G4VFS6_SCHMA Loading...

Snurportin-1

Functions as an U snRNP-specific nuclear import adapter. Involved in the trimethylguanosine (m3G)-cap-dependent nuclear import of U snRNPs. Binds specifically to the terminal m3G-cap U snRNAs.

AlphaFold DB , UniProt , Accession G4VFS6, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 345 aa.

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(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	36.5	Very low	36.4	Very low	226 Å²	226	122.4 Å²	122.4	100%	1.113	62%	0.618	S	S	*	*				0	96.2	0	-155.5	180	-64.7	0	0	105.1
2	E	41	Very low	36.6	Very low	160 Å²	160	116.5 Å²	116.5	75%	0.748	60%	0.597	S	S	*	*			trans	-65.7	142.3	-166.4	-76	171.5	147.6	0	0	111.3	D4 S5	E2-D4 PolarHBondContact O-N 2.99Å; E2-S5 PolarHBondContact O-N 3.42Å
3	L	34.1	Very low	36.8	Very low	136 Å²	136	109.4 Å²	109.4	71%	0.712	56%	0.562	S	S	*	*	H	α-helix	trans	-47.4	-31.6	-177.5	-124.8	93.7	0	0	0	112.8	S5 L6 C7	L3-S5 VanDerWaalsContact C-N 3.33Å; L3-S5 PolarHBondContact O-N 3.1Å; L3-L6 VanDerWaalsContact O-CB 3.29Å; L3-L6 WeakPolarHBondContact O-CB 3.26Å; L3-L6 PolarHBondContact O-N 3.09Å; L3-C7 PolarHBondContact O-N 3.19Å; L3-C7 PolarHBondContact O-SG 3.04Å
4	D	34.8	Very low	37.4	Very low	114 Å²	114	102.5 Å²	102.5	61%	0.61	53%	0.527	S	S	*	.	H	α-helix	trans	-63.8	-34.6	-179.3	-62.1	-21.4	0	0	0	113.2	E2 L6 C7	E2-D4 PolarHBondContact O-N 2.99Å; D4-L6 PolarHBondContact O-N 3.08Å; D4-C7 PolarHBondContact O-N 3.09Å
5	S	36.9	Very low	38	Very low	73 Å²	73	97.7 Å²	97.7	51%	0.51	50%	0.503	S	S	.	.	H	α-helix	trans	-70.2	-25.4	174.5	180	0	0	0	0	111.9	E2 L3	E2-S5 PolarHBondContact O-N 3.42Å; L3-S5 VanDerWaalsContact C-N 3.33Å; L3-S5 PolarHBondContact O-N 3.1Å
6	L	31.8	Very low	38.5	Very low	117 Å²	117	93 Å²	93	61%	0.613	48%	0.478	S	S	*	.	H	α-helix	trans	-74.9	-36.2	177	-144.8	82.3	0	0	0	110.2	L3 D4 Q8 W10	L3-L6 VanDerWaalsContact O-CB 3.29Å; L3-L6 WeakPolarHBondContact O-CB 3.26Å; L3-L6 PolarHBondContact O-N 3.09Å; D4-L6 PolarHBondContact O-N 3.08Å; L6-Q8 PolarHBondContact O-N 2.93Å; L6-W10 PolarHBondContact O-NE1 3.14Å
7	C	36.4	Very low	39	Very low	45 Å²	45	89.5 Å²	89.5	30%	0.304	46%	0.461	S	S	.	.	H	α-helix	trans	-66.7	-27.4	-178.2	-68.7	0	0	0	0	114.7	L3 D4 H9 W10	L3-C7 PolarHBondContact O-N 3.19Å; L3-C7 PolarHBondContact O-SG 3.04Å; D4-C7 PolarHBondContact O-N 3.09Å; C7-H9 VanDerWaalsContact C-N 3.29Å; C7-H9 PolarHBondContact O-N 3.17Å; C7-W10 HydrophobicContact CB-CZ2 4.48Å; C7-W10 VanDerWaalsContact O-CB 3.32Å; C7-W10 WeakPolarHBondContact O-CB 3.36Å; C7-W10 PolarHBondContact O-N 3.25Å
8	Q	33.5	Very low	39.6	Very low	161 Å²	161	88.7 Å²	88.7	75%	0.752	46%	0.455	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74.8	-15.9	-178.7	-69.7	-179	-0.9	0	0	114.2	L6 W10	L6-Q8 PolarHBondContact O-N 2.93Å; Q8-W10 VanDerWaalsContact C-N 3.27Å; Q8-W10 PolarHBondContact O-N 3.19Å
9	H	35	Very low	39.6	Very low	163 Å²	163	92.2 Å²	92.2	76%	0.755	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-89.8	16.3	176.5	-116.5	72.6	0	0	0	112.9	C7	C7-H9 VanDerWaalsContact C-N 3.29Å; C7-H9 PolarHBondContact O-N 3.17Å
10	W	41.4	Very low	39.6	Very low	81 Å²	81	92.2 Å²	92.2	31%	0.307	47%	0.47	S	S	.	.			trans	-94.2	111.9	-170.1	-68.1	20.4	0	0	0	110.3	L6 C7 Q8 S12 R147	L6-W10 PolarHBondContact O-NE1 3.14Å; C7-W10 HydrophobicContact CB-CZ2 4.48Å; C7-W10 VanDerWaalsContact O-CB 3.32Å; C7-W10 WeakPolarHBondContact O-CB 3.36Å; C7-W10 PolarHBondContact O-N 3.25Å; Q8-W10 VanDerWaalsContact C-N 3.27Å; Q8-W10 PolarHBondContact O-N 3.19Å; W10-S12 PolarHBondContact O-N 3.16Å; W10-R147 VanDerWaalsContact CE2-NH1 3.26Å; W10-R147 VanDerWaalsContact CH2-NH2 3.34Å
11	D	39	Very low	39.5	Very low	70 Å²	70	93.9 Å²	93.9	37%	0.374	47%	0.474	S	S	.	.			trans	-55.2	120.9	-178.4	-54.5	-47.4	0	0	0	111.4	T13 D15 M336	D11-T13 VanDerWaalsContact C-N 3.35Å; D11-D15 WeakPolarHBondContact CB-OD2 3.36Å; D11-M336 WeakPolarHBondContact OD1-CE 3.02Å
12	S	38.6	Very low	39.3	Very low	52 Å²	52	91.1 Å²	91.1	36%	0.364	46%	0.459	S	S	.	.			trans	-98.8	28.9	-174.4	51.1	0	0	0	0	111.8	W10	W10-S12 PolarHBondContact O-N 3.16Å
13	T	39.7	Very low	38.9	Very low	24 Å²	24	89.3 Å²	89.3	15%	0.147	46%	0.459	C	S	.	.	S	Bend	trans	-143.7	157.1	-175	-62.8	0	0	0	0	110.9	D11 D15 K297 Y332	D11-T13 VanDerWaalsContact C-N 3.35Å; T13-D15 VanDerWaalsContact C-N 3.26Å; T13-D15 PolarHBondContact O-N 3.26Å; T13-K297 VanDerWaalsContact CG2-NZ 3.33Å; T13-Y332 HydrophobicContact CG2-CE2 4.33Å
14	L	44.9	Very low	39	Very low	13 Å²	13	86.3 Å²	86.3	7%	0.068	45%	0.446	C	S	.	.			trans	-61.5	88.6	166.4	-76.9	155.4	0	0	0	108.7	I16 C124 H129 I178 W295	L14-I16 PolarHBondContact O-N 2.86Å; L14-C124 HydrophobicContact CD1-CB 3.78Å; L14-H129 HydrophobicContact CD2-CB 3.49Å; L14-H129 VanDerWaalsContact CD2-CB 3.49Å; L14-I178 HydrophobicContact CD1-CD1 3.76Å; L14-I178 HydrophobicContact CD1-CG1 4.34Å; L14-I178 HydrophobicContact CD2-CD1 3.96Å; L14-I178 HydrophobicContact CD2-CG1 3.71Å; L14-I178 HydrophobicContact CG-CD1 4.4Å; L14-I178 HydrophobicContact CG-CG1 4.47Å; L14-W295 HydrophobicContact CB-CH2 4.27Å; L14-W295 HydrophobicContact CB-CZ2 4.21Å; L14-W295 HydrophobicContact CD1-CH2 3.25Å; L14-W295 HydrophobicContact CD1-CZ2 3.96Å; L14-W295 HydrophobicContact CD1-CZ3 3.63Å; L14-W295 HydrophobicContact CG-CH2 4.37Å
15	D	46.8	Very low	38.9	Very low	31 Å²	31	85.4 Å²	85.4	17%	0.166	46%	0.455	C	S	.	.	P	Polyproline II helix	trans	-70.7	120.2	-176	-68.6	-40.5	0	0	0	111.9	D11 T13 R144 Y332	D11-D15 WeakPolarHBondContact CB-OD2 3.36Å; T13-D15 VanDerWaalsContact C-N 3.26Å; T13-D15 PolarHBondContact O-N 3.26Å; D15-R144 PolarHBondContact O-NH1 3.25Å; D15-Y332 PolarHBondContact OD1-OH 2.95Å
16	I	45.9	Very low	38.7	Very low	22 Å²	22	88.3 Å²	88.3	11%	0.113	46%	0.46	C	S	.	.	P	Polyproline II helix	trans	-57.3	143	163.5	-71.2	160.2	0	0	0	109.2	L14 A105 W107 R144 W295	L14-I16 PolarHBondContact O-N 2.86Å; I16-A105 WeakPolarHBondContact CA-O 3.15Å; I16-A105 WeakPolarHBondContact CG1-O 3.13Å; I16-A105 WeakPolarHBondContact CG2-O 3.42Å; I16-W107 HydrophobicContact CD1-CB 4.33Å; I16-W107 HydrophobicContact CD1-CD2 3.17Å; I16-W107 HydrophobicContact CD1-CE3 3.73Å; I16-W107 HydrophobicContact CD1-CG 3.47Å; I16-W107 VanDerWaalsContact CD1-CG 3.47Å; I16-W107 HydrophobicContact CD1-CH2 4.18Å; I16-W107 HydrophobicContact CD1-CZ2 3.69Å; I16-W107 HydrophobicContact CD1-CZ3 4.2Å; I16-R144 PolarHBondContact O-NH1 3.28Å; I16-R144 VanDerWaalsContact O-NH1 3.13Å; I16-W295 HydrophobicContact CD1-CB 4.12Å; I16-W295 HydrophobicContact CD1-CG 4.25Å; I16-W295 HydrophobicContact CG1-CB 4.34Å
17	D	47.1	Very low	39.3	Very low	33 Å²	33	88.5 Å²	88.5	18%	0.176	47%	0.471	C	S	.	.	P	Polyproline II helix	trans	-78.4	143.8	177.6	-153	-6.9	0	0	0	111.4	L104 A289	D17-L104 HydrophobicContact CB-CB 3.89Å; D17-L104 HydrophobicContact CB-CD1 3.45Å; D17-L104 VanDerWaalsContact CB-CD1 3.45Å; D17-L104 HydrophobicContact CB-CG 4.3Å; D17-L104 VanDerWaalsContact CG-CD1 3.46Å; D17-L104 WeakPolarHBondContact OD2-CD1 3.48Å; D17-A289 HydrophobicContact CB-CB 3.42Å; D17-A289 VanDerWaalsContact CB-CB 3.42Å; D17-A289 PolarHBondContact OD2-N 3.09Å
18	E	50	Low	39.4	Very low	76 Å²	76	94.1 Å²	94.1	36%	0.355	49%	0.493	S	S	.	.			trans	-108.5	-4.5	-175.1	-69.8	-175.4	175.7	0	0	113	N20 F21 M336	E18-N20 VanDerWaalsContact C-N 3.27Å; E18-N20 PolarHBondContact O-N 3.35Å; E18-N20 VanDerWaalsContact O-N 3.17Å; E18-F21 HydrophobicContact CB-CE2 4.07Å; E18-F21 WeakPolarHBondContact O-CD2 3.32Å; E18-F21 VanDerWaalsContact O-CE2 3.26Å; E18-F21 WeakPolarHBondContact O-CE2 3.5Å; E18-M336 WeakPolarHBondContact OE1-CB 3.35Å
19	E	39.6	Very low	39.3	Very low	154 Å²	154	96.7 Å²	96.7	72%	0.72	50%	0.502	S	S	*	.			trans	-75.8	0.5	-172	-81.1	-168.9	173.8	0	0	115.8
20	N	38.5	Very low	39.1	Very low	92 Å²	92	94.6 Å²	94.6	49%	0.492	49%	0.492	S	S	.	.			trans	-110.9	63.3	176.6	-76.2	-31.4	0	0	0	112.9	E18	E18-N20 VanDerWaalsContact C-N 3.27Å; E18-N20 PolarHBondContact O-N 3.35Å; E18-N20 VanDerWaalsContact O-N 3.17Å
21	F	37.5	Very low	39.2	Very low	128 Å²	128	96.1 Å²	96.1	56%	0.561	51%	0.512	S	S	*	.			trans	-95.2	57.5	166.1	-74	-77.9	0	0	0	111.7	E18 T23	E18-F21 HydrophobicContact CB-CE2 4.07Å; E18-F21 WeakPolarHBondContact O-CD2 3.32Å; E18-F21 VanDerWaalsContact O-CE2 3.26Å; E18-F21 WeakPolarHBondContact O-CE2 3.5Å; F21-T23 PolarHBondContact O-N 3.07Å
22	E	33.5	Very low	39	Very low	169 Å²	169	103.1 Å²	103.1	79%	0.79	53%	0.533	S	S	*	.			trans	-86.1	88.5	161.5	-74.9	-168.4	-179.8	0	0	108.6	V24	E22-V24 PolarHBondContact O-N 3.47Å
23	T	32.9	Very low	38.8	Very low	122 Å²	122	104.5 Å²	104.5	75%	0.748	54%	0.536	S	S	*	.			trans	-63.3	117.1	166.9	50.8	0	0	0	0	108.9	F21 A25	F21-T23 PolarHBondContact O-N 3.07Å; T23-A25 PolarHBondContact O-N 3.03Å
24	V	34.6	Very low	38.6	Very low	72 Å²	72	108.3 Å²	108.3	44%	0.436	56%	0.564	S	S	.	*			trans	-63	119.3	169.5	-177.8	0	0	0	0	107.6	E22 E26 K47	E22-V24 PolarHBondContact O-N 3.47Å; V24-E26 PolarHBondContact O-N 3.4Å; V24-K47 HydrophobicContact CG2-CD 4.35Å
25	A	34.2	Very low	38.5	Very low	96 Å²	96	114.5 Å²	114.5	79%	0.793	60%	0.596	S	S	*	*			trans	-66.4	103.8	169.3	0	0	0	0	0	108.8	T23	T23-A25 PolarHBondContact O-N 3.03Å
26	E	32.8	Very low	38.5	Very low	134 Å²	134	120.7 Å²	120.7	63%	0.626	62%	0.618	S	S	*	*			trans	-69.3	129.6	176.1	-79.3	-179.2	159.6	0	0	110.8	V24 E28	V24-E26 PolarHBondContact O-N 3.4Å; E26-E28 VanDerWaalsContact C-N 3.34Å; E26-E28 PolarHBondContact O-N 2.71Å
27	S	44.3	Very low	38.6	Very low	121 Å²	121	128.1 Å²	128.1	85%	0.846	65%	0.65	S	S	*	*	S	Bend	trans	-82.3	1.4	-174.6	58.4	0	0	0	0	115.1
28	E	38	Very low	39	Very low	163 Å²	163	127.1 Å²	127.1	76%	0.762	65%	0.645	S	S	*	*			trans	-131.6	110.4	-179.6	-73.3	-172.1	164	0	0	113	E26 H30	E26-E28 VanDerWaalsContact C-N 3.34Å; E26-E28 PolarHBondContact O-N 2.71Å; E28-H30 PolarHBondContact O-N 3.18Å; E28-H30 VanDerWaalsContact O-N 3.09Å
29	K	30.7	Very low	39.6	Very low	215 Å²	215	129.8 Å²	129.8	94%	0.935	66%	0.655	S	S	*	*			trans	-73.1	92.9	176.3	-65.3	-180	179.6	179.5	0	109.9
30	H	32.1	Very low	41.5	Very low	119 Å²	119	124 Å²	124	55%	0.551	64%	0.637	S	S	*	*			trans	-94.9	128.1	168.4	-160.8	-89.3	0	0	0	111.8	E28 R32 L33	E28-H30 PolarHBondContact O-N 3.18Å; E28-H30 VanDerWaalsContact O-N 3.09Å; H30-R32 PolarHBondContact O-N 3.4Å; H30-L33 HydrophobicContact CB-CB 4.49Å; H30-L33 HydrophobicContact CB-CD1 3.63Å; H30-L33 HydrophobicContact CB-CG 3.95Å; H30-L33 PolarHBondContact O-N 2.93Å; H30-L33 VanDerWaalsContact O-N 3.1Å
31	P	41.9	Very low	43.5	Very low	113 Å²	113	122.7 Å²	122.7	73%	0.734	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-10.7	-170.9	-19.2	29	0	0	0	116.3
32	R	34.7	Very low	45.8	Very low	217 Å²	217	117.6 Å²	117.6	82%	0.819	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.2	-0.2	179	-105	-178.9	158.3	129.9	-3.2	114.4	H30	H30-R32 PolarHBondContact O-N 3.4Å
33	L	35.1	Very low	48.4	Very low	81 Å²	81	111.8 Å²	111.8	42%	0.424	59%	0.587	S	S	.	*	S	Bend	trans	-87.2	-6.4	176.6	-69.6	174.4	0	0	0	113.2	H30 L35 K39	H30-L33 HydrophobicContact CB-CB 4.49Å; H30-L33 HydrophobicContact CB-CD1 3.63Å; H30-L33 HydrophobicContact CB-CG 3.95Å; H30-L33 PolarHBondContact O-N 2.93Å; H30-L33 VanDerWaalsContact O-N 3.1Å; L33-L35 PolarHBondContact O-N 2.96Å; L33-L35 VanDerWaalsContact O-N 3.09Å; L33-K39 HydrophobicContact CD2-CD 4.48Å
34	S	36.4	Very low	51.2	Low	104 Å²	104	107.1 Å²	107.1	73%	0.727	56%	0.558	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	5.1	-179.7	59.2	0	0	0	0	115.4
35	L	42.4	Very low	54	Low	142 Å²	142	103.7 Å²	103.7	74%	0.743	54%	0.537	S	S	*	.	T	Hydrogen-bonded Turn	trans	-106.2	-1.7	-176.5	-70.6	175.8	0	0	0	115.9	L33	L33-L35 PolarHBondContact O-N 2.96Å; L33-L35 VanDerWaalsContact O-N 3.09Å
36	Y	46.6	Very low	56.9	Low	162 Å²	162	101.8 Å²	101.8	64%	0.635	51%	0.512	S	S	*	.			trans	-129.1	94.8	177.7	-84.2	-86.3	0	0	0	112.6	N38 K39	Y36-N38 PolarHBondContact O-N 3.44Å; Y36-K39 PolarHBondContact O-N 3.44Å
37	K	48.7	Very low	59.9	Low	178 Å²	178	99.9 Å²	99.9	77%	0.774	50%	0.502	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.7	-26.4	175.3	-70.3	-178	178.2	178.3	0	113.5
38	N	53.7	Low	62.4	Low	12 Å²	12	96.4 Å²	96.4	6%	0.064	47%	0.47	C	S	.	.	T	Hydrogen-bonded Turn	trans	-92.8	-16.1	179.5	-76.3	-3.2	0	0	0	114.8	Y36 G40 R41 A42	Y36-N38 PolarHBondContact O-N 3.44Å; N38-G40 VanDerWaalsContact C-N 3.31Å; N38-G40 PolarHBondContact O-N 3.44Å; N38-R41 WeakPolarHBondContact O-CA 3.35Å; N38-R41 WeakPolarHBondContact O-CB 3.37Å; N38-R41 PolarHBondContact O-N 2.8Å; N38-R41 WeakPolarHBondContact OD1-CD 3.44Å; N38-R41 PolarHBondContact OD1-NH1 2.89Å; N38-A42 PolarHBondContact O-N 2.65Å
39	K	63.3	Low	65.2	Low	132 Å²	132	89.6 Å²	89.6	57%	0.574	44%	0.437	S	S	*	.	H	α-helix	trans	-62.1	-42.7	179.1	-175.4	178.7	178.2	-177.5	0	111.2	L33 Y36 R41 A43	L33-K39 HydrophobicContact CD2-CD 4.48Å; Y36-K39 PolarHBondContact O-N 3.44Å; K39-R41 VanDerWaalsContact C-N 3.3Å; K39-R41 PolarHBondContact O-N 3.07Å; K39-A43 WeakPolarHBondContact O-CB 3.49Å; K39-A43 PolarHBondContact O-N 3.43Å
40	G	78.9	Confident	68.4	Low	33 Å²	33	85.5 Å²	85.5	34%	0.34	42%	0.416	S	S	.	.	H	α-helix	trans	-63.7	-34.7	172.6	0	0	0	0	0	112.7	N38 D44	N38-G40 VanDerWaalsContact C-N 3.31Å; N38-G40 PolarHBondContact O-N 3.44Å; G40-D44 VanDerWaalsContact O-CB 3.26Å; G40-D44 WeakPolarHBondContact O-CB 3.4Å; G40-D44 PolarHBondContact O-N 2.89Å
41	R	81.5	Confident	71.4	Confident	63 Å²	63	84.7 Å²	84.7	24%	0.238	41%	0.412	C	S	.	.	H	α-helix	trans	-72.2	-42.7	178.7	-64.6	179.9	65.3	-171.4	5.9	113.1	N38 K39 A43 D44 Q45 L109 E333	N38-R41 WeakPolarHBondContact O-CA 3.35Å; N38-R41 WeakPolarHBondContact O-CB 3.37Å; N38-R41 PolarHBondContact O-N 2.8Å; N38-R41 WeakPolarHBondContact OD1-CD 3.44Å; N38-R41 PolarHBondContact OD1-NH1 2.89Å; K39-R41 VanDerWaalsContact C-N 3.3Å; K39-R41 PolarHBondContact O-N 3.07Å; R41-A43 VanDerWaalsContact C-N 3.34Å; R41-D44 PolarHBondContact O-N 3.35Å; R41-Q45 WeakPolarHBondContact O-CB 3.36Å; R41-Q45 PolarHBondContact O-N 3.48Å; R41-L109 HydrophobicContact CB-CD1 4.09Å; R41-E333 IonicContact CZ-OE1 3.94Å; R41-E333 IonicContact CZ-OE2 3.84Å; R41-E333 IonicContact NH1-OE1 2.71Å; R41-E333 PolarHBondContact NH1-OE1 2.82Å; R41-E333 IonicContact NH1-OE2 3.96Å; R41-E333 PolarHBondContact NH1-OE2 3.38Å; R41-E333 IonicContact NH2-OE1 3.1Å; R41-E333 PolarHBondContact NH2-OE1 3.04Å; R41-E333 IonicContact NH2-OE2 2.7Å; R41-E333 PolarHBondContact NH2-OE2 3Å
42	A	86.1	Confident	73.9	Confident	22 Å²	22	81.5 Å²	81.5	18%	0.182	39%	0.387	C	S	.	.	H	α-helix	trans	-62.6	-43.9	174	0	0	0	0	0	110.6	N38 Q45 E46 L109 F110	N38-A42 PolarHBondContact O-N 2.65Å; A42-Q45 PolarHBondContact O-N 3.12Å; A42-E46 WeakPolarHBondContact O-CB 3.44Å; A42-E46 PolarHBondContact O-N 3.39Å; A42-L109 HydrophobicContact CB-CB 4.1Å; A42-L109 WeakPolarHBondContact CB-O 3.38Å; A42-F110 HydrophobicContact CB-CB 4.5Å
43	A	88.5	Confident	76.8	Confident	46 Å²	46	71.8 Å²	71.8	38%	0.38	35%	0.351	S	S	.	.	H	α-helix	trans	-63.9	-39.5	175.3	0	0	0	0	0	112.6	K39 R41 K47	K39-A43 WeakPolarHBondContact O-CB 3.49Å; K39-A43 PolarHBondContact O-N 3.43Å; R41-A43 VanDerWaalsContact C-N 3.34Å; A43-K47 WeakPolarHBondContact O-CB 3.38Å; A43-K47 PolarHBondContact O-N 2.78Å
44	D	91.5	Very high	79.7	Confident	24 Å²	24	71.2 Å²	71.2	13%	0.128	35%	0.354	C	S	.	.	H	α-helix	trans	-64.1	-48.3	173.6	174.7	69.9	0	0	0	112	G40 R41 E46 K47 R48	G40-D44 VanDerWaalsContact O-CB 3.26Å; G40-D44 WeakPolarHBondContact O-CB 3.4Å; G40-D44 PolarHBondContact O-N 2.89Å; R41-D44 PolarHBondContact O-N 3.35Å; D44-E46 VanDerWaalsContact C-N 3.31Å; D44-E46 PolarHBondContact O-N 3.3Å; D44-K47 WeakPolarHBondContact O-CB 3.33Å; D44-K47 PolarHBondContact O-N 3.44Å; D44-K47 VanDerWaalsContact O-N 3.12Å; D44-R48 WeakPolarHBondContact O-CG 3.26Å; D44-R48 PolarHBondContact O-N 2.9Å; D44-R48 IonicContact OD1-NE 3.31Å; D44-R48 IonicContact OD2-CZ 2.78Å; D44-R48 IonicContact OD2-NE 3.43Å; D44-R48 PolarHBondContact OD2-NE 3.17Å; D44-R48 IonicContact OD2-NH2 3.57Å; D44-R48 PolarHBondContact OD2-NH2 2.67Å
45	Q	92.9	Very high	82.4	Confident	1 Å²	1	70.8 Å²	70.8	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-58.3	-45.2	176.6	-176.2	177.7	68.1	0	0	111.1	R41 A42 K47 R48 W49 E106 W107 L109 F110 P291	R41-Q45 WeakPolarHBondContact O-CB 3.36Å; R41-Q45 PolarHBondContact O-N 3.48Å; A42-Q45 PolarHBondContact O-N 3.12Å; Q45-K47 VanDerWaalsContact C-N 3.34Å; Q45-K47 PolarHBondContact O-N 2.8Å; Q45-R48 PolarHBondContact O-N 2.83Å; Q45-W49 WeakPolarHBondContact O-CB 3.37Å; Q45-W49 PolarHBondContact O-N 3.19Å; Q45-E106 VanDerWaalsContact NE2-CB 3.29Å; Q45-E106 PolarHBondContact NE2-OE2 3.02Å; Q45-W107 PolarHBondContact NE2-O 3.46Å; Q45-W107 PolarHBondContact OE1-O 2.93Å; Q45-L109 VanDerWaalsContact OE1-CB 3.31Å; Q45-L109 VanDerWaalsContact OE1-N 3.12Å; Q45-F110 HydrophobicContact CB-CD1 4.31Å; Q45-F110 HydrophobicContact CG-CD1 3.96Å; Q45-F110 HydrophobicContact CG-CE1 3.87Å; Q45-P291 HydrophobicContact CG-CB 4.08Å
46	E	95.5	Very high	84.7	Confident	56 Å²	56	65 Å²	65	26%	0.262	31%	0.312	S	S	.	.	H	α-helix	trans	-63.2	-38.9	176.7	-166.3	-166.8	-158.9	0	0	111.9	A42 D44 W49 R50 F110	A42-E46 WeakPolarHBondContact O-CB 3.44Å; A42-E46 PolarHBondContact O-N 3.39Å; D44-E46 VanDerWaalsContact C-N 3.31Å; D44-E46 PolarHBondContact O-N 3.3Å; E46-W49 WeakPolarHBondContact O-CB 3.32Å; E46-W49 PolarHBondContact O-N 2.98Å; E46-R50 WeakPolarHBondContact O-CG 3.38Å; E46-R50 PolarHBondContact O-N 3.45Å; E46-R50 IonicContact OE1-CZ 3.55Å; E46-R50 VanDerWaalsContact OE1-CZ 3.32Å; E46-R50 IonicContact OE1-NH1 2.82Å; E46-R50 PolarHBondContact OE1-NH1 3.25Å; E46-R50 IonicContact OE1-NH2 3.38Å; E46-R50 PolarHBondContact OE1-NH2 2.99Å; E46-R50 IonicContact OE2-CZ 3.18Å; E46-R50 IonicContact OE2-NH1 3.32Å; E46-R50 PolarHBondContact OE2-NH1 3.38Å; E46-R50 IonicContact OE2-NH2 2.65Å; E46-R50 PolarHBondContact OE2-NH2 3.12Å; E46-F110 HydrophobicContact CB-CD1 4.15Å; E46-F110 HydrophobicContact CB-CD2 3.96Å; E46-F110 HydrophobicContact CB-CE1 4.32Å; E46-F110 HydrophobicContact CB-CE2 4.11Å; E46-F110 HydrophobicContact CB-CG 3.99Å; E46-F110 HydrophobicContact CB-CZ 4.3Å; E46-F110 HydrophobicContact CG-CD2 3.65Å; E46-F110 HydrophobicContact CG-CE2 3.62Å; E46-F110 HydrophobicContact CG-CG 4.21Å; E46-F110 HydrophobicContact CG-CZ 4.16Å
47	K	95.8	Very high	86.9	Confident	94 Å²	94	63.4 Å²	63.4	41%	0.409	31%	0.308	S	S	.	.	H	α-helix	trans	-62.6	-49.6	174.6	179.6	-173.2	175	-170.3	0	111.4	V24 A43 D44 Q45 W49 R50 Q51	V24-K47 HydrophobicContact CG2-CD 4.35Å; A43-K47 WeakPolarHBondContact O-CB 3.38Å; A43-K47 PolarHBondContact O-N 2.78Å; D44-K47 WeakPolarHBondContact O-CB 3.33Å; D44-K47 PolarHBondContact O-N 3.44Å; D44-K47 VanDerWaalsContact O-N 3.12Å; Q45-K47 VanDerWaalsContact C-N 3.34Å; Q45-K47 PolarHBondContact O-N 2.8Å; K47-W49 VanDerWaalsContact C-N 3.31Å; K47-W49 PolarHBondContact O-N 3.39Å; K47-R50 PolarHBondContact O-N 2.83Å; K47-Q51 WeakPolarHBondContact O-CG 3.13Å; K47-Q51 PolarHBondContact O-N 3.02Å; K47-Q51 VanDerWaalsContact O-N 3.08Å
48	R	96	Very high	88.8	Confident	48 Å²	48	57.4 Å²	57.4	18%	0.181	29%	0.289	C	S	.	.	H	α-helix	trans	-63.8	-38.3	177.7	-68.3	-176.1	-66.7	98.3	-0.8	111.3	D44 Q45 Q51 K52 E106 P291	D44-R48 WeakPolarHBondContact O-CG 3.26Å; D44-R48 PolarHBondContact O-N 2.9Å; D44-R48 IonicContact OD1-NE 3.31Å; D44-R48 IonicContact OD2-CZ 2.78Å; D44-R48 IonicContact OD2-NE 3.43Å; D44-R48 PolarHBondContact OD2-NE 3.17Å; D44-R48 IonicContact OD2-NH2 3.57Å; D44-R48 PolarHBondContact OD2-NH2 2.67Å; Q45-R48 PolarHBondContact O-N 2.83Å; R48-Q51 PolarHBondContact O-N 3.32Å; R48-K52 WeakPolarHBondContact O-CB 3.42Å; R48-K52 PolarHBondContact O-N 2.87Å; R48-E106 IonicContact CZ-OE1 3.47Å; R48-E106 IonicContact CZ-OE2 3.53Å; R48-E106 IonicContact NH1-OE1 2.88Å; R48-E106 PolarHBondContact NH1-OE1 3.2Å; R48-E106 IonicContact NH1-OE2 3.62Å; R48-E106 PolarHBondContact NH1-OE2 3.49Å; R48-E106 IonicContact NH2-OE1 2.8Å; R48-E106 IonicContact NH2-OE2 3.44Å; R48-E106 PolarHBondContact NH2-OE2 3.14Å; R48-P291 HydrophobicContact CB-CB 4.44Å; R48-P291 HydrophobicContact CB-CG 3.98Å
49	W	96.9	Very high	90.4	Very high	19 Å²	19	62 Å²	62	7%	0.072	31%	0.308	C	S	.	.	H	α-helix	trans	-56.5	-51.3	173	179.1	94.5	0	0	0	111.7	Q45 E46 K47 Q51 K52 L53 F110 P112 P113 Y119 P291 L292	Q45-W49 WeakPolarHBondContact O-CB 3.37Å; Q45-W49 PolarHBondContact O-N 3.19Å; E46-W49 WeakPolarHBondContact O-CB 3.32Å; E46-W49 PolarHBondContact O-N 2.98Å; K47-W49 VanDerWaalsContact C-N 3.31Å; K47-W49 PolarHBondContact O-N 3.39Å; W49-Q51 PolarHBondContact O-N 2.87Å; W49-K52 PolarHBondContact O-N 3.42Å; W49-L53 HydrophobicContact CD2-CD1 4.03Å; W49-L53 HydrophobicContact CD2-CG 4.39Å; W49-L53 HydrophobicContact CE3-CD1 4.17Å; W49-L53 HydrophobicContact CH2-CD1 3.31Å; W49-L53 HydrophobicContact CZ2-CD1 3.17Å; W49-L53 HydrophobicContact CZ2-CG 4.23Å; W49-L53 HydrophobicContact CZ3-CD1 3.83Å; W49-L53 PolarHBondContact O-N 2.77Å; W49-F110 HydrophobicContact CB-CE1 4.13Å; W49-F110 HydrophobicContact CB-CZ 3.79Å; W49-F110 AromaticContact CD1-CZ 3.77Å; W49-F110 HydrophobicContact CD2-CE2 4.43Å; W49-F110 AromaticContact CD2-CZ 3.86Å; W49-F110 HydrophobicContact CD2-CZ 3.86Å; W49-F110 HydrophobicContact CE3-CZ 4.39Å; W49-F110 HydrophobicContact CG-CE1 4.25Å; W49-F110 AromaticContact CG-CZ 3.55Å; W49-F110 HydrophobicContact CG-CZ 3.55Å; W49-P112 HydrophobicContact CZ2-CB 3.92Å; W49-P113 HydrophobicContact CH2-CG 3.6Å; W49-P113 HydrophobicContact CZ2-CG 4.48Å; W49-P113 HydrophobicContact CZ3-CG 4.11Å; W49-Y119 AromaticContact NE1-CZ 3.93Å; W49-Y119 PolarHBondContact NE1-OH 3.04Å; W49-P291 HydrophobicContact CB-CB 4.07Å; W49-P291 HydrophobicContact CB-CG 4.4Å; W49-L292 VanDerWaalsContact CD1-CD2 3.47Å; W49-L292 HydrophobicContact CG-CD2 4.14Å
50	R	97.5	Very high	91.5	Very high	129 Å²	129	61.4 Å²	61.4	49%	0.487	31%	0.306	S	S	.	.	H	α-helix	trans	-59.3	-45.1	177.9	-73.3	-175.6	-179.6	100.9	3.1	112	E46 K47 K52 S54	E46-R50 WeakPolarHBondContact O-CG 3.38Å; E46-R50 PolarHBondContact O-N 3.45Å; E46-R50 IonicContact OE1-CZ 3.55Å; E46-R50 VanDerWaalsContact OE1-CZ 3.32Å; E46-R50 IonicContact OE1-NH1 2.82Å; E46-R50 PolarHBondContact OE1-NH1 3.25Å; E46-R50 IonicContact OE1-NH2 3.38Å; E46-R50 PolarHBondContact OE1-NH2 2.99Å; E46-R50 IonicContact OE2-CZ 3.18Å; E46-R50 IonicContact OE2-NH1 3.32Å; E46-R50 PolarHBondContact OE2-NH1 3.38Å; E46-R50 IonicContact OE2-NH2 2.65Å; E46-R50 PolarHBondContact OE2-NH2 3.12Å; K47-R50 PolarHBondContact O-N 2.83Å; R50-K52 VanDerWaalsContact C-N 3.34Å; R50-K52 PolarHBondContact O-N 3.24Å; R50-S54 WeakPolarHBondContact O-CB 3.41Å; R50-S54 PolarHBondContact O-N 2.87Å
51	Q	96.4	Very high	91.8	Very high	103 Å²	103	65.9 Å²	65.9	48%	0.481	32%	0.318	S	S	.	.	H	α-helix	trans	-60.2	-45.5	178.1	-71.9	174.2	-20.2	0	0	111.3	K47 R48 W49 S54 I55	K47-Q51 WeakPolarHBondContact O-CG 3.13Å; K47-Q51 PolarHBondContact O-N 3.02Å; K47-Q51 VanDerWaalsContact O-N 3.08Å; R48-Q51 PolarHBondContact O-N 3.32Å; W49-Q51 PolarHBondContact O-N 2.87Å; Q51-S54 WeakPolarHBondContact O-CB 3.27Å; Q51-S54 PolarHBondContact O-N 3.47Å; Q51-I55 WeakPolarHBondContact O-CG1 3.45Å; Q51-I55 PolarHBondContact O-N 3.24Å
52	K	94.6	Very high	92	Very high	46 Å²	46	70.7 Å²	70.7	20%	0.2	34%	0.336	C	S	.	.	H	α-helix	trans	-67.8	-41.6	-177.5	-151.1	158.7	-162.3	178.1	0	112.4	R48 W49 R50 S54 I55 L56 E286 T290 P291 L292	R48-K52 WeakPolarHBondContact O-CB 3.42Å; R48-K52 PolarHBondContact O-N 2.87Å; W49-K52 PolarHBondContact O-N 3.42Å; R50-K52 VanDerWaalsContact C-N 3.34Å; R50-K52 PolarHBondContact O-N 3.24Å; K52-S54 VanDerWaalsContact C-N 3.35Å; K52-S54 PolarHBondContact O-N 3.14Å; K52-I55 PolarHBondContact O-N 3.46Å; K52-L56 WeakPolarHBondContact O-CG 3.34Å; K52-L56 PolarHBondContact O-N 3.31Å; K52-E286 WeakPolarHBondContact CE-OE1 3.36Å; K52-E286 WeakPolarHBondContact CE-OE2 3.4Å; K52-E286 IonicContact NZ-OE1 3.49Å; K52-E286 PolarHBondContact NZ-OE1 3.49Å; K52-E286 IonicContact NZ-OE2 3.37Å; K52-E286 PolarHBondContact NZ-OE2 3.45Å; K52-T290 WeakPolarHBondContact CD-OG1 3.41Å; K52-T290 WeakPolarHBondContact CE-OG1 3.38Å; K52-T290 PolarHBondContact NZ-OG1 3.25Å; K52-P291 HydrophobicContact CD-CG 4.24Å; K52-L292 HydrophobicContact CB-CD1 4.05Å; K52-L292 HydrophobicContact CB-CG 4.21Å; K52-L292 HydrophobicContact CD-CD1 4.11Å; K52-L292 HydrophobicContact CD-CG 4.24Å; K52-L292 HydrophobicContact CG-CD1 3.79Å; K52-L292 HydrophobicContact CG-CG 4.26Å
53	L	95.2	Very high	91.7	Very high	13 Å²	13	72.6 Å²	72.6	7%	0.068	35%	0.348	C	S	.	.	H	α-helix	trans	-62.2	-40.6	171.8	-76	-167.1	0	0	0	112.9	W49 I55 L56 K57 L292	W49-L53 HydrophobicContact CD2-CD1 4.03Å; W49-L53 HydrophobicContact CD2-CG 4.39Å; W49-L53 HydrophobicContact CE3-CD1 4.17Å; W49-L53 HydrophobicContact CH2-CD1 3.31Å; W49-L53 HydrophobicContact CZ2-CD1 3.17Å; W49-L53 HydrophobicContact CZ2-CG 4.23Å; W49-L53 HydrophobicContact CZ3-CD1 3.83Å; W49-L53 PolarHBondContact O-N 2.77Å; L53-I55 VanDerWaalsContact C-N 3.28Å; L53-I55 PolarHBondContact O-N 3.18Å; L53-L56 HydrophobicContact CD2-CD1 4.28Å; L53-L56 PolarHBondContact O-N 3.08Å; L53-K57 WeakPolarHBondContact O-CG 3.45Å; L53-K57 PolarHBondContact O-N 3.33Å; L53-L292 HydrophobicContact CD2-CD1 4.15Å; L53-L292 HydrophobicContact CD2-CD2 3.54Å; L53-L292 HydrophobicContact CG-CD2 3.71Å
54	S	95.4	Very high	91.1	Very high	69 Å²	69	73.9 Å²	73.9	48%	0.483	35%	0.349	S	S	.	.	H	α-helix	trans	-59.2	-43	175.8	-171.3	0	0	0	0	111.1	R50 Q51 K52 K57 S58	R50-S54 WeakPolarHBondContact O-CB 3.41Å; R50-S54 PolarHBondContact O-N 2.87Å; Q51-S54 WeakPolarHBondContact O-CB 3.27Å; Q51-S54 PolarHBondContact O-N 3.47Å; K52-S54 VanDerWaalsContact C-N 3.35Å; K52-S54 PolarHBondContact O-N 3.14Å; S54-K57 PolarHBondContact O-N 3.3Å; S54-S58 PolarHBondContact O-N 3.24Å; S54-S58 PolarHBondContact O-OG 3.49Å; S54-S58 VanDerWaalsContact O-OG 3.12Å
55	I	92.4	Very high	90.3	Very high	94 Å²	94	78.5 Å²	78.5	48%	0.482	37%	0.369	S	S	.	.	H	α-helix	trans	-63.9	-42.1	177.7	-68	164.1	0	0	0	111.2	Q51 K52 L53 K59	Q51-I55 WeakPolarHBondContact O-CG1 3.45Å; Q51-I55 PolarHBondContact O-N 3.24Å; K52-I55 PolarHBondContact O-N 3.46Å; L53-I55 VanDerWaalsContact C-N 3.28Å; L53-I55 PolarHBondContact O-N 3.18Å; I55-K59 HydrophobicContact CG2-CD 4.26Å; I55-K59 WeakPolarHBondContact O-CB 3.48Å; I55-K59 WeakPolarHBondContact O-CG 3.44Å; I55-K59 PolarHBondContact O-N 3.07Å
56	L	91.8	Very high	89.5	Confident	22 Å²	22	85.1 Å²	85.1	12%	0.115	40%	0.398	C	S	.	.	H	α-helix	trans	-63	-47.1	177.3	-71.8	177.7	0	0	0	111.8	K52 L53 S58 K59 K60 N284 L292	K52-L56 WeakPolarHBondContact O-CG 3.34Å; K52-L56 PolarHBondContact O-N 3.31Å; L53-L56 HydrophobicContact CD2-CD1 4.28Å; L53-L56 PolarHBondContact O-N 3.08Å; L56-S58 PolarHBondContact O-N 2.93Å; L56-K59 WeakPolarHBondContact O-CB 3.29Å; L56-K59 PolarHBondContact O-N 3.04Å; L56-K60 PolarHBondContact O-N 3.42Å; L56-N284 WeakPolarHBondContact CD2-OD1 3.15Å; L56-L292 HydrophobicContact CD1-CD1 3.43Å; L56-L292 VanDerWaalsContact CD1-CD1 3.43Å
57	K	91.6	Very high	88.4	Confident	127 Å²	127	85.4 Å²	85.4	55%	0.552	40%	0.402	S	S	*	.	H	α-helix	trans	-59.4	-47.9	177.2	-71.2	177.3	-179.2	-177.1	0	111.5	L53 S54 K59 K60 E61	L53-K57 WeakPolarHBondContact O-CG 3.45Å; L53-K57 PolarHBondContact O-N 3.33Å; S54-K57 PolarHBondContact O-N 3.3Å; K57-K59 VanDerWaalsContact C-N 3.31Å; K57-K59 PolarHBondContact O-N 3.26Å; K57-K60 WeakPolarHBondContact O-CB 3.47Å; K57-K60 PolarHBondContact O-N 3.36Å; K57-K60 VanDerWaalsContact O-N 3.16Å; K57-E61 WeakPolarHBondContact O-CG 3.47Å; K57-E61 PolarHBondContact O-N 3.08Å
58	S	90.4	Very high	87.2	Confident	52 Å²	52	87.3 Å²	87.3	36%	0.364	41%	0.411	S	S	.	.	H	α-helix	trans	-66.9	-27.4	177	-58.9	0	0	0	0	113.8	S54 L56 R62	S54-S58 PolarHBondContact O-N 3.24Å; S54-S58 PolarHBondContact O-OG 3.49Å; S54-S58 VanDerWaalsContact O-OG 3.12Å; L56-S58 PolarHBondContact O-N 2.93Å; S58-R62 VanDerWaalsContact O-CG 3.28Å; S58-R62 WeakPolarHBondContact O-CG 3.36Å; S58-R62 PolarHBondContact O-N 2.81Å; S58-R62 PolarHBondContact O-NE 3.33Å
