A0A093H997_STRCA Loading...

DNA repair protein RAD51 homolog

Plays an important role in homologous strand exchange, a key step in DNA repair through homologous recombination (HR). Binds to single-stranded DNA in an ATP-dependent manner to form nucleoprotein filaments which are essential for the homology search and strand exchange. Catalyzes the recognition of homology and strand exchange between homologous DNA partners to form a joint molecule between a processed DNA break and the repair template. Recruited to resolve stalled replication forks during replication stress. Also involved in interstrand cross-link repair.

AlphaFold DB , UniProt , Accession A0A093H997, Species STRCA (Struthio camelus australis), Gene n/a, Length 339 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.7	Very low	30.5	Very low	255 Å²	255	158.9 Å²	158.9	100%	1.256	86%	0.856	S	S	*	*				0	87.1	0	-154.4	168.1	-174.5	0	0	106.4
2	A	29.6	Very low	30.6	Very low	100 Å²	100	158.2 Å²	158.2	83%	0.826	85%	0.852	S	S	*	*			trans	-131.8	115.1	179.1	0	0	0	0	0	106.1
3	M	30.9	Very low	30.4	Very low	183 Å²	183	155.8 Å²	155.8	90%	0.901	85%	0.846	S	S	*	*			trans	-79.2	117.3	-168.6	-158.3	171.5	-180	0	0	108.5	V5	M3-V5 PolarHBondContact O-N 3.47Å
4	Q	30	Very low	30.3	Very low	184 Å²	184	152.2 Å²	152.2	86%	0.86	84%	0.838	S	S	*	*			trans	-73.6	117.3	167.3	-83.7	174	-29	0	0	108.2
5	V	32.6	Very low	30.4	Very low	111 Å²	111	147.7 Å²	147.7	67%	0.673	83%	0.829	S	S	*	*			trans	-99.4	106	166.5	179.8	0	0	0	0	106.5	M3 Y7	M3-V5 PolarHBondContact O-N 3.47Å; V5-Y7 HydrophobicContact CG1-CD2 4.3Å; V5-Y7 HydrophobicContact CG1-CE2 4.35Å
6	Q	28.3	Very low	30.6	Very low	178 Å²	178	149.7 Å²	149.7	83%	0.832	83%	0.83	S	S	*	*			trans	-73.6	119.8	167.5	-74.6	174.7	-39.4	0	0	107.8
7	Y	28.6	Very low	30.7	Very low	221 Å²	221	151.9 Å²	151.9	87%	0.867	83%	0.833	S	S	*	*			trans	-84.9	109.5	166.7	-99.9	-95.2	0	0	0	108	V5 A9	V5-Y7 HydrophobicContact CG1-CD2 4.3Å; V5-Y7 HydrophobicContact CG1-CE2 4.35Å; Y7-A9 PolarHBondContact O-N 3.47Å
8	E	28.4	Very low	31.1	Very low	171 Å²	171	152 Å²	152	80%	0.799	83%	0.826	S	S	*	*			trans	-70.1	119.5	166.3	-72.7	176.4	156.5	0	0	108.8	N10	E8-N10 PolarHBondContact O-N 3.23Å
9	A	29.8	Very low	31.7	Very low	97 Å²	97	148.6 Å²	148.6	80%	0.802	82%	0.815	S	S	*	*			trans	-81.1	92.3	172.4	0	0	0	0	0	109.3	Y7 A11	Y7-A9 PolarHBondContact O-N 3.47Å; A9-A11 PolarHBondContact O-N 3.31Å
10	N	28.3	Very low	32.8	Very low	154 Å²	154	149.7 Å²	149.7	82%	0.824	81%	0.811	S	S	*	*			trans	-80.2	92.2	158.1	-83.5	-20.1	0	0	0	108	E8 D12	E8-N10 PolarHBondContact O-N 3.23Å; N10-D12 PolarHBondContact O-N 3.28Å
11	A	31.1	Very low	34.6	Very low	94 Å²	94	144.4 Å²	144.4	78%	0.777	79%	0.792	S	S	*	*			trans	-84.8	87.1	166.2	0	0	0	0	0	108.3	A9	A9-A11 PolarHBondContact O-N 3.31Å
12	D	32.1	Very low	36.7	Very low	150 Å²	150	133.9 Å²	133.9	80%	0.802	74%	0.742	S	S	*	*			trans	-129.2	78.2	161.9	-143.5	4.8	0	0	0	107.3	N10	N10-D12 PolarHBondContact O-N 3.28Å
13	T	28.5	Very low	39.7	Very low	127 Å²	127	130.5 Å²	130.5	78%	0.779	71%	0.71	S	S	*	*			trans	-125.9	77.6	168.2	50.2	0	0	0	0	107.2	A15	T13-A15 PolarHBondContact O-N 2.93Å
14	S	28.7	Very low	42.7	Very low	106 Å²	106	125.9 Å²	125.9	74%	0.741	69%	0.688	S	S	*	*			trans	-66	78.5	145.8	57.3	0	0	0	0	106.7	E16	S14-E16 PolarHBondContact O-N 3.06Å
15	A	31.8	Very low	45.7	Very low	84 Å²	84	117.2 Å²	117.2	69%	0.694	65%	0.648	S	S	*	*			trans	-61.3	109.6	162.5	0	0	0	0	0	105.1	T13 E17	T13-A15 PolarHBondContact O-N 2.93Å; A15-E17 PolarHBondContact O-N 2.81Å
16	E	33.2	Very low	48.6	Very low	180 Å²	180	114.6 Å²	114.6	84%	0.841	63%	0.634	S	S	*	*			trans	-50.3	111.2	162.3	-67.6	178	164.7	0	0	105.5	S14 E18	S14-E16 PolarHBondContact O-N 3.06Å; E16-E18 PolarHBondContact O-N 2.97Å
17	E	32	Very low	51.8	Low	188 Å²	188	111.2 Å²	111.2	88%	0.879	61%	0.614	S	S	*	*			trans	-57.2	99.2	166.1	-72.5	178.3	165.4	0	0	105.2	A15 S19	A15-E17 PolarHBondContact O-N 2.81Å; E17-S19 VanDerWaalsContact C-N 3.32Å; E17-S19 PolarHBondContact O-N 2.78Å
18	E	38.5	Very low	54.9	Low	153 Å²	153	100.7 Å²	100.7	72%	0.715	57%	0.573	S	S	*	*			trans	-54.4	106.2	168	-84.1	-176.3	155.6	0	0	105.6	E16 F20	E16-E18 PolarHBondContact O-N 2.97Å; E18-F20 VanDerWaalsContact C-N 3.28Å; E18-F20 HydrophobicContact CB-CD2 4.41Å; E18-F20 HydrophobicContact CB-CE2 4.03Å; E18-F20 WeakPolarHBondContact O-CD2 3.39Å; E18-F20 PolarHBondContact O-N 2.84Å
19	S	42.9	Very low	58.1	Low	87 Å²	87	96.8 Å²	96.8	61%	0.608	55%	0.554	S	S	*	*			trans	-64.5	90.5	-178.5	167.9	0	0	0	0	108.3	E17 G21	E17-S19 VanDerWaalsContact C-N 3.32Å; E17-S19 PolarHBondContact O-N 2.78Å; S19-G21 VanDerWaalsContact C-N 3.31Å; S19-G21 PolarHBondContact O-N 2.71Å
20	F	53.6	Low	61	Low	170 Å²	170	99.9 Å²	99.9	75%	0.746	55%	0.552	S	S	*	*			trans	-69.3	88.9	171.2	-77.2	-85.4	0	0	0	108.9	E18	E18-F20 VanDerWaalsContact C-N 3.28Å; E18-F20 HydrophobicContact CB-CD2 4.41Å; E18-F20 HydrophobicContact CB-CE2 4.03Å; E18-F20 WeakPolarHBondContact O-CD2 3.39Å; E18-F20 PolarHBondContact O-N 2.84Å
21	G	69.6	Low	64	Low	40 Å²	40	94.2 Å²	94.2	41%	0.412	53%	0.525	S	S	.	.	S	Bend	trans	160.3	167.6	179	0	0	0	0	0	111.9	S19	S19-G21 VanDerWaalsContact C-N 3.31Å; S19-G21 PolarHBondContact O-N 2.71Å
22	P	83.1	Confident	66.9	Low	33 Å²	33	91.8 Å²	91.8	21%	0.214	51%	0.508	C	S	.	.	P	Polyproline II helix	trans	-58.9	144.8	177.6	21	-29.2	0	0	0	111.5	L24 T48 E258 F259	P22-L24 PolarHBondContact O-N 3.29Å; P22-T48 HydrophobicContact CB-CG2 3.62Å; P22-T48 HydrophobicContact CG-CG2 4.23Å; P22-E258 WeakPolarHBondContact CB-O 3.28Å; P22-F259 HydrophobicContact CB-CD1 4.47Å; P22-F259 HydrophobicContact CG-CD1 3.58Å; P22-F259 HydrophobicContact CG-CE1 3.95Å; P22-F259 HydrophobicContact CG-CG 4.48Å
23	Q	91.1	Very high	70	Confident	30 Å²	30	85.2 Å²	85.2	14%	0.14	47%	0.473	C	S	.	.	P	Polyproline II helix	trans	-80.1	121.5	177.7	-60.7	177.4	54.6	0	0	109	R27 T48 V49 E50 L81	Q23-R27 VanDerWaalsContact CD-NH1 3.28Å; Q23-T48 CarbonylContact O-C 3.45Å; Q23-T48 WeakPolarHBondContact O-CA 3.12Å; Q23-T48 VanDerWaalsContact O-CB 3.31Å; Q23-T48 WeakPolarHBondContact O-CB 3.46Å; Q23-V49 HydrophobicContact CB-CB 4.05Å; Q23-V49 HydrophobicContact CB-CG2 3.77Å; Q23-V49 PolarHBondContact O-N 3.23Å; Q23-E50 PolarHBondContact N-OE1 2.71Å; Q23-E50 PolarHBondContact N-OE2 2.98Å; Q23-L81 PolarHBondContact NE2-O 3.07Å
24	L	94.1	Very high	73.2	Confident	85 Å²	85	83.5 Å²	83.5	45%	0.445	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-60.1	143.9	177.8	-62.6	-179.4	0	0	0	111.6	P22 S26 R27 A212	P22-L24 PolarHBondContact O-N 3.29Å; L24-S26 PolarHBondContact O-N 3.16Å; L24-S26 VanDerWaalsContact O-N 3.13Å; L24-R27 VanDerWaalsContact O-CB 3.25Å; L24-R27 WeakPolarHBondContact O-CB 3.33Å; L24-R27 PolarHBondContact O-N 3.1Å; L24-A212 HydrophobicContact CD2-CB 4.09Å
25	I	94.3	Very high	76.5	Confident	3 Å²	3	80.7 Å²	80.7	2%	0.015	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-24.5	-176.3	-163	167.4	0	0	0	113.7	R27 L28 V38 L41 E42 F46 H47 V52	I25-R27 PolarHBondContact O-N 3.11Å; I25-R27 VanDerWaalsContact O-N 3.1Å; I25-L28 HydrophobicContact CG1-CD1 3.87Å; I25-L28 VanDerWaalsContact O-CB 3.32Å; I25-L28 WeakPolarHBondContact O-CB 3.42Å; I25-L28 PolarHBondContact O-N 3.13Å; I25-V38 HydrophobicContact CG1-CG1 4.25Å; I25-V38 HydrophobicContact CG2-CG1 4Å; I25-L41 HydrophobicContact CD1-CB 3.44Å; I25-L41 VanDerWaalsContact CD1-CB 3.44Å; I25-L41 HydrophobicContact CD1-CD1 3.85Å; I25-L41 HydrophobicContact CD1-CG 4.27Å; I25-E42 HydrophobicContact CG2-CG 3.64Å; I25-E42 WeakPolarHBondContact CG2-OE1 3.25Å; I25-F46 HydrophobicContact CD1-CB 3.83Å; I25-F46 WeakPolarHBondContact CD1-O 3.44Å; I25-H47 WeakPolarHBondContact CB-O 3.47Å; I25-H47 PolarHBondContact N-O 3.18Å; I25-V52 HydrophobicContact CD1-CG2 3.78Å; I25-V52 HydrophobicContact CG1-CG2 4.36Å
26	S	93.1	Very high	79.5	Confident	56 Å²	56	81.9 Å²	81.9	39%	0.392	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.9	-23.2	172.9	56.3	0	0	0	0	113.1	L24 L28 E29	L24-S26 PolarHBondContact O-N 3.16Å; L24-S26 VanDerWaalsContact O-N 3.13Å; S26-L28 PolarHBondContact O-N 3.46Å; S26-E29 WeakPolarHBondContact O-CB 3.43Å; S26-E29 PolarHBondContact O-N 2.99Å
27	R	94.4	Very high	82.6	Confident	106 Å²	106	74 Å²	74	40%	0.4	40%	0.4	S	S	.	.	H	α-helix	trans	-61	-27	173.8	-159.4	175.6	-169.2	169.4	8.5	112.6	Q23 L24 I25 E29 Q30 V49 L81	Q23-R27 VanDerWaalsContact CD-NH1 3.28Å; L24-R27 VanDerWaalsContact O-CB 3.25Å; L24-R27 WeakPolarHBondContact O-CB 3.33Å; L24-R27 PolarHBondContact O-N 3.1Å; I25-R27 PolarHBondContact O-N 3.11Å; I25-R27 VanDerWaalsContact O-N 3.1Å; R27-E29 PolarHBondContact O-N 3.31Å; R27-Q30 WeakPolarHBondContact O-CB 3.45Å; R27-Q30 PolarHBondContact O-N 3.43Å; R27-Q30 VanDerWaalsContact O-N 3.16Å; R27-V49 HydrophobicContact CB-CG2 4.21Å; R27-L81 HydrophobicContact CG-CD1 4.25Å
28	L	94.7	Very high	85.7	Confident	0 Å²	0	65 Å²	65	0%	0	36%	0.359	C	S	.	.	H	α-helix	trans	-64.6	-24.6	175.2	-68.5	178.7	0	0	0	113.1	I25 S26 Q30 C31 G32 I33 V38 L41 V49 V52 I74 A78 L81	I25-L28 HydrophobicContact CG1-CD1 3.87Å; I25-L28 VanDerWaalsContact O-CB 3.32Å; I25-L28 WeakPolarHBondContact O-CB 3.42Å; I25-L28 PolarHBondContact O-N 3.13Å; S26-L28 PolarHBondContact O-N 3.46Å; L28-Q30 VanDerWaalsContact C-N 3.26Å; L28-Q30 PolarHBondContact O-N 2.8Å; L28-C31 CarbonylContact O-C 3.6Å; L28-C31 PolarHBondContact O-N 3.15Å; L28-C31 VanDerWaalsContact O-N 3.11Å; L28-G32 PolarHBondContact O-N 3.01Å; L28-I33 HydrophobicContact CB-CB 4.13Å; L28-I33 HydrophobicContact CB-CG1 4Å; L28-I33 WeakPolarHBondContact O-CB 3.35Å; L28-I33 WeakPolarHBondContact O-CG1 3.49Å; L28-I33 PolarHBondContact O-N 3.06Å; L28-I33 VanDerWaalsContact O-N 3.13Å; L28-V38 HydrophobicContact CB-CG2 4.36Å; L28-L41 HydrophobicContact CD1-CD1 4.43Å; L28-V49 HydrophobicContact CD2-CG1 4.16Å; L28-V49 HydrophobicContact CG-CG2 4.31Å; L28-V52 HydrophobicContact CD1-CG2 4.31Å; L28-I74 HydrophobicContact CD1-CG2 4.48Å; L28-A78 HydrophobicContact CD2-CB 4.14Å; L28-L81 HydrophobicContact CD2-CD1 4.2Å
29	E	94.4	Very high	88.4	Confident	89 Å²	89	63.2 Å²	63.2	42%	0.416	35%	0.349	S	S	.	.	H	α-helix	trans	-63.2	-37.5	175	-60.5	-170.1	175.8	0	0	111.2	S26 R27 C31 G32 I33 A35 V38	S26-E29 WeakPolarHBondContact O-CB 3.43Å; S26-E29 PolarHBondContact O-N 2.99Å; R27-E29 PolarHBondContact O-N 3.31Å; E29-C31 PolarHBondContact O-N 2.88Å; E29-G32 PolarHBondContact O-N 2.89Å; E29-I33 WeakPolarHBondContact CA-O 3.49Å; E29-A35 WeakPolarHBondContact OE1-CA 3.33Å; E29-A35 WeakPolarHBondContact OE1-CB 3.38Å; E29-V38 HydrophobicContact CG-CB 4.35Å; E29-V38 HydrophobicContact CG-CG2 3.76Å
30	Q	92.1	Very high	91	Very high	162 Å²	162	61.6 Å²	61.6	76%	0.757	33%	0.331	S	S	*	.	H	α-helix	trans	-67.4	-23.5	176.9	-55.7	174.9	2.5	0	0	111.9	R27 L28 G32	R27-Q30 WeakPolarHBondContact O-CB 3.45Å; R27-Q30 PolarHBondContact O-N 3.43Å; R27-Q30 VanDerWaalsContact O-N 3.16Å; L28-Q30 VanDerWaalsContact C-N 3.26Å; L28-Q30 PolarHBondContact O-N 2.8Å; Q30-G32 VanDerWaalsContact C-N 3.28Å
31	C	91.3	Very high	93	Very high	36 Å²	36	53.5 Å²	53.5	24%	0.243	30%	0.295	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.4	8.5	173.6	-55.9	0	0	0	0	113.1	L28 E29 E77	L28-C31 CarbonylContact O-C 3.6Å; L28-C31 PolarHBondContact O-N 3.15Å; L28-C31 VanDerWaalsContact O-N 3.11Å; E29-C31 PolarHBondContact O-N 2.88Å; C31-E77 HydrophobicContact CB-CB 3.89Å; C31-E77 HydrophobicContact CB-CG 4.1Å
32	G	91.6	Very high	94.2	Very high	42 Å²	42	55.4 Å²	55.4	43%	0.433	29%	0.293	S	S	.	.	T	Hydrogen-bonded Turn	trans	82.1	23	176.5	0	0	0	0	0	114.5	L28 E29 Q30 K73	L28-G32 PolarHBondContact O-N 3.01Å; E29-G32 PolarHBondContact O-N 2.89Å; Q30-G32 VanDerWaalsContact C-N 3.28Å; G32-K73 PolarHBondContact O-NZ 3.35Å
33	I	96.9	Very high	94.7	Very high	12 Å²	12	60.6 Å²	60.6	6%	0.062	32%	0.315	C	S	.	.			trans	-81.7	139.7	163.8	-54	-52.7	0	0	0	108.9	L28 E29 D37 V38 K73 I74 E77	L28-I33 HydrophobicContact CB-CB 4.13Å; L28-I33 HydrophobicContact CB-CG1 4Å; L28-I33 WeakPolarHBondContact O-CB 3.35Å; L28-I33 WeakPolarHBondContact O-CG1 3.49Å; L28-I33 PolarHBondContact O-N 3.06Å; L28-I33 VanDerWaalsContact O-N 3.13Å; E29-I33 WeakPolarHBondContact CA-O 3.49Å; I33-D37 HydrophobicContact CG2-CB 4.34Å; I33-V38 HydrophobicContact CB-CG2 4.37Å; I33-V38 HydrophobicContact CG2-CG2 3.89Å; I33-K73 HydrophobicContact CD1-CD 4.13Å; I33-K73 HydrophobicContact CD1-CG 3.96Å; I33-I74 HydrophobicContact CD1-CG1 3.92Å; I33-I74 HydrophobicContact CG1-CG1 4.36Å; I33-I74 HydrophobicContact CG2-CG1 3.98Å; I33-E77 HydrophobicContact CD1-CB 4.35Å; I33-E77 HydrophobicContact CD1-CG 4.01Å; I33-E77 HydrophobicContact CG1-CB 4.48Å
34	N	96.2	Very high	94.7	Very high	91 Å²	91	60.8 Å²	60.8	49%	0.487	32%	0.321	S	S	.	.			trans	-72	135.6	-178.2	-171.8	-61	0	0	0	110.6	N36 D37 V38	N34-N36 PolarHBondContact O-N 2.94Å; N34-N36 VanDerWaalsContact O-N 3.15Å; N34-N36 WeakPolarHBondContact OD1-CB 3.46Å; N34-N36 PolarHBondContact OD1-N 3.05Å; N34-D37 HydrophobicContact CB-CB 4.5Å; N34-D37 WeakPolarHBondContact O-CA 3.44Å; N34-D37 WeakPolarHBondContact O-CB 3.37Å; N34-D37 PolarHBondContact O-N 3.42Å; N34-V38 PolarHBondContact O-N 3.02Å
35	A	96.6	Very high	94.6	Very high	47 Å²	47	57.5 Å²	57.5	39%	0.388	31%	0.308	S	S	.	.	H	α-helix	trans	-52.8	-35.3	177.5	0	0	0	0	0	113.8	E29 D37 V38 K39	E29-A35 WeakPolarHBondContact OE1-CA 3.33Å; E29-A35 WeakPolarHBondContact OE1-CB 3.38Å; A35-D37 VanDerWaalsContact C-N 3.3Å; A35-D37 PolarHBondContact O-N 2.84Å; A35-V38 PolarHBondContact O-N 3.09Å; A35-K39 WeakPolarHBondContact O-CB 3.26Å; A35-K39 PolarHBondContact O-N 2.98Å
36	N	96.8	Very high	94.6	Very high	110 Å²	110	57.6 Å²	57.6	59%	0.588	31%	0.308	S	S	*	.	H	α-helix	trans	-68	-29.5	175.1	-75.5	-38.6	0	0	0	113.3	N34 K40	N34-N36 PolarHBondContact O-N 2.94Å; N34-N36 VanDerWaalsContact O-N 3.15Å; N34-N36 WeakPolarHBondContact OD1-CB 3.46Å; N34-N36 PolarHBondContact OD1-N 3.05Å; N36-K40 WeakPolarHBondContact O-CG 3.31Å; N36-K40 PolarHBondContact O-N 3.45Å
37	D	97.1	Very high	94.7	Very high	13 Å²	13	56.4 Å²	56.4	7%	0.07	30%	0.297	C	S	.	.	H	α-helix	trans	-79.2	-36.6	175.2	-67.1	-33.2	0	0	0	110.2	I33 N34 A35 K40 L41 I66 K70	I33-D37 HydrophobicContact CG2-CB 4.34Å; N34-D37 HydrophobicContact CB-CB 4.5Å; N34-D37 WeakPolarHBondContact O-CA 3.44Å; N34-D37 WeakPolarHBondContact O-CB 3.37Å; N34-D37 PolarHBondContact O-N 3.42Å; A35-D37 VanDerWaalsContact C-N 3.3Å; A35-D37 PolarHBondContact O-N 2.84Å; D37-K40 PolarHBondContact O-N 2.96Å; D37-K40 IonicContact OD1-NZ 2.82Å; D37-K40 PolarHBondContact OD1-NZ 3.02Å; D37-L41 WeakPolarHBondContact O-CG 3.44Å; D37-L41 PolarHBondContact O-N 3.34Å; D37-L41 VanDerWaalsContact O-N 3.13Å; D37-I66 HydrophobicContact CB-CD1 4Å; D37-K70 IonicContact OD1-NZ 3.41Å; D37-K70 PolarHBondContact OD1-NZ 3.19Å; D37-K70 WeakPolarHBondContact OD2-CD 3.14Å; D37-K70 VanDerWaalsContact OD2-CE 3.3Å; D37-K70 WeakPolarHBondContact OD2-CE 3.32Å; D37-K70 IonicContact OD2-NZ 3.75Å; D37-K70 PolarHBondContact OD2-NZ 3.16Å
38	V	96.9	Very high	94.8	Very high	1 Å²	1	51.4 Å²	51.4	1%	0.006	28%	0.278	C	S	.	.	H	α-helix	trans	-58.6	-48	170.4	174.9	0	0	0	0	111.3	I25 L28 E29 I33 N34 A35 K40 L41 E42	I25-V38 HydrophobicContact CG1-CG1 4.25Å; I25-V38 HydrophobicContact CG2-CG1 4Å; L28-V38 HydrophobicContact CB-CG2 4.36Å; E29-V38 HydrophobicContact CG-CB 4.35Å; E29-V38 HydrophobicContact CG-CG2 3.76Å; I33-V38 HydrophobicContact CB-CG2 4.37Å; I33-V38 HydrophobicContact CG2-CG2 3.89Å; N34-V38 PolarHBondContact O-N 3.02Å; A35-V38 PolarHBondContact O-N 3.09Å; V38-K40 VanDerWaalsContact C-N 3.27Å; V38-K40 PolarHBondContact O-N 3.49Å; V38-L41 WeakPolarHBondContact O-CA 3.4Å; V38-L41 VanDerWaalsContact O-CB 3.3Å; V38-L41 WeakPolarHBondContact O-CB 3.42Å; V38-L41 PolarHBondContact O-N 3.38Å; V38-E42 PolarHBondContact O-N 2.97Å
39	K	96.3	Very high	94.9	Very high	115 Å²	115	51.4 Å²	51.4	50%	0.5	28%	0.278	S	S	.	.	H	α-helix	trans	-57.2	-37.8	176.4	-173.6	176.9	179	-179.9	0	113.3	A35 L41 E42 E43	A35-K39 WeakPolarHBondContact O-CB 3.26Å; A35-K39 PolarHBondContact O-N 2.98Å; K39-L41 VanDerWaalsContact C-N 3.33Å; K39-E42 PolarHBondContact O-N 2.81Å; K39-E43 VanDerWaalsContact CE-OE1 3.27Å; K39-E43 WeakPolarHBondContact CE-OE1 3.22Å; K39-E43 WeakPolarHBondContact O-CG 3.45Å; K39-E43 PolarHBondContact O-N 2.87Å
40	K	97	Very high	94.9	Very high	53 Å²	53	48.2 Å²	48.2	23%	0.23	26%	0.263	C	S	.	.	H	α-helix	trans	-68.3	-32.9	175.3	-70.7	168.3	-170.9	158.5	0	112.6	N36 D37 V38 A44 I63 G65 I66	N36-K40 WeakPolarHBondContact O-CG 3.31Å; N36-K40 PolarHBondContact O-N 3.45Å; D37-K40 PolarHBondContact O-N 2.96Å; D37-K40 IonicContact OD1-NZ 2.82Å; D37-K40 PolarHBondContact OD1-NZ 3.02Å; V38-K40 VanDerWaalsContact C-N 3.27Å; V38-K40 PolarHBondContact O-N 3.49Å; K40-A44 WeakPolarHBondContact O-CB 3.47Å; K40-A44 PolarHBondContact O-N 3.39Å; K40-A44 VanDerWaalsContact O-N 3.1Å; K40-I63 HydrophobicContact CB-CG2 4.03Å; K40-G65 PolarHBondContact NZ-O 2.91Å; K40-G65 VanDerWaalsContact NZ-O 3.12Å; K40-I66 HydrophobicContact CD-CD1 4.11Å
41	L	96.3	Very high	95	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-66.4	-45	174.4	-64.6	170.6	0	0	0	109.6	I25 L28 D37 V38 K39 A44 G45 F46 V52 L60 I63 I74	I25-L41 HydrophobicContact CD1-CB 3.44Å; I25-L41 VanDerWaalsContact CD1-CB 3.44Å; I25-L41 HydrophobicContact CD1-CD1 3.85Å; I25-L41 HydrophobicContact CD1-CG 4.27Å; L28-L41 HydrophobicContact CD1-CD1 4.43Å; D37-L41 WeakPolarHBondContact O-CG 3.44Å; D37-L41 PolarHBondContact O-N 3.34Å; D37-L41 VanDerWaalsContact O-N 3.13Å; V38-L41 WeakPolarHBondContact O-CA 3.4Å; V38-L41 VanDerWaalsContact O-CB 3.3Å; V38-L41 WeakPolarHBondContact O-CB 3.42Å; V38-L41 PolarHBondContact O-N 3.38Å; K39-L41 VanDerWaalsContact C-N 3.33Å; L41-A44 CarbonylContact O-C 3.56Å; L41-A44 WeakPolarHBondContact O-CA 3.46Å; L41-A44 WeakPolarHBondContact O-CB 3.23Å; L41-A44 PolarHBondContact O-N 3Å; L41-G45 PolarHBondContact O-N 3.44Å; L41-G45 VanDerWaalsContact O-N 3.16Å; L41-F46 CarbonylContact C-O 3.56Å; L41-F46 HydrophobicContact CB-CB 4.07Å; L41-F46 HydrophobicContact CB-CD2 4.49Å; L41-F46 HydrophobicContact CD2-CD2 4.33Å; L41-F46 WeakPolarHBondContact O-CB 3.47Å; L41-F46 WeakPolarHBondContact O-CD2 3.3Å; L41-F46 PolarHBondContact O-N 3.48Å; L41-V52 HydrophobicContact CD1-CG2 4.29Å; L41-L60 HydrophobicContact CD2-CD2 3.76Å; L41-I63 HydrophobicContact CD2-CD1 3.66Å; L41-I74 HydrophobicContact CD1-CD1 4.33Å; L41-I74 HydrophobicContact CD1-CG2 4.13Å
42	E	94.3	Very high	95.3	Very high	79 Å²	79	38.8 Å²	38.8	37%	0.369	22%	0.215	S	C	.	.	H	α-helix	trans	-59.2	-47.2	174.3	-68.7	175.9	170.4	0	0	112.1	I25 V38 K39 A44 G45 F46 H47	I25-E42 HydrophobicContact CG2-CG 3.64Å; I25-E42 WeakPolarHBondContact CG2-OE1 3.25Å; V38-E42 PolarHBondContact O-N 2.97Å; K39-E42 PolarHBondContact O-N 2.81Å; E42-A44 PolarHBondContact O-N 3.13Å; E42-G45 PolarHBondContact O-N 3.36Å; E42-F46 WeakPolarHBondContact CA-O 3.35Å; E42-F46 PolarHBondContact N-O 3.24Å; E42-H47 PolarHBondContact O-CE1 3.11Å
43	E	92.6	Very high	95.4	Very high	142 Å²	142	37.6 Å²	37.6	66%	0.664	20%	0.201	S	C	*	.	H	α-helix	trans	-62	-24	175.8	-73.3	173.5	-174.3	0	0	112.8	K39	K39-E43 VanDerWaalsContact CE-OE1 3.27Å; K39-E43 WeakPolarHBondContact CE-OE1 3.22Å; K39-E43 WeakPolarHBondContact O-CG 3.45Å; K39-E43 PolarHBondContact O-N 2.87Å
44	A	92.6	Very high	95.3	Very high	34 Å²	34	41 Å²	41	28%	0.281	21%	0.214	S	C	.	.	T	Hydrogen-bonded Turn	trans	-89.4	0.4	174.3	0	0	0	0	0	113.5	K40 L41 E42 F46 I63	K40-A44 WeakPolarHBondContact O-CB 3.47Å; K40-A44 PolarHBondContact O-N 3.39Å; K40-A44 VanDerWaalsContact O-N 3.1Å; L41-A44 CarbonylContact O-C 3.56Å; L41-A44 WeakPolarHBondContact O-CA 3.46Å; L41-A44 WeakPolarHBondContact O-CB 3.23Å; L41-A44 PolarHBondContact O-N 3Å; E42-A44 PolarHBondContact O-N 3.13Å; A44-F46 HydrophobicContact CB-CD2 4Å; A44-F46 HydrophobicContact CB-CE2 4.12Å; A44-I63 HydrophobicContact CB-CD1 3.71Å; A44-I63 HydrophobicContact CB-CG1 3.84Å; A44-I63 HydrophobicContact CB-CG2 4.33Å
45	G	91.1	Very high	95.2	Very high	16 Å²	16	37.1 Å²	37.1	17%	0.165	19%	0.194	C	C	.	.	T	Hydrogen-bonded Turn	trans	93.8	11	176.3	0	0	0	0	0	115.6	L41 E42 H47	L41-G45 PolarHBondContact O-N 3.44Å; L41-G45 VanDerWaalsContact O-N 3.16Å; E42-G45 PolarHBondContact O-N 3.36Å; G45-H47 PolarHBondContact O-CD2 3.49Å
46	F	94.7	Very high	95.1	Very high	5 Å²	5	37.7 Å²	37.7	2%	0.022	19%	0.194	C	C	.	.			trans	-91.9	108	172.9	-60.6	-82.9	0	0	0	109.2	I25 L41 E42 A44 A51 V52 A55 E59 L60 I63	I25-F46 HydrophobicContact CD1-CB 3.83Å; I25-F46 WeakPolarHBondContact CD1-O 3.44Å; L41-F46 CarbonylContact C-O 3.56Å; L41-F46 HydrophobicContact CB-CB 4.07Å; L41-F46 HydrophobicContact CB-CD2 4.49Å; L41-F46 HydrophobicContact CD2-CD2 4.33Å; L41-F46 WeakPolarHBondContact O-CB 3.47Å; L41-F46 WeakPolarHBondContact O-CD2 3.3Å; L41-F46 PolarHBondContact O-N 3.48Å; E42-F46 WeakPolarHBondContact CA-O 3.35Å; E42-F46 PolarHBondContact N-O 3.24Å; A44-F46 HydrophobicContact CB-CD2 4Å; A44-F46 HydrophobicContact CB-CE2 4.12Å; F46-A51 HydrophobicContact CB-CB 4.48Å; F46-A51 HydrophobicContact CD1-CB 3.79Å; F46-V52 HydrophobicContact CB-CG2 4.04Å; F46-V52 HydrophobicContact CD1-CG2 4.23Å; F46-V52 HydrophobicContact CG-CG2 4.31Å; F46-A55 HydrophobicContact CE1-CB 3.74Å; F46-A55 HydrophobicContact CZ-CB 4.17Å; F46-E59 HydrophobicContact CZ-CG 3.96Å; F46-L60 HydrophobicContact CE2-CD2 4.23Å; F46-L60 HydrophobicContact CZ-CD2 4.19Å; F46-I63 HydrophobicContact CD2-CD1 4.13Å; F46-I63 HydrophobicContact CE2-CD1 3.81Å
