHBondContact O-N 2.96Å; L103-H105 VanDerWaalsContact C-N 3.32Å; L103-H105 PolarHBondContact O-N 3.22Å; L103-L106 VanDerWaalsContact O-CB 3.31Å; L103-L106 WeakPolarHBondContact O-CB 3.39Å; L103-L106 PolarHBondContact O-N 3.1Å; L103-I107 PolarHBondContact O-N 3.14Å; L103-R122 HydrophobicContact CD2-CG 4.21Å; L103-A127 HydrophobicContact CD1-CB 4.44Å; L103-L130 HydrophobicContact CB-CD2 4.19Å
104	V	97	Very high	96.1	Very high	1 Å²	1	58.9 Å²	58.9	1%	0.006	28%	0.277	C	S	.	.	H	α-helix	trans	-63.5	-39.2	176.8	166	0	0	0	0	111.5	L100 W101 L106 I107 R108 L130 A158 V160	L100-V104 HydrophobicContact CG-CG2 4.49Å; L100-V104 WeakPolarHBondContact O-CB 3.33Å; L100-V104 WeakPolarHBondContact O-CG2 3.4Å; L100-V104 PolarHBondContact O-N 3.41Å; W101-V104 PolarHBondContact O-N 3.3Å; V104-L106 VanDerWaalsContact C-N 3.27Å; V104-L106 PolarHBondContact O-N 3.21Å; V104-I107 WeakPolarHBondContact O-CG1 3.38Å; V104-I107 PolarHBondContact O-N 2.79Å; V104-R108 PolarHBondContact O-N 3.05Å; V104-L130 HydrophobicContact CG2-CD1 3.69Å; V104-L130 HydrophobicContact CG2-CD2 4.2Å; V104-A158 HydrophobicContact CG1-CB 3.4Å; V104-A158 VanDerWaalsContact CG1-CB 3.4Å; V104-A158 VanDerWaalsContact CG1-O 3.27Å; V104-A158 WeakPolarHBondContact CG1-O 3.48Å; V104-V160 HydrophobicContact CB-CG2 4.01Å; V104-V160 HydrophobicContact CG1-CG2 4.35Å; V104-V160 HydrophobicContact CG2-CG2 3.6Å
105	H	94.8	Very high	96.1	Very high	72 Å²	72	55.1 Å²	55.1	33%	0.333	26%	0.257	S	S	.	.	H	α-helix	trans	-64.1	-33	175.9	-169.3	77.1	0	0	0	112.4	W101 M102 L103 H201	W101-H105 VanDerWaalsContact O-CB 3.27Å; W101-H105 WeakPolarHBondContact O-CB 3.18Å; W101-H105 PolarHBondContact O-N 2.97Å; M102-H105 PolarHBondContact O-N 3.25Å; L103-H105 VanDerWaalsContact C-N 3.32Å; L103-H105 PolarHBondContact O-N 3.22Å; H105-H201 AromaticContact CE1-CE1 3.45Å; H105-H201 PolarHBondContact CE1-CE1 3.38Å; H105-H201 VanDerWaalsContact CE1-CE1 3.45Å; H105-H201 AromaticContact CE1-ND1 3.83Å; H105-H201 AromaticContact ND1-CE1 3.89Å; H105-H201 AromaticContact NE2-CE1 3.85Å
106	L	94.1	Very high	96.2	Very high	57 Å²	57	56.2 Å²	56.2	30%	0.298	26%	0.263	S	S	.	.	H	α-helix	trans	-64.4	-41.5	178.3	178.1	66.5	0	0	0	112.7	M102 L103 V104 Q118	M102-L106 PolarHBondContact O-N 3.39Å; L103-L106 VanDerWaalsContact O-CB 3.31Å; L103-L106 WeakPolarHBondContact O-CB 3.39Å; L103-L106 PolarHBondContact O-N 3.1Å; V104-L106 VanDerWaalsContact C-N 3.27Å; V104-L106 PolarHBondContact O-N 3.21Å; L106-Q118 HydrophobicContact CD2-CB 4.19Å
107	I	96.3	Very high	96.3	Very high	0 Å²	0	55.7 Å²	55.7	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-87.9	-13.8	-175.3	62.7	164.2	0	0	0	113.6	L103 V104 G109 R110 A115 L119 L130 I155	L103-I107 PolarHBondContact O-N 3.14Å; V104-I107 WeakPolarHBondContact O-CG1 3.38Å; V104-I107 PolarHBondContact O-N 2.79Å; I107-G109 PolarHBondContact O-N 3.23Å; I107-R110 WeakPolarHBondContact O-CB 3.41Å; I107-R110 PolarHBondContact O-N 3.32Å; I107-R110 VanDerWaalsContact O-N 3.16Å; I107-A115 HydrophobicContact CB-CB 3.88Å; I107-A115 HydrophobicContact CG2-CB 3.85Å; I107-L119 HydrophobicContact CG2-CD1 4.14Å; I107-L119 HydrophobicContact CG2-CD2 4.08Å; I107-L119 HydrophobicContact CG2-CG 3.95Å; I107-L130 HydrophobicContact CD1-CD1 4.1Å; I107-L130 HydrophobicContact CD1-CD2 3.39Å; I107-L130 HydrophobicContact CD1-CG 3.84Å; I107-L130 HydrophobicContact CG1-CD2 4.07Å; I107-L130 HydrophobicContact CG2-CD2 4.47Å; I107-I155 HydrophobicContact CB-CD1 4.07Å; I107-I155 HydrophobicContact CD1-CD1 3.97Å; I107-I155 HydrophobicContact CG1-CD1 4.3Å
108	R	95.2	Very high	96.3	Very high	66 Å²	66	57.8 Å²	57.8	25%	0.249	27%	0.27	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	128	-175.4	-157.4	-176.4	173.8	-160.6	-9.1	109.9	V104 R110 S157 Y200	V104-R108 PolarHBondContact O-N 3.05Å; R108-R110 VanDerWaalsContact C-N 3.32Å; R108-S157 PolarHBondContact NH2-OG 3.11Å; R108-Y200 HydrophobicContact CB-CE1 4.03Å; R108-Y200 WeakPolarHBondContact CD-OH 3.38Å; R108-Y200 HydrophobicContact CG-CD1 4.5Å; R108-Y200 HydrophobicContact CG-CE1 3.48Å; R108-Y200 VanDerWaalsContact CG-CE1 3.48Å; R108-Y200 WeakPolarHBondContact CG-OH 3.42Å; R108-Y200 PolarHBondContact NE-OH 2.95Å; R108-Y200 PolarHBondContact NH2-OH 3.06Å
109	G	95.7	Very high	96.4	Very high	5 Å²	5	50.3 Å²	50.3	5%	0.052	24%	0.237	C	C	.	.	T	Hydrogen-bonded Turn	trans	80.6	7.8	-178.2	0	0	0	0	0	115.4	I107 I155 P196	I107-G109 PolarHBondContact O-N 3.23Å; G109-I155 WeakPolarHBondContact CA-O 3.49Å; G109-I155 PolarHBondContact N-O 3.34Å; G109-P196 VanDerWaalsContact O-CB 3.32Å; G109-P196 WeakPolarHBondContact O-CB 3.17Å
110	R	95.4	Very high	96.4	Very high	104 Å²	104	45.1 Å²	45.1	39%	0.392	23%	0.229	S	C	.	.	S	Bend	trans	-97.4	159.8	175.1	-58.8	-61.1	-178.5	157.9	-16.7	111.2	I107 R108 D114 W154 I155	I107-R110 WeakPolarHBondContact O-CB 3.41Å; I107-R110 PolarHBondContact O-N 3.32Å; I107-R110 VanDerWaalsContact O-N 3.16Å; R108-R110 VanDerWaalsContact C-N 3.32Å; R110-D114 HydrophobicContact CB-CB 4.44Å; R110-D114 WeakPolarHBondContact CD-OD2 3.27Å; R110-D114 IonicContact NH1-OD2 3.93Å; R110-D114 PolarHBondContact NH1-OD2 3.21Å; R110-W154 WeakPolarHBondContact O-CA 3.39Å; R110-W154 WeakPolarHBondContact O-CB 3.38Å; R110-I155 PolarHBondContact O-N 3.38Å
111	S	96.7	Very high	96.3	Very high	36 Å²	36	53.2 Å²	53.2	25%	0.252	26%	0.264	S	S	.	.	B	Isolated β-bridge	trans	-63.6	153.3	163.8	57.6	0	0	0	0	109.4	D113 D114 A115	S111-D113 VanDerWaalsContact C-N 3.27Å; S111-D113 PolarHBondContact O-N 3.39Å; S111-D114 PolarHBondContact O-N 2.93Å; S111-D114 WeakPolarHBondContact OG-CB 3.48Å; S111-D114 PolarHBondContact OG-N 3.06Å; S111-A115 WeakPolarHBondContact O-CB 3.43Å; S111-A115 PolarHBondContact O-N 3.49Å
112	V	96.9	Very high	96.3	Very high	9 Å²	9	52.2 Å²	52.2	6%	0.055	26%	0.26	C	S	.	.	H	α-helix	trans	-59.1	-40.7	178.6	167.3	0	0	0	0	111.3	A115 F116 L134 I138 I153 I155 L191	V112-A115 WeakPolarHBondContact O-CB 3.27Å; V112-A115 PolarHBondContact O-N 3.42Å; V112-F116 HydrophobicContact CG1-CD2 3.81Å; V112-F116 HydrophobicContact CG1-CE2 3.56Å; V112-F116 VanDerWaalsContact O-CD2 3.28Å; V112-F116 WeakPolarHBondContact O-CD2 3.28Å; V112-F116 PolarHBondContact O-N 3.45Å; V112-L134 HydrophobicContact CG1-CD2 4.3Å; V112-I138 HydrophobicContact CG1-CD1 3.43Å; V112-I138 VanDerWaalsContact CG1-CD1 3.43Å; V112-I138 HydrophobicContact CG1-CG1 4.17Å; V112-I153 HydrophobicContact CB-CB 4.47Å; V112-I153 HydrophobicContact CG2-CB 3.83Å; V112-I153 HydrophobicContact CG2-CG2 3.62Å; V112-I153 PolarHBondContact N-O 3.25Å; V112-I155 HydrophobicContact CG2-CG1 4.37Å; V112-L191 HydrophobicContact CG2-CD2 4.27Å
113	D	95.8	Very high	96.3	Very high	110 Å²	110	54.3 Å²	54.3	59%	0.588	28%	0.279	S	S	*	.	H	α-helix	trans	-63.2	-44.2	178.1	-61	-29.5	0	0	0	112.9	S111 A115 F116 A117	S111-D113 VanDerWaalsContact C-N 3.27Å; S111-D113 PolarHBondContact O-N 3.39Å; D113-A115 VanDerWaalsContact C-N 3.3Å; D113-A115 PolarHBondContact O-N 3.07Å; D113-F116 PolarHBondContact O-N 3.29Å; D113-A117 PolarHBondContact O-N 2.86Å
114	D	96.1	Very high	96.2	Very high	46 Å²	46	57.3 Å²	57.3	25%	0.246	29%	0.293	C	S	.	.	H	α-helix	trans	-65.3	-38.8	175.6	-174.3	25.1	0	0	0	109.8	R110 S111 F116 A117 Q118	R110-D114 HydrophobicContact CB-CB 4.44Å; R110-D114 WeakPolarHBondContact CD-OD2 3.27Å; R110-D114 IonicContact NH1-OD2 3.93Å; R110-D114 PolarHBondContact NH1-OD2 3.21Å; S111-D114 PolarHBondContact O-N 2.93Å; S111-D114 WeakPolarHBondContact OG-CB 3.48Å; S111-D114 PolarHBondContact OG-N 3.06Å; D114-F116 PolarHBondContact O-N 3.45Å; D114-A117 WeakPolarHBondContact O-CB 3.3Å; D114-A117 PolarHBondContact O-N 3.19Å; D114-Q118 VanDerWaalsContact O-CG 3.3Å; D114-Q118 WeakPolarHBondContact O-CG 3.43Å; D114-Q118 PolarHBondContact O-N 3.19Å; D114-Q118 PolarHBondContact OD1-NE2 2.98Å; D114-Q118 VanDerWaalsContact OD1-NE2 3.12Å
115	A	97.1	Very high	96.2	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	32%	0.318	C	S	.	.	H	α-helix	trans	-59.5	-45.7	175.8	0	0	0	0	0	112.5	I107 S111 V112 D113 A117 Q118 L119 L134 I155	I107-A115 HydrophobicContact CB-CB 3.88Å; I107-A115 HydrophobicContact CG2-CB 3.85Å; S111-A115 WeakPolarHBondContact O-CB 3.43Å; S111-A115 PolarHBondContact O-N 3.49Å; V112-A115 WeakPolarHBondContact O-CB 3.27Å; V112-A115 PolarHBondContact O-N 3.42Å; D113-A115 VanDerWaalsContact C-N 3.3Å; D113-A115 PolarHBondContact O-N 3.07Å; A115-A117 VanDerWaalsContact C-N 3.34Å; A115-A117 PolarHBondContact O-N 3.32Å; A115-Q118 PolarHBondContact O-N 3.47Å; A115-L119 WeakPolarHBondContact O-CB 3.24Å; A115-L119 VanDerWaalsContact O-CG 3.26Å; A115-L119 WeakPolarHBondContact O-CG 3.24Å; A115-L119 PolarHBondContact O-N 3.43Å; A115-L134 HydrophobicContact CB-CD2 4.14Å; A115-I155 HydrophobicContact CB-CD1 3.47Å; A115-I155 VanDerWaalsContact CB-CD1 3.47Å
116	F	97.5	Very high	96.3	Very high	54 Å²	54	59.8 Å²	59.8	24%	0.237	30%	0.303	C	S	.	.	H	α-helix	trans	-61.9	-40.8	174.1	-81	-67.3	0	0	0	112.3	V112 D113 D114 L119 G120 E131 L134 E135 I138	V112-F116 HydrophobicContact CG1-CD2 3.81Å; V112-F116 HydrophobicContact CG1-CE2 3.56Å; V112-F116 VanDerWaalsContact O-CD2 3.28Å; V112-F116 WeakPolarHBondContact O-CD2 3.28Å; V112-F116 PolarHBondContact O-N 3.45Å; D113-F116 PolarHBondContact O-N 3.29Å; D114-F116 PolarHBondContact O-N 3.45Å; F116-L119 PolarHBondContact O-N 3.18Å; F116-G120 PolarHBondContact O-N 3.26Å; F116-E131 HydrophobicContact CD1-CB 4.46Å; F116-E131 HydrophobicContact CD1-CG 4.14Å; F116-E131 HydrophobicContact CE1-CB 4.17Å; F116-E131 HydrophobicContact CE1-CG 4.34Å; F116-L134 HydrophobicContact CD2-CD2 4.17Å; F116-L134 HydrophobicContact CE1-CD2 4.3Å; F116-L134 HydrophobicContact CE2-CD2 3.84Å; F116-L134 HydrophobicContact CE2-CG 4.2Å; F116-L134 HydrophobicContact CZ-CB 4.19Å; F116-L134 HydrophobicContact CZ-CD2 3.89Å; F116-L134 HydrophobicContact CZ-CG 4.03Å; F116-E135 HydrophobicContact CE1-CG 3.99Å; F116-E135 HydrophobicContact CZ-CG 3.78Å; F116-I138 HydrophobicContact CE2-CD1 3.59Å; F116-I138 HydrophobicContact CZ-CD1 3.91Å