59	K	86.8	Confident	86.2	Confident	108 Å²	108	89.3 Å²	89.3	47%	0.47	43%	0.426	S	S	.	.	H	α-helix	trans	-67.9	-45.5	170.8	-82.3	175.4	177.2	-174.5	0	110.8	I55 L56 K57 R62 S63	I55-K59 HydrophobicContact CG2-CD 4.26Å; I55-K59 WeakPolarHBondContact O-CB 3.48Å; I55-K59 WeakPolarHBondContact O-CG 3.44Å; I55-K59 PolarHBondContact O-N 3.07Å; L56-K59 WeakPolarHBondContact O-CB 3.29Å; L56-K59 PolarHBondContact O-N 3.04Å; K57-K59 VanDerWaalsContact C-N 3.31Å; K57-K59 PolarHBondContact O-N 3.26Å; K59-R62 VanDerWaalsContact CG-NH2 3.29Å; K59-R62 PolarHBondContact O-N 2.69Å; K59-S63 PolarHBondContact O-N 3.25Å
60	K	85.4	Confident	84.8	Confident	121 Å²	121	95.3 Å²	95.3	53%	0.526	45%	0.448	S	S	.	.	H	α-helix	trans	-61	-50.5	178.2	-172.7	171.9	-178	171.6	0	111.5	L56 K57 R62 S63 D64	L56-K60 PolarHBondContact O-N 3.42Å; K57-K60 WeakPolarHBondContact O-CB 3.47Å; K57-K60 PolarHBondContact O-N 3.36Å; K57-K60 VanDerWaalsContact O-N 3.16Å; K60-R62 VanDerWaalsContact C-N 3.29Å; K60-R62 PolarHBondContact O-N 3.22Å; K60-S63 WeakPolarHBondContact O-CB 3.39Å; K60-S63 PolarHBondContact O-N 2.77Å; K60-D64 VanDerWaalsContact O-CG 3.24Å; K60-D64 PolarHBondContact O-N 2.8Å
61	E	86	Confident	83.1	Confident	126 Å²	126	97 Å²	97	59%	0.589	46%	0.46	S	S	*	.	H	α-helix	trans	-56.8	-39.9	177	-71.5	167.2	-179.6	0	0	112.9	K57 H65	K57-E61 WeakPolarHBondContact O-CG 3.47Å; K57-E61 PolarHBondContact O-N 3.08Å; E61-H65 VanDerWaalsContact O-CB 3.23Å; E61-H65 WeakPolarHBondContact O-CB 3.41Å; E61-H65 PolarHBondContact O-N 2.97Å
62	R	85.2	Confident	81	Confident	164 Å²	164	96.2 Å²	96.2	62%	0.619	47%	0.465	S	S	*	.	H	α-helix	trans	-68.5	-38	176.2	-75.4	-176	-61.2	123	-6.6	112.6	S58 K59 K60 F66	S58-R62 VanDerWaalsContact O-CG 3.28Å; S58-R62 WeakPolarHBondContact O-CG 3.36Å; S58-R62 PolarHBondContact O-N 2.81Å; S58-R62 PolarHBondContact O-NE 3.33Å; K59-R62 VanDerWaalsContact CG-NH2 3.29Å; K59-R62 PolarHBondContact O-N 2.69Å; K60-R62 VanDerWaalsContact C-N 3.29Å; K60-R62 PolarHBondContact O-N 3.22Å; R62-F66 WeakPolarHBondContact O-CB 3.44Å; R62-F66 PolarHBondContact O-N 2.9Å
63	S	79.6	Confident	78.6	Confident	62 Å²	62	99.5 Å²	99.5	43%	0.434	49%	0.489	S	S	.	.	H	α-helix	trans	-65.4	-47.9	174.7	-162.6	0	0	0	0	110.5	K59 K60 H65 F66 D67	K59-S63 PolarHBondContact O-N 3.25Å; K60-S63 WeakPolarHBondContact O-CB 3.39Å; K60-S63 PolarHBondContact O-N 2.77Å; S63-H65 VanDerWaalsContact C-N 3.32Å; S63-H65 PolarHBondContact O-N 3.5Å; S63-F66 WeakPolarHBondContact O-CB 3.21Å; S63-F66 PolarHBondContact O-N 3.13Å; S63-F66 VanDerWaalsContact O-N 3.1Å; S63-D67 PolarHBondContact O-N 3.07Å
64	D	76.1	Confident	76.3	Confident	74 Å²	74	106.6 Å²	106.6	40%	0.396	53%	0.527	S	S	.	.	H	α-helix	trans	-61.2	-41.9	179.1	-64.6	-15.5	0	0	0	111	K60 D67 H68	K60-D64 VanDerWaalsContact O-CG 3.24Å; K60-D64 PolarHBondContact O-N 2.8Å; D64-D67 PolarHBondContact O-N 3.23Å; D64-H68 WeakPolarHBondContact O-CB 3.45Å; D64-H68 PolarHBondContact O-CD2 2.7Å; D64-H68 PolarHBondContact O-N 3.29Å
65	H	75.8	Confident	74	Confident	121 Å²	121	112.2 Å²	112.2	56%	0.56	54%	0.543	S	S	*	.	H	α-helix	trans	-63.7	-41.7	174.2	178.9	-90.2	0	0	0	112.4	E61 S63 N69	E61-H65 VanDerWaalsContact O-CB 3.23Å; E61-H65 WeakPolarHBondContact O-CB 3.41Å; E61-H65 PolarHBondContact O-N 2.97Å; S63-H65 VanDerWaalsContact C-N 3.32Å; S63-H65 PolarHBondContact O-N 3.5Å; H65-N69 PolarHBondContact CE1-ND2 3.05Å; H65-N69 PolarHBondContact ND1-ND2 3.1Å; H65-N69 PolarHBondContact O-N 3.12Å; H65-N69 PolarHBondContact O-ND2 2.69Å
66	F	75.5	Confident	71.6	Confident	140 Å²	140	116.3 Å²	116.3	61%	0.614	56%	0.56	S	S	*	*	H	α-helix	trans	-62.3	-44.9	175.4	178.6	-95.9	0	0	0	111.5	R62 S63 N69 R70	R62-F66 WeakPolarHBondContact O-CB 3.44Å; R62-F66 PolarHBondContact O-N 2.9Å; S63-F66 WeakPolarHBondContact O-CB 3.21Å; S63-F66 PolarHBondContact O-N 3.13Å; S63-F66 VanDerWaalsContact O-N 3.1Å; F66-N69 PolarHBondContact O-N 3.29Å; F66-R70 PolarHBondContact O-N 3.07Å
67	D	73.1	Confident	69	Low	62 Å²	62	124 Å²	124	33%	0.332	60%	0.595	S	S	.	*	H	α-helix	trans	-67.9	-40.5	178.8	-74.5	-32.7	0	0	0	112.2	S63 D64 N69 R70 F71	S63-D67 PolarHBondContact O-N 3.07Å; D64-D67 PolarHBondContact O-N 3.23Å; D67-N69 VanDerWaalsContact C-N 3.25Å; D67-N69 PolarHBondContact O-N 2.47Å; D67-R70 VanDerWaalsContact O-CB 3.27Å; D67-R70 WeakPolarHBondContact O-CB 3.09Å; D67-R70 PolarHBondContact O-N 2.7Å; D67-F71 WeakPolarHBondContact O-CD2 3.32Å; D67-F71 PolarHBondContact O-N 3.47Å
68	H	68.8	Low	66.4	Low	133 Å²	133	124.3 Å²	124.3	62%	0.616	60%	0.602	S	S	*	*	H	α-helix	trans	-56.1	-39.2	172.6	-90.5	-62	0	0	0	112.8	D64 R70 F71 S72	D64-H68 WeakPolarHBondContact O-CB 3.45Å; D64-H68 PolarHBondContact O-CD2 2.7Å; D64-H68 PolarHBondContact O-N 3.29Å; H68-R70 VanDerWaalsContact C-N 3.29Å; H68-R70 PolarHBondContact O-N 3.45Å; H68-F71 PolarHBondContact O-N 3.44Å; H68-S72 PolarHBondContact O-N 3.41Å; H68-S72 PolarHBondContact O-OG 2.97Å
69	N	75.2	Confident	64	Low	90 Å²	90	127.7 Å²	127.7	48%	0.481	63%	0.626	S	S	.	*	H	α-helix	trans	-72.7	-21.4	177.2	-70.7	-20.1	0	0	0	113.2	H65 F66 D67 F71	H65-N69 PolarHBondContact CE1-ND2 3.05Å; H65-N69 PolarHBondContact ND1-ND2 3.1Å; H65-N69 PolarHBondContact O-N 3.12Å; H65-N69 PolarHBondContact O-ND2 2.69Å; F66-N69 PolarHBondContact O-N 3.29Å; D67-N69 VanDerWaalsContact C-N 3.25Å; D67-N69 PolarHBondContact O-N 2.47Å; N69-F71 VanDerWaalsContact C-N 3.34Å
70	R	67.6	Low	61.8	Low	145 Å²	145	130.5 Å²	130.5	55%	0.547	64%	0.638	S	S	.	*	H	α-helix	trans	-72.2	-29.6	176.1	-160.5	178.5	-174.3	-178.6	2.3	112.7	F66 D67 H68 P82	F66-R70 PolarHBondContact O-N 3.07Å; D67-R70 VanDerWaalsContact O-CB 3.27Å; D67-R70 WeakPolarHBondContact O-CB 3.09Å; D67-R70 PolarHBondContact O-N 2.7Å; H68-R70 VanDerWaalsContact C-N 3.29Å; H68-R70 PolarHBondContact O-N 3.45Å; R70-P82 VanDerWaalsContact NH2-CG 3.32Å
71	F	61.7	Low	59.6	Low	166 Å²	166	132.5 Å²	132.5	73%	0.728	65%	0.649	S	S	*	*	H	α-helix	trans	-96.2	-7.7	178	-60	-72.7	0	0	0	113.4	D67 H68 N69 V73	D67-F71 WeakPolarHBondContact O-CD2 3.32Å; D67-F71 PolarHBondContact O-N 3.47Å; H68-F71 PolarHBondContact O-N 3.44Å; N69-F71 VanDerWaalsContact C-N 3.34Å; F71-V73 PolarHBondContact O-N 2.96Å; F71-V73 VanDerWaalsContact O-N 3.11Å
72	S	53.1	Low	57.8	Low	85 Å²	85	130 Å²	130	59%	0.594	64%	0.644	S	S	*	*	S	Bend	trans	-72.2	105.8	172.6	-73.4	0	0	0	0	110	H68 N74	H68-S72 PolarHBondContact O-N 3.41Å; H68-S72 PolarHBondContact O-OG 2.97Å; S72-N74 PolarHBondContact O-N 3.41Å; S72-N74 VanDerWaalsContact O-N 3.09Å
73	V	44.7	Very low	55.6	Low	116 Å²	116	132.5 Å²	132.5	70%	0.703	65%	0.653	S	S	*	*			trans	-49	102.1	-173.4	-175.1	0	0	0	0	112.7	F71 K75	F71-V73 PolarHBondContact O-N 2.96Å; F71-V73 VanDerWaalsContact O-N 3.11Å; V73-K75 HydrophobicContact CG1-CG 4.39Å
74	N	47.4	Very low	53.7	Low	161 Å²	161	133.1 Å²	133.1	86%	0.861	66%	0.662	S	S	*	*			trans	-117.7	95.9	133	-96.8	-21.8	0	0	0	106.9	S72 E76	S72-N74 PolarHBondContact O-N 3.41Å; S72-N74 VanDerWaalsContact O-N 3.09Å; N74-E76 VanDerWaalsContact C-N 3.32Å; N74-E76 PolarHBondContact O-N 3.03Å
75	K	45.9	Very low	51.9	Low	188 Å²	188	134.7 Å²	134.7	82%	0.817	68%	0.679	S	S	*	*			trans	-67.3	94.4	166.2	-95.3	-179.5	171.5	176.7	0	107	V73	V73-K75 HydrophobicContact CG1-CG 4.39Å
76	E	42.3	Very low	50	Low	180 Å²	180	134.6 Å²	134.6	84%	0.841	69%	0.687	S	S	*	*	S	Bend	trans	173.4	129.4	146.5	-96.1	157.5	-158.4	0	0	106.4	N74	N74-E76 VanDerWaalsContact C-N 3.32Å; N74-E76 PolarHBondContact O-N 3.03Å
77	E	37.3	Very low	48	Very low	183 Å²	183	135.3 Å²	135.3	86%	0.855	69%	0.692	S	S	*	*			trans	76.8	100.2	179.9	-50.2	-168.6	161.4	0	0	116.9
78	L	35.8	Very low	46.2	Very low	133 Å²	133	139.1 Å²	139.1	70%	0.696	71%	0.711	S	S	*	*				179.3	110	91.4	-139.8	76.4	0	0	0	110.3	K80	L78-K80 VanDerWaalsContact C-N 3.29Å; L78-K80 HydrophobicContact CD2-CD 4.35Å; L78-K80 PolarHBondContact O-N 3.42Å
79	S	40.8	Very low	44.3	Very low	124 Å²	124	141.3 Å²	141.3	87%	0.867	72%	0.719	S	S	*	*			trans	-69.9	76	168.9	55.1	0	0	0	0	111.1
80	K	39.8	Very low	42.5	Very low	166 Å²	166	140.3 Å²	140.3	72%	0.722	72%	0.719	S	S	*	*			trans	-142.9	112.4	165	-75.5	-178.3	178.4	168.1	0	109.3	L78 P82	L78-K80 VanDerWaalsContact C-N 3.29Å; L78-K80 HydrophobicContact CD2-CD 4.35Å; L78-K80 PolarHBondContact O-N 3.42Å; K80-P82 WeakPolarHBondContact O-CD 3.4Å
81	H	39.9	Very low	40.9	Very low	163 Å²	163	140.2 Å²	140.2	76%	0.755	73%	0.725	S	S	*	*			trans	-54.6	118.2	-179.5	-95	-82.1	0	0	0	111.4	W83	H81-W83 VanDerWaalsContact C-N 3.28Å; H81-W83 PolarHBondContact O-N 3.34Å
82	P	49	Very low	39.7	Very low	74 Å²	74	136.7 Å²	136.7	48%	0.481	71%	0.713	S	S	.	*	T	Hydrogen-bonded Turn	trans	-71.5	-16.8	-176.3	-18.7	30.8	0	0	0	115.4	R70 K80	R70-P82 VanDerWaalsContact NH2-CG 3.32Å; K80-P82 WeakPolarHBondContact O-CD 3.4Å
83	W	38.4	Very low	38.7	Very low	216 Å²	216	138.2 Å²	138.2	82%	0.818	71%	0.709	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99	11.8	-175.5	-60.8	-81.2	0	0	0	114	H81 S85	H81-W83 VanDerWaalsContact C-N 3.28Å; H81-W83 PolarHBondContact O-N 3.34Å; W83-S85 PolarHBondContact O-N 3.12Å
84	A	40.2	Very low	38.4	Very low	75 Å²	75	135.5 Å²	135.5	62%	0.62	70%	0.695	S	S	*	*			trans	-68.4	82.2	159.9	0	0	0	0	0	107.1	T86	A84-T86 VanDerWaalsContact C-N 3.34Å; A84-T86 PolarHBondContact O-N 3.2Å
85	S	37.4	Very low	37.8	Very low	108 Å²	108	136 Å²	136	76%	0.755	69%	0.685	S	S	*	*			trans	-46.3	103.6	169.3	176.1	0	0	0	0	106.8	W83 Q87	W83-S85 PolarHBondContact O-N 3.12Å; S85-Q87 PolarHBondContact O-N 3.48Å
86	T	35.5	Very low	37.4	Very low	118 Å²	118	135.5 Å²	135.5	72%	0.724	68%	0.678	S	S	*	*			trans	-60.6	113.4	164.4	-61.2	0	0	0	0	102.7	A84 I88	A84-T86 VanDerWaalsContact C-N 3.34Å; A84-T86 PolarHBondContact O-N 3.2Å; T86-I88 PolarHBondContact O-N 3.01Å
87	Q	34.1	Very low	37.6	Very low	155 Å²	155	134 Å²	134	72%	0.724	67%	0.665	S	S	*	*			trans	-48.3	99.4	168.6	-85.5	179.5	-24	0	0	106	S85 K89	S85-Q87 PolarHBondContact O-N 3.48Å; Q87-K89 PolarHBondContact O-N 3.46Å
88	I	35.3	Very low	38.1	Very low	143 Å²	143	126.2 Å²	126.2	73%	0.733	63%	0.628	S	S	*	*			trans	-68.1	90.7	167.2	-60.6	176.4	0	0	0	101.6	T86 S90	T86-I88 PolarHBondContact O-N 3.01Å; I88-S90 PolarHBondContact O-N 2.94Å
89	K	29.7	Very low	38.6	Very low	178 Å²	178	121.3 Å²	121.3	77%	0.774	61%	0.605	S	S	*	*			trans	-63	72	156.7	-70.2	-177.6	-180	178.3	0	104.8	Q87 E91	Q87-K89 PolarHBondContact O-N 3.46Å; K89-E91 PolarHBondContact O-N 2.94Å
90	S	37.5	Very low	39.7	Very low	70 Å²	70	122 Å²	122	49%	0.49	59%	0.592	S	S	.	*			trans	-63.4	97.4	159.9	50.8	0	0	0	0	103	I88 I92	I88-S90 PolarHBondContact O-N 2.94Å; S90-I92 PolarHBondContact O-N 3.02Å
91	E	32.3	Very low	41.4	Very low	143 Å²	143	116.2 Å²	116.2	67%	0.668	57%	0.569	S	S	*	*			trans	-58.9	89	159.4	-70.8	-178.5	163	0	0	105.2	K89 K93	K89-E91 PolarHBondContact O-N 2.94Å; E91-K93 HydrophobicContact CB-CG 4.16Å; E91-K93 PolarHBondContact O-N 3.25Å; E91-K93 WeakPolarHBondContact OE2-CE 3.2Å; E91-K93 IonicContact OE2-NZ 2.67Å
92	I	37.2	Very low	43.6	Very low	92 Å²	92	108.7 Å²	108.7	47%	0.472	53%	0.534	S	S	.	.			trans	-68	79.6	168.3	-58.1	175.5	0	0	0	105.1	S90 S94 H98	S90-I92 PolarHBondContact O-N 3.02Å; I92-S94 PolarHBondContact O-N 3.26Å; I92-H98 WeakPolarHBondContact CG2-NE2 3.36Å
93	K	31.6	Very low	45.6	Very low	116 Å²	116	105.3 Å²	105.3	50%	0.504	51%	0.512	S	S	.	.			trans	-64.2	121.9	178.6	-76.5	172.5	-179.7	173.3	0	107.7	E91 R97	E91-K93 HydrophobicContact CB-CG 4.16Å; E91-K93 PolarHBondContact O-N 3.25Å; E91-K93 WeakPolarHBondContact OE2-CE 3.2Å; E91-K93 IonicContact OE2-NZ 2.67Å; K93-R97 WeakPolarHBondContact O-CD 3.24Å; K93-R97 PolarHBondContact O-NE 2.74Å; K93-R97 PolarHBondContact O-NH1 3.25Å
94	S	38.1	Very low	48.1	Very low	60 Å²	60	95.3 Å²	95.3	42%	0.42	47%	0.474	S	S	.	.			trans	65.4	122.2	168.6	-176.3	0	0	0	0	116.2	I92 R96 R97	I92-S94 PolarHBondContact O-N 3.26Å; S94-R96 PolarHBondContact O-N 3.41Å; S94-R96 PolarHBondContact OG-N 3.49Å; S94-R97 PolarHBondContact O-N 2.99Å
95	W	34.7	Very low	50.7	Low	171 Å²	171	92.3 Å²	92.3	65%	0.648	45%	0.45	S	S	*	.	G	3₁₀ helix	trans	-48.7	-27.1	170.4	62.2	-84.5	0	0	0	113.7	R97 H98	W95-R97 PolarHBondContact O-N 2.86Å; W95-H98 PolarHBondContact O-N 3.5Å; W95-H98 VanDerWaalsContact O-N 3.13Å
96	R	38.4	Very low	53.3	Low	178 Å²	178	87.8 Å²	87.8	67%	0.672	42%	0.417	S	S	*	.	G	3₁₀ helix	trans	-67.6	-11.8	177.9	-62.3	-166.4	-171.3	-159.4	4.3	114.5	S94 S99	S94-R96 PolarHBondContact O-N 3.41Å; S94-R96 PolarHBondContact OG-N 3.49Å; R96-S99 PolarHBondContact O-OG 2.92Å; R96-S99 VanDerWaalsContact O-OG 3.09Å
97	R	45.9	Very low	56.1	Low	149 Å²	149	82.6 Å²	82.6	56%	0.562	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-88.3	-14.6	173.6	-62.1	-170.7	-163.7	153	4.5	113.4	K93 S94 W95 S99 K100	K93-R97 WeakPolarHBondContact O-CD 3.24Å; K93-R97 PolarHBondContact O-NE 2.74Å; K93-R97 PolarHBondContact O-NH1 3.25Å; S94-R97 PolarHBondContact O-N 2.99Å; W95-R97 PolarHBondContact O-N 2.86Å; R97-S99 PolarHBondContact O-N 2.96Å; R97-K100 PolarHBondContact O-N 2.65Å
98	H	48.7	Very low	59	Low	19 Å²	19	75.2 Å²	75.2	9%	0.088	35%	0.349	C	S	.	.	G	3₁₀ helix	trans	-71.5	-19.2	-179.2	-71.7	-102.9	0	0	0	113.3	I92 W95 K100 L101 F131	I92-H98 WeakPolarHBondContact CG2-NE2 3.36Å; W95-H98 PolarHBondContact O-N 3.5Å; W95-H98 VanDerWaalsContact O-N 3.13Å; H98-K100 PolarHBondContact O-N 3.15Å; H98-L101 HydrophobicContact CB-CD1 3.79Å; H98-L101 HydrophobicContact CB-CG 4.45Å; H98-L101 WeakPolarHBondContact ND1-CD1 3.24Å; H98-L101 WeakPolarHBondContact O-CB 3.46Å; H98-L101 PolarHBondContact O-N 3.21Å; H98-F131 AromaticContact ND1-CE1 3.65Å; H98-F131 AromaticContact ND1-CZ 3.92Å
99	S	45.8	Very low	61.7	Low	29 Å²	29	69 Å²	69	20%	0.203	32%	0.318	C	S	.	.	G	3₁₀ helix	trans	-58.9	-31.3	171	53.6	0	0	0	0	112.2	R96 R97 L101 R144	R96-S99 PolarHBondContact O-OG 2.92Å; R96-S99 VanDerWaalsContact O-OG 3.09Å; R97-S99 PolarHBondContact O-N 2.96Å; S99-L101 VanDerWaalsContact C-N 3.31Å; S99-L101 PolarHBondContact O-N 2.89Å; S99-R144 CarbonylContact C-O 3.54Å; S99-R144 WeakPolarHBondContact CA-O 3.33Å; S99-R144 WeakPolarHBondContact CB-O 3.38Å
100	K	64.1	Low	64.7	Low	140 Å²	140	61.3 Å²	61.3	61%	0.609	28%	0.284	S	S	*	.	G	3₁₀ helix	trans	-96.4	45	175.8	-54.2	-168.3	178.9	-149.8	0	111	R97 H98 P287	R97-K100 PolarHBondContact O-N 2.65Å; H98-K100 PolarHBondContact O-N 3.15Å; K100-P287 VanDerWaalsContact C-CB 3.44Å; K100-P287 WeakPolarHBondContact O-CB 3.47Å; K100-P287 WeakPolarHBondContact O-CG 3.38Å
101	L	74.5	Confident	67.5	Low	44 Å²	44	61.7 Å²	61.7	23%	0.23	28%	0.279	C	S	.	.	G	3₁₀ helix	trans	-110.8	-19.1	173.2	-71.2	176.6	0	0	0	113.6	H98 S99 F131 Y285	H98-L101 HydrophobicContact CB-CD1 3.79Å; H98-L101 HydrophobicContact CB-CG 4.45Å; H98-L101 WeakPolarHBondContact ND1-CD1 3.24Å; H98-L101 WeakPolarHBondContact O-CB 3.46Å; H98-L101 PolarHBondContact O-N 3.21Å; S99-L101 VanDerWaalsContact C-N 3.31Å; S99-L101 PolarHBondContact O-N 2.89Å; L101-F131 HydrophobicContact CB-CD2 4.08Å; L101-F131 HydrophobicContact CB-CE2 4.12Å; L101-F131 HydrophobicContact CD1-CD2 4.24Å; L101-F131 HydrophobicContact CD1-CE1 3.98Å; L101-F131 HydrophobicContact CD1-CE2 3.62Å; L101-F131 HydrophobicContact CD1-CZ 3.46Å; L101-F131 VanDerWaalsContact CD1-CZ 3.46Å; L101-Y285 WeakPolarHBondContact O-CE1 3.42Å; L101-Y285 PolarHBondContact O-OH 3.14Å
102	L	86.7	Confident	70.6	Confident	4 Å²	4	55.1 Å²	55.1	2%	0.021	25%	0.249	C	C	.	.	S	Bend	trans	-79.7	130.1	179.5	-66.5	174.6	0	0	0	110.1	L104 F131 R144 D176 Y285 P287 G288	L102-L104 HydrophobicContact CB-CD2 4.13Å; L102-F131 HydrophobicContact CD2-CB 4Å; L102-F131 HydrophobicContact CG-CB 4.28Å; L102-R144 HydrophobicContact CD1-CB 4.17Å; L102-D176 HydrophobicContact CD2-CB 4.38Å; L102-Y285 WeakPolarHBondContact CA-OH 3.46Å; L102-P287 WeakPolarHBondContact O-CA 3.44Å; L102-G288 PolarHBondContact O-N 3.34Å
103	M	91.7	Very high	73.3	Confident	3 Å²	3	54.1 Å²	54.1	2%	0.015	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.5	133.9	160.2	178.1	-177.6	-92.8	0	0	108.2	H129 Y279 V283 N284 Y285 E286 T290 V293	M103-H129 PolarHBondContact O-CE1 3.42Å; M103-Y279 HydrophobicContact SD-CD1 4.45Å; M103-Y279 HydrophobicContact SD-CE1 3.92Å; M103-V283 HydrophobicContact CE-CG1 4.49Å; M103-V283 HydrophobicContact CE-CG2 3.83Å; M103-N284 WeakPolarHBondContact CE-O 3.27Å; M103-Y285 HydrophobicContact CB-CD2 4.09Å; M103-Y285 HydrophobicContact CB-CE1 4.37Å; M103-Y285 HydrophobicContact CB-CE2 3.64Å; M103-Y285 PolarHBondContact N-OH 2.89Å; M103-Y285 VanDerWaalsContact N-OH 3.13Å; M103-Y285 HydrophobicContact SD-CD2 4.39Å; M103-E286 VanDerWaalsContact CA-O 3.24Å; M103-E286 WeakPolarHBondContact CA-O 3.34Å; M103-E286 WeakPolarHBondContact CB-O 3.49Å; M103-E286 HydrophobicContact CE-CG 3.87Å; M103-T290 HydrophobicContact CE-CG2 4.23Å; M103-T290 HydrophobicContact CG-CG2 4.01Å; M103-T290 HydrophobicContact SD-CG2 4.27Å; M103-V293 HydrophobicContact CG-CG2 4.47Å; M103-V293 HydrophobicContact SD-CG2 3.62Å
104	L	91	Very high	76.4	Confident	6 Å²	6	53.7 Å²	53.7	3%	0.031	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	139.3	-176.7	-58.1	168.4	0	0	0	109.7	D17 L102 R144 G288 A289 T290	D17-L104 HydrophobicContact CB-CB 3.89Å; D17-L104 HydrophobicContact CB-CD1 3.45Å; D17-L104 VanDerWaalsContact CB-CD1 3.45Å; D17-L104 HydrophobicContact CB-CG 4.3Å; D17-L104 VanDerWaalsContact CG-CD1 3.46Å; D17-L104 WeakPolarHBondContact OD2-CD1 3.48Å; L102-L104 HydrophobicContact CB-CD2 4.13Å; L104-R144 HydrophobicContact CD1-CG 4.33Å; L104-R144 HydrophobicContact CD2-CG 4.43Å; L104-G288 PolarHBondContact N-O 3.04Å; L104-A289 WeakPolarHBondContact O-CA 3.28Å; L104-T290 PolarHBondContact O-N 3.11Å; L104-T290 VanDerWaalsContact O-N 3.15Å
105	A	94	Very high	79.2	Confident	12 Å²	12	51.5 Å²	51.5	10%	0.099	23%	0.234	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-77.9	155.9	174	0	0	0	0	0	110.6	I16 L277 V293 W295	I16-A105 WeakPolarHBondContact CA-O 3.15Å; I16-A105 WeakPolarHBondContact CG1-O 3.13Å; I16-A105 WeakPolarHBondContact CG2-O 3.42Å; A105-L277 HydrophobicContact CB-CD2 3.53Å; A105-V293 WeakPolarHBondContact CA-O 3.49Å; A105-V293 HydrophobicContact CB-CB 4.45Å; A105-V293 HydrophobicContact CB-CG1 3.84Å; A105-W295 HydrophobicContact CB-CB 3.87Å
106	E	92.9	Very high	82.2	Confident	13 Å²	13	44.2 Å²	44.2	6%	0.061	21%	0.213	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	164.5	162.7	-65.7	180	-160.1	0	0	110.3	Q45 R48 F108 A289 V293 S294 W295	Q45-E106 VanDerWaalsContact NE2-CB 3.29Å; Q45-E106 PolarHBondContact NE2-OE2 3.02Å; R48-E106 IonicContact CZ-OE1 3.47Å; R48-E106 IonicContact CZ-OE2 3.53Å; R48-E106 IonicContact NH1-OE1 2.88Å; R48-E106 PolarHBondContact NH1-OE1 3.2Å; R48-E106 IonicContact NH1-OE2 3.62Å; R48-E106 PolarHBondContact NH1-OE2 3.49Å; R48-E106 IonicContact NH2-OE1 2.8Å; R48-E106 IonicContact NH2-OE2 3.44Å; R48-E106 PolarHBondContact NH2-OE2 3.14Å; E106-F108 PolarHBondContact O-N 3.35Å; E106-A289 HydrophobicContact CG-CB 4.02Å; E106-V293 PolarHBondContact N-O 2.96Å; E106-S294 CarbonylContact O-C 3.4Å; E106-S294 WeakPolarHBondContact O-CA 3.29Å; E106-W295 PolarHBondContact O-N 3.18Å
107	W	94.3	Very high	85	Confident	9 Å²	9	41.3 Å²	41.3	3%	0.034	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-58.3	142	167.3	-73	113.3	0	0	0	110.7	I16 Q45 L109 W295 K297 M300 I329 Y332	I16-W107 HydrophobicContact CD1-CB 4.33Å; I16-W107 HydrophobicContact CD1-CD2 3.17Å; I16-W107 HydrophobicContact CD1-CE3 3.73Å; I16-W107 HydrophobicContact CD1-CG 3.47Å; I16-W107 VanDerWaalsContact CD1-CG 3.47Å; I16-W107 HydrophobicContact CD1-CH2 4.18Å; I16-W107 HydrophobicContact CD1-CZ2 3.69Å; I16-W107 HydrophobicContact CD1-CZ3 4.2Å; Q45-W107 PolarHBondContact NE2-O 3.46Å; Q45-W107 PolarHBondContact OE1-O 2.93Å; W107-L109 HydrophobicContact CB-CD2 3.83Å; W107-L109 HydrophobicContact CB-CG 4.06Å; W107-L109 PolarHBondContact O-N 2.93Å; W107-L109 VanDerWaalsContact O-N 3.12Å; W107-W295 AromaticContact CE3-CD1 3.93Å; W107-W295 AromaticContact CH2-CD1 3.95Å; W107-W295 AromaticContact CZ3-CD1 3.51Å; W107-K297 HydrophobicContact CH2-CG 4.41Å; W107-K297 HydrophobicContact CZ3-CG 4.45Å; W107-M300 HydrophobicContact CH2-CE 4.3Å; W107-M300 HydrophobicContact CZ3-CE 3.94Å; W107-M300 HydrophobicContact CZ3-SD 3.99Å; W107-I329 HydrophobicContact CB-CD1 3.86Å; W107-I329 HydrophobicContact CB-CG1 4.47Å; W107-I329 HydrophobicContact CD2-CD1 3.9Å; W107-I329 HydrophobicContact CD2-CG1 3.6Å; W107-I329 HydrophobicContact CD2-CG2 4.35Å; W107-I329 HydrophobicContact CE3-CD1 4.04Å; W107-I329 HydrophobicContact CE3-CG1 3.84Å; W107-I329 HydrophobicContact CG-CD1 3.83Å; W107-I329 HydrophobicContact CG-CG1 3.89Å; W107-I329 HydrophobicContact CG-CG2 3.97Å; W107-I329 HydrophobicContact CZ2-CG1 4.4Å; W107-I329 HydrophobicContact CZ3-CG1 4.32Å; W107-Y332 AromaticContact CZ2-CD1 3.81Å; W107-Y332 HydrophobicContact CZ2-CD1 3.81Å; W107-Y332 HydrophobicContact CZ2-CD2 4.35Å; W107-Y332 HydrophobicContact CZ2-CE1 4.28Å; W107-Y332 AromaticContact CZ2-CG 3.86Å; W107-Y332 HydrophobicContact CZ2-CG 3.86Å
108	F	94.5	Very high	87.5	Confident	0 Å²	0	36.5 Å²	36.5	0%	0	19%	0.191	C	C	.	.			trans	-73.3	99.9	171.3	-164.4	-75.1	0	0	0	109.3	E106 F110 M111 F115 F278 S294 W295 L296 W304	E106-F108 PolarHBondContact O-N 3.35Å; F108-F110 WeakPolarHBondContact CE1-O 3.46Å; F108-F110 WeakPolarHBondContact CZ-O 3.38Å; F108-M111 HydrophobicContact CE1-CE 3.98Å; F108-M111 HydrophobicContact CE1-SD 4.36Å; F108-M111 HydrophobicContact CZ-CE 3.92Å; F108-M111 HydrophobicContact CZ-SD 3.86Å; F108-F115 HydrophobicContact CE2-CD2 4.28Å; F108-F115 AromaticContact CE2-CE2 3.62Å; F108-F115 HydrophobicContact CE2-CE2 3.62Å; F108-F115 HydrophobicContact CE2-CZ 4.09Å; F108-F115 HydrophobicContact CZ-CD2 4.37Å; F108-F115 HydrophobicContact CZ-CE2 4.07Å; F108-F115 HydrophobicContact CZ-CZ 4.46Å; F108-F278 HydrophobicContact CD2-CD2 4.14Å; F108-S294 VanDerWaalsContact CD2-CB 3.48Å; F108-W295 PolarHBondContact N-O 3.31Å; F108-W295 VanDerWaalsContact N-O 3.1Å; F108-L296 HydrophobicContact CB-CD1 4.03Å; F108-L296 HydrophobicContact CB-CD2 3.68Å; F108-L296 HydrophobicContact CB-CG 3.6Å; F108-L296 HydrophobicContact CD1-CD1 4.46Å; F108-L296 HydrophobicContact CG-CD1 4.13Å; F108-L296 HydrophobicContact CG-CG 4.25Å; F108-W304 AromaticContact CD1-CD2 3.68Å; F108-W304 HydrophobicContact CD1-CD2 3.68Å; F108-W304 AromaticContact CD1-CE2 3.63Å; F108-W304 AromaticContact CD1-CE3 3.87Å; F108-W304 HydrophobicContact CD1-CE3 3.87Å; F108-W304 HydrophobicContact CD1-CG 4.3Å; F108-W304 AromaticContact CD1-CH2 3.93Å; F108-W304 HydrophobicContact CD1-CH2 3.93Å; F108-W304 AromaticContact CD1-CZ2 3.76Å; F108-W304 HydrophobicContact CD1-CZ2 3.76Å; F108-W304 AromaticContact CD1-CZ3 3.99Å; F108-W304 HydrophobicContact CD1-CZ3 3.99Å; F108-W304 AromaticContact CE1-CD2 3.76Å; F108-W304 HydrophobicContact CE1-CD2 3.76Å; F108-W304 AromaticContact CE1-CE3 3.51Å; F108-W304 HydrophobicContact CE1-CE3 3.51Å; F108-W304 HydrophobicContact CE1-CG 4.43Å; F108-W304 HydrophobicContact CE1-CH2 4.08Å; F108-W304 HydrophobicContact CE1-CZ2 4.31Å; F108-W304 AromaticContact CE1-CZ3 3.68Å; F108-W304 HydrophobicContact CE1-CZ3 3.68Å; F108-W304 VanDerWaalsContact O-CZ2 3.24Å; F108-W304 WeakPolarHBondContact O-CZ2 3.36Å
109	L	92.3	Very high	89.8	Confident	13 Å²	13	35.7 Å²	35.7	7%	0.068	19%	0.187	C	C	.	.			trans	-108.3	-12.6	-175.3	-56.9	178.7	0	0	0	113.9	R41 A42 Q45 W107 I329	R41-L109 HydrophobicContact CB-CD1 4.09Å; A42-L109 HydrophobicContact CB-CB 4.1Å; A42-L109 WeakPolarHBondContact CB-O 3.38Å; Q45-L109 VanDerWaalsContact OE1-CB 3.31Å; Q45-L109 VanDerWaalsContact OE1-N 3.12Å; W107-L109 HydrophobicContact CB-CD2 3.83Å; W107-L109 HydrophobicContact CB-CG 4.06Å; W107-L109 PolarHBondContact O-N 2.93Å; W107-L109 VanDerWaalsContact O-N 3.12Å; L109-I329 HydrophobicContact CD2-CD1 3.67Å
110	F	93.1	Very high	92.4	Very high	17 Å²	17	36 Å²	36	8%	0.075	18%	0.183	C	C	.	.	S	Bend	trans	-145.9	154.6	176.7	83.9	-77.6	0	0	0	109.8	A42 Q45 E46 W49 F108 P112	A42-F110 HydrophobicContact CB-CB 4.5Å; Q45-F110 HydrophobicContact CB-CD1 4.31Å; Q45-F110 HydrophobicContact CG-CD1 3.96Å; Q45-F110 HydrophobicContact CG-CE1 3.87Å; E46-F110 HydrophobicContact CB-CD1 4.15Å; E46-F110 HydrophobicContact CB-CD2 3.96Å; E46-F110 HydrophobicContact CB-CE1 4.32Å; E46-F110 HydrophobicContact CB-CE2 4.11Å; E46-F110 HydrophobicContact CB-CG 3.99Å; E46-F110 HydrophobicContact CB-CZ 4.3Å; E46-F110 HydrophobicContact CG-CD2 3.65Å; E46-F110 HydrophobicContact CG-CE2 3.62Å; E46-F110 HydrophobicContact CG-CG 4.21Å; E46-F110 HydrophobicContact CG-CZ 4.16Å; W49-F110 HydrophobicContact CB-CE1 4.13Å; W49-F110 HydrophobicContact CB-CZ 3.79Å; W49-F110 AromaticContact CD1-CZ 3.77Å; W49-F110 HydrophobicContact CD2-CE2 4.43Å; W49-F110 AromaticContact CD2-CZ 3.86Å; W49-F110 HydrophobicContact CD2-CZ 3.86Å; W49-F110 HydrophobicContact CE3-CZ 4.39Å; W49-F110 HydrophobicContact CG-CE1 4.25Å; W49-F110 AromaticContact CG-CZ 3.55Å; W49-F110 HydrophobicContact CG-CZ 3.55Å; F108-F110 WeakPolarHBondContact CE1-O 3.46Å; F108-F110 WeakPolarHBondContact CZ-O 3.38Å; F110-P112 HydrophobicContact CE2-CB 4.17Å; F110-P112 HydrophobicContact CE2-CG 4.03Å; F110-P112 HydrophobicContact CZ-CB 4.42Å; F110-P112 HydrophobicContact CZ-CG 4Å; F110-P112 VanDerWaalsContact O-CD 3.32Å; F110-P112 WeakPolarHBondContact O-CD 3.46Å
111	M	95.9	Very high	94	Very high	78 Å²	78	29.3 Å²	29.3	38%	0.384	15%	0.154	S	C	.	.			trans	-87.2	115.5	175.9	-178.2	59.3	65.9	0	0	110.4	F108 F115 W304 F305	F108-M111 HydrophobicContact CE1-CE 3.98Å; F108-M111 HydrophobicContact CE1-SD 4.36Å; F108-M111 HydrophobicContact CZ-CE 3.92Å; F108-M111 HydrophobicContact CZ-SD 3.86Å; M111-F115 HydrophobicContact SD-CB 3.81Å; M111-F115 HydrophobicContact SD-CD1 4.09Å; M111-F115 HydrophobicContact SD-CD2 4.27Å; M111-F115 HydrophobicContact SD-CG 3.79Å; M111-W304 HydrophobicContact CB-CZ3 4.24Å; M111-W304 HydrophobicContact CE-CE3 3.93Å; M111-F305 HydrophobicContact CE-CD1 4.22Å; M111-F305 HydrophobicContact CE-CE1 3.56Å; M111-F305 HydrophobicContact CE-CZ 4.06Å; M111-F305 HydrophobicContact SD-CE1 4.41Å
112	P	96.7	Very high	95.1	Very high	4 Å²	4	27.2 Å²	27.2	3%	0.026	14%	0.144	C	C	.	.			trans	-65.6	146.8	175.3	-20.9	34.6	0	0	0	112.2	W49 F110 F115 Y119	W49-P112 HydrophobicContact CZ2-CB 3.92Å; F110-P112 HydrophobicContact CE2-CB 4.17Å; F110-P112 HydrophobicContact CE2-CG 4.03Å; F110-P112 HydrophobicContact CZ-CB 4.42Å; F110-P112 HydrophobicContact CZ-CG 4Å; F110-P112 VanDerWaalsContact O-CD 3.32Å; F110-P112 WeakPolarHBondContact O-CD 3.46Å; P112-F115 HydrophobicContact CG-CD2 4.23Å; P112-F115 WeakPolarHBondContact O-CB 3.08Å; P112-Y119 HydrophobicContact CB-CD2 4.42Å; P112-Y119 HydrophobicContact CB-CE2 3.57Å; P112-Y119 HydrophobicContact CG-CE1 4.3Å; P112-Y119 HydrophobicContact CG-CE2 3.74Å; P112-Y119 WeakPolarHBondContact CG-OH 3.26Å
113	P	94.8	Very high	95.6	Very high	72 Å²	72	27.1 Å²	27.1	47%	0.468	14%	0.143	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	146.3	170.8	29.1	-34.9	0	0	0	110.5	W49 F115	W49-P113 HydrophobicContact CH2-CG 3.6Å; W49-P113 HydrophobicContact CZ2-CG 4.48Å; W49-P113 HydrophobicContact CZ3-CG 4.11Å; P113-F115 PolarHBondContact O-N 2.89Å
114	N	95.3	Very high	95.9	Very high	107 Å²	107	27 Å²	27	57%	0.572	14%	0.143	S	C	*	.	T	Hydrogen-bonded Turn	trans	54.2	35	-178.3	-52.7	-30	0	0	0	113.1	G116 E117 E118	N114-G116 PolarHBondContact O-N 2.82Å; N114-E117 VanDerWaalsContact C-OE2 3.22Å; N114-E117 WeakPolarHBondContact CA-OE2 3.46Å; N114-E117 VanDerWaalsContact CB-OE2 3.27Å; N114-E117 WeakPolarHBondContact CB-OE2 2.89Å; N114-E117 PolarHBondContact O-N 2.8Å; N114-E117 VanDerWaalsContact O-N 3.14Å; N114-E118 HydrophobicContact CB-CG 3.92Å; N114-E118 WeakPolarHBondContact O-CB 3.37Å; N114-E118 PolarHBondContact O-N 3.24Å