47	H	95.4	Very high	95.1	Very high	32 Å²	32	35.1 Å²	35.1	15%	0.148	18%	0.178	C	C	.	.			trans	-108.6	-9.3	-178.6	-59.9	-73.1	0	0	0	113.4	I25 E42 G45 S208 A209 A212	I25-H47 WeakPolarHBondContact CB-O 3.47Å; I25-H47 PolarHBondContact N-O 3.18Å; E42-H47 PolarHBondContact O-CE1 3.11Å; G45-H47 PolarHBondContact O-CD2 3.49Å; H47-S208 PolarHBondContact CD2-OG 3.36Å; H47-S208 VanDerWaalsContact CD2-OG 3.32Å; H47-A209 PolarHBondContact CD2-N 3.39Å; H47-A212 HydrophobicContact CB-CB 3.73Å
48	T	96.4	Very high	95	Very high	0 Å²	0	41.9 Å²	41.9	0%	0	21%	0.207	C	C	.	.	B	Isolated β-bridge	trans	-130.1	163.5	-179.1	68	0	0	0	0	111.7	P22 Q23 E50 A51 E258 F259	P22-T48 HydrophobicContact CB-CG2 3.62Å; P22-T48 HydrophobicContact CG-CG2 4.23Å; Q23-T48 CarbonylContact O-C 3.45Å; Q23-T48 WeakPolarHBondContact O-CA 3.12Å; Q23-T48 VanDerWaalsContact O-CB 3.31Å; Q23-T48 WeakPolarHBondContact O-CB 3.46Å; T48-E50 VanDerWaalsContact C-N 3.34Å; T48-A51 WeakPolarHBondContact OG1-CB 3.27Å; T48-A51 PolarHBondContact OG1-N 3.39Å; T48-E258 VanDerWaalsContact CB-OE1 3.3Å; T48-E258 WeakPolarHBondContact CB-OE1 3.49Å; T48-E258 HydrophobicContact CG2-CG 3.88Å; T48-E258 WeakPolarHBondContact CG2-OE1 3.38Å; T48-E258 WeakPolarHBondContact OG1-CG 3.5Å; T48-E258 PolarHBondContact OG1-OE1 3.34Å; T48-F259 HydrophobicContact CG2-CE1 3.81Å; T48-F259 HydrophobicContact CG2-CZ 3.87Å
49	V	96.1	Very high	94.9	Very high	0 Å²	0	44.5 Å²	44.5	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-68.8	-37.8	174.5	-174.9	0	0	0	0	110.5	Q23 R27 L28 A51 V52 A53 A78 L81 V82	Q23-V49 HydrophobicContact CB-CB 4.05Å; Q23-V49 HydrophobicContact CB-CG2 3.77Å; Q23-V49 PolarHBondContact O-N 3.23Å; R27-V49 HydrophobicContact CB-CG2 4.21Å; L28-V49 HydrophobicContact CD2-CG1 4.16Å; L28-V49 HydrophobicContact CG-CG2 4.31Å; V49-A51 PolarHBondContact O-N 3.4Å; V49-V52 PolarHBondContact O-N 2.98Å; V49-A53 WeakPolarHBondContact O-CB 3.42Å; V49-A53 PolarHBondContact O-N 3.29Å; V49-A78 HydrophobicContact CG1-CB 3.92Å; V49-L81 HydrophobicContact CG1-CB 3.93Å; V49-L81 HydrophobicContact CG1-CD1 3.85Å; V49-L81 HydrophobicContact CG2-CD1 4.12Å; V49-V82 HydrophobicContact CB-CG2 4.35Å; V49-V82 HydrophobicContact CG1-CG2 3.82Å
50	E	94.8	Very high	94.9	Very high	22 Å²	22	39 Å²	39	10%	0.103	20%	0.195	C	C	.	.	H	α-helix	trans	-57.6	-46	175.5	-69.5	80.6	179.4	0	0	111.2	Q23 T48 V52 A53 Y54 V82 E258	Q23-E50 PolarHBondContact N-OE1 2.71Å; Q23-E50 PolarHBondContact N-OE2 2.98Å; T48-E50 VanDerWaalsContact C-N 3.34Å; E50-V52 PolarHBondContact O-N 2.99Å; E50-A53 PolarHBondContact O-N 3.24Å; E50-A53 VanDerWaalsContact O-N 3.14Å; E50-Y54 HydrophobicContact CB-CD2 4.34Å; E50-Y54 HydrophobicContact CB-CE2 3.81Å; E50-Y54 HydrophobicContact CG-CE2 4.48Å; E50-Y54 WeakPolarHBondContact O-CB 3.49Å; E50-Y54 WeakPolarHBondContact O-CD2 3Å; E50-Y54 PolarHBondContact O-N 3.25Å; E50-V82 HydrophobicContact CG-CG1 4.43Å; E50-V82 HydrophobicContact CG-CG2 4.13Å; E50-E258 HydrophobicContact CB-CG 4.46Å
51	A	94.8	Very high	94.9	Very high	1 Å²	1	39.9 Å²	39.9	1%	0.008	20%	0.202	C	C	.	.	H	α-helix	trans	-57.3	-39.1	177.4	0	0	0	0	0	112.4	F46 T48 V49 A55	F46-A51 HydrophobicContact CB-CB 4.48Å; F46-A51 HydrophobicContact CD1-CB 3.79Å; T48-A51 WeakPolarHBondContact OG1-CB 3.27Å; T48-A51 PolarHBondContact OG1-N 3.39Å; V49-A51 PolarHBondContact O-N 3.4Å; A51-A55 WeakPolarHBondContact O-CB 3.43Å; A51-A55 PolarHBondContact O-N 2.96Å
52	V	96.1	Very high	94.9	Very high	0 Å²	0	45.8 Å²	45.8	0%	0	23%	0.233	C	C	.	.	H	α-helix	trans	-71.8	-44.9	176.8	177	0	0	0	0	111.1	I25 L28 L41 F46 V49 E50 Y54 A55 L60 I74 L75 A78	I25-V52 HydrophobicContact CD1-CG2 3.78Å; I25-V52 HydrophobicContact CG1-CG2 4.36Å; L28-V52 HydrophobicContact CD1-CG2 4.31Å; L41-V52 HydrophobicContact CD1-CG2 4.29Å; F46-V52 HydrophobicContact CB-CG2 4.04Å; F46-V52 HydrophobicContact CD1-CG2 4.23Å; F46-V52 HydrophobicContact CG-CG2 4.31Å; V49-V52 PolarHBondContact O-N 2.98Å; E50-V52 PolarHBondContact O-N 2.99Å; V52-Y54 VanDerWaalsContact C-N 3.32Å; V52-Y54 PolarHBondContact O-N 3.13Å; V52-A55 WeakPolarHBondContact O-CB 3.34Å; V52-A55 PolarHBondContact O-N 2.8Å; V52-L60 HydrophobicContact CG1-CD1 4.46Å; V52-I74 HydrophobicContact CG1-CG2 3.41Å; V52-I74 VanDerWaalsContact CG1-CG2 3.41Å; V52-L75 WeakPolarHBondContact O-CD2 3.33Å; V52-A78 HydrophobicContact CB-CB 4.44Å; V52-A78 HydrophobicContact CG1-CB 4.05Å
53	A	95.2	Very high	95	Very high	17 Å²	17	43 Å²	43	14%	0.14	22%	0.221	C	C	.	.	H	α-helix	trans	-64.5	-35	-179.3	0	0	0	0	0	112.7	V49 E50 A55 A78 V82	V49-A53 WeakPolarHBondContact O-CB 3.42Å; V49-A53 PolarHBondContact O-N 3.29Å; E50-A53 PolarHBondContact O-N 3.24Å; E50-A53 VanDerWaalsContact O-N 3.14Å; A53-A55 VanDerWaalsContact C-N 3.35Å; A53-A78 HydrophobicContact CB-CB 4.23Å; A53-V82 HydrophobicContact CB-CB 3.98Å; A53-V82 HydrophobicContact CB-CG1 4.25Å; A53-V82 HydrophobicContact CB-CG2 3.94Å
54	Y	93.3	Very high	95.2	Very high	84 Å²	84	45.7 Å²	45.7	33%	0.329	23%	0.23	S	C	.	.	H	α-helix	trans	-81.4	-14.7	178	-57.5	-19.8	0	0	0	113.1	E50 V52 V82 M84 D257	E50-Y54 HydrophobicContact CB-CD2 4.34Å; E50-Y54 HydrophobicContact CB-CE2 3.81Å; E50-Y54 HydrophobicContact CG-CE2 4.48Å; E50-Y54 WeakPolarHBondContact O-CB 3.49Å; E50-Y54 WeakPolarHBondContact O-CD2 3Å; E50-Y54 PolarHBondContact O-N 3.25Å; V52-Y54 VanDerWaalsContact C-N 3.32Å; V52-Y54 PolarHBondContact O-N 3.13Å; Y54-V82 HydrophobicContact CE1-CG1 4.03Å; Y54-M84 HydrophobicContact CD1-CE 3.79Å; Y54-M84 HydrophobicContact CD1-SD 3.72Å; Y54-M84 HydrophobicContact CE1-CE 4.16Å; Y54-M84 HydrophobicContact CE1-SD 3.49Å; Y54-M84 WeakPolarHBondContact CE1-SD 3.45Å; Y54-D257 HydrophobicContact CE2-CB 4.18Å
55	A	94.2	Very high	95.3	Very high	8 Å²	8	46.3 Å²	46.3	7%	0.066	24%	0.24	C	C	.	.	S	Bend	trans	-74.3	135.4	-178.2	0	0	0	0	0	111.6	F46 A51 V52 A53 L60	F46-A55 HydrophobicContact CE1-CB 3.74Å; F46-A55 HydrophobicContact CZ-CB 4.17Å; A51-A55 WeakPolarHBondContact O-CB 3.43Å; A51-A55 PolarHBondContact O-N 2.96Å; V52-A55 WeakPolarHBondContact O-CB 3.34Å; V52-A55 PolarHBondContact O-N 2.8Å; A53-A55 VanDerWaalsContact C-N 3.35Å; A55-L60 HydrophobicContact CB-CD2 4.48Å
56	P	95	Very high	95.6	Very high	59 Å²	59	46 Å²	46	38%	0.383	23%	0.234	S	C	.	.			trans	-66.2	143.9	167.6	28.8	-32.1	0	0	0	109.6	K58 E59	P56-K58 PolarHBondContact O-N 3.04Å; P56-E59 WeakPolarHBondContact CD-OE2 3.49Å; P56-E59 HydrophobicContact CG-CB 4.09Å; P56-E59 WeakPolarHBondContact O-CB 3.5Å; P56-E59 PolarHBondContact O-N 2.81Å
57	K	96.6	Very high	95.7	Very high	56 Å²	56	48.8 Å²	48.8	24%	0.243	25%	0.254	C	S	.	.	H	α-helix	trans	-46.4	-38.3	176.2	-173.6	179.6	-178.1	178.1	0	113.1	E59 L60 L61 E68 A71 D72 L75	K57-E59 VanDerWaalsContact C-N 3.26Å; K57-E59 PolarHBondContact O-N 3.16Å; K57-L60 PolarHBondContact O-N 3.27Å; K57-L61 HydrophobicContact CG-CD1 4.17Å; K57-L61 HydrophobicContact CG-CG 4.3Å; K57-L61 WeakPolarHBondContact O-CG 3.28Å; K57-L61 PolarHBondContact O-N 2.96Å; K57-E68 IonicContact NZ-OE1 2.8Å; K57-E68 PolarHBondContact NZ-OE1 3.2Å; K57-A71 HydrophobicContact CG-CB 4.3Å; K57-D72 WeakPolarHBondContact CD-OD1 3.3Å; K57-D72 WeakPolarHBondContact CE-OD1 3.21Å; K57-D72 IonicContact NZ-OD1 2.67Å; K57-D72 PolarHBondContact NZ-OD1 3.21Å; K57-D72 IonicContact NZ-OD2 2.72Å; K57-D72 PolarHBondContact NZ-OD2 3.21Å; K57-L75 HydrophobicContact CB-CD1 3.89Å; K57-L75 HydrophobicContact CG-CD1 4.15Å
58	K	96.6	Very high	95.8	Very high	156 Å²	156	53 Å²	53	68%	0.678	27%	0.274	S	S	*	.	H	α-helix	trans	-57.1	-35.1	177.5	-173.3	179.2	179.6	-178.9	0	113.5	P56 N62	P56-K58 PolarHBondContact O-N 3.04Å; K58-N62 VanDerWaalsContact O-CG 3.26Å; K58-N62 PolarHBondContact O-N 2.63Å; K58-N62 PolarHBondContact O-ND2 3.4Å
59	E	94.6	Very high	95.9	Very high	56 Å²	56	56.7 Å²	56.7	26%	0.262	30%	0.304	S	S	.	.	H	α-helix	trans	-68.2	-44.1	178.6	-162.3	172.9	163.5	0	0	110.3	F46 P56 K57 L61 N62 R254	F46-E59 HydrophobicContact CZ-CG 3.96Å; P56-E59 WeakPolarHBondContact CD-OE2 3.49Å; P56-E59 HydrophobicContact CG-CB 4.09Å; P56-E59 WeakPolarHBondContact O-CB 3.5Å; P56-E59 PolarHBondContact O-N 2.81Å; K57-E59 VanDerWaalsContact C-N 3.26Å; K57-E59 PolarHBondContact O-N 3.16Å; E59-L61 VanDerWaalsContact C-N 3.34Å; E59-L61 PolarHBondContact O-N 3.41Å; E59-N62 WeakPolarHBondContact O-CB 3.42Å; E59-N62 PolarHBondContact O-N 3.08Å; E59-R254 IonicContact OE1-CZ 3.59Å; E59-R254 IonicContact OE1-NH1 2.77Å; E59-R254 PolarHBondContact OE1-NH1 3.42Å; E59-R254 IonicContact OE1-NH2 3.74Å; E59-R254 PolarHBondContact OE1-NH2 3.36Å; E59-R254 IonicContact OE2-CZ 2.81Å; E59-R254 IonicContact OE2-NH1 2.7Å; E59-R254 IonicContact OE2-NH2 2.71Å; E59-R254 PolarHBondContact OE2-NH2 2.86Å
60	L	96.4	Very high	95.9	Very high	0 Å²	0	60.2 Å²	60.2	0%	0	32%	0.32	C	S	.	.	H	α-helix	trans	-63.9	-37.3	175.6	-59	-177.5	0	0	0	112.6	L41 F46 V52 A55 K57 N62 I63 A71 I74 L75	L41-L60 HydrophobicContact CD2-CD2 3.76Å; F46-L60 HydrophobicContact CE2-CD2 4.23Å; F46-L60 HydrophobicContact CZ-CD2 4.19Å; V52-L60 HydrophobicContact CG1-CD1 4.46Å; A55-L60 HydrophobicContact CB-CD2 4.48Å; K57-L60 PolarHBondContact O-N 3.27Å; L60-N62 PolarHBondContact O-N 3.24Å; L60-I63 HydrophobicContact CD2-CD1 4.12Å; L60-I63 VanDerWaalsContact O-CB 3.32Å; L60-I63 WeakPolarHBondContact O-CB 3.49Å; L60-I63 WeakPolarHBondContact O-CG1 3.32Å; L60-I63 PolarHBondContact O-N 3.39Å; L60-I63 VanDerWaalsContact O-N 3.11Å; L60-A71 HydrophobicContact CB-CB 4.18Å; L60-I74 HydrophobicContact CD1-CG2 4.36Å; L60-L75 HydrophobicContact CD1-CD1 4.07Å; L60-L75 HydrophobicContact CD1-CD2 3.7Å; L60-L75 HydrophobicContact CD1-CG 3.63Å
61	L	97	Very high	96.1	Very high	71 Å²	71	59.2 Å²	59.2	37%	0.372	32%	0.315	S	S	.	.	H	α-helix	trans	-67.4	-22.6	177.2	-67.8	175.6	0	0	0	113.5	K57 E59 I63 E68 A71	K57-L61 HydrophobicContact CG-CD1 4.17Å; K57-L61 HydrophobicContact CG-CG 4.3Å; K57-L61 WeakPolarHBondContact O-CG 3.28Å; K57-L61 PolarHBondContact O-N 2.96Å; E59-L61 VanDerWaalsContact C-N 3.34Å; E59-L61 PolarHBondContact O-N 3.41Å; L61-I63 PolarHBondContact O-N 3.16Å; L61-E68 HydrophobicContact CD2-CB 4.26Å; L61-A71 HydrophobicContact CD2-CB 4.03Å
62	N	96	Very high	96.2	Very high	124 Å²	124	62.6 Å²	62.6	66%	0.663	33%	0.333	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.1	-11.8	174.9	-66.9	-26.3	0	0	0	112.2	K58 E59 L60 K64	K58-N62 VanDerWaalsContact O-CG 3.26Å; K58-N62 PolarHBondContact O-N 2.63Å; K58-N62 PolarHBondContact O-ND2 3.4Å; E59-N62 WeakPolarHBondContact O-CB 3.42Å; E59-N62 PolarHBondContact O-N 3.08Å; L60-N62 PolarHBondContact O-N 3.24Å; N62-K64 PolarHBondContact O-N 2.71Å
63	I	96.6	Very high	96.3	Very high	21 Å²	21	67.6 Å²	67.6	11%	0.108	36%	0.355	C	S	.	.	S	Bend	trans	-78	122.2	177.9	-53.9	173.2	0	0	0	108.9	K40 L41 A44 F46 L60 L61 G65 I66	K40-I63 HydrophobicContact CB-CG2 4.03Å; L41-I63 HydrophobicContact CD2-CD1 3.66Å; A44-I63 HydrophobicContact CB-CD1 3.71Å; A44-I63 HydrophobicContact CB-CG1 3.84Å; A44-I63 HydrophobicContact CB-CG2 4.33Å; F46-I63 HydrophobicContact CD2-CD1 4.13Å; F46-I63 HydrophobicContact CE2-CD1 3.81Å; L60-I63 HydrophobicContact CD2-CD1 4.12Å; L60-I63 VanDerWaalsContact O-CB 3.32Å; L60-I63 WeakPolarHBondContact O-CB 3.49Å; L60-I63 WeakPolarHBondContact O-CG1 3.32Å; L60-I63 PolarHBondContact O-N 3.39Å; L60-I63 VanDerWaalsContact O-N 3.11Å; L61-I63 PolarHBondContact O-N 3.16Å; I63-G65 PolarHBondContact O-N 3.02Å; I63-G65 VanDerWaalsContact O-N 3.16Å; I63-I66 HydrophobicContact CB-CB 4.33Å; I63-I66 HydrophobicContact CB-CG1 3.85Å; I63-I66 HydrophobicContact CG2-CG1 3.82Å; I63-I66 PolarHBondContact O-N 3.36Å; I63-I66 VanDerWaalsContact O-N 3.11Å
64	K	95.7	Very high	96.4	Very high	197 Å²	197	66.9 Å²	66.9	86%	0.857	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.9	121.9	-177.8	-173.2	179.9	178.3	-177.7	0	110.8	N62	N62-K64 PolarHBondContact O-N 2.71Å
65	G	94.8	Very high	96.6	Very high	47 Å²	47	64.6 Å²	64.6	49%	0.485	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.4	12.2	177.3	0	0	0	0	0	114.9	K40 I63	K40-G65 PolarHBondContact NZ-O 2.91Å; K40-G65 VanDerWaalsContact NZ-O 3.12Å; I63-G65 PolarHBondContact O-N 3.02Å; I63-G65 VanDerWaalsContact O-N 3.16Å
66	I	97.6	Very high	96.6	Very high	11 Å²	11	66.7 Å²	66.7	6%	0.056	36%	0.359	C	S	.	.			trans	-100.7	113.2	164.2	-58.9	-58.8	0	0	0	108.2	D37 K40 I63 K70 A71 I74	D37-I66 HydrophobicContact CB-CD1 4Å; K40-I66 HydrophobicContact CD-CD1 4.11Å; I63-I66 HydrophobicContact CB-CB 4.33Å; I63-I66 HydrophobicContact CB-CG1 3.85Å; I63-I66 HydrophobicContact CG2-CG1 3.82Å; I63-I66 PolarHBondContact O-N 3.36Å; I63-I66 VanDerWaalsContact O-N 3.11Å; I66-K70 HydrophobicContact CG2-CB 4.22Å; I66-A71 HydrophobicContact CG2-CB 4.08Å; I66-I74 HydrophobicContact CD1-CD1 4.32Å
67	S	97.4	Very high	96.7	Very high	62 Å²	62	65.5 Å²	65.5	43%	0.434	35%	0.348	S	S	.	.			trans	-85.5	169.2	175.5	64.5	0	0	0	0	111.2	A69 K70 A71	S67-A69 PolarHBondContact O-N 2.96Å; S67-K70 WeakPolarHBondContact O-CB 3.38Å; S67-K70 PolarHBondContact O-N 3Å; S67-K70 VanDerWaalsContact O-N 3.12Å; S67-K70 WeakPolarHBondContact OG-CG 3.03Å; S67-A71 PolarHBondContact O-N 2.97Å
68	E	97.4	Very high	96.6	Very high	121 Å²	121	62.8 Å²	62.8	57%	0.565	34%	0.337	S	S	*	.	H	α-helix	trans	-56.9	-48.9	178.4	-169.4	169	-168.8	0	0	113.3	K57 L61 K70 A71 D72	K57-E68 IonicContact NZ-OE1 2.8Å; K57-E68 PolarHBondContact NZ-OE1 3.2Å; L61-E68 HydrophobicContact CD2-CB 4.26Å; E68-K70 PolarHBondContact O-N 3.42Å; E68-A71 PolarHBondContact O-N 3.47Å; E68-A71 VanDerWaalsContact O-N 3.16Å; E68-D72 PolarHBondContact O-N 3.37Å
69	A	97.5	Very high	96.5	Very high	77 Å²	77	58.1 Å²	58.1	64%	0.636	33%	0.327	S	S	*	.	H	α-helix	trans	-61	-33.3	177.3	0	0	0	0	0	113	S67 K73	S67-A69 PolarHBondContact O-N 2.96Å; A69-K73 PolarHBondContact O-N 3.33Å
70	K	97.3	Very high	96.4	Very high	75 Å²	75	62.2 Å²	62.2	33%	0.326	34%	0.344	S	S	.	.	H	α-helix	trans	-70.5	-45.5	175.1	-73.8	-177.5	171.9	-157.8	0	111.4	D37 I66 S67 E68 D72 K73 I74	D37-K70 IonicContact OD1-NZ 3.41Å; D37-K70 PolarHBondContact OD1-NZ 3.19Å; D37-K70 WeakPolarHBondContact OD2-CD 3.14Å; D37-K70 VanDerWaalsContact OD2-CE 3.3Å; D37-K70 WeakPolarHBondContact OD2-CE 3.32Å; D37-K70 IonicContact OD2-NZ 3.75Å; D37-K70 PolarHBondContact OD2-NZ 3.16Å; I66-K70 HydrophobicContact CG2-CB 4.22Å; S67-K70 WeakPolarHBondContact O-CB 3.38Å; S67-K70 PolarHBondContact O-N 3Å; S67-K70 VanDerWaalsContact O-N 3.12Å; S67-K70 WeakPolarHBondContact OG-CG 3.03Å; E68-K70 PolarHBondContact O-N 3.42Å; K70-D72 VanDerWaalsContact C-N 3.32Å; K70-D72 PolarHBondContact O-N 3.08Å; K70-K73 PolarHBondContact O-N 3.49Å; K70-I74 WeakPolarHBondContact O-CB 3.37Å; K70-I74 WeakPolarHBondContact O-CD1 3.48Å; K70-I74 VanDerWaalsContact O-CG1 3.23Å; K70-I74 WeakPolarHBondContact O-CG1 3.35Å; K70-I74 PolarHBondContact O-N 3.15Å
71	A	97.8	Very high	96.2	Very high	0 Å²	0	64.2 Å²	64.2	0%	0	35%	0.354	C	S	.	.	H	α-helix	trans	-59.3	-43.9	178.2	0	0	0	0	0	111.3	K57 L60 L61 I66 S67 E68 K73 I74 L75	K57-A71 HydrophobicContact CG-CB 4.3Å; L60-A71 HydrophobicContact CB-CB 4.18Å; L61-A71 HydrophobicContact CD2-CB 4.03Å; I66-A71 HydrophobicContact CG2-CB 4.08Å; S67-A71 PolarHBondContact O-N 2.97Å; E68-A71 PolarHBondContact O-N 3.47Å; E68-A71 VanDerWaalsContact O-N 3.16Å; A71-K73 PolarHBondContact O-N 3.29Å; A71-I74 PolarHBondContact O-N 3.3Å; A71-L75 WeakPolarHBondContact O-CB 3.01Å; A71-L75 WeakPolarHBondContact O-CG 3.5Å; A71-L75 PolarHBondContact O-N 2.54Å
72	D	97.6	Very high	95.9	Very high	73 Å²	73	61.1 Å²	61.1	39%	0.39	34%	0.338	S	S	.	.	H	α-helix	trans	-62	-43.6	176.5	-71.7	-37.2	0	0	0	112.1	K57 E68 K70 A76	K57-D72 WeakPolarHBondContact CD-OD1 3.3Å; K57-D72 WeakPolarHBondContact CE-OD1 3.21Å; K57-D72 IonicContact NZ-OD1 2.67Å; K57-D72 PolarHBondContact NZ-OD1 3.21Å; K57-D72 IonicContact NZ-OD2 2.72Å; K57-D72 PolarHBondContact NZ-OD2 3.21Å; E68-D72 PolarHBondContact O-N 3.37Å; K70-D72 VanDerWaalsContact C-N 3.32Å; K70-D72 PolarHBondContact O-N 3.08Å; D72-A76 VanDerWaalsContact O-CB 3.26Å; D72-A76 WeakPolarHBondContact O-CB 3.33Å; D72-A76 PolarHBondContact O-N 3.05Å
73	K	97.4	Very high	95.5	Very high	104 Å²	104	59.8 Å²	59.8	45%	0.452	34%	0.337	S	S	.	.	H	α-helix	trans	-62.7	-47.2	176.2	-171.1	-175.9	-177.8	-169.3	0	111.7	G32 I33 A69 K70 A71 L75 A76 E77	G32-K73 PolarHBondContact O-NZ 3.35Å; I33-K73 HydrophobicContact CD1-CD 4.13Å; I33-K73 HydrophobicContact CD1-CG 3.96Å; A69-K73 PolarHBondContact O-N 3.33Å; K70-K73 PolarHBondContact O-N 3.49Å; A71-K73 PolarHBondContact O-N 3.29Å; K73-L75 PolarHBondContact O-N 2.96Å; K73-A76 PolarHBondContact O-N 3.18Å; K73-E77 WeakPolarHBondContact O-CG 3.34Å; K73-E77 PolarHBondContact O-N 2.9Å
74	I	97.6	Very high	95	Very high	2 Å²	2	64.1 Å²	64.1	1%	0.01	36%	0.358	C	S	.	.	H	α-helix	trans	-58.4	-48.8	179.9	-71.7	162.8	0	0	0	110.5	L28 I33 L41 V52 L60 I66 K70 A71 A76 E77 A78	L28-I74 HydrophobicContact CD1-CG2 4.48Å; I33-I74 HydrophobicContact CD1-CG1 3.92Å; I33-I74 HydrophobicContact CG1-CG1 4.36Å; I33-I74 HydrophobicContact CG2-CG1 3.98Å; L41-I74 HydrophobicContact CD1-CD1 4.33Å; L41-I74 HydrophobicContact CD1-CG2 4.13Å; V52-I74 HydrophobicContact CG1-CG2 3.41Å; V52-I74 VanDerWaalsContact CG1-CG2 3.41Å; L60-I74 HydrophobicContact CD1-CG2 4.36Å; I66-I74 HydrophobicContact CD1-CD1 4.32Å; K70-I74 WeakPolarHBondContact O-CB 3.37Å; K70-I74 WeakPolarHBondContact O-CD1 3.48Å; K70-I74 VanDerWaalsContact O-CG1 3.23Å; K70-I74 WeakPolarHBondContact O-CG1 3.35Å; K70-I74 PolarHBondContact O-N 3.15Å; A71-I74 PolarHBondContact O-N 3.3Å; I74-A76 PolarHBondContact O-N 3.47Å; I74-E77 PolarHBondContact O-N 2.97Å; I74-A78 WeakPolarHBondContact O-CB 3.38Å; I74-A78 PolarHBondContact O-N 2.98Å
75	L	96.7	Very high	94.8	Very high	37 Å²	37	57.5 Å²	57.5	19%	0.194	35%	0.346	C	S	.	.	H	α-helix	trans	-63.7	-40.9	178.5	-71.8	170.3	0	0	0	112.2	V52 K57 L60 A71 K73 E77 A78 A79	V52-L75 WeakPolarHBondContact O-CD2 3.33Å; K57-L75 HydrophobicContact CB-CD1 3.89Å; K57-L75 HydrophobicContact CG-CD1 4.15Å; L60-L75 HydrophobicContact CD1-CD1 4.07Å; L60-L75 HydrophobicContact CD1-CD2 3.7Å; L60-L75 HydrophobicContact CD1-CG 3.63Å; A71-L75 WeakPolarHBondContact O-CB 3.01Å; A71-L75 WeakPolarHBondContact O-CG 3.5Å; A71-L75 PolarHBondContact O-N 2.54Å; K73-L75 PolarHBondContact O-N 2.96Å; L75-E77 PolarHBondContact O-N 2.7Å; L75-A78 PolarHBondContact O-N 3.44Å; L75-A79 VanDerWaalsContact O-CB 3.32Å; L75-A79 WeakPolarHBondContact O-CB 3.48Å; L75-A79 PolarHBondContact O-N 2.77Å
76	A	95.9	Very high	94.7	Very high	52 Å²	52	65.9 Å²	65.9	43%	0.43	37%	0.369	S	S	.	.	H	α-helix	trans	-64.8	-38.3	178.9	0	0	0	0	0	112.5	D72 K73 I74	D72-A76 VanDerWaalsContact O-CB 3.26Å; D72-A76 WeakPolarHBondContact O-CB 3.33Å; D72-A76 PolarHBondContact O-N 3.05Å; K73-A76 PolarHBondContact O-N 3.18Å; I74-A76 PolarHBondContact O-N 3.47Å
77	E	95.9	Very high	94.5	Very high	33 Å²	33	68.5 Å²	68.5	15%	0.154	39%	0.386	C	S	.	.	H	α-helix	trans	-73.6	-41.7	175.9	-64.5	-50.7	137	0	0	111.9	C31 I33 K73 I74 L75 A79 K80	C31-E77 HydrophobicContact CB-CB 3.89Å; C31-E77 HydrophobicContact CB-CG 4.1Å; I33-E77 HydrophobicContact CD1-CB 4.35Å; I33-E77 HydrophobicContact CD1-CG 4.01Å; I33-E77 HydrophobicContact CG1-CB 4.48Å; K73-E77 WeakPolarHBondContact O-CG 3.34Å; K73-E77 PolarHBondContact O-N 2.9Å; I74-E77 PolarHBondContact O-N 2.97Å; L75-E77 PolarHBondContact O-N 2.7Å; E77-A79 VanDerWaalsContact C-N 3.31Å; E77-A79 PolarHBondContact O-N 3.03Å; E77-K80 WeakPolarHBondContact O-CB 3.29Å; E77-K80 PolarHBondContact O-N 3.05Å; E77-K80 VanDerWaalsContact O-N 3.16Å; E77-K80 IonicContact OE1-NZ 2.71Å; E77-K80 PolarHBondContact OE1-NZ 3.41Å; E77-K80 WeakPolarHBondContact OE2-CE 3.13Å; E77-K80 IonicContact OE2-NZ 2.71Å; E77-K80 PolarHBondContact OE2-NZ 3.31Å
78	A	95.6	Very high	94.5	Very high	0 Å²	0	69.7 Å²	69.7	0%	0	39%	0.39	C	S	.	.	H	α-helix	trans	-60.3	-40	176.1	0	0	0	0	0	112.3	L28 V49 V52 A53 I74 L75 K80 L81 V82	L28-A78 HydrophobicContact CD2-CB 4.14Å; V49-A78 HydrophobicContact CG1-CB 3.92Å; V52-A78 HydrophobicContact CB-CB 4.44Å; V52-A78 HydrophobicContact CG1-CB 4.05Å; A53-A78 HydrophobicContact CB-CB 4.23Å; I74-A78 WeakPolarHBondContact O-CB 3.38Å; I74-A78 PolarHBondContact O-N 2.98Å; L75-A78 PolarHBondContact O-N 3.44Å; A78-K80 PolarHBondContact O-N 2.98Å; A78-L81 PolarHBondContact O-N 3.41Å; A78-V82 PolarHBondContact O-N 3.07Å; A78-V82 VanDerWaalsContact O-N 3.09Å
79	A	93.3	Very high	94.4	Very high	58 Å²	58	68 Å²	68	48%	0.479	40%	0.397	S	S	.	.	H	α-helix	trans	-66	-16	178.6	0	0	0	0	0	114.3	L75 E77	L75-A79 VanDerWaalsContact O-CB 3.32Å; L75-A79 WeakPolarHBondContact O-CB 3.48Å; L75-A79 PolarHBondContact O-N 2.77Å; E77-A79 VanDerWaalsContact C-N 3.31Å; E77-A79 PolarHBondContact O-N 3.03Å