117	A	97.4	Very high	96.5	Very high	47 Å²	47	57.1 Å²	57.1	39%	0.388	29%	0.288	S	S	.	.	H	α-helix	trans	-60.5	-47.2	174.8	0	0	0	0	0	111.6	D113 D114 A115 L119 G120 F121	D113-A117 PolarHBondContact O-N 2.86Å; D114-A117 WeakPolarHBondContact O-CB 3.3Å; D114-A117 PolarHBondContact O-N 3.19Å; A115-A117 VanDerWaalsContact C-N 3.34Å; A115-A117 PolarHBondContact O-N 3.32Å; A117-L119 PolarHBondContact O-N 3.26Å; A117-G120 PolarHBondContact O-N 3.3Å; A117-F121 WeakPolarHBondContact O-CD2 3.48Å; A117-F121 WeakPolarHBondContact O-CE2 3.3Å; A117-F121 PolarHBondContact O-N 2.86Å
118	Q	96.9	Very high	96.6	Very high	65 Å²	65	62.2 Å²	62.2	30%	0.304	31%	0.308	S	S	.	.	H	α-helix	trans	-63	-39.5	178.5	-65	-53.4	-37.2	0	0	112.7	L106 D114 A115 R122	L106-Q118 HydrophobicContact CD2-CB 4.19Å; D114-Q118 VanDerWaalsContact O-CG 3.3Å; D114-Q118 WeakPolarHBondContact O-CG 3.43Å; D114-Q118 PolarHBondContact O-N 3.19Å; D114-Q118 PolarHBondContact OD1-NE2 2.98Å; D114-Q118 VanDerWaalsContact OD1-NE2 3.12Å; A115-Q118 PolarHBondContact O-N 3.47Å; Q118-R122 WeakPolarHBondContact O-CG 3.47Å
119	L	97.1	Very high	96.7	Very high	0 Å²	0	60 Å²	60	0%	0	30%	0.301	C	S	.	.	H	α-helix	trans	-73.4	-35.8	179	-66.5	170.8	0	0	0	112.3	I107 A115 F116 A117 F121 R122 A127 L130 E131	I107-L119 HydrophobicContact CG2-CD1 4.14Å; I107-L119 HydrophobicContact CG2-CD2 4.08Å; I107-L119 HydrophobicContact CG2-CG 3.95Å; A115-L119 WeakPolarHBondContact O-CB 3.24Å; A115-L119 VanDerWaalsContact O-CG 3.26Å; A115-L119 WeakPolarHBondContact O-CG 3.24Å; A115-L119 PolarHBondContact O-N 3.43Å; F116-L119 PolarHBondContact O-N 3.18Å; A117-L119 PolarHBondContact O-N 3.26Å; L119-F121 VanDerWaalsContact C-N 3.26Å; L119-F121 PolarHBondContact O-N 3.14Å; L119-R122 WeakPolarHBondContact O-CB 3.26Å; L119-R122 PolarHBondContact O-N 2.85Å; L119-A127 HydrophobicContact CB-CB 4.47Å; L119-A127 HydrophobicContact CD2-CB 4.06Å; L119-L130 HydrophobicContact CD1-CB 4.11Å; L119-L130 HydrophobicContact CD1-CD2 3.85Å; L119-L130 HydrophobicContact CD1-CG 3.94Å; L119-L130 HydrophobicContact CD2-CB 4.36Å; L119-L130 HydrophobicContact CD2-CD2 3.58Å; L119-L130 HydrophobicContact CD2-CG 4.4Å; L119-L130 HydrophobicContact CG-CD2 4.33Å; L119-E131 VanDerWaalsContact C-OE1 3.27Å; L119-E131 HydrophobicContact CB-CG 3.74Å; L119-E131 WeakPolarHBondContact CB-OE1 3.37Å; L119-E131 HydrophobicContact CD1-CG 3.95Å; L119-E131 HydrophobicContact CG-CG 4.49Å
120	G	96.5	Very high	96.8	Very high	36 Å²	36	59.8 Å²	59.8	37%	0.371	30%	0.298	S	S	.	.	H	α-helix	trans	-57.8	-36.8	178	0	0	0	0	0	113.4	F116 A117 R122 R128 E131	F116-G120 PolarHBondContact O-N 3.26Å; A117-G120 PolarHBondContact O-N 3.3Å; G120-R122 VanDerWaalsContact C-N 3.32Å; G120-R122 PolarHBondContact O-N 2.84Å; G120-R128 PolarHBondContact O-NH2 3.45Å; G120-E131 WeakPolarHBondContact CA-OE1 3.21Å; G120-E131 PolarHBondContact N-OE1 3.37Å
121	F	96.4	Very high	96.9	Very high	170 Å²	170	56.1 Å²	56.1	75%	0.746	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.5	-17.9	176.5	-69.4	-64	0	0	0	114.2	A117 L119	A117-F121 WeakPolarHBondContact O-CD2 3.48Å; A117-F121 WeakPolarHBondContact O-CE2 3.3Å; A117-F121 PolarHBondContact O-N 2.86Å; L119-F121 VanDerWaalsContact C-N 3.26Å; L119-F121 PolarHBondContact O-N 3.14Å
122	R	96.2	Very high	96.9	Very high	112 Å²	112	59.4 Å²	59.4	42%	0.423	30%	0.297	S	S	.	.			trans	-85.6	126.9	-178	-63.5	-68	178.6	178.5	-2.6	109.8	L103 Q118 L119 G120 E124 A127	L103-R122 HydrophobicContact CD2-CG 4.21Å; Q118-R122 WeakPolarHBondContact O-CG 3.47Å; L119-R122 WeakPolarHBondContact O-CB 3.26Å; L119-R122 PolarHBondContact O-N 2.85Å; G120-R122 VanDerWaalsContact C-N 3.32Å; G120-R122 PolarHBondContact O-N 2.84Å; R122-E124 PolarHBondContact O-N 2.85Å; R122-A127 HydrophobicContact CB-CB 3.67Å
123	T	96	Very high	97	Very high	144 Å²	144	59 Å²	59	88%	0.883	30%	0.295	S	S	*	.			trans	-82.3	2.7	177	55.2	0	0	0	0	113.3
124	E	96	Very high	97.1	Very high	70 Å²	70	53.8 Å²	53.8	33%	0.327	27%	0.267	S	S	.	.	S	Bend	trans	-78.6	139.6	-175.4	-58.9	-173.1	176.3	0	0	111.8	R122 G126 A127	R122-E124 PolarHBondContact O-N 2.85Å; E124-G126 PolarHBondContact O-N 2.8Å; E124-G126 VanDerWaalsContact O-N 3.15Å; E124-A127 WeakPolarHBondContact O-CB 3.28Å; E124-A127 PolarHBondContact O-N 2.87Å
125	K	96.7	Very high	97.1	Very high	125 Å²	125	56.3 Å²	56.3	54%	0.543	28%	0.277	S	S	.	.	H	α-helix	trans	-51.9	-38	171.6	-172.6	-167.2	179.8	-165.8	0	112.4	Y95 A127 R128 I129	Y95-K125 HydrophobicContact CD2-CD 4.46Å; Y95-K125 HydrophobicContact CE2-CB 4.16Å; K125-A127 PolarHBondContact O-N 2.83Å; K125-R128 PolarHBondContact O-N 2.89Å; K125-I129 HydrophobicContact CD-CD1 4.23Å; K125-I129 HydrophobicContact CG-CD1 4.02Å; K125-I129 WeakPolarHBondContact O-CG1 3.39Å; K125-I129 PolarHBondContact O-N 3.02Å; K125-I129 VanDerWaalsContact O-N 3.13Å
126	G	97	Very high	97.2	Very high	0 Å²	0	59.1 Å²	59.1	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-62.2	-28.5	179.3	0	0	0	0	0	113.3	E124 L130	E124-G126 PolarHBondContact O-N 2.8Å; E124-G126 VanDerWaalsContact O-N 3.15Å; G126-L130 WeakPolarHBondContact O-CB 3.31Å; G126-L130 PolarHBondContact O-N 2.85Å
127	A	97.8	Very high	97.1	Very high	0 Å²	0	56.6 Å²	56.6	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-70.5	-44.6	177.4	0	0	0	0	0	110.7	L103 L119 R122 E124 K125 I129 L130 E131	L103-A127 HydrophobicContact CD1-CB 4.44Å; L119-A127 HydrophobicContact CB-CB 4.47Å; L119-A127 HydrophobicContact CD2-CB 4.06Å; R122-A127 HydrophobicContact CB-CB 3.67Å; E124-A127 WeakPolarHBondContact O-CB 3.28Å; E124-A127 PolarHBondContact O-N 2.87Å; K125-A127 PolarHBondContact O-N 2.83Å; A127-I129 PolarHBondContact O-N 2.63Å; A127-L130 WeakPolarHBondContact O-CB 3.32Å; A127-L130 PolarHBondContact O-N 3.37Å; A127-E131 WeakPolarHBondContact O-CG 3.44Å; A127-E131 PolarHBondContact O-N 3.2Å
128	R	97.8	Very high	97.1	Very high	107 Å²	107	56.1 Å²	56.1	40%	0.404	27%	0.27	S	S	.	.	H	α-helix	trans	-60.8	-42.8	175.4	-55.9	-54.9	174.8	-154.9	-8.1	112.6	G120 K125 L130 E131 E132	G120-R128 PolarHBondContact O-NH2 3.45Å; K125-R128 PolarHBondContact O-N 2.89Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 2.84Å; R128-E131 WeakPolarHBondContact CD-OE2 3.46Å; R128-E131 IonicContact CZ-OE2 3.73Å; R128-E131 IonicContact NE-OE2 3.89Å; R128-E131 VanDerWaalsContact NH1-CD 3.28Å; R128-E131 IonicContact NH1-OE1 2.95Å; R128-E131 PolarHBondContact NH1-OE1 3.38Å; R128-E131 IonicContact NH1-OE2 2.77Å; R128-E131 PolarHBondContact NH1-OE2 3.1Å; R128-E131 PolarHBondContact O-N 3.01Å; R128-E132 WeakPolarHBondContact O-CG 3.35Å; R128-E132 PolarHBondContact O-N 3.47Å
129	I	97.7	Very high	97.1	Very high	20 Å²	20	59.4 Å²	59.4	10%	0.103	29%	0.285	C	S	.	.	H	α-helix	trans	-62.3	-37.7	174.4	-62.7	163.3	0	0	0	110.9	I93 K125 A127 V133	I93-I129 HydrophobicContact CD1-CG2 3.95Å; I93-I129 HydrophobicContact CG1-CG2 4.29Å; I93-I129 HydrophobicContact CG2-CD1 3.92Å; I93-I129 HydrophobicContact CG2-CG2 3.95Å; K125-I129 HydrophobicContact CD-CD1 4.23Å; K125-I129 HydrophobicContact CG-CD1 4.02Å; K125-I129 WeakPolarHBondContact O-CG1 3.39Å; K125-I129 PolarHBondContact O-N 3.02Å; K125-I129 VanDerWaalsContact O-N 3.13Å; A127-I129 PolarHBondContact O-N 2.63Å; I129-V133 HydrophobicContact CG2-CG2 4.43Å; I129-V133 VanDerWaalsContact O-CG2 3.22Å; I129-V133 WeakPolarHBondContact O-CG2 3.43Å; I129-V133 PolarHBondContact O-N 2.92Å
130	L	97.4	Very high	97	Very high	0 Å²	0	61.2 Å²	61.2	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-72.3	-34.8	179.9	-166.8	68.4	0	0	0	112	L103 V104 I107 L119 G126 A127 R128 V133 L134 L187	L103-L130 HydrophobicContact CB-CD2 4.19Å; V104-L130 HydrophobicContact CG2-CD1 3.69Å; V104-L130 HydrophobicContact CG2-CD2 4.2Å; I107-L130 HydrophobicContact CD1-CD1 4.1Å; I107-L130 HydrophobicContact CD1-CD2 3.39Å; I107-L130 HydrophobicContact CD1-CG 3.84Å; I107-L130 HydrophobicContact CG1-CD2 4.07Å; I107-L130 HydrophobicContact CG2-CD2 4.47Å; L119-L130 HydrophobicContact CD1-CB 4.11Å; L119-L130 HydrophobicContact CD1-CD2 3.85Å; L119-L130 HydrophobicContact CD1-CG 3.94Å; L119-L130 HydrophobicContact CD2-CB 4.36Å; L119-L130 HydrophobicContact CD2-CD2 3.58Å; L119-L130 HydrophobicContact CD2-CG 4.4Å; L119-L130 HydrophobicContact CG-CD2 4.33Å; G126-L130 WeakPolarHBondContact O-CB 3.31Å; G126-L130 PolarHBondContact O-N 2.85Å; A127-L130 WeakPolarHBondContact O-CB 3.32Å; A127-L130 PolarHBondContact O-N 3.37Å; R128-L130 VanDerWaalsContact C-N 3.27Å; R128-L130 PolarHBondContact O-N 2.84Å; L130-V133 PolarHBondContact O-N 3.46Å; L130-L134 VanDerWaalsContact O-CB 3.25Å; L130-L134 WeakPolarHBondContact O-CB 3.42Å; L130-L134 PolarHBondContact O-N 3.22Å; L130-L187 HydrophobicContact CD1-CD1 3.46Å; L130-L187 VanDerWaalsContact CD1-CD1 3.46Å; L130-L187 HydrophobicContact CD1-CD2 4.07Å; L130-L187 HydrophobicContact CD1-CG 4.25Å
131	E	97.7	Very high	97	Very high	27 Å²	27	59.5 Å²	59.5	13%	0.126	28%	0.277	C	S	.	.	H	α-helix	trans	-59.7	-51.9	170.8	-70.3	170	166.4	0	0	110.3	F116 L119 G120 A127 R128 V133 L134 E135	F116-E131 HydrophobicContact CD1-CB 4.46Å; F116-E131 HydrophobicContact CD1-CG 4.14Å; F116-E131 HydrophobicContact CE1-CB 4.17Å; F116-E131 HydrophobicContact CE1-CG 4.34Å; L119-E131 VanDerWaalsContact C-OE1 3.27Å; L119-E131 HydrophobicContact CB-CG 3.74Å; L119-E131 WeakPolarHBondContact CB-OE1 3.37Å; L119-E131 HydrophobicContact CD1-CG 3.95Å; L119-E131 HydrophobicContact CG-CG 4.49Å; G120-E131 WeakPolarHBondContact CA-OE1 3.21Å; G120-E131 PolarHBondContact N-OE1 3.37Å; A127-E131 WeakPolarHBondContact O-CG 3.44Å; A127-E131 PolarHBondContact O-N 3.2Å; R128-E131 WeakPolarHBondContact CD-OE2 3.46Å; R128-E131 IonicContact CZ-OE2 3.73Å; R128-E131 IonicContact NE-OE2 3.89Å; R128-E131 VanDerWaalsContact NH1-CD 3.28Å; R128-E131 IonicContact NH1-OE1 2.95Å; R128-E131 PolarHBondContact NH1-OE1 3.38Å; R128-E131 IonicContact NH1-OE2 2.77Å; R128-E131 PolarHBondContact NH1-OE2 3.1Å; R128-E131 PolarHBondContact O-N 3.01Å; E131-V133 VanDerWaalsContact C-N 3.34Å; E131-V133 PolarHBondContact O-N 3.37Å; E131-L134 PolarHBondContact O-N 3.27Å; E131-L134 VanDerWaalsContact O-N 3.1Å; E131-E135 WeakPolarHBondContact O-CG 3.33Å; E131-E135 PolarHBondContact O-N 3.06Å