115	F	97.4	Very high	96.1	Very high	13 Å²	13	26.7 Å²	26.7	6%	0.057	14%	0.141	C	C	.	.	H	α-helix	trans	-53.6	-41.9	-177.5	178.9	-103.3	0	0	0	112.1	F108 M111 P112 P113 E117 Y119 C256 M261 F278 F305	F108-F115 HydrophobicContact CE2-CD2 4.28Å; F108-F115 AromaticContact CE2-CE2 3.62Å; F108-F115 HydrophobicContact CE2-CE2 3.62Å; F108-F115 HydrophobicContact CE2-CZ 4.09Å; F108-F115 HydrophobicContact CZ-CD2 4.37Å; F108-F115 HydrophobicContact CZ-CE2 4.07Å; F108-F115 HydrophobicContact CZ-CZ 4.46Å; M111-F115 HydrophobicContact SD-CB 3.81Å; M111-F115 HydrophobicContact SD-CD1 4.09Å; M111-F115 HydrophobicContact SD-CD2 4.27Å; M111-F115 HydrophobicContact SD-CG 3.79Å; P112-F115 HydrophobicContact CG-CD2 4.23Å; P112-F115 WeakPolarHBondContact O-CB 3.08Å; P113-F115 PolarHBondContact O-N 2.89Å; F115-E117 VanDerWaalsContact C-N 3.31Å; F115-E117 PolarHBondContact O-N 2.82Å; F115-Y119 AromaticContact CD2-CD1 3.95Å; F115-Y119 HydrophobicContact CD2-CD1 3.95Å; F115-Y119 AromaticContact CD2-CD2 3.65Å; F115-Y119 HydrophobicContact CD2-CD2 3.65Å; F115-Y119 HydrophobicContact CD2-CE2 4.25Å; F115-Y119 AromaticContact CD2-CG 3.48Å; F115-Y119 HydrophobicContact CD2-CG 3.48Å; F115-Y119 VanDerWaalsContact CD2-CG 3.48Å; F115-Y119 AromaticContact CE2-CD1 3.65Å; F115-Y119 HydrophobicContact CE2-CD1 3.65Å; F115-Y119 HydrophobicContact CE2-CD2 4.21Å; F115-Y119 HydrophobicContact CE2-CE1 4.35Å; F115-Y119 AromaticContact CE2-CG 3.56Å; F115-Y119 HydrophobicContact CE2-CG 3.56Å; F115-Y119 HydrophobicContact CG-CD2 4.49Å; F115-Y119 HydrophobicContact CG-CG 4.47Å; F115-Y119 VanDerWaalsContact O-CB 3.28Å; F115-Y119 WeakPolarHBondContact O-CB 3.49Å; F115-Y119 PolarHBondContact O-N 3.3Å; F115-C256 HydrophobicContact CD1-CB 3.98Å; F115-C256 HydrophobicContact CE1-CB 3.58Å; F115-C256 HydrophobicContact CZ-CB 3.98Å; F115-M261 HydrophobicContact CE1-SD 4.3Å; F115-F278 HydrophobicContact CE1-CD1 4.47Å; F115-F278 HydrophobicContact CE2-CB 4.31Å; F115-F278 HydrophobicContact CE2-CD1 4.11Å; F115-F278 HydrophobicContact CE2-CG 4.37Å; F115-F278 HydrophobicContact CZ-CB 4.47Å; F115-F278 AromaticContact CZ-CD1 3.46Å; F115-F278 HydrophobicContact CZ-CD1 3.46Å; F115-F278 VanDerWaalsContact CZ-CD1 3.46Å; F115-F278 AromaticContact CZ-CE1 3.82Å; F115-F278 HydrophobicContact CZ-CE1 3.82Å; F115-F278 HydrophobicContact CZ-CG 4.08Å; F115-F305 AromaticContact CD1-CE1 3.83Å; F115-F305 HydrophobicContact CD1-CE1 3.83Å; F115-F305 HydrophobicContact CD1-CZ 4.31Å; F115-F305 AromaticContact CE1-CE1 3.34Å; F115-F305 HydrophobicContact CE1-CE1 3.34Å; F115-F305 AromaticContact CE1-CZ 3.44Å; F115-F305 HydrophobicContact CE1-CZ 3.44Å; F115-F305 VanDerWaalsContact CE1-CZ 3.44Å; F115-F305 HydrophobicContact CZ-CE1 4.09Å; F115-F305 AromaticContact CZ-CZ 3.72Å; F115-F305 HydrophobicContact CZ-CZ 3.72Å
116	G	97.2	Very high	96	Very high	19 Å²	19	27.7 Å²	27.7	20%	0.196	14%	0.143	C	C	.	.	H	α-helix	trans	-66.6	-28	-178.6	0	0	0	0	0	115	N114 Q255 C256 D257	N114-G116 PolarHBondContact O-N 2.82Å; G116-Q255 PolarHBondContact O-NE2 3.25Å; G116-C256 VanDerWaalsContact CA-O 3.25Å; G116-C256 WeakPolarHBondContact CA-O 3.43Å; G116-D257 PolarHBondContact O-N 2.93Å
117	E	97.9	Very high	96	Very high	116 Å²	116	27.3 Å²	27.3	54%	0.542	14%	0.143	S	C	.	.	H	α-helix	trans	-95.4	-31.3	179.3	-54.9	92.6	170.7	0	0	113.5	N114 F115	N114-E117 VanDerWaalsContact C-OE2 3.22Å; N114-E117 WeakPolarHBondContact CA-OE2 3.46Å; N114-E117 VanDerWaalsContact CB-OE2 3.27Å; N114-E117 WeakPolarHBondContact CB-OE2 2.89Å; N114-E117 PolarHBondContact O-N 2.8Å; N114-E117 VanDerWaalsContact O-N 3.14Å; F115-E117 VanDerWaalsContact C-N 3.31Å; F115-E117 PolarHBondContact O-N 2.82Å
118	E	97.9	Very high	95.8	Very high	49 Å²	49	28.9 Å²	28.9	23%	0.229	15%	0.148	C	C	.	.	H	α-helix	trans	-100.7	-15	-170.8	-63.7	-58.7	135	0	0	113.5	N114 H280 K281	N114-E118 HydrophobicContact CB-CG 3.92Å; N114-E118 WeakPolarHBondContact O-CB 3.37Å; N114-E118 PolarHBondContact O-N 3.24Å; E118-H280 IonicContact OE2-CE1 2.85Å; E118-K281 VanDerWaalsContact O-CB 3.3Å; E118-K281 WeakPolarHBondContact O-CB 3.12Å; E118-K281 WeakPolarHBondContact O-CG 3.48Å; E118-K281 PolarHBondContact O-N 2.87Å; E118-K281 IonicContact OE1-NZ 3.94Å; E118-K281 PolarHBondContact OE1-NZ 3.37Å; E118-K281 WeakPolarHBondContact OE2-CE 3.41Å; E118-K281 IonicContact OE2-NZ 2.74Å; E118-K281 PolarHBondContact OE2-NZ 3.09Å
119	Y	98.6	Very high	95.7	Very high	2 Å²	2	30 Å²	30	1%	0.008	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.7	150.9	-178.8	-79	-111.1	0	0	0	113.9	W49 P112 F115 C256 F278 Y279 H280	W49-Y119 AromaticContact NE1-CZ 3.93Å; W49-Y119 PolarHBondContact NE1-OH 3.04Å; P112-Y119 HydrophobicContact CB-CD2 4.42Å; P112-Y119 HydrophobicContact CB-CE2 3.57Å; P112-Y119 HydrophobicContact CG-CE1 4.3Å; P112-Y119 HydrophobicContact CG-CE2 3.74Å; P112-Y119 WeakPolarHBondContact CG-OH 3.26Å; F115-Y119 AromaticContact CD2-CD1 3.95Å; F115-Y119 HydrophobicContact CD2-CD1 3.95Å; F115-Y119 AromaticContact CD2-CD2 3.65Å; F115-Y119 HydrophobicContact CD2-CD2 3.65Å; F115-Y119 HydrophobicContact CD2-CE2 4.25Å; F115-Y119 AromaticContact CD2-CG 3.48Å; F115-Y119 HydrophobicContact CD2-CG 3.48Å; F115-Y119 VanDerWaalsContact CD2-CG 3.48Å; F115-Y119 AromaticContact CE2-CD1 3.65Å; F115-Y119 HydrophobicContact CE2-CD1 3.65Å; F115-Y119 HydrophobicContact CE2-CD2 4.21Å; F115-Y119 HydrophobicContact CE2-CE1 4.35Å; F115-Y119 AromaticContact CE2-CG 3.56Å; F115-Y119 HydrophobicContact CE2-CG 3.56Å; F115-Y119 HydrophobicContact CG-CD2 4.49Å; F115-Y119 HydrophobicContact CG-CG 4.47Å; F115-Y119 VanDerWaalsContact O-CB 3.28Å; F115-Y119 WeakPolarHBondContact O-CB 3.49Å; F115-Y119 PolarHBondContact O-N 3.3Å; Y119-C256 WeakPolarHBondContact O-CB 3.41Å; Y119-C256 PolarHBondContact O-N 3.41Å; Y119-C256 VanDerWaalsContact O-N 3.17Å; Y119-C256 PolarHBondContact O-SG 3.25Å; Y119-C256 VanDerWaalsContact O-SG 3.37Å; Y119-F278 HydrophobicContact CD1-CB 4.09Å; Y119-Y279 VanDerWaalsContact CA-O 3.31Å; Y119-Y279 WeakPolarHBondContact CA-O 3.43Å; Y119-Y279 WeakPolarHBondContact CD1-O 3.45Å; Y119-H280 HydrophobicContact CE1-CB 4.11Å; Y119-H280 HydrophobicContact CE2-CB 4.12Å; Y119-H280 AromaticContact CE2-CD2 3.59Å
120	R	98.6	Very high	95.7	Very high	34 Å²	34	29.4 Å²	29.4	13%	0.128	15%	0.151	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	148.2	172	-59.9	-169.9	72.3	79.8	3.8	109.7	F222 S253 Y254 C256 F278 Y279 K281	R120-F222 HydrophobicContact CB-CD1 4.32Å; R120-F222 HydrophobicContact CB-CE1 3.85Å; R120-S253 PolarHBondContact NE-OG 3.48Å; R120-S253 PolarHBondContact NH2-O 2.87Å; R120-Y254 CarbonylContact C-O 3.5Å; R120-Y254 WeakPolarHBondContact CA-O 3.33Å; R120-Y254 WeakPolarHBondContact CB-O 3.45Å; R120-C256 VanDerWaalsContact C-SG 3.52Å; R120-F278 CarbonylContact O-C 3.22Å; R120-F278 WeakPolarHBondContact O-CA 3.37Å; R120-Y279 PolarHBondContact N-O 3.05Å; R120-Y279 PolarHBondContact O-N 2.85Å; R120-K281 HydrophobicContact CG-CB 4.45Å
121	M	98.1	Very high	95.6	Very high	0 Å²	0	28.7 Å²	28.7	0%	0	15%	0.148	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	155.2	-178	66.8	175.9	-173.8	0	0	113.4	S253 Y254 M261 A264 F265 V276 L277 F278	M121-S253 WeakPolarHBondContact O-CA 3.41Å; M121-Y254 HydrophobicContact CE-CD2 4.49Å; M121-Y254 HydrophobicContact CE-CG 4.3Å; M121-Y254 PolarHBondContact N-O 3.19Å; M121-Y254 PolarHBondContact O-N 3.09Å; M121-M261 HydrophobicContact CE-CB 4.13Å; M121-M261 HydrophobicContact CE-CG 3.77Å; M121-M261 HydrophobicContact SD-CG 4.01Å; M121-A264 HydrophobicContact CE-CB 3.41Å; M121-A264 VanDerWaalsContact CE-CB 3.41Å; M121-F265 HydrophobicContact CE-CD1 4.49Å; M121-F265 HydrophobicContact CE-CE1 3.94Å; M121-F265 HydrophobicContact CE-CE2 4.35Å; M121-F265 HydrophobicContact CE-CZ 3.86Å; M121-F265 HydrophobicContact SD-CE1 3.79Å; M121-F265 HydrophobicContact SD-CE2 4.22Å; M121-F265 HydrophobicContact SD-CZ 3.41Å; M121-F265 WeakPolarHBondContact SD-CZ 2.84Å; M121-V276 HydrophobicContact CB-CG1 3.98Å; M121-V276 HydrophobicContact SD-CG1 4.26Å; M121-L277 CarbonylContact C-O 3.53Å; M121-L277 WeakPolarHBondContact CA-O 3.06Å; M121-L277 WeakPolarHBondContact CB-O 3.33Å; M121-F278 HydrophobicContact CB-CD1 3.64Å; M121-F278 HydrophobicContact CB-CE1 3.78Å; M121-F278 HydrophobicContact SD-CE1 3.98Å
122	K	98.2	Very high	95.6	Very high	0 Å²	0	25 Å²	25	0%	0	13%	0.129	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.3	129.2	170.6	-64.5	-162	168	-156.1	0	109.5	C124 V207 F222 L251 V276 L277	K122-C124 PolarHBondContact O-N 3.25Å; K122-V207 WeakPolarHBondContact CE-O 3.43Å; K122-V207 PolarHBondContact NZ-O 2.85Å; K122-F222 HydrophobicContact CD-CZ 4.29Å; K122-F222 HydrophobicContact CG-CZ 4.43Å; K122-L251 HydrophobicContact CD-CB 4.01Å; K122-L251 WeakPolarHBondContact CE-O 3.37Å; K122-L251 PolarHBondContact NZ-O 3.37Å; K122-V276 WeakPolarHBondContact O-CA 3.45Å; K122-L277 PolarHBondContact N-O 3.02Å; K122-L277 PolarHBondContact O-N 2.83Å
123	L	97.3	Very high	95.5	Very high	3 Å²	3	28.7 Å²	28.7	2%	0.016	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-76.1	118.2	170.1	-57.4	-176.9	0	0	0	108.1	L251 Y254 F265 Y271 V276 F314	L123-L251 WeakPolarHBondContact O-CD2 3.48Å; L123-Y254 HydrophobicContact CG-CE2 4.41Å; L123-F265 HydrophobicContact CD2-CD1 3.85Å; L123-F265 HydrophobicContact CD2-CE1 3.56Å; L123-Y271 PolarHBondContact O-OH 3.17Å; L123-V276 HydrophobicContact CD2-CG1 4.35Å; L123-V276 HydrophobicContact CD2-CG2 3.81Å; L123-F314 HydrophobicContact CD1-CZ 4.44Å; L123-F314 HydrophobicContact CD2-CE1 4.35Å; L123-F314 HydrophobicContact CD2-CZ 4.34Å
124	C	97.2	Very high	95.6	Very high	0 Å²	0	25.2 Å²	25.2	0%	0	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	132	-172.3	-68.5	0	0	0	0	111.1	L14 K122 I178 D274 G275 L277 W295	L14-C124 HydrophobicContact CD1-CB 3.78Å; K122-C124 PolarHBondContact O-N 3.25Å; C124-I178 HydrophobicContact CB-CD1 3.81Å; C124-D274 PolarHBondContact O-N 3.47Å; C124-G275 WeakPolarHBondContact CB-O 3.4Å; C124-G275 PolarHBondContact N-O 2.82Å; C124-G275 PolarHBondContact O-N 3.24Å; C124-L277 WeakPolarHBondContact SG-CD1 3.15Å; C124-W295 HydrophobicContact CB-CH2 3.8Å; C124-W295 HydrophobicContact CB-CZ3 3.67Å
125	P	96.3	Very high	95.6	Very high	0 Å²	0	20.8 Å²	20.8	0%	0	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-74	159.4	178.1	31.1	-37.4	0	0	0	112.3	G127 I178 Y180 Y205 Y271 K272	P125-G127 PolarHBondContact O-N 3.48Å; P125-I178 HydrophobicContact CG-CB 4.22Å; P125-I178 HydrophobicContact CG-CD1 4.28Å; P125-I178 HydrophobicContact CG-CG2 3.94Å; P125-Y180 HydrophobicContact CB-CD2 3.82Å; P125-Y180 HydrophobicContact CB-CE2 4.13Å; P125-Y205 HydrophobicContact CB-CD2 4.04Å; P125-Y205 HydrophobicContact CB-CE2 4.19Å; P125-Y205 HydrophobicContact CB-CG 4.48Å; P125-Y205 HydrophobicContact CG-CD1 4.37Å; P125-Y205 HydrophobicContact CG-CD2 3.47Å; P125-Y205 VanDerWaalsContact CG-CD2 3.47Å; P125-Y205 HydrophobicContact CG-CE2 4.11Å; P125-Y205 HydrophobicContact CG-CG 3.6Å; P125-Y271 HydrophobicContact CB-CD2 3.42Å; P125-Y271 VanDerWaalsContact CB-CD2 3.42Å; P125-Y271 HydrophobicContact CB-CE2 3.86Å; P125-Y271 HydrophobicContact CB-CG 3.78Å; P125-Y271 HydrophobicContact CG-CD2 4.45Å; P125-K272 CarbonylContact C-O 3.09Å; P125-K272 WeakPolarHBondContact CA-O 3.33Å
126	K	92.6	Very high	95.5	Very high	32 Å²	32	27.5 Å²	27.5	14%	0.139	13%	0.127	C	C	.	.	S	Bend	trans	-62.2	122.5	166.6	-69.3	-149	176.3	-168.7	0	111.3	Y180 C181 K272 I273 D274 D317	K126-Y180 WeakPolarHBondContact O-CD2 3.24Å; K126-C181 CarbonylContact O-C 3.46Å; K126-C181 PolarHBondContact O-N 3.18Å; K126-K272 HydrophobicContact CD-CD 3.84Å; K126-K272 HydrophobicContact CD-CG 3.98Å; K126-K272 HydrophobicContact CG-CB 4.28Å; K126-K272 HydrophobicContact CG-CD 4.43Å; K126-K272 HydrophobicContact CG-CG 4.04Å; K126-K272 PolarHBondContact N-O 2.87Å; K126-I273 VanDerWaalsContact CE-O 3.31Å; K126-I273 WeakPolarHBondContact CE-O 3.35Å; K126-D274 HydrophobicContact CB-CB 4.47Å; K126-D274 HydrophobicContact CG-CB 3.85Å; K126-D317 WeakPolarHBondContact CE-OD2 3.29Å; K126-D317 VanDerWaalsContact NZ-CG 3.31Å; K126-D317 IonicContact NZ-OD1 2.65Å; K126-D317 IonicContact NZ-OD2 3.87Å; K126-D317 PolarHBondContact NZ-OD2 3.25Å
127	G	91.8	Very high	95.4	Very high	5 Å²	5	27.4 Å²	27.4	5%	0.052	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	169.6	-168.5	-175.2	0	0	0	0	0	112.7	P125 L179	P125-G127 PolarHBondContact O-N 3.48Å; G127-L179 CarbonylContact C-O 3.42Å; G127-L179 WeakPolarHBondContact CA-O 3.39Å
128	R	89.6	Confident	95.3	Very high	42 Å²	42	27.7 Å²	27.7	16%	0.158	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	129.1	-176.6	-169.8	167	-175.6	160.3	13.6	110.9	V130 T143 R147 I178 L179	R128-V130 HydrophobicContact CB-CG1 4.44Å; R128-V130 HydrophobicContact CG-CG1 4.23Å; R128-V130 PolarHBondContact O-N 3.21Å; R128-T143 VanDerWaalsContact CZ-CG2 3.46Å; R128-R147 VanDerWaalsContact NH1-NH2 3.1Å; R128-I178 CarbonylContact O-C 3.57Å; R128-I178 WeakPolarHBondContact O-CA 3.42Å; R128-L179 PolarHBondContact N-O 3.46Å; R128-L179 PolarHBondContact O-N 2.88Å
129	H	92	Very high	95.2	Very high	24 Å²	24	25.6 Å²	25.6	11%	0.111	12%	0.116	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	120.9	172.3	-158.2	-169.7	0	0	0	110.2	L14 M103 D176 C177	L14-H129 HydrophobicContact CD2-CB 3.49Å; L14-H129 VanDerWaalsContact CD2-CB 3.49Å; M103-H129 PolarHBondContact O-CE1 3.42Å; H129-D176 IonicContact CD2-OD1 2.86Å; H129-D176 PolarHBondContact CD2-OD1 2.72Å; H129-D176 VanDerWaalsContact CD2-OD1 3.3Å; H129-D176 IonicContact CE1-OD1 3.22Å; H129-D176 IonicContact NE2-OD1 2.69Å; H129-D176 PolarHBondContact NE2-OD1 3.42Å; H129-D176 IonicContact NE2-OD2 3.59Å; H129-D176 PolarHBondContact NE2-OD2 2.66Å; H129-C177 PolarHBondContact CD2-O 3.02Å
130	V	92.3	Very high	94.9	Very high	0 Å²	0	27.4 Å²	27.4	0%	0	13%	0.125	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.1	143.9	-174.3	-66.2	0	0	0	0	111.5	R128 I132 C142 L149 C177 L179 F204	R128-V130 HydrophobicContact CB-CG1 4.44Å; R128-V130 HydrophobicContact CG-CG1 4.23Å; R128-V130 PolarHBondContact O-N 3.21Å; V130-I132 HydrophobicContact CG2-CD1 4.14Å; V130-C142 CarbonylContact C-O 3.54Å; V130-C142 VanDerWaalsContact CA-O 3.24Å; V130-C142 WeakPolarHBondContact CA-O 3.24Å; V130-C142 WeakPolarHBondContact CB-O 3.07Å; V130-L149 HydrophobicContact CG1-CD1 3.75Å; V130-C177 HydrophobicContact CG2-CB 4.05Å; V130-C177 WeakPolarHBondContact CG2-O 3.06Å; V130-C177 PolarHBondContact N-O 2.88Å; V130-C177 PolarHBondContact O-N 3.32Å; V130-L179 HydrophobicContact CG1-CB 4.29Å; V130-L179 HydrophobicContact CG2-CB 4.06Å; V130-F204 HydrophobicContact CG2-CD1 3.9Å; V130-F204 HydrophobicContact CG2-CE1 3.96Å
131	F	92.4	Very high	94.7	Very high	3 Å²	3	25.9 Å²	25.9	1%	0.013	12%	0.12	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	127.2	167.5	172.1	-101.6	0	0	0	109.4	H98 L101 L102 R133 A141 C142 L174 I210	H98-F131 AromaticContact ND1-CE1 3.65Å; H98-F131 AromaticContact ND1-CZ 3.92Å; L101-F131 HydrophobicContact CB-CD2 4.08Å; L101-F131 HydrophobicContact CB-CE2 4.12Å; L101-F131 HydrophobicContact CD1-CD2 4.24Å; L101-F131 HydrophobicContact CD1-CE1 3.98Å; L101-F131 HydrophobicContact CD1-CE2 3.62Å; L101-F131 HydrophobicContact CD1-CZ 3.46Å; L101-F131 VanDerWaalsContact CD1-CZ 3.46Å; L102-F131 HydrophobicContact CD2-CB 4Å; L102-F131 HydrophobicContact CG-CB 4.28Å; F131-R133 HydrophobicContact CE1-CB 3.88Å; F131-R133 HydrophobicContact CZ-CB 4.43Å; F131-A141 WeakPolarHBondContact O-CA 3.1Å; F131-C142 PolarHBondContact N-O 3.01Å; F131-C142 PolarHBondContact O-N 2.78Å; F131-L174 HydrophobicContact CE1-CD2 4.22Å; F131-L174 HydrophobicContact CE2-CB 3.96Å; F131-L174 HydrophobicContact CE2-CD1 4.25Å; F131-L174 HydrophobicContact CE2-CD2 4.24Å; F131-L174 HydrophobicContact CE2-CG 4.37Å; F131-L174 HydrophobicContact CZ-CB 4.11Å; F131-L174 HydrophobicContact CZ-CD1 3.89Å; F131-L174 HydrophobicContact CZ-CD2 3.51Å; F131-L174 HydrophobicContact CZ-CG 4.03Å; F131-I210 HydrophobicContact CD2-CD1 3.96Å; F131-I210 HydrophobicContact CE2-CD1 3.83Å
132	I	95.6	Very high	94.2	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	13%	0.126	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	132.4	176.4	-58	-66.2	0	0	0	109.7	V130 T139 I140 A141 L156 L174 L175 C177 F204 F248	V130-I132 HydrophobicContact CG2-CD1 4.14Å; I132-T139 HydrophobicContact CG2-CG2 3.9Å; I132-I140 WeakPolarHBondContact CA-O 3.02Å; I132-A141 HydrophobicContact CD1-CB 3.48Å; I132-A141 VanDerWaalsContact CD1-CB 3.48Å; I132-L156 HydrophobicContact CG2-CD1 4.08Å; I132-L174 VanDerWaalsContact O-CA 3.28Å; I132-L174 WeakPolarHBondContact O-CA 3.33Å; I132-L175 HydrophobicContact CB-CB 4.2Å; I132-L175 PolarHBondContact N-O 3.27Å; I132-L175 PolarHBondContact O-N 2.79Å; I132-C177 HydrophobicContact CG1-CB 3.77Å; I132-C177 VanDerWaalsContact CG1-SG 3.59Å; I132-F204 HydrophobicContact CD1-CD1 3.63Å; I132-F204 HydrophobicContact CD1-CE1 3.46Å; I132-F204 VanDerWaalsContact CD1-CE1 3.46Å; I132-F204 HydrophobicContact CD1-CG 4.24Å; I132-F204 HydrophobicContact CD1-CZ 3.95Å; I132-F204 HydrophobicContact CG1-CD1 4.35Å; I132-F248 HydrophobicContact CG1-CE1 4.22Å; I132-F248 HydrophobicContact CG2-CE1 4.1Å; I132-F248 HydrophobicContact CG2-CZ 4.13Å
133	R	94.7	Very high	93.6	Very high	81 Å²	81	27.1 Å²	27.1	31%	0.306	13%	0.128	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.4	115.4	171.2	173.9	178.7	179.1	166.2	7.6	110.2	F131 S135 T139 I140 T173 L174	F131-R133 HydrophobicContact CE1-CB 3.88Å; F131-R133 HydrophobicContact CZ-CB 4.43Å; R133-S135 PolarHBondContact NE-OG 3.24Å; R133-T139 CarbonylContact O-C 3.45Å; R133-T139 WeakPolarHBondContact O-CA 3.21Å; R133-I140 PolarHBondContact N-O 3.33Å; R133-I140 PolarHBondContact O-N 2.98Å; R133-T173 WeakPolarHBondContact CA-O 3.3Å; R133-L174 HydrophobicContact CB-CD2 3.7Å; R133-L174 HydrophobicContact CG-CD2 3.62Å
134	A	96.5	Very high	92.5	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	14%	0.142	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.3	114.5	167	0	0	0	0	0	109.6	K138 T139 L156 T172 T173	A134-K138 CarbonylContact C-O 3.48Å; A134-K138 VanDerWaalsContact CA-O 3.28Å; A134-K138 WeakPolarHBondContact CA-O 3.47Å; A134-T139 HydrophobicContact CB-CG2 4.45Å; A134-T139 WeakPolarHBondContact CB-OG1 3.38Å; A134-L156 HydrophobicContact CB-CB 3.79Å; A134-L156 HydrophobicContact CB-CD1 4.17Å; A134-T172 WeakPolarHBondContact O-CA 3.2Å; A134-T173 PolarHBondContact N-O 2.84Å; A134-T173 PolarHBondContact O-N 2.85Å
135	S	95.1	Very high	91.5	Very high	14 Å²	14	36.1 Å²	36.1	10%	0.098	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-162.2	147.9	177.9	63.4	0	0	0	0	110.6	R133 G137 K138 G158	R133-S135 PolarHBondContact NE-OG 3.24Å; S135-G137 VanDerWaalsContact C-N 3.27Å; S135-G137 PolarHBondContact O-N 3.47Å; S135-K138 PolarHBondContact N-O 3.22Å; S135-K138 PolarHBondContact O-N 3.27Å; S135-G158 CarbonylContact C-O 3.56Å; S135-G158 WeakPolarHBondContact CA-O 3.28Å; S135-G158 PolarHBondContact N-O 2.89Å; S135-G158 VanDerWaalsContact N-O 3.1Å
136	K	95.4	Very high	90.4	Very high	154 Å²	154	36.7 Å²	36.7	67%	0.67	18%	0.175	S	C	*	.	T	Hydrogen-bonded Turn	trans	58.2	38.4	177.6	-54.2	-177.7	178	-175.6	0	113.1	K138 G158 N168	K136-K138 VanDerWaalsContact C-N 3.3Å; K136-K138 PolarHBondContact O-N 3.35Å; K136-G158 PolarHBondContact N-O 3.35Å; K136-N168 VanDerWaalsContact CA-O 3.23Å; K136-N168 WeakPolarHBondContact CA-O 2.91Å; K136-N168 PolarHBondContact N-O 3.42Å
137	G	96.5	Very high	89.9	Confident	17 Å²	17	38.8 Å²	38.8	18%	0.175	18%	0.183	C	C	.	.	T	Hydrogen-bonded Turn	trans	72.1	20.2	177.3	0	0	0	0	0	114.4	S135 G158	S135-G137 VanDerWaalsContact C-N 3.27Å; S135-G137 PolarHBondContact O-N 3.47Å; G137-G158 WeakPolarHBondContact CA-O 3.39Å; G137-G158 PolarHBondContact N-O 3.24Å
138	K	95.3	Very high	89.7	Confident	122 Å²	122	43.3 Å²	43.3	53%	0.53	20%	0.202	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.1	148.3	179.5	-65	-174	-179.6	-175.3	0	110.8	A134 S135 K136 G158	A134-K138 CarbonylContact C-O 3.48Å; A134-K138 VanDerWaalsContact CA-O 3.28Å; A134-K138 WeakPolarHBondContact CA-O 3.47Å; S135-K138 PolarHBondContact N-O 3.22Å; S135-K138 PolarHBondContact O-N 3.27Å; K136-K138 VanDerWaalsContact C-N 3.3Å; K136-K138 PolarHBondContact O-N 3.35Å; K138-G158 PolarHBondContact N-O 3.14Å
139	T	95.8	Very high	89.5	Confident	5 Å²	5	42.4 Å²	42.4	3%	0.031	20%	0.201	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.5	120.6	175.2	-62.3	0	0	0	0	109.6	I132 R133 A134 S152 S154 G159 F248	I132-T139 HydrophobicContact CG2-CG2 3.9Å; R133-T139 CarbonylContact O-C 3.45Å; R133-T139 WeakPolarHBondContact O-CA 3.21Å; A134-T139 HydrophobicContact CB-CG2 4.45Å; A134-T139 WeakPolarHBondContact CB-OG1 3.38Å; T139-S152 PolarHBondContact N-O 2.9Å; T139-S152 PolarHBondContact O-N 3.12Å; T139-S154 PolarHBondContact OG1-OG 3.46Å; T139-G159 WeakPolarHBondContact OG1-CA 3.39Å; T139-G159 PolarHBondContact OG1-O 3.24Å; T139-F248 HydrophobicContact CG2-CZ 4.26Å
140	I	92.9	Very high	89.3	Confident	40 Å²	40	41.8 Å²	41.8	21%	0.205	20%	0.198	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	131.3	-175.7	-60.5	176.7	0	0	0	108.8	I132 R133 Q148 I150	I132-I140 WeakPolarHBondContact CA-O 3.02Å; R133-I140 PolarHBondContact N-O 3.33Å; R133-I140 PolarHBondContact O-N 2.98Å; I140-Q148 HydrophobicContact CG2-CB 4.43Å; I140-Q148 HydrophobicContact CG2-CG 3.72Å; I140-I150 WeakPolarHBondContact CA-O 3.41Å
141	A	92.5	Very high	89.3	Confident	2 Å²	2	45 Å²	45	2%	0.017	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.7	123.1	169.3	0	0	0	0	0	110	F131 I132 L149 I150 F204	F131-A141 WeakPolarHBondContact O-CA 3.1Å; I132-A141 HydrophobicContact CD1-CB 3.48Å; I132-A141 VanDerWaalsContact CD1-CB 3.48Å; A141-L149 PolarHBondContact O-N 3.03Å; A141-I150 HydrophobicContact CB-CB 4.01Å; A141-I150 HydrophobicContact CB-CD1 4.47Å; A141-I150 PolarHBondContact N-O 3.49Å; A141-I150 PolarHBondContact O-N 3.03Å; A141-F204 HydrophobicContact CB-CE1 3.81Å; A141-F204 HydrophobicContact CB-CZ 3.92Å
142	C	88.9	Confident	89.4	Confident	20 Å²	20	46.1 Å²	46.1	14%	0.135	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-116.1	142.9	176.8	-67.2	0	0	0	0	110.7	V130 F131 R147	V130-C142 CarbonylContact C-O 3.54Å; V130-C142 VanDerWaalsContact CA-O 3.24Å; V130-C142 WeakPolarHBondContact CA-O 3.24Å; V130-C142 WeakPolarHBondContact CB-O 3.07Å; F131-C142 PolarHBondContact N-O 3.01Å; F131-C142 PolarHBondContact O-N 2.78Å; C142-R147 CarbonylContact C-O 3.45Å; C142-R147 VanDerWaalsContact CA-O 3.31Å; C142-R147 WeakPolarHBondContact CA-O 3.19Å
143	T	85	Confident	89.4	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.031	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-68.5	170	168.8	62.8	0	0	0	0	112.1	R128 N145 G146 R147 L149	R128-T143 VanDerWaalsContact CZ-CG2 3.46Å; T143-N145 PolarHBondContact O-N 3.36Å; T143-N145 PolarHBondContact OG1-N 2.89Å; T143-N145 PolarHBondContact OG1-OD1 3.16Å; T143-G146 WeakPolarHBondContact O-CA 3.44Å; T143-G146 PolarHBondContact O-N 3.35Å; T143-R147 HydrophobicContact CG2-CB 4.46Å; T143-R147 PolarHBondContact N-O 2.95Å; T143-R147 WeakPolarHBondContact OG1-CB 3Å; T143-R147 PolarHBondContact OG1-N 3.17Å; T143-R147 PolarHBondContact OG1-O 2.72Å; T143-L149 HydrophobicContact CG2-CD1 3.69Å; T143-L149 HydrophobicContact CG2-CD2 3.45Å; T143-L149 VanDerWaalsContact CG2-CD2 3.45Å; T143-L149 HydrophobicContact CG2-CG 3.5Å
144	R	75.1	Confident	89.5	Confident	83 Å²	83	44.7 Å²	44.7	31%	0.313	23%	0.229	S	C	.	.	T	Hydrogen-bonded Turn	trans	-49.9	-35.8	168.3	-167.9	179.9	103.4	175.9	0.8	114	D15 I16 S99 L102 L104 G146	D15-R144 PolarHBondContact O-NH1 3.25Å; I16-R144 PolarHBondContact O-NH1 3.28Å; I16-R144 VanDerWaalsContact O-NH1 3.13Å; S99-R144 CarbonylContact C-O 3.54Å; S99-R144 WeakPolarHBondContact CA-O 3.33Å; S99-R144 WeakPolarHBondContact CB-O 3.38Å; L102-R144 HydrophobicContact CD1-CB 4.17Å; L104-R144 HydrophobicContact CD1-CG 4.33Å; L104-R144 HydrophobicContact CD2-CG 4.43Å; R144-G146 PolarHBondContact O-N 2.99Å
145	N	75.2	Confident	89.5	Confident	110 Å²	110	46.7 Å²	46.7	59%	0.588	24%	0.236	S	C	*	.	T	Hydrogen-bonded Turn	trans	-83.7	7.2	177.7	71.6	22.6	0	0	0	113.7	T143 R147	T143-N145 PolarHBondContact O-N 3.36Å; T143-N145 PolarHBondContact OG1-N 2.89Å; T143-N145 PolarHBondContact OG1-OD1 3.16Å; N145-R147 VanDerWaalsContact C-N 3.28Å; N145-R147 PolarHBondContact O-N 2.92Å; N145-R147 WeakPolarHBondContact OD1-CB 3.05Å; N145-R147 PolarHBondContact OD1-N 2.97Å
146	G	74.2	Confident	89.7	Confident	11 Å²	11	46 Å²	46	11%	0.113	23%	0.232	C	C	.	.	S	Bend	trans	82	-0.4	179.6	0	0	0	0	0	114.1	T143 R144 Q148	T143-G146 WeakPolarHBondContact O-CA 3.44Å; T143-G146 PolarHBondContact O-N 3.35Å; R144-G146 PolarHBondContact O-N 2.99Å; G146-Q148 PolarHBondContact O-N 3.33Å
147	R	81.5	Confident	89.8	Confident	77 Å²	77	38.9 Å²	38.9	29%	0.291	20%	0.201	S	C	.	.			trans	-67.1	126.7	173.9	-177	-179.3	70.9	172	8.9	110.6	W10 R128 C142 T143 N145 L149	W10-R147 VanDerWaalsContact CE2-NH1 3.26Å; W10-R147 VanDerWaalsContact CH2-NH2 3.34Å; R128-R147 VanDerWaalsContact NH1-NH2 3.1Å; C142-R147 CarbonylContact C-O 3.45Å; C142-R147 VanDerWaalsContact CA-O 3.31Å; C142-R147 WeakPolarHBondContact CA-O 3.19Å; T143-R147 HydrophobicContact CG2-CB 4.46Å; T143-R147 PolarHBondContact N-O 2.95Å; T143-R147 WeakPolarHBondContact OG1-CB 3Å; T143-R147 PolarHBondContact OG1-N 3.17Å; T143-R147 PolarHBondContact OG1-O 2.72Å; N145-R147 VanDerWaalsContact C-N 3.28Å; N145-R147 PolarHBondContact O-N 2.92Å; N145-R147 WeakPolarHBondContact OD1-CB 3.05Å; N145-R147 PolarHBondContact OD1-N 2.97Å; R147-L149 PolarHBondContact O-N 3.29Å
148	Q	86.7	Confident	89.7	Confident	99 Å²	99	38 Å²	38	46%	0.463	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-69.1	124.5	172.1	178.3	174	-55.5	0	0	110.7	I140 G146	I140-Q148 HydrophobicContact CG2-CB 4.43Å; I140-Q148 HydrophobicContact CG2-CG 3.72Å; G146-Q148 PolarHBondContact O-N 3.33Å
149	L	85.5	Confident	88.9	Confident	24 Å²	24	32.2 Å²	32.2	13%	0.126	17%	0.167	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.2	-46.5	173.1	-61.2	-179.3	0	0	0	111.6	V130 A141 T143 R147 L179	V130-L149 HydrophobicContact CG1-CD1 3.75Å; A141-L149 PolarHBondContact O-N 3.03Å; T143-L149 HydrophobicContact CG2-CD1 3.69Å; T143-L149 HydrophobicContact CG2-CD2 3.45Å; T143-L149 VanDerWaalsContact CG2-CD2 3.45Å; T143-L149 HydrophobicContact CG2-CG 3.5Å; R147-L149 PolarHBondContact O-N 3.29Å; L149-L179 HydrophobicContact CD1-CD2 4.29Å
150	I	89.1	Confident	88	Confident	11 Å²	11	33.1 Å²	33.1	6%	0.056	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	138.2	-171.4	-62.5	161.6	0	0	0	108.2	I140 A141 L179 F202 F204	I140-I150 WeakPolarHBondContact CA-O 3.41Å; A141-I150 HydrophobicContact CB-CB 4.01Å; A141-I150 HydrophobicContact CB-CD1 4.47Å; A141-I150 PolarHBondContact N-O 3.49Å; A141-I150 PolarHBondContact O-N 3.03Å; I150-L179 HydrophobicContact CD1-CD1 4.05Å; I150-L179 HydrophobicContact CD1-CD2 3.72Å; I150-F202 HydrophobicContact CD1-CB 4.43Å; I150-F202 HydrophobicContact CD1-CD1 3.44Å; I150-F202 VanDerWaalsContact CD1-CD1 3.44Å; I150-F202 HydrophobicContact CD1-CD2 4.27Å; I150-F202 HydrophobicContact CD1-CE1 3.43Å; I150-F202 VanDerWaalsContact CD1-CE1 3.43Å; I150-F202 HydrophobicContact CD1-CE2 4.27Å; I150-F202 HydrophobicContact CD1-CG 3.82Å; I150-F202 HydrophobicContact CD1-CZ 3.81Å; I150-F202 HydrophobicContact CG1-CD1 4.32Å; I150-F202 HydrophobicContact CG1-CE1 3.85Å; I150-F202 HydrophobicContact CG1-CE2 4.29Å; I150-F202 HydrophobicContact CG1-CZ 3.77Å; I150-F202 HydrophobicContact CG2-CD2 4.13Å; I150-F202 HydrophobicContact CG2-CE2 3.87Å; I150-F202 HydrophobicContact CG2-CZ 4.19Å; I150-F204 HydrophobicContact CD1-CE1 4.3Å; I150-F204 HydrophobicContact CD1-CZ 3.65Å
151	S	91.9	Very high	88.2	Confident	67 Å²	67	33.1 Å²	33.1	47%	0.469	18%	0.178	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-130.2	114.4	166.4	166.4	0	0	0	0	107.4
152	S	93.2	Very high	88.3	Confident	26 Å²	26	36.6 Å²	36.6	18%	0.182	21%	0.214	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.6	-164.5	-174.5	-165.5	0	0	0	0	110.3	T139 P245	T139-S152 PolarHBondContact N-O 2.9Å; T139-S152 PolarHBondContact O-N 3.12Å; S152-P245 WeakPolarHBondContact OG-CB 3.38Å; S152-P245 WeakPolarHBondContact OG-CG 3.37Å
153	V	95.8	Very high	88.6	Confident	50 Å²	50	37.5 Å²	37.5	30%	0.303	22%	0.216	S	C	.	.			trans	-118.6	153.5	168.1	-65.4	0	0	0	0	109.4	G159 L161 P245	V153-G159 CarbonylContact C-O 3.5Å; V153-G159 VanDerWaalsContact CA-O 3.3Å; V153-G159 WeakPolarHBondContact CA-O 3.47Å; V153-L161 HydrophobicContact CB-CD2 4.35Å; V153-L161 HydrophobicContact CB-CG 4.07Å; V153-L161 HydrophobicContact CG2-CD1 4.1Å; V153-L161 HydrophobicContact CG2-CD2 3.75Å; V153-L161 HydrophobicContact CG2-CG 3.81Å; V153-P245 HydrophobicContact CG2-CG 3.92Å; V153-P245 WeakPolarHBondContact O-CG 3.44Å