80	K	92.8	Very high	94.3	Very high	142 Å²	142	69 Å²	69	62%	0.617	40%	0.396	S	S	*	.	H	α-helix	trans	-78.5	-25.1	172.3	-63.3	173.7	-165.6	168.4	0	112.3	E77 A78	E77-K80 WeakPolarHBondContact O-CB 3.29Å; E77-K80 PolarHBondContact O-N 3.05Å; E77-K80 VanDerWaalsContact O-N 3.16Å; E77-K80 IonicContact OE1-NZ 2.71Å; E77-K80 PolarHBondContact OE1-NZ 3.41Å; E77-K80 WeakPolarHBondContact OE2-CE 3.13Å; E77-K80 IonicContact OE2-NZ 2.71Å; E77-K80 PolarHBondContact OE2-NZ 3.31Å; A78-K80 PolarHBondContact O-N 2.98Å
81	L	92	Very high	94.1	Very high	41 Å²	41	68.7 Å²	68.7	22%	0.215	40%	0.395	C	S	.	.	H	α-helix	trans	-95.1	-26.9	-176.3	-62.4	178.3	0	0	0	112.3	Q23 R27 L28 V49 A78	Q23-L81 PolarHBondContact NE2-O 3.07Å; R27-L81 HydrophobicContact CG-CD1 4.25Å; L28-L81 HydrophobicContact CD2-CD1 4.2Å; V49-L81 HydrophobicContact CG1-CB 3.93Å; V49-L81 HydrophobicContact CG1-CD1 3.85Å; V49-L81 HydrophobicContact CG2-CD1 4.12Å; A78-L81 PolarHBondContact O-N 3.41Å
82	V	90.9	Very high	93.9	Very high	6 Å²	6	74.2 Å²	74.2	4%	0.036	42%	0.419	C	S	.	.	S	Bend	trans	-111.3	117.4	-178.1	-176.1	0	0	0	0	109.4	V49 E50 A53 Y54 A78 M84	V49-V82 HydrophobicContact CB-CG2 4.35Å; V49-V82 HydrophobicContact CG1-CG2 3.82Å; E50-V82 HydrophobicContact CG-CG1 4.43Å; E50-V82 HydrophobicContact CG-CG2 4.13Å; A53-V82 HydrophobicContact CB-CB 3.98Å; A53-V82 HydrophobicContact CB-CG1 4.25Å; A53-V82 HydrophobicContact CB-CG2 3.94Å; Y54-V82 HydrophobicContact CE1-CG1 4.03Å; A78-V82 PolarHBondContact O-N 3.07Å; A78-V82 VanDerWaalsContact O-N 3.09Å; V82-M84 HydrophobicContact CB-CG 4.45Å; V82-M84 HydrophobicContact CG1-CG 4.11Å; V82-M84 HydrophobicContact CG1-SD 3.92Å; V82-M84 WeakPolarHBondContact O-CG 3.33Å; V82-M84 PolarHBondContact O-N 3.39Å
83	P	87.1	Confident	93.6	Very high	97 Å²	97	77 Å²	77	63%	0.63	43%	0.43	S	S	*	.			trans	-72.3	96.7	-179.9	28.9	-33.4	0	0	0	111
84	M	86.2	Confident	93.4	Very high	112 Å²	112	77.4 Å²	77.4	55%	0.552	43%	0.434	S	S	*	.			trans	-98.1	4.2	-178.2	-65.1	-68.5	-75.9	0	0	114.2	Y54 V82	Y54-M84 HydrophobicContact CD1-CE 3.79Å; Y54-M84 HydrophobicContact CD1-SD 3.72Å; Y54-M84 HydrophobicContact CE1-CE 4.16Å; Y54-M84 HydrophobicContact CE1-SD 3.49Å; Y54-M84 WeakPolarHBondContact CE1-SD 3.45Å; V82-M84 HydrophobicContact CB-CG 4.45Å; V82-M84 HydrophobicContact CG1-CG 4.11Å; V82-M84 HydrophobicContact CG1-SD 3.92Å; V82-M84 WeakPolarHBondContact O-CG 3.33Å; V82-M84 PolarHBondContact O-N 3.39Å
85	G	91.4	Very high	93	Very high	58 Å²	58	82.4 Å²	82.4	60%	0.598	45%	0.452	S	S	*	.	S	Bend	trans	-84.2	176.7	-174.2	0	0	0	0	0	114.2
86	F	94.2	Very high	92.7	Very high	223 Å²	223	85.3 Å²	85.3	98%	0.978	46%	0.461	S	S	*	.			trans	-66.1	135.3	170.3	-70.5	-88	0	0	0	110.7
87	T	93.4	Very high	92.4	Very high	65 Å²	65	87.1 Å²	87.1	40%	0.399	47%	0.47	S	S	.	.			trans	-124.2	164	173.7	60.7	0	0	0	0	109.7
88	T	95.9	Very high	92.1	Very high	87 Å²	87	92.1 Å²	92.1	53%	0.534	49%	0.493	S	S	.	.			trans	-76	150	177.7	69.6	0	0	0	0	110.8	T90 E91 F92	T88-T90 PolarHBondContact O-N 3.44Å; T88-E91 PolarHBondContact O-N 3.09Å; T88-E91 VanDerWaalsContact O-N 3.16Å; T88-E91 WeakPolarHBondContact OG1-CB 3.38Å; T88-E91 PolarHBondContact OG1-N 3.22Å; T88-F92 PolarHBondContact O-N 3.32Å
89	A	95.9	Very high	92	Very high	86 Å²	86	94.5 Å²	94.5	71%	0.711	51%	0.505	S	S	*	.	H	α-helix	trans	-59.1	-30.9	175.4	0	0	0	0	0	112.6	H93	A89-H93 WeakPolarHBondContact O-CB 3.48Å; A89-H93 PolarHBondContact O-N 3.29Å
90	T	96.5	Very high	92.2	Very high	98 Å²	98	93.3 Å²	93.3	60%	0.601	49%	0.491	S	S	*	.	H	α-helix	trans	-65.2	-46.1	175.4	-58.1	0	0	0	0	112	T88 H93 Q94	T88-T90 PolarHBondContact O-N 3.44Å; T90-H93 WeakPolarHBondContact O-CB 3.34Å; T90-H93 PolarHBondContact O-N 3.48Å; T90-Q94 WeakPolarHBondContact O-CG 3.5Å; T90-Q94 PolarHBondContact O-N 3.5Å
91	E	92.8	Very high	92.4	Very high	69 Å²	69	90.1 Å²	90.1	32%	0.322	48%	0.478	S	S	.	.	H	α-helix	trans	-63.9	-42.8	176.9	-172.2	-172.9	165.1	0	0	111	T88 H93 Q94 R95	T88-E91 PolarHBondContact O-N 3.09Å; T88-E91 VanDerWaalsContact O-N 3.16Å; T88-E91 WeakPolarHBondContact OG1-CB 3.38Å; T88-E91 PolarHBondContact OG1-N 3.22Å; E91-H93 VanDerWaalsContact C-N 3.31Å; E91-H93 PolarHBondContact O-N 3.4Å; E91-Q94 PolarHBondContact O-N 2.9Å; E91-R95 WeakPolarHBondContact O-CG 3.3Å; E91-R95 PolarHBondContact O-N 3.16Å; E91-R95 VanDerWaalsContact O-N 3.08Å; E91-R95 IonicContact OE1-CZ 3.18Å; E91-R95 IonicContact OE1-NE 3.24Å; E91-R95 IonicContact OE1-NH2 2.89Å; E91-R95 PolarHBondContact OE1-NH2 3.43Å
92	F	92.2	Very high	92.7	Very high	115 Å²	115	88.2 Å²	88.2	50%	0.504	47%	0.468	S	S	.	.	H	α-helix	trans	-62.9	-37.7	175.4	-173.4	-109.3	0	0	0	112.4	T88 R95 R96	T88-F92 PolarHBondContact O-N 3.32Å; F92-R95 PolarHBondContact O-N 2.92Å; F92-R96 HydrophobicContact CD1-CG 4.34Å; F92-R96 VanDerWaalsContact CE1-CD 3.43Å; F92-R96 HydrophobicContact CE1-CG 3.96Å; F92-R96 HydrophobicContact CZ-CG 4.09Å; F92-R96 WeakPolarHBondContact O-CG 3.45Å; F92-R96 PolarHBondContact O-N 3.5Å
93	H	92.4	Very high	93.1	Very high	133 Å²	133	88.8 Å²	88.8	62%	0.616	47%	0.471	S	S	*	.	H	α-helix	trans	-63.4	-40.5	175	179.3	58.4	0	0	0	112.4	A89 T90 E91 R96 S97	A89-H93 WeakPolarHBondContact O-CB 3.48Å; A89-H93 PolarHBondContact O-N 3.29Å; T90-H93 WeakPolarHBondContact O-CB 3.34Å; T90-H93 PolarHBondContact O-N 3.48Å; E91-H93 VanDerWaalsContact C-N 3.31Å; E91-H93 PolarHBondContact O-N 3.4Å; H93-R96 PolarHBondContact O-N 3.42Å; H93-S97 PolarHBondContact O-N 3.28Å
94	Q	92.4	Very high	93.7	Very high	112 Å²	112	84.2 Å²	84.2	52%	0.523	44%	0.442	S	S	.	.	H	α-helix	trans	-60.9	-48.7	174.7	-71.7	172.1	-8.9	0	0	111.1	T90 E91 R96 S97	T90-Q94 WeakPolarHBondContact O-CG 3.5Å; T90-Q94 PolarHBondContact O-N 3.5Å; E91-Q94 PolarHBondContact O-N 2.9Å; Q94-R96 VanDerWaalsContact C-N 3.26Å; Q94-R96 PolarHBondContact O-N 3.45Å; Q94-S97 WeakPolarHBondContact O-CB 3.34Å; Q94-S97 PolarHBondContact O-N 2.93Å; Q94-S97 PolarHBondContact O-OG 3.43Å
95	R	89.4	Confident	94.2	Very high	106 Å²	106	79.1 Å²	79.1	40%	0.4	42%	0.418	S	S	.	.	H	α-helix	trans	-57.5	-39.5	175.1	-64.5	-180	-169.5	-165.9	2.5	112.3	E91 F92 S97 E98	E91-R95 WeakPolarHBondContact O-CG 3.3Å; E91-R95 PolarHBondContact O-N 3.16Å; E91-R95 VanDerWaalsContact O-N 3.08Å; E91-R95 IonicContact OE1-CZ 3.18Å; E91-R95 IonicContact OE1-NE 3.24Å; E91-R95 IonicContact OE1-NH2 2.89Å; E91-R95 PolarHBondContact OE1-NH2 3.43Å; F92-R95 PolarHBondContact O-N 2.92Å; R95-S97 VanDerWaalsContact C-N 3.28Å; R95-S97 PolarHBondContact O-N 3.12Å; R95-E98 PolarHBondContact O-N 2.94Å
96	R	90.3	Very high	94.5	Very high	99 Å²	99	76.3 Å²	76.3	37%	0.374	39%	0.389	S	S	.	.	H	α-helix	trans	-67	-26.8	176.1	-75.5	-166	61.5	74.2	3	113.7	F92 H93 Q94 E98 I99 E118	F92-R96 HydrophobicContact CD1-CG 4.34Å; F92-R96 VanDerWaalsContact CE1-CD 3.43Å; F92-R96 HydrophobicContact CE1-CG 3.96Å; F92-R96 HydrophobicContact CZ-CG 4.09Å; F92-R96 WeakPolarHBondContact O-CG 3.45Å; F92-R96 PolarHBondContact O-N 3.5Å; H93-R96 PolarHBondContact O-N 3.42Å; Q94-R96 VanDerWaalsContact C-N 3.26Å; Q94-R96 PolarHBondContact O-N 3.45Å; R96-E98 PolarHBondContact O-N 3.03Å; R96-I99 HydrophobicContact CB-CD1 4.11Å; R96-I99 HydrophobicContact CG-CD1 3.95Å; R96-I99 WeakPolarHBondContact O-CB 3.48Å; R96-I99 WeakPolarHBondContact O-CG1 3.38Å; R96-I99 PolarHBondContact O-N 2.94Å; R96-E118 IonicContact CZ-OE1 3.12Å; R96-E118 IonicContact NH1-OE1 2.79Å; R96-E118 PolarHBondContact NH1-OE1 2.96Å; R96-E118 IonicContact NH2-OE1 3.86Å; R96-E118 PolarHBondContact NH2-OE1 3.02Å; R96-E118 IonicContact NH2-OE2 3.78Å; R96-E118 PolarHBondContact NH2-OE2 3.3Å
97	S	89.3	Confident	94.7	Very high	89 Å²	89	73.2 Å²	73.2	62%	0.622	38%	0.375	S	S	*	.	H	α-helix	trans	-71.9	-16	176.6	73.1	0	0	0	0	113.5	H93 Q94 R95	H93-S97 PolarHBondContact O-N 3.28Å; Q94-S97 WeakPolarHBondContact O-CB 3.34Å; Q94-S97 PolarHBondContact O-N 2.93Å; Q94-S97 PolarHBondContact O-OG 3.43Å; R95-S97 VanDerWaalsContact C-N 3.28Å; R95-S97 PolarHBondContact O-N 3.12Å
98	E	89.5	Confident	95	Very high	138 Å²	138	74.3 Å²	74.3	65%	0.645	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-92	-2	177	-62.4	167.2	-177.9	0	0	112.5	R95 R96 I100	R95-E98 PolarHBondContact O-N 2.94Å; R96-E98 PolarHBondContact O-N 3.03Å; E98-I100 PolarHBondContact O-N 3.49Å
99	I	93.8	Very high	95.1	Very high	50 Å²	50	70.4 Å²	70.4	26%	0.256	35%	0.352	S	S	.	.			trans	-67.2	129.1	179.3	-67.3	173.9	0	0	0	109.9	R96 E118	R96-I99 HydrophobicContact CB-CD1 4.11Å; R96-I99 HydrophobicContact CG-CD1 3.95Å; R96-I99 WeakPolarHBondContact O-CB 3.48Å; R96-I99 WeakPolarHBondContact O-CG1 3.38Å; R96-I99 PolarHBondContact O-N 2.94Å; I99-E118 HydrophobicContact CG2-CG 3.5Å
100	I	96.9	Very high	95.2	Very high	34 Å²	34	67.6 Å²	67.6	17%	0.174	33%	0.325	C	S	.	.			trans	-76.1	138.5	176.7	-62.5	172.7	0	0	0	109.4	E98 T119 I148 G152	E98-I100 PolarHBondContact O-N 3.49Å; I100-T119 HydrophobicContact CB-CG2 4Å; I100-T119 HydrophobicContact CG2-CG2 4.25Å; I100-T119 PolarHBondContact N-OG1 2.94Å; I100-T119 WeakPolarHBondContact O-CG2 3.43Å; I100-T119 PolarHBondContact O-N 2.92Å; I100-T119 PolarHBondContact O-OG1 2.94Å; I100-T119 VanDerWaalsContact O-OG1 3.04Å; I100-I148 HydrophobicContact CD1-CD1 4.06Å; I100-I148 HydrophobicContact CD1-CG1 4.46Å; I100-G152 WeakPolarHBondContact CG2-O 3.32Å
101	Q	98	Very high	95.3	Very high	75 Å²	75	70.1 Å²	70.1	35%	0.35	33%	0.328	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.3	117.2	175.1	-66.2	174.9	-32.5	0	0	109.3	Q114 I117	Q101-Q114 PolarHBondContact OE1-O 3.29Å; Q101-I117 WeakPolarHBondContact CA-O 3.49Å
102	I	98.8	Very high	95.5	Very high	0 Å²	0	67.7 Å²	67.7	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	125.1	-175.5	-59.9	166.4	0	0	0	109.7	G116 I117 T119 L140 C144 G151 A217 L218 A262	I102-G116 CarbonylContact O-C 3.59Å; I102-G116 WeakPolarHBondContact O-CA 3.48Å; I102-I117 HydrophobicContact CB-CB 4.49Å; I102-I117 PolarHBondContact N-O 3.24Å; I102-I117 PolarHBondContact O-N 3.2Å; I102-T119 HydrophobicContact CD1-CG2 4.26Å; I102-T119 HydrophobicContact CG1-CG2 4.5Å; I102-L140 HydrophobicContact CG2-CD2 4.19Å; I102-C144 HydrophobicContact CD1-CB 3.84Å; I102-C144 HydrophobicContact CG2-CB 4.14Å; I102-G151 CarbonylContact C-O 3.46Å; I102-G151 WeakPolarHBondContact CA-O 3.41Å; I102-A217 HydrophobicContact CD1-CB 4.5Å; I102-L218 HydrophobicContact CD1-CB 4.47Å; I102-A262 HydrophobicContact CD1-CB 3.91Å
103	T	98.8	Very high	95.8	Very high	18 Å²	18	62.7 Å²	62.7	11%	0.11	30%	0.295	C	S	.	.			trans	-59.5	137.4	176.4	178.9	0	0	0	0	111.5	G105 D110 L140 T143 L146 G151	T103-G105 VanDerWaalsContact C-N 3.27Å; T103-G105 PolarHBondContact OG1-N 3.39Å; T103-G105 VanDerWaalsContact OG1-N 3.13Å; T103-D110 WeakPolarHBondContact CB-OD2 3.13Å; T103-D110 PolarHBondContact OG1-OD2 3.16Å; T103-L140 WeakPolarHBondContact O-CD2 3.49Å; T103-T143 HydrophobicContact CG2-CG2 4.01Å; T103-T143 WeakPolarHBondContact O-CB 3.43Å; T103-T143 PolarHBondContact O-OG1 3.29Å; T103-L146 HydrophobicContact CG2-CD1 4.36Å; T103-G151 WeakPolarHBondContact CG2-O 3.34Å; T103-G151 PolarHBondContact N-O 2.89Å
104	T	98.8	Very high	96	Very high	1 Å²	1	62 Å²	62	1%	0.006	29%	0.292	C	S	.	.			trans	-79.8	-11.4	174.6	65.2	0	0	0	0	112.8	S106 L109 D110 L113 I117	T104-S106 VanDerWaalsContact C-N 3.31Å; T104-S106 PolarHBondContact OG1-N 3.1Å; T104-S106 PolarHBondContact OG1-O 3.11Å; T104-L109 HydrophobicContact CG2-CB 4.21Å; T104-L109 WeakPolarHBondContact OG1-CB 3.39Å; T104-D110 VanDerWaalsContact CB-OD1 3.29Å; T104-D110 WeakPolarHBondContact CB-OD1 3.25Å; T104-D110 WeakPolarHBondContact CG2-OD1 3.45Å; T104-D110 PolarHBondContact N-OD1 3.04Å; T104-D110 PolarHBondContact OG1-OD1 3.4Å; T104-L113 HydrophobicContact CG2-CD1 3.75Å; T104-I117 HydrophobicContact CG2-CD1 4.38Å; T104-I117 HydrophobicContact CG2-CG1 4.22Å
105	G	98.1	Very high	96.2	Very high	5 Å²	5	58.2 Å²	58.2	5%	0.052	28%	0.283	C	S	.	.	S	Bend	trans	83.2	-3.5	-172.4	0	0	0	0	0	115.1	T103 R177 Y178 V334	T103-G105 VanDerWaalsContact C-N 3.27Å; T103-G105 PolarHBondContact OG1-N 3.39Å; T103-G105 VanDerWaalsContact OG1-N 3.13Å; G105-R177 PolarHBondContact O-NH2 3.06Å; G105-Y178 WeakPolarHBondContact CA-OH 3.47Å; G105-V334 CarbonylContact C-O 3.54Å
106	S	98.4	Very high	96.6	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.			trans	-115.5	129	168	168.4	0	0	0	0	109.3	T104 E108 L109 D110 D336	T104-S106 VanDerWaalsContact C-N 3.31Å; T104-S106 PolarHBondContact OG1-N 3.1Å; T104-S106 PolarHBondContact OG1-O 3.11Å; S106-E108 VanDerWaalsContact C-N 3.28Å; S106-E108 PolarHBondContact O-N 3.21Å; S106-E108 PolarHBondContact OG-N 2.92Å; S106-L109 PolarHBondContact O-N 3.05Å; S106-L109 PolarHBondContact OG-N 3.26Å; S106-D110 PolarHBondContact O-N 3.33Å; S106-D336 WeakPolarHBondContact CA-OD1 3.34Å; S106-D336 WeakPolarHBondContact CB-OD1 3.49Å; S106-D336 PolarHBondContact OG-OD1 3.14Å
107	K	98.1	Very high	97	Very high	157 Å²	157	48.8 Å²	48.8	68%	0.683	25%	0.249	S	C	*	.	H	α-helix	trans	-64.3	-36	177.3	-67.2	178.4	179.2	179.1	0	111.6	D110 K111 D336	K107-D110 PolarHBondContact O-N 3.27Å; K107-K111 WeakPolarHBondContact O-CB 3.33Å; K107-K111 PolarHBondContact O-N 3.06Å; K107-D336 PolarHBondContact N-OD1 3.12Å
108	E	98	Very high	97.4	Very high	89 Å²	89	45.9 Å²	45.9	42%	0.416	23%	0.225	S	C	.	.	H	α-helix	trans	-69	-36.7	177.5	-68.4	-57.3	131.5	0	0	112	S106 L112 A325 D336	S106-E108 VanDerWaalsContact C-N 3.28Å; S106-E108 PolarHBondContact O-N 3.21Å; S106-E108 PolarHBondContact OG-N 2.92Å; E108-L112 WeakPolarHBondContact O-CB 3.41Å; E108-L112 PolarHBondContact O-N 2.93Å; E108-A325 HydrophobicContact CB-CB 4.31Å; E108-A325 WeakPolarHBondContact O-CB 3.32Å; E108-D336 PolarHBondContact N-OD1 3.41Å
109	L	98.1	Very high	97.8	Very high	4 Å²	4	40.1 Å²	40.1	2%	0.021	20%	0.2	C	C	.	.	H	α-helix	trans	-69.7	-43.2	172.2	-72.5	-177.4	0	0	0	112.3	T104 S106 K111 L112 L113 C312 A325 F327 V334	T104-L109 HydrophobicContact CG2-CB 4.21Å; T104-L109 WeakPolarHBondContact OG1-CB 3.39Å; S106-L109 PolarHBondContact O-N 3.05Å; S106-L109 PolarHBondContact OG-N 3.26Å; L109-K111 VanDerWaalsContact C-N 3.27Å; L109-K111 PolarHBondContact O-N 3.03Å; L109-L112 HydrophobicContact CD2-CD2 4.48Å; L109-L112 WeakPolarHBondContact O-CB 3.49Å; L109-L112 PolarHBondContact O-N 2.98Å; L109-L112 VanDerWaalsContact O-N 3.17Å; L109-L113 WeakPolarHBondContact O-CG 3.37Å; L109-L113 PolarHBondContact O-N 3.04Å; L109-C312 HydrophobicContact CD2-CB 3.43Å; L109-C312 VanDerWaalsContact CD2-CB 3.43Å; L109-A325 HydrophobicContact CD2-CB 4.35Å; L109-F327 HydrophobicContact CD1-CB 3.87Å; L109-F327 HydrophobicContact CD1-CD1 3.9Å; L109-F327 HydrophobicContact CD1-CD2 4.24Å; L109-F327 HydrophobicContact CD1-CE1 4.46Å; L109-F327 HydrophobicContact CD1-CG 3.76Å; L109-F327 HydrophobicContact CD2-CB 4.44Å; L109-F327 HydrophobicContact CD2-CD1 3.84Å; L109-F327 HydrophobicContact CD2-CE1 4.46Å; L109-F327 HydrophobicContact CD2-CG 4.39Å; L109-F327 HydrophobicContact CG-CB 3.93Å; L109-F327 HydrophobicContact CG-CD1 4.14Å; L109-F327 HydrophobicContact CG-CG 4.19Å; L109-V334 HydrophobicContact CD1-CG1 3.97Å
110	D	98.6	Very high	97.9	Very high	27 Å²	27	39.1 Å²	39.1	14%	0.144	20%	0.202	C	C	.	.	H	α-helix	trans	-62.5	-38.9	177.3	-67	-11.5	0	0	0	110.6	T103 T104 S106 K107 L113 Q114 G115	T103-D110 WeakPolarHBondContact CB-OD2 3.13Å; T103-D110 PolarHBondContact OG1-OD2 3.16Å; T104-D110 VanDerWaalsContact CB-OD1 3.29Å; T104-D110 WeakPolarHBondContact CB-OD1 3.25Å; T104-D110 WeakPolarHBondContact CG2-OD1 3.45Å; T104-D110 PolarHBondContact N-OD1 3.04Å; T104-D110 PolarHBondContact OG1-OD1 3.4Å; S106-D110 PolarHBondContact O-N 3.33Å; K107-D110 PolarHBondContact O-N 3.27Å; D110-L113 CarbonylContact O-C 3.59Å; D110-L113 PolarHBondContact O-N 3.4Å; D110-Q114 PolarHBondContact O-N 3.26Å; D110-G115 PolarHBondContact O-N 2.82Å
111	K	98.3	Very high	97.9	Very high	152 Å²	152	37.7 Å²	37.7	66%	0.661	20%	0.195	S	C	*	.	H	α-helix	trans	-63.9	-42.5	173	-177	-178	177.5	-173	0	112.4	K107 L109 L113 Q114	K107-K111 WeakPolarHBondContact O-CB 3.33Å; K107-K111 PolarHBondContact O-N 3.06Å; L109-K111 VanDerWaalsContact C-N 3.27Å; L109-K111 PolarHBondContact O-N 3.03Å; K111-L113 PolarHBondContact O-N 3.02Å; K111-Q114 PolarHBondContact O-N 3.15Å
112	L	98.3	Very high	97.9	Very high	17 Å²	17	34.1 Å²	34.1	9%	0.089	18%	0.178	C	C	.	.	H	α-helix	trans	-57.8	-41.6	174.4	178.7	65.4	0	0	0	111	E108 L109 Q114 C312 I314 A323 A325	E108-L112 WeakPolarHBondContact O-CB 3.41Å; E108-L112 PolarHBondContact O-N 2.93Å; L109-L112 HydrophobicContact CD2-CD2 4.48Å; L109-L112 WeakPolarHBondContact O-CB 3.49Å; L109-L112 PolarHBondContact O-N 2.98Å; L109-L112 VanDerWaalsContact O-N 3.17Å; L112-Q114 VanDerWaalsContact C-N 3.32Å; L112-C312 HydrophobicContact CD2-CB 4.19Å; L112-I314 HydrophobicContact CD1-CD1 3.71Å; L112-I314 HydrophobicContact CD1-CG1 3.94Å; L112-I314 HydrophobicContact CD2-CG1 4.13Å; L112-I314 HydrophobicContact CG-CD1 3.78Å; L112-I314 HydrophobicContact CG-CG1 3.88Å; L112-I314 WeakPolarHBondContact O-CD1 3.36Å; L112-A323 HydrophobicContact CD1-CB 3.49Å; L112-A323 VanDerWaalsContact CD1-CB 3.49Å; L112-A325 HydrophobicContact CB-CB 3.84Å; L112-A325 HydrophobicContact CD2-CB 3.82Å; L112-A325 HydrophobicContact CG-CB 4.27Å
113	L	98.1	Very high	97.9	Very high	10 Å²	10	34.3 Å²	34.3	5%	0.052	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-86.1	2.3	-179.6	-60.8	176.3	0	0	0	114.3	T104 L109 D110 K111 G115 G116 I117 L300 L320	T104-L113 HydrophobicContact CG2-CD1 3.75Å; L109-L113 WeakPolarHBondContact O-CG 3.37Å; L109-L113 PolarHBondContact O-N 3.04Å; D110-L113 CarbonylContact O-C 3.59Å; D110-L113 PolarHBondContact O-N 3.4Å; K111-L113 PolarHBondContact O-N 3.02Å; L113-G115 PolarHBondContact O-N 3.17Å; L113-G116 WeakPolarHBondContact CB-O 3.39Å; L113-I117 HydrophobicContact CD1-CD1 3.81Å; L113-L300 HydrophobicContact CD1-CD1 4.4Å; L113-L300 HydrophobicContact CD2-CD1 3.96Å; L113-L300 HydrophobicContact CD2-CD2 3.83Å; L113-L320 HydrophobicContact CD2-CD1 4.06Å
114	Q	97.1	Very high	97.9	Very high	120 Å²	120	33.4 Å²	33.4	56%	0.561	17%	0.174	S	C	*	.	T	Hydrogen-bonded Turn	trans	53.2	36.4	-174.7	-58.5	179.1	17.8	0	0	113.7	Q101 D110 K111 L112 L320	Q101-Q114 PolarHBondContact OE1-O 3.29Å; D110-Q114 PolarHBondContact O-N 3.26Å; K111-Q114 PolarHBondContact O-N 3.15Å; L112-Q114 VanDerWaalsContact C-N 3.32Å; Q114-L320 HydrophobicContact CB-CD2 3.97Å; Q114-L320 HydrophobicContact CG-CD2 3.68Å
115	G	96.2	Very high	97.9	Very high	32 Å²	32	33.4 Å²	33.4	33%	0.33	17%	0.174	S	C	.	.	T	Hydrogen-bonded Turn	trans	145.3	-41.9	171.7	0	0	0	0	0	113.5	D110 L113	D110-G115 PolarHBondContact O-N 2.82Å; L113-G115 PolarHBondContact O-N 3.17Å
116	G	97.9	Very high	97.9	Very high	4 Å²	4	33.4 Å²	33.4	4%	0.041	17%	0.172	C	C	.	.	S	Bend	trans	153.7	-156.6	-179.4	0	0	0	0	0	113.2	I102 L113 E118	I102-G116 CarbonylContact O-C 3.59Å; I102-G116 WeakPolarHBondContact O-CA 3.48Å; L113-G116 WeakPolarHBondContact CB-O 3.39Å; G116-E118 PolarHBondContact O-N 3.13Å
117	I	98.6	Very high	97.8	Very high	2 Å²	2	33.4 Å²	33.4	1%	0.01	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-78	117.3	176.3	-55.8	-65.2	0	0	0	109.3	Q101 I102 T104 L113 T123 L140 A262 V264	Q101-I117 WeakPolarHBondContact CA-O 3.49Å; I102-I117 HydrophobicContact CB-CB 4.49Å; I102-I117 PolarHBondContact N-O 3.24Å; I102-I117 PolarHBondContact O-N 3.2Å; T104-I117 HydrophobicContact CG2-CD1 4.38Å; T104-I117 HydrophobicContact CG2-CG1 4.22Å; L113-I117 HydrophobicContact CD1-CD1 3.81Å; I117-T123 HydrophobicContact CD1-CG2 4.09Å; I117-L140 HydrophobicContact CG1-CD1 4.01Å; I117-L140 HydrophobicContact CG1-CD2 3.84Å; I117-A262 HydrophobicContact CG2-CB 4.09Å; I117-V264 HydrophobicContact CG2-CG2 3.79Å
118	E	97.9	Very high	97.6	Very high	28 Å²	28	29.2 Å²	29.2	13%	0.131	16%	0.156	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-71.3	126.2	-178.4	-169.4	176.1	146.5	0	0	111.8	R96 I99 G116 S121	R96-E118 IonicContact CZ-OE1 3.12Å; R96-E118 IonicContact NH1-OE1 2.79Å; R96-E118 PolarHBondContact NH1-OE1 2.96Å; R96-E118 IonicContact NH2-OE1 3.86Å; R96-E118 PolarHBondContact NH2-OE1 3.02Å; R96-E118 IonicContact NH2-OE2 3.78Å; R96-E118 PolarHBondContact NH2-OE2 3.3Å; I99-E118 HydrophobicContact CG2-CG 3.5Å; G116-E118 PolarHBondContact O-N 3.13Å; E118-S121 PolarHBondContact O-OG 3.44Å
119	T	97.6	Very high	97.2	Very high	17 Å²	17	33.2 Å²	33.2	10%	0.104	17%	0.172	C	C	.	.	T	Hydrogen-bonded Turn	trans	-70.8	155.5	171	57.7	0	0	0	0	112.3	I100 I102 S121 G260 A262	I100-T119 HydrophobicContact CB-CG2 4Å; I100-T119 HydrophobicContact CG2-CG2 4.25Å; I100-T119 PolarHBondContact N-OG1 2.94Å; I100-T119 WeakPolarHBondContact O-CG2 3.43Å; I100-T119 PolarHBondContact O-N 2.92Å; I100-T119 PolarHBondContact O-OG1 2.94Å; I100-T119 VanDerWaalsContact O-OG1 3.04Å; I102-T119 HydrophobicContact CD1-CG2 4.26Å; I102-T119 HydrophobicContact CG1-CG2 4.5Å; T119-S121 VanDerWaalsContact C-N 3.26Å; T119-S121 PolarHBondContact O-N 3.19Å; T119-G260 WeakPolarHBondContact CB-O 3.36Å; T119-A262 HydrophobicContact CG2-CB 4.03Å
120	G	95.8	Very high	97	Very high	29 Å²	29	41.7 Å²	41.7	30%	0.299	20%	0.203	S	C	.	.	T	Hydrogen-bonded Turn	trans	72.7	20.1	-178.2	0	0	0	0	0	113.4	V261	G120-V261 PolarHBondContact N-O 3Å
121	S	96.5	Very high	96.9	Very high	4 Å²	4	40.4 Å²	40.4	3%	0.028	20%	0.197	C	C	.	.	S	Bend	trans	-145.5	162.6	179.6	80.5	0	0	0	0	111.8	E118 T119 V263	E118-S121 PolarHBondContact O-OG 3.44Å; T119-S121 VanDerWaalsContact C-N 3.26Å; T119-S121 PolarHBondContact O-N 3.19Å; S121-V263 PolarHBondContact O-N 2.93Å