132	E	97.9	Very high	96.9	Very high	105 Å²	105	54.2 Å²	54.2	49%	0.491	26%	0.259	S	S	.	.	H	α-helix	trans	-55.3	-46.5	176.7	-69.3	167	-165.2	0	0	112	R128 L134 E135 E136	R128-E132 WeakPolarHBondContact O-CG 3.35Å; R128-E132 PolarHBondContact O-N 3.47Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.05Å; E132-E135 PolarHBondContact O-N 2.86Å; E132-E136 WeakPolarHBondContact O-CG 3.43Å; E132-E136 PolarHBondContact O-N 3.12Å
133	V	98	Very high	96.8	Very high	1 Å²	1	57.1 Å²	57.1	1%	0.006	27%	0.274	C	S	.	.	H	α-helix	trans	-70.2	-29.9	-179.4	177.4	0	0	0	0	112	H88 R90 I129 L130 E131 A137 L187 I189	H88-V133 PolarHBondContact CD2-O 2.63Å; R90-V133 HydrophobicContact CB-CB 4.46Å; R90-V133 HydrophobicContact CB-CG1 3.92Å; R90-V133 HydrophobicContact CB-CG2 3.56Å; R90-V133 HydrophobicContact CG-CG2 3.63Å; I129-V133 HydrophobicContact CG2-CG2 4.43Å; I129-V133 VanDerWaalsContact O-CG2 3.22Å; I129-V133 WeakPolarHBondContact O-CG2 3.43Å; I129-V133 PolarHBondContact O-N 2.92Å; L130-V133 PolarHBondContact O-N 3.46Å; E131-V133 VanDerWaalsContact C-N 3.34Å; E131-V133 PolarHBondContact O-N 3.37Å; V133-A137 WeakPolarHBondContact O-CB 3.4Å; V133-A137 PolarHBondContact O-N 2.5Å; V133-A137 VanDerWaalsContact O-N 3.13Å; V133-L187 HydrophobicContact CB-CD1 4.47Å; V133-L187 HydrophobicContact CG1-CD1 4.39Å; V133-L187 HydrophobicContact CG1-CD2 3.95Å; V133-L187 HydrophobicContact CG2-CD1 4.42Å; V133-I189 HydrophobicContact CB-CD1 4.5Å; V133-I189 HydrophobicContact CG1-CD1 3.75Å; V133-I189 HydrophobicContact CG1-CG1 4.38Å
134	L	97.4	Very high	96.6	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-72.5	-39.5	175.2	-169.9	62.4	0	0	0	110.9	V112 A115 F116 L130 E131 E132 A137 I138 I155 I189 L191	V112-L134 HydrophobicContact CG1-CD2 4.3Å; A115-L134 HydrophobicContact CB-CD2 4.14Å; F116-L134 HydrophobicContact CD2-CD2 4.17Å; F116-L134 HydrophobicContact CE1-CD2 4.3Å; F116-L134 HydrophobicContact CE2-CD2 3.84Å; F116-L134 HydrophobicContact CE2-CG 4.2Å; F116-L134 HydrophobicContact CZ-CB 4.19Å; F116-L134 HydrophobicContact CZ-CD2 3.89Å; F116-L134 HydrophobicContact CZ-CG 4.03Å; L130-L134 VanDerWaalsContact O-CB 3.25Å; L130-L134 WeakPolarHBondContact O-CB 3.42Å; L130-L134 PolarHBondContact O-N 3.22Å; E131-L134 PolarHBondContact O-N 3.27Å; E131-L134 VanDerWaalsContact O-N 3.1Å; E132-L134 VanDerWaalsContact C-N 3.31Å; E132-L134 PolarHBondContact O-N 3.05Å; L134-A137 PolarHBondContact O-N 3.46Å; L134-I138 HydrophobicContact CG-CD1 4.14Å; L134-I138 WeakPolarHBondContact O-CD1 3.24Å; L134-I138 WeakPolarHBondContact O-CG1 3.35Å; L134-I138 PolarHBondContact O-N 3.06Å; L134-I155 HydrophobicContact CD1-CD1 4.11Å; L134-I155 HydrophobicContact CD1-CG1 4.08Å; L134-I155 HydrophobicContact CD2-CD1 4.27Å; L134-I189 HydrophobicContact CD1-CD1 4.37Å; L134-L191 HydrophobicContact CD1-CD2 3.97Å
135	E	97.4	Very high	96.4	Very high	99 Å²	99	55.5 Å²	55.5	46%	0.463	26%	0.257	S	S	.	.	H	α-helix	trans	-58.6	-50.1	171.6	-70.3	172	-178.6	0	0	111.2	F116 E131 E132 A137 I138 E139	F116-E135 HydrophobicContact CE1-CG 3.99Å; F116-E135 HydrophobicContact CZ-CG 3.78Å; E131-E135 WeakPolarHBondContact O-CG 3.33Å; E131-E135 PolarHBondContact O-N 3.06Å; E132-E135 PolarHBondContact O-N 2.86Å; E135-A137 PolarHBondContact O-N 2.94Å; E135-I138 PolarHBondContact O-N 3.22Å; E135-I138 VanDerWaalsContact O-N 3.12Å; E135-E139 WeakPolarHBondContact O-CG 3.5Å; E135-E139 PolarHBondContact O-N 3.25Å
136	E	97.7	Very high	95.9	Very high	59 Å²	59	55.5 Å²	55.5	28%	0.276	26%	0.262	S	S	.	.	H	α-helix	trans	-55.3	-39.9	175.1	-70.6	173.2	-175.7	0	0	112	H88 R90 E132 L140	H88-E136 IonicContact CD2-OE2 2.99Å; H88-E136 IonicContact CE1-OE2 3.11Å; H88-E136 PolarHBondContact CE1-OE2 2.58Å; H88-E136 VanDerWaalsContact NE2-CB 3.33Å; H88-E136 WeakPolarHBondContact NE2-CB 3.34Å; H88-E136 IonicContact NE2-OE2 2.62Å; H88-E136 PolarHBondContact NE2-OE2 3.34Å; R90-E136 WeakPolarHBondContact CD-OE2 3.17Å; R90-E136 IonicContact NE-OE1 3.35Å; R90-E136 PolarHBondContact NE-OE1 3.14Å; R90-E136 IonicContact NE-OE2 3.78Å; E132-E136 WeakPolarHBondContact O-CG 3.43Å; E132-E136 PolarHBondContact O-N 3.12Å; E136-L140 PolarHBondContact O-N 3.48Å; E136-L140 VanDerWaalsContact O-N 3.1Å
137	A	97.1	Very high	95.7	Very high	1 Å²	1	55.9 Å²	55.9	1%	0.008	26%	0.264	C	S	.	.	H	α-helix	trans	-70.3	-37.2	179	0	0	0	0	0	112.8	H88 V133 L134 E135 A141 L191	H88-A137 HydrophobicContact CB-CB 3.67Å; V133-A137 WeakPolarHBondContact O-CB 3.4Å; V133-A137 PolarHBondContact O-N 2.5Å; V133-A137 VanDerWaalsContact O-N 3.13Å; L134-A137 PolarHBondContact O-N 3.46Å; E135-A137 PolarHBondContact O-N 2.94Å; A137-A141 WeakPolarHBondContact O-CB 3.4Å; A137-A141 PolarHBondContact O-N 3.41Å; A137-L191 HydrophobicContact CB-CD1 3.73Å; A137-L191 HydrophobicContact CB-CG 4.33Å
138	I	96.5	Very high	95.2	Very high	38 Å²	38	63.3 Å²	63.3	20%	0.195	30%	0.299	C	S	.	.	H	α-helix	trans	-69.2	-43.4	176.7	-66	157.8	0	0	0	110	V112 F116 L134 E135 L140 A141 V142 L191	V112-I138 HydrophobicContact CG1-CD1 3.43Å; V112-I138 VanDerWaalsContact CG1-CD1 3.43Å; V112-I138 HydrophobicContact CG1-CG1 4.17Å; F116-I138 HydrophobicContact CE2-CD1 3.59Å; F116-I138 HydrophobicContact CZ-CD1 3.91Å; L134-I138 HydrophobicContact CG-CD1 4.14Å; L134-I138 WeakPolarHBondContact O-CD1 3.24Å; L134-I138 WeakPolarHBondContact O-CG1 3.35Å; L134-I138 PolarHBondContact O-N 3.06Å; E135-I138 PolarHBondContact O-N 3.22Å; E135-I138 VanDerWaalsContact O-N 3.12Å; I138-L140 VanDerWaalsContact C-N 3.31Å; I138-L140 PolarHBondContact O-N 3.39Å; I138-A141 PolarHBondContact O-N 2.97Å; I138-A141 VanDerWaalsContact O-N 3.11Å; I138-V142 HydrophobicContact CG2-CG2 4.32Å; I138-V142 WeakPolarHBondContact O-CG2 3.41Å; I138-V142 PolarHBondContact O-N 2.61Å; I138-L191 HydrophobicContact CG1-CD1 4.16Å
139	E	96	Very high	94.8	Very high	134 Å²	134	63.3 Å²	63.3	63%	0.626	30%	0.302	S	S	*	.	H	α-helix	trans	-57.7	-44.6	175.3	-72.7	-177.5	179.5	0	0	111.5	E135 A141 V142 K143	E135-E139 WeakPolarHBondContact O-CG 3.5Å; E135-E139 PolarHBondContact O-N 3.25Å; E139-A141 VanDerWaalsContact C-N 3.34Å; E139-A141 PolarHBondContact O-N 3.48Å; E139-V142 PolarHBondContact O-N 2.95Å; E139-K143 WeakPolarHBondContact O-CB 3.19Å; E139-K143 PolarHBondContact O-N 2.86Å
140	L	95.6	Very high	94.1	Very high	37 Å²	37	66 Å²	66	19%	0.194	32%	0.322	C	S	.	.	H	α-helix	trans	-60.3	-41.9	173.4	-91.5	171.8	0	0	0	112.8	V86 H88 E136 I138 E144	V86-L140 HydrophobicContact CG1-CB 4.33Å; H88-L140 HydrophobicContact CB-CD1 4.35Å; H88-L140 WeakPolarHBondContact ND1-CD1 3.38Å; E136-L140 PolarHBondContact O-N 3.48Å; E136-L140 VanDerWaalsContact O-N 3.1Å; I138-L140 VanDerWaalsContact C-N 3.31Å; I138-L140 PolarHBondContact O-N 3.39Å; L140-E144 HydrophobicContact CD2-CG 4.08Å; L140-E144 WeakPolarHBondContact CD2-OE1 3.45Å; L140-E144 WeakPolarHBondContact CD2-OE2 3.49Å; L140-E144 WeakPolarHBondContact O-CB 3.31Å; L140-E144 PolarHBondContact O-N 3.45Å
141	A	95.8	Very high	93.7	Very high	0 Å²	0	71.2 Å²	71.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-67.2	-39.9	-178.6	0	0	0	0	0	112.9	V86 A137 I138 E139 H145 D146 F147	V86-A141 HydrophobicContact CB-CB 4.2Å; V86-A141 HydrophobicContact CG1-CB 4.33Å; V86-A141 HydrophobicContact CG2-CB 3.79Å; A137-A141 WeakPolarHBondContact O-CB 3.4Å; A137-A141 PolarHBondContact O-N 3.41Å; I138-A141 PolarHBondContact O-N 2.97Å; I138-A141 VanDerWaalsContact O-N 3.11Å; E139-A141 VanDerWaalsContact C-N 3.34Å; E139-A141 PolarHBondContact O-N 3.48Å; A141-H145 CarbonylContact O-C 3.58Å; A141-D146 PolarHBondContact O-N 3.18Å; A141-F147 HydrophobicContact CB-CD1 4.14Å; A141-F147 HydrophobicContact CB-CD2 3.95Å; A141-F147 HydrophobicContact CB-CE1 4.25Å; A141-F147 HydrophobicContact CB-CE2 4.11Å; A141-F147 HydrophobicContact CB-CG 3.98Å; A141-F147 HydrophobicContact CB-CZ 4.23Å; A141-F147 WeakPolarHBondContact O-CD2 3.47Å; A141-F147 PolarHBondContact O-N 3.19Å
142	V	94.6	Very high	93.4	Very high	60 Å²	60	74.5 Å²	74.5	36%	0.364	37%	0.367	S	S	.	.	H	α-helix	trans	-77.4	-37.1	179.9	176.6	0	0	0	0	111.6	I138 E139	I138-V142 HydrophobicContact CG2-CG2 4.32Å; I138-V142 WeakPolarHBondContact O-CG2 3.41Å; I138-V142 PolarHBondContact O-N 2.61Å; E139-V142 PolarHBondContact O-N 2.95Å
143	K	94.5	Very high	93.3	Very high	172 Å²	172	69.8 Å²	69.8	75%	0.748	35%	0.346	S	S	*	.	H	α-helix	trans	-87.6	-38.8	-171.5	-171.7	-178.1	177.2	-172.8	0	114.3	E139	E139-K143 WeakPolarHBondContact O-CB 3.19Å; E139-K143 PolarHBondContact O-N 2.86Å
144	E	92.4	Very high	93.3	Very high	125 Å²	125	71.2 Å²	71.2	58%	0.584	35%	0.351	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.4	-31.5	-171.7	-64.9	-175.6	-177.8	0	0	113.5	L140	L140-E144 HydrophobicContact CD2-CG 4.08Å; L140-E144 WeakPolarHBondContact CD2-OE1 3.45Å; L140-E144 WeakPolarHBondContact CD2-OE2 3.49Å; L140-E144 WeakPolarHBondContact O-CB 3.31Å; L140-E144 PolarHBondContact O-N 3.45Å
145	H	91.9	Very high	93.3	Very high	56 Å²	56	71.2 Å²	71.2	26%	0.259	35%	0.351	S	S	.	.	S	Bend	trans	-109	4.1	-175.3	-62.7	75	0	0	0	113.2	N61 V86 A141 F147	N61-H145 VanDerWaalsContact CB-NE2 3.33Å; N61-H145 WeakPolarHBondContact CB-NE2 2.98Å; V86-H145 HydrophobicContact CG2-CB 3.6Å; V86-H145 VanDerWaalsContact CG2-CG 3.48Å; A141-H145 CarbonylContact O-C 3.58Å; H145-F147 HydrophobicContact CB-CD2 4.22Å; H145-F147 HydrophobicContact CB-CE2 4.25Å; H145-F147 PolarHBondContact O-N 3.39Å