154	S	97	Very high	89.1	Confident	1 Å²	1	40 Å²	40	1%	0.007	23%	0.234	C	C	.	.	B	Isolated β-bridge	trans	-149.7	172.2	173.8	72.6	0	0	0	0	111.4	T139 L156 G159 G160 L161	T139-S154 PolarHBondContact OG1-OG 3.46Å; S154-L156 VanDerWaalsContact C-N 3.27Å; S154-L156 PolarHBondContact O-N 2.79Å; S154-L156 PolarHBondContact OG-N 3.35Å; S154-G159 PolarHBondContact N-O 2.7Å; S154-G159 CarbonylContact O-C 2.96Å; S154-G160 PolarHBondContact O-N 2.89Å; S154-L161 PolarHBondContact O-N 2.78Å
155	R	97.4	Very high	90.1	Very high	42 Å²	42	42 Å²	42	16%	0.158	25%	0.251	C	S	.	.	S	Bend	trans	-80.1	-6.1	176.8	-66.3	-179.1	178.8	-79.8	-23.4	114.2	L161 Q163 E239 N241 D244	R155-L161 HydrophobicContact CG-CB 3.74Å; R155-L161 HydrophobicContact CG-CD1 4.32Å; R155-Q163 PolarHBondContact O-NE2 3.01Å; R155-E239 HydrophobicContact CB-CB 4.31Å; R155-E239 WeakPolarHBondContact CD-O 3.34Å; R155-E239 WeakPolarHBondContact CD-OE1 3.32Å; R155-E239 IonicContact CZ-OE1 3.86Å; R155-E239 IonicContact NE-OE1 3.71Å; R155-E239 IonicContact NH1-OE1 3.32Å; R155-E239 PolarHBondContact NH1-OE1 2.99Å; R155-N241 VanDerWaalsContact CZ-ND2 3.28Å; R155-N241 PolarHBondContact NH2-ND2 3.26Å; R155-D244 WeakPolarHBondContact CD-OD2 3.23Å; R155-D244 IonicContact CZ-OD1 3.44Å; R155-D244 IonicContact CZ-OD2 2.68Å; R155-D244 IonicContact NE-OD1 2.76Å; R155-D244 IonicContact NE-OD2 3.58Å; R155-D244 PolarHBondContact NE-OD2 2.81Å; R155-D244 IonicContact NH2-OD1 3.3Å; R155-D244 PolarHBondContact NH2-OD1 3.04Å; R155-D244 IonicContact NH2-OD2 2.66Å
156	L	98.1	Very high	91.2	Very high	0 Å²	0	43 Å²	43	0%	0	26%	0.256	C	S	.	.	S	Bend	trans	-55.5	145.6	175.7	-66.4	-179.5	0	0	0	110.8	I132 A134 S154 G158 G159 Q163 T173 L175 I237 F248	I132-L156 HydrophobicContact CG2-CD1 4.08Å; A134-L156 HydrophobicContact CB-CB 3.79Å; A134-L156 HydrophobicContact CB-CD1 4.17Å; S154-L156 VanDerWaalsContact C-N 3.27Å; S154-L156 PolarHBondContact O-N 2.79Å; S154-L156 PolarHBondContact OG-N 3.35Å; L156-G158 PolarHBondContact O-N 3.01Å; L156-G158 VanDerWaalsContact O-N 3.16Å; L156-G159 VanDerWaalsContact O-CA 3.29Å; L156-G159 WeakPolarHBondContact O-CA 3.45Å; L156-G159 PolarHBondContact O-N 3.34Å; L156-Q163 PolarHBondContact O-NE2 3.34Å; L156-T173 HydrophobicContact CB-CG2 4.43Å; L156-T173 HydrophobicContact CD1-CG2 4.31Å; L156-L175 HydrophobicContact CD1-CD1 3.82Å; L156-L175 HydrophobicContact CD2-CD1 4.12Å; L156-I237 HydrophobicContact CD2-CB 4.38Å; L156-I237 HydrophobicContact CD2-CG1 4.27Å; L156-I237 HydrophobicContact CD2-CG2 4.3Å; L156-F248 HydrophobicContact CD1-CD2 4.19Å; L156-F248 HydrophobicContact CD1-CE1 3.95Å; L156-F248 HydrophobicContact CD1-CE2 3.56Å; L156-F248 HydrophobicContact CD1-CZ 3.44Å; L156-F248 VanDerWaalsContact CD1-CZ 3.44Å; L156-F248 HydrophobicContact CD2-CD2 4.16Å; L156-F248 HydrophobicContact CD2-CE2 4.3Å; L156-F248 HydrophobicContact CG-CD2 4.03Å; L156-F248 HydrophobicContact CG-CE2 3.67Å; L156-F248 HydrophobicContact CG-CZ 4.1Å
157	P	97.5	Very high	92.2	Very high	4 Å²	4	46 Å²	46	3%	0.026	27%	0.267	C	S	.	.	T	Hydrogen-bonded Turn	trans	-56.3	122.9	176.7	-25.9	34.4	0	0	0	112.6	Q163 Y171 T173 M212 R213	P157-Q163 VanDerWaalsContact CA-OE1 3.26Å; P157-Y171 HydrophobicContact CB-CD2 4.07Å; P157-Y171 HydrophobicContact CB-CG 4.22Å; P157-T173 WeakPolarHBondContact O-CB 3.42Å; P157-T173 PolarHBondContact O-OG1 3.5Å; P157-M212 HydrophobicContact CG-CE 3.58Å; P157-M212 HydrophobicContact CG-SD 3.81Å; P157-R213 HydrophobicContact CB-CG 3.56Å; P157-R213 HydrophobicContact CG-CG 3.66Å
158	G	96.1	Very high	92.8	Very high	0 Å²	0	42.9 Å²	42.9	0%	0	26%	0.257	C	S	.	.	T	Hydrogen-bonded Turn	trans	89.2	-2.6	-171.9	0	0	0	0	0	115.1	S135 K136 G137 K138 L156	S135-G158 CarbonylContact C-O 3.56Å; S135-G158 WeakPolarHBondContact CA-O 3.28Å; S135-G158 PolarHBondContact N-O 2.89Å; S135-G158 VanDerWaalsContact N-O 3.1Å; K136-G158 PolarHBondContact N-O 3.35Å; G137-G158 WeakPolarHBondContact CA-O 3.39Å; G137-G158 PolarHBondContact N-O 3.24Å; K138-G158 PolarHBondContact N-O 3.14Å; L156-G158 PolarHBondContact O-N 3.01Å; L156-G158 VanDerWaalsContact O-N 3.16Å
159	G	76.8	Confident	93.2	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	26%	0.263	C	S	.	.	S	Bend	trans	-98.1	-0.8	-167.4	0	0	0	0	0	117.4	T139 V153 S154 L156	T139-G159 WeakPolarHBondContact OG1-CA 3.39Å; T139-G159 PolarHBondContact OG1-O 3.24Å; V153-G159 CarbonylContact C-O 3.5Å; V153-G159 VanDerWaalsContact CA-O 3.3Å; V153-G159 WeakPolarHBondContact CA-O 3.47Å; S154-G159 PolarHBondContact N-O 2.7Å; S154-G159 CarbonylContact O-C 2.96Å; L156-G159 VanDerWaalsContact O-CA 3.29Å; L156-G159 WeakPolarHBondContact O-CA 3.45Å; L156-G159 PolarHBondContact O-N 3.34Å
160	G	78.1	Confident	93.6	Very high	24 Å²	24	46.3 Å²	46.3	25%	0.247	28%	0.284	C	S	.	.	B	Isolated β-bridge	trans	95.8	-3.5	161.9	0	0	0	0	0	118.5	S154 N168	S154-G160 PolarHBondContact O-N 2.89Å; G160-N168 PolarHBondContact N-OD1 3.3Å
161	L	96	Very high	93.9	Very high	39 Å²	39	49.2 Å²	49.2	20%	0.204	30%	0.295	C	S	.	.	S	Bend	trans	-109.5	138.4	168.4	-64.1	176.4	0	0	0	111	V153 S154 R155 Q163 D244	V153-L161 HydrophobicContact CB-CD2 4.35Å; V153-L161 HydrophobicContact CB-CG 4.07Å; V153-L161 HydrophobicContact CG2-CD1 4.1Å; V153-L161 HydrophobicContact CG2-CD2 3.75Å; V153-L161 HydrophobicContact CG2-CG 3.81Å; S154-L161 PolarHBondContact O-N 2.78Å; R155-L161 HydrophobicContact CG-CB 3.74Å; R155-L161 HydrophobicContact CG-CD1 4.32Å; L161-Q163 PolarHBondContact O-N 3.37Å; L161-Q163 PolarHBondContact O-NE2 3.13Å; L161-D244 HydrophobicContact CD1-CB 4.19Å
162	G	94.8	Very high	94	Very high	76 Å²	76	48 Å²	48	78%	0.784	29%	0.285	S	S	*	.	S	Bend	trans	68	11.8	174.5	0	0	0	0	0	115.9
163	Q	95.4	Very high	94.2	Very high	38 Å²	38	46.8 Å²	46.8	18%	0.178	28%	0.276	C	S	.	.			trans	-125.3	144.4	-171.9	-71.6	170.3	81.8	0	0	112.1	R155 L156 P157 L161 Q167 N168	R155-Q163 PolarHBondContact O-NE2 3.01Å; L156-Q163 PolarHBondContact O-NE2 3.34Å; P157-Q163 VanDerWaalsContact CA-OE1 3.26Å; L161-Q163 PolarHBondContact O-N 3.37Å; L161-Q163 PolarHBondContact O-NE2 3.13Å; Q163-Q167 HydrophobicContact CB-CB 4.26Å; Q163-N168 PolarHBondContact O-ND2 2.92Å
164	S	96.7	Very high	94.2	Very high	59 Å²	59	44.8 Å²	44.8	41%	0.413	26%	0.264	S	S	.	.			trans	-69.5	160	172.2	62.3	0	0	0	0	112.3	N166 Q167 N168	S164-N166 PolarHBondContact O-N 3.2Å; S164-Q167 PolarHBondContact O-N 3.36Å; S164-Q167 VanDerWaalsContact O-N 3.1Å; S164-Q167 WeakPolarHBondContact OG-CG 3.18Å; S164-Q167 PolarHBondContact OG-N 2.6Å; S164-Q167 PolarHBondContact OG-OE1 3.24Å; S164-N168 PolarHBondContact O-N 3.13Å; S164-N168 PolarHBondContact O-ND2 2.68Å
165	D	95.9	Very high	94.2	Very high	125 Å²	125	44.8 Å²	44.8	67%	0.668	26%	0.264	S	S	*	.	H	α-helix	trans	-55.9	-39.2	175.4	-68.5	-25.6	0	0	0	112.4	N168 N169	D165-N168 PolarHBondContact O-N 3.44Å; D165-N169 WeakPolarHBondContact O-CB 3.27Å; D165-N169 VanDerWaalsContact O-CG 3.29Å; D165-N169 PolarHBondContact O-N 3.45Å; D165-N169 PolarHBondContact O-ND2 3.22Å
166	N	96.9	Very high	94.1	Very high	129 Å²	129	42.8 Å²	42.8	69%	0.69	26%	0.256	S	S	*	.	H	α-helix	trans	-62.8	-44.1	177.1	-73.8	-7.8	0	0	0	111.8	S164 N169 S170	S164-N166 PolarHBondContact O-N 3.2Å; N166-N169 PolarHBondContact O-N 3.03Å; N166-S170 VanDerWaalsContact O-CB 3.26Å; N166-S170 WeakPolarHBondContact O-CB 2.97Å; N166-S170 PolarHBondContact O-N 3.21Å; N166-S170 PolarHBondContact O-OG 2.8Å
167	Q	95.5	Very high	94.1	Very high	74 Å²	74	42.8 Å²	42.8	35%	0.346	26%	0.256	S	S	.	.	H	α-helix	trans	-65.7	-45.7	176.3	-71.2	168.5	-54.1	0	0	111.1	Q163 S164 N169 S170 Y171	Q163-Q167 HydrophobicContact CB-CB 4.26Å; S164-Q167 PolarHBondContact O-N 3.36Å; S164-Q167 VanDerWaalsContact O-N 3.1Å; S164-Q167 WeakPolarHBondContact OG-CG 3.18Å; S164-Q167 PolarHBondContact OG-N 2.6Å; S164-Q167 PolarHBondContact OG-OE1 3.24Å; Q167-N169 PolarHBondContact O-N 3.39Å; Q167-S170 PolarHBondContact O-N 2.83Å; Q167-S170 VanDerWaalsContact O-N 3.12Å; Q167-Y171 HydrophobicContact CB-CD2 3.9Å; Q167-Y171 HydrophobicContact CB-CE2 3.83Å; Q167-Y171 HydrophobicContact CG-CD2 4.36Å; Q167-Y171 HydrophobicContact CG-CE2 3.76Å; Q167-Y171 WeakPolarHBondContact O-CB 3.49Å; Q167-Y171 PolarHBondContact O-N 3.3Å
168	N	95.5	Very high	94	Very high	13 Å²	13	42.6 Å²	42.6	7%	0.07	26%	0.255	C	S	.	.	H	α-helix	trans	-59.9	-34.9	178.7	-79.9	-35.7	0	0	0	112.8	K136 G160 Q163 S164 D165	K136-N168 VanDerWaalsContact CA-O 3.23Å; K136-N168 WeakPolarHBondContact CA-O 2.91Å; K136-N168 PolarHBondContact N-O 3.42Å; G160-N168 PolarHBondContact N-OD1 3.3Å; Q163-N168 PolarHBondContact O-ND2 2.92Å; S164-N168 PolarHBondContact O-N 3.13Å; S164-N168 PolarHBondContact O-ND2 2.68Å; D165-N168 PolarHBondContact O-N 3.44Å
169	N	93.6	Very high	93.9	Very high	113 Å²	113	42.7 Å²	42.7	60%	0.604	26%	0.256	S	S	*	.	H	α-helix	trans	-82.3	-22.1	177.6	-72.8	-40.7	0	0	0	113.9	D165 N166 Q167	D165-N169 WeakPolarHBondContact O-CB 3.27Å; D165-N169 VanDerWaalsContact O-CG 3.29Å; D165-N169 PolarHBondContact O-N 3.45Å; D165-N169 PolarHBondContact O-ND2 3.22Å; N166-N169 PolarHBondContact O-N 3.03Å; Q167-N169 PolarHBondContact O-N 3.39Å
170	S	94.3	Very high	94.7	Very high	81 Å²	81	45.6 Å²	45.6	57%	0.566	27%	0.267	S	S	*	.	H	α-helix	trans	-96.1	-34.5	-176	-56.9	0	0	0	0	113.5	N166 Q167 S214	N166-S170 VanDerWaalsContact O-CB 3.26Å; N166-S170 WeakPolarHBondContact O-CB 2.97Å; N166-S170 PolarHBondContact O-N 3.21Å; N166-S170 PolarHBondContact O-OG 2.8Å; Q167-S170 PolarHBondContact O-N 2.83Å; Q167-S170 VanDerWaalsContact O-N 3.12Å; S170-S214 PolarHBondContact O-OG 3.48Å
171	Y	95.7	Very high	95.3	Very high	72 Å²	72	45.5 Å²	45.5	28%	0.282	26%	0.262	S	S	.	.			trans	-92.4	143	-175.1	-61.2	-33.9	0	0	0	112.4	P157 Q167 R213 S214	P157-Y171 HydrophobicContact CB-CD2 4.07Å; P157-Y171 HydrophobicContact CB-CG 4.22Å; Q167-Y171 HydrophobicContact CB-CD2 3.9Å; Q167-Y171 HydrophobicContact CB-CE2 3.83Å; Q167-Y171 HydrophobicContact CG-CD2 4.36Å; Q167-Y171 HydrophobicContact CG-CE2 3.76Å; Q167-Y171 WeakPolarHBondContact O-CB 3.49Å; Q167-Y171 PolarHBondContact O-N 3.3Å; Y171-R213 HydrophobicContact CD1-CB 4.02Å; Y171-R213 HydrophobicContact CD1-CG 4.28Å; Y171-R213 HydrophobicContact CE1-CB 4.35Å; Y171-R213 HydrophobicContact CG-CB 4.43Å; Y171-R213 HydrophobicContact CG-CG 4.3Å; Y171-S214 WeakPolarHBondContact CA-OG 3.26Å
172	T	94.4	Very high	94.7	Very high	42 Å²	42	46.1 Å²	46.1	26%	0.258	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	133.3	168.3	-66.4	0	0	0	0	109.1	A134 L174 R213 S214	A134-T172 WeakPolarHBondContact O-CA 3.2Å; T172-L174 HydrophobicContact CG2-CD2 4.01Å; T172-L174 HydrophobicContact CG2-CG 4.13Å; T172-R213 PolarHBondContact O-N 3.31Å; T172-S214 PolarHBondContact N-OG 3.07Å; T172-S214 PolarHBondContact O-N 3.07Å
173	T	96.4	Very high	94.1	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	127.5	175	-56.9	0	0	0	0	108.9	R133 A134 L156 P157 L175 F211 M212	R133-T173 WeakPolarHBondContact CA-O 3.3Å; A134-T173 PolarHBondContact N-O 2.84Å; A134-T173 PolarHBondContact O-N 2.85Å; L156-T173 HydrophobicContact CB-CG2 4.43Å; L156-T173 HydrophobicContact CD1-CG2 4.31Å; P157-T173 WeakPolarHBondContact O-CB 3.42Å; P157-T173 PolarHBondContact O-OG1 3.5Å; T173-L175 HydrophobicContact CG2-CD1 4.3Å; T173-L175 HydrophobicContact CG2-CD2 4.13Å; T173-L175 HydrophobicContact CG2-CG 3.96Å; T173-F211 CarbonylContact C-O 3.51Å; T173-F211 WeakPolarHBondContact CA-O 3.49Å; T173-M212 HydrophobicContact CG2-SD 3.62Å
174	L	95.5	Very high	92.7	Very high	9 Å²	9	55.3 Å²	55.3	5%	0.047	29%	0.289	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.2	120.7	177.4	-57.1	-174.6	0	0	0	108.9	F131 I132 R133 T172 I210 F211	F131-L174 HydrophobicContact CE1-CD2 4.22Å; F131-L174 HydrophobicContact CE2-CB 3.96Å; F131-L174 HydrophobicContact CE2-CD1 4.25Å; F131-L174 HydrophobicContact CE2-CD2 4.24Å; F131-L174 HydrophobicContact CE2-CG 4.37Å; F131-L174 HydrophobicContact CZ-CB 4.11Å; F131-L174 HydrophobicContact CZ-CD1 3.89Å; F131-L174 HydrophobicContact CZ-CD2 3.51Å; F131-L174 HydrophobicContact CZ-CG 4.03Å; I132-L174 VanDerWaalsContact O-CA 3.28Å; I132-L174 WeakPolarHBondContact O-CA 3.33Å; R133-L174 HydrophobicContact CB-CD2 3.7Å; R133-L174 HydrophobicContact CG-CD2 3.62Å; T172-L174 HydrophobicContact CG2-CD2 4.01Å; T172-L174 HydrophobicContact CG2-CG 4.13Å; L174-I210 HydrophobicContact CB-CB 3.99Å; L174-I210 HydrophobicContact CB-CG2 4.45Å; L174-I210 WeakPolarHBondContact O-CB 3.45Å; L174-I210 PolarHBondContact O-N 3.1Å; L174-F211 HydrophobicContact CB-CB 3.92Å; L174-F211 HydrophobicContact CB-CD2 4.29Å; L174-F211 HydrophobicContact CD1-CB 4.38Å; L174-F211 HydrophobicContact CD1-CD2 3.65Å; L174-F211 HydrophobicContact CD1-CE2 4.25Å; L174-F211 HydrophobicContact CD1-CG 4.22Å; L174-F211 HydrophobicContact CG-CB 3.99Å; L174-F211 HydrophobicContact CG-CD2 4.19Å; L174-F211 HydrophobicContact CG-CG 4.37Å; L174-F211 PolarHBondContact N-O 3.04Å; L174-F211 PolarHBondContact O-N 3.24Å; L174-F211 VanDerWaalsContact O-O 3.12Å
175	L	97.2	Very high	90.9	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	148.4	-178.2	-55.8	173.7	0	0	0	110.9	I132 L156 T173 C177 V206 I209 I237 F248	I132-L175 HydrophobicContact CB-CB 4.2Å; I132-L175 PolarHBondContact N-O 3.27Å; I132-L175 PolarHBondContact O-N 2.79Å; L156-L175 HydrophobicContact CD1-CD1 3.82Å; L156-L175 HydrophobicContact CD2-CD1 4.12Å; T173-L175 HydrophobicContact CG2-CD1 4.3Å; T173-L175 HydrophobicContact CG2-CD2 4.13Å; T173-L175 HydrophobicContact CG2-CG 3.96Å; L175-C177 VanDerWaalsContact CB-SG 3.57Å; L175-V206 HydrophobicContact CB-CG1 4.34Å; L175-V206 HydrophobicContact CD1-CG1 4.29Å; L175-V206 HydrophobicContact CD1-CG2 4.12Å; L175-V206 HydrophobicContact CD2-CG1 4.23Å; L175-I209 HydrophobicContact CD2-CB 4.43Å; L175-I209 HydrophobicContact CD2-CG1 4.24Å; L175-I237 HydrophobicContact CD2-CD1 4.44Å; L175-F248 HydrophobicContact CD1-CD1 4.46Å
176	D	96	Very high	89.3	Confident	0 Å²	0	56.1 Å²	56.1	0%	0	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.9	118.6	165	-171.6	-34.1	0	0	0	108.1	L102 H129 V207 D208 Y285	L102-D176 HydrophobicContact CD2-CB 4.38Å; H129-D176 IonicContact CD2-OD1 2.86Å; H129-D176 PolarHBondContact CD2-OD1 2.72Å; H129-D176 VanDerWaalsContact CD2-OD1 3.3Å; H129-D176 IonicContact CE1-OD1 3.22Å; H129-D176 IonicContact NE2-OD1 2.69Å; H129-D176 PolarHBondContact NE2-OD1 3.42Å; H129-D176 IonicContact NE2-OD2 3.59Å; H129-D176 PolarHBondContact NE2-OD2 2.66Å; D176-V207 PolarHBondContact O-N 2.77Å; D176-D208 HydrophobicContact CB-CB 3.94Å; D176-D208 PolarHBondContact N-O 2.9Å; D176-D208 PolarHBondContact O-N 3.41Å; D176-Y285 HydrophobicContact CB-CE2 4.1Å; D176-Y285 WeakPolarHBondContact OD2-CE2 3.21Å; D176-Y285 PolarHBondContact OD2-OH 2.86Å
177	C	97.4	Very high	87.5	Confident	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-137.4	162.8	-171.5	-65.3	0	0	0	0	113.2	H129 V130 I132 L175 F204 Y205	H129-C177 PolarHBondContact CD2-O 3.02Å; V130-C177 HydrophobicContact CG2-CB 4.05Å; V130-C177 WeakPolarHBondContact CG2-O 3.06Å; V130-C177 PolarHBondContact N-O 2.88Å; V130-C177 PolarHBondContact O-N 3.32Å; I132-C177 HydrophobicContact CG1-CB 3.77Å; I132-C177 VanDerWaalsContact CG1-SG 3.59Å; L175-C177 VanDerWaalsContact CB-SG 3.57Å; C177-F204 HydrophobicContact CB-CB 4.3Å; C177-F204 HydrophobicContact CB-CD1 4.43Å; C177-Y205 CarbonylContact C-O 3.54Å; C177-Y205 WeakPolarHBondContact CA-O 3.38Å
178	I	95.9	Very high	85.9	Confident	0 Å²	0	51.4 Å²	51.4	0%	0	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.5	118	166.3	-61.8	159.7	0	0	0	108	L14 C124 P125 R128 Y180 F204 Y205 V207 L251	L14-I178 HydrophobicContact CD1-CD1 3.76Å; L14-I178 HydrophobicContact CD1-CG1 4.34Å; L14-I178 HydrophobicContact CD2-CD1 3.96Å; L14-I178 HydrophobicContact CD2-CG1 3.71Å; L14-I178 HydrophobicContact CG-CD1 4.4Å; L14-I178 HydrophobicContact CG-CG1 4.47Å; C124-I178 HydrophobicContact CB-CD1 3.81Å; P125-I178 HydrophobicContact CG-CB 4.22Å; P125-I178 HydrophobicContact CG-CD1 4.28Å; P125-I178 HydrophobicContact CG-CG2 3.94Å; R128-I178 CarbonylContact O-C 3.57Å; R128-I178 WeakPolarHBondContact O-CA 3.42Å; I178-Y180 PolarHBondContact O-N 3.28Å; I178-F204 CarbonylContact O-C 3.56Å; I178-F204 WeakPolarHBondContact O-CA 3.06Å; I178-Y205 PolarHBondContact N-O 3.39Å; I178-Y205 PolarHBondContact O-N 3.31Å; I178-V207 HydrophobicContact CD1-CG2 3.59Å; I178-V207 HydrophobicContact CG1-CG2 3.69Å; I178-L251 HydrophobicContact CD1-CD1 4.2Å
179	L	94.7	Very high	84	Confident	2 Å²	2	54.3 Å²	54.3	1%	0.01	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	115.3	168.8	172.8	59.8	0	0	0	108.7	G127 R128 V130 L149 I150 C181 F188 F202 F204	G127-L179 CarbonylContact C-O 3.42Å; G127-L179 WeakPolarHBondContact CA-O 3.39Å; R128-L179 PolarHBondContact N-O 3.46Å; R128-L179 PolarHBondContact O-N 2.88Å; V130-L179 HydrophobicContact CG1-CB 4.29Å; V130-L179 HydrophobicContact CG2-CB 4.06Å; L149-L179 HydrophobicContact CD1-CD2 4.29Å; I150-L179 HydrophobicContact CD1-CD1 4.05Å; I150-L179 HydrophobicContact CD1-CD2 3.72Å; L179-C181 PolarHBondContact O-N 3.01Å; L179-F188 HydrophobicContact CD2-CD1 4.45Å; L179-F188 HydrophobicContact CD2-CE1 3.51Å; L179-F188 HydrophobicContact CD2-CZ 3.61Å; L179-F188 HydrophobicContact CG-CE1 4.41Å; L179-F188 HydrophobicContact CG-CZ 4.45Å; L179-F202 HydrophobicContact CD1-CB 4.38Å; L179-F202 HydrophobicContact CD1-CD1 4.21Å; L179-F204 HydrophobicContact CB-CD1 3.93Å; L179-F204 HydrophobicContact CB-CE1 3.83Å; L179-F204 HydrophobicContact CD1-CD1 4.01Å; L179-F204 HydrophobicContact CD1-CE1 3.62Å; L179-F204 HydrophobicContact CD1-CE2 4.38Å; L179-F204 HydrophobicContact CD1-CZ 3.85Å; L179-F204 HydrophobicContact CD2-CE1 4.47Å; L179-F204 HydrophobicContact CG-CE1 4.16Å
180	Y	94.2	Very high	81.8	Confident	62 Å²	62	54.3 Å²	54.3	24%	0.243	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.3	117.7	-175.2	-176	-125.3	0	0	0	112	P125 K126 I178 P182 V203 Y205 K272	P125-Y180 HydrophobicContact CB-CD2 3.82Å; P125-Y180 HydrophobicContact CB-CE2 4.13Å; K126-Y180 WeakPolarHBondContact O-CD2 3.24Å; I178-Y180 PolarHBondContact O-N 3.28Å; Y180-P182 HydrophobicContact CE1-CG 3.99Å; Y180-P182 HydrophobicContact CE2-CB 4.23Å; Y180-P182 HydrophobicContact CE2-CG 4.37Å; Y180-V203 WeakPolarHBondContact CB-O 3.14Å; Y180-V203 PolarHBondContact N-O 2.99Å; Y180-Y205 HydrophobicContact CD1-CE2 4.46Å; Y180-Y205 HydrophobicContact CD2-CE2 4.04Å; Y180-Y205 HydrophobicContact CG-CD2 4.43Å; Y180-Y205 AromaticContact CG-CE2 3.83Å; Y180-Y205 HydrophobicContact CG-CE2 3.83Å; Y180-K272 PolarHBondContact OH-N 2.95Å
181	C	89.2	Confident	80	Confident	21 Å²	21	53.6 Å²	53.6	14%	0.142	27%	0.272	C	S	.	.			trans	-146.6	86.4	-179.5	-66.8	0	0	0	0	108.7	K126 L179 E183 I186 F188	K126-C181 CarbonylContact O-C 3.46Å; K126-C181 PolarHBondContact O-N 3.18Å; L179-C181 PolarHBondContact O-N 3.01Å; C181-E183 PolarHBondContact O-N 3.1Å; C181-I186 HydrophobicContact CB-CD1 3.87Å; C181-F188 WeakPolarHBondContact SG-CZ 3.31Å
182	P	84.6	Confident	77.6	Confident	53 Å²	53	58.2 Å²	58.2	34%	0.344	30%	0.296	S	S	.	.			trans	-69	-21.5	-177.2	26.9	-33.8	0	0	0	113.1	Y180	Y180-P182 HydrophobicContact CE1-CG 3.99Å; Y180-P182 HydrophobicContact CE2-CB 4.23Å; Y180-P182 HydrophobicContact CE2-CG 4.37Å
183	E	81.8	Confident	75	Confident	142 Å²	142	63.6 Å²	63.6	66%	0.664	32%	0.32	S	S	*	.	S	Bend	trans	-98.9	135.9	176.8	-62.7	-175.3	-173	0	0	111.1	C181 N185 I186	C181-E183 PolarHBondContact O-N 3.1Å; E183-N185 VanDerWaalsContact C-N 3.27Å; E183-N185 PolarHBondContact O-N 3.22Å; E183-I186 HydrophobicContact CB-CD1 4.36Å; E183-I186 HydrophobicContact CB-CG1 4.07Å
184	K	65	Low	72.3	Confident	165 Å²	165	66.3 Å²	66.3	72%	0.717	34%	0.342	S	S	*	.	T	Hydrogen-bonded Turn	trans	-68	-21.4	-173.9	-67.9	-173.7	175.7	-176.8	0	114.3
185	N	59.5	Low	69.9	Low	143 Å²	143	74 Å²	74	77%	0.765	38%	0.384	S	S	*	.	T	Hydrogen-bonded Turn	trans	-119.9	39.5	-169.8	-64.6	-29.7	0	0	0	112.9	E183 D187	E183-N185 VanDerWaalsContact C-N 3.27Å; E183-N185 PolarHBondContact O-N 3.22Å; N185-D187 PolarHBondContact O-N 3.32Å
186	I	61.3	Low	67.6	Low	58 Å²	58	77.2 Å²	77.2	30%	0.297	42%	0.416	S	S	.	.			trans	-72.4	112.7	172.2	-61.5	178.4	0	0	0	108.5	C181 E183 F188 F191	C181-I186 HydrophobicContact CB-CD1 3.87Å; E183-I186 HydrophobicContact CB-CD1 4.36Å; E183-I186 HydrophobicContact CB-CG1 4.07Å; I186-F188 HydrophobicContact CG2-CE1 4.33Å; I186-F188 WeakPolarHBondContact O-CD2 3.41Å; I186-F188 PolarHBondContact O-N 3.28Å; I186-F191 HydrophobicContact CG2-CE2 3.89Å; I186-F191 HydrophobicContact CG2-CZ 4.12Å
187	D	60.2	Low	65.5	Low	71 Å²	71	83.6 Å²	83.6	38%	0.38	46%	0.455	S	S	.	.			trans	-73	107	173.2	178.9	15.1	0	0	0	110.5	N185 S189 N190 F191	N185-D187 PolarHBondContact O-N 3.32Å; D187-S189 VanDerWaalsContact C-N 3.27Å; D187-S189 PolarHBondContact O-N 2.82Å; D187-S189 WeakPolarHBondContact OD1-CB 3.46Å; D187-S189 PolarHBondContact OD1-N 2.76Å; D187-S189 PolarHBondContact OD1-OG 3.36Å; D187-S189 PolarHBondContact OD2-OG 3.24Å; D187-N190 PolarHBondContact OD2-ND2 2.87Å; D187-F191 WeakPolarHBondContact O-CD2 3.28Å; D187-F191 WeakPolarHBondContact O-CE2 3.46Å
188	F	60.8	Low	63.5	Low	32 Å²	32	93.2 Å²	93.2	14%	0.14	50%	0.497	C	S	.	.	S	Bend	trans	-75.1	-13.7	175.8	-66.2	-73.3	0	0	0	113.8	L179 C181 I186 N190 F191 F202	L179-F188 HydrophobicContact CD2-CD1 4.45Å; L179-F188 HydrophobicContact CD2-CE1 3.51Å; L179-F188 HydrophobicContact CD2-CZ 3.61Å; L179-F188 HydrophobicContact CG-CE1 4.41Å; L179-F188 HydrophobicContact CG-CZ 4.45Å; C181-F188 WeakPolarHBondContact SG-CZ 3.31Å; I186-F188 HydrophobicContact CG2-CE1 4.33Å; I186-F188 WeakPolarHBondContact O-CD2 3.41Å; I186-F188 PolarHBondContact O-N 3.28Å; F188-N190 VanDerWaalsContact C-N 3.3Å; F188-N190 PolarHBondContact O-N 2.69Å; F188-F191 VanDerWaalsContact CA-CD2 3.49Å; F188-F191 HydrophobicContact CB-CD2 4.41Å; F188-F191 HydrophobicContact CD1-CD2 4.19Å; F188-F191 AromaticContact CD1-CE2 3.96Å; F188-F191 HydrophobicContact CD1-CE2 3.96Å; F188-F191 WeakPolarHBondContact O-CB 3.19Å; F188-F191 PolarHBondContact O-N 2.93Å; F188-F202 HydrophobicContact CD1-CE1 4.44Å
189	S	55.8	Low	62	Low	74 Å²	74	98.4 Å²	98.4	52%	0.517	52%	0.521	S	S	.	.	G	3₁₀ helix	trans	-66.1	-34.7	-175.2	76.4	0	0	0	0	112.1	D187 F191	D187-S189 VanDerWaalsContact C-N 3.27Å; D187-S189 PolarHBondContact O-N 2.82Å; D187-S189 WeakPolarHBondContact OD1-CB 3.46Å; D187-S189 PolarHBondContact OD1-N 2.76Å; D187-S189 PolarHBondContact OD1-OG 3.36Å; D187-S189 PolarHBondContact OD2-OG 3.24Å; S189-F191 PolarHBondContact O-N 3.19Å
190	N	48	Very low	61.3	Low	113 Å²	113	104 Å²	104	60%	0.604	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-72.7	-8.9	178.8	-67.9	-38.2	0	0	0	114.3	D187 F188 Q192	D187-N190 PolarHBondContact OD2-ND2 2.87Å; F188-N190 VanDerWaalsContact C-N 3.3Å; F188-N190 PolarHBondContact O-N 2.69Å; N190-Q192 VanDerWaalsContact C-N 3.27Å; N190-Q192 PolarHBondContact O-N 3.18Å
191	F	55.6	Low	61.1	Low	67 Å²	67	102.8 Å²	102.8	29%	0.294	55%	0.548	S	S	.	.	G	3₁₀ helix	trans	-76.8	-10.6	-177	-76.3	-99	0	0	0	114.3	I186 D187 F188 S189 M193 M200 F202	I186-F191 HydrophobicContact CG2-CE2 3.89Å; I186-F191 HydrophobicContact CG2-CZ 4.12Å; D187-F191 WeakPolarHBondContact O-CD2 3.28Å; D187-F191 WeakPolarHBondContact O-CE2 3.46Å; F188-F191 VanDerWaalsContact CA-CD2 3.49Å; F188-F191 HydrophobicContact CB-CD2 4.41Å; F188-F191 HydrophobicContact CD1-CD2 4.19Å; F188-F191 AromaticContact CD1-CE2 3.96Å; F188-F191 HydrophobicContact CD1-CE2 3.96Å; F188-F191 WeakPolarHBondContact O-CB 3.19Å; F188-F191 PolarHBondContact O-N 2.93Å; S189-F191 PolarHBondContact O-N 3.19Å; F191-M193 VanDerWaalsContact C-N 3.27Å; F191-M193 PolarHBondContact O-N 3.31Å; F191-M200 HydrophobicContact CE1-CB 4.18Å; F191-M200 HydrophobicContact CE1-CG 3.81Å; F191-F202 HydrophobicContact CB-CE1 4.32Å; F191-F202 HydrophobicContact CB-CZ 3.61Å; F191-F202 HydrophobicContact CD1-CD1 4.15Å; F191-F202 AromaticContact CD1-CE1 3.12Å; F191-F202 HydrophobicContact CD1-CE1 3.12Å; F191-F202 AromaticContact CD1-CE2 3.83Å; F191-F202 HydrophobicContact CD1-CE2 3.83Å; F191-F202 AromaticContact CD1-CZ 2.97Å; F191-F202 HydrophobicContact CD1-CZ 2.97Å; F191-F202 HydrophobicContact CD2-CE1 4.35Å; F191-F202 HydrophobicContact CD2-CZ 4.46Å; F191-F202 AromaticContact CE1-CD1 3.9Å; F191-F202 HydrophobicContact CE1-CD1 3.9Å; F191-F202 AromaticContact CE1-CE1 3.2Å; F191-F202 HydrophobicContact CE1-CE1 3.2Å; F191-F202 HydrophobicContact CE1-CE2 4.46Å; F191-F202 AromaticContact CE1-CZ 3.59Å; F191-F202 HydrophobicContact CE1-CZ 3.59Å; F191-F202 HydrophobicContact CE2-CE1 4.42Å; F191-F202 AromaticContact CG-CE1 3.7Å; F191-F202 HydrophobicContact CG-CE1 3.7Å; F191-F202 AromaticContact CG-CZ 3.45Å; F191-F202 HydrophobicContact CG-CZ 3.45Å; F191-F202 VanDerWaalsContact CG-CZ 3.45Å; F191-F202 AromaticContact CZ-CE1 3.88Å; F191-F202 HydrophobicContact CZ-CE1 3.88Å
192	Q	45.9	Very low	61.3	Low	168 Å²	168	102.7 Å²	102.7	79%	0.785	55%	0.545	S	S	*	.	G	3₁₀ helix	trans	-76.7	-10	176.4	-70.4	-169	11	0	0	113.7	N190	N190-Q192 VanDerWaalsContact C-N 3.27Å; N190-Q192 PolarHBondContact O-N 3.18Å
193	M	39.3	Very low	61.8	Low	156 Å²	156	102 Å²	102	77%	0.768	54%	0.54	S	S	*	.			trans	-145.8	95.2	-169.2	-62.4	-67.1	-75.2	0	0	111.6	F191	F191-M193 VanDerWaalsContact C-N 3.27Å; F191-M193 PolarHBondContact O-N 3.31Å
194	A	40.5	Very low	62.6	Low	57 Å²	57	95.3 Å²	95.3	47%	0.471	51%	0.509	S	S	.	.			trans	-136	62.3	169.2	0	0	0	0	0	111.6	G196	A194-G196 PolarHBondContact O-N 3.19Å
195	N	44.7	Very low	64.2	Low	171 Å²	171	88.4 Å²	88.4	91%	0.914	48%	0.478	S	S	*	.	S	Bend	trans	-75.8	90.7	157.6	-68.4	-9.3	0	0	0	107.2
196	G	49.4	Very low	66.1	Low	66 Å²	66	81.6 Å²	81.6	68%	0.68	44%	0.442	S	S	*	.	S	Bend	trans	173.9	-69.5	174	0	0	0	0	0	117.9	A194	A194-G196 PolarHBondContact O-N 3.19Å
197	T	52.4	Low	67.8	Low	134 Å²	134	78.9 Å²	78.9	82%	0.822	43%	0.428	S	S	*	.	S	Bend	trans	-153.5	103.7	-164.3	47.5	0	0	0	0	111.1
198	K	54	Low	69.6	Low	202 Å²	202	75.5 Å²	75.5	88%	0.878	41%	0.41	S	S	*	.			trans	64.6	98.6	178.8	-157.8	174.1	-176	179.6	0	114.9	M200	K198-M200 PolarHBondContact O-N 2.88Å
199	Q	65.5	Low	71.3	Confident	109 Å²	109	74 Å²	74	51%	0.509	40%	0.403	S	S	.	.	P	Polyproline II helix	trans	-56.6	121.4	168.7	-178.8	64.3	61.9	0	0	109.3
200	M	78.7	Confident	73.1	Confident	121 Å²	121	70.9 Å²	70.9	60%	0.596	38%	0.38	S	S	*	.	P	Polyproline II helix	trans	-78.2	133.7	171.3	-174	73	86.5	0	0	109	F191 K198	F191-M200 HydrophobicContact CE1-CB 4.18Å; F191-M200 HydrophobicContact CE1-CG 3.81Å; K198-M200 PolarHBondContact O-N 2.88Å
201	T	90.8	Very high	75.3	Confident	35 Å²	35	68 Å²	68	22%	0.215	36%	0.363	C	S	.	.	P	Polyproline II helix	trans	-93.9	125.6	172	-60.1	0	0	0	0	109.3	Y240 D244 A247	T201-Y240 HydrophobicContact CG2-CE2 3.7Å; T201-Y240 PolarHBondContact OG1-OH 2.92Å; T201-D244 WeakPolarHBondContact CG2-O 3.25Å; T201-D244 PolarHBondContact OG1-O 3.32Å; T201-D244 VanDerWaalsContact OG1-O 3.04Å; T201-A247 HydrophobicContact CG2-CB 3.88Å