122	I	98.6	Very high	96.8	Very high	0 Å²	0	33.6 Å²	33.6	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	120.9	173.3	-58.5	179	0	0	0	109.3	L252 L253 V263 I265 T297 T298	I122-L252 HydrophobicContact CD1-CB 3.95Å; I122-L253 HydrophobicContact CD1-CB 4.04Å; I122-V263 CarbonylContact C-O 3.56Å; I122-V263 WeakPolarHBondContact CA-O 3.27Å; I122-V263 HydrophobicContact CG1-CB 4.08Å; I122-V263 HydrophobicContact CG1-CG1 4.21Å; I122-V263 HydrophobicContact CG2-CG1 4.47Å; I122-I265 HydrophobicContact CG2-CD1 3.82Å; I122-I265 HydrophobicContact CG2-CG1 4.1Å; I122-I265 HydrophobicContact CG2-CG2 4.47Å; I122-T297 PolarHBondContact O-N 3.48Å; I122-T298 PolarHBondContact O-N 2.92Å
123	T	98.8	Very high	96.8	Very high	4 Å²	4	33.8 Å²	33.8	3%	0.025	17%	0.17	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.5	120.5	170.6	-60.1	0	0	0	0	110.7	I117 L125 V263 V264 I265 T298 L300	I117-T123 HydrophobicContact CD1-CG2 4.09Å; T123-L125 HydrophobicContact CG2-CD2 4.43Å; T123-V263 PolarHBondContact N-O 2.92Å; T123-V264 WeakPolarHBondContact O-CA 3.42Å; T123-I265 PolarHBondContact O-N 3.01Å; T123-T298 CarbonylContact C-O 3.6Å; T123-T298 WeakPolarHBondContact CA-O 3.13Å; T123-L300 HydrophobicContact CG2-CD1 4.07Å; T123-L300 HydrophobicContact CG2-CG 4.28Å
124	E	98.8	Very high	96.8	Very high	0 Å²	0	34.8 Å²	34.8	0%	0	18%	0.176	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96	124	177.4	-176.5	-169.6	169	0	0	111.3	F126 I265 N267 T298 R299 L300	E124-F126 HydrophobicContact CG-CD1 4.49Å; E124-I265 WeakPolarHBondContact CA-O 3.43Å; E124-I265 HydrophobicContact CB-CD1 4.27Å; E124-I265 HydrophobicContact CB-CG1 3.95Å; E124-I265 HydrophobicContact CG-CD1 4.35Å; E124-I265 HydrophobicContact CG-CG1 4.1Å; E124-N267 HydrophobicContact CG-CB 4.13Å; E124-N267 WeakPolarHBondContact OE1-CB 3.37Å; E124-N267 PolarHBondContact OE1-ND2 2.86Å; E124-T298 PolarHBondContact N-O 3.34Å; E124-R299 HydrophobicContact CB-CG 4.34Å; E124-R299 IonicContact OE1-NH2 2.79Å; E124-R299 PolarHBondContact OE1-NH2 2.98Å; E124-R299 IonicContact OE2-CZ 3.33Å; E124-R299 IonicContact OE2-NE 3.01Å; E124-R299 PolarHBondContact OE2-NE 3.25Å; E124-R299 IonicContact OE2-NH2 3.35Å; E124-R299 PolarHBondContact OE2-NH2 3.41Å; E124-L300 PolarHBondContact O-N 3.49Å
125	L	98.6	Very high	96.9	Very high	0 Å²	0	31.3 Å²	31.3	0%	0	16%	0.16	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	112	170.3	-54.2	-179.8	0	0	0	109.8	T123 K133 L136 V264 I265 T266 N267 L300	T123-L125 HydrophobicContact CG2-CD2 4.43Å; L125-K133 HydrophobicContact CB-CG 4.43Å; L125-K133 WeakPolarHBondContact O-CD 3.45Å; L125-L136 HydrophobicContact CD1-CB 4.35Å; L125-L136 HydrophobicContact CD1-CD2 3.79Å; L125-L136 HydrophobicContact CD1-CG 4.17Å; L125-L136 HydrophobicContact CD2-CD2 4.05Å; L125-V264 HydrophobicContact CD1-CG1 3.71Å; L125-V264 HydrophobicContact CG-CG1 3.97Å; L125-I265 PolarHBondContact N-O 3.25Å; L125-T266 CarbonylContact O-C 3.54Å; L125-T266 VanDerWaalsContact O-CA 3.32Å; L125-T266 WeakPolarHBondContact O-CA 3.43Å; L125-N267 PolarHBondContact O-N 2.86Å; L125-L300 HydrophobicContact CD2-CB 3.87Å; L125-L300 HydrophobicContact CD2-CD1 3.71Å; L125-L300 HydrophobicContact CD2-CG 4.19Å
126	F	97.8	Very high	97	Very high	5 Å²	5	29.9 Å²	29.9	2%	0.022	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.5	151.6	178.7	74.6	-86.9	0	0	0	112.7	E124 N267 V269 P286 R299 L300 Y301 L302 Y315	E124-F126 HydrophobicContact CG-CD1 4.49Å; F126-N267 WeakPolarHBondContact CA-O 3.1Å; F126-N267 HydrophobicContact CB-CB 3.89Å; F126-V269 HydrophobicContact CD2-CG1 3.78Å; F126-P286 HydrophobicContact CB-CB 4.21Å; F126-P286 HydrophobicContact CD2-CB 3.84Å; F126-P286 HydrophobicContact CD2-CG 4.19Å; F126-P286 HydrophobicContact CE2-CB 4.34Å; F126-P286 HydrophobicContact CE2-CG 4.18Å; F126-P286 HydrophobicContact CG-CB 3.99Å; F126-R299 HydrophobicContact CE1-CB 4.11Å; F126-L300 WeakPolarHBondContact CD1-O 3.31Å; F126-L300 PolarHBondContact N-O 3.35Å; F126-Y301 AromaticContact CD2-CD2 3.75Å; F126-Y301 HydrophobicContact CD2-CD2 3.75Å; F126-Y301 HydrophobicContact CD2-CE2 4.46Å; F126-Y301 AromaticContact CE2-CD2 3.42Å; F126-Y301 HydrophobicContact CE2-CD2 3.42Å; F126-Y301 VanDerWaalsContact CE2-CD2 3.42Å; F126-Y301 HydrophobicContact CE2-CE2 4.22Å; F126-Y301 AromaticContact CE2-CG 3.89Å; F126-Y301 HydrophobicContact CE2-CG 3.89Å; F126-Y301 HydrophobicContact CZ-CD2 4.09Å; F126-Y301 HydrophobicContact CZ-CG 4.12Å; F126-Y301 WeakPolarHBondContact O-CA 3.3Å; F126-L302 PolarHBondContact O-N 3.13Å; F126-Y315 HydrophobicContact CE1-CD1 4.29Å; F126-Y315 HydrophobicContact CE1-CD2 4.45Å; F126-Y315 AromaticContact CE1-CG 3.95Å; F126-Y315 HydrophobicContact CE1-CG 3.95Å; F126-Y315 HydrophobicContact CE2-CD2 4.49Å; F126-Y315 HydrophobicContact CZ-CD1 4Å; F126-Y315 AromaticContact CZ-CD2 3.61Å; F126-Y315 HydrophobicContact CZ-CD2 3.61Å; F126-Y315 HydrophobicContact CZ-CE1 4.5Å; F126-Y315 HydrophobicContact CZ-CE2 4.12Å; F126-Y315 AromaticContact CZ-CG 3.53Å; F126-Y315 HydrophobicContact CZ-CG 3.53Å
127	G	96.1	Very high	97	Very high	1 Å²	1	29.7 Å²	29.7	1%	0.01	14%	0.143	C	C	.	.	E	Extended strand (participates in β ladder)	trans	161.5	177.4	-179.9	0	0	0	0	0	112.3	K133 L302	G127-K133 PolarHBondContact O-NZ 2.96Å; G127-L302 WeakPolarHBondContact CA-O 3.43Å
128	E	93.6	Very high	97.1	Very high	69 Å²	69	29.7 Å²	29.7	32%	0.322	14%	0.143	S	C	.	.	S	Bend	trans	-63.9	170.9	-179.3	-66.6	-175.6	109.5	0	0	112.9	T131 K133 V269 K284	E128-T131 HydrophobicContact CB-CG2 3.91Å; E128-T131 WeakPolarHBondContact O-CG2 3.41Å; E128-T131 PolarHBondContact O-OG1 2.88Å; E128-K133 PolarHBondContact O-NZ 3.43Å; E128-V269 HydrophobicContact CB-CG2 4.35Å; E128-V269 HydrophobicContact CG-CG2 3.63Å; E128-K284 VanDerWaalsContact CD-CE 3.4Å; E128-K284 HydrophobicContact CG-CD 3.94Å; E128-K284 WeakPolarHBondContact OE1-CE 3.38Å; E128-K284 IonicContact OE1-NZ 2.85Å; E128-K284 PolarHBondContact OE1-NZ 3.21Å; E128-K284 VanDerWaalsContact OE1-NZ 3.14Å; E128-K284 IonicContact OE2-NZ 3.35Å; E128-K284 PolarHBondContact OE2-NZ 3.05Å
129	F	91.1	Very high	97.1	Very high	172 Å²	172	28.4 Å²	28.4	75%	0.754	14%	0.137	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.1	150	168.9	67.1	-84.6	0	0	0	109.9	T131	F129-T131 PolarHBondContact O-N 3.14Å; F129-T131 VanDerWaalsContact O-N 3.14Å
130	R	92.9	Very high	97.2	Very high	182 Å²	182	27.6 Å²	27.6	69%	0.687	13%	0.132	S	C	*	.	T	Hydrogen-bonded Turn	trans	65.7	8.9	177.3	-160.4	176.9	177.1	175.8	2	115.8	G132 R310	R130-G132 VanDerWaalsContact C-N 3.31Å; R130-G132 PolarHBondContact O-N 3.43Å; R130-R310 PolarHBondContact O-NE 3.03Å; R130-R310 PolarHBondContact O-NH2 3.31Å
131	T	96.3	Very high	97.3	Very high	1 Å²	1	26.2 Å²	26.2	1%	0.006	12%	0.117	C	C	.	.	S	Bend	trans	-77.6	-13.1	176.4	60.1	0	0	0	0	114.2	E128 F129 L302 R310	E128-T131 HydrophobicContact CB-CG2 3.91Å; E128-T131 WeakPolarHBondContact O-CG2 3.41Å; E128-T131 PolarHBondContact O-OG1 2.88Å; F129-T131 PolarHBondContact O-N 3.14Å; F129-T131 VanDerWaalsContact O-N 3.14Å; T131-L302 WeakPolarHBondContact CB-O 3.4Å; T131-L302 VanDerWaalsContact CG2-O 3.29Å; T131-L302 WeakPolarHBondContact CG2-O 3.37Å; T131-R310 WeakPolarHBondContact O-CD 3.43Å; T131-R310 WeakPolarHBondContact O-CG 3.36Å
132	G	96.3	Very high	97.4	Very high	8 Å²	8	26 Å²	26	8%	0.082	12%	0.116	C	C	.	.	S	Bend	trans	108.6	8	171.7	0	0	0	0	0	116.2	R130 T134 Q135 L136	R130-G132 VanDerWaalsContact C-N 3.31Å; R130-G132 PolarHBondContact O-N 3.43Å; G132-T134 PolarHBondContact O-N 2.99Å; G132-Q135 WeakPolarHBondContact O-CA 3.39Å; G132-Q135 WeakPolarHBondContact O-CB 3.41Å; G132-Q135 PolarHBondContact O-N 3.08Å; G132-L136 PolarHBondContact O-N 3.42Å
133	K	98.4	Very high	97.4	Very high	22 Å²	22	26 Å²	26	10%	0.096	12%	0.116	C	C	.	.	H	α-helix	trans	-46.4	-62.2	178.9	-61.3	-176.3	-63.5	-75.2	0	113	L125 G127 E128 Q135 L136 C137 T266 N267 L302	L125-K133 HydrophobicContact CB-CG 4.43Å; L125-K133 WeakPolarHBondContact O-CD 3.45Å; G127-K133 PolarHBondContact O-NZ 2.96Å; E128-K133 PolarHBondContact O-NZ 3.43Å; K133-Q135 VanDerWaalsContact C-N 3.25Å; K133-Q135 PolarHBondContact O-N 2.88Å; K133-L136 PolarHBondContact O-N 3.3Å; K133-L136 VanDerWaalsContact O-N 3.13Å; K133-C137 PolarHBondContact O-N 3.22Å; K133-C137 PolarHBondContact O-SG 3.32Å; K133-C137 VanDerWaalsContact O-SG 3.41Å; K133-T266 HydrophobicContact CB-CG2 4.08Å; K133-N267 WeakPolarHBondContact CD-O 3.37Å; K133-N267 WeakPolarHBondContact CE-O 3.48Å; K133-L302 HydrophobicContact CG-CD1 3.94Å
134	T	98.5	Very high	97.4	Very high	30 Å²	30	25.9 Å²	25.9	18%	0.184	12%	0.115	C	C	.	.	H	α-helix	trans	-59.5	-30.7	176.6	-52.1	0	0	0	0	113.6	G132 C137 H138 D222	G132-T134 PolarHBondContact O-N 2.99Å; T134-C137 PolarHBondContact O-N 2.97Å; T134-H138 PolarHBondContact O-N 2.83Å; T134-H138 PolarHBondContact O-ND1 3.18Å; T134-D222 VanDerWaalsContact CB-OD2 3.26Å; T134-D222 WeakPolarHBondContact CB-OD2 3.46Å; T134-D222 VanDerWaalsContact CG2-OD2 3.24Å; T134-D222 WeakPolarHBondContact CG2-OD2 3.32Å; T134-D222 PolarHBondContact OG1-OD2 3.41Å
135	Q	98.5	Very high	97.4	Very high	47 Å²	47	27.2 Å²	27.2	22%	0.22	12%	0.121	C	C	.	.	H	α-helix	trans	-71.7	-37.3	177.8	-64.9	-64.6	-52.9	0	0	111.7	G132 K133 T139 R170 I329	G132-Q135 WeakPolarHBondContact O-CA 3.39Å; G132-Q135 WeakPolarHBondContact O-CB 3.41Å; G132-Q135 PolarHBondContact O-N 3.08Å; K133-Q135 VanDerWaalsContact C-N 3.25Å; K133-Q135 PolarHBondContact O-N 2.88Å; Q135-T139 PolarHBondContact O-N 3.12Å; Q135-T139 VanDerWaalsContact O-N 3.11Å; Q135-T139 PolarHBondContact O-OG1 2.88Å; Q135-R170 VanDerWaalsContact OE1-NE 3.08Å; Q135-R170 VanDerWaalsContact OE1-NH2 3.09Å; Q135-I329 HydrophobicContact CB-CD1 4.37Å; Q135-I329 HydrophobicContact CB-CG2 4.22Å; Q135-I329 HydrophobicContact CG-CD1 4.26Å; Q135-I329 HydrophobicContact CG-CG2 3.97Å
136	L	98.7	Very high	97.4	Very high	3 Å²	3	27.2 Å²	27.2	2%	0.016	12%	0.121	C	C	.	.	H	α-helix	trans	-66.2	-43.5	171.8	-177.4	55.5	0	0	0	110.5	L125 G132 K133 H138 T139 L140 V334	L125-L136 HydrophobicContact CD1-CB 4.35Å; L125-L136 HydrophobicContact CD1-CD2 3.79Å; L125-L136 HydrophobicContact CD1-CG 4.17Å; L125-L136 HydrophobicContact CD2-CD2 4.05Å; G132-L136 PolarHBondContact O-N 3.42Å; K133-L136 PolarHBondContact O-N 3.3Å; K133-L136 VanDerWaalsContact O-N 3.13Å; L136-H138 PolarHBondContact O-N 2.91Å; L136-T139 WeakPolarHBondContact O-CB 3.45Å; L136-T139 PolarHBondContact O-N 3.1Å; L136-T139 VanDerWaalsContact O-N 3.11Å; L136-L140 HydrophobicContact CD1-CD1 4.24Å; L136-L140 HydrophobicContact CD1-CG 4.17Å; L136-L140 HydrophobicContact CG-CD1 4.01Å; L136-L140 HydrophobicContact CG-CG 4.41Å; L136-L140 WeakPolarHBondContact O-CG 3.29Å; L136-L140 PolarHBondContact O-N 3.49Å; L136-V334 HydrophobicContact CB-CG2 4.22Å; L136-V334 HydrophobicContact CD1-CB 4.38Å; L136-V334 HydrophobicContact CD1-CG1 4.24Å; L136-V334 HydrophobicContact CD1-CG2 4.22Å
137	C	98.9	Very high	97.4	Very high	0 Å²	0	29.2 Å²	29.2	0%	0	14%	0.135	C	C	.	.	H	α-helix	trans	-56.8	-46.8	173.9	-67.2	0	0	0	0	113.1	K133 T134 T139 L140 A141 Y159 I220 T266	K133-C137 PolarHBondContact O-N 3.22Å; K133-C137 PolarHBondContact O-SG 3.32Å; K133-C137 VanDerWaalsContact O-SG 3.41Å; T134-C137 PolarHBondContact O-N 2.97Å; C137-T139 VanDerWaalsContact C-N 3.29Å; C137-T139 PolarHBondContact O-N 2.95Å; C137-L140 PolarHBondContact O-N 3.08Å; C137-A141 PolarHBondContact O-N 3.41Å; C137-Y159 HydrophobicContact CB-CE2 3.84Å; C137-Y159 WeakPolarHBondContact CB-OH 3.45Å; C137-I220 HydrophobicContact CB-CD1 4.06Å; C137-I220 HydrophobicContact CB-CG2 3.94Å; C137-I220 VanDerWaalsContact O-CD1 3.22Å; C137-I220 WeakPolarHBondContact O-CD1 3.24Å; C137-T266 WeakPolarHBondContact SG-CG2 3.37Å
138	H	98.9	Very high	97.4	Very high	2 Å²	2	33.3 Å²	33.3	1%	0.009	16%	0.155	C	C	.	.	H	α-helix	trans	-61.1	-37.1	174.9	-72.1	149.2	0	0	0	113	T134 L136 F166 R167 R170 L171	T134-H138 PolarHBondContact O-N 2.83Å; T134-H138 PolarHBondContact O-ND1 3.18Å; L136-H138 PolarHBondContact O-N 2.91Å; H138-F166 AromaticContact CD2-CD2 3.92Å; H138-F166 AromaticContact NE2-CD2 3.68Å; H138-R167 PolarHBondContact NE2-N 3.16Å; H138-R170 HydrophobicContact CB-CB 4.41Å; H138-L171 HydrophobicContact CB-CD1 3.91Å
139	T	98.9	Very high	97.5	Very high	1 Å²	1	36.8 Å²	36.8	1%	0.006	18%	0.176	C	C	.	.	H	α-helix	trans	-67.3	-46.3	177.6	-54	0	0	0	0	110.4	Q135 L136 C137 A141 V142 T143 V174 V334	Q135-T139 PolarHBondContact O-N 3.12Å; Q135-T139 VanDerWaalsContact O-N 3.11Å; Q135-T139 PolarHBondContact O-OG1 2.88Å; L136-T139 WeakPolarHBondContact O-CB 3.45Å; L136-T139 PolarHBondContact O-N 3.1Å; L136-T139 VanDerWaalsContact O-N 3.11Å; C137-T139 VanDerWaalsContact C-N 3.29Å; C137-T139 PolarHBondContact O-N 2.95Å; T139-A141 VanDerWaalsContact C-N 3.33Å; T139-A141 PolarHBondContact O-N 3.24Å; T139-V142 PolarHBondContact O-N 3.43Å; T139-V142 VanDerWaalsContact O-N 3.1Å; T139-T143 HydrophobicContact CG2-CG2 4.19Å; T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.5Å; T139-V174 HydrophobicContact CG2-CG1 4.14Å; T139-V334 HydrophobicContact CG2-CB 4.25Å; T139-V334 PolarHBondContact OG1-N 3.2Å; T139-V334 VanDerWaalsContact OG1-N 3.09Å
140	L	98.9	Very high	97.8	Very high	0 Å²	0	34.4 Å²	34.4	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-63.1	-35.5	179.4	-69.2	170.9	0	0	0	113.1	I102 T103 I117 L136 C137 V142 T143 C144 L218 V264	I102-L140 HydrophobicContact CG2-CD2 4.19Å; T103-L140 WeakPolarHBondContact O-CD2 3.49Å; I117-L140 HydrophobicContact CG1-CD1 4.01Å; I117-L140 HydrophobicContact CG1-CD2 3.84Å; L136-L140 HydrophobicContact CD1-CD1 4.24Å; L136-L140 HydrophobicContact CD1-CG 4.17Å; L136-L140 HydrophobicContact CG-CD1 4.01Å; L136-L140 HydrophobicContact CG-CG 4.41Å; L136-L140 WeakPolarHBondContact O-CG 3.29Å; L136-L140 PolarHBondContact O-N 3.49Å; C137-L140 PolarHBondContact O-N 3.08Å; L140-V142 PolarHBondContact O-N 3.02Å; L140-V142 VanDerWaalsContact O-N 3.13Å; L140-T143 WeakPolarHBondContact CA-OG1 3.49Å; L140-T143 PolarHBondContact O-N 3.18Å; L140-C144 WeakPolarHBondContact O-CB 3.47Å; L140-C144 PolarHBondContact O-N 2.89Å; L140-L218 VanDerWaalsContact C-CD2 3.44Å; L140-L218 HydrophobicContact CB-CD2 3.67Å; L140-L218 WeakPolarHBondContact O-CD2 3.42Å; L140-V264 HydrophobicContact CD1-CG1 4.47Å; L140-V264 HydrophobicContact CD1-CG2 4.19Å
141	A	98.9	Very high	98	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-61.6	-18.4	175.8	0	0	0	0	0	113.8	C137 T139 Q145 A157 I220	C137-A141 PolarHBondContact O-N 3.41Å; T139-A141 VanDerWaalsContact C-N 3.33Å; T139-A141 PolarHBondContact O-N 3.24Å; A141-Q145 PolarHBondContact O-NE2 2.88Å; A141-A157 HydrophobicContact CB-CB 4.16Å; A141-I220 HydrophobicContact CB-CD1 4.1Å
142	V	98.9	Very high	98.1	Very high	0 Å²	0	26.9 Å²	26.9	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-99.7	-45	173.6	-177.2	0	0	0	0	111	T139 L140 C144 Q145 L171 V174 A175 L180 V185	T139-V142 PolarHBondContact O-N 3.43Å; T139-V142 VanDerWaalsContact O-N 3.1Å; L140-V142 PolarHBondContact O-N 3.02Å; L140-V142 VanDerWaalsContact O-N 3.13Å; V142-C144 VanDerWaalsContact C-N 3.27Å; V142-C144 PolarHBondContact O-N 3.31Å; V142-Q145 WeakPolarHBondContact O-CB 3.34Å; V142-Q145 PolarHBondContact O-N 3.11Å; V142-Q145 VanDerWaalsContact O-N 3.08Å; V142-L171 HydrophobicContact CG2-CB 3.91Å; V142-L171 HydrophobicContact CG2-CG 3.86Å; V142-V174 HydrophobicContact CB-CB 4.17Å; V142-V174 HydrophobicContact CB-CG1 3.75Å; V142-V174 HydrophobicContact CG1-CB 4.31Å; V142-V174 HydrophobicContact CG1-CG1 3.9Å; V142-V174 HydrophobicContact CG2-CB 4Å; V142-V174 HydrophobicContact CG2-CG1 4.15Å; V142-A175 HydrophobicContact CG1-CB 4.38Å; V142-L180 HydrophobicContact CG1-CD1 3.92Å; V142-V185 HydrophobicContact CB-CG1 4.48Å; V142-V185 HydrophobicContact CG1-CG1 4.16Å; V142-V185 HydrophobicContact CG1-CG2 4.4Å; V142-V185 HydrophobicContact CG2-CG1 3.85Å
143	T	98.8	Very high	98.1	Very high	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.139	C	C	.	.	H	α-helix	trans	-66.7	-27	-176.4	58.8	0	0	0	0	113.2	T103 T139 L140 Q145 L146 G152 Y178	T103-T143 HydrophobicContact CG2-CG2 4.01Å; T103-T143 WeakPolarHBondContact O-CB 3.43Å; T103-T143 PolarHBondContact O-OG1 3.29Å; T139-T143 HydrophobicContact CG2-CG2 4.19Å; T139-T143 PolarHBondContact O-N 3.18Å; T139-T143 PolarHBondContact O-OG1 3.5Å; L140-T143 WeakPolarHBondContact CA-OG1 3.49Å; L140-T143 PolarHBondContact O-N 3.18Å; T143-Q145 PolarHBondContact O-N 3.27Å; T143-L146 HydrophobicContact CG2-CD1 4.25Å; T143-L146 WeakPolarHBondContact O-CB 3.48Å; T143-L146 PolarHBondContact O-N 3.44Å; T143-L146 VanDerWaalsContact O-N 3.13Å; T143-G152 VanDerWaalsContact O-CA 3.25Å; T143-G152 WeakPolarHBondContact O-CA 3.41Å; T143-Y178 HydrophobicContact CG2-CD2 4.43Å; T143-Y178 HydrophobicContact CG2-CE2 3.66Å
144	C	98.8	Very high	98	Very high	0 Å²	0	30.7 Å²	30.7	0%	0	16%	0.158	C	C	.	.	T	Hydrogen-bonded Turn	trans	-63	-22.2	174.3	76.5	0	0	0	0	113.4	I102 L140 V142 L146 G153 E154 G155 A217 L218	I102-C144 HydrophobicContact CD1-CB 3.84Å; I102-C144 HydrophobicContact CG2-CB 4.14Å; L140-C144 WeakPolarHBondContact O-CB 3.47Å; L140-C144 PolarHBondContact O-N 2.89Å; V142-C144 VanDerWaalsContact C-N 3.27Å; V142-C144 PolarHBondContact O-N 3.31Å; C144-L146 VanDerWaalsContact C-N 3.33Å; C144-G153 CarbonylContact O-C 3.57Å; C144-G153 WeakPolarHBondContact O-CA 3.35Å; C144-G153 PolarHBondContact O-N 3.46Å; C144-E154 PolarHBondContact O-N 3Å; C144-G155 PolarHBondContact O-N 3.16Å; C144-A217 HydrophobicContact CB-CB 4.09Å; C144-L218 HydrophobicContact CB-CB 3.86Å; C144-L218 HydrophobicContact CB-CD2 4.22Å
145	Q	98.6	Very high	97.9	Very high	28 Å²	28	29.7 Å²	29.7	13%	0.131	15%	0.153	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84.7	-9.6	-179.8	-49.5	-173.4	31.8	0	0	112.7	A141 V142 T143 V185 N188	A141-Q145 PolarHBondContact O-NE2 2.88Å; V142-Q145 WeakPolarHBondContact O-CB 3.34Å; V142-Q145 PolarHBondContact O-N 3.11Å; V142-Q145 VanDerWaalsContact O-N 3.08Å; T143-Q145 PolarHBondContact O-N 3.27Å; Q145-V185 PolarHBondContact NE2-O 2.88Å; Q145-V185 VanDerWaalsContact NE2-O 3.1Å; Q145-N188 VanDerWaalsContact OE1-CB 3.24Å
146	L	98.6	Very high	98	Very high	0 Å²	0	30.4 Å²	30.4	0%	0	16%	0.156	C	C	.	.	S	Bend	trans	-66.5	155.6	177.5	-65.7	168.5	0	0	0	111	T103 T143 C144 R150 G152 G153 E154 Y178 L180	T103-L146 HydrophobicContact CG2-CD1 4.36Å; T143-L146 HydrophobicContact CG2-CD1 4.25Å; T143-L146 WeakPolarHBondContact O-CB 3.48Å; T143-L146 PolarHBondContact O-N 3.44Å; T143-L146 VanDerWaalsContact O-N 3.13Å; C144-L146 VanDerWaalsContact C-N 3.33Å; L146-R150 HydrophobicContact CB-CB 4.42Å; L146-G152 CarbonylContact O-C 3.47Å; L146-G152 VanDerWaalsContact O-CA 3.28Å; L146-G152 WeakPolarHBondContact O-CA 3.32Å; L146-G153 PolarHBondContact O-N 3.47Å; L146-E154 PolarHBondContact O-N 3.34Å; L146-E154 VanDerWaalsContact O-N 3.08Å; L146-Y178 HydrophobicContact CD1-CD1 3.71Å; L146-Y178 HydrophobicContact CD1-CE1 3.92Å; L146-Y178 HydrophobicContact CD1-CG 4.1Å; L146-Y178 HydrophobicContact CD2-CD1 4.25Å; L146-Y178 HydrophobicContact CD2-CG 4.23Å; L146-L180 HydrophobicContact CD2-CD1 3.82Å; L146-L180 HydrophobicContact CD2-CD2 4.04Å; L146-L180 HydrophobicContact CD2-CG 4.12Å; L146-L180 HydrophobicContact CG-CD1 4.49Å
147	P	97.9	Very high	98	Very high	47 Å²	47	30.3 Å²	30.3	31%	0.305	16%	0.155	S	C	.	.			trans	-51.1	148.7	163.7	-31.4	40	0	0	0	113.3	D149 R150 G151 G152 E154	P147-D149 VanDerWaalsContact C-N 3.27Å; P147-D149 WeakPolarHBondContact CB-OD1 3.34Å; P147-D149 PolarHBondContact O-N 3.01Å; P147-R150 CarbonylContact O-C 3.53Å; P147-R150 WeakPolarHBondContact O-CA 3.45Å; P147-R150 PolarHBondContact O-N 3.13Å; P147-G151 PolarHBondContact O-N 3.32Å; P147-G152 PolarHBondContact O-N 3.33Å; P147-E154 WeakPolarHBondContact CA-OE1 3.29Å
148	I	95.6	Very high	98	Very high	87 Å²	87	30.8 Å²	30.8	45%	0.446	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-61.3	-38.2	-179.6	-66.8	170.4	0	0	0	110.8	I100 R150 G151 E154	I100-I148 HydrophobicContact CD1-CD1 4.06Å; I100-I148 HydrophobicContact CD1-CG1 4.46Å; I148-R150 PolarHBondContact O-N 2.58Å; I148-R150 VanDerWaalsContact O-N 3.16Å; I148-G151 PolarHBondContact O-N 2.79Å; I148-E154 HydrophobicContact CG1-CG 4.04Å; I148-E154 PolarHBondContact N-OE1 3.45Å
149	D	95.9	Very high	98	Very high	142 Å²	142	30.8 Å²	30.8	76%	0.759	16%	0.158	S	C	*	.	G	3₁₀ helix	trans	-65.7	-15.4	177.1	71.3	-23.6	0	0	0	113.7	P147	P147-D149 VanDerWaalsContact C-N 3.27Å; P147-D149 WeakPolarHBondContact CB-OD1 3.34Å; P147-D149 PolarHBondContact O-N 3.01Å
150	R	96.9	Very high	98	Very high	122 Å²	122	30.9 Å²	30.9	46%	0.46	16%	0.158	S	C	.	.	G	3₁₀ helix	trans	-104.1	13.8	173.1	-65.8	-178.1	65.1	-170.7	-1.8	113	L146 P147 I148 Y178	L146-R150 HydrophobicContact CB-CB 4.42Å; P147-R150 CarbonylContact O-C 3.53Å; P147-R150 WeakPolarHBondContact O-CA 3.45Å; P147-R150 PolarHBondContact O-N 3.13Å; I148-R150 PolarHBondContact O-N 2.58Å; I148-R150 VanDerWaalsContact O-N 3.16Å; R150-Y178 PolarHBondContact NH1-O 2.85Å; R150-Y178 PolarHBondContact NH2-O 3.14Å