146	D	86	Confident	93.2	Very high	124 Å²	124	67.8 Å²	67.8	66%	0.663	34%	0.335	S	S	*	.			trans	47.3	53.1	174.4	-61.8	-40	0	0	0	113.9	A141 E148	A141-D146 PolarHBondContact O-N 3.18Å; D146-E148 PolarHBondContact O-N 3.3Å; D146-E148 VanDerWaalsContact O-N 3.1Å
147	F	92.1	Very high	93.1	Very high	9 Å²	9	65.4 Å²	65.4	4%	0.039	33%	0.325	C	S	.	.			trans	-56.7	117.5	172	-87.9	-137.5	0	0	0	110	G84 V86 A141 H145 F149 I153 E193	G84-F147 WeakPolarHBondContact O-CZ 3.48Å; V86-F147 HydrophobicContact CB-CE2 4.4Å; V86-F147 HydrophobicContact CB-CZ 4.35Å; V86-F147 HydrophobicContact CG2-CD2 4.18Å; V86-F147 HydrophobicContact CG2-CE2 3.33Å; V86-F147 HydrophobicContact CG2-CZ 3.72Å; A141-F147 HydrophobicContact CB-CD1 4.14Å; A141-F147 HydrophobicContact CB-CD2 3.95Å; A141-F147 HydrophobicContact CB-CE1 4.25Å; A141-F147 HydrophobicContact CB-CE2 4.11Å; A141-F147 HydrophobicContact CB-CG 3.98Å; A141-F147 HydrophobicContact CB-CZ 4.23Å; A141-F147 WeakPolarHBondContact O-CD2 3.47Å; A141-F147 PolarHBondContact O-N 3.19Å; H145-F147 HydrophobicContact CB-CD2 4.22Å; H145-F147 HydrophobicContact CB-CE2 4.25Å; H145-F147 PolarHBondContact O-N 3.39Å; F147-F149 VanDerWaalsContact C-N 3.31Å; F147-F149 PolarHBondContact O-N 2.89Å; F147-I153 HydrophobicContact CD1-CD1 3.73Å; F147-I153 HydrophobicContact CD1-CG1 3.87Å; F147-I153 HydrophobicContact CD1-CG2 4.5Å; F147-I153 HydrophobicContact CE1-CD1 4.37Å; F147-I153 HydrophobicContact CE1-CG1 4.32Å; F147-I153 HydrophobicContact CE1-CG2 4.14Å; F147-E193 HydrophobicContact CD1-CB 4.06Å; F147-E193 HydrophobicContact CD1-CG 4.35Å; F147-E193 HydrophobicContact CE1-CB 3.9Å; F147-E193 HydrophobicContact CZ-CB 4.42Å
148	E	88.3	Confident	93.1	Very high	156 Å²	156	65.5 Å²	65.5	73%	0.729	33%	0.326	S	S	*	.	S	Bend	trans	-64.4	-39.3	-173.4	-60.6	-176.9	171	0	0	111.2	D146 E193	D146-E148 PolarHBondContact O-N 3.3Å; D146-E148 VanDerWaalsContact O-N 3.1Å; E148-E193 PolarHBondContact N-OE1 3.36Å; E148-E193 VanDerWaalsContact N-OE1 3.13Å
149	F	88.9	Confident	93	Very high	106 Å²	106	67.2 Å²	67.2	47%	0.465	33%	0.333	S	S	.	.			trans	-118.8	97.3	-178.7	-58.7	-75.3	0	0	0	112	F147 T151 K152 E193	F147-F149 VanDerWaalsContact C-N 3.31Å; F147-F149 PolarHBondContact O-N 2.89Å; F149-T151 PolarHBondContact O-N 3.49Å; F149-T151 VanDerWaalsContact O-N 3.07Å; F149-K152 HydrophobicContact CB-CB 4Å; F149-K152 HydrophobicContact CB-CG 4.34Å; F149-K152 PolarHBondContact O-N 2.93Å; F149-E193 PolarHBondContact N-OE1 2.77Å
150	C	83	Confident	93.1	Very high	78 Å²	78	62.1 Å²	62.1	53%	0.527	31%	0.31	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-26.5	173.6	-55.7	0	0	0	0	113.4
151	T	88.3	Confident	93	Very high	108 Å²	108	62.8 Å²	62.8	66%	0.663	32%	0.318	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.3	-19	179.5	53.5	0	0	0	0	113.8	F149	F149-T151 PolarHBondContact O-N 3.49Å; F149-T151 VanDerWaalsContact O-N 3.07Å
152	K	92.1	Very high	93	Very high	96 Å²	96	72.7 Å²	72.7	42%	0.417	36%	0.356	S	S	.	.	S	Bend	trans	-113	73.3	-176.2	-68.4	-173.1	176.8	-177.1	0	109.9	F149 E193 G194	F149-K152 HydrophobicContact CB-CB 4Å; F149-K152 HydrophobicContact CB-CG 4.34Å; F149-K152 PolarHBondContact O-N 2.93Å; K152-E193 CarbonylContact O-C 3.53Å; K152-E193 WeakPolarHBondContact O-CA 3.49Å; K152-G194 CarbonylContact C-O 3.36Å; K152-G194 PolarHBondContact O-N 2.95Å
153	I	96.2	Very high	92.9	Very high	6 Å²	6	71 Å²	71	3%	0.031	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	137.3	177.8	-49.7	-178.9	0	0	0	109.1	V112 F147 L191	V112-I153 HydrophobicContact CB-CB 4.47Å; V112-I153 HydrophobicContact CG2-CB 3.83Å; V112-I153 HydrophobicContact CG2-CG2 3.62Å; V112-I153 PolarHBondContact N-O 3.25Å; F147-I153 HydrophobicContact CD1-CD1 3.73Å; F147-I153 HydrophobicContact CD1-CG1 3.87Å; F147-I153 HydrophobicContact CD1-CG2 4.5Å; F147-I153 HydrophobicContact CE1-CD1 4.37Å; F147-I153 HydrophobicContact CE1-CG1 4.32Å; F147-I153 HydrophobicContact CE1-CG2 4.14Å; I153-L191 HydrophobicContact CG2-CB 4.06Å; I153-L191 HydrophobicContact CG2-CD1 4.26Å; I153-L191 HydrophobicContact CG2-CD2 4.43Å; I153-L191 HydrophobicContact CG2-CG 4.48Å
154	W	97.1	Very high	92.8	Very high	31 Å²	31	69.2 Å²	69.2	12%	0.117	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.2	155.5	176	71.5	-75.8	0	0	0	111.8	R110 E156 R192 P196 P197 Y200	R110-W154 WeakPolarHBondContact O-CA 3.39Å; R110-W154 WeakPolarHBondContact O-CB 3.38Å; W154-E156 HydrophobicContact CE3-CB 4.38Å; W154-E156 HydrophobicContact CH2-CB 3.82Å; W154-E156 HydrophobicContact CH2-CG 3.41Å; W154-E156 VanDerWaalsContact CH2-CG 3.41Å; W154-E156 HydrophobicContact CZ2-CB 4.08Å; W154-E156 HydrophobicContact CZ2-CG 3.81Å; W154-E156 VanDerWaalsContact CZ3-CA 3.43Å; W154-E156 HydrophobicContact CZ3-CB 3.99Å; W154-E156 HydrophobicContact CZ3-CG 3.98Å; W154-E156 PolarHBondContact O-N 2.89Å; W154-R192 HydrophobicContact CZ2-CB 4.21Å; W154-R192 PolarHBondContact N-O 3.13Å; W154-R192 PolarHBondContact O-N 3.25Å; W154-P196 HydrophobicContact CB-CB 3.98Å; W154-P196 HydrophobicContact CE3-CB 4.44Å; W154-P196 HydrophobicContact CG-CB 4.36Å; W154-P197 VanDerWaalsContact CE3-CD 3.47Å; W154-P197 HydrophobicContact CE3-CG 4.41Å; W154-P197 HydrophobicContact CH2-CG 3.91Å; W154-P197 HydrophobicContact CZ3-CG 3.74Å; W154-Y200 HydrophobicContact CH2-CE2 4.45Å; W154-Y200 AromaticContact CZ3-CD2 3.89Å; W154-Y200 HydrophobicContact CZ3-CD2 3.89Å; W154-Y200 AromaticContact CZ3-CE2 3.8Å; W154-Y200 HydrophobicContact CZ3-CE2 3.8Å
155	I	97.8	Very high	92.9	Very high	0 Å²	0	67.8 Å²	67.8	0%	0	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.5	100.8	-177.2	-62.6	149.4	0	0	0	108.3	I107 G109 R110 V112 A115 L134 A158 I189 L191	I107-I155 HydrophobicContact CB-CD1 4.07Å; I107-I155 HydrophobicContact CD1-CD1 3.97Å; I107-I155 HydrophobicContact CG1-CD1 4.3Å; G109-I155 WeakPolarHBondContact CA-O 3.49Å; G109-I155 PolarHBondContact N-O 3.34Å; R110-I155 PolarHBondContact O-N 3.38Å; V112-I155 HydrophobicContact CG2-CG1 4.37Å; A115-I155 HydrophobicContact CB-CD1 3.47Å; A115-I155 VanDerWaalsContact CB-CD1 3.47Å; L134-I155 HydrophobicContact CD1-CD1 4.11Å; L134-I155 HydrophobicContact CD1-CG1 4.08Å; L134-I155 HydrophobicContact CD2-CD1 4.27Å; I155-A158 HydrophobicContact CG2-CB 3.93Å; I155-I189 HydrophobicContact CG2-CG2 4.5Å; I155-L191 HydrophobicContact CB-CD2 4.44Å; I155-L191 HydrophobicContact CG1-CD2 3.72Å
156	E	96.4	Very high	93.1	Very high	28 Å²	28	66.7 Å²	66.7	13%	0.131	33%	0.331	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75	-42.7	-177.3	-167.3	-142.6	161.8	0	0	112.2	W154 R190 R192 Y200	W154-E156 HydrophobicContact CE3-CB 4.38Å; W154-E156 HydrophobicContact CH2-CB 3.82Å; W154-E156 HydrophobicContact CH2-CG 3.41Å; W154-E156 VanDerWaalsContact CH2-CG 3.41Å; W154-E156 HydrophobicContact CZ2-CB 4.08Å; W154-E156 HydrophobicContact CZ2-CG 3.81Å; W154-E156 VanDerWaalsContact CZ3-CA 3.43Å; W154-E156 HydrophobicContact CZ3-CB 3.99Å; W154-E156 HydrophobicContact CZ3-CG 3.98Å; W154-E156 PolarHBondContact O-N 2.89Å; E156-R190 PolarHBondContact N-O 2.96Å; E156-R190 IonicContact OE1-CZ 3.51Å; E156-R190 IonicContact OE1-NE 3.42Å; E156-R190 IonicContact OE1-NH2 2.63Å; E156-R190 PolarHBondContact OE1-NH2 3.44Å; E156-R190 IonicContact OE2-CZ 3.82Å; E156-R190 IonicContact OE2-NE 3.65Å; E156-R190 PolarHBondContact OE2-NE 3.1Å; E156-R190 IonicContact OE2-NH2 3.56Å; E156-R190 PolarHBondContact OE2-NH2 3.41Å; E156-R192 HydrophobicContact CB-CB 4.18Å; E156-R192 HydrophobicContact CB-CG 3.8Å; E156-R192 HydrophobicContact CG-CG 4.13Å; E156-R192 IonicContact OE1-CZ 3.76Å; E156-R192 IonicContact OE1-NE 3.49Å; E156-R192 IonicContact OE1-NH2 2.77Å; E156-R192 WeakPolarHBondContact OE2-CD 3.11Å; E156-R192 IonicContact OE2-CZ 3.37Å; E156-R192 IonicContact OE2-NE 3.41Å; E156-R192 PolarHBondContact OE2-NE 3.1Å; E156-R192 IonicContact OE2-NH2 2.72Å; E156-Y200 WeakPolarHBondContact O-CE2 3.15Å; E156-Y200 VanDerWaalsContact O-CZ 3.29Å; E156-Y200 PolarHBondContact O-OH 3.06Å
157	S	95.1	Very high	93.6	Very high	9 Å²	9	62.8 Å²	62.8	6%	0.063	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	137.1	176.9	-78.2	0	0	0	0	110.3	R108 I189 R190	R108-S157 PolarHBondContact NH2-OG 3.11Å; S157-I189 CarbonylContact O-C 3.56Å; S157-R190 PolarHBondContact N-O 2.9Å; S157-R190 PolarHBondContact O-N 2.95Å
158	A	96.6	Very high	93.8	Very high	3 Å²	3	68.9 Å²	68.9	3%	0.025	34%	0.335	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.2	131.3	176.1	0	0	0	0	0	108.7	V104 I155 Y188	V104-A158 HydrophobicContact CG1-CB 3.4Å; V104-A158 VanDerWaalsContact CG1-CB 3.4Å; V104-A158 VanDerWaalsContact CG1-O 3.27Å; V104-A158 WeakPolarHBondContact CG1-O 3.48Å; I155-A158 HydrophobicContact CG2-CB 3.93Å; A158-Y188 CarbonylContact C-O 3.59Å; A158-Y188 VanDerWaalsContact CA-O 3.24Å; A158-Y188 WeakPolarHBondContact CA-O 3.45Å
159	H	95.3	Very high	94.1	Very high	74 Å²	74	65.1 Å²	65.1	34%	0.343	32%	0.319	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	149.4	-171.2	-58.9	-67.2	0	0	0	110.9	Y188	H159-Y188 PolarHBondContact N-O 2.6Å; H159-Y188 PolarHBondContact O-N 2.87Å
160	V	97	Very high	94.3	Very high	26 Å²	26	64.5 Å²	64.5	16%	0.158	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	125.5	174.2	179.5	0	0	0	0	108	L100 W101 V104 N186	L100-V160 HydrophobicContact CB-CG1 4.15Å; L100-V160 HydrophobicContact CB-CG2 4.09Å; L100-V160 HydrophobicContact CD2-CG1 4.05Å; L100-V160 HydrophobicContact CD2-CG2 4.1Å; L100-V160 HydrophobicContact CG-CG1 4.42Å; L100-V160 HydrophobicContact CG-CG2 3.88Å; W101-V160 HydrophobicContact CB-CB 4.25Å; W101-V160 HydrophobicContact CB-CG2 4.36Å; V104-V160 HydrophobicContact CB-CG2 4.01Å; V104-V160 HydrophobicContact CG1-CG2 4.35Å; V104-V160 HydrophobicContact CG2-CG2 3.6Å; V160-N186 WeakPolarHBondContact CA-O 3.35Å