202	F	93.4	Very high	77.2	Confident	19 Å²	19	64.9 Å²	64.9	8%	0.083	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	128.5	172.6	-65.3	-77.9	0	0	0	110.8	I150 L179 F188 F191 F204 P245 V246 A247	I150-F202 HydrophobicContact CD1-CB 4.43Å; I150-F202 HydrophobicContact CD1-CD1 3.44Å; I150-F202 VanDerWaalsContact CD1-CD1 3.44Å; I150-F202 HydrophobicContact CD1-CD2 4.27Å; I150-F202 HydrophobicContact CD1-CE1 3.43Å; I150-F202 VanDerWaalsContact CD1-CE1 3.43Å; I150-F202 HydrophobicContact CD1-CE2 4.27Å; I150-F202 HydrophobicContact CD1-CG 3.82Å; I150-F202 HydrophobicContact CD1-CZ 3.81Å; I150-F202 HydrophobicContact CG1-CD1 4.32Å; I150-F202 HydrophobicContact CG1-CE1 3.85Å; I150-F202 HydrophobicContact CG1-CE2 4.29Å; I150-F202 HydrophobicContact CG1-CZ 3.77Å; I150-F202 HydrophobicContact CG2-CD2 4.13Å; I150-F202 HydrophobicContact CG2-CE2 3.87Å; I150-F202 HydrophobicContact CG2-CZ 4.19Å; L179-F202 HydrophobicContact CD1-CB 4.38Å; L179-F202 HydrophobicContact CD1-CD1 4.21Å; F188-F202 HydrophobicContact CD1-CE1 4.44Å; F191-F202 HydrophobicContact CB-CE1 4.32Å; F191-F202 HydrophobicContact CB-CZ 3.61Å; F191-F202 HydrophobicContact CD1-CD1 4.15Å; F191-F202 AromaticContact CD1-CE1 3.12Å; F191-F202 HydrophobicContact CD1-CE1 3.12Å; F191-F202 AromaticContact CD1-CE2 3.83Å; F191-F202 HydrophobicContact CD1-CE2 3.83Å; F191-F202 AromaticContact CD1-CZ 2.97Å; F191-F202 HydrophobicContact CD1-CZ 2.97Å; F191-F202 HydrophobicContact CD2-CE1 4.35Å; F191-F202 HydrophobicContact CD2-CZ 4.46Å; F191-F202 AromaticContact CE1-CD1 3.9Å; F191-F202 HydrophobicContact CE1-CD1 3.9Å; F191-F202 AromaticContact CE1-CE1 3.2Å; F191-F202 HydrophobicContact CE1-CE1 3.2Å; F191-F202 HydrophobicContact CE1-CE2 4.46Å; F191-F202 AromaticContact CE1-CZ 3.59Å; F191-F202 HydrophobicContact CE1-CZ 3.59Å; F191-F202 HydrophobicContact CE2-CE1 4.42Å; F191-F202 AromaticContact CG-CE1 3.7Å; F191-F202 HydrophobicContact CG-CE1 3.7Å; F191-F202 AromaticContact CG-CZ 3.45Å; F191-F202 HydrophobicContact CG-CZ 3.45Å; F191-F202 VanDerWaalsContact CG-CZ 3.45Å; F191-F202 AromaticContact CZ-CE1 3.88Å; F191-F202 HydrophobicContact CZ-CE1 3.88Å; F202-F204 HydrophobicContact CB-CD2 4.38Å; F202-F204 HydrophobicContact CB-CE2 3.67Å; F202-F204 HydrophobicContact CB-CZ 4.23Å; F202-P245 WeakPolarHBondContact CD2-O 3.12Å; F202-P245 PolarHBondContact N-O 3.28Å; F202-V246 HydrophobicContact CB-CG2 4.36Å; F202-V246 HydrophobicContact CD2-CG2 4.39Å; F202-V246 CarbonylContact O-C 3.56Å; F202-V246 WeakPolarHBondContact O-CA 3.15Å; F202-A247 PolarHBondContact O-N 2.91Å
203	V	95.9	Very high	79.5	Confident	38 Å²	38	61.6 Å²	61.6	23%	0.23	33%	0.33	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	121.4	179.5	-178.1	0	0	0	0	109.7	Y180 Y205	Y180-V203 WeakPolarHBondContact CB-O 3.14Å; Y180-V203 PolarHBondContact N-O 2.99Å; V203-Y205 HydrophobicContact CG1-CD2 4.31Å; V203-Y205 HydrophobicContact CG1-CE2 3.81Å
204	F	97.9	Very high	81.9	Confident	3 Å²	3	56.8 Å²	56.8	1%	0.013	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	131.2	175.2	-62.2	-89.9	0	0	0	110.5	V130 I132 A141 I150 C177 I178 L179 F202 V246 A247 F248 H249	V130-F204 HydrophobicContact CG2-CD1 3.9Å; V130-F204 HydrophobicContact CG2-CE1 3.96Å; I132-F204 HydrophobicContact CD1-CD1 3.63Å; I132-F204 HydrophobicContact CD1-CE1 3.46Å; I132-F204 VanDerWaalsContact CD1-CE1 3.46Å; I132-F204 HydrophobicContact CD1-CG 4.24Å; I132-F204 HydrophobicContact CD1-CZ 3.95Å; I132-F204 HydrophobicContact CG1-CD1 4.35Å; A141-F204 HydrophobicContact CB-CE1 3.81Å; A141-F204 HydrophobicContact CB-CZ 3.92Å; I150-F204 HydrophobicContact CD1-CE1 4.3Å; I150-F204 HydrophobicContact CD1-CZ 3.65Å; C177-F204 HydrophobicContact CB-CB 4.3Å; C177-F204 HydrophobicContact CB-CD1 4.43Å; I178-F204 CarbonylContact O-C 3.56Å; I178-F204 WeakPolarHBondContact O-CA 3.06Å; L179-F204 HydrophobicContact CB-CD1 3.93Å; L179-F204 HydrophobicContact CB-CE1 3.83Å; L179-F204 HydrophobicContact CD1-CD1 4.01Å; L179-F204 HydrophobicContact CD1-CE1 3.62Å; L179-F204 HydrophobicContact CD1-CE2 4.38Å; L179-F204 HydrophobicContact CD1-CZ 3.85Å; L179-F204 HydrophobicContact CD2-CE1 4.47Å; L179-F204 HydrophobicContact CG-CE1 4.16Å; F202-F204 HydrophobicContact CB-CD2 4.38Å; F202-F204 HydrophobicContact CB-CE2 3.67Å; F202-F204 HydrophobicContact CB-CZ 4.23Å; F204-V246 HydrophobicContact CD2-CG1 3.42Å; F204-V246 VanDerWaalsContact CD2-CG1 3.42Å; F204-V246 HydrophobicContact CE2-CB 4.45Å; F204-V246 HydrophobicContact CE2-CG1 3.41Å; F204-V246 VanDerWaalsContact CE2-CG1 3.41Å; F204-V246 HydrophobicContact CE2-CG2 4.26Å; F204-A247 PolarHBondContact N-O 3.39Å; F204-F248 HydrophobicContact CB-CD1 3.61Å; F204-F248 HydrophobicContact CB-CE1 3.72Å; F204-F248 HydrophobicContact CD2-CD1 4.39Å; F204-F248 AromaticContact CD2-CE1 3.88Å; F204-F248 HydrophobicContact CD2-CE1 3.88Å; F204-F248 HydrophobicContact CD2-CZ 4.17Å; F204-F248 HydrophobicContact CG-CD1 4.3Å; F204-F248 AromaticContact CG-CE1 3.92Å; F204-F248 HydrophobicContact CG-CE1 3.92Å; F204-F248 CarbonylContact O-C 3.51Å; F204-F248 VanDerWaalsContact O-CA 3.3Å; F204-F248 WeakPolarHBondContact O-CA 3.17Å; F204-H249 PolarHBondContact O-N 3.1Å
205	Y	98.4	Very high	84.4	Confident	20 Å²	20	57.8 Å²	57.8	8%	0.078	31%	0.312	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	118.3	171.4	-73.6	-87.8	0	0	0	110	P125 C177 I178 Y180 V203 V207 H249 L251 Y271	P125-Y205 HydrophobicContact CB-CD2 4.04Å; P125-Y205 HydrophobicContact CB-CE2 4.19Å; P125-Y205 HydrophobicContact CB-CG 4.48Å; P125-Y205 HydrophobicContact CG-CD1 4.37Å; P125-Y205 HydrophobicContact CG-CD2 3.47Å; P125-Y205 VanDerWaalsContact CG-CD2 3.47Å; P125-Y205 HydrophobicContact CG-CE2 4.11Å; P125-Y205 HydrophobicContact CG-CG 3.6Å; C177-Y205 CarbonylContact C-O 3.54Å; C177-Y205 WeakPolarHBondContact CA-O 3.38Å; I178-Y205 PolarHBondContact N-O 3.39Å; I178-Y205 PolarHBondContact O-N 3.31Å; Y180-Y205 HydrophobicContact CD1-CE2 4.46Å; Y180-Y205 HydrophobicContact CD2-CE2 4.04Å; Y180-Y205 HydrophobicContact CG-CD2 4.43Å; Y180-Y205 AromaticContact CG-CE2 3.83Å; Y180-Y205 HydrophobicContact CG-CE2 3.83Å; V203-Y205 HydrophobicContact CG1-CD2 4.31Å; V203-Y205 HydrophobicContact CG1-CE2 3.81Å; Y205-V207 PolarHBondContact O-N 2.71Å; Y205-H249 CarbonylContact C-O 3.58Å; Y205-H249 WeakPolarHBondContact CA-O 3.24Å; Y205-H249 HydrophobicContact CD1-CB 3.78Å; Y205-H249 HydrophobicContact CE1-CB 3.78Å; Y205-L251 HydrophobicContact CD1-CD2 3.55Å; Y205-L251 HydrophobicContact CD1-CG 4.31Å; Y205-L251 HydrophobicContact CE1-CD2 4.44Å; Y205-L251 HydrophobicContact CG-CD2 4.06Å; Y205-Y271 HydrophobicContact CD1-CD1 4.26Å; Y205-Y271 HydrophobicContact CD1-CE1 4.06Å; Y205-Y271 AromaticContact CE1-CD1 3.38Å; Y205-Y271 HydrophobicContact CE1-CD1 3.38Å; Y205-Y271 AromaticContact CE1-CE1 3.5Å; Y205-Y271 HydrophobicContact CE1-CE1 3.5Å; Y205-Y271 HydrophobicContact CE1-CG 4.34Å; Y205-Y271 HydrophobicContact CE2-CD1 4.27Å; Y205-Y271 AromaticContact CZ-CD1 3.38Å; Y205-Y271 VanDerWaalsContact OH-CD1 3.31Å; Y205-Y271 WeakPolarHBondContact OH-CD1 3.39Å
206	V	98.6	Very high	86.6	Confident	0 Å²	0	52.3 Å²	52.3	0%	0	29%	0.286	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.9	117.1	-176.4	-173.7	0	0	0	0	109.4	L175 L229 I237 F248 H249 I250 L251	L175-V206 HydrophobicContact CB-CG1 4.34Å; L175-V206 HydrophobicContact CD1-CG1 4.29Å; L175-V206 HydrophobicContact CD1-CG2 4.12Å; L175-V206 HydrophobicContact CD2-CG1 4.23Å; V206-L229 HydrophobicContact CG1-CD1 4.33Å; V206-L229 HydrophobicContact CG1-CD2 4.01Å; V206-I237 HydrophobicContact CG2-CG2 3.88Å; V206-F248 HydrophobicContact CG2-CB 4.17Å; V206-F248 HydrophobicContact CG2-CD1 4.04Å; V206-H249 PolarHBondContact N-O 2.8Å; V206-I250 HydrophobicContact CB-CG1 4.05Å; V206-I250 HydrophobicContact CG2-CG1 4.33Å; V206-L251 PolarHBondContact O-N 2.84Å
207	V	98.2	Very high	88.8	Confident	1 Å²	1	50.1 Å²	50.1	1%	0.006	26%	0.257	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-50.2	179.9	-177.9	0	0	0	0	110	K122 D176 I178 Y205 L251 L277 Y279	K122-V207 WeakPolarHBondContact CE-O 3.43Å; K122-V207 PolarHBondContact NZ-O 2.85Å; D176-V207 PolarHBondContact O-N 2.77Å; I178-V207 HydrophobicContact CD1-CG2 3.59Å; I178-V207 HydrophobicContact CG1-CG2 3.69Å; Y205-V207 PolarHBondContact O-N 2.71Å; V207-L251 HydrophobicContact CG2-CD1 4.04Å; V207-L277 HydrophobicContact CG1-CD1 3.83Å; V207-Y279 VanDerWaalsContact CG1-OH 3.26Å; V207-Y279 WeakPolarHBondContact CG1-OH 3.41Å
208	D	97.9	Very high	90.6	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	167	-176.6	-150.3	-21.1	0	0	0	111.8	D176 R225 Y285	D176-D208 HydrophobicContact CB-CB 3.94Å; D176-D208 PolarHBondContact N-O 2.9Å; D176-D208 PolarHBondContact O-N 3.41Å; D208-R225 IonicContact OD1-CZ 2.78Å; D208-R225 IonicContact OD1-NE 2.72Å; D208-R225 PolarHBondContact OD1-NE 2.89Å; D208-R225 IonicContact OD1-NH2 2.95Å; D208-R225 IonicContact OD2-CZ 3.01Å; D208-R225 VanDerWaalsContact OD2-CZ 3.31Å; D208-R225 IonicContact OD2-NE 3.86Å; D208-R225 PolarHBondContact OD2-NE 3.2Å; D208-R225 VanDerWaalsContact OD2-NE 3.1Å; D208-R225 IonicContact OD2-NH2 3.7Å; D208-R225 PolarHBondContact OD2-NH2 2.93Å; D208-Y285 HydrophobicContact CB-CD2 4.11Å; D208-Y285 HydrophobicContact CB-CE2 3.93Å; D208-Y285 WeakPolarHBondContact OD2-CD2 3.49Å
209	I	96.5	Very high	92.4	Very high	0 Å²	0	42 Å²	42	0%	0	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-115.6	131.1	-177.7	-178.6	165.7	0	0	0	111	L175 M212 Y217 R225 L229 L233	L175-I209 HydrophobicContact CD2-CB 4.43Å; L175-I209 HydrophobicContact CD2-CG1 4.24Å; I209-M212 HydrophobicContact CD1-CB 3.65Å; I209-M212 HydrophobicContact CD1-CG 4.49Å; I209-M212 HydrophobicContact CG1-CB 4.47Å; I209-Y217 HydrophobicContact CD1-CD1 4.41Å; I209-Y217 HydrophobicContact CD1-CD2 3.88Å; I209-Y217 HydrophobicContact CD1-CE2 4Å; I209-Y217 HydrophobicContact CD1-CG 4.11Å; I209-Y217 HydrophobicContact CG1-CD2 4Å; I209-Y217 HydrophobicContact CG1-CG 4.11Å; I209-Y217 HydrophobicContact CG2-CG 4.33Å; I209-R225 HydrophobicContact CG2-CB 3.84Å; I209-R225 HydrophobicContact CG2-CG 4.28Å; I209-L229 HydrophobicContact CB-CD1 4.22Å; I209-L229 HydrophobicContact CB-CD2 3.86Å; I209-L229 HydrophobicContact CB-CG 3.95Å; I209-L229 HydrophobicContact CD1-CD2 4.32Å; I209-L229 HydrophobicContact CG2-CD1 4.17Å; I209-L229 HydrophobicContact CG2-CD2 4.32Å; I209-L229 HydrophobicContact CG2-CG 3.86Å; I209-L233 HydrophobicContact CD1-CD1 3.21Å
210	I	94.2	Very high	93.8	Very high	8 Å²	8	39.1 Å²	39.1	4%	0.041	21%	0.207	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	-51	179.1	-48.5	172.7	0	0	0	109.1	F131 L174 Y217 V218 Y285	F131-I210 HydrophobicContact CD2-CD1 3.96Å; F131-I210 HydrophobicContact CE2-CD1 3.83Å; L174-I210 HydrophobicContact CB-CB 3.99Å; L174-I210 HydrophobicContact CB-CG2 4.45Å; L174-I210 WeakPolarHBondContact O-CB 3.45Å; L174-I210 PolarHBondContact O-N 3.1Å; I210-Y217 PolarHBondContact O-N 2.92Å; I210-V218 HydrophobicContact CB-CG1 4.43Å; I210-V218 HydrophobicContact CG2-CG1 3.51Å; I210-Y285 HydrophobicContact CD1-CD1 4.35Å; I210-Y285 HydrophobicContact CD1-CE1 3.52Å; I210-Y285 HydrophobicContact CG1-CD1 3.97Å; I210-Y285 HydrophobicContact CG1-CE1 3.59Å; I210-Y285 HydrophobicContact CG1-CE2 4.35Å; I210-Y285 HydrophobicContact CG1-CG 4.48Å; I210-Y285 HydrophobicContact CG2-CD1 4.45Å
211	F	93.2	Very high	94.6	Very high	52 Å²	52	34.7 Å²	34.7	23%	0.228	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-138.5	143.6	173.3	-77.4	-105.8	0	0	0	111.3	T173 L174 T215 C216	T173-F211 CarbonylContact C-O 3.51Å; T173-F211 WeakPolarHBondContact CA-O 3.49Å; L174-F211 HydrophobicContact CB-CB 3.92Å; L174-F211 HydrophobicContact CB-CD2 4.29Å; L174-F211 HydrophobicContact CD1-CB 4.38Å; L174-F211 HydrophobicContact CD1-CD2 3.65Å; L174-F211 HydrophobicContact CD1-CE2 4.25Å; L174-F211 HydrophobicContact CD1-CG 4.22Å; L174-F211 HydrophobicContact CG-CB 3.99Å; L174-F211 HydrophobicContact CG-CD2 4.19Å; L174-F211 HydrophobicContact CG-CG 4.37Å; L174-F211 PolarHBondContact N-O 3.04Å; L174-F211 PolarHBondContact O-N 3.24Å; L174-F211 VanDerWaalsContact O-O 3.12Å; F211-T215 CarbonylContact C-O 3.44Å; F211-T215 WeakPolarHBondContact CA-O 3.1Å; F211-C216 HydrophobicContact CD1-CB 4.03Å; F211-C216 HydrophobicContact CE1-CB 3.5Å; F211-C216 VanDerWaalsContact CE1-CB 3.5Å; F211-C216 HydrophobicContact CE2-CB 4.21Å; F211-C216 WeakPolarHBondContact CE2-SG 3.07Å; F211-C216 HydrophobicContact CZ-CB 3.6Å; F211-C216 WeakPolarHBondContact CZ-SG 3.27Å
212	M	95.4	Very high	95	Very high	3 Å²	3	33 Å²	33	2%	0.015	18%	0.177	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.5	129.6	168.8	-179	65.2	161	0	0	109.4	P157 T173 I209 S214 T215 Y217 L233 Q236 I237	P157-M212 HydrophobicContact CG-CE 3.58Å; P157-M212 HydrophobicContact CG-SD 3.81Å; T173-M212 HydrophobicContact CG2-SD 3.62Å; I209-M212 HydrophobicContact CD1-CB 3.65Å; I209-M212 HydrophobicContact CD1-CG 4.49Å; I209-M212 HydrophobicContact CG1-CB 4.47Å; M212-S214 PolarHBondContact O-N 2.95Å; M212-T215 PolarHBondContact N-O 2.66Å; M212-T215 WeakPolarHBondContact O-CB 3.41Å; M212-T215 PolarHBondContact O-N 3.25Å; M212-Y217 HydrophobicContact CB-CE2 3.83Å; M212-L233 HydrophobicContact CB-CD1 4.19Å; M212-L233 HydrophobicContact CE-CD2 4.38Å; M212-L233 HydrophobicContact CG-CD1 4.02Å; M212-L233 HydrophobicContact CG-CD2 3.96Å; M212-Q236 HydrophobicContact CE-CB 3.96Å; M212-I237 HydrophobicContact CE-CG1 3.86Å
213	R	93.6	Very high	95.2	Very high	99 Å²	99	36.9 Å²	36.9	37%	0.374	19%	0.192	S	C	.	.	T	Hydrogen-bonded Turn	trans	47.7	40.2	-172.9	-67.3	-159.3	174.3	99.8	7.9	114	P157 Y171 T172 T215 Q236	P157-R213 HydrophobicContact CB-CG 3.56Å; P157-R213 HydrophobicContact CG-CG 3.66Å; Y171-R213 HydrophobicContact CD1-CB 4.02Å; Y171-R213 HydrophobicContact CD1-CG 4.28Å; Y171-R213 HydrophobicContact CE1-CB 4.35Å; Y171-R213 HydrophobicContact CG-CB 4.43Å; Y171-R213 HydrophobicContact CG-CG 4.3Å; T172-R213 PolarHBondContact O-N 3.31Å; R213-T215 PolarHBondContact O-N 3.38Å; R213-Q236 VanDerWaalsContact NH1-CD 3.31Å; R213-Q236 VanDerWaalsContact NH2-OE1 3.14Å
214	S	90.4	Very high	95.3	Very high	55 Å²	55	38.9 Å²	38.9	39%	0.385	20%	0.199	S	C	.	.	T	Hydrogen-bonded Turn	trans	67.7	7.2	-178.9	-46	0	0	0	0	115.1	S170 Y171 T172 M212	S170-S214 PolarHBondContact O-OG 3.48Å; Y171-S214 WeakPolarHBondContact CA-OG 3.26Å; T172-S214 PolarHBondContact N-OG 3.07Å; T172-S214 PolarHBondContact O-N 3.07Å; M212-S214 PolarHBondContact O-N 2.95Å
215	T	93	Very high	95.4	Very high	78 Å²	78	38.8 Å²	38.8	48%	0.479	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	133.1	167	-60.2	0	0	0	0	109.6	F211 M212 R213 Y217	F211-T215 CarbonylContact C-O 3.44Å; F211-T215 WeakPolarHBondContact CA-O 3.1Å; M212-T215 PolarHBondContact N-O 2.66Å; M212-T215 WeakPolarHBondContact O-CB 3.41Å; M212-T215 PolarHBondContact O-N 3.25Å; R213-T215 PolarHBondContact O-N 3.38Å; T215-Y217 HydrophobicContact CG2-CD2 4.49Å; T215-Y217 HydrophobicContact CG2-CE2 3.9Å; T215-Y217 WeakPolarHBondContact O-CD2 3.43Å; T215-Y217 WeakPolarHBondContact O-CE2 3.48Å
216	C	91.4	Very high	95.4	Very high	55 Å²	55	37.8 Å²	37.8	37%	0.372	20%	0.195	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88.1	138.3	178.8	-165	0	0	0	0	111.1	F211 V218	F211-C216 HydrophobicContact CD1-CB 4.03Å; F211-C216 HydrophobicContact CE1-CB 3.5Å; F211-C216 VanDerWaalsContact CE1-CB 3.5Å; F211-C216 HydrophobicContact CE2-CB 4.21Å; F211-C216 WeakPolarHBondContact CE2-SG 3.07Å; F211-C216 HydrophobicContact CZ-CB 3.6Å; F211-C216 WeakPolarHBondContact CZ-SG 3.27Å; C216-V218 WeakPolarHBondContact SG-CG2 3.31Å
217	Y	94.7	Very high	95.3	Very high	21 Å²	21	39.8 Å²	39.8	8%	0.082	20%	0.204	C	C	.	.			trans	-116.2	-2.7	-179.1	-71.9	-98.4	0	0	0	113.4	I209 I210 M212 T215 D219 L220 R225 W228	I209-Y217 HydrophobicContact CD1-CD1 4.41Å; I209-Y217 HydrophobicContact CD1-CD2 3.88Å; I209-Y217 HydrophobicContact CD1-CE2 4Å; I209-Y217 HydrophobicContact CD1-CG 4.11Å; I209-Y217 HydrophobicContact CG1-CD2 4Å; I209-Y217 HydrophobicContact CG1-CG 4.11Å; I209-Y217 HydrophobicContact CG2-CG 4.33Å; I210-Y217 PolarHBondContact O-N 2.92Å; M212-Y217 HydrophobicContact CB-CE2 3.83Å; T215-Y217 HydrophobicContact CG2-CD2 4.49Å; T215-Y217 HydrophobicContact CG2-CE2 3.9Å; T215-Y217 WeakPolarHBondContact O-CD2 3.43Å; T215-Y217 WeakPolarHBondContact O-CE2 3.48Å; Y217-D219 VanDerWaalsContact C-N 3.28Å; Y217-D219 PolarHBondContact O-N 2.76Å; Y217-L220 HydrophobicContact CD1-CD1 3.82Å; Y217-L220 HydrophobicContact CE1-CD1 4.48Å; Y217-L220 WeakPolarHBondContact O-CB 3.22Å; Y217-L220 PolarHBondContact O-N 3.1Å; Y217-L220 VanDerWaalsContact O-N 3.1Å; Y217-R225 WeakPolarHBondContact O-CD 3.46Å; Y217-W228 HydrophobicContact CD1-CB 4.38Å; Y217-W228 HydrophobicContact CD1-CG 4.1Å; Y217-W228 HydrophobicContact CE1-CB 4.11Å; Y217-W228 AromaticContact CE1-CD1 3.96Å; Y217-W228 AromaticContact CE1-CD2 3.74Å; Y217-W228 HydrophobicContact CE1-CD2 3.74Å; Y217-W228 HydrophobicContact CE1-CE3 4.18Å; Y217-W228 AromaticContact CE1-CG 3.67Å; Y217-W228 HydrophobicContact CE1-CG 3.67Å
218	V	91.4	Very high	95.4	Very high	29 Å²	29	44.2 Å²	44.2	18%	0.176	22%	0.221	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-31.7	-170.1	-55.3	0	0	0	0	113.9	I210 C216 L220 N284 Y285	I210-V218 HydrophobicContact CB-CG1 4.43Å; I210-V218 HydrophobicContact CG2-CG1 3.51Å; C216-V218 WeakPolarHBondContact SG-CG2 3.31Å; V218-L220 VanDerWaalsContact C-N 3.26Å; V218-L220 PolarHBondContact O-N 2.88Å; V218-N284 WeakPolarHBondContact O-CB 3.39Å; V218-N284 PolarHBondContact O-ND2 3.22Å; V218-Y285 HydrophobicContact CG1-CD1 4.26Å; V218-Y285 PolarHBondContact O-N 3.43Å
219	D	90.3	Very high	95.4	Very high	137 Å²	137	44.2 Å²	44.2	73%	0.733	22%	0.221	S	C	*	.	T	Hydrogen-bonded Turn	trans	-81.2	-2.7	-179.2	-63.7	-42	0	0	0	113.4	Y217 N284	Y217-D219 VanDerWaalsContact C-N 3.28Å; Y217-D219 PolarHBondContact O-N 2.76Å; D219-N284 VanDerWaalsContact CA-ND2 3.34Å; D219-N284 WeakPolarHBondContact CA-ND2 3.49Å; D219-N284 PolarHBondContact O-ND2 2.7Å
220	L	95.1	Very high	95.4	Very high	48 Å²	48	46 Å²	46	25%	0.251	23%	0.229	S	C	.	.	S	Bend	trans	-85.5	148.8	171.1	-58.9	-177.3	0	0	0	111.2	Y217 V218 E224 R225 N284	Y217-L220 HydrophobicContact CD1-CD1 3.82Å; Y217-L220 HydrophobicContact CE1-CD1 4.48Å; Y217-L220 WeakPolarHBondContact O-CB 3.22Å; Y217-L220 PolarHBondContact O-N 3.1Å; Y217-L220 VanDerWaalsContact O-N 3.1Å; V218-L220 VanDerWaalsContact C-N 3.26Å; V218-L220 PolarHBondContact O-N 2.88Å; L220-E224 HydrophobicContact CB-CB 4.26Å; L220-R225 HydrophobicContact CB-CG 3.91Å; L220-R225 PolarHBondContact O-NH1 2.94Å; L220-N284 PolarHBondContact O-ND2 2.87Å
221	P	97.1	Very high	95.6	Very high	27 Å²	27	51.6 Å²	51.6	18%	0.175	25%	0.254	C	S	.	.	B	Isolated β-bridge	trans	-52.5	149.3	165.2	-30.6	38.9	0	0	0	113.7	Y223 E224 R225	P221-Y223 PolarHBondContact O-N 2.87Å; P221-E224 HydrophobicContact CB-CG 4.36Å; P221-E224 HydrophobicContact CG-CG 4.44Å; P221-E224 PolarHBondContact O-N 2.81Å; P221-E224 VanDerWaalsContact O-N 3.07Å; P221-R225 WeakPolarHBondContact O-CG 3.41Å; P221-R225 PolarHBondContact O-N 2.89Å
222	F	98.5	Very high	95.8	Very high	0 Å²	0	56.2 Å²	56.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-56.4	-38.1	176.8	172.8	-98.2	0	0	0	112.9	R120 K122 E224 R225 S226 Y279 K281 V283	R120-F222 HydrophobicContact CB-CD1 4.32Å; R120-F222 HydrophobicContact CB-CE1 3.85Å; K122-F222 HydrophobicContact CD-CZ 4.29Å; K122-F222 HydrophobicContact CG-CZ 4.43Å; F222-E224 PolarHBondContact O-N 3Å; F222-R225 PolarHBondContact O-N 2.97Å; F222-S226 WeakPolarHBondContact CE1-OG 3.37Å; F222-S226 VanDerWaalsContact CZ-OG 3.25Å; F222-S226 WeakPolarHBondContact CZ-OG 3.43Å; F222-S226 WeakPolarHBondContact O-CB 3.24Å; F222-S226 PolarHBondContact O-N 2.62Å; F222-S226 PolarHBondContact O-OG 2.98Å; F222-Y279 HydrophobicContact CB-CD1 4.49Å; F222-Y279 HydrophobicContact CD1-CD1 4.25Å; F222-Y279 HydrophobicContact CD1-CD2 4.47Å; F222-Y279 AromaticContact CD1-CG 3.82Å; F222-Y279 HydrophobicContact CD1-CG 3.82Å; F222-Y279 AromaticContact CD2-CD1 3.42Å; F222-Y279 HydrophobicContact CD2-CD1 3.42Å; F222-Y279 VanDerWaalsContact CD2-CD1 3.42Å; F222-Y279 HydrophobicContact CD2-CD2 4.36Å; F222-Y279 AromaticContact CD2-CE1 3.83Å; F222-Y279 HydrophobicContact CD2-CE1 3.83Å; F222-Y279 AromaticContact CD2-CG 3.74Å; F222-Y279 HydrophobicContact CD2-CG 3.74Å; F222-Y279 VanDerWaalsContact CE1-CB 3.48Å; F222-Y279 HydrophobicContact CE1-CD1 4.36Å; F222-Y279 AromaticContact CE1-CD2 3.85Å; F222-Y279 HydrophobicContact CE1-CD2 3.85Å; F222-Y279 AromaticContact CE1-CG 3.66Å; F222-Y279 HydrophobicContact CE1-CG 3.66Å; F222-Y279 AromaticContact CE2-CD1 3.53Å; F222-Y279 HydrophobicContact CE2-CD1 3.53Å; F222-Y279 AromaticContact CE2-CD2 3.7Å; F222-Y279 HydrophobicContact CE2-CD2 3.7Å; F222-Y279 AromaticContact CE2-CE1 3.7Å; F222-Y279 HydrophobicContact CE2-CE1 3.7Å; F222-Y279 AromaticContact CE2-CE2 3.83Å; F222-Y279 HydrophobicContact CE2-CE2 3.83Å; F222-Y279 AromaticContact CE2-CG 3.55Å; F222-Y279 HydrophobicContact CE2-CG 3.55Å; F222-Y279 AromaticContact CE2-CZ 3.84Å; F222-Y279 AromaticContact CG-CD1 3.78Å; F222-Y279 HydrophobicContact CG-CD1 3.78Å; F222-Y279 AromaticContact CG-CG 3.85Å; F222-Y279 HydrophobicContact CG-CG 3.85Å; F222-Y279 HydrophobicContact CZ-CD1 4Å; F222-Y279 AromaticContact CZ-CD2 3.39Å; F222-Y279 HydrophobicContact CZ-CD2 3.39Å; F222-Y279 HydrophobicContact CZ-CE1 4.4Å; F222-Y279 AromaticContact CZ-CE2 3.82Å; F222-Y279 HydrophobicContact CZ-CE2 3.82Å; F222-Y279 AromaticContact CZ-CG 3.49Å; F222-Y279 HydrophobicContact CZ-CG 3.49Å; F222-Y279 VanDerWaalsContact CZ-CG 3.49Å; F222-K281 PolarHBondContact N-O 3.17Å; F222-V283 HydrophobicContact CB-CG1 3.71Å; F222-V283 HydrophobicContact CG-CG1 4.49Å; F222-V283 PolarHBondContact N-O 2.78Å
223	Y	98.2	Very high	95.9	Very high	100 Å²	100	56.5 Å²	56.5	39%	0.392	27%	0.273	S	S	.	.	H	α-helix	trans	-56.4	-51	174.7	170.7	-113.7	0	0	0	111.2	P221 S226 Q227 K281	P221-Y223 PolarHBondContact O-N 2.87Å; Y223-S226 WeakPolarHBondContact O-CB 3Å; Y223-S226 PolarHBondContact O-N 3.35Å; Y223-Q227 HydrophobicContact CD2-CG 4.24Å; Y223-Q227 HydrophobicContact CE1-CG 4.2Å; Y223-Q227 HydrophobicContact CE2-CG 3.87Å; Y223-Q227 WeakPolarHBondContact O-CG 3.35Å; Y223-Q227 PolarHBondContact O-N 2.94Å; Y223-K281 PolarHBondContact N-O 3.01Å
224	E	98.3	Very high	96.1	Very high	81 Å²	81	55.8 Å²	55.8	38%	0.379	27%	0.273	S	S	.	.	H	α-helix	trans	-64.7	-42.9	179.4	-67.6	-179.4	-148.9	0	0	111.8	L220 P221 F222 S226 Q227 W228	L220-E224 HydrophobicContact CB-CB 4.26Å; P221-E224 HydrophobicContact CB-CG 4.36Å; P221-E224 HydrophobicContact CG-CG 4.44Å; P221-E224 PolarHBondContact O-N 2.81Å; P221-E224 VanDerWaalsContact O-N 3.07Å; F222-E224 PolarHBondContact O-N 3Å; E224-S226 VanDerWaalsContact C-N 3.27Å; E224-S226 PolarHBondContact O-N 2.93Å; E224-Q227 WeakPolarHBondContact O-CB 3.27Å; E224-Q227 PolarHBondContact O-N 3.33Å; E224-Q227 VanDerWaalsContact O-N 3.14Å; E224-W228 PolarHBondContact O-N 3.23Å
225	R	98.2	Very high	96.4	Very high	0 Å²	0	61.5 Å²	61.5	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-58.2	-40.6	174.6	-66.2	-163	-49.5	-85.5	5.7	112.1	D208 I209 Y217 L220 P221 F222 W228 L229 V283	D208-R225 IonicContact OD1-CZ 2.78Å; D208-R225 IonicContact OD1-NE 2.72Å; D208-R225 PolarHBondContact OD1-NE 2.89Å; D208-R225 IonicContact OD1-NH2 2.95Å; D208-R225 IonicContact OD2-CZ 3.01Å; D208-R225 VanDerWaalsContact OD2-CZ 3.31Å; D208-R225 IonicContact OD2-NE 3.86Å; D208-R225 PolarHBondContact OD2-NE 3.2Å; D208-R225 VanDerWaalsContact OD2-NE 3.1Å; D208-R225 IonicContact OD2-NH2 3.7Å; D208-R225 PolarHBondContact OD2-NH2 2.93Å; I209-R225 HydrophobicContact CG2-CB 3.84Å; I209-R225 HydrophobicContact CG2-CG 4.28Å; Y217-R225 WeakPolarHBondContact O-CD 3.46Å; L220-R225 HydrophobicContact CB-CG 3.91Å; L220-R225 PolarHBondContact O-NH1 2.94Å; P221-R225 WeakPolarHBondContact O-CG 3.41Å; P221-R225 PolarHBondContact O-N 2.89Å; F222-R225 PolarHBondContact O-N 2.97Å; R225-W228 WeakPolarHBondContact O-CB 3.41Å; R225-W228 PolarHBondContact O-N 3.2Å; R225-L229 PolarHBondContact O-N 2.76Å; R225-V283 PolarHBondContact NH1-O 3.45Å; R225-V283 PolarHBondContact NH2-O 2.96Å
226	S	98.4	Very high	96.5	Very high	0 Å²	0	60.5 Å²	60.5	0%	0	28%	0.283	C	S	.	.	H	α-helix	trans	-66	-42	174.9	-61.5	0	0	0	0	111.9	F222 Y223 E224 W228 L229 E230	F222-S226 WeakPolarHBondContact CE1-OG 3.37Å; F222-S226 VanDerWaalsContact CZ-OG 3.25Å; F222-S226 WeakPolarHBondContact CZ-OG 3.43Å; F222-S226 WeakPolarHBondContact O-CB 3.24Å; F222-S226 PolarHBondContact O-N 2.62Å; F222-S226 PolarHBondContact O-OG 2.98Å; Y223-S226 WeakPolarHBondContact O-CB 3Å; Y223-S226 PolarHBondContact O-N 3.35Å; E224-S226 VanDerWaalsContact C-N 3.27Å; E224-S226 PolarHBondContact O-N 2.93Å; S226-W228 VanDerWaalsContact C-N 3.35Å; S226-W228 PolarHBondContact O-N 3.03Å; S226-L229 PolarHBondContact O-N 2.91Å; S226-E230 WeakPolarHBondContact O-CB 3.11Å; S226-E230 WeakPolarHBondContact O-CG 2.96Å; S226-E230 PolarHBondContact O-N 2.84Å
227	Q	98.4	Very high	96.8	Very high	42 Å²	42	58 Å²	58	20%	0.196	27%	0.266	C	S	.	.	H	α-helix	trans	-61.3	-42.3	173.8	-65.7	-54.2	-66.6	0	0	111.8	Y223 E224 E230 H231	Y223-Q227 HydrophobicContact CD2-CG 4.24Å; Y223-Q227 HydrophobicContact CE1-CG 4.2Å; Y223-Q227 HydrophobicContact CE2-CG 3.87Å; Y223-Q227 WeakPolarHBondContact O-CG 3.35Å; Y223-Q227 PolarHBondContact O-N 2.94Å; E224-Q227 WeakPolarHBondContact O-CB 3.27Å; E224-Q227 PolarHBondContact O-N 3.33Å; E224-Q227 VanDerWaalsContact O-N 3.14Å; Q227-E230 PolarHBondContact O-N 2.79Å; Q227-H231 WeakPolarHBondContact O-CB 3.31Å; Q227-H231 PolarHBondContact O-N 3.47Å; Q227-H231 PolarHBondContact OE1-CE1 3.03Å; Q227-H231 PolarHBondContact OE1-ND1 3.29Å
228	W	98.4	Very high	97	Very high	94 Å²	94	59.4 Å²	59.4	36%	0.356	27%	0.273	S	S	.	.	I	π-helix	trans	-57.9	-49.5	174.6	-84.4	109.8	0	0	0	112.2	Y217 E224 R225 S226 Y232 L233	Y217-W228 HydrophobicContact CD1-CB 4.38Å; Y217-W228 HydrophobicContact CD1-CG 4.1Å; Y217-W228 HydrophobicContact CE1-CB 4.11Å; Y217-W228 AromaticContact CE1-CD1 3.96Å; Y217-W228 AromaticContact CE1-CD2 3.74Å; Y217-W228 HydrophobicContact CE1-CD2 3.74Å; Y217-W228 HydrophobicContact CE1-CE3 4.18Å; Y217-W228 AromaticContact CE1-CG 3.67Å; Y217-W228 HydrophobicContact CE1-CG 3.67Å; E224-W228 PolarHBondContact O-N 3.23Å; R225-W228 WeakPolarHBondContact O-CB 3.41Å; R225-W228 PolarHBondContact O-N 3.2Å; S226-W228 VanDerWaalsContact C-N 3.35Å; S226-W228 PolarHBondContact O-N 3.03Å; W228-Y232 HydrophobicContact CD2-CD2 4.31Å; W228-Y232 AromaticContact CE3-CD2 3.96Å; W228-Y232 HydrophobicContact CE3-CD2 3.96Å; W228-Y232 AromaticContact CE3-CG 3.84Å; W228-Y232 HydrophobicContact CE3-CG 3.84Å; W228-Y232 HydrophobicContact CZ3-CD1 4.35Å; W228-Y232 HydrophobicContact CZ3-CD2 4.35Å; W228-Y232 AromaticContact CZ3-CG 3.93Å; W228-Y232 HydrophobicContact CZ3-CG 3.93Å; W228-Y232 PolarHBondContact O-N 3.44Å; W228-L233 HydrophobicContact CB-CD1 4.37Å; W228-L233 WeakPolarHBondContact O-CB 3.48Å; W228-L233 WeakPolarHBondContact O-CG 3.42Å; W228-L233 PolarHBondContact O-N 2.78Å
229	L	98.2	Very high	97.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	29%	0.286	C	S	.	.	I	π-helix	trans	-57.3	-54.9	176.2	-81.1	175	0	0	0	111.5	V206 I209 R225 S226 K234 I237 I250	V206-L229 HydrophobicContact CG1-CD1 4.33Å; V206-L229 HydrophobicContact CG1-CD2 4.01Å; I209-L229 HydrophobicContact CB-CD1 4.22Å; I209-L229 HydrophobicContact CB-CD2 3.86Å; I209-L229 HydrophobicContact CB-CG 3.95Å; I209-L229 HydrophobicContact CD1-CD2 4.32Å; I209-L229 HydrophobicContact CG2-CD1 4.17Å; I209-L229 HydrophobicContact CG2-CD2 4.32Å; I209-L229 HydrophobicContact CG2-CG 3.86Å; R225-L229 PolarHBondContact O-N 2.76Å; S226-L229 PolarHBondContact O-N 2.91Å; L229-K234 WeakPolarHBondContact O-CA 3.36Å; L229-K234 WeakPolarHBondContact O-CB 3.14Å; L229-K234 PolarHBondContact O-N 2.78Å; L229-I237 HydrophobicContact CD2-CD1 3.48Å; L229-I237 VanDerWaalsContact CD2-CD1 3.48Å; L229-I250 HydrophobicContact CB-CD1 4.16Å; L229-I250 HydrophobicContact CB-CG2 4.02Å; L229-I250 HydrophobicContact CD2-CD1 4.07Å; L229-I250 HydrophobicContact CD2-CG1 4.39Å; L229-I250 WeakPolarHBondContact O-CD1 3.41Å
230	E	97.5	Very high	97.6	Very high	38 Å²	38	60.3 Å²	60.3	18%	0.178	27%	0.268	C	S	.	.	I	π-helix	trans	-75.8	-38.3	-167.7	-69.7	171.7	-147.4	0	0	113.7	S226 Q227 K234 I250 S253	S226-E230 WeakPolarHBondContact O-CB 3.11Å; S226-E230 WeakPolarHBondContact O-CG 2.96Å; S226-E230 PolarHBondContact O-N 2.84Å; Q227-E230 PolarHBondContact O-N 2.79Å; E230-K234 WeakPolarHBondContact O-CB 3.49Å; E230-I250 HydrophobicContact CG-CG2 4.1Å; E230-S253 WeakPolarHBondContact OE1-CA 3.37Å; E230-S253 WeakPolarHBondContact OE1-CB 3.43Å; E230-S253 PolarHBondContact OE1-N 2.96Å
231	H	97.3	Very high	97.5	Very high	124 Å²	124	62 Å²	62	57%	0.574	28%	0.278	S	S	*	.	I	π-helix	trans	-105.4	-25.9	-170.5	-60	112	0	0	0	114.3	Q227	Q227-H231 WeakPolarHBondContact O-CB 3.31Å; Q227-H231 PolarHBondContact O-N 3.47Å; Q227-H231 PolarHBondContact OE1-CE1 3.03Å; Q227-H231 PolarHBondContact OE1-ND1 3.29Å