151	G	96.9	Very high	97.9	Very high	25 Å²	25	30.9 Å²	30.9	26%	0.258	16%	0.158	S	C	.	.	T	Hydrogen-bonded Turn	trans	77.5	20	178.3	0	0	0	0	0	114.3	I102 T103 P147 I148	I102-G151 CarbonylContact C-O 3.46Å; I102-G151 WeakPolarHBondContact CA-O 3.41Å; T103-G151 WeakPolarHBondContact CG2-O 3.34Å; T103-G151 PolarHBondContact N-O 2.89Å; P147-G151 PolarHBondContact O-N 3.32Å; I148-G151 PolarHBondContact O-N 2.79Å
152	G	97.9	Very high	97.9	Very high	1 Å²	1	31.4 Å²	31.4	1%	0.01	16%	0.162	C	C	.	.			trans	-93.7	-169.7	170.2	0	0	0	0	0	113.3	I100 T143 L146 P147	I100-G152 WeakPolarHBondContact CG2-O 3.32Å; T143-G152 VanDerWaalsContact O-CA 3.25Å; T143-G152 WeakPolarHBondContact O-CA 3.41Å; L146-G152 CarbonylContact O-C 3.47Å; L146-G152 VanDerWaalsContact O-CA 3.28Å; L146-G152 WeakPolarHBondContact O-CA 3.32Å; P147-G152 PolarHBondContact O-N 3.33Å
153	G	97	Very high	97.7	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.01	18%	0.179	C	C	.	.			trans	-122	6.2	178.5	0	0	0	0	0	114.7	C144 L146 G155	C144-G153 CarbonylContact O-C 3.57Å; C144-G153 WeakPolarHBondContact O-CA 3.35Å; C144-G153 PolarHBondContact O-N 3.46Å; L146-G153 PolarHBondContact O-N 3.47Å; G153-G155 PolarHBondContact O-N 3.46Å
154	E	96.8	Very high	97.6	Very high	109 Å²	109	35.9 Å²	35.9	51%	0.509	19%	0.187	S	C	.	.	S	Bend	trans	48.3	43.8	-178.7	-68.7	176.8	-162.5	0	0	112.9	C144 L146 P147 I148	C144-E154 PolarHBondContact O-N 3Å; L146-E154 PolarHBondContact O-N 3.34Å; L146-E154 VanDerWaalsContact O-N 3.08Å; P147-E154 WeakPolarHBondContact CA-OE1 3.29Å; I148-E154 HydrophobicContact CG1-CG 4.04Å; I148-E154 PolarHBondContact N-OE1 3.45Å
155	G	96.7	Very high	97.5	Very high	8 Å²	8	38 Å²	38	8%	0.082	20%	0.199	C	C	.	.	S	Bend	trans	-147	159.5	-177	0	0	0	0	0	113.6	C144 G153	C144-G155 PolarHBondContact O-N 3.16Å; G153-G155 PolarHBondContact O-N 3.46Å
156	K	98.7	Very high	97.5	Very high	63 Å²	63	37.9 Å²	37.9	27%	0.274	20%	0.198	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-65	160.2	175.7	-65.6	-179.9	-179	174.5	0	111.4	N188 S214 R215 Y216 A217	K156-N188 WeakPolarHBondContact CA-O 3.4Å; K156-N188 WeakPolarHBondContact CB-O 3.38Å; K156-N188 HydrophobicContact CG-CB 4.13Å; K156-S214 PolarHBondContact NZ-OG 2.91Å; K156-R215 PolarHBondContact N-O 2.84Å; K156-R215 VanDerWaalsContact N-O 3.15Å; K156-Y216 HydrophobicContact CB-CD1 3.57Å; K156-Y216 HydrophobicContact CB-CE1 3.54Å; K156-Y216 HydrophobicContact CB-CE2 4.49Å; K156-Y216 HydrophobicContact CB-CG 4.06Å; K156-Y216 HydrophobicContact CD-CE1 4.45Å; K156-Y216 HydrophobicContact CD-CE2 4.44Å; K156-Y216 CarbonylContact O-C 3.6Å; K156-Y216 WeakPolarHBondContact O-CA 3.49Å; K156-Y216 WeakPolarHBondContact O-CD1 3.38Å; K156-A217 PolarHBondContact O-N 2.76Å
157	A	98.9	Very high	97.5	Very high	0 Å²	0	43.9 Å²	43.9	0%	0	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	147.9	173.4	0	0	0	0	0	111.2	A141 N188 V189 A190 Y216	A141-A157 HydrophobicContact CB-CB 4.16Å; A157-N188 PolarHBondContact N-O 2.9Å; A157-V189 HydrophobicContact CB-CG1 4.32Å; A157-V189 HydrophobicContact CB-CG2 4.05Å; A157-V189 WeakPolarHBondContact O-CA 3.35Å; A157-A190 PolarHBondContact O-N 3.49Å; A157-Y216 WeakPolarHBondContact O-CE1 3.34Å
158	M	98.9	Very high	97.5	Very high	11 Å²	11	43.9 Å²	43.9	5%	0.054	22%	0.221	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121	131.5	169.8	-170.4	173.9	-68	0	0	109.8	A190 A207 M210 M211 Y216 L218 L219 I220	M158-A190 CarbonylContact C-O 3.56Å; M158-A190 WeakPolarHBondContact CA-O 3.4Å; M158-A190 HydrophobicContact CG-CB 4.36Å; M158-A207 HydrophobicContact CE-CB 3.93Å; M158-A207 HydrophobicContact SD-CB 3.29Å; M158-A207 WeakPolarHBondContact SD-CB 3.35Å; M158-M210 HydrophobicContact CE-CB 4.01Å; M158-M210 HydrophobicContact CE-CE 4.42Å; M158-M210 HydrophobicContact CE-SD 3.97Å; M158-M211 HydrophobicContact CE-CE 4.29Å; M158-M211 HydrophobicContact SD-CE 4.24Å; M158-Y216 HydrophobicContact CB-CD1 4.06Å; M158-Y216 HydrophobicContact CB-CE1 4.17Å; M158-Y216 HydrophobicContact CE-CD1 4.35Å; M158-Y216 HydrophobicContact CE-CE1 4.02Å; M158-Y216 HydrophobicContact CE-CE2 4.46Å; M158-L218 PolarHBondContact N-O 3.16Å; M158-L219 HydrophobicContact CB-CD1 3.86Å; M158-L219 HydrophobicContact CG-CD1 3.81Å; M158-L219 HydrophobicContact SD-CD1 3.89Å; M158-I220 PolarHBondContact O-N 3.25Å
159	Y	98.9	Very high	97.6	Very high	1 Å²	1	45.7 Å²	45.7	0%	0.004	23%	0.228	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	109.9	-175.1	-154.2	-66.2	0	0	0	110.7	C137 D161 F166 A190 Y191 A192 I220 D222	C137-Y159 HydrophobicContact CB-CE2 3.84Å; C137-Y159 WeakPolarHBondContact CB-OH 3.45Å; Y159-D161 HydrophobicContact CD1-CB 4.18Å; Y159-D161 HydrophobicContact CE1-CB 4.16Å; Y159-F166 AromaticContact CD1-CD2 3.9Å; Y159-F166 HydrophobicContact CD1-CD2 3.9Å; Y159-F166 HydrophobicContact CD1-CE2 4.46Å; Y159-F166 AromaticContact CD2-CD2 3.96Å; Y159-F166 HydrophobicContact CD2-CD2 3.96Å; Y159-F166 AromaticContact CD2-CE2 3.89Å; Y159-F166 HydrophobicContact CD2-CE2 3.89Å; Y159-F166 HydrophobicContact CE1-CD2 4.06Å; Y159-F166 HydrophobicContact CE2-CD2 4.11Å; Y159-F166 HydrophobicContact CE2-CE2 4.34Å; Y159-F166 AromaticContact CG-CD2 3.86Å; Y159-F166 HydrophobicContact CG-CD2 3.86Å; Y159-F166 AromaticContact CG-CE2 3.97Å; Y159-F166 HydrophobicContact CG-CE2 3.97Å; Y159-A190 PolarHBondContact N-O 3.05Å; Y159-Y191 WeakPolarHBondContact O-CA 3.37Å; Y159-A192 PolarHBondContact O-N 3.27Å; Y159-I220 HydrophobicContact CD1-CG2 4.33Å; Y159-I220 HydrophobicContact CD2-CB 3.96Å; Y159-I220 HydrophobicContact CD2-CD1 3.62Å; Y159-I220 HydrophobicContact CD2-CG1 4.42Å; Y159-I220 HydrophobicContact CD2-CG2 3.94Å; Y159-I220 HydrophobicContact CE1-CG2 4.08Å; Y159-I220 HydrophobicContact CE2-CB 4.18Å; Y159-I220 HydrophobicContact CE2-CD1 3.71Å; Y159-I220 HydrophobicContact CE2-CG2 3.69Å; Y159-I220 HydrophobicContact CG-CB 4.25Å; Y159-I220 HydrophobicContact CG-CG2 4.25Å; Y159-D222 HydrophobicContact CE1-CB 3.71Å; Y159-D222 WeakPolarHBondContact OH-CB 3.41Å; Y159-D222 PolarHBondContact OH-OD2 2.94Å
160	I	98.8	Very high	97.7	Very high	3 Å²	3	41.7 Å²	41.7	2%	0.015	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.1	106.2	172.9	-59.6	176.4	0	0	0	108.1	A192 L203 L204 L219 I220 V221 D222	I160-A192 WeakPolarHBondContact CA-O 3.29Å; I160-L203 HydrophobicContact CD1-CB 4.05Å; I160-L203 HydrophobicContact CG2-CD1 3.89Å; I160-L204 HydrophobicContact CD1-CD2 3.76Å; I160-L219 HydrophobicContact CD1-CD1 4.13Å; I160-L219 HydrophobicContact CG1-CD1 4.39Å; I160-I220 PolarHBondContact N-O 3.18Å; I160-V221 HydrophobicContact CB-CG1 4.49Å; I160-V221 HydrophobicContact CB-CG2 4.44Å; I160-V221 HydrophobicContact CD1-CG2 4.49Å; I160-V221 HydrophobicContact CG2-CG1 4.42Å; I160-V221 WeakPolarHBondContact O-CA 3.44Å; I160-D222 PolarHBondContact O-N 3.35Å
161	D	98.6	Very high	97.8	Very high	0 Å²	0	35.9 Å²	35.9	0%	0	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-96.4	134.1	178.8	-177	10.8	0	0	0	110.6	Y159 E163 G164 T165 F166 Y191 A192 R193 G194 D222	Y159-D161 HydrophobicContact CD1-CB 4.18Å; Y159-D161 HydrophobicContact CE1-CB 4.16Å; D161-E163 PolarHBondContact OD1-N 3.12Å; D161-G164 VanDerWaalsContact CG-N 3.28Å; D161-G164 PolarHBondContact OD1-N 3.31Å; D161-G164 WeakPolarHBondContact OD2-CA 3.5Å; D161-G164 PolarHBondContact OD2-N 3.41Å; D161-G164 VanDerWaalsContact OD2-N 3.07Å; D161-T165 PolarHBondContact OD1-N 3.25Å; D161-T165 PolarHBondContact OD2-N 2.81Å; D161-F166 HydrophobicContact CB-CB 4.46Å; D161-F166 PolarHBondContact OD2-N 3.44Å; D161-F166 VanDerWaalsContact OD2-N 3.12Å; D161-Y191 HydrophobicContact CB-CD2 4.45Å; D161-Y191 HydrophobicContact CB-CE2 3.56Å; D161-A192 PolarHBondContact N-O 2.8Å; D161-R193 CarbonylContact O-C 3.49Å; D161-R193 VanDerWaalsContact O-CA 3.26Å; D161-R193 WeakPolarHBondContact O-CA 3.48Å; D161-G194 PolarHBondContact O-N 2.93Å; D161-D222 CarbonylContact C-O 3.59Å; D161-D222 WeakPolarHBondContact CA-O 3.43Å
162	T	97.8	Very high	97.9	Very high	12 Å²	12	38.1 Å²	38.1	7%	0.074	19%	0.186	C	C	.	.	S	Bend	trans	-114.7	-11.3	174.9	64.6	0	0	0	0	112.8	D222 S223 L227	T162-D222 PolarHBondContact N-O 3.26Å; T162-D222 PolarHBondContact OG1-O 3.02Å; T162-S223 WeakPolarHBondContact CG2-O 3.26Å; T162-S223 PolarHBondContact OG1-N 3.43Å; T162-S223 PolarHBondContact OG1-O 2.81Å; T162-L227 HydrophobicContact CG2-CD1 3.58Å; T162-L227 HydrophobicContact CG2-CG 4.02Å
163	E	94.6	Very high	97.9	Very high	79 Å²	79	39.1 Å²	39.1	37%	0.369	19%	0.194	S	C	.	.	S	Bend	trans	-108.8	-11.2	-174.9	-60.5	-167.6	-154.1	0	0	112.7	D161 T165 S223 A226 Q268	D161-E163 PolarHBondContact OD1-N 3.12Å; E163-T165 HydrophobicContact CB-CG2 3.91Å; E163-S223 VanDerWaalsContact OE1-CB 3.29Å; E163-S223 WeakPolarHBondContact OE1-CB 3.42Å; E163-S223 PolarHBondContact OE1-OG 3.21Å; E163-A226 HydrophobicContact CG-CB 3.97Å; E163-Q268 PolarHBondContact OE1-NE2 3.42Å
164	G	96.6	Very high	98	Very high	15 Å²	15	39.1 Å²	39.1	16%	0.155	19%	0.194	C	C	.	.	S	Bend	trans	75.4	29.7	-178.4	0	0	0	0	0	112.6	D161 R167	D161-G164 VanDerWaalsContact CG-N 3.28Å; D161-G164 PolarHBondContact OD1-N 3.31Å; D161-G164 WeakPolarHBondContact OD2-CA 3.5Å; D161-G164 PolarHBondContact OD2-N 3.41Å; D161-G164 VanDerWaalsContact OD2-N 3.07Å; G164-R167 PolarHBondContact O-NH1 3.14Å; G164-R167 PolarHBondContact O-NH2 3.33Å
165	T	97	Very high	98.1	Very high	44 Å²	44	34 Å²	34	27%	0.27	17%	0.17	S	C	.	.			trans	-103	-1.1	-173.7	63.3	0	0	0	0	113.7	D161 E163 R167	D161-T165 PolarHBondContact OD1-N 3.25Å; D161-T165 PolarHBondContact OD2-N 2.81Å; E163-T165 HydrophobicContact CB-CG2 3.91Å; T165-R167 PolarHBondContact O-N 3.25Å
166	F	98.4	Very high	98.2	Very high	25 Å²	25	41.3 Å²	41.3	11%	0.11	20%	0.202	C	C	.	.			trans	-62	127.7	173.6	-172.1	-106.4	0	0	0	111.5	H138 Y159 D161 P168 L171 V189 Y191	H138-F166 AromaticContact CD2-CD2 3.92Å; H138-F166 AromaticContact NE2-CD2 3.68Å; Y159-F166 AromaticContact CD1-CD2 3.9Å; Y159-F166 HydrophobicContact CD1-CD2 3.9Å; Y159-F166 HydrophobicContact CD1-CE2 4.46Å; Y159-F166 AromaticContact CD2-CD2 3.96Å; Y159-F166 HydrophobicContact CD2-CD2 3.96Å; Y159-F166 AromaticContact CD2-CE2 3.89Å; Y159-F166 HydrophobicContact CD2-CE2 3.89Å; Y159-F166 HydrophobicContact CE1-CD2 4.06Å; Y159-F166 HydrophobicContact CE2-CD2 4.11Å; Y159-F166 HydrophobicContact CE2-CE2 4.34Å; Y159-F166 AromaticContact CG-CD2 3.86Å; Y159-F166 HydrophobicContact CG-CD2 3.86Å; Y159-F166 AromaticContact CG-CE2 3.97Å; Y159-F166 HydrophobicContact CG-CE2 3.97Å; D161-F166 HydrophobicContact CB-CB 4.46Å; D161-F166 PolarHBondContact OD2-N 3.44Å; D161-F166 VanDerWaalsContact OD2-N 3.12Å; F166-P168 HydrophobicContact CD1-CG 4.19Å; F166-P168 HydrophobicContact CE1-CG 3.81Å; F166-L171 HydrophobicContact CE2-CD1 4.16Å; F166-L171 HydrophobicContact CE2-CD2 4.12Å; F166-L171 HydrophobicContact CZ-CD1 4.45Å; F166-L171 HydrophobicContact CZ-CD2 3.83Å; F166-V189 HydrophobicContact CE2-CG1 4.46Å; F166-V189 HydrophobicContact CZ-CG1 4.19Å; F166-Y191 HydrophobicContact CB-CD2 3.94Å; F166-Y191 HydrophobicContact CB-CE2 3.45Å; F166-Y191 VanDerWaalsContact CB-CE2 3.45Å; F166-Y191 AromaticContact CD1-CD2 3.56Å; F166-Y191 HydrophobicContact CD1-CD2 3.56Å; F166-Y191 AromaticContact CD1-CE2 3.8Å; F166-Y191 HydrophobicContact CD1-CE2 3.8Å; F166-Y191 HydrophobicContact CD1-CG 4.06Å; F166-Y191 HydrophobicContact CD2-CD2 4.14Å; F166-Y191 HydrophobicContact CD2-CE2 4.49Å; F166-Y191 HydrophobicContact CE1-CD2 4.04Å; F166-Y191 HydrophobicContact CE1-CG 4.2Å; F166-Y191 AromaticContact CG-CD2 3.61Å; F166-Y191 HydrophobicContact CG-CD2 3.61Å; F166-Y191 AromaticContact CG-CE2 3.68Å; F166-Y191 HydrophobicContact CG-CE2 3.68Å
167	R	98.3	Very high	98.2	Very high	126 Å²	126	42.4 Å²	42.4	48%	0.475	20%	0.204	S	C	.	.			trans	-133.6	101.3	-179.8	-65.4	-62.8	178.2	-82.2	-2.4	109.7	H138 G164 T165 E169 R170	H138-R167 PolarHBondContact NE2-N 3.16Å; G164-R167 PolarHBondContact O-NH1 3.14Å; G164-R167 PolarHBondContact O-NH2 3.33Å; T165-R167 PolarHBondContact O-N 3.25Å; R167-E169 PolarHBondContact O-N 2.99Å; R167-E169 VanDerWaalsContact O-N 3.13Å; R167-R170 HydrophobicContact CB-CG 3.98Å; R167-R170 WeakPolarHBondContact O-CB 3.4Å; R167-R170 PolarHBondContact O-N 3.13Å
168	P	98.1	Very high	98.1	Very high	48 Å²	48	44 Å²	44	31%	0.312	21%	0.211	S	C	.	.	H	α-helix	trans	-55.1	-30.3	-179.5	-26.1	34.1	0	0	0	113.9	F166 R170 L171 L172 L186	F166-P168 HydrophobicContact CD1-CG 4.19Å; F166-P168 HydrophobicContact CE1-CG 3.81Å; P168-R170 PolarHBondContact O-N 3.1Å; P168-L171 WeakPolarHBondContact O-CB 3.44Å; P168-L171 PolarHBondContact O-N 3Å; P168-L172 PolarHBondContact O-N 3.4Å; P168-L172 VanDerWaalsContact O-N 3.14Å; P168-L186 HydrophobicContact CB-CD2 3.96Å
169	E	98.2	Very high	98.1	Very high	125 Å²	125	46.8 Å²	46.8	58%	0.584	24%	0.242	S	C	*	.	H	α-helix	trans	-61.7	-27.9	178	-54.7	80	-175.4	0	0	112	R167 A173	R167-E169 PolarHBondContact O-N 2.99Å; R167-E169 VanDerWaalsContact O-N 3.13Å; E169-A173 PolarHBondContact O-N 3Å
170	R	98.3	Very high	98	Very high	58 Å²	58	48.9 Å²	48.9	22%	0.219	25%	0.253	C	S	.	.	H	α-helix	trans	-71.4	-36.1	173.8	-62.9	-60.9	-65.3	150.8	-0.7	111.7	Q135 H138 R167 P168 A173 V174 N330 A331	Q135-R170 VanDerWaalsContact OE1-NE 3.08Å; Q135-R170 VanDerWaalsContact OE1-NH2 3.09Å; H138-R170 HydrophobicContact CB-CB 4.41Å; R167-R170 HydrophobicContact CB-CG 3.98Å; R167-R170 WeakPolarHBondContact O-CB 3.4Å; R167-R170 PolarHBondContact O-N 3.13Å; P168-R170 PolarHBondContact O-N 3.1Å; R170-A173 PolarHBondContact O-N 2.84Å; R170-V174 WeakPolarHBondContact O-CG2 3.46Å; R170-V174 PolarHBondContact O-N 2.86Å; R170-N330 PolarHBondContact NH2-O 2.81Å; R170-A331 PolarHBondContact NH1-O 2.88Å
171	L	98.8	Very high	98	Very high	0 Å²	0	51.3 Å²	51.3	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-65.5	-41.7	175.8	-81.8	56.1	0	0	0	110.3	H138 V142 F166 P168 A173 V174 A175 L186 V189	H138-L171 HydrophobicContact CB-CD1 3.91Å; V142-L171 HydrophobicContact CG2-CB 3.91Å; V142-L171 HydrophobicContact CG2-CG 3.86Å; F166-L171 HydrophobicContact CE2-CD1 4.16Å; F166-L171 HydrophobicContact CE2-CD2 4.12Å; F166-L171 HydrophobicContact CZ-CD1 4.45Å; F166-L171 HydrophobicContact CZ-CD2 3.83Å; P168-L171 WeakPolarHBondContact O-CB 3.44Å; P168-L171 PolarHBondContact O-N 3Å; L171-A173 VanDerWaalsContact C-N 3.32Å; L171-A173 PolarHBondContact O-N 2.79Å; L171-V174 PolarHBondContact O-N 2.86Å; L171-V174 VanDerWaalsContact O-N 3.14Å; L171-A175 WeakPolarHBondContact O-CB 3.44Å; L171-A175 PolarHBondContact O-N 3.27Å; L171-L186 HydrophobicContact CB-CD2 4.08Å; L171-L186 HydrophobicContact CD2-CD2 4.1Å; L171-V189 HydrophobicContact CD2-CB 4.31Å; L171-V189 HydrophobicContact CD2-CG1 4.34Å; L171-V189 HydrophobicContact CD2-CG2 3.83Å
172	L	98.8	Very high	98	Very high	72 Å²	72	52.3 Å²	52.3	38%	0.377	28%	0.281	S	S	.	.	H	α-helix	trans	-58.7	-42.2	176.4	-67.7	175.9	0	0	0	112.5	P168 V174 A175 E176 L186	P168-L172 PolarHBondContact O-N 3.4Å; P168-L172 VanDerWaalsContact O-N 3.14Å; L172-V174 VanDerWaalsContact C-N 3.32Å; L172-V174 PolarHBondContact O-N 3.04Å; L172-A175 WeakPolarHBondContact O-CB 3.42Å; L172-A175 PolarHBondContact O-N 3.49Å; L172-E176 PolarHBondContact O-N 3.28Å; L172-L186 HydrophobicContact CD1-CD1 4.36Å; L172-L186 HydrophobicContact CD2-CD1 3.77Å; L172-L186 HydrophobicContact CD2-CG 4.05Å; L172-L186 HydrophobicContact CG-CD1 4.13Å
173	A	98.4	Very high	98	Very high	21 Å²	21	55 Å²	55	17%	0.174	30%	0.3	C	S	.	.	H	α-helix	trans	-64.2	-36.1	176.9	0	0	0	0	0	112.7	E169 R170 L171 R177 A331	E169-A173 PolarHBondContact O-N 3Å; R170-A173 PolarHBondContact O-N 2.84Å; L171-A173 VanDerWaalsContact C-N 3.32Å; L171-A173 PolarHBondContact O-N 2.79Å; A173-R177 PolarHBondContact O-N 3.48Å; A173-A331 WeakPolarHBondContact CB-O 3.22Å
174	V	98.7	Very high	98.2	Very high	2 Å²	2	55.3 Å²	55.3	1%	0.012	30%	0.304	C	S	.	.	H	α-helix	trans	-73.2	-38	174.4	-176.7	0	0	0	0	110.8	T139 V142 R170 L171 L172 E176 R177 Y178	T139-V174 HydrophobicContact CG2-CG1 4.14Å; V142-V174 HydrophobicContact CB-CB 4.17Å; V142-V174 HydrophobicContact CB-CG1 3.75Å; V142-V174 HydrophobicContact CG1-CB 4.31Å; V142-V174 HydrophobicContact CG1-CG1 3.9Å; V142-V174 HydrophobicContact CG2-CB 4Å; V142-V174 HydrophobicContact CG2-CG1 4.15Å; R170-V174 WeakPolarHBondContact O-CG2 3.46Å; R170-V174 PolarHBondContact O-N 2.86Å; L171-V174 PolarHBondContact O-N 2.86Å; L171-V174 VanDerWaalsContact O-N 3.14Å; L172-V174 VanDerWaalsContact C-N 3.32Å; L172-V174 PolarHBondContact O-N 3.04Å; V174-E176 VanDerWaalsContact C-N 3.32Å; V174-E176 PolarHBondContact O-N 2.99Å; V174-R177 WeakPolarHBondContact O-CB 3.43Å; V174-R177 PolarHBondContact O-N 2.85Å; V174-Y178 HydrophobicContact CG1-CD2 3.85Å; V174-Y178 HydrophobicContact CG1-CE2 3.76Å; V174-Y178 VanDerWaalsContact O-CD2 3.29Å; V174-Y178 WeakPolarHBondContact O-CD2 3.21Å; V174-Y178 PolarHBondContact O-N 3.28Å
175	A	98.6	Very high	98.3	Very high	1 Å²	1	54.7 Å²	54.7	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-59.6	-43.7	176.6	0	0	0	0	0	111.6	V142 L171 L172 R177 Y178 G179 L180 V185	V142-A175 HydrophobicContact CG1-CB 4.38Å; L171-A175 WeakPolarHBondContact O-CB 3.44Å; L171-A175 PolarHBondContact O-N 3.27Å; L172-A175 WeakPolarHBondContact O-CB 3.42Å; L172-A175 PolarHBondContact O-N 3.49Å; A175-R177 VanDerWaalsContact C-N 3.33Å; A175-R177 PolarHBondContact O-N 2.98Å; A175-Y178 PolarHBondContact O-N 3.41Å; A175-Y178 VanDerWaalsContact O-N 3.17Å; A175-G179 PolarHBondContact O-N 2.98Å; A175-L180 HydrophobicContact CB-CB 4.24Å; A175-L180 PolarHBondContact O-N 3.41Å; A175-V185 HydrophobicContact CB-CB 4.26Å; A175-V185 HydrophobicContact CB-CG1 4.29Å; A175-V185 HydrophobicContact CB-CG2 3.91Å
176	E	98.4	Very high	98.4	Very high	162 Å²	162	55.3 Å²	55.3	76%	0.757	30%	0.299	S	S	*	.	H	α-helix	trans	-57.1	-45.4	175.5	-175.2	177.3	-169.2	0	0	111.6	L172 V174 Y178 G179	L172-E176 PolarHBondContact O-N 3.28Å; V174-E176 VanDerWaalsContact C-N 3.32Å; V174-E176 PolarHBondContact O-N 2.99Å; E176-Y178 PolarHBondContact O-N 3.39Å; E176-G179 PolarHBondContact O-N 2.79Å; E176-G179 VanDerWaalsContact O-N 3.15Å
177	R	98.4	Very high	98.4	Very high	85 Å²	85	60.5 Å²	60.5	32%	0.321	33%	0.328	S	S	.	.	H	α-helix	trans	-55.6	-39.3	177.1	-176.3	-178.1	166.7	-177.6	-7	113.2	G105 A173 V174 A175 D332 V334	G105-R177 PolarHBondContact O-NH2 3.06Å; A173-R177 PolarHBondContact O-N 3.48Å; V174-R177 WeakPolarHBondContact O-CB 3.43Å; V174-R177 PolarHBondContact O-N 2.85Å; A175-R177 VanDerWaalsContact C-N 3.33Å; A175-R177 PolarHBondContact O-N 2.98Å; R177-D332 HydrophobicContact CB-CB 4.13Å; R177-D332 WeakPolarHBondContact CD-O 3.38Å; R177-D332 WeakPolarHBondContact CD-OD2 3.44Å; R177-D332 HydrophobicContact CG-CB 4.39Å; R177-D332 IonicContact NE-OD2 3.04Å; R177-V334 PolarHBondContact NH1-O 3.35Å
178	Y	98.3	Very high	98.4	Very high	34 Å²	34	57.1 Å²	57.1	13%	0.133	32%	0.319	C	S	.	.	H	α-helix	trans	-94.2	-0.8	-177	-71.3	-76.9	0	0	0	114.1	G105 T143 L146 R150 V174 A175 E176	G105-Y178 WeakPolarHBondContact CA-OH 3.47Å; T143-Y178 HydrophobicContact CG2-CD2 4.43Å; T143-Y178 HydrophobicContact CG2-CE2 3.66Å; L146-Y178 HydrophobicContact CD1-CD1 3.71Å; L146-Y178 HydrophobicContact CD1-CE1 3.92Å; L146-Y178 HydrophobicContact CD1-CG 4.1Å; L146-Y178 HydrophobicContact CD2-CD1 4.25Å; L146-Y178 HydrophobicContact CD2-CG 4.23Å; R150-Y178 PolarHBondContact NH1-O 2.85Å; R150-Y178 PolarHBondContact NH2-O 3.14Å; V174-Y178 HydrophobicContact CG1-CD2 3.85Å; V174-Y178 HydrophobicContact CG1-CE2 3.76Å; V174-Y178 VanDerWaalsContact O-CD2 3.29Å; V174-Y178 WeakPolarHBondContact O-CD2 3.21Å; V174-Y178 PolarHBondContact O-N 3.28Å; A175-Y178 PolarHBondContact O-N 3.41Å; A175-Y178 VanDerWaalsContact O-N 3.17Å; E176-Y178 PolarHBondContact O-N 3.39Å
179	G	98	Very high	98.4	Very high	69 Å²	69	55.7 Å²	55.7	71%	0.711	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.5	32.9	-178.3	0	0	0	0	0	113.3	A175 E176	A175-G179 PolarHBondContact O-N 2.98Å; E176-G179 PolarHBondContact O-N 2.79Å; E176-G179 VanDerWaalsContact O-N 3.15Å
180	L	97.9	Very high	98.5	Very high	46 Å²	46	50.8 Å²	50.8	24%	0.241	29%	0.291	C	S	.	.			trans	-93.5	152.4	177.1	-62.4	179	0	0	0	111.4	V142 L146 A175 G182 V185	V142-L180 HydrophobicContact CG1-CD1 3.92Å; L146-L180 HydrophobicContact CD2-CD1 3.82Å; L146-L180 HydrophobicContact CD2-CD2 4.04Å; L146-L180 HydrophobicContact CD2-CG 4.12Å; L146-L180 HydrophobicContact CG-CD1 4.49Å; A175-L180 HydrophobicContact CB-CB 4.24Å; A175-L180 PolarHBondContact O-N 3.41Å; L180-G182 PolarHBondContact O-N 2.82Å; L180-V185 HydrophobicContact CB-CG2 3.67Å; L180-V185 HydrophobicContact CD1-CG2 3.81Å; L180-V185 HydrophobicContact CG-CG2 4.4Å
181	S	98.3	Very high	98.5	Very high	53 Å²	53	52.8 Å²	52.8	37%	0.371	30%	0.299	S	S	.	.			trans	-66.1	121	170.7	176.4	0	0	0	0	110	S183 D184 V185	S181-S183 VanDerWaalsContact C-N 3.33Å; S181-S183 PolarHBondContact O-N 3.29Å; S181-S183 PolarHBondContact OG-OG 3.3Å; S181-D184 VanDerWaalsContact CB-CG 3.42Å; S181-D184 VanDerWaalsContact CB-OD2 3.22Å; S181-D184 WeakPolarHBondContact CB-OD2 3.43Å; S181-D184 PolarHBondContact O-N 3.12Å; S181-D184 PolarHBondContact OG-OD1 2.99Å; S181-D184 VanDerWaalsContact OG-OD1 3.05Å; S181-D184 PolarHBondContact OG-OD2 3.08Å; S181-V185 WeakPolarHBondContact O-CG2 3.37Å; S181-V185 PolarHBondContact O-N 3.19Å