161	S	94.8	Very high	94.8	Very high	51 Å²	51	68.8 Å²	68.8	36%	0.357	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	157.4	172.6	-167.8	0	0	0	0	111	G163 T185 N186	S161-G163 PolarHBondContact O-N 3.12Å; S161-T185 WeakPolarHBondContact O-CA 3.46Å; S161-N186 PolarHBondContact N-O 3.34Å; S161-N186 PolarHBondContact O-N 3.37Å
162	R	94.1	Very high	95.1	Very high	209 Å²	209	64.6 Å²	64.6	79%	0.789	30%	0.303	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.9	120.7	168.6	-69.9	-177.2	178.2	157.6	1.4	108
163	G	92.9	Very high	95.1	Very high	24 Å²	24	66.7 Å²	66.7	25%	0.247	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.8	-153.7	174.2	0	0	0	0	0	111.3	S161 Y184	S161-G163 PolarHBondContact O-N 3.12Å; G163-Y184 WeakPolarHBondContact CA-O 3.14Å; G163-Y184 PolarHBondContact N-O 3.02Å
164	R	93.3	Very high	94.8	Very high	134 Å²	134	76.8 Å²	76.8	51%	0.506	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	155.4	177.3	63.9	-178.6	171.5	133.8	-5.2	112.3	D92 Y184	D92-R164 VanDerWaalsContact CG-NE 3.28Å; D92-R164 WeakPolarHBondContact OD1-CG 3.34Å; D92-R164 IonicContact OD1-CZ 3.89Å; D92-R164 IonicContact OD1-NE 2.93Å; D92-R164 PolarHBondContact OD1-NE 2.95Å; D92-R164 IonicContact OD1-NH2 3.95Å; D92-R164 IonicContact OD2-CZ 3.26Å; D92-R164 VanDerWaalsContact OD2-CZ 3.26Å; D92-R164 IonicContact OD2-NE 2.96Å; D92-R164 PolarHBondContact OD2-NE 3.16Å; D92-R164 IonicContact OD2-NH2 2.77Å; D92-R164 PolarHBondContact OD2-NH2 2.95Å; R164-Y184 HydrophobicContact CG-CD2 4.02Å; R164-Y184 HydrophobicContact CG-CG 4.3Å; R164-Y184 WeakPolarHBondContact O-CB 3.5Å; R164-Y184 PolarHBondContact O-N 3.02Å
165	M	95	Very high	94.4	Very high	95 Å²	95	80 Å²	80	47%	0.468	38%	0.383	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	122.8	173.3	-173.4	178.9	76.5	0	0	108.7	N181 F182 H183	M165-N181 HydrophobicContact CE-CB 4.42Å; M165-N181 HydrophobicContact CG-CB 3.59Å; M165-N181 HydrophobicContact SD-CB 3.58Å; M165-N181 VanDerWaalsContact SD-CB 3.58Å; M165-N181 VanDerWaalsContact SD-CG 3.55Å; M165-N181 PolarHBondContact SD-ND2 3.41Å; M165-N181 VanDerWaalsContact SD-ND2 3.4Å; M165-F182 CarbonylContact C-O 3.5Å; M165-F182 WeakPolarHBondContact CA-O 3.33Å; M165-H183 PolarHBondContact SD-CE1 2.86Å
166	V	94.9	Very high	94.3	Very high	34 Å²	34	83.5 Å²	83.5	21%	0.206	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	110.3	177.9	-177.8	0	0	0	0	108.7	R168 F182 Y184	V166-R168 PolarHBondContact O-N 2.95Å; V166-F182 HydrophobicContact CB-CB 4.44Å; V166-F182 PolarHBondContact N-O 2.87Å; V166-F182 PolarHBondContact O-N 3.15Å; V166-Y184 HydrophobicContact CB-CE2 4.27Å; V166-Y184 HydrophobicContact CG2-CD2 4.2Å; V166-Y184 HydrophobicContact CG2-CE2 3.73Å
167	P	95.8	Very high	94.2	Very high	42 Å²	42	86.9 Å²	86.9	27%	0.273	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.6	129.5	175.1	29	-34	0	0	0	110.3	L31 M179 N181	L31-P167 HydrophobicContact CD2-CG 4Å; P167-M179 HydrophobicContact CB-CG 4.24Å; P167-M179 HydrophobicContact CB-SD 3.93Å; P167-N181 VanDerWaalsContact CA-OD1 3.31Å; P167-N181 WeakPolarHBondContact CA-OD1 3.49Å; P167-N181 WeakPolarHBondContact CB-OD1 3.47Å
168	R	96.1	Very high	94.2	Very high	136 Å²	136	90.2 Å²	90.2	51%	0.513	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	111.8	167.6	-177.8	-172.8	-179	-168	1.8	108.2	V166 M179 I180 F182	V166-R168 PolarHBondContact O-N 2.95Å; R168-M179 WeakPolarHBondContact O-CA 3.25Å; R168-I180 WeakPolarHBondContact CA-O 3.42Å; R168-I180 VanDerWaalsContact CB-O 3.3Å; R168-I180 WeakPolarHBondContact CB-O 3.12Å; R168-I180 PolarHBondContact N-O 3.23Å; R168-I180 PolarHBondContact O-N 3.09Å; R168-F182 HydrophobicContact CB-CD2 4.18Å; R168-F182 HydrophobicContact CB-CE2 3.74Å; R168-F182 HydrophobicContact CG-CE2 4.18Å
169	L	95.2	Very high	94.1	Very high	78 Å²	78	95.6 Å²	95.6	41%	0.408	47%	0.467	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	136.5	167.8	-61.4	-169.8	0	0	0	110	I29 V177 H178 M179	I29-L169 HydrophobicContact CD1-CD1 3.19Å; I29-L169 HydrophobicContact CD1-CG 3.98Å; L169-V177 HydrophobicContact CB-CG1 4.32Å; L169-V177 HydrophobicContact CD1-CG1 4.4Å; L169-V177 HydrophobicContact CD2-CG1 4.37Å; L169-H178 WeakPolarHBondContact CA-O 3.37Å; L169-M179 HydrophobicContact CD2-CB 3.55Å; L169-M179 HydrophobicContact CD2-CG 3.62Å; L169-M179 HydrophobicContact CD2-SD 3.91Å
170	Y	93.3	Very high	94.1	Very high	92 Å²	92	95.8 Å²	95.8	36%	0.361	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	149.6	171.1	66.6	-78.7	0	0	0	110.3	G172 H178 I180	Y170-G172 PolarHBondContact O-N 3.48Å; Y170-H178 HydrophobicContact CD1-CB 4.07Å; Y170-H178 HydrophobicContact CD2-CB 4.32Å; Y170-H178 HydrophobicContact CE1-CB 3.42Å; Y170-H178 VanDerWaalsContact CE1-CB 3.42Å; Y170-H178 HydrophobicContact CE2-CB 3.75Å; Y170-H178 AromaticContact CE2-CD2 3.95Å; Y170-H178 HydrophobicContact CG-CB 4.47Å; Y170-H178 AromaticContact CZ-CG 3.93Å; Y170-H178 PolarHBondContact N-O 3.49Å; Y170-H178 PolarHBondContact O-N 2.77Å; Y170-H178 WeakPolarHBondContact OH-CB 3.21Å; Y170-I180 HydrophobicContact CD1-CD1 4.31Å; Y170-I180 HydrophobicContact CE1-CB 4.33Å; Y170-I180 HydrophobicContact CE1-CD1 3.38Å; Y170-I180 HydrophobicContact CE1-CG1 3.68Å
171	K	94.5	Very high	94	Very high	168 Å²	168	96.6 Å²	96.6	73%	0.73	47%	0.473	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.9	119.8	176.8	-174.9	179.8	176.7	-175.9	0	109
172	G	92.9	Very high	94	Very high	21 Å²	21	97.8 Å²	97.8	22%	0.216	47%	0.472	C	S	.	.			trans	-86.9	-163.7	168.7	0	0	0	0	0	113.1	Y170 V176	Y170-G172 PolarHBondContact O-N 3.48Å; G172-V176 WeakPolarHBondContact CA-O 3.39Å; G172-V176 PolarHBondContact N-O 3.37Å
173	L	92.9	Very high	94.1	Very high	140 Å²	140	92.8 Å²	92.8	73%	0.733	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-66.6	146.6	178.5	-174.8	61.6	0	0	0	111.2	S175 V176	L173-S175 VanDerWaalsContact C-N 3.33Å; L173-S175 PolarHBondContact O-N 3.48Å; L173-V176 WeakPolarHBondContact O-CB 3.35Å; L173-V176 WeakPolarHBondContact O-CG2 3.46Å; L173-V176 PolarHBondContact O-N 3.03Å; L173-V176 VanDerWaalsContact O-N 3.12Å
174	R	90.8	Very high	94.3	Very high	218 Å²	218	93.9 Å²	93.9	82%	0.823	45%	0.454	S	S	*	.	G	3₁₀ helix	trans	49.3	47.8	173.3	-69.6	172.1	-174.6	178.6	2.2	113.8	V176	R174-V176 PolarHBondContact O-N 2.94Å; R174-V176 VanDerWaalsContact O-N 3.14Å
175	S	88.6	Confident	94.4	Very high	98 Å²	98	87.5 Å²	87.5	69%	0.685	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	63.6	11.6	177.5	68.1	0	0	0	0	116.5	L173 V177	L173-S175 VanDerWaalsContact C-N 3.33Å; L173-S175 PolarHBondContact O-N 3.48Å; S175-V177 PolarHBondContact O-N 3.38Å
176	V	94.8	Very high	94.5	Very high	73 Å²	73	83.8 Å²	83.8	44%	0.442	41%	0.412	S	S	.	.			trans	-69.1	128.2	170.8	-180	0	0	0	0	108.9	G172 L173 R174	G172-V176 WeakPolarHBondContact CA-O 3.39Å; G172-V176 PolarHBondContact N-O 3.37Å; L173-V176 WeakPolarHBondContact O-CB 3.35Å; L173-V176 WeakPolarHBondContact O-CG2 3.46Å; L173-V176 PolarHBondContact O-N 3.03Å; L173-V176 VanDerWaalsContact O-N 3.12Å; R174-V176 PolarHBondContact O-N 2.94Å; R174-V176 VanDerWaalsContact O-N 3.14Å
177	V	93.9	Very high	94.6	Very high	99 Å²	99	82.1 Å²	82.1	60%	0.6	40%	0.402	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-95.2	123.9	172	-179.2	0	0	0	0	108	L169 S175	L169-V177 HydrophobicContact CB-CG1 4.32Å; L169-V177 HydrophobicContact CD1-CG1 4.4Å; L169-V177 HydrophobicContact CD2-CG1 4.37Å; S175-V177 PolarHBondContact O-N 3.38Å
178	H	95.6	Very high	94.7	Very high	79 Å²	79	81.7 Å²	81.7	37%	0.366	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.5	152	173.8	-63.9	-76.8	0	0	0	110.1	L169 Y170	L169-H178 WeakPolarHBondContact CA-O 3.37Å; Y170-H178 HydrophobicContact CD1-CB 4.07Å; Y170-H178 HydrophobicContact CD2-CB 4.32Å; Y170-H178 HydrophobicContact CE1-CB 3.42Å; Y170-H178 VanDerWaalsContact CE1-CB 3.42Å; Y170-H178 HydrophobicContact CE2-CB 3.75Å; Y170-H178 AromaticContact CE2-CD2 3.95Å; Y170-H178 HydrophobicContact CG-CB 4.47Å; Y170-H178 AromaticContact CZ-CG 3.93Å; Y170-H178 PolarHBondContact N-O 3.49Å; Y170-H178 PolarHBondContact O-N 2.77Å; Y170-H178 WeakPolarHBondContact OH-CB 3.21Å
179	M	94.9	Very high	94.7	Very high	117 Å²	117	75.2 Å²	75.2	58%	0.576	37%	0.371	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-122.3	123.7	176.5	-175.6	168.2	67.3	0	0	109.3	P167 R168 L169	P167-M179 HydrophobicContact CB-CG 4.24Å; P167-M179 HydrophobicContact CB-SD 3.93Å; R168-M179 WeakPolarHBondContact O-CA 3.25Å; L169-M179 HydrophobicContact CD2-CB 3.55Å; L169-M179 HydrophobicContact CD2-CG 3.62Å; L169-M179 HydrophobicContact CD2-SD 3.91Å
180	I	94.6	Very high	94.8	Very high	77 Å²	77	74.2 Å²	74.2	40%	0.395	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.2	131.1	167.5	-73.3	163.1	0	0	0	107.4	R168 Y170	R168-I180 WeakPolarHBondContact CA-O 3.42Å; R168-I180 VanDerWaalsContact CB-O 3.3Å; R168-I180 WeakPolarHBondContact CB-O 3.12Å; R168-I180 PolarHBondContact N-O 3.23Å; R168-I180 PolarHBondContact O-N 3.09Å; Y170-I180 HydrophobicContact CD1-CD1 4.31Å; Y170-I180 HydrophobicContact CE1-CB 4.33Å; Y170-I180 HydrophobicContact CE1-CD1 3.38Å; Y170-I180 HydrophobicContact CE1-CG1 3.68Å
181	N	94.7	Very high	95	Very high	44 Å²	44	69.9 Å²	69.9	24%	0.235	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.5	126.2	179	-68.5	-30.6	0	0	0	110.3	M165 P167 H183	M165-N181 HydrophobicContact CE-CB 4.42Å; M165-N181 HydrophobicContact CG-CB 3.59Å; M165-N181 HydrophobicContact SD-CB 3.58Å; M165-N181 VanDerWaalsContact SD-CB 3.58Å; M165-N181 VanDerWaalsContact SD-CG 3.55Å; M165-N181 PolarHBondContact SD-ND2 3.41Å; M165-N181 VanDerWaalsContact SD-ND2 3.4Å; P167-N181 VanDerWaalsContact CA-OD1 3.31Å; P167-N181 WeakPolarHBondContact CA-OD1 3.49Å; P167-N181 WeakPolarHBondContact CB-OD1 3.47Å; N181-H183 PolarHBondContact O-CD2 2.82Å; N181-H183 VanDerWaalsContact O-CD2 3.29Å