232	Y	97.4	Very high	97.3	Very high	149 Å²	149	70.1 Å²	70.1	58%	0.584	31%	0.313	S	S	*	.	I	π-helix	trans	-115.9	-30.5	-171.4	-60.5	-82.7	0	0	0	113.6	W228	W228-Y232 HydrophobicContact CD2-CD2 4.31Å; W228-Y232 AromaticContact CE3-CD2 3.96Å; W228-Y232 HydrophobicContact CE3-CD2 3.96Å; W228-Y232 AromaticContact CE3-CG 3.84Å; W228-Y232 HydrophobicContact CE3-CG 3.84Å; W228-Y232 HydrophobicContact CZ3-CD1 4.35Å; W228-Y232 HydrophobicContact CZ3-CD2 4.35Å; W228-Y232 AromaticContact CZ3-CG 3.93Å; W228-Y232 HydrophobicContact CZ3-CG 3.93Å; W228-Y232 PolarHBondContact O-N 3.44Å
233	L	97.6	Very high	96.9	Very high	10 Å²	10	72.6 Å²	72.6	5%	0.052	34%	0.339	C	S	.	.	I	π-helix	trans	-111.8	-12.5	-173.8	-60.4	176.4	0	0	0	113.6	I209 M212 W228 Q235 Q236 I237	I209-L233 HydrophobicContact CD1-CD1 3.21Å; M212-L233 HydrophobicContact CB-CD1 4.19Å; M212-L233 HydrophobicContact CE-CD2 4.38Å; M212-L233 HydrophobicContact CG-CD1 4.02Å; M212-L233 HydrophobicContact CG-CD2 3.96Å; W228-L233 HydrophobicContact CB-CD1 4.37Å; W228-L233 WeakPolarHBondContact O-CB 3.48Å; W228-L233 WeakPolarHBondContact O-CG 3.42Å; W228-L233 PolarHBondContact O-N 2.78Å; L233-Q235 PolarHBondContact O-N 3.4Å; L233-Q236 PolarHBondContact O-N 3.46Å; L233-I237 HydrophobicContact CB-CD1 3.79Å; L233-I237 HydrophobicContact CB-CG1 4.35Å; L233-I237 PolarHBondContact O-N 2.92Å
234	K	98	Very high	96.7	Very high	84 Å²	84	68.5 Å²	68.5	37%	0.365	32%	0.324	S	S	.	.	H	α-helix	trans	-50.4	-52.5	-175.3	-174	174	-179.7	68.4	0	113.6	L229 E230 Q236 I237 E238 I250	L229-K234 WeakPolarHBondContact O-CA 3.36Å; L229-K234 WeakPolarHBondContact O-CB 3.14Å; L229-K234 PolarHBondContact O-N 2.78Å; E230-K234 WeakPolarHBondContact O-CB 3.49Å; K234-Q236 PolarHBondContact O-N 3.15Å; K234-I237 PolarHBondContact O-N 2.83Å; K234-E238 WeakPolarHBondContact CE-OE2 3.48Å; K234-E238 HydrophobicContact CG-CG 4.18Å; K234-E238 WeakPolarHBondContact CG-OE2 3.22Å; K234-E238 IonicContact NZ-OE1 2.69Å; K234-E238 PolarHBondContact NZ-OE1 3.46Å; K234-E238 IonicContact NZ-OE2 3.58Å; K234-E238 PolarHBondContact NZ-OE2 2.59Å; K234-E238 WeakPolarHBondContact O-CB 3.5Å; K234-E238 WeakPolarHBondContact O-CG 3.34Å; K234-E238 PolarHBondContact O-N 3.5Å; K234-I250 HydrophobicContact CB-CD1 4.02Å; K234-I250 HydrophobicContact CG-CD1 4.2Å
235	Q	96.9	Very high	96.5	Very high	174 Å²	174	65.7 Å²	65.7	81%	0.813	31%	0.312	S	S	*	.	H	α-helix	trans	-57.1	-36.4	-179.7	-176.2	-177.8	-4	0	0	112.8	L233 E239	L233-Q235 PolarHBondContact O-N 3.4Å; Q235-E239 PolarHBondContact O-N 3.36Å
236	Q	95.5	Very high	96.4	Very high	57 Å²	57	65.9 Å²	65.9	27%	0.266	31%	0.314	S	S	.	.	H	α-helix	trans	-84.7	-28.3	-176.1	-60.3	170.4	21.4	0	0	112.6	M212 R213 L233 K234	M212-Q236 HydrophobicContact CE-CB 3.96Å; R213-Q236 VanDerWaalsContact NH1-CD 3.31Å; R213-Q236 VanDerWaalsContact NH2-OE1 3.14Å; L233-Q236 PolarHBondContact O-N 3.46Å; K234-Q236 PolarHBondContact O-N 3.15Å
237	I	98.2	Very high	96.3	Very high	2 Å²	2	66.2 Å²	66.2	1%	0.01	32%	0.316	C	S	.	.	H	α-helix	trans	-79.7	-43.9	177.9	-71	174.2	0	0	0	110	L156 L175 V206 M212 L229 L233 K234 E239 F248 I250	L156-I237 HydrophobicContact CD2-CB 4.38Å; L156-I237 HydrophobicContact CD2-CG1 4.27Å; L156-I237 HydrophobicContact CD2-CG2 4.3Å; L175-I237 HydrophobicContact CD2-CD1 4.44Å; V206-I237 HydrophobicContact CG2-CG2 3.88Å; M212-I237 HydrophobicContact CE-CG1 3.86Å; L229-I237 HydrophobicContact CD2-CD1 3.48Å; L229-I237 VanDerWaalsContact CD2-CD1 3.48Å; L233-I237 HydrophobicContact CB-CD1 3.79Å; L233-I237 HydrophobicContact CB-CG1 4.35Å; L233-I237 PolarHBondContact O-N 2.92Å; K234-I237 PolarHBondContact O-N 2.83Å; I237-E239 VanDerWaalsContact C-N 3.34Å; I237-F248 HydrophobicContact CG2-CB 3.97Å; I237-F248 WeakPolarHBondContact O-CB 3.34Å; I237-I250 HydrophobicContact CB-CD1 4.1Å; I237-I250 HydrophobicContact CB-CG1 4.5Å; I237-I250 HydrophobicContact CD1-CD1 4.04Å; I237-I250 HydrophobicContact CG2-CD1 4.06Å; I237-I250 HydrophobicContact CG2-CG1 3.92Å
238	E	98.1	Very high	96.3	Very high	51 Å²	51	64.4 Å²	64.4	24%	0.238	31%	0.308	C	S	.	.	S	Bend	trans	-89.5	6.1	-176.6	-55.2	-172.7	163.5	0	0	113.5	K234 Y240 F248 I250	K234-E238 WeakPolarHBondContact CE-OE2 3.48Å; K234-E238 HydrophobicContact CG-CG 4.18Å; K234-E238 WeakPolarHBondContact CG-OE2 3.22Å; K234-E238 IonicContact NZ-OE1 2.69Å; K234-E238 PolarHBondContact NZ-OE1 3.46Å; K234-E238 IonicContact NZ-OE2 3.58Å; K234-E238 PolarHBondContact NZ-OE2 2.59Å; K234-E238 WeakPolarHBondContact O-CB 3.5Å; K234-E238 WeakPolarHBondContact O-CG 3.34Å; K234-E238 PolarHBondContact O-N 3.5Å; E238-Y240 PolarHBondContact O-N 2.81Å; E238-F248 WeakPolarHBondContact CG-O 3.45Å; E238-I250 HydrophobicContact CG-CG1 4.34Å; E238-I250 WeakPolarHBondContact OE1-CB 3.13Å; E238-I250 PolarHBondContact OE1-N 3.28Å
239	E	97.2	Very high	96.3	Very high	93 Å²	93	63.5 Å²	63.5	44%	0.435	31%	0.307	S	S	.	.			trans	-58.2	125.9	173.5	-164	-169.6	142.2	0	0	109.7	R155 Q235 I237	R155-E239 HydrophobicContact CB-CB 4.31Å; R155-E239 WeakPolarHBondContact CD-O 3.34Å; R155-E239 WeakPolarHBondContact CD-OE1 3.32Å; R155-E239 IonicContact CZ-OE1 3.86Å; R155-E239 IonicContact NE-OE1 3.71Å; R155-E239 IonicContact NH1-OE1 3.32Å; R155-E239 PolarHBondContact NH1-OE1 2.99Å; Q235-E239 PolarHBondContact O-N 3.36Å; I237-E239 VanDerWaalsContact C-N 3.34Å
240	Y	96.1	Very high	96.3	Very high	92 Å²	92	64 Å²	64	36%	0.361	31%	0.31	S	S	.	.			trans	-152.6	136.8	-175.7	175	-96.3	0	0	0	110.7	T201 E238 D244 A247	T201-Y240 HydrophobicContact CG2-CE2 3.7Å; T201-Y240 PolarHBondContact OG1-OH 2.92Å; E238-Y240 PolarHBondContact O-N 2.81Å; Y240-D244 HydrophobicContact CD2-CB 3.76Å; Y240-D244 HydrophobicContact CE2-CB 3.6Å; Y240-A247 HydrophobicContact CD2-CB 3.72Å; Y240-A247 HydrophobicContact CE2-CB 3.93Å; Y240-A247 HydrophobicContact CG-CB 4.36Å
241	N	94.9	Very high	96.3	Very high	85 Å²	85	62.2 Å²	62.2	46%	0.455	30%	0.301	S	S	.	.			trans	-116	152.8	169	-72.9	-11.1	0	0	0	110.6	R155 G243 D244	R155-N241 VanDerWaalsContact CZ-ND2 3.28Å; R155-N241 PolarHBondContact NH2-ND2 3.26Å; N241-G243 PolarHBondContact O-N 2.81Å; N241-D244 PolarHBondContact N-OD2 2.9Å; N241-D244 WeakPolarHBondContact O-CB 3.25Å; N241-D244 VanDerWaalsContact O-CG 3.28Å; N241-D244 PolarHBondContact O-N 3.36Å
242	E	92.2	Very high	96.3	Very high	196 Å²	196	58.4 Å²	58.4	92%	0.916	29%	0.288	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.9	126.5	174.2	-170.8	175.5	-170.8	0	0	110.8
243	G	90	Very high	96.4	Very high	53 Å²	53	51.7 Å²	51.7	55%	0.546	26%	0.263	S	S	.	.	T	Hydrogen-bonded Turn	trans	94.7	-7.5	-176.4	0	0	0	0	0	114.7	N241	N241-G243 PolarHBondContact O-N 2.81Å
244	D	94.4	Very high	96.4	Very high	13 Å²	13	54.7 Å²	54.7	7%	0.07	27%	0.274	C	S	.	.			trans	-62.1	136.2	170	-69	-14.9	0	0	0	109.4	R155 L161 T201 Y240 N241 V246	R155-D244 WeakPolarHBondContact CD-OD2 3.23Å; R155-D244 IonicContact CZ-OD1 3.44Å; R155-D244 IonicContact CZ-OD2 2.68Å; R155-D244 IonicContact NE-OD1 2.76Å; R155-D244 IonicContact NE-OD2 3.58Å; R155-D244 PolarHBondContact NE-OD2 2.81Å; R155-D244 IonicContact NH2-OD1 3.3Å; R155-D244 PolarHBondContact NH2-OD1 3.04Å; R155-D244 IonicContact NH2-OD2 2.66Å; L161-D244 HydrophobicContact CD1-CB 4.19Å; T201-D244 WeakPolarHBondContact CG2-O 3.25Å; T201-D244 PolarHBondContact OG1-O 3.32Å; T201-D244 VanDerWaalsContact OG1-O 3.04Å; Y240-D244 HydrophobicContact CD2-CB 3.76Å; Y240-D244 HydrophobicContact CE2-CB 3.6Å; N241-D244 PolarHBondContact N-OD2 2.9Å; N241-D244 WeakPolarHBondContact O-CB 3.25Å; N241-D244 VanDerWaalsContact O-CG 3.28Å; N241-D244 PolarHBondContact O-N 3.36Å; D244-V246 PolarHBondContact O-N 2.95Å
245	P	93.8	Very high	96.4	Very high	22 Å²	22	54.4 Å²	54.4	14%	0.143	27%	0.274	C	S	.	.	S	Bend	trans	-75.3	-11.2	-174.7	31.7	-37	0	0	0	112.9	S152 V153 F202	S152-P245 WeakPolarHBondContact OG-CB 3.38Å; S152-P245 WeakPolarHBondContact OG-CG 3.37Å; V153-P245 HydrophobicContact CG2-CG 3.92Å; V153-P245 WeakPolarHBondContact O-CG 3.44Å; F202-P245 WeakPolarHBondContact CD2-O 3.12Å; F202-P245 PolarHBondContact N-O 3.28Å
246	V	95.1	Very high	96.4	Very high	5 Å²	5	46.1 Å²	46.1	3%	0.03	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-141.4	133.4	-176	-179.7	0	0	0	0	110.4	F202 F204 D244 F248	F202-V246 HydrophobicContact CB-CG2 4.36Å; F202-V246 HydrophobicContact CD2-CG2 4.39Å; F202-V246 CarbonylContact O-C 3.56Å; F202-V246 WeakPolarHBondContact O-CA 3.15Å; F204-V246 HydrophobicContact CD2-CG1 3.42Å; F204-V246 VanDerWaalsContact CD2-CG1 3.42Å; F204-V246 HydrophobicContact CE2-CB 4.45Å; F204-V246 HydrophobicContact CE2-CG1 3.41Å; F204-V246 VanDerWaalsContact CE2-CG1 3.41Å; F204-V246 HydrophobicContact CE2-CG2 4.26Å; D244-V246 PolarHBondContact O-N 2.95Å; V246-F248 HydrophobicContact CB-CE2 4.42Å; V246-F248 HydrophobicContact CG1-CD2 4.09Å; V246-F248 HydrophobicContact CG1-CE1 4.33Å; V246-F248 HydrophobicContact CG1-CE2 3.4Å; V246-F248 VanDerWaalsContact CG1-CE2 3.4Å; V246-F248 HydrophobicContact CG1-CZ 3.54Å
247	A	97	Very high	96.5	Very high	6 Å²	6	45.7 Å²	45.7	5%	0.05	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119	144.2	170.9	0	0	0	0	0	110.6	T201 F202 F204 Y240	T201-A247 HydrophobicContact CG2-CB 3.88Å; F202-A247 PolarHBondContact O-N 2.91Å; F204-A247 PolarHBondContact N-O 3.39Å; Y240-A247 HydrophobicContact CD2-CB 3.72Å; Y240-A247 HydrophobicContact CE2-CB 3.93Å; Y240-A247 HydrophobicContact CG-CB 4.36Å
248	F	98.5	Very high	96.4	Very high	5 Å²	5	50.2 Å²	50.2	2%	0.022	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	139.9	175.4	-64.4	-86.5	0	0	0	110.5	I132 T139 L156 L175 F204 V206 I237 E238 V246	I132-F248 HydrophobicContact CG1-CE1 4.22Å; I132-F248 HydrophobicContact CG2-CE1 4.1Å; I132-F248 HydrophobicContact CG2-CZ 4.13Å; T139-F248 HydrophobicContact CG2-CZ 4.26Å; L156-F248 HydrophobicContact CD1-CD2 4.19Å; L156-F248 HydrophobicContact CD1-CE1 3.95Å; L156-F248 HydrophobicContact CD1-CE2 3.56Å; L156-F248 HydrophobicContact CD1-CZ 3.44Å; L156-F248 VanDerWaalsContact CD1-CZ 3.44Å; L156-F248 HydrophobicContact CD2-CD2 4.16Å; L156-F248 HydrophobicContact CD2-CE2 4.3Å; L156-F248 HydrophobicContact CG-CD2 4.03Å; L156-F248 HydrophobicContact CG-CE2 3.67Å; L156-F248 HydrophobicContact CG-CZ 4.1Å; L175-F248 HydrophobicContact CD1-CD1 4.46Å; F204-F248 HydrophobicContact CB-CD1 3.61Å; F204-F248 HydrophobicContact CB-CE1 3.72Å; F204-F248 HydrophobicContact CD2-CD1 4.39Å; F204-F248 AromaticContact CD2-CE1 3.88Å; F204-F248 HydrophobicContact CD2-CE1 3.88Å; F204-F248 HydrophobicContact CD2-CZ 4.17Å; F204-F248 HydrophobicContact CG-CD1 4.3Å; F204-F248 AromaticContact CG-CE1 3.92Å; F204-F248 HydrophobicContact CG-CE1 3.92Å; F204-F248 CarbonylContact O-C 3.51Å; F204-F248 VanDerWaalsContact O-CA 3.3Å; F204-F248 WeakPolarHBondContact O-CA 3.17Å; V206-F248 HydrophobicContact CG2-CB 4.17Å; V206-F248 HydrophobicContact CG2-CD1 4.04Å; I237-F248 HydrophobicContact CG2-CB 3.97Å; I237-F248 WeakPolarHBondContact O-CB 3.34Å; E238-F248 WeakPolarHBondContact CG-O 3.45Å; V246-F248 HydrophobicContact CB-CE2 4.42Å; V246-F248 HydrophobicContact CG1-CD2 4.09Å; V246-F248 HydrophobicContact CG1-CE1 4.33Å; V246-F248 HydrophobicContact CG1-CE2 3.4Å; V246-F248 VanDerWaalsContact CG1-CE2 3.4Å; V246-F248 HydrophobicContact CG1-CZ 3.54Å
249	H	98.4	Very high	96.3	Very high	75 Å²	75	49.5 Å²	49.5	35%	0.347	27%	0.269	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.2	121.2	173.3	-59.9	-57	0	0	0	109.6	F204 Y205 V206 L251	F204-H249 PolarHBondContact O-N 3.1Å; Y205-H249 CarbonylContact C-O 3.58Å; Y205-H249 WeakPolarHBondContact CA-O 3.24Å; Y205-H249 HydrophobicContact CD1-CB 3.78Å; Y205-H249 HydrophobicContact CE1-CB 3.78Å; V206-H249 PolarHBondContact N-O 2.8Å; H249-L251 PolarHBondContact O-N 3.34Å
250	I	98.5	Very high	96.3	Very high	9 Å²	9	46.8 Å²	46.8	5%	0.046	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.8	128	177	-66.8	171.2	0	0	0	109.3	V206 L229 E230 K234 I237 E238	V206-I250 HydrophobicContact CB-CG1 4.05Å; V206-I250 HydrophobicContact CG2-CG1 4.33Å; L229-I250 HydrophobicContact CB-CD1 4.16Å; L229-I250 HydrophobicContact CB-CG2 4.02Å; L229-I250 HydrophobicContact CD2-CD1 4.07Å; L229-I250 HydrophobicContact CD2-CG1 4.39Å; L229-I250 WeakPolarHBondContact O-CD1 3.41Å; E230-I250 HydrophobicContact CG-CG2 4.1Å; K234-I250 HydrophobicContact CB-CD1 4.02Å; K234-I250 HydrophobicContact CG-CD1 4.2Å; I237-I250 HydrophobicContact CB-CD1 4.1Å; I237-I250 HydrophobicContact CB-CG1 4.5Å; I237-I250 HydrophobicContact CD1-CD1 4.04Å; I237-I250 HydrophobicContact CG2-CD1 4.06Å; I237-I250 HydrophobicContact CG2-CG1 3.92Å; E238-I250 HydrophobicContact CG-CG1 4.34Å; E238-I250 WeakPolarHBondContact OE1-CB 3.13Å; E238-I250 PolarHBondContact OE1-N 3.28Å
251	L	98.2	Very high	96.3	Very high	1 Å²	1	42.8 Å²	42.8	1%	0.005	25%	0.245	C	C	.	.	P	Polyproline II helix	trans	-72.1	124.4	171.5	-68.3	177.7	0	0	0	109.8	K122 L123 I178 Y205 V206 V207 H249 Y271	K122-L251 HydrophobicContact CD-CB 4.01Å; K122-L251 WeakPolarHBondContact CE-O 3.37Å; K122-L251 PolarHBondContact NZ-O 3.37Å; L123-L251 WeakPolarHBondContact O-CD2 3.48Å; I178-L251 HydrophobicContact CD1-CD1 4.2Å; Y205-L251 HydrophobicContact CD1-CD2 3.55Å; Y205-L251 HydrophobicContact CD1-CG 4.31Å; Y205-L251 HydrophobicContact CE1-CD2 4.44Å; Y205-L251 HydrophobicContact CG-CD2 4.06Å; V206-L251 PolarHBondContact O-N 2.84Å; V207-L251 HydrophobicContact CG2-CD1 4.04Å; H249-L251 PolarHBondContact O-N 3.34Å; L251-Y271 HydrophobicContact CD2-CE1 4.13Å; L251-Y271 WeakPolarHBondContact CD2-OH 3.17Å
252	P	97.2	Very high	96.4	Very high	45 Å²	45	40.6 Å²	40.6	29%	0.292	23%	0.232	S	C	.	.	P	Polyproline II helix	trans	-65.1	144	176.4	26.9	-33.3	0	0	0	111.1	Y254	P252-Y254 HydrophobicContact CB-CE2 4.03Å; P252-Y254 HydrophobicContact CG-CE2 3.69Å; P252-Y254 WeakPolarHBondContact CG-OH 3.45Å
253	S	97.9	Very high	96.5	Very high	8 Å²	8	36.8 Å²	36.8	6%	0.056	22%	0.218	C	C	.	.	P	Polyproline II helix	trans	-101.5	117.7	174.9	-175.6	0	0	0	0	110.8	R120 M121 E230	R120-S253 PolarHBondContact NE-OG 3.48Å; R120-S253 PolarHBondContact NH2-O 2.87Å; M121-S253 WeakPolarHBondContact O-CA 3.41Å; E230-S253 WeakPolarHBondContact OE1-CA 3.37Å; E230-S253 WeakPolarHBondContact OE1-CB 3.43Å; E230-S253 PolarHBondContact OE1-N 2.96Å
254	Y	97.8	Very high	96.8	Very high	73 Å²	73	34.4 Å²	34.4	29%	0.286	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-98	150.3	177.4	-54.3	-85.9	0	0	0	110.8	R120 M121 L123 P252 A264	R120-Y254 CarbonylContact C-O 3.5Å; R120-Y254 WeakPolarHBondContact CA-O 3.33Å; R120-Y254 WeakPolarHBondContact CB-O 3.45Å; M121-Y254 HydrophobicContact CE-CD2 4.49Å; M121-Y254 HydrophobicContact CE-CG 4.3Å; M121-Y254 PolarHBondContact N-O 3.19Å; M121-Y254 PolarHBondContact O-N 3.09Å; L123-Y254 HydrophobicContact CG-CE2 4.41Å; P252-Y254 HydrophobicContact CB-CE2 4.03Å; P252-Y254 HydrophobicContact CG-CE2 3.69Å; P252-Y254 WeakPolarHBondContact CG-OH 3.45Å; Y254-A264 HydrophobicContact CD1-CB 3.99Å; Y254-A264 HydrophobicContact CD2-CB 4.21Å; Y254-A264 HydrophobicContact CE1-CB 4.22Å; Y254-A264 HydrophobicContact CE2-CB 4.43Å; Y254-A264 HydrophobicContact CG-CB 3.98Å
255	Q	97.8	Very high	96.9	Very high	77 Å²	77	33.8 Å²	33.8	36%	0.36	19%	0.189	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	152.4	166.3	-175.5	172	-13.4	0	0	109.9	G116 D257 S260	G116-Q255 PolarHBondContact O-NE2 3.25Å; Q255-D257 VanDerWaalsContact C-N 3.33Å; Q255-D257 WeakPolarHBondContact CB-OD2 3.21Å; Q255-D257 VanDerWaalsContact CD-OD2 3.31Å; Q255-D257 HydrophobicContact CG-CB 4.35Å; Q255-D257 VanDerWaalsContact CG-OD2 3.24Å; Q255-D257 WeakPolarHBondContact CG-OD2 3.44Å; Q255-S260 WeakPolarHBondContact O-CB 3.48Å
256	C	97.9	Very high	96.8	Very high	1 Å²	1	35.4 Å²	35.4	1%	0.007	20%	0.201	C	C	.	.			trans	-93.6	21.8	-179.6	-62.2	0	0	0	0	113.6	F115 G116 Y119 R120 M261	F115-C256 HydrophobicContact CD1-CB 3.98Å; F115-C256 HydrophobicContact CE1-CB 3.58Å; F115-C256 HydrophobicContact CZ-CB 3.98Å; G116-C256 VanDerWaalsContact CA-O 3.25Å; G116-C256 WeakPolarHBondContact CA-O 3.43Å; Y119-C256 WeakPolarHBondContact O-CB 3.41Å; Y119-C256 PolarHBondContact O-N 3.41Å; Y119-C256 VanDerWaalsContact O-N 3.17Å; Y119-C256 PolarHBondContact O-SG 3.25Å; Y119-C256 VanDerWaalsContact O-SG 3.37Å; R120-C256 VanDerWaalsContact C-SG 3.52Å; C256-M261 HydrophobicContact CB-SD 4.29Å; C256-M261 WeakPolarHBondContact O-CE 3.41Å
257	D	97	Very high	96.5	Very high	47 Å²	47	38 Å²	38	25%	0.251	22%	0.22	S	C	.	.	S	Bend	trans	-74.6	159.3	169.4	71.5	89.3	0	0	0	110.6	G116 Q255 G259 S260 M261	G116-D257 PolarHBondContact O-N 2.93Å; Q255-D257 VanDerWaalsContact C-N 3.33Å; Q255-D257 WeakPolarHBondContact CB-OD2 3.21Å; Q255-D257 VanDerWaalsContact CD-OD2 3.31Å; Q255-D257 HydrophobicContact CG-CB 4.35Å; Q255-D257 VanDerWaalsContact CG-OD2 3.24Å; Q255-D257 WeakPolarHBondContact CG-OD2 3.44Å; D257-G259 VanDerWaalsContact C-N 3.26Å; D257-G259 PolarHBondContact O-N 3.47Å; D257-G259 WeakPolarHBondContact OD1-CA 3.49Å; D257-G259 PolarHBondContact OD1-N 3.44Å; D257-S260 PolarHBondContact O-N 3.18Å; D257-S260 PolarHBondContact OD1-N 3.44Å; D257-S260 WeakPolarHBondContact OD2-CB 3.45Å; D257-S260 PolarHBondContact OD2-OG 3.46Å; D257-M261 WeakPolarHBondContact O-CB 3.31Å; D257-M261 WeakPolarHBondContact O-CG 3.2Å; D257-M261 PolarHBondContact O-N 3.25Å
258	V	95.7	Very high	96	Very high	97 Å²	97	42.2 Å²	42.2	59%	0.588	24%	0.241	S	C	*	.	H	α-helix	trans	-57.1	-39.3	-174.4	178.6	0	0	0	0	112.2	Q262	V258-Q262 WeakPolarHBondContact O-CB 3.2Å; V258-Q262 PolarHBondContact O-N 2.91Å
259	G	96.4	Very high	95.6	Very high	37 Å²	37	42.9 Å²	42.9	38%	0.381	25%	0.245	S	C	.	.	H	α-helix	trans	-67.5	-52.7	-179.5	0	0	0	0	0	111.7	D257 M261 Q262 D263	D257-G259 VanDerWaalsContact C-N 3.26Å; D257-G259 PolarHBondContact O-N 3.47Å; D257-G259 WeakPolarHBondContact OD1-CA 3.49Å; D257-G259 PolarHBondContact OD1-N 3.44Å; G259-M261 VanDerWaalsContact C-N 3.3Å; G259-M261 PolarHBondContact O-N 2.85Å; G259-Q262 WeakPolarHBondContact O-CB 3.49Å; G259-Q262 PolarHBondContact O-N 3.37Å; G259-D263 PolarHBondContact O-N 3Å
260	S	97	Very high	95.3	Very high	36 Å²	36	45.2 Å²	45.2	25%	0.252	27%	0.267	S	S	.	.	H	α-helix	trans	-59.7	-39.5	178	-63.7	0	0	0	0	112.7	Q255 D257 A264	Q255-S260 WeakPolarHBondContact O-CB 3.48Å; D257-S260 PolarHBondContact O-N 3.18Å; D257-S260 PolarHBondContact OD1-N 3.44Å; D257-S260 WeakPolarHBondContact OD2-CB 3.45Å; D257-S260 PolarHBondContact OD2-OG 3.46Å; S260-A264 VanDerWaalsContact O-CB 3.31Å; S260-A264 WeakPolarHBondContact O-CB 3.49Å; S260-A264 PolarHBondContact O-N 3.29Å
261	M	97.2	Very high	95.1	Very high	7 Å²	7	45.9 Å²	45.9	3%	0.034	27%	0.269	C	S	.	.	H	α-helix	trans	-69.5	-40.7	176.7	-68.4	-171.4	-64.6	0	0	112.4	F115 M121 C256 D257 G259 D263 A264 F265 F305 I308	F115-M261 HydrophobicContact CE1-SD 4.3Å; M121-M261 HydrophobicContact CE-CB 4.13Å; M121-M261 HydrophobicContact CE-CG 3.77Å; M121-M261 HydrophobicContact SD-CG 4.01Å; C256-M261 HydrophobicContact CB-SD 4.29Å; C256-M261 WeakPolarHBondContact O-CE 3.41Å; D257-M261 WeakPolarHBondContact O-CB 3.31Å; D257-M261 WeakPolarHBondContact O-CG 3.2Å; D257-M261 PolarHBondContact O-N 3.25Å; G259-M261 VanDerWaalsContact C-N 3.3Å; G259-M261 PolarHBondContact O-N 2.85Å; M261-D263 VanDerWaalsContact C-N 3.33Å; M261-D263 PolarHBondContact O-N 2.66Å; M261-A264 PolarHBondContact O-N 2.73Å; M261-F265 HydrophobicContact CB-CD2 4.15Å; M261-F265 HydrophobicContact CB-CE2 3.94Å; M261-F265 HydrophobicContact CG-CE2 4.27Å; M261-F265 WeakPolarHBondContact O-CB 3.39Å; M261-F265 VanDerWaalsContact O-CD2 3.27Å; M261-F265 WeakPolarHBondContact O-CD2 3.45Å; M261-F265 WeakPolarHBondContact O-CG 3.2Å; M261-F265 PolarHBondContact O-N 2.98Å; M261-F265 HydrophobicContact SD-CE2 4.38Å; M261-F305 HydrophobicContact CE-CD1 4.27Å; M261-F305 HydrophobicContact SD-CD1 4.4Å; M261-F305 HydrophobicContact SD-CE1 4.41Å; M261-I308 HydrophobicContact CB-CD1 3.7Å; M261-I308 HydrophobicContact CE-CD1 3.54Å; M261-I308 HydrophobicContact CG-CD1 4.45Å; M261-I308 HydrophobicContact SD-CD1 3.95Å
262	Q	95.9	Very high	94.8	Very high	39 Å²	39	49.4 Å²	49.4	18%	0.182	28%	0.284	C	S	.	.	H	α-helix	trans	-58	-47	175.4	-176.6	62.4	60.7	0	0	110.7	V258 G259 S266 I308 N309	V258-Q262 WeakPolarHBondContact O-CB 3.2Å; V258-Q262 PolarHBondContact O-N 2.91Å; G259-Q262 WeakPolarHBondContact O-CB 3.49Å; G259-Q262 PolarHBondContact O-N 3.37Å; Q262-S266 PolarHBondContact NE2-OG 3.37Å; Q262-S266 WeakPolarHBondContact O-CB 3.35Å; Q262-S266 PolarHBondContact O-N 3Å; Q262-S266 PolarHBondContact O-OG 2.84Å; Q262-I308 HydrophobicContact CB-CG2 4.43Å; Q262-N309 VanDerWaalsContact NE2-CB 3.31Å; Q262-N309 PolarHBondContact NE2-ND2 3.14Å; Q262-N309 PolarHBondContact NE2-O 3.34Å; Q262-N309 VanDerWaalsContact NE2-O 3.15Å; Q262-N309 PolarHBondContact OE1-ND2 3.36Å
263	D	95.4	Very high	94.6	Very high	117 Å²	117	48 Å²	48	63%	0.626	27%	0.274	S	S	*	.	H	α-helix	trans	-65.4	-45.2	179.5	-70.2	-17.6	0	0	0	112.1	G259 M261 S267	G259-D263 PolarHBondContact O-N 3Å; M261-D263 VanDerWaalsContact C-N 3.33Å; M261-D263 PolarHBondContact O-N 2.66Å; D263-S267 PolarHBondContact O-OG 3.48Å
264	A	95.6	Very high	94.4	Very high	2 Å²	2	48 Å²	48	2%	0.017	27%	0.274	C	S	.	.	H	α-helix	trans	-65.4	-42.4	-179.4	0	0	0	0	0	112.7	M121 Y254 S260 M261 S267	M121-A264 HydrophobicContact CE-CB 3.41Å; M121-A264 VanDerWaalsContact CE-CB 3.41Å; Y254-A264 HydrophobicContact CD1-CB 3.99Å; Y254-A264 HydrophobicContact CD2-CB 4.21Å; Y254-A264 HydrophobicContact CE1-CB 4.22Å; Y254-A264 HydrophobicContact CE2-CB 4.43Å; Y254-A264 HydrophobicContact CG-CB 3.98Å; S260-A264 VanDerWaalsContact O-CB 3.31Å; S260-A264 WeakPolarHBondContact O-CB 3.49Å; S260-A264 PolarHBondContact O-N 3.29Å; M261-A264 PolarHBondContact O-N 2.73Å; A264-S267 PolarHBondContact O-OG 3.01Å
265	F	95.7	Very high	94.3	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-84	-16.3	-177.7	-60.3	-34.7	0	0	0	114.2	M121 L123 M261 S267 V276 L301 I308 Y310 H311 F314	M121-F265 HydrophobicContact CE-CD1 4.49Å; M121-F265 HydrophobicContact CE-CE1 3.94Å; M121-F265 HydrophobicContact CE-CE2 4.35Å; M121-F265 HydrophobicContact CE-CZ 3.86Å; M121-F265 HydrophobicContact SD-CE1 3.79Å; M121-F265 HydrophobicContact SD-CE2 4.22Å; M121-F265 HydrophobicContact SD-CZ 3.41Å; M121-F265 WeakPolarHBondContact SD-CZ 2.84Å; L123-F265 HydrophobicContact CD2-CD1 3.85Å; L123-F265 HydrophobicContact CD2-CE1 3.56Å; M261-F265 HydrophobicContact CB-CD2 4.15Å; M261-F265 HydrophobicContact CB-CE2 3.94Å; M261-F265 HydrophobicContact CG-CE2 4.27Å; M261-F265 WeakPolarHBondContact O-CB 3.39Å; M261-F265 VanDerWaalsContact O-CD2 3.27Å; M261-F265 WeakPolarHBondContact O-CD2 3.45Å; M261-F265 WeakPolarHBondContact O-CG 3.2Å; M261-F265 PolarHBondContact O-N 2.98Å; M261-F265 HydrophobicContact SD-CE2 4.38Å; F265-S267 VanDerWaalsContact C-N 3.33Å; F265-V276 HydrophobicContact CE1-CG1 4.41Å; F265-V276 HydrophobicContact CE1-CG2 4.08Å; F265-L301 HydrophobicContact CD1-CD1 4.35Å; F265-L301 HydrophobicContact CE1-CD1 3.93Å; F265-L301 HydrophobicContact CE2-CD1 4.37Å; F265-L301 HydrophobicContact CZ-CD1 3.95Å; F265-L301 HydrophobicContact CZ-CD2 4.27Å; F265-I308 HydrophobicContact CD2-CD1 4.44Å; F265-I308 HydrophobicContact CD2-CG2 3.98Å; F265-I308 HydrophobicContact CE2-CD1 4.41Å; F265-Y310 HydrophobicContact CB-CD1 3.85Å; F265-Y310 HydrophobicContact CB-CE1 4.23Å; F265-Y310 HydrophobicContact CD2-CD1 4.04Å; F265-Y310 AromaticContact CD2-CE1 3.52Å; F265-Y310 HydrophobicContact CD2-CE1 3.52Å; F265-Y310 HydrophobicContact CE2-CE1 4.02Å; F265-Y310 HydrophobicContact CG-CD1 4.04Å; F265-Y310 AromaticContact CG-CE1 3.98Å; F265-Y310 HydrophobicContact CG-CE1 3.98Å; F265-H311 WeakPolarHBondContact O-CB 3.41Å; F265-H311 PolarHBondContact O-N 2.77Å; F265-F314 HydrophobicContact CB-CE1 4.4Å; F265-F314 HydrophobicContact CB-CZ 4.28Å; F265-F314 HydrophobicContact CD1-CD1 4.46Å; F265-F314 AromaticContact CD1-CE1 3.48Å; F265-F314 HydrophobicContact CD1-CE1 3.48Å; F265-F314 VanDerWaalsContact CD1-CE1 3.48Å; F265-F314 AromaticContact CD1-CZ 3.74Å; F265-F314 HydrophobicContact CD1-CZ 3.74Å; F265-F314 HydrophobicContact CE1-CE1 4.08Å; F265-F314 HydrophobicContact CG-CE1 4.21Å; F265-F314 HydrophobicContact CG-CZ 4.42Å
266	S	91.7	Very high	94.3	Very high	56 Å²	56	40.9 Å²	40.9	39%	0.392	24%	0.243	S	C	.	.	H	α-helix	trans	-79.9	-17.3	173.9	-58.3	0	0	0	0	113.1	Q262	Q262-S266 PolarHBondContact NE2-OG 3.37Å; Q262-S266 WeakPolarHBondContact O-CB 3.35Å; Q262-S266 PolarHBondContact O-N 3Å; Q262-S266 PolarHBondContact O-OG 2.84Å
267	S	89.8	Confident	94.3	Very high	60 Å²	60	41.5 Å²	41.5	42%	0.42	25%	0.246	S	C	.	.	S	Bend	trans	-103	151.4	-178.9	65.5	0	0	0	0	112	D263 A264 F265	D263-S267 PolarHBondContact O-OG 3.48Å; A264-S267 PolarHBondContact O-OG 3.01Å; F265-S267 VanDerWaalsContact C-N 3.33Å
268	I	87	Confident	94.4	Very high	95 Å²	95	39.2 Å²	39.2	49%	0.487	23%	0.234	S	C	.	.	P	Polyproline II helix	trans	-97.7	121	178.4	-47.1	171.9	0	0	0	108.5	H311	I268-H311 WeakPolarHBondContact CD1-CE1 3.37Å; I268-H311 VanDerWaalsContact CD1-NE2 3.33Å; I268-H311 WeakPolarHBondContact CD1-NE2 3.46Å; I268-H311 VanDerWaalsContact CG1-CE1 3.43Å; I268-H311 WeakPolarHBondContact CG1-CE1 3.44Å; I268-H311 WeakPolarHBondContact CG1-ND1 3.41Å
269	P	90.2	Very high	94.5	Very high	19 Å²	19	34.9 Å²	34.9	12%	0.123	21%	0.207	C	C	.	.	P	Polyproline II helix	trans	-69	160	171	27.4	-31.1	0	0	0	111.3	Y271 I273	P269-Y271 HydrophobicContact CB-CD1 4.17Å; P269-Y271 HydrophobicContact CB-CD2 4.05Å; P269-Y271 HydrophobicContact CB-CE1 3.8Å; P269-Y271 HydrophobicContact CB-CE2 3.67Å; P269-Y271 HydrophobicContact CB-CG 4.31Å; P269-Y271 HydrophobicContact CG-CD2 4.05Å; P269-Y271 HydrophobicContact CG-CE2 3.73Å; P269-Y271 PolarHBondContact O-N 2.91Å; P269-I273 HydrophobicContact CG-CD1 3.54Å; P269-I273 HydrophobicContact CG-CG1 3.41Å; P269-I273 VanDerWaalsContact CG-CG1 3.41Å
270	P	91.6	Very high	94.6	Very high	124 Å²	124	33.4 Å²	33.4	81%	0.805	19%	0.19	S	C	*	.	S	Bend	trans	-72.2	16.4	-177.6	31.3	-36.6	0	0	0	114.3
271	Y	93.6	Very high	94.7	Very high	22 Å²	22	34.4 Å²	34.4	9%	0.086	19%	0.19	C	C	.	.	S	Bend	trans	-144.2	157.5	-176.1	49.4	-102.9	0	0	0	110.3	L123 P125 Y205 L251 P269 I273	L123-Y271 PolarHBondContact O-OH 3.17Å; P125-Y271 HydrophobicContact CB-CD2 3.42Å; P125-Y271 VanDerWaalsContact CB-CD2 3.42Å; P125-Y271 HydrophobicContact CB-CE2 3.86Å; P125-Y271 HydrophobicContact CB-CG 3.78Å; P125-Y271 HydrophobicContact CG-CD2 4.45Å; Y205-Y271 HydrophobicContact CD1-CD1 4.26Å; Y205-Y271 HydrophobicContact CD1-CE1 4.06Å; Y205-Y271 AromaticContact CE1-CD1 3.38Å; Y205-Y271 HydrophobicContact CE1-CD1 3.38Å; Y205-Y271 AromaticContact CE1-CE1 3.5Å; Y205-Y271 HydrophobicContact CE1-CE1 3.5Å; Y205-Y271 HydrophobicContact CE1-CG 4.34Å; Y205-Y271 HydrophobicContact CE2-CD1 4.27Å; Y205-Y271 AromaticContact CZ-CD1 3.38Å; Y205-Y271 VanDerWaalsContact OH-CD1 3.31Å; Y205-Y271 WeakPolarHBondContact OH-CD1 3.39Å; L251-Y271 HydrophobicContact CD2-CE1 4.13Å; L251-Y271 WeakPolarHBondContact CD2-OH 3.17Å; P269-Y271 HydrophobicContact CB-CD1 4.17Å; P269-Y271 HydrophobicContact CB-CD2 4.05Å; P269-Y271 HydrophobicContact CB-CE1 3.8Å; P269-Y271 HydrophobicContact CB-CE2 3.67Å; P269-Y271 HydrophobicContact CB-CG 4.31Å; P269-Y271 HydrophobicContact CG-CD2 4.05Å; P269-Y271 HydrophobicContact CG-CE2 3.73Å; P269-Y271 PolarHBondContact O-N 2.91Å; Y271-I273 HydrophobicContact CE2-CG1 4.4Å; Y271-I273 PolarHBondContact O-N 3.34Å
272	K	92.5	Very high	94.7	Very high	75 Å²	75	36.4 Å²	36.4	33%	0.326	20%	0.201	S	C	.	.			trans	-69.9	123.6	172.7	-170.1	169.4	179.2	-179.4	0	109.6	P125 K126 Y180 D317	P125-K272 CarbonylContact C-O 3.09Å; P125-K272 WeakPolarHBondContact CA-O 3.33Å; K126-K272 HydrophobicContact CD-CD 3.84Å; K126-K272 HydrophobicContact CD-CG 3.98Å; K126-K272 HydrophobicContact CG-CB 4.28Å; K126-K272 HydrophobicContact CG-CD 4.43Å; K126-K272 HydrophobicContact CG-CG 4.04Å; K126-K272 PolarHBondContact N-O 2.87Å; Y180-K272 PolarHBondContact OH-N 2.95Å; K272-D317 WeakPolarHBondContact CE-OD1 3.23Å; K272-D317 WeakPolarHBondContact CE-OD2 3.35Å; K272-D317 IonicContact NZ-OD1 3.58Å; K272-D317 PolarHBondContact NZ-OD1 2.82Å; K272-D317 IonicContact NZ-OD2 3.2Å; K272-D317 PolarHBondContact NZ-OD2 2.9Å