182	G	98.1	Very high	98.5	Very high	22 Å²	22	54.2 Å²	54.2	23%	0.227	31%	0.31	C	S	.	.	H	α-helix	trans	-62.4	-37.1	-178.8	0	0	0	0	0	113.5	L180 L186	L180-G182 PolarHBondContact O-N 2.82Å; G182-L186 WeakPolarHBondContact O-CG 3.37Å; G182-L186 PolarHBondContact O-N 3.48Å
183	S	98.3	Very high	98.5	Very high	68 Å²	68	55.7 Å²	55.7	48%	0.476	31%	0.311	S	S	.	.	H	α-helix	trans	-62.7	-48.6	175.9	48.6	0	0	0	0	111.1	S181 V185 L186 D187	S181-S183 VanDerWaalsContact C-N 3.33Å; S181-S183 PolarHBondContact O-N 3.29Å; S181-S183 PolarHBondContact OG-OG 3.3Å; S183-V185 VanDerWaalsContact C-N 3.31Å; S183-V185 PolarHBondContact O-N 3.41Å; S183-L186 PolarHBondContact O-N 3.4Å; S183-L186 VanDerWaalsContact O-N 3.16Å; S183-D187 PolarHBondContact O-N 3.22Å
184	D	98.4	Very high	98.4	Very high	85 Å²	85	54.8 Å²	54.8	46%	0.455	30%	0.303	S	S	.	.	H	α-helix	trans	-68.6	-37.6	-173.9	-50.1	2.6	0	0	0	109.9	S181 L186 D187 N188	S181-D184 VanDerWaalsContact CB-CG 3.42Å; S181-D184 VanDerWaalsContact CB-OD2 3.22Å; S181-D184 WeakPolarHBondContact CB-OD2 3.43Å; S181-D184 PolarHBondContact O-N 3.12Å; S181-D184 PolarHBondContact OG-OD1 2.99Å; S181-D184 VanDerWaalsContact OG-OD1 3.05Å; S181-D184 PolarHBondContact OG-OD2 3.08Å; D184-L186 VanDerWaalsContact C-N 3.35Å; D184-L186 PolarHBondContact O-N 2.96Å; D184-D187 PolarHBondContact O-N 3.39Å; D184-N188 WeakPolarHBondContact O-CB 3.44Å; D184-N188 VanDerWaalsContact O-CG 3.25Å; D184-N188 PolarHBondContact O-N 2.81Å; D184-N188 PolarHBondContact O-ND2 3.17Å; D184-N188 VanDerWaalsContact O-ND2 3.07Å
185	V	98.6	Very high	98.4	Very high	3 Å²	3	61 Å²	61	2%	0.018	33%	0.331	C	S	.	.	H	α-helix	trans	-59.3	-46.2	173.7	166.3	0	0	0	0	111.1	V142 Q145 A175 L180 S181 S183 N188 V189	V142-V185 HydrophobicContact CB-CG1 4.48Å; V142-V185 HydrophobicContact CG1-CG1 4.16Å; V142-V185 HydrophobicContact CG1-CG2 4.4Å; V142-V185 HydrophobicContact CG2-CG1 3.85Å; Q145-V185 PolarHBondContact NE2-O 2.88Å; Q145-V185 VanDerWaalsContact NE2-O 3.1Å; A175-V185 HydrophobicContact CB-CB 4.26Å; A175-V185 HydrophobicContact CB-CG1 4.29Å; A175-V185 HydrophobicContact CB-CG2 3.91Å; L180-V185 HydrophobicContact CB-CG2 3.67Å; L180-V185 HydrophobicContact CD1-CG2 3.81Å; L180-V185 HydrophobicContact CG-CG2 4.4Å; S181-V185 WeakPolarHBondContact O-CG2 3.37Å; S181-V185 PolarHBondContact O-N 3.19Å; S183-V185 VanDerWaalsContact C-N 3.31Å; S183-V185 PolarHBondContact O-N 3.41Å; V185-N188 PolarHBondContact O-N 2.95Å; V185-V189 WeakPolarHBondContact O-CG2 3.16Å
186	L	98.6	Very high	98.3	Very high	56 Å²	56	64.2 Å²	64.2	29%	0.293	35%	0.347	S	S	.	.	H	α-helix	trans	-68.3	-41	-179.6	-69.4	-180	0	0	0	112.2	P168 L171 L172 G182 S183 D184 N188 V189	P168-L186 HydrophobicContact CB-CD2 3.96Å; L171-L186 HydrophobicContact CB-CD2 4.08Å; L171-L186 HydrophobicContact CD2-CD2 4.1Å; L172-L186 HydrophobicContact CD1-CD1 4.36Å; L172-L186 HydrophobicContact CD2-CD1 3.77Å; L172-L186 HydrophobicContact CD2-CG 4.05Å; L172-L186 HydrophobicContact CG-CD1 4.13Å; G182-L186 WeakPolarHBondContact O-CG 3.37Å; G182-L186 PolarHBondContact O-N 3.48Å; S183-L186 PolarHBondContact O-N 3.4Å; S183-L186 VanDerWaalsContact O-N 3.16Å; D184-L186 VanDerWaalsContact C-N 3.35Å; D184-L186 PolarHBondContact O-N 2.96Å; L186-N188 PolarHBondContact O-N 3.27Å; L186-V189 PolarHBondContact O-N 2.96Å; L186-V189 VanDerWaalsContact O-N 3.12Å
187	D	98.5	Very high	98.3	Very high	134 Å²	134	56.8 Å²	56.8	72%	0.717	31%	0.313	S	S	*	.	H	α-helix	trans	-64.4	-26.2	177.4	-71.8	-17.8	0	0	0	112.3	S183 D184	S183-D187 PolarHBondContact O-N 3.22Å; D184-D187 PolarHBondContact O-N 3.39Å
188	N	98.7	Very high	98.2	Very high	56 Å²	56	57.7 Å²	57.7	30%	0.299	32%	0.324	S	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	4.5	176.7	-73.5	-31.9	0	0	0	114.5	Q145 K156 A157 D184 V185 L186	Q145-N188 VanDerWaalsContact OE1-CB 3.24Å; K156-N188 WeakPolarHBondContact CA-O 3.4Å; K156-N188 WeakPolarHBondContact CB-O 3.38Å; K156-N188 HydrophobicContact CG-CB 4.13Å; A157-N188 PolarHBondContact N-O 2.9Å; D184-N188 WeakPolarHBondContact O-CB 3.44Å; D184-N188 VanDerWaalsContact O-CG 3.25Å; D184-N188 PolarHBondContact O-N 2.81Å; D184-N188 PolarHBondContact O-ND2 3.17Å; D184-N188 VanDerWaalsContact O-ND2 3.07Å; V185-N188 PolarHBondContact O-N 2.95Å; L186-N188 PolarHBondContact O-N 3.27Å
189	V	98.8	Very high	98.2	Very high	17 Å²	17	58.5 Å²	58.5	10%	0.103	33%	0.329	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111	109.1	172.6	-175.5	0	0	0	0	111	A157 F166 L171 V185 L186	A157-V189 HydrophobicContact CB-CG1 4.32Å; A157-V189 HydrophobicContact CB-CG2 4.05Å; A157-V189 WeakPolarHBondContact O-CA 3.35Å; F166-V189 HydrophobicContact CE2-CG1 4.46Å; F166-V189 HydrophobicContact CZ-CG1 4.19Å; L171-V189 HydrophobicContact CD2-CB 4.31Å; L171-V189 HydrophobicContact CD2-CG1 4.34Å; L171-V189 HydrophobicContact CD2-CG2 3.83Å; V185-V189 WeakPolarHBondContact O-CG2 3.16Å; L186-V189 PolarHBondContact O-N 2.96Å; L186-V189 VanDerWaalsContact O-N 3.12Å
190	A	98.8	Very high	98.2	Very high	23 Å²	23	55.2 Å²	55.2	19%	0.19	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.6	127.5	169.5	0	0	0	0	0	110.2	A157 M158 Y159 M210 Y216	A157-A190 PolarHBondContact O-N 3.49Å; M158-A190 CarbonylContact C-O 3.56Å; M158-A190 WeakPolarHBondContact CA-O 3.4Å; M158-A190 HydrophobicContact CG-CB 4.36Å; Y159-A190 PolarHBondContact N-O 3.05Å; A190-M210 HydrophobicContact CB-CE 3.84Å; A190-Y216 HydrophobicContact CB-CE1 4.19Å
191	Y	98.8	Very high	98.2	Very high	100 Å²	100	53.6 Å²	53.6	39%	0.392	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.8	136.2	-179.3	166	-95.2	0	0	0	111.7	Y159 D161 F166	Y159-Y191 WeakPolarHBondContact O-CA 3.37Å; D161-Y191 HydrophobicContact CB-CD2 4.45Å; D161-Y191 HydrophobicContact CB-CE2 3.56Å; F166-Y191 HydrophobicContact CB-CD2 3.94Å; F166-Y191 HydrophobicContact CB-CE2 3.45Å; F166-Y191 VanDerWaalsContact CB-CE2 3.45Å; F166-Y191 AromaticContact CD1-CD2 3.56Å; F166-Y191 HydrophobicContact CD1-CD2 3.56Å; F166-Y191 AromaticContact CD1-CE2 3.8Å; F166-Y191 HydrophobicContact CD1-CE2 3.8Å; F166-Y191 HydrophobicContact CD1-CG 4.06Å; F166-Y191 HydrophobicContact CD2-CD2 4.14Å; F166-Y191 HydrophobicContact CD2-CE2 4.49Å; F166-Y191 HydrophobicContact CE1-CD2 4.04Å; F166-Y191 HydrophobicContact CE1-CG 4.2Å; F166-Y191 AromaticContact CG-CD2 3.61Å; F166-Y191 HydrophobicContact CG-CD2 3.61Å; F166-Y191 AromaticContact CG-CE2 3.68Å; F166-Y191 HydrophobicContact CG-CE2 3.68Å
192	A	98.6	Very high	98.1	Very high	29 Å²	29	56.5 Å²	56.5	24%	0.24	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.2	145.9	170	0	0	0	0	0	111.3	Y159 I160 D161 L203	Y159-A192 PolarHBondContact O-N 3.27Å; I160-A192 WeakPolarHBondContact CA-O 3.29Å; D161-A192 PolarHBondContact N-O 2.8Å; A192-L203 HydrophobicContact CB-CD1 3.95Å; A192-L203 HydrophobicContact CB-CD2 3.72Å; A192-L203 HydrophobicContact CB-CG 4.45Å
193	R	98.5	Very high	98.1	Very high	104 Å²	104	56 Å²	56	39%	0.392	29%	0.287	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104	115.1	174.5	-167.5	172.1	-178.5	177.7	2.9	111.4	D161 F195 H199	D161-R193 CarbonylContact O-C 3.49Å; D161-R193 VanDerWaalsContact O-CA 3.26Å; D161-R193 WeakPolarHBondContact O-CA 3.48Å; R193-F195 HydrophobicContact CB-CE2 4.14Å; R193-F195 HydrophobicContact CB-CZ 4.13Å; R193-F195 HydrophobicContact CG-CE1 4.14Å; R193-F195 HydrophobicContact CG-CE2 4.29Å; R193-F195 HydrophobicContact CG-CZ 3.97Å; R193-F195 WeakPolarHBondContact O-CD2 3.21Å; R193-F195 WeakPolarHBondContact O-CE2 2.97Å; R193-H199 PolarHBondContact O-CE1 3.21Å; R193-H199 VanDerWaalsContact O-CE1 3.26Å
194	G	97.6	Very high	98.1	Very high	1 Å²	1	52.9 Å²	52.9	1%	0.01	27%	0.265	C	S	.	.			trans	-78.3	129.6	170.6	0	0	0	0	0	110.9	D161	D161-G194 PolarHBondContact O-N 2.93Å
195	F	97.4	Very high	97.9	Very high	134 Å²	134	53.5 Å²	53.5	59%	0.588	26%	0.262	S	S	*	.			trans	-109.2	-18.1	-176.3	-70	-77.2	0	0	0	114.1	R193 H199	R193-F195 HydrophobicContact CB-CE2 4.14Å; R193-F195 HydrophobicContact CB-CZ 4.13Å; R193-F195 HydrophobicContact CG-CE1 4.14Å; R193-F195 HydrophobicContact CG-CE2 4.29Å; R193-F195 HydrophobicContact CG-CZ 3.97Å; R193-F195 WeakPolarHBondContact O-CD2 3.21Å; R193-F195 WeakPolarHBondContact O-CE2 2.97Å; F195-H199 AromaticContact CD2-ND1 3.87Å
196	N	97.8	Very high	97.8	Very high	68 Å²	68	58.3 Å²	58.3	36%	0.364	28%	0.284	S	S	.	.	S	Bend	trans	-154.7	166.7	175.7	57.5	60.7	0	0	0	108.9	D198 H199 Q200 D231	N196-D198 VanDerWaalsContact C-N 3.3Å; N196-D198 PolarHBondContact O-N 3.32Å; N196-D198 PolarHBondContact OD1-N 2.78Å; N196-H199 PolarHBondContact O-N 2.71Å; N196-H199 VanDerWaalsContact OD1-CB 3.25Å; N196-H199 WeakPolarHBondContact OD1-CB 3.45Å; N196-H199 PolarHBondContact OD1-N 3.09Å; N196-Q200 PolarHBondContact O-N 2.81Å; N196-D231 VanDerWaalsContact CA-OD2 3.27Å; N196-D231 WeakPolarHBondContact CA-OD2 3.34Å; N196-D231 WeakPolarHBondContact CB-OD2 3.44Å
197	T	97.7	Very high	97.8	Very high	5 Å²	5	55.7 Å²	55.7	3%	0.031	27%	0.27	C	S	.	.	H	α-helix	trans	-63.9	-32.2	-174.2	54.1	0	0	0	0	114	Q200 T201 L227 Y228 D231 Y232 H244	T197-Q200 PolarHBondContact O-N 2.61Å; T197-T201 PolarHBondContact O-N 3.33Å; T197-T201 PolarHBondContact O-OG1 3.33Å; T197-L227 HydrophobicContact CG2-CB 3.75Å; T197-Y228 HydrophobicContact CG2-CD1 3.74Å; T197-Y228 HydrophobicContact CG2-CD2 3.88Å; T197-Y228 HydrophobicContact CG2-CE1 3.88Å; T197-Y228 HydrophobicContact CG2-CE2 4Å; T197-Y228 HydrophobicContact CG2-CG 3.76Å; T197-D231 HydrophobicContact CG2-CB 4.17Å; T197-D231 PolarHBondContact N-OD2 2.72Å; T197-Y232 HydrophobicContact CG2-CD2 4.44Å; T197-Y232 HydrophobicContact CG2-CE2 3.89Å; T197-Y232 WeakPolarHBondContact OG1-CE2 3.5Å; T197-H244 PolarHBondContact O-CE1 3.23Å
198	D	97.7	Very high	97.6	Very high	104 Å²	104	49.5 Å²	49.5	56%	0.556	24%	0.238	S	C	*	.	H	α-helix	trans	-70.1	-44.9	178.1	-66.8	-28.4	0	0	0	111.2	N196 Q200 T201 Q202 H244	N196-D198 VanDerWaalsContact C-N 3.3Å; N196-D198 PolarHBondContact O-N 3.32Å; N196-D198 PolarHBondContact OD1-N 2.78Å; D198-Q200 VanDerWaalsContact C-N 3.31Å; D198-Q200 PolarHBondContact O-N 3.32Å; D198-T201 PolarHBondContact O-N 2.76Å; D198-Q202 PolarHBondContact O-N 3.39Å; D198-H244 IonicContact OD1-NE2 2.91Å; D198-H244 PolarHBondContact OD1-NE2 3.43Å
199	H	98.3	Very high	97.5	Very high	51 Å²	51	48.3 Å²	48.3	24%	0.236	24%	0.235	C	C	.	.	H	α-helix	trans	-61.7	-40	175.4	-177.5	-159.6	0	0	0	111	R193 F195 N196 T201 Q202 L203	R193-H199 PolarHBondContact O-CE1 3.21Å; R193-H199 VanDerWaalsContact O-CE1 3.26Å; F195-H199 AromaticContact CD2-ND1 3.87Å; N196-H199 PolarHBondContact O-N 2.71Å; N196-H199 VanDerWaalsContact OD1-CB 3.25Å; N196-H199 WeakPolarHBondContact OD1-CB 3.45Å; N196-H199 PolarHBondContact OD1-N 3.09Å; H199-T201 VanDerWaalsContact C-N 3.29Å; H199-T201 PolarHBondContact O-N 2.87Å; H199-Q202 WeakPolarHBondContact O-CB 3.42Å; H199-Q202 PolarHBondContact O-N 3.11Å; H199-Q202 VanDerWaalsContact O-N 3.08Å; H199-L203 WeakPolarHBondContact O-CG 3.5Å; H199-L203 PolarHBondContact O-N 3.11Å
200	Q	97.6	Very high	97.4	Very high	0 Å²	0	51 Å²	51	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-57.9	-41.3	175.4	-168.1	-177.7	17.5	0	0	112.1	N196 T197 D198 V221 L227 F248	N196-Q200 PolarHBondContact O-N 2.81Å; T197-Q200 PolarHBondContact O-N 2.61Å; D198-Q200 VanDerWaalsContact C-N 3.31Å; D198-Q200 PolarHBondContact O-N 3.32Å; Q200-V221 VanDerWaalsContact NE2-CG1 3.27Å; Q200-L227 HydrophobicContact CB-CD1 4.24Å; Q200-F248 HydrophobicContact CG-CE2 3.72Å; Q200-F248 HydrophobicContact CG-CZ 3.88Å
201	T	97.1	Very high	97.3	Very high	13 Å²	13	50.3 Å²	50.3	8%	0.08	24%	0.241	C	C	.	.	H	α-helix	trans	-68.9	-39.3	173.4	-57	0	0	0	0	111.8	T197 D198 H199 L203 L204 Y205 H244 M251	T197-T201 PolarHBondContact O-N 3.33Å; T197-T201 PolarHBondContact O-OG1 3.33Å; D198-T201 PolarHBondContact O-N 2.76Å; H199-T201 VanDerWaalsContact C-N 3.29Å; H199-T201 PolarHBondContact O-N 2.87Å; T201-L203 VanDerWaalsContact C-N 3.29Å; T201-L203 PolarHBondContact O-N 3.43Å; T201-L204 WeakPolarHBondContact O-CB 3.22Å; T201-L204 PolarHBondContact O-N 2.94Å; T201-L204 VanDerWaalsContact O-N 3.12Å; T201-Y205 HydrophobicContact CG2-CE2 4.27Å; T201-H244 PolarHBondContact OG1-CE1 2.9Å; T201-M251 HydrophobicContact CG2-CE 4.19Å; T201-M251 HydrophobicContact CG2-SD 3.63Å
202	Q	96.9	Very high	97	Very high	114 Å²	114	46.8 Å²	46.8	53%	0.533	23%	0.232	S	C	.	.	H	α-helix	trans	-60.6	-38.8	178.8	-169.7	178.9	4.7	0	0	112.3	D198 H199 L204 Y205 Q206	D198-Q202 PolarHBondContact O-N 3.39Å; H199-Q202 WeakPolarHBondContact O-CB 3.42Å; H199-Q202 PolarHBondContact O-N 3.11Å; H199-Q202 VanDerWaalsContact O-N 3.08Å; Q202-L204 PolarHBondContact O-N 3.02Å; Q202-Y205 PolarHBondContact O-N 2.94Å; Q202-Y205 VanDerWaalsContact O-N 3.08Å; Q202-Q206 PolarHBondContact O-N 3.48Å
203	L	98.3	Very high	96.8	Very high	12 Å²	12	53.3 Å²	53.3	6%	0.063	26%	0.258	C	S	.	.	H	α-helix	trans	-59.5	-27.9	176.8	-70.2	172.5	0	0	0	112.6	I160 A192 H199 T201 Y205 Q206 A207	I160-L203 HydrophobicContact CD1-CB 4.05Å; I160-L203 HydrophobicContact CG2-CD1 3.89Å; A192-L203 HydrophobicContact CB-CD1 3.95Å; A192-L203 HydrophobicContact CB-CD2 3.72Å; A192-L203 HydrophobicContact CB-CG 4.45Å; H199-L203 WeakPolarHBondContact O-CG 3.5Å; H199-L203 PolarHBondContact O-N 3.11Å; T201-L203 VanDerWaalsContact C-N 3.29Å; T201-L203 PolarHBondContact O-N 3.43Å; L203-Y205 VanDerWaalsContact C-N 3.35Å; L203-Q206 PolarHBondContact O-N 3Å; L203-A207 WeakPolarHBondContact O-CB 3.3Å; L203-A207 PolarHBondContact O-N 3.34Å
204	L	97.6	Very high	96.6	Very high	2 Å²	2	50.3 Å²	50.3	1%	0.01	25%	0.253	C	S	.	.	H	α-helix	trans	-70.5	-28.5	176.5	-61.3	-171	0	0	0	113.4	I160 T201 Q202 A207 S208 L219 F248 M251 L252 L255	I160-L204 HydrophobicContact CD1-CD2 3.76Å; T201-L204 WeakPolarHBondContact O-CB 3.22Å; T201-L204 PolarHBondContact O-N 2.94Å; T201-L204 VanDerWaalsContact O-N 3.12Å; Q202-L204 PolarHBondContact O-N 3.02Å; L204-A207 WeakPolarHBondContact O-CB 3.34Å; L204-A207 PolarHBondContact O-N 3.44Å; L204-S208 PolarHBondContact O-N 3Å; L204-S208 VanDerWaalsContact O-N 3.08Å; L204-L219 HydrophobicContact CD2-CD2 4.31Å; L204-F248 HydrophobicContact CD1-CD2 3.64Å; L204-F248 HydrophobicContact CD1-CE2 3.43Å; L204-F248 VanDerWaalsContact CD1-CE2 3.43Å; L204-F248 HydrophobicContact CD1-CZ 4.22Å; L204-F248 HydrophobicContact CD2-CE2 4.3Å; L204-F248 HydrophobicContact CG-CD2 4.38Å; L204-F248 HydrophobicContact CG-CE2 3.84Å; L204-M251 HydrophobicContact CB-CE 3.88Å; L204-M251 HydrophobicContact CD1-CB 3.74Å; L204-M251 HydrophobicContact CD1-CE 4.47Å; L204-L252 HydrophobicContact CD1-CD2 3.81Å; L204-L252 HydrophobicContact CD1-CG 4.04Å; L204-L252 HydrophobicContact CD2-CD2 3.65Å; L204-L252 HydrophobicContact CG-CD2 4.41Å; L204-L255 HydrophobicContact CB-CD1 4.29Å; L204-L255 HydrophobicContact CD2-CD1 4.08Å
205	Y	94.8	Very high	96.5	Very high	98 Å²	98	56.6 Å²	56.6	38%	0.384	28%	0.276	S	S	.	.	H	α-helix	trans	-72.4	-33.4	172.9	-67	-82.5	0	0	0	111.9	T201 Q202 L203 A207 S208 A209 M251	T201-Y205 HydrophobicContact CG2-CE2 4.27Å; Q202-Y205 PolarHBondContact O-N 2.94Å; Q202-Y205 VanDerWaalsContact O-N 3.08Å; L203-Y205 VanDerWaalsContact C-N 3.35Å; Y205-A207 VanDerWaalsContact C-N 3.34Å; Y205-S208 PolarHBondContact O-OG 3.02Å; Y205-A209 PolarHBondContact O-N 3.29Å; Y205-M251 HydrophobicContact CD1-CE 4.26Å; Y205-M251 HydrophobicContact CD2-CE 3.87Å; Y205-M251 HydrophobicContact CE1-CE 3.93Å; Y205-M251 HydrophobicContact CE2-CE 3.52Å; Y205-M251 HydrophobicContact CE2-SD 4.4Å; Y205-M251 HydrophobicContact CG-CE 4.25Å
206	Q	96.4	Very high	96.5	Very high	103 Å²	103	51.2 Å²	51.2	48%	0.481	25%	0.252	S	S	.	.	H	α-helix	trans	-70.8	-37.5	172.1	-64.8	177.6	-6.8	0	0	110.3	Q202 L203 S208 A209 M210	Q202-Q206 PolarHBondContact O-N 3.48Å; L203-Q206 PolarHBondContact O-N 3Å; Q206-S208 PolarHBondContact O-N 3.4Å; Q206-A209 PolarHBondContact O-N 2.91Å; Q206-M210 WeakPolarHBondContact O-CG 3.38Å; Q206-M210 PolarHBondContact O-N 2.96Å
207	A	97.6	Very high	96.6	Very high	1 Å²	1	48.2 Å²	48.2	1%	0.008	24%	0.237	C	C	.	.	H	α-helix	trans	-58.4	-47.1	176.5	0	0	0	0	0	112.3	M158 L203 L204 Y205 A209 M210 M211 L255	M158-A207 HydrophobicContact CE-CB 3.93Å; M158-A207 HydrophobicContact SD-CB 3.29Å; M158-A207 WeakPolarHBondContact SD-CB 3.35Å; L203-A207 WeakPolarHBondContact O-CB 3.3Å; L203-A207 PolarHBondContact O-N 3.34Å; L204-A207 WeakPolarHBondContact O-CB 3.34Å; L204-A207 PolarHBondContact O-N 3.44Å; Y205-A207 VanDerWaalsContact C-N 3.34Å; A207-A209 VanDerWaalsContact C-N 3.32Å; A207-A209 PolarHBondContact O-N 3.04Å; A207-M210 PolarHBondContact O-N 3.14Å; A207-M211 WeakPolarHBondContact O-CB 3.43Å; A207-M211 VanDerWaalsContact O-CG 3.24Å; A207-M211 WeakPolarHBondContact O-CG 3.44Å; A207-M211 PolarHBondContact O-N 3.31Å; A207-L255 HydrophobicContact CB-CD1 4.41Å
208	S	95.8	Very high	96.6	Very high	5 Å²	5	48 Å²	48	4%	0.035	24%	0.235	C	C	.	.	H	α-helix	trans	-59.9	-41.4	177.8	53.8	0	0	0	0	112.3	H47 L204 Y205 Q206 M211 A212 F259	H47-S208 PolarHBondContact CD2-OG 3.36Å; H47-S208 VanDerWaalsContact CD2-OG 3.32Å; L204-S208 PolarHBondContact O-N 3Å; L204-S208 VanDerWaalsContact O-N 3.08Å; Y205-S208 PolarHBondContact O-OG 3.02Å; Q206-S208 PolarHBondContact O-N 3.4Å; S208-M211 PolarHBondContact O-N 3.31Å; S208-A212 PolarHBondContact O-N 2.83Å; S208-A212 VanDerWaalsContact O-N 3.09Å; S208-F259 WeakPolarHBondContact O-CZ 3.45Å
209	A	94.7	Very high	96.7	Very high	30 Å²	30	43 Å²	43	25%	0.248	21%	0.209	C	C	.	.	H	α-helix	trans	-61.9	-46.7	175.6	0	0	0	0	0	111.9	H47 Y205 Q206 A207 M211 A212 E213	H47-A209 PolarHBondContact CD2-N 3.39Å; Y205-A209 PolarHBondContact O-N 3.29Å; Q206-A209 PolarHBondContact O-N 2.91Å; A207-A209 VanDerWaalsContact C-N 3.32Å; A207-A209 PolarHBondContact O-N 3.04Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 2.83Å; A209-A212 PolarHBondContact O-N 3.28Å; A209-E213 PolarHBondContact O-N 2.99Å
210	M	96.9	Very high	96.7	Very high	74 Å²	74	40.6 Å²	40.6	37%	0.365	20%	0.198	S	C	.	.	H	α-helix	trans	-64.3	-37.1	178.6	-66.1	175.8	75.6	0	0	112.5	M158 A190 Q206 A207 A212 E213 S214 Y216	M158-M210 HydrophobicContact CE-CB 4.01Å; M158-M210 HydrophobicContact CE-CE 4.42Å; M158-M210 HydrophobicContact CE-SD 3.97Å; A190-M210 HydrophobicContact CB-CE 3.84Å; Q206-M210 WeakPolarHBondContact O-CG 3.38Å; Q206-M210 PolarHBondContact O-N 2.96Å; A207-M210 PolarHBondContact O-N 3.14Å; M210-A212 VanDerWaalsContact C-N 3.29Å; M210-A212 PolarHBondContact O-N 3.2Å; M210-E213 PolarHBondContact O-N 3.13Å; M210-S214 PolarHBondContact O-N 3.38Å; M210-S214 VanDerWaalsContact O-N 3.11Å; M210-Y216 HydrophobicContact CB-CE2 4.24Å; M210-Y216 WeakPolarHBondContact CE-OH 3.33Å
211	M	96.7	Very high	96.8	Very high	9 Å²	9	40.6 Å²	40.6	4%	0.044	20%	0.198	C	C	.	.	H	α-helix	trans	-71.5	-23.2	177.8	-68.9	178.2	-179.5	0	0	113.1	M158 A207 S208 A209 S214 Y216 L219 L255 F259 V261	M158-M211 HydrophobicContact CE-CE 4.29Å; M158-M211 HydrophobicContact SD-CE 4.24Å; A207-M211 WeakPolarHBondContact O-CB 3.43Å; A207-M211 VanDerWaalsContact O-CG 3.24Å; A207-M211 WeakPolarHBondContact O-CG 3.44Å; A207-M211 PolarHBondContact O-N 3.31Å; S208-M211 PolarHBondContact O-N 3.31Å; A209-M211 VanDerWaalsContact C-N 3.33Å; A209-M211 PolarHBondContact O-N 2.83Å; M211-S214 CarbonylContact C-O 3.49Å; M211-S214 VanDerWaalsContact O-O 3.07Å; M211-Y216 HydrophobicContact CB-CD2 4.4Å; M211-Y216 HydrophobicContact CG-CD2 3.82Å; M211-Y216 HydrophobicContact CG-CG 4.11Å; M211-L219 HydrophobicContact CE-CB 4.1Å; M211-L219 HydrophobicContact CE-CD2 4.31Å; M211-L255 HydrophobicContact SD-CD2 4.43Å; M211-F259 VanDerWaalsContact C-CE1 3.43Å; M211-F259 HydrophobicContact CB-CB 4.44Å; M211-F259 HydrophobicContact CB-CD1 3.46Å; M211-F259 VanDerWaalsContact CB-CD1 3.46Å; M211-F259 HydrophobicContact CB-CD2 3.91Å; M211-F259 HydrophobicContact CB-CE1 3.58Å; M211-F259 HydrophobicContact CB-CE2 3.99Å; M211-F259 HydrophobicContact CB-CG 3.66Å; M211-F259 HydrophobicContact CB-CZ 3.84Å; M211-F259 HydrophobicContact CG-CD2 4.49Å; M211-F259 HydrophobicContact CG-CG 4.39Å; M211-F259 HydrophobicContact SD-CB 4.21Å; M211-F259 HydrophobicContact SD-CD2 3.76Å; M211-F259 HydrophobicContact SD-CE2 4.35Å; M211-F259 HydrophobicContact SD-CG 3.99Å; M211-V261 HydrophobicContact CE-CG1 4.32Å; M211-V261 HydrophobicContact CE-CG2 4.26Å; M211-V261 HydrophobicContact SD-CG1 4.24Å; M211-V261 HydrophobicContact SD-CG2 4.36Å
212	A	94	Very high	96.8	Very high	25 Å²	25	40 Å²	40	21%	0.207	19%	0.194	C	C	.	.	H	α-helix	trans	-74.9	-27.6	172.2	0	0	0	0	0	112.6	L24 H47 S208 A209 M210 F259	L24-A212 HydrophobicContact CD2-CB 4.09Å; H47-A212 HydrophobicContact CB-CB 3.73Å; S208-A212 PolarHBondContact O-N 2.83Å; S208-A212 VanDerWaalsContact O-N 3.09Å; A209-A212 PolarHBondContact O-N 3.28Å; M210-A212 VanDerWaalsContact C-N 3.29Å; M210-A212 PolarHBondContact O-N 3.2Å; A212-F259 HydrophobicContact CB-CE1 4.26Å