182	F	95.4	Very high	95.1	Very high	75 Å²	75	64.5 Å²	64.5	33%	0.329	32%	0.32	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.1	119.6	165.5	-65	-67.3	0	0	0	108.8	L94 M165 V166 R168 Y184	L94-F182 HydrophobicContact CD1-CB 4.2Å; L94-F182 HydrophobicContact CD1-CD1 4.29Å; M165-F182 CarbonylContact C-O 3.5Å; M165-F182 WeakPolarHBondContact CA-O 3.33Å; V166-F182 HydrophobicContact CB-CB 4.44Å; V166-F182 PolarHBondContact N-O 2.87Å; V166-F182 PolarHBondContact O-N 3.15Å; R168-F182 HydrophobicContact CB-CD2 4.18Å; R168-F182 HydrophobicContact CB-CE2 3.74Å; R168-F182 HydrophobicContact CG-CE2 4.18Å; F182-Y184 HydrophobicContact CB-CE2 4.08Å
183	H	95.4	Very high	95.1	Very high	104 Å²	104	65 Å²	65	48%	0.481	32%	0.317	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.4	118	177.6	-63.5	-80.6	0	0	0	108.9	M165 N181	M165-H183 PolarHBondContact SD-CE1 2.86Å; N181-H183 PolarHBondContact O-CD2 2.82Å; N181-H183 VanDerWaalsContact O-CD2 3.29Å
184	Y	97.3	Very high	95.2	Very high	47 Å²	47	59.5 Å²	59.5	18%	0.184	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94	160	170.9	-68.2	-90.9	0	0	0	110.5	D92 I93 L94 G163 R164 V166 F182	D92-Y184 HydrophobicContact CB-CD1 4.26Å; D92-Y184 VanDerWaalsContact O-CD1 3.27Å; D92-Y184 WeakPolarHBondContact O-CD1 3.41Å; I93-Y184 CarbonylContact O-C 3.56Å; I93-Y184 WeakPolarHBondContact O-CA 3.32Å; L94-Y184 HydrophobicContact CB-CD1 4.12Å; L94-Y184 HydrophobicContact CB-CE1 3.83Å; L94-Y184 HydrophobicContact CD1-CD1 4.31Å; L94-Y184 HydrophobicContact CD1-CE1 4Å; L94-Y184 HydrophobicContact CD1-CE2 4.41Å; L94-Y184 HydrophobicContact CG-CE1 4.42Å; G163-Y184 WeakPolarHBondContact CA-O 3.14Å; G163-Y184 PolarHBondContact N-O 3.02Å; R164-Y184 HydrophobicContact CG-CD2 4.02Å; R164-Y184 HydrophobicContact CG-CG 4.3Å; R164-Y184 WeakPolarHBondContact O-CB 3.5Å; R164-Y184 PolarHBondContact O-N 3.02Å; V166-Y184 HydrophobicContact CB-CE2 4.27Å; V166-Y184 HydrophobicContact CG2-CD2 4.2Å; V166-Y184 HydrophobicContact CG2-CE2 3.73Å; F182-Y184 HydrophobicContact CB-CE2 4.08Å
185	T	96.5	Very high	95.3	Very high	0 Å²	0	54.7 Å²	54.7	0%	0	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	148	-176.9	58.2	0	0	0	0	111.1	D92 I93 Y95 S97 S161	D92-T185 PolarHBondContact N-O 3.45Å; I93-T185 WeakPolarHBondContact CB-O 2.9Å; I93-T185 WeakPolarHBondContact CB-OG1 3.41Å; I93-T185 PolarHBondContact N-O 2.94Å; I93-T185 PolarHBondContact O-N 3.13Å; I93-T185 PolarHBondContact O-OG1 2.86Å; Y95-T185 WeakPolarHBondContact O-CG2 3.47Å; S97-T185 VanDerWaalsContact CA-CG2 3.48Å; S97-T185 WeakPolarHBondContact OG-CG2 3.33Å; S161-T185 WeakPolarHBondContact O-CA 3.46Å
186	N	96	Very high	95.6	Very high	17 Å²	17	52.2 Å²	52.2	9%	0.091	27%	0.265	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	137.2	177.2	-58.4	-7.3	0	0	0	107.9	R89 R90 D91 D92 V160 S161 Y188	R89-N186 PolarHBondContact NH2-ND2 3.35Å; R90-N186 CarbonylContact O-C 3.6Å; R90-N186 WeakPolarHBondContact O-CA 3.33Å; D91-N186 VanDerWaalsContact OD1-CB 3.26Å; D91-N186 WeakPolarHBondContact OD1-CB 3.23Å; D91-N186 PolarHBondContact OD1-ND2 3.09Å; D91-N186 PolarHBondContact OD1-OD1 2.78Å; D92-N186 PolarHBondContact N-OD1 2.64Å; V160-N186 WeakPolarHBondContact CA-O 3.35Å; S161-N186 PolarHBondContact N-O 3.34Å; S161-N186 PolarHBondContact O-N 3.37Å; N186-Y188 HydrophobicContact CB-CE2 3.67Å
187	L	96.9	Very high	95.5	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117	130.7	-175.1	-159.7	166.4	0	0	0	108.1	R89 R90 I93 L100 L130 V133 I189	R89-L187 CarbonylContact C-O 3.52Å; R89-L187 VanDerWaalsContact CA-O 3.23Å; R89-L187 WeakPolarHBondContact CA-O 3.42Å; R89-L187 WeakPolarHBondContact CG-O 3.43Å; R90-L187 HydrophobicContact CB-CB 4.44Å; R90-L187 PolarHBondContact N-O 3.25Å; R90-L187 PolarHBondContact O-N 2.78Å; I93-L187 HydrophobicContact CD1-CB 3.69Å; I93-L187 HydrophobicContact CD1-CD1 3.98Å; L100-L187 HydrophobicContact CD1-CD1 4.37Å; L100-L187 HydrophobicContact CD2-CD1 3.99Å; L100-L187 HydrophobicContact CD2-CG 4.42Å; L100-L187 HydrophobicContact CG-CD1 4.35Å; L130-L187 HydrophobicContact CD1-CD1 3.46Å; L130-L187 VanDerWaalsContact CD1-CD1 3.46Å; L130-L187 HydrophobicContact CD1-CD2 4.07Å; L130-L187 HydrophobicContact CD1-CG 4.25Å; V133-L187 HydrophobicContact CB-CD1 4.47Å; V133-L187 HydrophobicContact CG1-CD1 4.39Å; V133-L187 HydrophobicContact CG1-CD2 3.95Å; V133-L187 HydrophobicContact CG2-CD1 4.42Å; L187-I189 HydrophobicContact CD2-CD1 3.65Å; L187-I189 HydrophobicContact CD2-CG1 3.28Å
188	Y	97.4	Very high	95.1	Very high	32 Å²	32	56.6 Å²	56.6	13%	0.125	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.2	-178.1	-54.7	-101.7	0	0	0	107.8	W57 R89 A158 H159 N186	W57-Y188 HydrophobicContact CB-CD1 3.88Å; W57-Y188 HydrophobicContact CB-CE1 4.18Å; W57-Y188 AromaticContact CD1-CD1 3.94Å; W57-Y188 AromaticContact CD2-CD1 3.9Å; W57-Y188 HydrophobicContact CD2-CD1 3.9Å; W57-Y188 HydrophobicContact CE3-CD1 4.49Å; W57-Y188 AromaticContact CG-CD1 3.62Å; W57-Y188 HydrophobicContact CG-CD1 3.62Å; W57-Y188 HydrophobicContact CG-CE1 4.4Å; R89-Y188 HydrophobicContact CB-CD1 4.23Å; R89-Y188 HydrophobicContact CG-CD1 3.76Å; R89-Y188 HydrophobicContact CG-CE1 3.78Å; R89-Y188 HydrophobicContact CG-CG 4.37Å; R89-Y188 PolarHBondContact NE-OH 3.45Å; R89-Y188 PolarHBondContact NH1-OH 2.9Å; R89-Y188 PolarHBondContact NH2-OH 3.24Å; A158-Y188 CarbonylContact C-O 3.59Å; A158-Y188 VanDerWaalsContact CA-O 3.24Å; A158-Y188 WeakPolarHBondContact CA-O 3.45Å; H159-Y188 PolarHBondContact N-O 2.6Å; H159-Y188 PolarHBondContact O-N 2.87Å; N186-Y188 HydrophobicContact CB-CE2 3.67Å
189	I	97.6	Very high	94.6	Very high	1 Å²	1	57.6 Å²	57.6	1%	0.005	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	140.4	177.3	-55.8	-172.5	0	0	0	108.1	W57 T87 H88 V133 L134 I155 S157 L187 L191	W57-I189 PolarHBondContact NE1-O 3.19Å; W57-I189 VanDerWaalsContact NE1-O 3.14Å; T87-I189 WeakPolarHBondContact CA-O 3.08Å; H88-I189 PolarHBondContact N-O 2.99Å; H88-I189 PolarHBondContact O-N 3.13Å; H88-I189 VanDerWaalsContact O-O 3.11Å; V133-I189 HydrophobicContact CB-CD1 4.5Å; V133-I189 HydrophobicContact CG1-CD1 3.75Å; V133-I189 HydrophobicContact CG1-CG1 4.38Å; L134-I189 HydrophobicContact CD1-CD1 4.37Å; I155-I189 HydrophobicContact CG2-CG2 4.5Å; S157-I189 CarbonylContact O-C 3.56Å; L187-I189 HydrophobicContact CD2-CD1 3.65Å; L187-I189 HydrophobicContact CD2-CG1 3.28Å; I189-L191 HydrophobicContact CG2-CD2 3.79Å; I189-L191 HydrophobicContact CG2-CG 4.1Å
190	R	97.5	Very high	94.3	Very high	57 Å²	57	54.3 Å²	54.3	22%	0.215	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.3	117.2	165.4	-170.2	164.9	68.5	-175.6	10.5	108.7	W57 V86 T87 E156 S157	W57-R190 HydrophobicContact CH2-CB 4.34Å; W57-R190 HydrophobicContact CZ2-CB 3.89Å; V86-R190 CarbonylContact O-C 3.53Å; V86-R190 VanDerWaalsContact O-CA 3.24Å; V86-R190 WeakPolarHBondContact O-CA 3.45Å; T87-R190 HydrophobicContact CG2-CB 4.23Å; T87-R190 HydrophobicContact CG2-CG 3.81Å; E156-R190 PolarHBondContact N-O 2.96Å; E156-R190 IonicContact OE1-CZ 3.51Å; E156-R190 IonicContact OE1-NE 3.42Å; E156-R190 IonicContact OE1-NH2 2.63Å; E156-R190 PolarHBondContact OE1-NH2 3.44Å; E156-R190 IonicContact OE2-CZ 3.82Å; E156-R190 IonicContact OE2-NE 3.65Å; E156-R190 PolarHBondContact OE2-NE 3.1Å; E156-R190 IonicContact OE2-NH2 3.56Å; E156-R190 PolarHBondContact OE2-NH2 3.41Å; S157-R190 PolarHBondContact N-O 2.9Å; S157-R190 PolarHBondContact O-N 2.95Å
191	L	97.5	Very high	93.7	Very high	0 Å²	0	51.9 Å²	51.9	0%	0	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.6	146.7	174	-60.7	-177.6	0	0	0	109.2	E85 V86 V112 L134 A137 I138 I153 I155 I189	E85-L191 VanDerWaalsContact CA-O 3.3Å; E85-L191 WeakPolarHBondContact CA-O 3.26Å; V86-L191 PolarHBondContact N-O 3.06Å; V86-L191 PolarHBondContact O-N 2.63Å; V112-L191 HydrophobicContact CG2-CD2 4.27Å; L134-L191 HydrophobicContact CD1-CD2 3.97Å; A137-L191 HydrophobicContact CB-CD1 3.73Å; A137-L191 HydrophobicContact CB-CG 4.33Å; I138-L191 HydrophobicContact CG1-CD1 4.16Å; I153-L191 HydrophobicContact CG2-CB 4.06Å; I153-L191 HydrophobicContact CG2-CD1 4.26Å; I153-L191 HydrophobicContact CG2-CD2 4.43Å; I153-L191 HydrophobicContact CG2-CG 4.48Å; I155-L191 HydrophobicContact CB-CD2 4.44Å; I155-L191 HydrophobicContact CG1-CD2 3.72Å; I189-L191 HydrophobicContact CG2-CD2 3.79Å; I189-L191 HydrophobicContact CG2-CG 4.1Å
192	R	95.6	Very high	92.7	Very high	56 Å²	56	54.7 Å²	54.7	21%	0.211	27%	0.272	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	147.3	168.6	-78.1	-162.3	178.2	-159.6	-3.5	110.7	G84 E85 W154 E156	G84-R192 CarbonylContact O-C 3.54Å; G84-R192 VanDerWaalsContact O-CA 3.28Å; G84-R192 WeakPolarHBondContact O-CA 3.42Å; E85-R192 HydrophobicContact CB-CG 3.93Å; E85-R192 IonicContact OE2-CZ 3.84Å; E85-R192 IonicContact OE2-NE 3.82Å; E85-R192 PolarHBondContact OE2-NE 2.96Å; E85-R192 IonicContact OE2-NH2 2.65Å; E85-R192 PolarHBondContact OE2-NH2 3.31Å; W154-R192 HydrophobicContact CZ2-CB 4.21Å; W154-R192 PolarHBondContact N-O 3.13Å; W154-R192 PolarHBondContact O-N 3.25Å; E156-R192 HydrophobicContact CB-CB 4.18Å; E156-R192 HydrophobicContact CB-CG 3.8Å; E156-R192 HydrophobicContact CG-CG 4.13Å; E156-R192 IonicContact OE1-CZ 3.76Å; E156-R192 IonicContact OE1-NE 3.49Å; E156-R192 IonicContact OE1-NH2 2.77Å; E156-R192 WeakPolarHBondContact OE2-CD 3.11Å; E156-R192 IonicContact OE2-CZ 3.37Å; E156-R192 IonicContact OE2-NE 3.41Å; E156-R192 PolarHBondContact OE2-NE 3.1Å; E156-R192 IonicContact OE2-NH2 2.72Å
193	E	94.2	Very high	91.4	Very high	32 Å²	32	57 Å²	57	15%	0.15	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.7	148.5	171.7	-165.4	168	-161.6	0	0	111	P83 G84 F147 E148 F149 K152	P83-E193 HydrophobicContact CB-CB 4.48Å; P83-E193 WeakPolarHBondContact CB-O 3.3Å; G84-E193 PolarHBondContact O-N 3.48Å; F147-E193 HydrophobicContact CD1-CB 4.06Å; F147-E193 HydrophobicContact CD1-CG 4.35Å; F147-E193 HydrophobicContact CE1-CB 3.9Å; F147-E193 HydrophobicContact CZ-CB 4.42Å; E148-E193 PolarHBondContact N-OE1 3.36Å; E148-E193 VanDerWaalsContact N-OE1 3.13Å; F149-E193 PolarHBondContact N-OE1 2.77Å; K152-E193 CarbonylContact O-C 3.53Å; K152-E193 WeakPolarHBondContact O-CA 3.49Å