273	I	93.7	Very high	94.7	Very high	16 Å²	16	34.6 Å²	34.6	8%	0.082	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72.2	140	178.4	-58.1	174.1	0	0	0	109.8	K126 P269 Y271 P298 F314	K126-I273 VanDerWaalsContact CE-O 3.31Å; K126-I273 WeakPolarHBondContact CE-O 3.35Å; P269-I273 HydrophobicContact CG-CD1 3.54Å; P269-I273 HydrophobicContact CG-CG1 3.41Å; P269-I273 VanDerWaalsContact CG-CG1 3.41Å; Y271-I273 HydrophobicContact CE2-CG1 4.4Å; Y271-I273 PolarHBondContact O-N 3.34Å; I273-P298 HydrophobicContact CB-CG 4.43Å; I273-P298 HydrophobicContact CG2-CG 3.62Å; I273-F314 HydrophobicContact CD1-CD2 4.22Å; I273-F314 HydrophobicContact CD1-CE1 3.94Å; I273-F314 HydrophobicContact CD1-CE2 3.53Å; I273-F314 HydrophobicContact CD1-CZ 3.36Å
274	D	93.3	Very high	94.7	Very high	9 Å²	9	30.8 Å²	30.8	5%	0.048	17%	0.172	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102	-33.3	168.1	-164.2	42.1	0	0	0	113.4	C124 K126 W295 K297 P298	C124-D274 PolarHBondContact O-N 3.47Å; K126-D274 HydrophobicContact CB-CB 4.47Å; K126-D274 HydrophobicContact CG-CB 3.85Å; D274-W295 HydrophobicContact CB-CH2 4.29Å; D274-W295 HydrophobicContact CB-CZ2 4.4Å; D274-K297 WeakPolarHBondContact O-CD 3.37Å; D274-K297 PolarHBondContact O-NZ 2.94Å; D274-K297 IonicContact OD1-NZ 3.36Å; D274-K297 PolarHBondContact OD1-NZ 3.32Å; D274-K297 IonicContact OD2-NZ 3.49Å; D274-K297 PolarHBondContact OD2-NZ 2.92Å; D274-P298 WeakPolarHBondContact O-CD 3.37Å
275	G	95.3	Very high	94.6	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	17%	0.174	C	C	.	.	E	Extended strand (participates in β ladder)	trans	172.6	-170.9	-179.1	0	0	0	0	0	112.2	C124 W295 L296	C124-G275 WeakPolarHBondContact CB-O 3.4Å; C124-G275 PolarHBondContact N-O 2.82Å; C124-G275 PolarHBondContact O-N 3.24Å; G275-W295 VanDerWaalsContact C-CZ3 3.43Å; G275-W295 VanDerWaalsContact CA-CZ2 3.46Å; G275-L296 CarbonylContact C-O 3.57Å; G275-L296 WeakPolarHBondContact CA-O 3.18Å
276	V	97.8	Very high	94.3	Very high	0 Å²	0	34 Å²	34	0%	0	19%	0.187	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.8	125.5	-173.2	-172.8	0	0	0	0	109	M121 K122 L123 F265 F278 W295 L296 L301	M121-V276 HydrophobicContact CB-CG1 3.98Å; M121-V276 HydrophobicContact SD-CG1 4.26Å; K122-V276 WeakPolarHBondContact O-CA 3.45Å; L123-V276 HydrophobicContact CD2-CG1 4.35Å; L123-V276 HydrophobicContact CD2-CG2 3.81Å; F265-V276 HydrophobicContact CE1-CG1 4.41Å; F265-V276 HydrophobicContact CE1-CG2 4.08Å; V276-F278 HydrophobicContact CB-CE2 3.89Å; V276-F278 HydrophobicContact CB-CZ 3.99Å; V276-F278 HydrophobicContact CG1-CD1 4.43Å; V276-F278 HydrophobicContact CG1-CD2 4.33Å; V276-F278 HydrophobicContact CG1-CE1 3.85Å; V276-F278 HydrophobicContact CG1-CE2 3.71Å; V276-F278 HydrophobicContact CG1-CZ 3.45Å; V276-F278 VanDerWaalsContact CG1-CZ 3.45Å; V276-W295 WeakPolarHBondContact O-CA 3.38Å; V276-L296 PolarHBondContact N-O 3.2Å; V276-L296 PolarHBondContact O-N 3.17Å; V276-L296 VanDerWaalsContact O-N 3.09Å; V276-L301 HydrophobicContact CB-CD2 4.45Å; V276-L301 HydrophobicContact CG2-CD1 3.86Å; V276-L301 HydrophobicContact CG2-CD2 4.29Å
277	L	98.4	Very high	94.1	Very high	13 Å²	13	34.6 Å²	34.6	7%	0.068	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	137.5	169.4	-72.3	167.7	0	0	0	109.7	A105 M121 K122 C124 V207 Y279 V293 S294 W295	A105-L277 HydrophobicContact CB-CD2 3.53Å; M121-L277 CarbonylContact C-O 3.53Å; M121-L277 WeakPolarHBondContact CA-O 3.06Å; M121-L277 WeakPolarHBondContact CB-O 3.33Å; K122-L277 PolarHBondContact N-O 3.02Å; K122-L277 PolarHBondContact O-N 2.83Å; C124-L277 WeakPolarHBondContact SG-CD1 3.15Å; V207-L277 HydrophobicContact CG1-CD1 3.83Å; L277-Y279 HydrophobicContact CB-CD2 4.12Å; L277-Y279 HydrophobicContact CB-CE2 3.51Å; L277-Y279 HydrophobicContact CD1-CE2 3.97Å; L277-Y279 WeakPolarHBondContact CD1-OH 3.5Å; L277-Y279 HydrophobicContact CG-CE2 4.25Å; L277-V293 HydrophobicContact CD2-CG1 4.19Å; L277-S294 CarbonylContact C-O 3.52Å; L277-S294 WeakPolarHBondContact CA-O 3.28Å; L277-W295 HydrophobicContact CD2-CB 4.5Å; L277-W295 HydrophobicContact CD2-CD2 4.5Å; L277-W295 HydrophobicContact CD2-CE3 3.56Å; L277-W295 HydrophobicContact CD2-CZ3 4.19Å; L277-W295 HydrophobicContact CG-CE3 3.65Å; L277-W295 HydrophobicContact CG-CZ3 3.82Å
278	F	98.6	Very high	93.9	Very high	0 Å²	0	32.6 Å²	32.6	0%	0	18%	0.178	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	116.6	174.8	-60.8	-81.5	0	0	0	109.4	F108 F115 Y119 R120 M121 V276 V293 S294 L296 L301 F305	F108-F278 HydrophobicContact CD2-CD2 4.14Å; F115-F278 HydrophobicContact CE1-CD1 4.47Å; F115-F278 HydrophobicContact CE2-CB 4.31Å; F115-F278 HydrophobicContact CE2-CD1 4.11Å; F115-F278 HydrophobicContact CE2-CG 4.37Å; F115-F278 HydrophobicContact CZ-CB 4.47Å; F115-F278 AromaticContact CZ-CD1 3.46Å; F115-F278 HydrophobicContact CZ-CD1 3.46Å; F115-F278 VanDerWaalsContact CZ-CD1 3.46Å; F115-F278 AromaticContact CZ-CE1 3.82Å; F115-F278 HydrophobicContact CZ-CE1 3.82Å; F115-F278 HydrophobicContact CZ-CG 4.08Å; Y119-F278 HydrophobicContact CD1-CB 4.09Å; R120-F278 CarbonylContact O-C 3.22Å; R120-F278 WeakPolarHBondContact O-CA 3.37Å; M121-F278 HydrophobicContact CB-CD1 3.64Å; M121-F278 HydrophobicContact CB-CE1 3.78Å; M121-F278 HydrophobicContact SD-CE1 3.98Å; V276-F278 HydrophobicContact CB-CE2 3.89Å; V276-F278 HydrophobicContact CB-CZ 3.99Å; V276-F278 HydrophobicContact CG1-CD1 4.43Å; V276-F278 HydrophobicContact CG1-CD2 4.33Å; V276-F278 HydrophobicContact CG1-CE1 3.85Å; V276-F278 HydrophobicContact CG1-CE2 3.71Å; V276-F278 HydrophobicContact CG1-CZ 3.45Å; V276-F278 VanDerWaalsContact CG1-CZ 3.45Å; F278-V293 CarbonylContact O-C 3.6Å; F278-V293 VanDerWaalsContact O-CA 3.26Å; F278-V293 WeakPolarHBondContact O-CA 3.09Å; F278-S294 PolarHBondContact N-O 2.85Å; F278-S294 PolarHBondContact O-N 3.01Å; F278-L296 HydrophobicContact CE2-CB 4.13Å; F278-L296 HydrophobicContact CE2-CD1 3.85Å; F278-L296 HydrophobicContact CE2-CG 4.15Å; F278-L296 HydrophobicContact CZ-CD1 4.47Å; F278-L301 HydrophobicContact CE2-CD2 4.15Å; F278-L301 HydrophobicContact CZ-CD2 3.78Å; F278-F305 HydrophobicContact CE1-CE2 4.47Å; F278-F305 HydrophobicContact CE1-CZ 4.47Å; F278-F305 HydrophobicContact CZ-CE2 4.06Å; F278-F305 HydrophobicContact CZ-CZ 4.42Å
279	Y	98.7	Very high	93.9	Very high	5 Å²	5	28.6 Å²	28.6	2%	0.02	16%	0.159	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.3	131.2	-179.2	-69.5	-101	0	0	0	109.9	M103 Y119 R120 V207 F222 L277 K281 V283 V293	M103-Y279 HydrophobicContact SD-CD1 4.45Å; M103-Y279 HydrophobicContact SD-CE1 3.92Å; Y119-Y279 VanDerWaalsContact CA-O 3.31Å; Y119-Y279 WeakPolarHBondContact CA-O 3.43Å; Y119-Y279 WeakPolarHBondContact CD1-O 3.45Å; R120-Y279 PolarHBondContact N-O 3.05Å; R120-Y279 PolarHBondContact O-N 2.85Å; V207-Y279 VanDerWaalsContact CG1-OH 3.26Å; V207-Y279 WeakPolarHBondContact CG1-OH 3.41Å; F222-Y279 HydrophobicContact CB-CD1 4.49Å; F222-Y279 HydrophobicContact CD1-CD1 4.25Å; F222-Y279 HydrophobicContact CD1-CD2 4.47Å; F222-Y279 AromaticContact CD1-CG 3.82Å; F222-Y279 HydrophobicContact CD1-CG 3.82Å; F222-Y279 AromaticContact CD2-CD1 3.42Å; F222-Y279 HydrophobicContact CD2-CD1 3.42Å; F222-Y279 VanDerWaalsContact CD2-CD1 3.42Å; F222-Y279 HydrophobicContact CD2-CD2 4.36Å; F222-Y279 AromaticContact CD2-CE1 3.83Å; F222-Y279 HydrophobicContact CD2-CE1 3.83Å; F222-Y279 AromaticContact CD2-CG 3.74Å; F222-Y279 HydrophobicContact CD2-CG 3.74Å; F222-Y279 VanDerWaalsContact CE1-CB 3.48Å; F222-Y279 HydrophobicContact CE1-CD1 4.36Å; F222-Y279 AromaticContact CE1-CD2 3.85Å; F222-Y279 HydrophobicContact CE1-CD2 3.85Å; F222-Y279 AromaticContact CE1-CG 3.66Å; F222-Y279 HydrophobicContact CE1-CG 3.66Å; F222-Y279 AromaticContact CE2-CD1 3.53Å; F222-Y279 HydrophobicContact CE2-CD1 3.53Å; F222-Y279 AromaticContact CE2-CD2 3.7Å; F222-Y279 HydrophobicContact CE2-CD2 3.7Å; F222-Y279 AromaticContact CE2-CE1 3.7Å; F222-Y279 HydrophobicContact CE2-CE1 3.7Å; F222-Y279 AromaticContact CE2-CE2 3.83Å; F222-Y279 HydrophobicContact CE2-CE2 3.83Å; F222-Y279 AromaticContact CE2-CG 3.55Å; F222-Y279 HydrophobicContact CE2-CG 3.55Å; F222-Y279 AromaticContact CE2-CZ 3.84Å; F222-Y279 AromaticContact CG-CD1 3.78Å; F222-Y279 HydrophobicContact CG-CD1 3.78Å; F222-Y279 AromaticContact CG-CG 3.85Å; F222-Y279 HydrophobicContact CG-CG 3.85Å; F222-Y279 HydrophobicContact CZ-CD1 4Å; F222-Y279 AromaticContact CZ-CD2 3.39Å; F222-Y279 HydrophobicContact CZ-CD2 3.39Å; F222-Y279 HydrophobicContact CZ-CE1 4.4Å; F222-Y279 AromaticContact CZ-CE2 3.82Å; F222-Y279 HydrophobicContact CZ-CE2 3.82Å; F222-Y279 AromaticContact CZ-CG 3.49Å; F222-Y279 HydrophobicContact CZ-CG 3.49Å; F222-Y279 VanDerWaalsContact CZ-CG 3.49Å; L277-Y279 HydrophobicContact CB-CD2 4.12Å; L277-Y279 HydrophobicContact CB-CE2 3.51Å; L277-Y279 HydrophobicContact CD1-CE2 3.97Å; L277-Y279 WeakPolarHBondContact CD1-OH 3.5Å; L277-Y279 HydrophobicContact CG-CE2 4.25Å; Y279-K281 PolarHBondContact O-N 2.76Å; Y279-V283 HydrophobicContact CD1-CG1 4.07Å; Y279-V293 HydrophobicContact CD1-CB 4.2Å; Y279-V293 HydrophobicContact CD1-CG1 3.78Å; Y279-V293 HydrophobicContact CD1-CG2 3.31Å; Y279-V293 HydrophobicContact CD2-CG1 4.27Å; Y279-V293 HydrophobicContact CE1-CB 4.27Å; Y279-V293 HydrophobicContact CE1-CG1 3.58Å; Y279-V293 HydrophobicContact CE1-CG2 3.6Å; Y279-V293 HydrophobicContact CE2-CG1 4.13Å; Y279-V293 HydrophobicContact CG-CG1 4.1Å; Y279-V293 HydrophobicContact CG-CG2 4.1Å
280	H	98.5	Very high	93.9	Very high	7 Å²	7	27.7 Å²	27.7	3%	0.032	15%	0.153	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-62.3	127.4	160.6	-170.7	-73.4	0	0	0	108.5	E118 Y119 D282 V283 L292	E118-H280 IonicContact OE2-CE1 2.85Å; Y119-H280 HydrophobicContact CE1-CB 4.11Å; Y119-H280 HydrophobicContact CE2-CB 4.12Å; Y119-H280 AromaticContact CE2-CD2 3.59Å; H280-D282 IonicContact CE1-OD2 3.48Å; H280-D282 PolarHBondContact ND1-N 2.82Å; H280-D282 PolarHBondContact O-N 3.03Å; H280-V283 WeakPolarHBondContact O-CG1 3.33Å; H280-V283 PolarHBondContact O-N 2.86Å; H280-L292 HydrophobicContact CB-CB 4.19Å; H280-L292 HydrophobicContact CB-CD2 4.35Å; H280-L292 PolarHBondContact N-O 3Å
281	K	98.1	Very high	94.1	Very high	57 Å²	57	22 Å²	22	25%	0.248	12%	0.116	C	C	.	.	T	Hydrogen-bonded Turn	trans	-57	-31.5	-169.8	74.4	-177.5	-173.5	-151.7	0	113.9	E118 R120 F222 Y223 Y279	E118-K281 VanDerWaalsContact O-CB 3.3Å; E118-K281 WeakPolarHBondContact O-CB 3.12Å; E118-K281 WeakPolarHBondContact O-CG 3.48Å; E118-K281 PolarHBondContact O-N 2.87Å; E118-K281 IonicContact OE1-NZ 3.94Å; E118-K281 PolarHBondContact OE1-NZ 3.37Å; E118-K281 WeakPolarHBondContact OE2-CE 3.41Å; E118-K281 IonicContact OE2-NZ 2.74Å; E118-K281 PolarHBondContact OE2-NZ 3.09Å; R120-K281 HydrophobicContact CG-CB 4.45Å; F222-K281 PolarHBondContact N-O 3.17Å; Y223-K281 PolarHBondContact N-O 3.01Å; Y279-K281 PolarHBondContact O-N 2.76Å
282	D	97.1	Very high	94.3	Very high	49 Å²	49	21 Å²	21	26%	0.262	11%	0.112	S	C	.	.	T	Hydrogen-bonded Turn	trans	-85.4	-1.4	-179.1	-65.1	-32.2	0	0	0	115.2	H280 N284	H280-D282 IonicContact CE1-OD2 3.48Å; H280-D282 PolarHBondContact ND1-N 2.82Å; H280-D282 PolarHBondContact O-N 3.03Å; D282-N284 PolarHBondContact O-N 3.3Å
283	V	96.8	Very high	94.5	Very high	0 Å²	0	17.4 Å²	17.4	0%	0	10%	0.097	C	C	.	.	P	Polyproline II helix	trans	-68.5	125.7	-176.2	71.9	0	0	0	0	112	M103 F222 R225 Y279 H280 L292 V293	M103-V283 HydrophobicContact CE-CG1 4.49Å; M103-V283 HydrophobicContact CE-CG2 3.83Å; F222-V283 HydrophobicContact CB-CG1 3.71Å; F222-V283 HydrophobicContact CG-CG1 4.49Å; F222-V283 PolarHBondContact N-O 2.78Å; R225-V283 PolarHBondContact NH1-O 3.45Å; R225-V283 PolarHBondContact NH2-O 2.96Å; Y279-V283 HydrophobicContact CD1-CG1 4.07Å; H280-V283 WeakPolarHBondContact O-CG1 3.33Å; H280-V283 PolarHBondContact O-N 2.86Å; V283-L292 HydrophobicContact CB-CB 4.01Å; V283-L292 HydrophobicContact CB-CD1 4.14Å; V283-L292 HydrophobicContact CG2-CB 3.71Å; V283-L292 HydrophobicContact CG2-CD1 3.77Å; V283-L292 HydrophobicContact CG2-CG 4.38Å; V283-V293 HydrophobicContact CG1-CG2 4.08Å
284	N	95	Very high	94.7	Very high	37 Å²	37	16.7 Å²	16.7	20%	0.198	9%	0.093	C	C	.	.	B	Isolated β-bridge	trans	-73.4	148.4	169.3	-72.1	104.5	0	0	0	111.4	L56 M103 V218 D219 L220 D282 E286	L56-N284 WeakPolarHBondContact CD2-OD1 3.15Å; M103-N284 WeakPolarHBondContact CE-O 3.27Å; V218-N284 WeakPolarHBondContact O-CB 3.39Å; V218-N284 PolarHBondContact O-ND2 3.22Å; D219-N284 VanDerWaalsContact CA-ND2 3.34Å; D219-N284 WeakPolarHBondContact CA-ND2 3.49Å; D219-N284 PolarHBondContact O-ND2 2.7Å; L220-N284 PolarHBondContact O-ND2 2.87Å; D282-N284 PolarHBondContact O-N 3.3Å; N284-E286 PolarHBondContact O-N 2.86Å
285	Y	94.1	Very high	94.8	Very high	13 Å²	13	16.4 Å²	16.4	5%	0.051	9%	0.091	C	C	.	.	P	Polyproline II helix	trans	-69.6	123.6	175.8	-163.2	-89.7	0	0	0	109.6	L101 L102 M103 D176 D208 I210 V218	L101-Y285 WeakPolarHBondContact O-CE1 3.42Å; L101-Y285 PolarHBondContact O-OH 3.14Å; L102-Y285 WeakPolarHBondContact CA-OH 3.46Å; M103-Y285 HydrophobicContact CB-CD2 4.09Å; M103-Y285 HydrophobicContact CB-CE1 4.37Å; M103-Y285 HydrophobicContact CB-CE2 3.64Å; M103-Y285 PolarHBondContact N-OH 2.89Å; M103-Y285 VanDerWaalsContact N-OH 3.13Å; M103-Y285 HydrophobicContact SD-CD2 4.39Å; D176-Y285 HydrophobicContact CB-CE2 4.1Å; D176-Y285 WeakPolarHBondContact OD2-CE2 3.21Å; D176-Y285 PolarHBondContact OD2-OH 2.86Å; D208-Y285 HydrophobicContact CB-CD2 4.11Å; D208-Y285 HydrophobicContact CB-CE2 3.93Å; D208-Y285 WeakPolarHBondContact OD2-CD2 3.49Å; I210-Y285 HydrophobicContact CD1-CD1 4.35Å; I210-Y285 HydrophobicContact CD1-CE1 3.52Å; I210-Y285 HydrophobicContact CG1-CD1 3.97Å; I210-Y285 HydrophobicContact CG1-CE1 3.59Å; I210-Y285 HydrophobicContact CG1-CE2 4.35Å; I210-Y285 HydrophobicContact CG1-CG 4.48Å; I210-Y285 HydrophobicContact CG2-CD1 4.45Å; V218-Y285 HydrophobicContact CG1-CD1 4.26Å; V218-Y285 PolarHBondContact O-N 3.43Å
286	E	88.5	Confident	94.9	Very high	58 Å²	58	16.4 Å²	16.4	27%	0.271	9%	0.091	S	C	.	.			trans	-145.6	138.4	-176.8	69.2	-171.2	147	0	0	108	K52 M103 N284 T290	K52-E286 WeakPolarHBondContact CE-OE1 3.36Å; K52-E286 WeakPolarHBondContact CE-OE2 3.4Å; K52-E286 IonicContact NZ-OE1 3.49Å; K52-E286 PolarHBondContact NZ-OE1 3.49Å; K52-E286 IonicContact NZ-OE2 3.37Å; K52-E286 PolarHBondContact NZ-OE2 3.45Å; M103-E286 VanDerWaalsContact CA-O 3.24Å; M103-E286 WeakPolarHBondContact CA-O 3.34Å; M103-E286 WeakPolarHBondContact CB-O 3.49Å; M103-E286 HydrophobicContact CE-CG 3.87Å; N284-E286 PolarHBondContact O-N 2.86Å; E286-T290 WeakPolarHBondContact OE1-CB 3.48Å; E286-T290 PolarHBondContact OE1-OG1 2.81Å
287	P	86.9	Confident	94.7	Very high	68 Å²	68	17.2 Å²	17.2	44%	0.442	10%	0.095	S	C	.	.	S	Bend	trans	-72.7	150.8	177.6	-19.6	32.8	0	0	0	114.2	K100 L102	K100-P287 VanDerWaalsContact C-CB 3.44Å; K100-P287 WeakPolarHBondContact O-CB 3.47Å; K100-P287 WeakPolarHBondContact O-CG 3.38Å; L102-P287 WeakPolarHBondContact O-CA 3.44Å
288	G	85.5	Confident	94.6	Very high	18 Å²	18	17 Å²	17	19%	0.186	9%	0.094	C	C	.	.	E	Extended strand (participates in β ladder)	trans	92.1	176.8	179.7	0	0	0	0	0	113.3	L102 L104	L102-G288 PolarHBondContact O-N 3.34Å; L104-G288 PolarHBondContact N-O 3.04Å
289	A	87.2	Confident	94.4	Very high	10 Å²	10	18 Å²	18	8%	0.083	10%	0.098	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	142.4	175.7	0	0	0	0	0	113.1	D17 L104 E106	D17-A289 HydrophobicContact CB-CB 3.42Å; D17-A289 VanDerWaalsContact CB-CB 3.42Å; D17-A289 PolarHBondContact OD2-N 3.09Å; L104-A289 WeakPolarHBondContact O-CA 3.28Å; E106-A289 HydrophobicContact CG-CB 4.02Å
290	T	91.3	Very high	94.2	Very high	0 Å²	0	17.7 Å²	17.7	0%	0	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.9	135.4	174.2	-171.5	0	0	0	0	110.8	K52 M103 L104 E286 L292 V293	K52-T290 WeakPolarHBondContact CD-OG1 3.41Å; K52-T290 WeakPolarHBondContact CE-OG1 3.38Å; K52-T290 PolarHBondContact NZ-OG1 3.25Å; M103-T290 HydrophobicContact CE-CG2 4.23Å; M103-T290 HydrophobicContact CG-CG2 4.01Å; M103-T290 HydrophobicContact SD-CG2 4.27Å; L104-T290 PolarHBondContact O-N 3.11Å; L104-T290 VanDerWaalsContact O-N 3.15Å; E286-T290 WeakPolarHBondContact OE1-CB 3.48Å; E286-T290 PolarHBondContact OE1-OG1 2.81Å; T290-L292 PolarHBondContact O-N 3.31Å; T290-L292 VanDerWaalsContact O-N 3.14Å; T290-V293 HydrophobicContact CG2-CB 3.81Å; T290-V293 HydrophobicContact CG2-CG2 3.62Å; T290-V293 PolarHBondContact O-N 2.76Å
291	P	95.4	Very high	94.1	Very high	4 Å²	4	17.4 Å²	17.4	3%	0.026	10%	0.095	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.4	-8.4	177.1	30.9	-37.5	0	0	0	112.5	Q45 R48 W49 K52 V293	Q45-P291 HydrophobicContact CG-CB 4.08Å; R48-P291 HydrophobicContact CB-CB 4.44Å; R48-P291 HydrophobicContact CB-CG 3.98Å; W49-P291 HydrophobicContact CB-CB 4.07Å; W49-P291 HydrophobicContact CB-CG 4.4Å; K52-P291 HydrophobicContact CD-CG 4.24Å; P291-V293 VanDerWaalsContact C-N 3.29Å
292	L	97.4	Very high	93.9	Very high	1 Å²	1	16.7 Å²	16.7	1%	0.005	10%	0.097	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84	-5.1	176.9	-60.6	-177.6	0	0	0	113.2	W49 K52 L53 L56 H280 V283 T290	W49-L292 VanDerWaalsContact CD1-CD2 3.47Å; W49-L292 HydrophobicContact CG-CD2 4.14Å; K52-L292 HydrophobicContact CB-CD1 4.05Å; K52-L292 HydrophobicContact CB-CG 4.21Å; K52-L292 HydrophobicContact CD-CD1 4.11Å; K52-L292 HydrophobicContact CD-CG 4.24Å; K52-L292 HydrophobicContact CG-CD1 3.79Å; K52-L292 HydrophobicContact CG-CG 4.26Å; L53-L292 HydrophobicContact CD2-CD1 4.15Å; L53-L292 HydrophobicContact CD2-CD2 3.54Å; L53-L292 HydrophobicContact CG-CD2 3.71Å; L56-L292 HydrophobicContact CD1-CD1 3.43Å; L56-L292 VanDerWaalsContact CD1-CD1 3.43Å; H280-L292 HydrophobicContact CB-CB 4.19Å; H280-L292 HydrophobicContact CB-CD2 4.35Å; H280-L292 PolarHBondContact N-O 3Å; V283-L292 HydrophobicContact CB-CB 4.01Å; V283-L292 HydrophobicContact CB-CD1 4.14Å; V283-L292 HydrophobicContact CG2-CB 3.71Å; V283-L292 HydrophobicContact CG2-CD1 3.77Å; V283-L292 HydrophobicContact CG2-CG 4.38Å; T290-L292 PolarHBondContact O-N 3.31Å; T290-L292 VanDerWaalsContact O-N 3.14Å
293	V	97.8	Very high	93.8	Very high	1 Å²	1	18.1 Å²	18.1	1%	0.006	10%	0.102	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-129.1	123.5	174.2	-174.1	0	0	0	0	108.6	M103 A105 E106 L277 F278 Y279 V283 T290 P291	M103-V293 HydrophobicContact CG-CG2 4.47Å; M103-V293 HydrophobicContact SD-CG2 3.62Å; A105-V293 WeakPolarHBondContact CA-O 3.49Å; A105-V293 HydrophobicContact CB-CB 4.45Å; A105-V293 HydrophobicContact CB-CG1 3.84Å; E106-V293 PolarHBondContact N-O 2.96Å; L277-V293 HydrophobicContact CD2-CG1 4.19Å; F278-V293 CarbonylContact O-C 3.6Å; F278-V293 VanDerWaalsContact O-CA 3.26Å; F278-V293 WeakPolarHBondContact O-CA 3.09Å; Y279-V293 HydrophobicContact CD1-CB 4.2Å; Y279-V293 HydrophobicContact CD1-CG1 3.78Å; Y279-V293 HydrophobicContact CD1-CG2 3.31Å; Y279-V293 HydrophobicContact CD2-CG1 4.27Å; Y279-V293 HydrophobicContact CE1-CB 4.27Å; Y279-V293 HydrophobicContact CE1-CG1 3.58Å; Y279-V293 HydrophobicContact CE1-CG2 3.6Å; Y279-V293 HydrophobicContact CE2-CG1 4.13Å; Y279-V293 HydrophobicContact CG-CG1 4.1Å; Y279-V293 HydrophobicContact CG-CG2 4.1Å; V283-V293 HydrophobicContact CG1-CG2 4.08Å; T290-V293 HydrophobicContact CG2-CB 3.81Å; T290-V293 HydrophobicContact CG2-CG2 3.62Å; T290-V293 PolarHBondContact O-N 2.76Å; P291-V293 VanDerWaalsContact C-N 3.29Å
294	S	96.6	Very high	93.7	Very high	1 Å²	1	20.1 Å²	20.1	1%	0.007	11%	0.11	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-122.9	152.4	-173.5	-56	0	0	0	0	111.5	E106 F108 L277 F278	E106-S294 CarbonylContact O-C 3.4Å; E106-S294 WeakPolarHBondContact O-CA 3.29Å; F108-S294 VanDerWaalsContact CD2-CB 3.48Å; L277-S294 CarbonylContact C-O 3.52Å; L277-S294 WeakPolarHBondContact CA-O 3.28Å; F278-S294 PolarHBondContact N-O 2.85Å; F278-S294 PolarHBondContact O-N 3.01Å
295	W	96.7	Very high	93.7	Very high	3 Å²	3	19.2 Å²	19.2	1%	0.011	10%	0.104	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.8	139	-178	176.6	-105.2	0	0	0	111.1	L14 I16 A105 E106 W107 F108 C124 D274 G275 V276 L277 K297	L14-W295 HydrophobicContact CB-CH2 4.27Å; L14-W295 HydrophobicContact CB-CZ2 4.21Å; L14-W295 HydrophobicContact CD1-CH2 3.25Å; L14-W295 HydrophobicContact CD1-CZ2 3.96Å; L14-W295 HydrophobicContact CD1-CZ3 3.63Å; L14-W295 HydrophobicContact CG-CH2 4.37Å; I16-W295 HydrophobicContact CD1-CB 4.12Å; I16-W295 HydrophobicContact CD1-CG 4.25Å; I16-W295 HydrophobicContact CG1-CB 4.34Å; A105-W295 HydrophobicContact CB-CB 3.87Å; E106-W295 PolarHBondContact O-N 3.18Å; W107-W295 AromaticContact CE3-CD1 3.93Å; W107-W295 AromaticContact CH2-CD1 3.95Å; W107-W295 AromaticContact CZ3-CD1 3.51Å; F108-W295 PolarHBondContact N-O 3.31Å; F108-W295 VanDerWaalsContact N-O 3.1Å; C124-W295 HydrophobicContact CB-CH2 3.8Å; C124-W295 HydrophobicContact CB-CZ3 3.67Å; D274-W295 HydrophobicContact CB-CH2 4.29Å; D274-W295 HydrophobicContact CB-CZ2 4.4Å; G275-W295 VanDerWaalsContact C-CZ3 3.43Å; G275-W295 VanDerWaalsContact CA-CZ2 3.46Å; V276-W295 WeakPolarHBondContact O-CA 3.38Å; L277-W295 HydrophobicContact CD2-CB 4.5Å; L277-W295 HydrophobicContact CD2-CD2 4.5Å; L277-W295 HydrophobicContact CD2-CE3 3.56Å; L277-W295 HydrophobicContact CD2-CZ3 4.19Å; L277-W295 HydrophobicContact CG-CE3 3.65Å; L277-W295 HydrophobicContact CG-CZ3 3.82Å; W295-K297 HydrophobicContact CZ2-CD 4.48Å
296	L	95.9	Very high	93.7	Very high	0 Å²	0	23.1 Å²	23.1	0%	0	13%	0.131	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.9	144.6	168.5	-73.8	175.5	0	0	0	110.6	F108 G275 V276 F278 M300 L301 W304 F305	F108-L296 HydrophobicContact CB-CD1 4.03Å; F108-L296 HydrophobicContact CB-CD2 3.68Å; F108-L296 HydrophobicContact CB-CG 3.6Å; F108-L296 HydrophobicContact CD1-CD1 4.46Å; F108-L296 HydrophobicContact CG-CD1 4.13Å; F108-L296 HydrophobicContact CG-CG 4.25Å; G275-L296 CarbonylContact C-O 3.57Å; G275-L296 WeakPolarHBondContact CA-O 3.18Å; V276-L296 PolarHBondContact N-O 3.2Å; V276-L296 PolarHBondContact O-N 3.17Å; V276-L296 VanDerWaalsContact O-N 3.09Å; F278-L296 HydrophobicContact CE2-CB 4.13Å; F278-L296 HydrophobicContact CE2-CD1 3.85Å; F278-L296 HydrophobicContact CE2-CG 4.15Å; F278-L296 HydrophobicContact CZ-CD1 4.47Å; L296-M300 HydrophobicContact CD2-CB 4Å; L296-M300 HydrophobicContact CD2-SD 3.93Å; L296-L301 HydrophobicContact CB-CD2 4.09Å; L296-L301 HydrophobicContact CD1-CD2 3.88Å; L296-W304 HydrophobicContact CD1-CB 4.38Å; L296-W304 HydrophobicContact CD1-CG 4.04Å; L296-F305 HydrophobicContact CD1-CE2 4.36Å
297	K	95.2	Very high	93.9	Very high	16 Å²	16	27.4 Å²	27.4	7%	0.07	16%	0.155	C	C	.	.			trans	-73.2	150.7	163.1	-70.1	-62.9	-165.3	-176	0	110	T13 W107 D274 W295 Y299 M300	T13-K297 VanDerWaalsContact CG2-NZ 3.33Å; W107-K297 HydrophobicContact CH2-CG 4.41Å; W107-K297 HydrophobicContact CZ3-CG 4.45Å; D274-K297 WeakPolarHBondContact O-CD 3.37Å; D274-K297 PolarHBondContact O-NZ 2.94Å; D274-K297 IonicContact OD1-NZ 3.36Å; D274-K297 PolarHBondContact OD1-NZ 3.32Å; D274-K297 IonicContact OD2-NZ 3.49Å; D274-K297 PolarHBondContact OD2-NZ 2.92Å; W295-K297 HydrophobicContact CZ2-CD 4.48Å; K297-Y299 VanDerWaalsContact C-N 3.28Å; K297-Y299 HydrophobicContact CB-CD1 4.12Å; K297-Y299 HydrophobicContact CB-CD2 4.4Å; K297-Y299 HydrophobicContact CB-CE1 3.64Å; K297-Y299 HydrophobicContact CB-CE2 3.97Å; K297-Y299 HydrophobicContact CB-CG 4.48Å; K297-Y299 HydrophobicContact CG-CE1 4.13Å; K297-Y299 PolarHBondContact O-N 3.21Å; K297-M300 HydrophobicContact CB-CE 4.14Å; K297-M300 HydrophobicContact CB-CG 4.11Å; K297-M300 HydrophobicContact CB-SD 3.91Å; K297-M300 HydrophobicContact CG-CE 4.19Å; K297-M300 HydrophobicContact CG-SD 4.4Å; K297-M300 WeakPolarHBondContact O-CB 3.3Å; K297-M300 PolarHBondContact O-N 2.96Å
298	P	95.2	Very high	94.2	Very high	10 Å²	10	24.6 Å²	24.6	7%	0.065	14%	0.137	C	C	.	.	G	3₁₀ helix	trans	-57.7	-38.2	-174.2	-29.4	40.6	0	0	0	113.6	I273 D274 M300 L301 F314	I273-P298 HydrophobicContact CB-CG 4.43Å; I273-P298 HydrophobicContact CG2-CG 3.62Å; D274-P298 WeakPolarHBondContact O-CD 3.37Å; P298-M300 VanDerWaalsContact C-N 3.25Å; P298-M300 PolarHBondContact O-N 3.46Å; P298-L301 WeakPolarHBondContact O-CB 3.31Å; P298-L301 WeakPolarHBondContact O-CG 3.42Å; P298-L301 PolarHBondContact O-N 3.05Å; P298-F314 CarbonylContact C-O 3.58Å; P298-F314 HydrophobicContact CB-CB 3.97Å; P298-F314 HydrophobicContact CB-CD1 3.71Å; P298-F314 HydrophobicContact CB-CG 4.15Å; P298-F314 VanDerWaalsContact CB-O 3.27Å; P298-F314 WeakPolarHBondContact CB-O 3.17Å
299	Y	94.2	Very high	94.6	Very high	19 Å²	19	29.4 Å²	29.4	8%	0.075	16%	0.158	C	C	.	.	G	3₁₀ helix	trans	-72.5	-12.3	178.6	52.2	-97.5	0	0	0	114.4	K297 F314 D317 I318 Y322 E328	K297-Y299 VanDerWaalsContact C-N 3.28Å; K297-Y299 HydrophobicContact CB-CD1 4.12Å; K297-Y299 HydrophobicContact CB-CD2 4.4Å; K297-Y299 HydrophobicContact CB-CE1 3.64Å; K297-Y299 HydrophobicContact CB-CE2 3.97Å; K297-Y299 HydrophobicContact CB-CG 4.48Å; K297-Y299 HydrophobicContact CG-CE1 4.13Å; K297-Y299 PolarHBondContact O-N 3.21Å; Y299-F314 PolarHBondContact N-O 2.99Å; Y299-D317 WeakPolarHBondContact CE1-O 3.44Å; Y299-I318 HydrophobicContact CD1-CB 4.5Å; Y299-I318 HydrophobicContact CD2-CG1 4.3Å; Y299-I318 HydrophobicContact CG-CB 4.2Å; Y299-I318 HydrophobicContact CG-CG1 4.2Å; Y299-Y322 AromaticContact CD2-CD2 3.91Å; Y299-Y322 HydrophobicContact CD2-CD2 3.91Å; Y299-Y322 HydrophobicContact CD2-CE1 4.41Å; Y299-Y322 AromaticContact CD2-CE2 3.57Å; Y299-Y322 HydrophobicContact CD2-CE2 3.57Å; Y299-Y322 HydrophobicContact CD2-CG 4.44Å; Y299-Y322 AromaticContact CD2-CZ 3.83Å; Y299-Y322 AromaticContact CE2-CD2 3.7Å; Y299-Y322 HydrophobicContact CE2-CD2 3.7Å; Y299-Y322 AromaticContact CE2-CE2 3.48Å; Y299-Y322 HydrophobicContact CE2-CE2 3.48Å; Y299-Y322 VanDerWaalsContact CE2-CE2 3.48Å; Y299-E328 HydrophobicContact CE2-CG 4.12Å; Y299-E328 PolarHBondContact OH-OE1 3.43Å
300	M	95.1	Very high	94.9	Very high	0 Å²	0	30.9 Å²	30.9	0%	0	16%	0.162	C	C	.	.	G	3₁₀ helix	trans	-85.7	-17	173.7	-59.7	171.1	174	0	0	112.5	W107 L296 K297 P298 E303 Y322 E328 I329	W107-M300 HydrophobicContact CH2-CE 4.3Å; W107-M300 HydrophobicContact CZ3-CE 3.94Å; W107-M300 HydrophobicContact CZ3-SD 3.99Å; L296-M300 HydrophobicContact CD2-CB 4Å; L296-M300 HydrophobicContact CD2-SD 3.93Å; K297-M300 HydrophobicContact CB-CE 4.14Å; K297-M300 HydrophobicContact CB-CG 4.11Å; K297-M300 HydrophobicContact CB-SD 3.91Å; K297-M300 HydrophobicContact CG-CE 4.19Å; K297-M300 HydrophobicContact CG-SD 4.4Å; K297-M300 WeakPolarHBondContact O-CB 3.3Å; K297-M300 PolarHBondContact O-N 2.96Å; P298-M300 VanDerWaalsContact C-N 3.25Å; P298-M300 PolarHBondContact O-N 3.46Å; M300-E303 PolarHBondContact O-N 2.73Å; M300-Y322 HydrophobicContact CG-CE2 4.4Å; M300-Y322 WeakPolarHBondContact CG-OH 3.45Å; M300-E328 HydrophobicContact CE-CB 3.83Å; M300-E328 HydrophobicContact CE-CG 3.29Å; M300-I329 HydrophobicContact CE-CG1 4.36Å
301	L	95.7	Very high	95.1	Very high	0 Å²	0	33.4 Å²	33.4	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-60.5	-41.3	-174.8	-63.1	168.3	0	0	0	113.5	F265 V276 F278 L296 P298 E303 W304 F305 Y310 F314	F265-L301 HydrophobicContact CD1-CD1 4.35Å; F265-L301 HydrophobicContact CE1-CD1 3.93Å; F265-L301 HydrophobicContact CE2-CD1 4.37Å; F265-L301 HydrophobicContact CZ-CD1 3.95Å; F265-L301 HydrophobicContact CZ-CD2 4.27Å; V276-L301 HydrophobicContact CB-CD2 4.45Å; V276-L301 HydrophobicContact CG2-CD1 3.86Å; V276-L301 HydrophobicContact CG2-CD2 4.29Å; F278-L301 HydrophobicContact CE2-CD2 4.15Å; F278-L301 HydrophobicContact CZ-CD2 3.78Å; L296-L301 HydrophobicContact CB-CD2 4.09Å; L296-L301 HydrophobicContact CD1-CD2 3.88Å; P298-L301 WeakPolarHBondContact O-CB 3.31Å; P298-L301 WeakPolarHBondContact O-CG 3.42Å; P298-L301 PolarHBondContact O-N 3.05Å; L301-E303 PolarHBondContact O-N 2.88Å; L301-W304 PolarHBondContact O-N 2.98Å; L301-F305 HydrophobicContact CD2-CD2 4.38Å; L301-F305 HydrophobicContact CD2-CE2 4.2Å; L301-F305 PolarHBondContact O-N 3.4Å; L301-Y310 HydrophobicContact CB-CD1 4.29Å; L301-Y310 HydrophobicContact CB-CE1 3.42Å; L301-Y310 VanDerWaalsContact CB-CE1 3.42Å; L301-Y310 HydrophobicContact CD1-CD1 4.29Å; L301-Y310 HydrophobicContact CD1-CE1 3.88Å; L301-Y310 HydrophobicContact CG-CE1 4.29Å; L301-Y310 PolarHBondContact O-OH 2.9Å; L301-F314 HydrophobicContact CD1-CD1 3.77Å; L301-F314 HydrophobicContact CD1-CE1 3.97Å