213	E	92.9	Very high	96.8	Very high	166 Å²	166	34.6 Å²	34.6	78%	0.776	17%	0.169	S	C	*	.	H	α-helix	trans	-89.1	-29.2	-179.7	-67.4	-179.7	-177.8	0	0	113.6	A209 M210	A209-E213 PolarHBondContact O-N 2.99Å; M210-E213 PolarHBondContact O-N 3.13Å
214	S	94.5	Very high	96.7	Very high	41 Å²	41	34 Å²	34	29%	0.287	17%	0.166	S	C	.	.	S	Bend	trans	-143	147.3	-175.6	-77.1	0	0	0	0	110.9	K156 M210 M211 Y216	K156-S214 PolarHBondContact NZ-OG 2.91Å; M210-S214 PolarHBondContact O-N 3.38Å; M210-S214 VanDerWaalsContact O-N 3.11Å; M211-S214 CarbonylContact C-O 3.49Å; M211-S214 VanDerWaalsContact O-O 3.07Å; S214-Y216 VanDerWaalsContact O-CD2 3.29Å; S214-Y216 WeakPolarHBondContact O-CD2 3.49Å; S214-Y216 PolarHBondContact O-N 2.92Å
215	R	95.8	Very high	96.6	Very high	133 Å²	133	34 Å²	34	50%	0.502	17%	0.166	S	C	.	.			trans	-69.5	119.3	174.1	-176	179.5	173.9	85.5	1.9	111.2	K156	K156-R215 PolarHBondContact N-O 2.84Å; K156-R215 VanDerWaalsContact N-O 3.15Å
216	Y	98.3	Very high	96.5	Very high	22 Å²	22	30.1 Å²	30.1	9%	0.086	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	151	165.4	-74.7	-98.8	0	0	0	109.3	K156 A157 M158 A190 M210 M211 S214 V261	K156-Y216 HydrophobicContact CB-CD1 3.57Å; K156-Y216 HydrophobicContact CB-CE1 3.54Å; K156-Y216 HydrophobicContact CB-CE2 4.49Å; K156-Y216 HydrophobicContact CB-CG 4.06Å; K156-Y216 HydrophobicContact CD-CE1 4.45Å; K156-Y216 HydrophobicContact CD-CE2 4.44Å; K156-Y216 CarbonylContact O-C 3.6Å; K156-Y216 WeakPolarHBondContact O-CA 3.49Å; K156-Y216 WeakPolarHBondContact O-CD1 3.38Å; A157-Y216 WeakPolarHBondContact O-CE1 3.34Å; M158-Y216 HydrophobicContact CB-CD1 4.06Å; M158-Y216 HydrophobicContact CB-CE1 4.17Å; M158-Y216 HydrophobicContact CE-CD1 4.35Å; M158-Y216 HydrophobicContact CE-CE1 4.02Å; M158-Y216 HydrophobicContact CE-CE2 4.46Å; A190-Y216 HydrophobicContact CB-CE1 4.19Å; M210-Y216 HydrophobicContact CB-CE2 4.24Å; M210-Y216 WeakPolarHBondContact CE-OH 3.33Å; M211-Y216 HydrophobicContact CB-CD2 4.4Å; M211-Y216 HydrophobicContact CG-CD2 3.82Å; M211-Y216 HydrophobicContact CG-CG 4.11Å; S214-Y216 VanDerWaalsContact O-CD2 3.29Å; S214-Y216 WeakPolarHBondContact O-CD2 3.49Å; S214-Y216 PolarHBondContact O-N 2.92Å; Y216-V261 WeakPolarHBondContact O-CG1 3.36Å
217	A	98.2	Very high	96.5	Very high	5 Å²	5	25.9 Å²	25.9	4%	0.041	13%	0.134	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	-23.5	174.6	0	0	0	0	0	112.3	I102 C144 K156 A262	I102-A217 HydrophobicContact CD1-CB 4.5Å; C144-A217 HydrophobicContact CB-CB 4.09Å; K156-A217 PolarHBondContact O-N 2.76Å; A217-A262 PolarHBondContact O-N 3.08Å
218	L	98.9	Very high	96.4	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.135	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	133	-171.1	-178.1	68.5	0	0	0	111.9	I102 L140 C144 M158 I220 A262 V264	I102-L218 HydrophobicContact CD1-CB 4.47Å; L140-L218 VanDerWaalsContact C-CD2 3.44Å; L140-L218 HydrophobicContact CB-CD2 3.67Å; L140-L218 WeakPolarHBondContact O-CD2 3.42Å; C144-L218 HydrophobicContact CB-CB 3.86Å; C144-L218 HydrophobicContact CB-CD2 4.22Å; M158-L218 PolarHBondContact N-O 3.16Å; L218-I220 HydrophobicContact CD1-CG1 4.38Å; L218-I220 HydrophobicContact CD2-CD1 3.66Å; L218-I220 HydrophobicContact CD2-CG1 3.94Å; L218-I220 HydrophobicContact CG-CD1 4.24Å; L218-I220 HydrophobicContact CG-CG1 4Å; L218-A262 CarbonylContact C-O 3.56Å; L218-A262 WeakPolarHBondContact CA-O 3.45Å; L218-A262 HydrophobicContact CD1-CB 3.84Å; L218-V264 HydrophobicContact CD1-CB 4.42Å; L218-V264 HydrophobicContact CD1-CG2 3.78Å
219	L	98.9	Very high	96	Very high	0 Å²	0	31.4 Å²	31.4	0%	0	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-117.1	119.7	167	172.8	60.8	0	0	0	109.7	M158 I160 L204 M211 L252 L255 A262 V263 V264	M158-L219 HydrophobicContact CB-CD1 3.86Å; M158-L219 HydrophobicContact CG-CD1 3.81Å; M158-L219 HydrophobicContact SD-CD1 3.89Å; I160-L219 HydrophobicContact CD1-CD1 4.13Å; I160-L219 HydrophobicContact CG1-CD1 4.39Å; L204-L219 HydrophobicContact CD2-CD2 4.31Å; M211-L219 HydrophobicContact CE-CB 4.1Å; M211-L219 HydrophobicContact CE-CD2 4.31Å; L219-L252 HydrophobicContact CD2-CD2 3.66Å; L219-L255 HydrophobicContact CD2-CD1 3.85Å; L219-A262 PolarHBondContact N-O 2.75Å; L219-V263 HydrophobicContact CB-CG2 4.41Å; L219-V263 HydrophobicContact CD2-CG2 4.45Å; L219-V263 CarbonylContact O-C 3.54Å; L219-V263 WeakPolarHBondContact O-CA 3.45Å; L219-V264 PolarHBondContact O-N 3.31Å
220	I	98.9	Very high	95.8	Very high	0 Å²	0	34.3 Å²	34.3	0%	0	17%	0.169	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	134.8	175.3	-66.9	160.3	0	0	0	110.1	C137 A141 M158 Y159 I160 L218 D222 V264	C137-I220 HydrophobicContact CB-CD1 4.06Å; C137-I220 HydrophobicContact CB-CG2 3.94Å; C137-I220 VanDerWaalsContact O-CD1 3.22Å; C137-I220 WeakPolarHBondContact O-CD1 3.24Å; A141-I220 HydrophobicContact CB-CD1 4.1Å; M158-I220 PolarHBondContact O-N 3.25Å; Y159-I220 HydrophobicContact CD1-CG2 4.33Å; Y159-I220 HydrophobicContact CD2-CB 3.96Å; Y159-I220 HydrophobicContact CD2-CD1 3.62Å; Y159-I220 HydrophobicContact CD2-CG1 4.42Å; Y159-I220 HydrophobicContact CD2-CG2 3.94Å; Y159-I220 HydrophobicContact CE1-CG2 4.08Å; Y159-I220 HydrophobicContact CE2-CB 4.18Å; Y159-I220 HydrophobicContact CE2-CD1 3.71Å; Y159-I220 HydrophobicContact CE2-CG2 3.69Å; Y159-I220 HydrophobicContact CG-CB 4.25Å; Y159-I220 HydrophobicContact CG-CG2 4.25Å; I160-I220 PolarHBondContact N-O 3.18Å; L218-I220 HydrophobicContact CD1-CG1 4.38Å; L218-I220 HydrophobicContact CD2-CD1 3.66Å; L218-I220 HydrophobicContact CD2-CG1 3.94Å; L218-I220 HydrophobicContact CG-CD1 4.24Å; L218-I220 HydrophobicContact CG-CG1 4Å; I220-D222 HydrophobicContact CG2-CB 4.05Å; I220-V264 CarbonylContact C-O 3.45Å; I220-V264 VanDerWaalsContact CA-O 3.3Å; I220-V264 WeakPolarHBondContact CA-O 3.23Å; I220-V264 HydrophobicContact CG1-CB 4.33Å
221	V	98.8	Very high	95.6	Very high	0 Å²	0	33.9 Å²	33.9	0%	0	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	103.3	166.6	-170.7	0	0	0	0	109.5	I160 Q200 A224 F248 L252 V264 I265 T266	I160-V221 HydrophobicContact CB-CG1 4.49Å; I160-V221 HydrophobicContact CB-CG2 4.44Å; I160-V221 HydrophobicContact CD1-CG2 4.49Å; I160-V221 HydrophobicContact CG2-CG1 4.42Å; I160-V221 WeakPolarHBondContact O-CA 3.44Å; Q200-V221 VanDerWaalsContact NE2-CG1 3.27Å; V221-A224 HydrophobicContact CB-CB 4.48Å; V221-A224 HydrophobicContact CG1-CB 4.1Å; V221-A224 PolarHBondContact O-N 3.46Å; V221-F248 HydrophobicContact CG1-CE1 4.49Å; V221-F248 HydrophobicContact CG1-CZ 4.06Å; V221-F248 HydrophobicContact CG2-CZ 4.32Å; V221-L252 HydrophobicContact CG2-CD1 4.4Å; V221-L252 HydrophobicContact CG2-CD2 4.11Å; V221-V264 PolarHBondContact N-O 2.86Å; V221-I265 HydrophobicContact CB-CG2 4.13Å; V221-I265 HydrophobicContact CG2-CG2 4.37Å; V221-T266 PolarHBondContact O-N 2.92Å
222	D	98.4	Very high	95.3	Very high	1 Å²	1	35.2 Å²	35.2	1%	0.005	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	98.9	-174.3	-170.7	24	0	0	0	111.7	T134 Y159 I160 D161 T162 I220 T266	T134-D222 VanDerWaalsContact CB-OD2 3.26Å; T134-D222 WeakPolarHBondContact CB-OD2 3.46Å; T134-D222 VanDerWaalsContact CG2-OD2 3.24Å; T134-D222 WeakPolarHBondContact CG2-OD2 3.32Å; T134-D222 PolarHBondContact OG1-OD2 3.41Å; Y159-D222 HydrophobicContact CE1-CB 3.71Å; Y159-D222 WeakPolarHBondContact OH-CB 3.41Å; Y159-D222 PolarHBondContact OH-OD2 2.94Å; I160-D222 PolarHBondContact O-N 3.35Å; D161-D222 CarbonylContact C-O 3.59Å; D161-D222 WeakPolarHBondContact CA-O 3.43Å; T162-D222 PolarHBondContact N-O 3.26Å; T162-D222 PolarHBondContact OG1-O 3.02Å; I220-D222 HydrophobicContact CG2-CB 4.05Å; D222-T266 WeakPolarHBondContact CA-OG1 3.47Å; D222-T266 HydrophobicContact CB-CG2 4.11Å; D222-T266 WeakPolarHBondContact OD1-CB 3.48Å; D222-T266 VanDerWaalsContact OD1-CG2 3.24Å; D222-T266 WeakPolarHBondContact OD1-CG2 3.37Å; D222-T266 PolarHBondContact OD1-OG1 3.28Å
223	S	96.4	Very high	95	Very high	0 Å²	0	37.8 Å²	37.8	0%	0	19%	0.189	C	C	.	.	T	Hydrogen-bonded Turn	cis	-101.7	152.3	-7.9	71.4	0	0	0	0	112.7	T162 E163 T225 A226 T266	T162-S223 WeakPolarHBondContact CG2-O 3.26Å; T162-S223 PolarHBondContact OG1-N 3.43Å; T162-S223 PolarHBondContact OG1-O 2.81Å; E163-S223 VanDerWaalsContact OE1-CB 3.29Å; E163-S223 WeakPolarHBondContact OE1-CB 3.42Å; E163-S223 PolarHBondContact OE1-OG 3.21Å; S223-T225 PolarHBondContact O-N 3.35Å; S223-A226 WeakPolarHBondContact OG-CB 3.44Å; S223-A226 PolarHBondContact OG-N 3.23Å; S223-A226 VanDerWaalsContact OG-N 3.16Å; S223-T266 WeakPolarHBondContact CA-OG1 3.43Å; S223-T266 WeakPolarHBondContact CB-O 3.31Å; S223-T266 WeakPolarHBondContact CB-OG1 3.46Å
224	A	96.5	Very high	94.7	Very high	0 Å²	0	33 Å²	33	0%	0	18%	0.184	C	C	.	.	S	Bend	trans	-67.8	-20.2	177	0	0	0	0	0	112.4	V221 Y228 F248 I265 T266	V221-A224 HydrophobicContact CB-CB 4.48Å; V221-A224 HydrophobicContact CG1-CB 4.1Å; V221-A224 PolarHBondContact O-N 3.46Å; A224-Y228 VanDerWaalsContact O-CD2 3.28Å; A224-Y228 WeakPolarHBondContact O-CD2 3.32Å; A224-Y228 WeakPolarHBondContact O-CE2 3.25Å; A224-F248 HydrophobicContact CB-CE1 4.42Å; A224-I265 HydrophobicContact CB-CB 3.91Å; A224-I265 HydrophobicContact CB-CG2 4.24Å; A224-T266 PolarHBondContact N-O 2.83Å
225	T	94.4	Very high	94.3	Very high	1 Å²	1	42.4 Å²	42.4	1%	0.006	21%	0.213	C	C	.	.	S	Bend	trans	-114	-13.3	-169.6	59.3	0	0	0	0	115.6	S223 L227 Y228 R229 N267 I287 I292	S223-T225 PolarHBondContact O-N 3.35Å; T225-L227 PolarHBondContact O-N 3.3Å; T225-Y228 PolarHBondContact O-N 3.42Å; T225-R229 PolarHBondContact O-N 3.42Å; T225-N267 HydrophobicContact CG2-CB 4.41Å; T225-N267 WeakPolarHBondContact CG2-OD1 3.48Å; T225-N267 PolarHBondContact OG1-OD1 2.82Å; T225-I287 HydrophobicContact CG2-CG2 4.45Å; T225-I292 HydrophobicContact CG2-CD1 4.12Å
226	A	94.4	Very high	94.2	Very high	16 Å²	16	39.5 Å²	39.5	13%	0.132	23%	0.225	C	C	.	.	H	α-helix	trans	-58	-52.2	-174.3	0	0	0	0	0	112.8	E163 S223 Y228 R229	E163-A226 HydrophobicContact CG-CB 3.97Å; S223-A226 WeakPolarHBondContact OG-CB 3.44Å; S223-A226 PolarHBondContact OG-N 3.23Å; S223-A226 VanDerWaalsContact OG-N 3.16Å; A226-Y228 VanDerWaalsContact C-N 3.29Å; A226-Y228 PolarHBondContact O-N 2.65Å; A226-R229 WeakPolarHBondContact O-CB 3.43Å; A226-R229 PolarHBondContact O-N 3Å
227	L	96.1	Very high	94	Very high	14 Å²	14	42.7 Å²	42.7	7%	0.073	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-35.9	-178	-57.7	174.3	0	0	0	112	T162 T197 Q200 T225 R229 T230 D231	T162-L227 HydrophobicContact CG2-CD1 3.58Å; T162-L227 HydrophobicContact CG2-CG 4.02Å; T197-L227 HydrophobicContact CG2-CB 3.75Å; Q200-L227 HydrophobicContact CB-CD1 4.24Å; T225-L227 PolarHBondContact O-N 3.3Å; L227-R229 PolarHBondContact O-N 3.4Å; L227-R229 VanDerWaalsContact O-N 3.13Å; L227-T230 PolarHBondContact O-N 3.28Å; L227-T230 VanDerWaalsContact O-N 3.15Å; L227-T230 PolarHBondContact O-OG1 3.48Å; L227-T230 VanDerWaalsContact O-OG1 3.1Å; L227-D231 WeakPolarHBondContact O-CB 3.44Å; L227-D231 VanDerWaalsContact O-CG 3.31Å; L227-D231 PolarHBondContact O-N 2.83Å
228	Y	94.6	Very high	93.6	Very high	6 Å²	6	46.1 Å²	46.1	2%	0.024	26%	0.258	C	S	.	.	H	α-helix	trans	-65.4	-15.6	176.8	-72.1	-86.3	0	0	0	114.1	T197 A224 T225 A226 Y232 R241 H244 L245 F248	T197-Y228 HydrophobicContact CG2-CD1 3.74Å; T197-Y228 HydrophobicContact CG2-CD2 3.88Å; T197-Y228 HydrophobicContact CG2-CE1 3.88Å; T197-Y228 HydrophobicContact CG2-CE2 4Å; T197-Y228 HydrophobicContact CG2-CG 3.76Å; A224-Y228 VanDerWaalsContact O-CD2 3.28Å; A224-Y228 WeakPolarHBondContact O-CD2 3.32Å; A224-Y228 WeakPolarHBondContact O-CE2 3.25Å; T225-Y228 PolarHBondContact O-N 3.42Å; A226-Y228 VanDerWaalsContact C-N 3.29Å; A226-Y228 PolarHBondContact O-N 2.65Å; Y228-Y232 HydrophobicContact CD1-CD2 4.06Å; Y228-Y232 AromaticContact CD1-CE2 3.81Å; Y228-Y232 HydrophobicContact CD1-CE2 3.81Å; Y228-Y232 HydrophobicContact CE1-CE2 4.15Å; Y228-R241 HydrophobicContact CD1-CG 3.94Å; Y228-R241 WeakPolarHBondContact O-CD 3.46Å; Y228-H244 HydrophobicContact CE1-CB 4.2Å; Y228-H244 AromaticContact CE1-ND1 3.36Å; Y228-H244 WeakPolarHBondContact CE1-ND1 3.43Å; Y228-H244 AromaticContact CZ-ND1 3.49Å; Y228-H244 PolarHBondContact OH-CE1 2.99Å; Y228-H244 PolarHBondContact OH-ND1 2.94Å; Y228-L245 HydrophobicContact CD1-CB 4.3Å; Y228-L245 HydrophobicContact CD2-CD1 4.26Å; Y228-L245 HydrophobicContact CE1-CB 3.91Å; Y228-L245 HydrophobicContact CE1-CD1 4.44Å; Y228-L245 HydrophobicContact CE2-CD1 3.94Å; Y228-F248 WeakPolarHBondContact OH-CB 3.36Å
229	R	87.9	Confident	93.3	Very high	117 Å²	117	49.8 Å²	49.8	44%	0.442	28%	0.284	S	S	.	.	H	α-helix	trans	-81.1	-31.9	174.9	-64.8	179.8	73.9	171.7	-1.6	112.7	T225 A226 L227 I287	T225-R229 PolarHBondContact O-N 3.42Å; A226-R229 WeakPolarHBondContact O-CB 3.43Å; A226-R229 PolarHBondContact O-N 3Å; L227-R229 PolarHBondContact O-N 3.4Å; L227-R229 VanDerWaalsContact O-N 3.13Å; R229-I287 VanDerWaalsContact CD-CD1 3.42Å; R229-I287 HydrophobicContact CG-CD1 3.95Å
230	T	89.6	Confident	93.2	Very high	91 Å²	91	52.1 Å²	52.1	56%	0.558	30%	0.303	S	S	*	.	H	α-helix	trans	-95.8	-41.8	-173.4	49.7	0	0	0	0	111.5	L227 Y232 S233	L227-T230 PolarHBondContact O-N 3.28Å; L227-T230 VanDerWaalsContact O-N 3.15Å; L227-T230 PolarHBondContact O-OG1 3.48Å; L227-T230 VanDerWaalsContact O-OG1 3.1Å; T230-Y232 VanDerWaalsContact C-N 3.31Å; T230-Y232 PolarHBondContact O-N 2.83Å; T230-S233 PolarHBondContact O-OG 2.86Å
231	D	92.6	Very high	93	Very high	64 Å²	64	55 Å²	55	34%	0.342	31%	0.314	S	S	.	.	S	Bend	trans	-75.7	-24.9	-170.7	-63.7	9.5	0	0	0	111.9	N196 T197 L227	N196-D231 VanDerWaalsContact CA-OD2 3.27Å; N196-D231 WeakPolarHBondContact CA-OD2 3.34Å; N196-D231 WeakPolarHBondContact CB-OD2 3.44Å; T197-D231 HydrophobicContact CG2-CB 4.17Å; T197-D231 PolarHBondContact N-OD2 2.72Å; L227-D231 WeakPolarHBondContact O-CB 3.44Å; L227-D231 VanDerWaalsContact O-CG 3.31Å; L227-D231 PolarHBondContact O-N 2.83Å
232	Y	92.1	Very high	92.8	Very high	37 Å²	37	56.7 Å²	56.7	15%	0.145	32%	0.322	C	S	.	.	S	Bend	trans	-117.2	108.1	176.9	-61.6	-87.4	0	0	0	110.2	T197 Y228 T230 E237 A240 R241	T197-Y232 HydrophobicContact CG2-CD2 4.44Å; T197-Y232 HydrophobicContact CG2-CE2 3.89Å; T197-Y232 WeakPolarHBondContact OG1-CE2 3.5Å; Y228-Y232 HydrophobicContact CD1-CD2 4.06Å; Y228-Y232 AromaticContact CD1-CE2 3.81Å; Y228-Y232 HydrophobicContact CD1-CE2 3.81Å; Y228-Y232 HydrophobicContact CE1-CE2 4.15Å; T230-Y232 VanDerWaalsContact C-N 3.31Å; T230-Y232 PolarHBondContact O-N 2.83Å; Y232-E237 VanDerWaalsContact CA-OE2 3.28Å; Y232-E237 WeakPolarHBondContact CA-OE2 3.4Å; Y232-E237 HydrophobicContact CD1-CB 4.4Å; Y232-A240 HydrophobicContact CE1-CB 4.31Å; Y232-R241 HydrophobicContact CD1-CB 3.88Å; Y232-R241 HydrophobicContact CD2-CB 4.01Å; Y232-R241 HydrophobicContact CD2-CG 3.75Å; Y232-R241 HydrophobicContact CE1-CB 4.46Å; Y232-R241 HydrophobicContact CE2-CG 4.4Å; Y232-R241 HydrophobicContact CG-CB 3.62Å; Y232-R241 HydrophobicContact CG-CG 3.81Å
233	S	87.4	Confident	92.6	Very high	80 Å²	80	63.1 Å²	63.1	56%	0.559	35%	0.353	S	S	*	.			trans	-111.2	134.7	-169.9	-77.2	0	0	0	0	112.7	T230 E237	T230-S233 PolarHBondContact O-OG 2.86Å; S233-E237 PolarHBondContact N-OE2 3.31Å
234	G	86	Confident	92.7	Very high	64 Å²	64	64.2 Å²	64.2	66%	0.66	36%	0.359	S	S	*	.	S	Bend	trans	77.7	178.7	177.2	0	0	0	0	0	114.7
235	R	87.2	Confident	92.7	Very high	239 Å²	239	64.4 Å²	64.4	90%	0.902	36%	0.36	S	S	*	.	S	Bend	trans	-75.9	-25.8	-174.6	-68.3	-174.3	179.7	-175.5	0.3	113.6	E237 L238	R235-E237 VanDerWaalsContact C-N 3.3Å; R235-E237 PolarHBondContact O-N 2.91Å; R235-L238 WeakPolarHBondContact O-CB 3.09Å; R235-L238 PolarHBondContact O-N 3.37Å
236	G	92.8	Very high	92.8	Very high	73 Å²	73	66.1 Å²	66.1	75%	0.753	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.5	-28	-177	0	0	0	0	0	113.9
237	E	93.5	Very high	92.8	Very high	88 Å²	88	72.8 Å²	72.8	41%	0.411	40%	0.395	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.5	3	-176.9	-62.9	-179	178.3	0	0	113.2	Y232 S233 R235 S239 A240 R241	Y232-E237 VanDerWaalsContact CA-OE2 3.28Å; Y232-E237 WeakPolarHBondContact CA-OE2 3.4Å; Y232-E237 HydrophobicContact CD1-CB 4.4Å; S233-E237 PolarHBondContact N-OE2 3.31Å; R235-E237 VanDerWaalsContact C-N 3.3Å; R235-E237 PolarHBondContact O-N 2.91Å; E237-S239 VanDerWaalsContact C-N 3.3Å; E237-S239 PolarHBondContact O-N 3.06Å; E237-A240 PolarHBondContact O-N 2.86Å; E237-R241 WeakPolarHBondContact O-CB 3.33Å; E237-R241 PolarHBondContact O-N 2.96Å
238	L	90.6	Very high	92.9	Very high	78 Å²	78	72.1 Å²	72.1	41%	0.408	39%	0.392	S	S	.	.	H	α-helix	trans	-58.7	-41.2	-176.5	178.6	60.5	0	0	0	112.2	R235 Q242	R235-L238 WeakPolarHBondContact O-CB 3.09Å; R235-L238 PolarHBondContact O-N 3.37Å; L238-Q242 HydrophobicContact CD1-CG 3.96Å; L238-Q242 HydrophobicContact CG-CG 4.35Å; L238-Q242 VanDerWaalsContact O-CB 3.3Å; L238-Q242 WeakPolarHBondContact O-CB 3.41Å; L238-Q242 WeakPolarHBondContact O-CG 3.4Å; L238-Q242 PolarHBondContact O-N 2.82Å
239	S	93.3	Very high	93.1	Very high	77 Å²	77	71.9 Å²	71.9	54%	0.538	39%	0.391	S	S	.	.	H	α-helix	trans	-64.8	-47.3	179.4	54.5	0	0	0	0	111.9	E237 R241 Q242 M243	E237-S239 VanDerWaalsContact C-N 3.3Å; E237-S239 PolarHBondContact O-N 3.06Å; S239-R241 PolarHBondContact O-N 2.82Å; S239-Q242 PolarHBondContact O-N 3.01Å; S239-M243 WeakPolarHBondContact O-CG 3.39Å; S239-M243 PolarHBondContact O-N 3.16Å
240	A	94.9	Very high	93.4	Very high	49 Å²	49	73.7 Å²	73.7	41%	0.405	40%	0.398	S	S	.	.	H	α-helix	trans	-61	-45.9	178	0	0	0	0	0	111.2	Y232 E237 Q242 M243 H244	Y232-A240 HydrophobicContact CE1-CB 4.31Å; E237-A240 PolarHBondContact O-N 2.86Å; A240-Q242 VanDerWaalsContact C-N 3.34Å; A240-Q242 PolarHBondContact O-N 3.33Å; A240-M243 PolarHBondContact O-N 3.45Å; A240-H244 WeakPolarHBondContact O-CB 3.4Å; A240-H244 PolarHBondContact O-N 2.98Å
241	R	94.9	Very high	93.8	Very high	59 Å²	59	70.6 Å²	70.6	22%	0.223	38%	0.378	C	S	.	.	H	α-helix	trans	-55.3	-48.1	174.1	-173.8	-179	70.8	179.3	8.2	112.3	Y228 Y232 E237 S239 H244 L245	Y228-R241 HydrophobicContact CD1-CG 3.94Å; Y228-R241 WeakPolarHBondContact O-CD 3.46Å; Y232-R241 HydrophobicContact CD1-CB 3.88Å; Y232-R241 HydrophobicContact CD2-CB 4.01Å; Y232-R241 HydrophobicContact CD2-CG 3.75Å; Y232-R241 HydrophobicContact CE1-CB 4.46Å; Y232-R241 HydrophobicContact CE2-CG 4.4Å; Y232-R241 HydrophobicContact CG-CB 3.62Å; Y232-R241 HydrophobicContact CG-CG 3.81Å; E237-R241 WeakPolarHBondContact O-CB 3.33Å; E237-R241 PolarHBondContact O-N 2.96Å; S239-R241 PolarHBondContact O-N 2.82Å; R241-H244 PolarHBondContact O-N 3.13Å; R241-L245 VanDerWaalsContact O-CB 3.31Å; R241-L245 WeakPolarHBondContact O-CB 3.48Å; R241-L245 PolarHBondContact O-N 3.41Å
242	Q	94.3	Very high	94	Very high	36 Å²	36	67.6 Å²	67.6	17%	0.168	36%	0.361	C	S	.	.	H	α-helix	trans	-67.9	-39.8	-177.6	-73.5	-72.4	-59.3	0	0	111.7	L238 S239 A240 A246 G288 I291	L238-Q242 HydrophobicContact CD1-CG 3.96Å; L238-Q242 HydrophobicContact CG-CG 4.35Å; L238-Q242 VanDerWaalsContact O-CB 3.3Å; L238-Q242 WeakPolarHBondContact O-CB 3.41Å; L238-Q242 WeakPolarHBondContact O-CG 3.4Å; L238-Q242 PolarHBondContact O-N 2.82Å; S239-Q242 PolarHBondContact O-N 3.01Å; A240-Q242 VanDerWaalsContact C-N 3.34Å; A240-Q242 PolarHBondContact O-N 3.33Å; Q242-A246 VanDerWaalsContact O-CB 3.32Å; Q242-A246 WeakPolarHBondContact O-CB 3.39Å; Q242-A246 PolarHBondContact O-N 3Å; Q242-G288 PolarHBondContact NE2-O 2.81Å; Q242-G288 PolarHBondContact OE1-O 2.83Å; Q242-I291 HydrophobicContact CB-CD1 3.6Å; Q242-I291 HydrophobicContact CG-CD1 4.23Å; Q242-I291 VanDerWaalsContact O-CD1 3.3Å; Q242-I291 WeakPolarHBondContact O-CD1 3.21Å; Q242-I291 VanDerWaalsContact OE1-CG1 3.25Å
243	M	95.5	Very high	94.2	Very high	136 Å²	136	68.8 Å²	68.8	67%	0.67	37%	0.37	S	S	*	.	H	α-helix	trans	-64.4	-42.7	173.7	-73.2	-176.6	-179.8	0	0	112.2	S239 A240 A246 R247	S239-M243 WeakPolarHBondContact O-CG 3.39Å; S239-M243 PolarHBondContact O-N 3.16Å; A240-M243 PolarHBondContact O-N 3.45Å; M243-A246 PolarHBondContact O-N 2.74Å; M243-R247 WeakPolarHBondContact O-CG 3.36Å; M243-R247 PolarHBondContact O-N 3.44Å; M243-R247 VanDerWaalsContact O-N 3.15Å
244	H	97.3	Very high	94.6	Very high	24 Å²	24	67.2 Å²	67.2	11%	0.111	35%	0.352	C	S	.	.	H	α-helix	trans	-65.8	-46.8	178.3	-168.8	-81.5	0	0	0	111.4	T197 D198 T201 Y228 A240 R241 A246 R247 F248	T197-H244 PolarHBondContact O-CE1 3.23Å; D198-H244 IonicContact OD1-NE2 2.91Å; D198-H244 PolarHBondContact OD1-NE2 3.43Å; T201-H244 PolarHBondContact OG1-CE1 2.9Å; Y228-H244 HydrophobicContact CE1-CB 4.2Å; Y228-H244 AromaticContact CE1-ND1 3.36Å; Y228-H244 WeakPolarHBondContact CE1-ND1 3.43Å; Y228-H244 AromaticContact CZ-ND1 3.49Å; Y228-H244 PolarHBondContact OH-CE1 2.99Å; Y228-H244 PolarHBondContact OH-ND1 2.94Å; A240-H244 WeakPolarHBondContact O-CB 3.4Å; A240-H244 PolarHBondContact O-N 2.98Å; R241-H244 PolarHBondContact O-N 3.13Å; H244-A246 VanDerWaalsContact C-N 3.33Å; H244-A246 PolarHBondContact O-N 2.54Å; H244-R247 WeakPolarHBondContact O-CB 3.24Å; H244-R247 PolarHBondContact O-N 2.77Å; H244-F248 PolarHBondContact O-N 3.29Å