194	G	93.8	Very high	90	Very high	23 Å²	23	55.8 Å²	55.8	24%	0.237	28%	0.282	C	S	.	.	S	Bend	trans	107.8	-168.6	179.8	0	0	0	0	0	114.4	K152	K152-G194 CarbonylContact C-O 3.36Å; K152-G194 PolarHBondContact O-N 2.95Å
195	D	93.1	Very high	88.4	Confident	117 Å²	117	56.9 Å²	56.9	63%	0.626	29%	0.29	S	S	*	.	P	Polyproline II helix	trans	-85.6	146.2	178.8	-64.7	-55.6	0	0	0	111.4
196	P	94.7	Very high	86.5	Confident	47 Å²	47	65.7 Å²	65.7	31%	0.305	33%	0.329	S	S	.	.	P	Polyproline II helix	trans	-62.8	146.5	175.1	27	-34.6	0	0	0	111.3	G109 W154	G109-P196 VanDerWaalsContact O-CB 3.32Å; G109-P196 WeakPolarHBondContact O-CB 3.17Å; W154-P196 HydrophobicContact CB-CB 3.98Å; W154-P196 HydrophobicContact CE3-CB 4.44Å; W154-P196 HydrophobicContact CG-CB 4.36Å
197	P	92.2	Very high	84.7	Confident	53 Å²	53	68.1 Å²	68.1	34%	0.344	36%	0.358	S	S	.	.	P	Polyproline II helix	trans	-67.6	143.4	178.9	28.4	-34.2	0	0	0	111	W154 I199 Y200	W154-P197 VanDerWaalsContact CE3-CD 3.47Å; W154-P197 HydrophobicContact CE3-CG 4.41Å; W154-P197 HydrophobicContact CH2-CG 3.91Å; W154-P197 HydrophobicContact CZ3-CG 3.74Å; P197-I199 PolarHBondContact O-N 3.15Å; P197-I199 VanDerWaalsContact O-N 3.15Å; P197-Y200 HydrophobicContact CG-CD2 3.76Å
198	K	86.8	Confident	82.6	Confident	211 Å²	211	71.9 Å²	71.9	92%	0.917	38%	0.381	S	S	*	.	S	Bend	trans	-58.5	-29.7	178.9	-65.9	-179	-179.1	177.5	0	113.9
199	I	85.3	Confident	80.2	Confident	99 Å²	99	81 Å²	81	51%	0.508	42%	0.415	S	S	.	.			trans	-130	109.6	178	-57.4	173.4	0	0	0	105.2	P197 I205	P197-I199 PolarHBondContact O-N 3.15Å; P197-I199 VanDerWaalsContact O-N 3.15Å; I199-I205 HydrophobicContact CG2-CG1 4.03Å
200	Y	88.6	Confident	77.8	Confident	48 Å²	48	85.9 Å²	85.9	19%	0.188	45%	0.445	C	S	.	.			trans	-101.9	-48.9	176.2	-175	-93.9	0	0	0	110.4	R108 W154 E156 P197 E204	R108-Y200 HydrophobicContact CB-CE1 4.03Å; R108-Y200 WeakPolarHBondContact CD-OH 3.38Å; R108-Y200 HydrophobicContact CG-CD1 4.5Å; R108-Y200 HydrophobicContact CG-CE1 3.48Å; R108-Y200 VanDerWaalsContact CG-CE1 3.48Å; R108-Y200 WeakPolarHBondContact CG-OH 3.42Å; R108-Y200 PolarHBondContact NE-OH 2.95Å; R108-Y200 PolarHBondContact NH2-OH 3.06Å; W154-Y200 HydrophobicContact CH2-CE2 4.45Å; W154-Y200 AromaticContact CZ3-CD2 3.89Å; W154-Y200 HydrophobicContact CZ3-CD2 3.89Å; W154-Y200 AromaticContact CZ3-CE2 3.8Å; W154-Y200 HydrophobicContact CZ3-CE2 3.8Å; E156-Y200 WeakPolarHBondContact O-CE2 3.15Å; E156-Y200 VanDerWaalsContact O-CZ 3.29Å; E156-Y200 PolarHBondContact O-OH 3.06Å; P197-Y200 HydrophobicContact CG-CD2 3.76Å; Y200-E204 PolarHBondContact N-OE2 3.31Å; Y200-E204 VanDerWaalsContact N-OE2 3.09Å
201	H	81.1	Confident	75.3	Confident	26 Å²	26	86.5 Å²	86.5	12%	0.12	46%	0.457	C	S	.	.	S	Bend	trans	-93.7	137.6	177.9	-61.1	-73.5	0	0	0	111	H105 N203 E204	H105-H201 AromaticContact CE1-CE1 3.45Å; H105-H201 PolarHBondContact CE1-CE1 3.38Å; H105-H201 VanDerWaalsContact CE1-CE1 3.45Å; H105-H201 AromaticContact CE1-ND1 3.83Å; H105-H201 AromaticContact ND1-CE1 3.89Å; H105-H201 AromaticContact NE2-CE1 3.85Å; H201-N203 WeakPolarHBondContact CB-OD1 3.39Å; H201-N203 PolarHBondContact O-N 3.13Å; H201-E204 HydrophobicContact CB-CG 4.14Å; H201-E204 IonicContact CD2-OE1 2.73Å; H201-E204 PolarHBondContact N-OE2 3.34Å; H201-E204 WeakPolarHBondContact O-CB 3.39Å; H201-E204 PolarHBondContact O-N 3.28Å
202	P	74.5	Confident	73.2	Confident	103 Å²	103	89 Å²	89	67%	0.669	48%	0.478	S	S	*	.	G	3₁₀ helix	trans	-65.1	-22.6	-179.4	26.1	-34.7	0	0	0	113.2	E204 I205	P202-E204 PolarHBondContact O-N 3.45Å; P202-I205 WeakPolarHBondContact O-CB 3.22Å; P202-I205 WeakPolarHBondContact O-CG1 3.4Å; P202-I205 PolarHBondContact O-N 3.06Å
203	N	68.5	Low	71.3	Confident	124 Å²	124	91.9 Å²	91.9	66%	0.663	51%	0.513	S	S	*	.	G	3₁₀ helix	trans	-71.9	-15.2	175.1	62.9	-12.9	0	0	0	113.3	H201	H201-N203 WeakPolarHBondContact CB-OD1 3.39Å; H201-N203 PolarHBondContact O-N 3.13Å
204	E	64.5	Low	69.4	Low	78 Å²	78	95.4 Å²	95.4	36%	0.364	54%	0.537	S	S	.	.	G	3₁₀ helix	trans	-76.9	-13.9	173.4	-64	171.4	158.6	0	0	112	Y200 H201 P202 K206	Y200-E204 PolarHBondContact N-OE2 3.31Å; Y200-E204 VanDerWaalsContact N-OE2 3.09Å; H201-E204 HydrophobicContact CB-CG 4.14Å; H201-E204 IonicContact CD2-OE1 2.73Å; H201-E204 PolarHBondContact N-OE2 3.34Å; H201-E204 WeakPolarHBondContact O-CB 3.39Å; H201-E204 PolarHBondContact O-N 3.28Å; P202-E204 PolarHBondContact O-N 3.45Å; E204-K206 PolarHBondContact O-N 3.05Å
205	I	64.1	Low	67.4	Low	70 Å²	70	97 Å²	97	36%	0.359	54%	0.544	S	S	.	.	S	Bend	trans	-64.4	102.2	167.9	-56.1	172.3	0	0	0	106.1	I199 P202 G207	I199-I205 HydrophobicContact CG2-CG1 4.03Å; P202-I205 WeakPolarHBondContact O-CB 3.22Å; P202-I205 WeakPolarHBondContact O-CG1 3.4Å; P202-I205 PolarHBondContact O-N 3.06Å; I205-G207 PolarHBondContact O-N 3Å
206	K	56.8	Low	65.5	Low	185 Å²	185	94.3 Å²	94.3	80%	0.804	53%	0.533	S	S	*	.			trans	-48.8	113.8	166.2	-71.1	-175.6	180	-179.5	0	106.3	E204 V208	E204-K206 PolarHBondContact O-N 3.05Å; K206-V208 PolarHBondContact O-N 3.35Å
207	G	58	Low	63.7	Low	69 Å²	69	98.8 Å²	98.8	71%	0.711	56%	0.562	S	S	*	*			trans	-51.9	110.7	172.7	0	0	0	0	0	106	I205 W209	I205-G207 PolarHBondContact O-N 3Å; G207-W209 PolarHBondContact O-N 2.98Å
208	V	52.3	Low	61.8	Low	79 Å²	79	105.3 Å²	105.3	48%	0.479	59%	0.587	S	S	.	*			trans	-72.4	84.3	178.1	-172.8	0	0	0	0	104.3	K206 T210	K206-V208 PolarHBondContact O-N 3.35Å; V208-T210 HydrophobicContact CG1-CG2 3.58Å; V208-T210 WeakPolarHBondContact CG1-OG1 3.44Å; V208-T210 PolarHBondContact O-N 3.33Å
209	W	48.2	Very low	60	Low	224 Å²	224	97.3 Å²	97.3	85%	0.848	57%	0.565	S	S	*	*			trans	-71.3	41.6	167.2	-168.3	85.4	0	0	0	108.6	G207 P211	G207-W209 PolarHBondContact O-N 2.98Å; W209-P211 HydrophobicContact CZ3-CG 4.41Å; W209-P211 WeakPolarHBondContact O-CD 3.12Å; W209-P211 VanDerWaalsContact O-N 3.08Å
210	T	47.7	Very low	58.5	Low	102 Å²	102	98.8 Å²	98.8	63%	0.626	56%	0.564	S	S	*	*			trans	-64.8	111.8	158.5	47.1	0	0	0	0	104.3	V208 A212	V208-T210 HydrophobicContact CG1-CG2 3.58Å; V208-T210 WeakPolarHBondContact CG1-OG1 3.44Å; V208-T210 PolarHBondContact O-N 3.33Å; T210-A212 PolarHBondContact O-N 2.86Å
211	P	44.8	Very low	56.7	Low	71 Å²	71	102 Å²	102	46%	0.461	59%	0.591	S	S	.	*			trans	-53.1	122.1	161.9	24.2	-31.1	0	0	0	104.8	W209 A213 C215	W209-P211 HydrophobicContact CZ3-CG 4.41Å; W209-P211 WeakPolarHBondContact O-CD 3.12Å; W209-P211 VanDerWaalsContact O-N 3.08Å; P211-A213 PolarHBondContact O-N 3.47Å; P211-C215 HydrophobicContact CB-CB 3.73Å
212	A	52.4	Low	55.3	Low	53 Å²	53	112.3 Å²	112.3	44%	0.438	63%	0.629	S	S	.	*			trans	-52	147.7	166.3	0	0	0	0	0	106.7	T210 T214 C215	T210-A212 PolarHBondContact O-N 2.86Å; A212-T214 PolarHBondContact O-N 3.24Å; A212-C215 WeakPolarHBondContact O-CB 3.35Å; A212-C215 PolarHBondContact O-N 2.9Å
213	A	55.1	Low	54.3	Low	116 Å²	116	108.7 Å²	108.7	96%	0.959	61%	0.611	S	S	*	*	T	Hydrogen-bonded Turn	trans	-53.2	-14.6	178.3	0	0	0	0	0	113.3	P211	P211-A213 PolarHBondContact O-N 3.47Å
214	T	54.9	Low	53.9	Low	106 Å²	106	106.3 Å²	106.3	65%	0.65	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-95.7	9.2	176.5	54	0	0	0	0	115	A212 P216	A212-T214 PolarHBondContact O-N 3.24Å; T214-P216 WeakPolarHBondContact O-CD 3.34Å
215	C	51.6	Low	53.4	Low	56 Å²	56	107.9 Å²	107.9	38%	0.378	62%	0.619	S	S	.	*			trans	-76.3	122.6	173.5	-78.8	0	0	0	0	110.4	P211 A212	P211-C215 HydrophobicContact CB-CB 3.73Å; A212-C215 WeakPolarHBondContact O-CB 3.35Å; A212-C215 PolarHBondContact O-N 2.9Å
216	P	52.8	Low	53.2	Low	61 Å²	61	114.7 Å²	114.7	40%	0.396	64%	0.64	S	S	.	*			trans	-61.8	149.8	173.2	-18.7	30.9	0	0	0	111.2	T214 E218 G219	T214-P216 WeakPolarHBondContact O-CD 3.34Å; P216-E218 PolarHBondContact O-N 2.93Å; P216-E218 VanDerWaalsContact O-N 3.12Å; P216-G219 PolarHBondContact O-N 3.29Å
217	P	57.4	Low	53.3	Low	140 Å²	140	111.1 Å²	111.1	91%	0.909	63%	0.626	S	S	*	*	T	Hydrogen-bonded Turn	trans	-59.1	-25.1	-178.5	20.7	-31.1	0	0	0	113.9	G219	P217-G219 VanDerWaalsContact C-N 3.29Å; P217-G219 PolarHBondContact O-N 3.02Å
218	E	51.9	Low	53.4	Low	190 Å²	190	113.3 Å²	113.3	89%	0.888	62%	0.619	S	S	*	*	T	Hydrogen-bonded Turn	trans	-83.2	-1.6	178.4	-57	-167.1	-166.5	0	0	113.9	P216	P216-E218 PolarHBondContact O-N 2.93Å; P216-E218 VanDerWaalsContact O-N 3.12Å
219	G	50.1	Low	54.2	Low	44 Å²	44	113.6 Å²	113.6	45%	0.454	62%	0.621	S	S	.	*			trans	74.6	154.8	-171.8	0	0	0	0	0	112.3	P216 P217	P216-G219 PolarHBondContact O-N 3.29Å; P217-G219 VanDerWaalsContact C-N 3.29Å; P217-G219 PolarHBondContact O-N 3.02Å
220	R	52.7	Low	55.2	Low	129 Å²	129	107.8 Å²	107.8	49%	0.487	60%	0.603	S	S	.	*			trans	-85.7	138.7	168.2	-99.7	-159	-73.2	-91.1	-2.2	109.4
221	P	52.1	Low	55.9	Low	115 Å²	115	109.1 Å²	109.1	75%	0.747	60%	0.596	S	S	*	*			trans	-52.7	144.3	166.2	-20.9	30.6	0	0	0	110	G223	P221-G223 PolarHBondContact O-N 3.35Å
222	W	51.4	Low	57	Low	244 Å²	244	109.4 Å²	109.4	92%	0.924	59%	0.592	S	S	*	*			trans	-53.8	104	178.4	-64	87.3	0	0	0	109.6
223	G	52.4	Low	58.1	Low	27 Å²	27	110.7 Å²	110.7	28%	0.278	59%	0.591	S	S	.	*			trans	-56.7	154.2	168.6	0	0	0	0	0	110.6	P221 E227	P221-G223 PolarHBondContact O-N 3.35Å; G223-E227 WeakPolarHBondContact CA-OE2 3.45Å
224	S	61.2	Low	58.8	Low	74 Å²	74	110.5 Å²	110.5	52%	0.517	57%	0.57	S	S	.	*			trans	-48.9	149.5	174.3	171.9	0	0	0	0	111.4	R226 E227 M228	S224-R226 PolarHBondContact O-N 2.91Å; S224-E227 WeakPolarHBondContact O-CA 3.38Å; S224-E227 VanDerWaalsContact O-CB 3.31Å; S224-E227 WeakPolarHBondContact O-CB 3.41Å; S224-E227 PolarHBondContact O-N 3.4Å; S224-M228 PolarHBondContact O-N 2.96Å