302	P	94.8	Very high	94.9	Very high	42 Å²	42	37.3 Å²	37.3	27%	0.273	20%	0.201	S	C	.	.	H	α-helix	trans	-61.3	-28.1	179.4	-23.4	34.1	0	0	0	114.2	W304 F305 P306 Y310 M315	P302-W304 VanDerWaalsContact C-N 3.33Å; P302-F305 CarbonylContact O-C 3.57Å; P302-P306 VanDerWaalsContact O-CA 3.24Å; P302-P306 WeakPolarHBondContact O-CA 3.41Å; P302-Y310 HydrophobicContact CB-CD2 4.49Å; P302-Y310 HydrophobicContact CB-CE2 4.02Å; P302-Y310 HydrophobicContact CG-CD2 3.89Å; P302-Y310 HydrophobicContact CG-CE2 3.75Å; P302-M315 HydrophobicContact CG-CE 3.27Å; P302-M315 HydrophobicContact CG-SD 4.18Å
303	E	94.3	Very high	94.6	Very high	80 Å²	80	40.3 Å²	40.3	37%	0.374	22%	0.217	S	C	.	.	H	α-helix	trans	-69.6	-32.6	176.2	-72.5	171.8	-113	0	0	112.1	M300 L301 Y322 D324 Y325	M300-E303 PolarHBondContact O-N 2.73Å; L301-E303 PolarHBondContact O-N 2.88Å; E303-Y322 VanDerWaalsContact OE1-CE1 3.24Å; E303-Y322 WeakPolarHBondContact OE1-CE1 3.47Å; E303-Y322 PolarHBondContact OE1-OH 3.05Å; E303-D324 WeakPolarHBondContact OE2-CA 3.48Å; E303-Y325 WeakPolarHBondContact OE2-CD1 3.3Å; E303-Y325 PolarHBondContact OE2-N 2.94Å; E303-Y325 VanDerWaalsContact OE2-N 3.07Å
304	W	94.9	Very high	94.3	Very high	42 Å²	42	40.4 Å²	40.4	16%	0.159	22%	0.217	C	C	.	.	H	α-helix	trans	-89.8	-33.4	178.9	-73.7	102.1	0	0	0	113.2	F108 M111 L296 L301 P302 Y325	F108-W304 AromaticContact CD1-CD2 3.68Å; F108-W304 HydrophobicContact CD1-CD2 3.68Å; F108-W304 AromaticContact CD1-CE2 3.63Å; F108-W304 AromaticContact CD1-CE3 3.87Å; F108-W304 HydrophobicContact CD1-CE3 3.87Å; F108-W304 HydrophobicContact CD1-CG 4.3Å; F108-W304 AromaticContact CD1-CH2 3.93Å; F108-W304 HydrophobicContact CD1-CH2 3.93Å; F108-W304 AromaticContact CD1-CZ2 3.76Å; F108-W304 HydrophobicContact CD1-CZ2 3.76Å; F108-W304 AromaticContact CD1-CZ3 3.99Å; F108-W304 HydrophobicContact CD1-CZ3 3.99Å; F108-W304 AromaticContact CE1-CD2 3.76Å; F108-W304 HydrophobicContact CE1-CD2 3.76Å; F108-W304 AromaticContact CE1-CE3 3.51Å; F108-W304 HydrophobicContact CE1-CE3 3.51Å; F108-W304 HydrophobicContact CE1-CG 4.43Å; F108-W304 HydrophobicContact CE1-CH2 4.08Å; F108-W304 HydrophobicContact CE1-CZ2 4.31Å; F108-W304 AromaticContact CE1-CZ3 3.68Å; F108-W304 HydrophobicContact CE1-CZ3 3.68Å; F108-W304 VanDerWaalsContact O-CZ2 3.24Å; F108-W304 WeakPolarHBondContact O-CZ2 3.36Å; M111-W304 HydrophobicContact CB-CZ3 4.24Å; M111-W304 HydrophobicContact CE-CE3 3.93Å; L296-W304 HydrophobicContact CD1-CB 4.38Å; L296-W304 HydrophobicContact CD1-CG 4.04Å; L301-W304 PolarHBondContact O-N 2.98Å; P302-W304 VanDerWaalsContact C-N 3.33Å; W304-Y325 HydrophobicContact CZ2-CD2 4.24Å; W304-Y325 HydrophobicContact CZ2-CE1 4.1Å; W304-Y325 AromaticContact CZ2-CE2 3.61Å; W304-Y325 HydrophobicContact CZ2-CE2 3.61Å; W304-Y325 AromaticContact CZ2-CZ 3.53Å; W304-Y325 AromaticContact NE1-CG 3.95Å
305	F	95.2	Very high	94.1	Very high	17 Å²	17	43.3 Å²	43.3	8%	0.075	23%	0.232	C	C	.	.			trans	-132.4	74.7	-178.7	-39.2	-83.4	0	0	0	110.5	M111 F115 M261 F278 L296 L301 P302 N307 I308 Y310	M111-F305 HydrophobicContact CE-CD1 4.22Å; M111-F305 HydrophobicContact CE-CE1 3.56Å; M111-F305 HydrophobicContact CE-CZ 4.06Å; M111-F305 HydrophobicContact SD-CE1 4.41Å; F115-F305 AromaticContact CD1-CE1 3.83Å; F115-F305 HydrophobicContact CD1-CE1 3.83Å; F115-F305 HydrophobicContact CD1-CZ 4.31Å; F115-F305 AromaticContact CE1-CE1 3.34Å; F115-F305 HydrophobicContact CE1-CE1 3.34Å; F115-F305 AromaticContact CE1-CZ 3.44Å; F115-F305 HydrophobicContact CE1-CZ 3.44Å; F115-F305 VanDerWaalsContact CE1-CZ 3.44Å; F115-F305 HydrophobicContact CZ-CE1 4.09Å; F115-F305 AromaticContact CZ-CZ 3.72Å; F115-F305 HydrophobicContact CZ-CZ 3.72Å; M261-F305 HydrophobicContact CE-CD1 4.27Å; M261-F305 HydrophobicContact SD-CD1 4.4Å; M261-F305 HydrophobicContact SD-CE1 4.41Å; F278-F305 HydrophobicContact CE1-CE2 4.47Å; F278-F305 HydrophobicContact CE1-CZ 4.47Å; F278-F305 HydrophobicContact CZ-CE2 4.06Å; F278-F305 HydrophobicContact CZ-CZ 4.42Å; L296-F305 HydrophobicContact CD1-CE2 4.36Å; L301-F305 HydrophobicContact CD2-CD2 4.38Å; L301-F305 HydrophobicContact CD2-CE2 4.2Å; L301-F305 PolarHBondContact O-N 3.4Å; P302-F305 CarbonylContact O-C 3.57Å; F305-N307 PolarHBondContact O-N 3.36Å; F305-I308 HydrophobicContact CB-CD1 3.49Å; F305-I308 VanDerWaalsContact CB-CD1 3.49Å; F305-I308 HydrophobicContact CB-CG1 4.04Å; F305-I308 HydrophobicContact CG-CD1 4.14Å; F305-I308 PolarHBondContact O-N 2.91Å; F305-Y310 WeakPolarHBondContact CB-OH 3.34Å; F305-Y310 PolarHBondContact O-OH 3.42Å
306	P	93.6	Very high	93.7	Very high	95 Å²	95	50 Å²	50	62%	0.617	26%	0.261	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.1	-15.8	-173.8	26.5	-35.9	0	0	0	114.3	P302 I308	P302-P306 VanDerWaalsContact O-CA 3.24Å; P302-P306 WeakPolarHBondContact O-CA 3.41Å; P306-I308 VanDerWaalsContact C-N 3.35Å
307	N	92.3	Very high	93.4	Very high	148 Å²	148	52.9 Å²	52.9	79%	0.791	28%	0.276	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92.9	10.6	-176.2	-61	-36.8	0	0	0	113.6	F305	F305-N307 PolarHBondContact O-N 3.36Å
308	I	94.1	Very high	93.2	Very high	10 Å²	10	55.8 Å²	55.8	5%	0.051	29%	0.292	C	S	.	.	S	Bend	trans	-110.1	138.9	-179	-54.6	177.5	0	0	0	109.2	M261 Q262 F265 F305 P306 Y310	M261-I308 HydrophobicContact CB-CD1 3.7Å; M261-I308 HydrophobicContact CE-CD1 3.54Å; M261-I308 HydrophobicContact CG-CD1 4.45Å; M261-I308 HydrophobicContact SD-CD1 3.95Å; Q262-I308 HydrophobicContact CB-CG2 4.43Å; F265-I308 HydrophobicContact CD2-CD1 4.44Å; F265-I308 HydrophobicContact CD2-CG2 3.98Å; F265-I308 HydrophobicContact CE2-CD1 4.41Å; F305-I308 HydrophobicContact CB-CD1 3.49Å; F305-I308 VanDerWaalsContact CB-CD1 3.49Å; F305-I308 HydrophobicContact CB-CG1 4.04Å; F305-I308 HydrophobicContact CG-CD1 4.14Å; F305-I308 PolarHBondContact O-N 2.91Å; P306-I308 VanDerWaalsContact C-N 3.35Å; I308-Y310 HydrophobicContact CB-CE2 4.1Å; I308-Y310 VanDerWaalsContact O-CD2 3.22Å; I308-Y310 WeakPolarHBondContact O-CD2 3.34Å; I308-Y310 WeakPolarHBondContact O-CE2 3.48Å
309	N	93.1	Very high	93	Very high	118 Å²	118	57 Å²	57	63%	0.631	30%	0.3	S	S	*	.			trans	-85.2	134.1	170	-47.2	-68.1	0	0	0	110.6	Q262	Q262-N309 VanDerWaalsContact NE2-CB 3.31Å; Q262-N309 PolarHBondContact NE2-ND2 3.14Å; Q262-N309 PolarHBondContact NE2-O 3.34Å; Q262-N309 VanDerWaalsContact NE2-O 3.15Å; Q262-N309 PolarHBondContact OE1-ND2 3.36Å
310	Y	94.4	Very high	92.8	Very high	42 Å²	42	64.8 Å²	64.8	17%	0.165	34%	0.342	C	S	.	.			trans	-110.4	140.9	179.9	-59.5	-89.6	0	0	0	110.2	F265 L301 P302 F305 I308 F314 M315	F265-Y310 HydrophobicContact CB-CD1 3.85Å; F265-Y310 HydrophobicContact CB-CE1 4.23Å; F265-Y310 HydrophobicContact CD2-CD1 4.04Å; F265-Y310 AromaticContact CD2-CE1 3.52Å; F265-Y310 HydrophobicContact CD2-CE1 3.52Å; F265-Y310 HydrophobicContact CE2-CE1 4.02Å; F265-Y310 HydrophobicContact CG-CD1 4.04Å; F265-Y310 AromaticContact CG-CE1 3.98Å; F265-Y310 HydrophobicContact CG-CE1 3.98Å; L301-Y310 HydrophobicContact CB-CD1 4.29Å; L301-Y310 HydrophobicContact CB-CE1 3.42Å; L301-Y310 VanDerWaalsContact CB-CE1 3.42Å; L301-Y310 HydrophobicContact CD1-CD1 4.29Å; L301-Y310 HydrophobicContact CD1-CE1 3.88Å; L301-Y310 HydrophobicContact CG-CE1 4.29Å; L301-Y310 PolarHBondContact O-OH 2.9Å; P302-Y310 HydrophobicContact CB-CD2 4.49Å; P302-Y310 HydrophobicContact CB-CE2 4.02Å; P302-Y310 HydrophobicContact CG-CD2 3.89Å; P302-Y310 HydrophobicContact CG-CE2 3.75Å; F305-Y310 WeakPolarHBondContact CB-OH 3.34Å; F305-Y310 PolarHBondContact O-OH 3.42Å; I308-Y310 HydrophobicContact CB-CE2 4.1Å; I308-Y310 VanDerWaalsContact O-CD2 3.22Å; I308-Y310 WeakPolarHBondContact O-CD2 3.34Å; I308-Y310 WeakPolarHBondContact O-CE2 3.48Å; Y310-F314 HydrophobicContact CD1-CD1 4.31Å; Y310-M315 HydrophobicContact CD2-CE 4.25Å; Y310-M315 HydrophobicContact CG-CE 3.95Å
311	H	94.7	Very high	92.6	Very high	52 Å²	52	69 Å²	69	24%	0.241	37%	0.365	C	S	.	.			trans	-61.6	144.6	166.2	-171.7	-90.2	0	0	0	110.4	F265 I268 D313 F314	F265-H311 WeakPolarHBondContact O-CB 3.41Å; F265-H311 PolarHBondContact O-N 2.77Å; I268-H311 WeakPolarHBondContact CD1-CE1 3.37Å; I268-H311 VanDerWaalsContact CD1-NE2 3.33Å; I268-H311 WeakPolarHBondContact CD1-NE2 3.46Å; I268-H311 VanDerWaalsContact CG1-CE1 3.43Å; I268-H311 WeakPolarHBondContact CG1-CE1 3.44Å; I268-H311 WeakPolarHBondContact CG1-ND1 3.41Å; H311-D313 IonicContact CE1-OD2 2.99Å; H311-D313 PolarHBondContact CE1-OD2 2.74Å; H311-D313 PolarHBondContact ND1-N 3.45Å; H311-D313 VanDerWaalsContact ND1-N 3.19Å; H311-D313 IonicContact ND1-OD2 3.95Å; H311-D313 PolarHBondContact ND1-OD2 2.74Å; H311-D313 PolarHBondContact O-N 3.1Å; H311-D313 VanDerWaalsContact O-N 3.1Å; H311-F314 HydrophobicContact CB-CD2 4.08Å; H311-F314 HydrophobicContact CB-CE2 4.32Å; H311-F314 WeakPolarHBondContact O-CB 3.43Å; H311-F314 PolarHBondContact O-N 2.85Å
312	S	92	Very high	92.3	Very high	86 Å²	86	70.7 Å²	70.7	60%	0.601	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-57.7	-29.6	-174.8	55.8	0	0	0	0	113.9	F314 M315	S312-F314 PolarHBondContact O-N 2.76Å; S312-M315 PolarHBondContact O-N 3.46Å
313	D	90.3	Very high	92.1	Very high	65 Å²	65	73.2 Å²	73.2	35%	0.348	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-60.5	-23.5	176.6	-78.9	-36.2	0	0	0	113.9	H311 M315 K316	H311-D313 IonicContact CE1-OD2 2.99Å; H311-D313 PolarHBondContact CE1-OD2 2.74Å; H311-D313 PolarHBondContact ND1-N 3.45Å; H311-D313 VanDerWaalsContact ND1-N 3.19Å; H311-D313 IonicContact ND1-OD2 3.95Å; H311-D313 PolarHBondContact ND1-OD2 2.74Å; H311-D313 PolarHBondContact O-N 3.1Å; H311-D313 VanDerWaalsContact O-N 3.1Å; D313-M315 PolarHBondContact O-N 2.92Å; D313-K316 WeakPolarHBondContact O-CB 3.19Å; D313-K316 PolarHBondContact O-N 2.72Å
314	F	92	Very high	91.8	Very high	3 Å²	3	71.8 Å²	71.8	1%	0.013	38%	0.381	C	S	.	.	G	3₁₀ helix	trans	-68	-20.6	174.9	-76.5	-112.8	0	0	0	112.2	L123 F265 I273 P298 Y299 L301 Y310 H311 S312	L123-F314 HydrophobicContact CD1-CZ 4.44Å; L123-F314 HydrophobicContact CD2-CE1 4.35Å; L123-F314 HydrophobicContact CD2-CZ 4.34Å; F265-F314 HydrophobicContact CB-CE1 4.4Å; F265-F314 HydrophobicContact CB-CZ 4.28Å; F265-F314 HydrophobicContact CD1-CD1 4.46Å; F265-F314 AromaticContact CD1-CE1 3.48Å; F265-F314 HydrophobicContact CD1-CE1 3.48Å; F265-F314 VanDerWaalsContact CD1-CE1 3.48Å; F265-F314 AromaticContact CD1-CZ 3.74Å; F265-F314 HydrophobicContact CD1-CZ 3.74Å; F265-F314 HydrophobicContact CE1-CE1 4.08Å; F265-F314 HydrophobicContact CG-CE1 4.21Å; F265-F314 HydrophobicContact CG-CZ 4.42Å; I273-F314 HydrophobicContact CD1-CD2 4.22Å; I273-F314 HydrophobicContact CD1-CE1 3.94Å; I273-F314 HydrophobicContact CD1-CE2 3.53Å; I273-F314 HydrophobicContact CD1-CZ 3.36Å; P298-F314 CarbonylContact C-O 3.58Å; P298-F314 HydrophobicContact CB-CB 3.97Å; P298-F314 HydrophobicContact CB-CD1 3.71Å; P298-F314 HydrophobicContact CB-CG 4.15Å; P298-F314 VanDerWaalsContact CB-O 3.27Å; P298-F314 WeakPolarHBondContact CB-O 3.17Å; Y299-F314 PolarHBondContact N-O 2.99Å; L301-F314 HydrophobicContact CD1-CD1 3.77Å; L301-F314 HydrophobicContact CD1-CE1 3.97Å; Y310-F314 HydrophobicContact CD1-CD1 4.31Å; H311-F314 HydrophobicContact CB-CD2 4.08Å; H311-F314 HydrophobicContact CB-CE2 4.32Å; H311-F314 WeakPolarHBondContact O-CB 3.43Å; H311-F314 PolarHBondContact O-N 2.85Å; S312-F314 PolarHBondContact O-N 2.76Å
315	M	92.3	Very high	91.4	Very high	62 Å²	62	72.1 Å²	72.1	31%	0.305	38%	0.383	S	S	.	.	G	3₁₀ helix	trans	-100.5	-0.9	178.9	-52.7	-54	150.2	0	0	112.8	P302 Y310 S312 D313 D317 I318	P302-M315 HydrophobicContact CG-CE 3.27Å; P302-M315 HydrophobicContact CG-SD 4.18Å; Y310-M315 HydrophobicContact CD2-CE 4.25Å; Y310-M315 HydrophobicContact CG-CE 3.95Å; S312-M315 PolarHBondContact O-N 3.46Å; D313-M315 PolarHBondContact O-N 2.92Å; M315-D317 VanDerWaalsContact C-N 3.34Å; M315-D317 PolarHBondContact O-N 2.83Å; M315-I318 WeakPolarHBondContact O-CG2 3.18Å; M315-I318 PolarHBondContact O-N 3.2Å
316	K	89.5	Confident	91	Very high	143 Å²	143	72.7 Å²	72.7	62%	0.622	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	-30.8	-170.3	-173.3	174.5	-173.9	168.5	0	114.4	D313	D313-K316 WeakPolarHBondContact O-CB 3.19Å; D313-K316 PolarHBondContact O-N 2.72Å
317	D	88.5	Confident	90.7	Very high	60 Å²	60	71.1 Å²	71.1	32%	0.321	37%	0.373	S	S	.	.	T	Hydrogen-bonded Turn	trans	-104.7	20	-178.1	-64.2	-47.4	0	0	0	112.4	K126 K272 Y299 M315 P319	K126-D317 WeakPolarHBondContact CE-OD2 3.29Å; K126-D317 VanDerWaalsContact NZ-CG 3.31Å; K126-D317 IonicContact NZ-OD1 2.65Å; K126-D317 IonicContact NZ-OD2 3.87Å; K126-D317 PolarHBondContact NZ-OD2 3.25Å; K272-D317 WeakPolarHBondContact CE-OD1 3.23Å; K272-D317 WeakPolarHBondContact CE-OD2 3.35Å; K272-D317 IonicContact NZ-OD1 3.58Å; K272-D317 PolarHBondContact NZ-OD1 2.82Å; K272-D317 IonicContact NZ-OD2 3.2Å; K272-D317 PolarHBondContact NZ-OD2 2.9Å; Y299-D317 WeakPolarHBondContact CE1-O 3.44Å; M315-D317 VanDerWaalsContact C-N 3.34Å; M315-D317 PolarHBondContact O-N 2.83Å; D317-P319 WeakPolarHBondContact O-CD 3.41Å
318	I	92	Very high	90.3	Very high	78 Å²	78	65 Å²	65	40%	0.4	34%	0.34	S	S	.	.			trans	-63.1	128.2	174	-166.1	170.6	0	0	0	109.9	Y299 M315 Y322	Y299-I318 HydrophobicContact CD1-CB 4.5Å; Y299-I318 HydrophobicContact CD2-CG1 4.3Å; Y299-I318 HydrophobicContact CG-CB 4.2Å; Y299-I318 HydrophobicContact CG-CG1 4.2Å; M315-I318 WeakPolarHBondContact O-CG2 3.18Å; M315-I318 PolarHBondContact O-N 3.2Å; I318-Y322 HydrophobicContact CD1-CD1 3.79Å; I318-Y322 HydrophobicContact CD1-CE1 4.43Å; I318-Y322 HydrophobicContact CD1-CG 4.26Å; I318-Y322 HydrophobicContact CG1-CD1 3.97Å; I318-Y322 HydrophobicContact CG1-CG 3.93Å
319	P	90.6	Very high	89.8	Confident	36 Å²	36	64.6 Å²	64.6	23%	0.234	34%	0.337	C	S	.	.			trans	-64.7	146.8	174	-22.6	32.8	0	0	0	112.7	D317 D321 Y322	D317-P319 WeakPolarHBondContact O-CD 3.41Å; P319-D321 WeakPolarHBondContact CB-OD1 3.48Å; P319-D321 PolarHBondContact O-N 3.23Å; P319-Y322 WeakPolarHBondContact O-CB 3.43Å; P319-Y322 PolarHBondContact O-N 2.7Å; P319-Y322 VanDerWaalsContact O-N 3.08Å
320	D	89.9	Confident	89.4	Confident	181 Å²	181	62.1 Å²	62.1	97%	0.968	32%	0.322	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-29.2	178.1	-66.4	-37.1	0	0	0	112.7
321	D	89.5	Confident	88.8	Confident	88 Å²	88	63 Å²	63	47%	0.471	33%	0.327	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95	10.9	177.3	68.2	-44.3	0	0	0	113.2	P319 T323 Q331	P319-D321 WeakPolarHBondContact CB-OD1 3.48Å; P319-D321 PolarHBondContact O-N 3.23Å; D321-T323 PolarHBondContact O-N 2.94Å; D321-Q331 PolarHBondContact OD2-NE2 3.31Å; D321-Q331 PolarHBondContact OD2-OE1 3.49Å
322	Y	90.7	Very high	88.1	Confident	36 Å²	36	62.4 Å²	62.4	14%	0.141	32%	0.324	C	S	.	.			trans	-66	123.4	177.6	-173.7	-97	0	0	0	111.1	Y299 M300 E303 I318 P319 Y325 E328	Y299-Y322 AromaticContact CD2-CD2 3.91Å; Y299-Y322 HydrophobicContact CD2-CD2 3.91Å; Y299-Y322 HydrophobicContact CD2-CE1 4.41Å; Y299-Y322 AromaticContact CD2-CE2 3.57Å; Y299-Y322 HydrophobicContact CD2-CE2 3.57Å; Y299-Y322 HydrophobicContact CD2-CG 4.44Å; Y299-Y322 AromaticContact CD2-CZ 3.83Å; Y299-Y322 AromaticContact CE2-CD2 3.7Å; Y299-Y322 HydrophobicContact CE2-CD2 3.7Å; Y299-Y322 AromaticContact CE2-CE2 3.48Å; Y299-Y322 HydrophobicContact CE2-CE2 3.48Å; Y299-Y322 VanDerWaalsContact CE2-CE2 3.48Å; M300-Y322 HydrophobicContact CG-CE2 4.4Å; M300-Y322 WeakPolarHBondContact CG-OH 3.45Å; E303-Y322 VanDerWaalsContact OE1-CE1 3.24Å; E303-Y322 WeakPolarHBondContact OE1-CE1 3.47Å; E303-Y322 PolarHBondContact OE1-OH 3.05Å; I318-Y322 HydrophobicContact CD1-CD1 3.79Å; I318-Y322 HydrophobicContact CD1-CE1 4.43Å; I318-Y322 HydrophobicContact CD1-CG 4.26Å; I318-Y322 HydrophobicContact CG1-CD1 3.97Å; I318-Y322 HydrophobicContact CG1-CG 3.93Å; P319-Y322 WeakPolarHBondContact O-CB 3.43Å; P319-Y322 PolarHBondContact O-N 2.7Å; P319-Y322 VanDerWaalsContact O-N 3.08Å; Y322-Y325 WeakPolarHBondContact OH-CA 3.47Å; Y322-Y325 PolarHBondContact OH-N 3.12Å; Y322-E328 HydrophobicContact CD2-CB 3.89Å; Y322-E328 HydrophobicContact CD2-CG 4.08Å; Y322-E328 HydrophobicContact CE2-CB 3.61Å; Y322-E328 HydrophobicContact CE2-CG 3.9Å
323	T	89.6	Confident	87.4	Confident	95 Å²	95	60.1 Å²	60.1	58%	0.583	30%	0.303	S	S	*	.			trans	-111	-46.9	176.4	58.5	0	0	0	0	112.7	D321 N327	D321-T323 PolarHBondContact O-N 2.94Å; T323-N327 WeakPolarHBondContact OG1-CB 3.2Å; T323-N327 PolarHBondContact OG1-ND2 3.31Å
324	D	89.2	Confident	86.9	Confident	51 Å²	51	60.1 Å²	60.1	27%	0.273	31%	0.312	S	S	.	.			trans	-162	165.2	-178.6	58.6	35.8	0	0	0	108.9	E303 I326 N327 E328	E303-D324 WeakPolarHBondContact OE2-CA 3.48Å; D324-I326 PolarHBondContact O-N 2.93Å; D324-I326 WeakPolarHBondContact OD1-CB 3.36Å; D324-I326 PolarHBondContact OD1-N 3.29Å; D324-I326 VanDerWaalsContact OD1-N 3.14Å; D324-N327 PolarHBondContact O-N 3.01Å; D324-N327 WeakPolarHBondContact OD1-CB 3.41Å; D324-N327 PolarHBondContact OD1-N 3.19Å; D324-N327 PolarHBondContact OD1-ND2 2.97Å; D324-E328 PolarHBondContact O-N 2.99Å
325	Y	86.8	Confident	86.1	Confident	48 Å²	48	67 Å²	67	19%	0.188	34%	0.342	C	S	.	.	H	α-helix	trans	-61.5	-27.2	-180	78.6	-86.3	0	0	0	112.6	E303 W304 Y322 I329	E303-Y325 WeakPolarHBondContact OE2-CD1 3.3Å; E303-Y325 PolarHBondContact OE2-N 2.94Å; E303-Y325 VanDerWaalsContact OE2-N 3.07Å; W304-Y325 HydrophobicContact CZ2-CD2 4.24Å; W304-Y325 HydrophobicContact CZ2-CE1 4.1Å; W304-Y325 AromaticContact CZ2-CE2 3.61Å; W304-Y325 HydrophobicContact CZ2-CE2 3.61Å; W304-Y325 AromaticContact CZ2-CZ 3.53Å; W304-Y325 AromaticContact NE1-CG 3.95Å; Y322-Y325 WeakPolarHBondContact OH-CA 3.47Å; Y322-Y325 PolarHBondContact OH-N 3.12Å; Y325-I329 HydrophobicContact CD2-CD1 3.78Å; Y325-I329 HydrophobicContact CE2-CD1 4.46Å; Y325-I329 WeakPolarHBondContact O-CB 3.47Å; Y325-I329 WeakPolarHBondContact O-CD1 3.33Å; Y325-I329 WeakPolarHBondContact O-CG1 3.26Å; Y325-I329 PolarHBondContact O-N 3.47Å
326	I	86.1	Confident	84.7	Confident	29 Å²	29	66.7 Å²	66.7	15%	0.149	34%	0.341	C	S	.	.	H	α-helix	trans	-68.5	-49.4	-176.6	-72.7	174.7	0	0	0	110.9	D324 Q330	D324-I326 PolarHBondContact O-N 2.93Å; D324-I326 WeakPolarHBondContact OD1-CB 3.36Å; D324-I326 PolarHBondContact OD1-N 3.29Å; D324-I326 VanDerWaalsContact OD1-N 3.14Å; I326-Q330 WeakPolarHBondContact O-CG 3.33Å; I326-Q330 PolarHBondContact O-N 2.9Å; I326-Q330 VanDerWaalsContact O-N 3.14Å
327	N	86.2	Confident	83.2	Confident	63 Å²	63	62.8 Å²	62.8	34%	0.337	33%	0.332	S	S	.	.	H	α-helix	trans	-68.9	-39.3	-179.6	-70.6	-24.2	0	0	0	110.3	T323 D324 I329 Q330 Q331	T323-N327 WeakPolarHBondContact OG1-CB 3.2Å; T323-N327 PolarHBondContact OG1-ND2 3.31Å; D324-N327 PolarHBondContact O-N 3.01Å; D324-N327 WeakPolarHBondContact OD1-CB 3.41Å; D324-N327 PolarHBondContact OD1-N 3.19Å; D324-N327 PolarHBondContact OD1-ND2 2.97Å; N327-I329 PolarHBondContact O-N 3.32Å; N327-Q330 PolarHBondContact O-N 3.27Å; N327-Q331 WeakPolarHBondContact O-CG 3.36Å; N327-Q331 PolarHBondContact O-N 2.79Å
328	E	84.7	Confident	81.4	Confident	20 Å²	20	65.4 Å²	65.4	9%	0.093	35%	0.352	C	S	.	.	H	α-helix	trans	-60.2	-46.4	175.8	-178.8	68.9	179	0	0	112.2	Y299 M300 Y322 D324 Q330 Q331 Y332	Y299-E328 HydrophobicContact CE2-CG 4.12Å; Y299-E328 PolarHBondContact OH-OE1 3.43Å; M300-E328 HydrophobicContact CE-CB 3.83Å; M300-E328 HydrophobicContact CE-CG 3.29Å; Y322-E328 HydrophobicContact CD2-CB 3.89Å; Y322-E328 HydrophobicContact CD2-CG 4.08Å; Y322-E328 HydrophobicContact CE2-CB 3.61Å; Y322-E328 HydrophobicContact CE2-CG 3.9Å; D324-E328 PolarHBondContact O-N 2.99Å; E328-Q330 VanDerWaalsContact C-N 3.32Å; E328-Q330 PolarHBondContact O-N 3.16Å; E328-Q331 PolarHBondContact O-N 3.42Å; E328-Y332 WeakPolarHBondContact O-CB 3.4Å; E328-Y332 PolarHBondContact O-N 3.46Å
329	I	84.3	Confident	79.3	Confident	0 Å²	0	70.6 Å²	70.6	0%	0	37%	0.371	C	S	.	.	H	α-helix	trans	-59.8	-44.4	176.1	-71.6	169.3	0	0	0	110.7	W107 L109 M300 Y325 N327 Q331 Y332 E333	W107-I329 HydrophobicContact CB-CD1 3.86Å; W107-I329 HydrophobicContact CB-CG1 4.47Å; W107-I329 HydrophobicContact CD2-CD1 3.9Å; W107-I329 HydrophobicContact CD2-CG1 3.6Å; W107-I329 HydrophobicContact CD2-CG2 4.35Å; W107-I329 HydrophobicContact CE3-CD1 4.04Å; W107-I329 HydrophobicContact CE3-CG1 3.84Å; W107-I329 HydrophobicContact CG-CD1 3.83Å; W107-I329 HydrophobicContact CG-CG1 3.89Å; W107-I329 HydrophobicContact CG-CG2 3.97Å; W107-I329 HydrophobicContact CZ2-CG1 4.4Å; W107-I329 HydrophobicContact CZ3-CG1 4.32Å; L109-I329 HydrophobicContact CD2-CD1 3.67Å; M300-I329 HydrophobicContact CE-CG1 4.36Å; Y325-I329 HydrophobicContact CD2-CD1 3.78Å; Y325-I329 HydrophobicContact CE2-CD1 4.46Å; Y325-I329 WeakPolarHBondContact O-CB 3.47Å; Y325-I329 WeakPolarHBondContact O-CD1 3.33Å; Y325-I329 WeakPolarHBondContact O-CG1 3.26Å; Y325-I329 PolarHBondContact O-N 3.47Å; N327-I329 PolarHBondContact O-N 3.32Å; I329-Q331 PolarHBondContact O-N 3.38Å; I329-Y332 PolarHBondContact O-N 3.22Å; I329-E333 HydrophobicContact CG2-CG 4.47Å; I329-E333 WeakPolarHBondContact CG2-OE1 3.45Å; I329-E333 WeakPolarHBondContact O-CB 3.36Å; I329-E333 VanDerWaalsContact O-CG 3.27Å; I329-E333 WeakPolarHBondContact O-CG 3.4Å; I329-E333 PolarHBondContact O-N 3.36Å
330	Q	84.1	Confident	76.8	Confident	67 Å²	67	74.7 Å²	74.7	31%	0.313	40%	0.398	S	S	.	.	H	α-helix	trans	-63.5	-40.7	177.8	-71.9	175.6	23.8	0	0	112.2	I326 N327 E328 A334	I326-Q330 WeakPolarHBondContact O-CG 3.33Å; I326-Q330 PolarHBondContact O-N 2.9Å; I326-Q330 VanDerWaalsContact O-N 3.14Å; N327-Q330 PolarHBondContact O-N 3.27Å; E328-Q330 VanDerWaalsContact C-N 3.32Å; E328-Q330 PolarHBondContact O-N 3.16Å; Q330-A334 WeakPolarHBondContact O-CB 3.46Å; Q330-A334 PolarHBondContact O-N 3.25Å
331	Q	82.8	Confident	74.4	Confident	59 Å²	59	73.7 Å²	73.7	28%	0.276	39%	0.392	S	S	.	.	H	α-helix	trans	-65.6	-41.9	176.2	-72.6	-165.9	20.8	0	0	112	D321 N327 E328 I329 A334 K335	D321-Q331 PolarHBondContact OD2-NE2 3.31Å; D321-Q331 PolarHBondContact OD2-OE1 3.49Å; N327-Q331 WeakPolarHBondContact O-CG 3.36Å; N327-Q331 PolarHBondContact O-N 2.79Å; E328-Q331 PolarHBondContact O-N 3.42Å; I329-Q331 PolarHBondContact O-N 3.38Å; Q331-A334 PolarHBondContact O-N 3.29Å; Q331-K335 VanDerWaalsContact O-CG 3.29Å; Q331-K335 WeakPolarHBondContact O-CG 3.39Å; Q331-K335 PolarHBondContact O-N 3.1Å; Q331-K335 VanDerWaalsContact O-N 3.07Å
332	Y	79.9	Confident	72.2	Confident	41 Å²	41	74.9 Å²	74.9	16%	0.161	40%	0.404	C	S	.	.	H	α-helix	trans	-59.2	-50.7	176.8	-173.7	-86.9	0	0	0	110.7	T13 D15 W107 E328 I329 A334 K335 M336	T13-Y332 HydrophobicContact CG2-CE2 4.33Å; D15-Y332 PolarHBondContact OD1-OH 2.95Å; W107-Y332 AromaticContact CZ2-CD1 3.81Å; W107-Y332 HydrophobicContact CZ2-CD1 3.81Å; W107-Y332 HydrophobicContact CZ2-CD2 4.35Å; W107-Y332 HydrophobicContact CZ2-CE1 4.28Å; W107-Y332 AromaticContact CZ2-CG 3.86Å; W107-Y332 HydrophobicContact CZ2-CG 3.86Å; E328-Y332 WeakPolarHBondContact O-CB 3.4Å; E328-Y332 PolarHBondContact O-N 3.46Å; I329-Y332 PolarHBondContact O-N 3.22Å; Y332-A334 PolarHBondContact O-N 3.38Å; Y332-K335 WeakPolarHBondContact O-CB 3.17Å; Y332-K335 PolarHBondContact O-N 3.3Å; Y332-K335 VanDerWaalsContact O-N 3.12Å; Y332-M336 HydrophobicContact CD1-CG 3.91Å; Y332-M336 HydrophobicContact CE1-CG 3.57Å; Y332-M336 HydrophobicContact CE1-SD 4.22Å; Y332-M336 WeakPolarHBondContact O-CG 3.34Å; Y332-M336 PolarHBondContact O-N 2.87Å
333	E	76.2	Confident	69.8	Low	37 Å²	37	78 Å²	78	17%	0.173	43%	0.432	C	S	.	.	H	α-helix	trans	-64	-39.2	179.6	-70	170.6	174.7	0	0	112.3	R41 I329 K335 M336 S337	R41-E333 IonicContact CZ-OE1 3.94Å; R41-E333 IonicContact CZ-OE2 3.84Å; R41-E333 IonicContact NH1-OE1 2.71Å; R41-E333 PolarHBondContact NH1-OE1 2.82Å; R41-E333 IonicContact NH1-OE2 3.96Å; R41-E333 PolarHBondContact NH1-OE2 3.38Å; R41-E333 IonicContact NH2-OE1 3.1Å; R41-E333 PolarHBondContact NH2-OE1 3.04Å; R41-E333 IonicContact NH2-OE2 2.7Å; R41-E333 PolarHBondContact NH2-OE2 3Å; I329-E333 HydrophobicContact CG2-CG 4.47Å; I329-E333 WeakPolarHBondContact CG2-OE1 3.45Å; I329-E333 WeakPolarHBondContact O-CB 3.36Å; I329-E333 VanDerWaalsContact O-CG 3.27Å; I329-E333 WeakPolarHBondContact O-CG 3.4Å; I329-E333 PolarHBondContact O-N 3.36Å; E333-K335 VanDerWaalsContact C-N 3.27Å; E333-K335 PolarHBondContact O-N 3.26Å; E333-M336 PolarHBondContact O-N 2.84Å; E333-S337 PolarHBondContact O-N 3.26Å
334	A	79.3	Confident	67.7	Low	65 Å²	65	80.4 Å²	80.4	54%	0.537	45%	0.445	S	S	.	.	H	α-helix	trans	-62.6	-35.2	174.6	0	0	0	0	0	112.3	Q330 Q331 Y332 S337	Q330-A334 WeakPolarHBondContact O-CB 3.46Å; Q330-A334 PolarHBondContact O-N 3.25Å; Q331-A334 PolarHBondContact O-N 3.29Å; Y332-A334 PolarHBondContact O-N 3.38Å; A334-S337 PolarHBondContact O-OG 2.9Å
335	K	75.3	Confident	65.9	Low	147 Å²	147	88.5 Å²	88.5	64%	0.639	49%	0.487	S	S	*	.	H	α-helix	trans	-72	-34.4	176.2	-71.6	165.8	-174	163.3	0	112.3	Q331 Y332 E333	Q331-K335 VanDerWaalsContact O-CG 3.29Å; Q331-K335 WeakPolarHBondContact O-CG 3.39Å; Q331-K335 PolarHBondContact O-N 3.1Å; Q331-K335 VanDerWaalsContact O-N 3.07Å; Y332-K335 WeakPolarHBondContact O-CB 3.17Å; Y332-K335 PolarHBondContact O-N 3.3Å; Y332-K335 VanDerWaalsContact O-N 3.12Å; E333-K335 VanDerWaalsContact C-N 3.27Å; E333-K335 PolarHBondContact O-N 3.26Å
336	M	62.8	Low	64.8	Low	57 Å²	57	90.6 Å²	90.6	28%	0.281	50%	0.501	S	S	.	.	H	α-helix	trans	-81.8	-27.5	179.8	-64.5	-72.8	82.4	0	0	113.4	D11 E18 Y332 E333	D11-M336 WeakPolarHBondContact OD1-CE 3.02Å; E18-M336 WeakPolarHBondContact OE1-CB 3.35Å; Y332-M336 HydrophobicContact CD1-CG 3.91Å; Y332-M336 HydrophobicContact CE1-CG 3.57Å; Y332-M336 HydrophobicContact CE1-SD 4.22Å; Y332-M336 WeakPolarHBondContact O-CG 3.34Å; Y332-M336 PolarHBondContact O-N 2.87Å; E333-M336 PolarHBondContact O-N 2.84Å
337	S	57.8	Low	63.7	Low	61 Å²	61	93.8 Å²	93.8	43%	0.427	52%	0.52	S	S	.	.	S	Bend	trans	-57.3	128.1	175.6	70.6	0	0	0	0	110.3	E333 A334 K339	E333-S337 PolarHBondContact O-N 3.26Å; A334-S337 PolarHBondContact O-OG 2.9Å; S337-K339 PolarHBondContact O-N 3.21Å; S337-K339 VanDerWaalsContact O-N 3.07Å
338	P	51.8	Low	62.4	Low	114 Å²	114	95.5 Å²	95.5	74%	0.74	53%	0.53	S	S	*	.	P	Polyproline II helix	trans	-59.6	121	-178.8	20.1	-29.3	0	0	0	109
339	K	47.4	Very low	61.1	Low	188 Å²	188	99.9 Å²	99.9	82%	0.817	56%	0.556	S	S	*	*	P	Polyproline II helix	trans	-52.2	127.8	171.8	-73.7	-178.6	179.3	175.7	0	107.6	S337 L341	S337-K339 PolarHBondContact O-N 3.21Å; S337-K339 VanDerWaalsContact O-N 3.07Å; K339-L341 PolarHBondContact O-N 3.2Å; K339-L341 VanDerWaalsContact O-N 3.16Å
340	P	39.3	Very low	59.7	Low	121 Å²	121	106.2 Å²	106.2	79%	0.786	59%	0.591	S	S	*	*	P	Polyproline II helix	trans	-54.5	128.5	178.2	19.4	-29.3	0	0	0	108.5
341	L	39.3	Very low	58.1	Low	161 Å²	161	108.8 Å²	108.8	84%	0.843	61%	0.609	S	S	*	*	P	Polyproline II helix	trans	-49.6	129.1	176.4	-77.5	160.5	0	0	0	107.8	K339 S343	K339-L341 PolarHBondContact O-N 3.2Å; K339-L341 VanDerWaalsContact O-N 3.16Å; L341-S343 PolarHBondContact O-N 2.97Å; L341-S343 VanDerWaalsContact O-N 3.14Å
342	P	42.2	Very low	56.3	Low	113 Å²	113	112.4 Å²	112.4	73%	0.734	63%	0.633	S	S	*	*	P	Polyproline II helix	trans	-55.4	127.5	178	20.8	-29.4	0	0	0	107.8	V344	P342-V344 PolarHBondContact O-N 2.99Å
343	S	41.1	Very low	54.5	Low	102 Å²	102	117.8 Å²	117.8	71%	0.713	67%	0.669	S	S	*	*			trans	-55.3	109.1	174.9	47.4	0	0	0	0	107.7	L341 I345	L341-S343 PolarHBondContact O-N 2.97Å; L341-S343 VanDerWaalsContact O-N 3.14Å; S343-I345 PolarHBondContact O-N 2.69Å; S343-I345 VanDerWaalsContact O-N 3.08Å
344	V	45.9	Very low	52.7	Low	144 Å²	144	124.6 Å²	124.6	87%	0.873	71%	0.711	S	S	*	*			trans	-65.9	109.2	166.7	-177.5	0	0	0	0	105.2	P342	P342-V344 PolarHBondContact O-N 2.99Å
345	I	49.9	Very low	50.2	Low	222 Å²	222	130 Å²	130	100%	1.138	73%	0.726	S	S	*	*			trans	-70.7	0	170.2	-63.7	176.2	0	0	0	108.6	S343	S343-I345 PolarHBondContact O-N 2.69Å; S343-I345 VanDerWaalsContact O-N 3.08Å

Retrieved 345 of 345 residues in 134.4 ms (Link to these results)

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