225	T	54.1	Low	59.5	Low	111 Å²	111	108.7 Å²	108.7	68%	0.681	55%	0.551	S	S	*	*	H	α-helix	trans	-47.3	-31.5	176.3	-47.5	0	0	0	0	112.7	M228 V229	T225-M228 WeakPolarHBondContact O-CB 3.34Å; T225-M228 PolarHBondContact O-N 2.75Å; T225-V229 PolarHBondContact O-N 2.9Å; T225-V229 VanDerWaalsContact O-N 3.16Å
226	R	58.9	Low	60.3	Low	213 Å²	213	110 Å²	110	80%	0.804	55%	0.554	S	S	*	*	H	α-helix	trans	-65.2	-38.5	175.5	-166	173.4	-175.1	160.5	0.6	113	S224 V229 H230	S224-R226 PolarHBondContact O-N 2.91Å; R226-V229 PolarHBondContact O-N 2.87Å; R226-H230 WeakPolarHBondContact O-CB 3.3Å; R226-H230 PolarHBondContact O-N 3.47Å
227	E	59.8	Low	61	Low	110 Å²	110	115.4 Å²	115.4	51%	0.514	57%	0.567	S	S	.	*	H	α-helix	trans	-68.3	-35.4	174.9	-62.1	-179.6	-168.2	0	0	111.6	G223 S224 H230 R231	G223-E227 WeakPolarHBondContact CA-OE2 3.45Å; S224-E227 WeakPolarHBondContact O-CA 3.38Å; S224-E227 VanDerWaalsContact O-CB 3.31Å; S224-E227 WeakPolarHBondContact O-CB 3.41Å; S224-E227 PolarHBondContact O-N 3.4Å; E227-H230 PolarHBondContact O-N 2.77Å; E227-R231 VanDerWaalsContact O-CB 3.3Å; E227-R231 WeakPolarHBondContact O-CB 3.44Å; E227-R231 PolarHBondContact O-N 2.77Å
228	M	59.9	Low	61.4	Low	115 Å²	115	111.8 Å²	111.8	57%	0.567	55%	0.554	S	S	*	*	H	α-helix	trans	-60.4	-50.5	173	-93.8	-176.5	62.4	0	0	111.7	S224 T225 H230 R231 E232	S224-M228 PolarHBondContact O-N 2.96Å; T225-M228 WeakPolarHBondContact O-CB 3.34Å; T225-M228 PolarHBondContact O-N 2.75Å; M228-H230 VanDerWaalsContact C-N 3.3Å; M228-H230 PolarHBondContact O-N 2.67Å; M228-R231 PolarHBondContact O-N 2.69Å; M228-E232 WeakPolarHBondContact O-CB 3.31Å; M228-E232 PolarHBondContact O-N 2.95Å
229	V	69.2	Low	61.8	Low	85 Å²	85	110.7 Å²	110.7	52%	0.515	54%	0.542	S	S	.	.	H	α-helix	trans	-61.3	-42.9	178	175.1	0	0	0	0	110.4	T225 R226 R231 E232 L233	T225-V229 PolarHBondContact O-N 2.9Å; T225-V229 VanDerWaalsContact O-N 3.16Å; R226-V229 PolarHBondContact O-N 2.87Å; V229-R231 PolarHBondContact O-N 2.67Å; V229-E232 PolarHBondContact O-N 2.92Å; V229-L233 HydrophobicContact CG1-CD1 4.01Å; V229-L233 HydrophobicContact CG1-CG 4.46Å; V229-L233 WeakPolarHBondContact O-CB 3.2Å; V229-L233 WeakPolarHBondContact O-CG 3.27Å; V229-L233 PolarHBondContact O-N 3.43Å
230	H	68.8	Low	61.9	Low	101 Å²	101	119.1 Å²	119.1	47%	0.468	56%	0.56	S	S	.	*	H	α-helix	trans	-63.5	-42	-179.6	-158.9	-13.1	0	0	0	112.2	R226 E227 M228 L233 E234	R226-H230 WeakPolarHBondContact O-CB 3.3Å; R226-H230 PolarHBondContact O-N 3.47Å; E227-H230 PolarHBondContact O-N 2.77Å; M228-H230 VanDerWaalsContact C-N 3.3Å; M228-H230 PolarHBondContact O-N 2.67Å; H230-L233 WeakPolarHBondContact O-CB 3.4Å; H230-L233 PolarHBondContact O-N 2.69Å; H230-E234 IonicContact CE1-OE1 3.66Å; H230-E234 IonicContact ND1-OE1 3.9Å; H230-E234 WeakPolarHBondContact O-CG 3.37Å; H230-E234 PolarHBondContact O-N 2.75Å
231	R	61.6	Low	61.5	Low	130 Å²	130	120.7 Å²	120.7	49%	0.491	58%	0.577	S	S	.	*	H	α-helix	trans	-66.7	-40	176.8	179.5	174.5	-89.5	129.9	5.4	111.9	E227 M228 V229 L233 E234 R235	E227-R231 VanDerWaalsContact O-CB 3.3Å; E227-R231 WeakPolarHBondContact O-CB 3.44Å; E227-R231 PolarHBondContact O-N 2.77Å; M228-R231 PolarHBondContact O-N 2.69Å; V229-R231 PolarHBondContact O-N 2.67Å; R231-L233 VanDerWaalsContact C-N 3.34Å; R231-E234 PolarHBondContact O-N 3.12Å; R231-R235 WeakPolarHBondContact O-CB 3.44Å; R231-R235 PolarHBondContact O-N 3.14Å
232	E	68.4	Low	61.1	Low	77 Å²	77	125.4 Å²	125.4	36%	0.36	59%	0.586	S	S	.	*	H	α-helix	trans	-65.4	-39.7	175.7	-174.5	57.7	-162.4	0	0	111.4	M228 V229 R235 L236	M228-E232 WeakPolarHBondContact O-CB 3.31Å; M228-E232 PolarHBondContact O-N 2.95Å; V229-E232 PolarHBondContact O-N 2.92Å; E232-R235 VanDerWaalsContact CD-NE 3.32Å; E232-R235 WeakPolarHBondContact O-CB 3.38Å; E232-R235 PolarHBondContact O-N 2.73Å; E232-R235 IonicContact OE1-CZ 3.12Å; E232-R235 VanDerWaalsContact OE1-CZ 3.28Å; E232-R235 IonicContact OE1-NE 3.81Å; E232-R235 PolarHBondContact OE1-NE 2.69Å; E232-R235 VanDerWaalsContact OE1-NE 3.12Å; E232-R235 IonicContact OE1-NH2 3.28Å; E232-R235 PolarHBondContact OE1-NH2 2.65Å; E232-R235 IonicContact OE2-CZ 2.84Å; E232-R235 IonicContact OE2-NE 3.97Å; E232-R235 PolarHBondContact OE2-NE 2.64Å; E232-R235 IonicContact OE2-NH2 3.75Å; E232-L236 HydrophobicContact CG-CD1 4.37Å; E232-L236 WeakPolarHBondContact O-CB 3.44Å; E232-L236 VanDerWaalsContact O-CG 3.26Å; E232-L236 WeakPolarHBondContact O-CG 3.39Å; E232-L236 PolarHBondContact O-N 3.49Å
233	L	75.1	Confident	60.7	Low	81 Å²	81	116.6 Å²	116.6	42%	0.424	57%	0.571	S	S	.	*	H	α-helix	trans	-61.6	-43.4	172.7	-76.3	168.8	0	0	0	112.3	V229 H230 R231 L236 R237	V229-L233 HydrophobicContact CG1-CD1 4.01Å; V229-L233 HydrophobicContact CG1-CG 4.46Å; V229-L233 WeakPolarHBondContact O-CB 3.2Å; V229-L233 WeakPolarHBondContact O-CG 3.27Å; V229-L233 PolarHBondContact O-N 3.43Å; H230-L233 WeakPolarHBondContact O-CB 3.4Å; H230-L233 PolarHBondContact O-N 2.69Å; R231-L233 VanDerWaalsContact C-N 3.34Å; L233-L236 PolarHBondContact O-N 2.79Å; L233-R237 WeakPolarHBondContact O-CB 3.5Å; L233-R237 WeakPolarHBondContact O-CG 3.41Å; L233-R237 PolarHBondContact O-N 2.84Å
234	E	71.2	Confident	60.2	Low	111 Å²	111	123.3 Å²	123.3	52%	0.519	60%	0.601	S	S	.	*	H	α-helix	trans	-62	-44.6	174.7	-76.2	177.4	174.9	0	0	112.1	H230 R231 L236 R237 G238	H230-E234 IonicContact CE1-OE1 3.66Å; H230-E234 IonicContact ND1-OE1 3.9Å; H230-E234 WeakPolarHBondContact O-CG 3.37Å; H230-E234 PolarHBondContact O-N 2.75Å; R231-E234 PolarHBondContact O-N 3.12Å; E234-L236 VanDerWaalsContact C-N 3.32Å; E234-L236 PolarHBondContact O-N 3.23Å; E234-R237 WeakPolarHBondContact O-CB 2.99Å; E234-R237 PolarHBondContact O-N 2.73Å; E234-G238 PolarHBondContact O-N 2.91Å
235	R	68.7	Low	59.1	Low	68 Å²	68	131.7 Å²	131.7	26%	0.257	64%	0.638	S	S	.	*	H	α-helix	trans	-58.2	-44.3	175.7	-169.6	-169.3	76.6	80.7	1.8	111.7	R231 E232 G238 R239	R231-R235 WeakPolarHBondContact O-CB 3.44Å; R231-R235 PolarHBondContact O-N 3.14Å; E232-R235 VanDerWaalsContact CD-NE 3.32Å; E232-R235 WeakPolarHBondContact O-CB 3.38Å; E232-R235 PolarHBondContact O-N 2.73Å; E232-R235 IonicContact OE1-CZ 3.12Å; E232-R235 VanDerWaalsContact OE1-CZ 3.28Å; E232-R235 IonicContact OE1-NE 3.81Å; E232-R235 PolarHBondContact OE1-NE 2.69Å; E232-R235 VanDerWaalsContact OE1-NE 3.12Å; E232-R235 IonicContact OE1-NH2 3.28Å; E232-R235 PolarHBondContact OE1-NH2 2.65Å; E232-R235 IonicContact OE2-CZ 2.84Å; E232-R235 IonicContact OE2-NE 3.97Å; E232-R235 PolarHBondContact OE2-NE 2.64Å; E232-R235 IonicContact OE2-NH2 3.75Å; R235-G238 PolarHBondContact O-N 2.69Å; R235-R239 VanDerWaalsContact NH1-NH2 3.11Å; R235-R239 PolarHBondContact O-N 3.41Å
236	L	68.6	Low	59.4	Low	85 Å²	85	132.7 Å²	132.7	45%	0.445	64%	0.636	S	S	.	*	H	α-helix	trans	-66.8	-40.3	176.9	-71.2	172.3	0	0	0	112	E232 L233 E234 G238 R239	E232-L236 HydrophobicContact CG-CD1 4.37Å; E232-L236 WeakPolarHBondContact O-CB 3.44Å; E232-L236 VanDerWaalsContact O-CG 3.26Å; E232-L236 WeakPolarHBondContact O-CG 3.39Å; E232-L236 PolarHBondContact O-N 3.49Å; L233-L236 PolarHBondContact O-N 2.79Å; E234-L236 VanDerWaalsContact C-N 3.32Å; E234-L236 PolarHBondContact O-N 3.23Å; L236-G238 VanDerWaalsContact C-N 3.29Å; L236-G238 PolarHBondContact O-N 2.78Å; L236-R239 PolarHBondContact O-N 3.39Å
237	R	68.5	Low	59.4	Low	174 Å²	174	128.5 Å²	128.5	66%	0.657	63%	0.627	S	S	*	*	H	α-helix	trans	-60.5	-39.8	173.2	-73.3	168.6	-179.1	-170.1	0.1	111.5	L233 E234 R239 R240	L233-R237 WeakPolarHBondContact O-CB 3.5Å; L233-R237 WeakPolarHBondContact O-CG 3.41Å; L233-R237 PolarHBondContact O-N 2.84Å; E234-R237 WeakPolarHBondContact O-CB 2.99Å; E234-R237 PolarHBondContact O-N 2.73Å; R237-R239 VanDerWaalsContact C-N 3.26Å; R237-R239 PolarHBondContact O-N 3.37Å; R237-R240 WeakPolarHBondContact O-CB 3.28Å; R237-R240 PolarHBondContact O-N 3.38Å; R237-R240 VanDerWaalsContact O-N 3.15Å
238	G	63.9	Low	59.4	Low	63 Å²	63	129.5 Å²	129.5	65%	0.649	63%	0.634	S	S	*	*	H	α-helix	trans	-64.2	-24.4	177.2	0	0	0	0	0	114.7	E234 R235 L236 R240	E234-G238 PolarHBondContact O-N 2.91Å; R235-G238 PolarHBondContact O-N 2.69Å; L236-G238 VanDerWaalsContact C-N 3.29Å; L236-G238 PolarHBondContact O-N 2.78Å; G238-R240 PolarHBondContact O-N 2.88Å
239	R	61.7	Low	59.3	Low	168 Å²	168	130.4 Å²	130.4	63%	0.634	64%	0.638	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72	-14.2	174.9	-74.6	-172.5	171.7	-173.7	-3.1	113.7	R235 L236 R237 L241	R235-R239 VanDerWaalsContact NH1-NH2 3.11Å; R235-R239 PolarHBondContact O-N 3.41Å; L236-R239 PolarHBondContact O-N 3.39Å; R237-R239 VanDerWaalsContact C-N 3.26Å; R237-R239 PolarHBondContact O-N 3.37Å; R239-L241 VanDerWaalsContact C-N 3.25Å; R239-L241 PolarHBondContact O-N 2.88Å
240	R	52.3	Low	58.7	Low	221 Å²	221	133.2 Å²	133.2	83%	0.834	65%	0.645	S	S	*	*	T	Hydrogen-bonded Turn	trans	-79.7	6.2	-169.2	-140.7	-176.6	-141.9	177.6	6	115.5	R237 G238	R237-R240 WeakPolarHBondContact O-CB 3.28Å; R237-R240 PolarHBondContact O-N 3.38Å; R237-R240 VanDerWaalsContact O-N 3.15Å; G238-R240 PolarHBondContact O-N 2.88Å
241	L	42.8	Very low	58.1	Low	161 Å²	161	135.3 Å²	135.3	84%	0.843	66%	0.657	S	S	*	*			trans	-132.9	75.6	178.5	-66.9	172.1	0	0	0	111.5	R239	R239-L241 VanDerWaalsContact C-N 3.25Å; R239-L241 PolarHBondContact O-N 2.88Å
242	K	44.1	Very low	57.8	Low	215 Å²	215	135.7 Å²	135.7	94%	0.935	67%	0.669	S	S	*	*			trans	-134.4	63	142.4	-142.8	179.5	-173	-175	0	107.2
243	G	42.5	Very low	57	Low	59 Å²	59	140.2 Å²	140.2	61%	0.608	69%	0.693	S	S	*	*	S	Bend	trans	-119.9	122.2	168.9	0	0	0	0	0	106.5	L245	G243-L245 PolarHBondContact O-N 3.32Å
244	D	42.4	Very low	55.5	Low	167 Å²	167	145.2 Å²	145.2	89%	0.893	72%	0.715	S	S	*	*			trans	-51.7	118.6	177.9	-60	-49.5	0	0	0	111.4
245	L	39.1	Very low	54.1	Low	250 Å²	250	148.3 Å²	148.3	100%	1.309	73%	0.733	S	S	*	*			trans	-138.6	0	151.6	-80.4	176.4	0	0	0	107.3	G243	G243-L245 PolarHBondContact O-N 3.32Å

Retrieved 245 of 245 residues in 55.4 ms (Link to these results)

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