245	L	96.8	Very high	95.1	Very high	4 Å²	4	64.5 Å²	64.5	2%	0.021	32%	0.322	C	S	.	.	H	α-helix	trans	-59.5	-41.3	175.5	-179.5	62.2	0	0	0	112.1	Y228 R241 R247 F248 L249	Y228-L245 HydrophobicContact CD1-CB 4.3Å; Y228-L245 HydrophobicContact CD2-CD1 4.26Å; Y228-L245 HydrophobicContact CE1-CB 3.91Å; Y228-L245 HydrophobicContact CE1-CD1 4.44Å; Y228-L245 HydrophobicContact CE2-CD1 3.94Å; R241-L245 VanDerWaalsContact O-CB 3.31Å; R241-L245 WeakPolarHBondContact O-CB 3.48Å; R241-L245 PolarHBondContact O-N 3.41Å; L245-R247 VanDerWaalsContact C-N 3.32Å; L245-R247 PolarHBondContact O-N 2.98Å; L245-F248 HydrophobicContact CD1-CD1 4.44Å; L245-F248 PolarHBondContact O-N 2.9Å; L245-L249 HydrophobicContact CD1-CD1 4.04Å; L245-L249 HydrophobicContact CD1-CG 4.08Å; L245-L249 HydrophobicContact CD2-CD1 4.5Å; L245-L249 HydrophobicContact CG-CD1 3.85Å; L245-L249 HydrophobicContact CG-CG 4.34Å; L245-L249 WeakPolarHBondContact O-CB 3.32Å; L245-L249 VanDerWaalsContact O-CG 3.32Å; L245-L249 WeakPolarHBondContact O-CG 3.32Å; L245-L249 PolarHBondContact O-N 2.87Å
246	A	96.6	Very high	95.5	Very high	37 Å²	37	53.1 Å²	53.1	31%	0.306	28%	0.279	S	S	.	.	H	α-helix	trans	-60.8	-41.1	176.6	0	0	0	0	0	112.4	Q242 M243 H244 R250 I291	Q242-A246 VanDerWaalsContact O-CB 3.32Å; Q242-A246 WeakPolarHBondContact O-CB 3.39Å; Q242-A246 PolarHBondContact O-N 3Å; M243-A246 PolarHBondContact O-N 2.74Å; H244-A246 VanDerWaalsContact C-N 3.33Å; H244-A246 PolarHBondContact O-N 2.54Å; A246-R250 WeakPolarHBondContact O-CB 3.49Å; A246-R250 PolarHBondContact O-N 3.43Å; A246-I291 HydrophobicContact CB-CD1 4.23Å; A246-I291 HydrophobicContact CB-CG2 3.74Å
247	R	95.8	Very high	95.5	Very high	155 Å²	155	53.8 Å²	53.8	59%	0.585	27%	0.265	S	S	*	.	H	α-helix	trans	-64.7	-45.5	175.5	-72.3	175.2	61.1	-160.2	-4	111.4	M243 H244 L245 R250 M251	M243-R247 WeakPolarHBondContact O-CG 3.36Å; M243-R247 PolarHBondContact O-N 3.44Å; M243-R247 VanDerWaalsContact O-N 3.15Å; H244-R247 WeakPolarHBondContact O-CB 3.24Å; H244-R247 PolarHBondContact O-N 2.77Å; L245-R247 VanDerWaalsContact C-N 3.32Å; L245-R247 PolarHBondContact O-N 2.98Å; R247-R250 PolarHBondContact O-N 3.17Å; R247-M251 WeakPolarHBondContact O-CG 3.24Å; R247-M251 PolarHBondContact O-N 3.39Å
248	F	97.8	Very high	95.5	Very high	0 Å²	0	50 Å²	50	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-58.9	-49.2	177.6	176.8	-102.4	0	0	0	112	Q200 L204 V221 A224 Y228 H244 L245 R250 M251 L252	Q200-F248 HydrophobicContact CG-CE2 3.72Å; Q200-F248 HydrophobicContact CG-CZ 3.88Å; L204-F248 HydrophobicContact CD1-CD2 3.64Å; L204-F248 HydrophobicContact CD1-CE2 3.43Å; L204-F248 VanDerWaalsContact CD1-CE2 3.43Å; L204-F248 HydrophobicContact CD1-CZ 4.22Å; L204-F248 HydrophobicContact CD2-CE2 4.3Å; L204-F248 HydrophobicContact CG-CD2 4.38Å; L204-F248 HydrophobicContact CG-CE2 3.84Å; V221-F248 HydrophobicContact CG1-CE1 4.49Å; V221-F248 HydrophobicContact CG1-CZ 4.06Å; V221-F248 HydrophobicContact CG2-CZ 4.32Å; A224-F248 HydrophobicContact CB-CE1 4.42Å; Y228-F248 WeakPolarHBondContact OH-CB 3.36Å; H244-F248 PolarHBondContact O-N 3.29Å; L245-F248 HydrophobicContact CD1-CD1 4.44Å; L245-F248 PolarHBondContact O-N 2.9Å; F248-R250 VanDerWaalsContact C-N 3.32Å; F248-R250 PolarHBondContact O-N 3.15Å; F248-M251 WeakPolarHBondContact O-CB 3.32Å; F248-M251 PolarHBondContact O-N 3.46Å; F248-M251 VanDerWaalsContact O-N 3.14Å; F248-L252 HydrophobicContact CD1-CD1 4.21Å; F248-L252 HydrophobicContact CE1-CD1 3.61Å; F248-L252 HydrophobicContact CE1-CG 4.23Å; F248-L252 HydrophobicContact CZ-CD1 3.99Å; F248-L252 HydrophobicContact CZ-CD2 4.42Å; F248-L252 HydrophobicContact CZ-CG 4.27Å; F248-L252 PolarHBondContact O-N 2.92Å
249	L	97.6	Very high	95.7	Very high	2 Å²	2	47.4 Å²	47.4	1%	0.01	23%	0.233	C	C	.	.	H	α-helix	trans	-64.4	-35.4	178.2	-67.9	168.5	0	0	0	112.4	L245 M251 L252 L253 I265 I291 I292 A295	L245-L249 HydrophobicContact CD1-CD1 4.04Å; L245-L249 HydrophobicContact CD1-CG 4.08Å; L245-L249 HydrophobicContact CD2-CD1 4.5Å; L245-L249 HydrophobicContact CG-CD1 3.85Å; L245-L249 HydrophobicContact CG-CG 4.34Å; L245-L249 WeakPolarHBondContact O-CB 3.32Å; L245-L249 VanDerWaalsContact O-CG 3.32Å; L245-L249 WeakPolarHBondContact O-CG 3.32Å; L245-L249 PolarHBondContact O-N 2.87Å; L249-M251 VanDerWaalsContact C-N 3.34Å; L249-L252 HydrophobicContact CD2-CD1 4.32Å; L249-L252 PolarHBondContact O-N 3.43Å; L249-L253 PolarHBondContact O-N 2.85Å; L249-I265 HydrophobicContact CD2-CD1 4.05Å; L249-I291 HydrophobicContact CD1-CG2 3.97Å; L249-I292 HydrophobicContact CD1-CB 4.04Å; L249-I292 HydrophobicContact CD1-CG1 4.08Å; L249-I292 HydrophobicContact CD2-CG1 4.24Å; L249-A295 HydrophobicContact CB-CB 3.87Å; L249-A295 HydrophobicContact CD1-CB 3.94Å; L249-A295 HydrophobicContact CG-CB 4.35Å
250	R	95.9	Very high	95.8	Very high	155 Å²	155	45.6 Å²	45.6	59%	0.585	23%	0.227	S	C	*	.	H	α-helix	trans	-66.1	-35.6	173.9	-175.4	172.3	-178.9	171.8	0.4	112.4	A246 R247 F248 L253 R254	A246-R250 WeakPolarHBondContact O-CB 3.49Å; A246-R250 PolarHBondContact O-N 3.43Å; R247-R250 PolarHBondContact O-N 3.17Å; F248-R250 VanDerWaalsContact C-N 3.32Å; F248-R250 PolarHBondContact O-N 3.15Å; R250-L253 PolarHBondContact O-N 3.46Å; R250-R254 WeakPolarHBondContact O-CB 3.26Å; R250-R254 PolarHBondContact O-N 2.87Å
251	M	96.4	Very high	95.9	Very high	26 Å²	26	43.3 Å²	43.3	13%	0.128	21%	0.208	C	C	.	.	H	α-helix	trans	-67.1	-40.7	173.9	-71.1	175.9	68.5	0	0	111.4	T201 L204 Y205 R247 F248 L249 L253 R254 L255	T201-M251 HydrophobicContact CG2-CE 4.19Å; T201-M251 HydrophobicContact CG2-SD 3.63Å; L204-M251 HydrophobicContact CB-CE 3.88Å; L204-M251 HydrophobicContact CD1-CB 3.74Å; L204-M251 HydrophobicContact CD1-CE 4.47Å; Y205-M251 HydrophobicContact CD1-CE 4.26Å; Y205-M251 HydrophobicContact CD2-CE 3.87Å; Y205-M251 HydrophobicContact CE1-CE 3.93Å; Y205-M251 HydrophobicContact CE2-CE 3.52Å; Y205-M251 HydrophobicContact CE2-SD 4.4Å; Y205-M251 HydrophobicContact CG-CE 4.25Å; R247-M251 WeakPolarHBondContact O-CG 3.24Å; R247-M251 PolarHBondContact O-N 3.39Å; F248-M251 WeakPolarHBondContact O-CB 3.32Å; F248-M251 PolarHBondContact O-N 3.46Å; F248-M251 VanDerWaalsContact O-N 3.14Å; L249-M251 VanDerWaalsContact C-N 3.34Å; M251-L253 VanDerWaalsContact C-N 3.35Å; M251-L253 PolarHBondContact O-N 2.93Å; M251-R254 WeakPolarHBondContact O-CB 3.5Å; M251-R254 PolarHBondContact O-N 3.07Å; M251-L255 WeakPolarHBondContact O-CG 3.01Å; M251-L255 PolarHBondContact O-N 3.5Å
252	L	98	Very high	96.1	Very high	0 Å²	0	40.5 Å²	40.5	0%	0	20%	0.197	C	C	.	.	H	α-helix	trans	-59.5	-44.6	173.1	-71.5	-179.6	0	0	0	112.3	I122 L204 L219 V221 F248 L249 R254 L255 A256 V263 I265	I122-L252 HydrophobicContact CD1-CB 3.95Å; L204-L252 HydrophobicContact CD1-CD2 3.81Å; L204-L252 HydrophobicContact CD1-CG 4.04Å; L204-L252 HydrophobicContact CD2-CD2 3.65Å; L204-L252 HydrophobicContact CG-CD2 4.41Å; L219-L252 HydrophobicContact CD2-CD2 3.66Å; V221-L252 HydrophobicContact CG2-CD1 4.4Å; V221-L252 HydrophobicContact CG2-CD2 4.11Å; F248-L252 HydrophobicContact CD1-CD1 4.21Å; F248-L252 HydrophobicContact CE1-CD1 3.61Å; F248-L252 HydrophobicContact CE1-CG 4.23Å; F248-L252 HydrophobicContact CZ-CD1 3.99Å; F248-L252 HydrophobicContact CZ-CD2 4.42Å; F248-L252 HydrophobicContact CZ-CG 4.27Å; F248-L252 PolarHBondContact O-N 2.92Å; L249-L252 HydrophobicContact CD2-CD1 4.32Å; L249-L252 PolarHBondContact O-N 3.43Å; L252-R254 VanDerWaalsContact C-N 3.33Å; L252-R254 PolarHBondContact O-N 2.94Å; L252-L255 PolarHBondContact O-N 3.12Å; L252-A256 PolarHBondContact O-N 3.41Å; L252-V263 HydrophobicContact CB-CG1 4.28Å; L252-V263 HydrophobicContact CD1-CG1 4.27Å; L252-V263 HydrophobicContact CD2-CG1 4.2Å; L252-V263 HydrophobicContact CG-CG1 4.5Å; L252-I265 HydrophobicContact CD1-CG2 3.77Å
253	L	96.4	Very high	96.3	Very high	63 Å²	63	38.8 Å²	38.8	33%	0.33	19%	0.189	S	C	.	.	H	α-helix	trans	-62.6	-42.7	177.2	-177.1	61.8	0	0	0	111.1	I122 L249 R250 M251 L255 A256 D257	I122-L253 HydrophobicContact CD1-CB 4.04Å; L249-L253 PolarHBondContact O-N 2.85Å; R250-L253 PolarHBondContact O-N 3.46Å; M251-L253 VanDerWaalsContact C-N 3.35Å; M251-L253 PolarHBondContact O-N 2.93Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-L255 PolarHBondContact O-N 3.47Å; L253-A256 WeakPolarHBondContact O-CB 3.13Å; L253-A256 PolarHBondContact O-N 2.83Å; L253-A256 VanDerWaalsContact O-N 3.12Å; L253-D257 PolarHBondContact O-N 3.36Å
254	R	94.6	Very high	96.5	Very high	47 Å²	47	32.3 Å²	32.3	18%	0.177	16%	0.157	C	C	.	.	H	α-helix	trans	-57.2	-45.8	174.6	-175.3	-174.8	-66.5	177.6	-5.5	111.6	E59 R250 M251 L252 A256 D257 E258	E59-R254 IonicContact OE1-CZ 3.59Å; E59-R254 IonicContact OE1-NH1 2.77Å; E59-R254 PolarHBondContact OE1-NH1 3.42Å; E59-R254 IonicContact OE1-NH2 3.74Å; E59-R254 PolarHBondContact OE1-NH2 3.36Å; E59-R254 IonicContact OE2-CZ 2.81Å; E59-R254 IonicContact OE2-NH1 2.7Å; E59-R254 IonicContact OE2-NH2 2.71Å; E59-R254 PolarHBondContact OE2-NH2 2.86Å; R250-R254 WeakPolarHBondContact O-CB 3.26Å; R250-R254 PolarHBondContact O-N 2.87Å; M251-R254 WeakPolarHBondContact O-CB 3.5Å; M251-R254 PolarHBondContact O-N 3.07Å; L252-R254 VanDerWaalsContact C-N 3.33Å; L252-R254 PolarHBondContact O-N 2.94Å; R254-A256 VanDerWaalsContact C-N 3.29Å; R254-A256 PolarHBondContact O-N 2.88Å; R254-D257 PolarHBondContact O-N 2.83Å; R254-E258 WeakPolarHBondContact O-CB 3.39Å; R254-E258 PolarHBondContact O-N 2.96Å
255	L	96.6	Very high	96.6	Very high	7 Å²	7	31.1 Å²	31.1	4%	0.037	15%	0.152	C	C	.	.	H	α-helix	trans	-61.6	-38.4	176.8	-68.2	175	0	0	0	112.1	L204 A207 M211 L219 M251 L252 L253 F259	L204-L255 HydrophobicContact CB-CD1 4.29Å; L204-L255 HydrophobicContact CD2-CD1 4.08Å; A207-L255 HydrophobicContact CB-CD1 4.41Å; M211-L255 HydrophobicContact SD-CD2 4.43Å; L219-L255 HydrophobicContact CD2-CD1 3.85Å; M251-L255 WeakPolarHBondContact O-CG 3.01Å; M251-L255 PolarHBondContact O-N 3.5Å; L252-L255 PolarHBondContact O-N 3.12Å; L253-L255 VanDerWaalsContact C-N 3.34Å; L253-L255 PolarHBondContact O-N 3.47Å; L255-F259 HydrophobicContact CD2-CD2 4Å; L255-F259 HydrophobicContact CD2-CE2 3.78Å; L255-F259 PolarHBondContact O-N 3.32Å
256	A	96.4	Very high	96.6	Very high	0 Å²	0	31 Å²	31	0%	0	15%	0.151	C	C	.	.	H	α-helix	trans	-64.2	-46.2	176.2	0	0	0	0	0	111.7	L252 L253 R254 G260 V263	L252-A256 PolarHBondContact O-N 3.41Å; L253-A256 WeakPolarHBondContact O-CB 3.13Å; L253-A256 PolarHBondContact O-N 2.83Å; L253-A256 VanDerWaalsContact O-N 3.12Å; R254-A256 VanDerWaalsContact C-N 3.29Å; R254-A256 PolarHBondContact O-N 2.88Å; A256-G260 WeakPolarHBondContact O-CA 3.01Å; A256-G260 PolarHBondContact O-N 2.89Å; A256-V263 HydrophobicContact CB-CG2 3.85Å
257	D	92.4	Very high	96.6	Very high	86 Å²	86	29.2 Å²	29.2	46%	0.46	14%	0.137	S	C	.	.	H	α-helix	trans	-69.7	-35.7	179.7	-66.2	-28.7	0	0	0	112.6	Y54 L253 R254	Y54-D257 HydrophobicContact CE2-CB 4.18Å; L253-D257 PolarHBondContact O-N 3.36Å; R254-D257 PolarHBondContact O-N 2.83Å
258	E	93	Very high	96.5	Very high	10 Å²	10	23.7 Å²	23.7	5%	0.047	12%	0.117	C	C	.	.	H	α-helix	trans	-75.9	-52.7	-176.7	-179	177.2	173.7	0	0	111.8	P22 T48 E50 R254	P22-E258 WeakPolarHBondContact CB-O 3.28Å; T48-E258 VanDerWaalsContact CB-OE1 3.3Å; T48-E258 WeakPolarHBondContact CB-OE1 3.49Å; T48-E258 HydrophobicContact CG2-CG 3.88Å; T48-E258 WeakPolarHBondContact CG2-OE1 3.38Å; T48-E258 WeakPolarHBondContact OG1-CG 3.5Å; T48-E258 PolarHBondContact OG1-OE1 3.34Å; E50-E258 HydrophobicContact CB-CG 4.46Å; R254-E258 WeakPolarHBondContact O-CB 3.39Å; R254-E258 PolarHBondContact O-N 2.96Å
259	F	95.3	Very high	96.2	Very high	22 Å²	22	24.8 Å²	24.8	10%	0.096	12%	0.124	C	C	.	.	H	α-helix	trans	-99.4	-5.1	-173.7	-61.5	-80.2	0	0	0	113.3	P22 T48 S208 M211 A212 L255 V261	P22-F259 HydrophobicContact CB-CD1 4.47Å; P22-F259 HydrophobicContact CG-CD1 3.58Å; P22-F259 HydrophobicContact CG-CE1 3.95Å; P22-F259 HydrophobicContact CG-CG 4.48Å; T48-F259 HydrophobicContact CG2-CE1 3.81Å; T48-F259 HydrophobicContact CG2-CZ 3.87Å; S208-F259 WeakPolarHBondContact O-CZ 3.45Å; M211-F259 VanDerWaalsContact C-CE1 3.43Å; M211-F259 HydrophobicContact CB-CB 4.44Å; M211-F259 HydrophobicContact CB-CD1 3.46Å; M211-F259 VanDerWaalsContact CB-CD1 3.46Å; M211-F259 HydrophobicContact CB-CD2 3.91Å; M211-F259 HydrophobicContact CB-CE1 3.58Å; M211-F259 HydrophobicContact CB-CE2 3.99Å; M211-F259 HydrophobicContact CB-CG 3.66Å; M211-F259 HydrophobicContact CB-CZ 3.84Å; M211-F259 HydrophobicContact CG-CD2 4.49Å; M211-F259 HydrophobicContact CG-CG 4.39Å; M211-F259 HydrophobicContact SD-CB 4.21Å; M211-F259 HydrophobicContact SD-CD2 3.76Å; M211-F259 HydrophobicContact SD-CE2 4.35Å; M211-F259 HydrophobicContact SD-CG 3.99Å; A212-F259 HydrophobicContact CB-CE1 4.26Å; L255-F259 HydrophobicContact CD2-CD2 4Å; L255-F259 HydrophobicContact CD2-CE2 3.78Å; L255-F259 PolarHBondContact O-N 3.32Å; F259-V261 HydrophobicContact CB-CG1 3.94Å; F259-V261 PolarHBondContact O-N 3.08Å
260	G	95.3	Very high	95.6	Very high	40 Å²	40	27.5 Å²	27.5	41%	0.412	14%	0.141	S	C	.	.			trans	64.3	26.3	-176.1	0	0	0	0	0	113	T119 A256	T119-G260 WeakPolarHBondContact CB-O 3.36Å; A256-G260 WeakPolarHBondContact O-CA 3.01Å; A256-G260 PolarHBondContact O-N 2.89Å
261	V	97.8	Very high	94.9	Very high	0 Å²	0	23.5 Å²	23.5	0%	0	14%	0.141	C	C	.	.			trans	-82.4	148.3	-179.6	-64.8	0	0	0	0	111.5	G120 M211 Y216 F259 V263	G120-V261 PolarHBondContact N-O 3Å; M211-V261 HydrophobicContact CE-CG1 4.32Å; M211-V261 HydrophobicContact CE-CG2 4.26Å; M211-V261 HydrophobicContact SD-CG1 4.24Å; M211-V261 HydrophobicContact SD-CG2 4.36Å; Y216-V261 WeakPolarHBondContact O-CG1 3.36Å; F259-V261 HydrophobicContact CB-CG1 3.94Å; F259-V261 PolarHBondContact O-N 3.08Å; V261-V263 HydrophobicContact CG2-CG2 4.2Å
262	A	98.7	Very high	93.7	Very high	0 Å²	0	24.6 Å²	24.6	0%	0	15%	0.145	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-72	131.3	164.1	0	0	0	0	0	109.5	I102 I117 T119 A217 L218 L219	I102-A262 HydrophobicContact CD1-CB 3.91Å; I117-A262 HydrophobicContact CG2-CB 4.09Å; T119-A262 HydrophobicContact CG2-CB 4.03Å; A217-A262 PolarHBondContact O-N 3.08Å; L218-A262 CarbonylContact C-O 3.56Å; L218-A262 WeakPolarHBondContact CA-O 3.45Å; L218-A262 HydrophobicContact CD1-CB 3.84Å; L219-A262 PolarHBondContact N-O 2.75Å
263	V	98.9	Very high	92.1	Very high	0 Å²	0	31.7 Å²	31.7	0%	0	19%	0.189	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110	119.1	173.9	-179.5	0	0	0	0	109.3	S121 I122 T123 L219 L252 A256 V261 I265	S121-V263 PolarHBondContact O-N 2.93Å; I122-V263 CarbonylContact C-O 3.56Å; I122-V263 WeakPolarHBondContact CA-O 3.27Å; I122-V263 HydrophobicContact CG1-CB 4.08Å; I122-V263 HydrophobicContact CG1-CG1 4.21Å; I122-V263 HydrophobicContact CG2-CG1 4.47Å; T123-V263 PolarHBondContact N-O 2.92Å; L219-V263 HydrophobicContact CB-CG2 4.41Å; L219-V263 HydrophobicContact CD2-CG2 4.45Å; L219-V263 CarbonylContact O-C 3.54Å; L219-V263 WeakPolarHBondContact O-CA 3.45Å; L252-V263 HydrophobicContact CB-CG1 4.28Å; L252-V263 HydrophobicContact CD1-CG1 4.27Å; L252-V263 HydrophobicContact CD2-CG1 4.2Å; L252-V263 HydrophobicContact CG-CG1 4.5Å; A256-V263 HydrophobicContact CB-CG2 3.85Å; V261-V263 HydrophobicContact CG2-CG2 4.2Å; V263-I265 HydrophobicContact CG1-CG2 4.09Å
264	V	98.9	Very high	90.8	Very high	0 Å²	0	32.3 Å²	32.3	0%	0	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-114.8	118.2	177	178.5	0	0	0	0	109.4	I117 T123 L125 L140 L218 L219 I220 V221	I117-V264 HydrophobicContact CG2-CG2 3.79Å; T123-V264 WeakPolarHBondContact O-CA 3.42Å; L125-V264 HydrophobicContact CD1-CG1 3.71Å; L125-V264 HydrophobicContact CG-CG1 3.97Å; L140-V264 HydrophobicContact CD1-CG1 4.47Å; L140-V264 HydrophobicContact CD1-CG2 4.19Å; L218-V264 HydrophobicContact CD1-CB 4.42Å; L218-V264 HydrophobicContact CD1-CG2 3.78Å; L219-V264 PolarHBondContact O-N 3.31Å; I220-V264 CarbonylContact C-O 3.45Å; I220-V264 VanDerWaalsContact CA-O 3.3Å; I220-V264 WeakPolarHBondContact CA-O 3.23Å; I220-V264 HydrophobicContact CG1-CB 4.33Å; V221-V264 PolarHBondContact N-O 2.86Å
265	I	98.8	Very high	89.1	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	22%	0.215	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.9	139.6	176.6	64.6	179.3	0	0	0	110.1	I122 T123 E124 L125 V221 A224 L249 L252 V263 I292	I122-I265 HydrophobicContact CG2-CD1 3.82Å; I122-I265 HydrophobicContact CG2-CG1 4.1Å; I122-I265 HydrophobicContact CG2-CG2 4.47Å; T123-I265 PolarHBondContact O-N 3.01Å; E124-I265 WeakPolarHBondContact CA-O 3.43Å; E124-I265 HydrophobicContact CB-CD1 4.27Å; E124-I265 HydrophobicContact CB-CG1 3.95Å; E124-I265 HydrophobicContact CG-CD1 4.35Å; E124-I265 HydrophobicContact CG-CG1 4.1Å; L125-I265 PolarHBondContact N-O 3.25Å; V221-I265 HydrophobicContact CB-CG2 4.13Å; V221-I265 HydrophobicContact CG2-CG2 4.37Å; A224-I265 HydrophobicContact CB-CB 3.91Å; A224-I265 HydrophobicContact CB-CG2 4.24Å; L249-I265 HydrophobicContact CD2-CD1 4.05Å; L252-I265 HydrophobicContact CD1-CG2 3.77Å; V263-I265 HydrophobicContact CG1-CG2 4.09Å; I265-I292 HydrophobicContact CD1-CD1 3.85Å; I265-I292 HydrophobicContact CD1-CG1 4.05Å
266	T	98.5	Very high	87.5	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-100.1	146.3	169.8	80.6	0	0	0	0	110.7	L125 K133 C137 V221 D222 S223 A224	L125-T266 CarbonylContact O-C 3.54Å; L125-T266 VanDerWaalsContact O-CA 3.32Å; L125-T266 WeakPolarHBondContact O-CA 3.43Å; K133-T266 HydrophobicContact CB-CG2 4.08Å; C137-T266 WeakPolarHBondContact SG-CG2 3.37Å; V221-T266 PolarHBondContact O-N 2.92Å; D222-T266 WeakPolarHBondContact CA-OG1 3.47Å; D222-T266 HydrophobicContact CB-CG2 4.11Å; D222-T266 WeakPolarHBondContact OD1-CB 3.48Å; D222-T266 VanDerWaalsContact OD1-CG2 3.24Å; D222-T266 WeakPolarHBondContact OD1-CG2 3.37Å; D222-T266 PolarHBondContact OD1-OG1 3.28Å; S223-T266 WeakPolarHBondContact CA-OG1 3.43Å; S223-T266 WeakPolarHBondContact CB-O 3.31Å; S223-T266 WeakPolarHBondContact CB-OG1 3.46Å; A224-T266 PolarHBondContact N-O 2.83Å
267	N	96.8	Very high	85.7	Confident	0 Å²	0	37 Å²	37	0%	0	25%	0.248	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-135.1	148.7	180	-169.5	4.5	0	0	0	110.9	E124 L125 F126 K133 T225 I287	E124-N267 HydrophobicContact CG-CB 4.13Å; E124-N267 WeakPolarHBondContact OE1-CB 3.37Å; E124-N267 PolarHBondContact OE1-ND2 2.86Å; L125-N267 PolarHBondContact O-N 2.86Å; F126-N267 WeakPolarHBondContact CA-O 3.1Å; F126-N267 HydrophobicContact CB-CB 3.89Å; K133-N267 WeakPolarHBondContact CD-O 3.37Å; K133-N267 WeakPolarHBondContact CE-O 3.48Å; T225-N267 HydrophobicContact CG2-CB 4.41Å; T225-N267 WeakPolarHBondContact CG2-OD1 3.48Å; T225-N267 PolarHBondContact OG1-OD1 2.82Å; N267-I287 PolarHBondContact ND2-O 3.44Å; N267-I287 WeakPolarHBondContact OD1-CB 3.38Å
268	Q	92.1	Very high	84.2	Confident	39 Å²	39	40.9 Å²	40.9	18%	0.182	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.1	156	176.5	-59.4	177.6	-3.8	0	0	109.9	E163 I287	E163-Q268 PolarHBondContact OE1-NE2 3.42Å; Q268-I287 HydrophobicContact CB-CD1 3.84Å; Q268-I287 WeakPolarHBondContact O-CG1 3.21Å; Q268-I287 PolarHBondContact O-N 2.79Å
269	V	91.4	Very high	82.8	Confident	24 Å²	24	49.5 Å²	49.5	15%	0.145	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	150.2	173	-62.7	0	0	0	0	110.8	F126 E128 K284 K285	F126-V269 HydrophobicContact CD2-CG1 3.78Å; E128-V269 HydrophobicContact CB-CG2 4.35Å; E128-V269 HydrophobicContact CG-CG2 3.63Å; V269-K284 HydrophobicContact CB-CB 4.4Å; V269-K284 HydrophobicContact CG2-CD 4.48Å; V269-K285 WeakPolarHBondContact CA-O 3.33Å
270	V	85.3	Confident	81.3	Confident	58 Å²	58	50.5 Å²	50.5	35%	0.352	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	145.4	171.7	-69.3	0	0	0	0	109.9	K284 K285 I287	V270-K284 WeakPolarHBondContact O-CA 3.46Å; V270-K285 PolarHBondContact N-O 2.9Å; V270-K285 PolarHBondContact O-N 3.47Å; V270-I287 HydrophobicContact CG1-CD1 3.71Å; V270-I287 HydrophobicContact CG1-CG1 3.77Å; V270-I287 HydrophobicContact CG2-CG1 4.19Å
271	A	81.1	Confident	79.7	Confident	71 Å²	71	54.1 Å²	54.1	59%	0.587	34%	0.342	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.8	133.6	171.8	0	0	0	0	0	109.8
272	Q	71.9	Confident	78.4	Confident	49 Å²	49	57.3 Å²	57.3	23%	0.229	36%	0.359	C	S	.	.			trans	-73.1	130.1	163.6	-70	-171.1	-86.5	0	0	109.4	D274 A277 P283 K285	Q272-D274 PolarHBondContact NE2-OD2 3.14Å; Q272-A277 HydrophobicContact CB-CB 4.01Å; Q272-A277 WeakPolarHBondContact O-CB 3.49Å; Q272-P283 WeakPolarHBondContact CB-O 3.43Å; Q272-P283 WeakPolarHBondContact CG-O 3.37Å; Q272-P283 PolarHBondContact N-O 3.3Å; Q272-K285 VanDerWaalsContact CD-CD 3.49Å; Q272-K285 VanDerWaalsContact CD-CE 3.43Å; Q272-K285 VanDerWaalsContact CD-NZ 3.33Å; Q272-K285 HydrophobicContact CG-CD 4Å; Q272-K285 HydrophobicContact CG-CG 4.19Å; Q272-K285 VanDerWaalsContact OE1-NZ 3.11Å
273	V	64.5	Low	77.3	Confident	150 Å²	150	59.3 Å²	59.3	91%	0.909	37%	0.372	S	S	*	.			trans	-110.4	19.2	175.9	-92.9	0	0	0	0	111.5
274	D	67.8	Low	76.5	Confident	75 Å²	75	62.3 Å²	62.3	40%	0.401	39%	0.385	S	S	.	.	S	Bend	trans	-83.7	161.9	175.6	60.7	32.3	0	0	0	112.1	Q272 A276 A277	Q272-D274 PolarHBondContact NE2-OD2 3.14Å; D274-A276 PolarHBondContact O-N 3.12Å; D274-A276 VanDerWaalsContact O-N 3.14Å; D274-A276 PolarHBondContact OD1-N 2.83Å; D274-A277 WeakPolarHBondContact O-CB 3.44Å; D274-A277 PolarHBondContact O-N 2.89Å; D274-A277 PolarHBondContact OD1-N 3.24Å
275	G	60	Low	75.9	Confident	64 Å²	64	67.3 Å²	67.3	66%	0.66	41%	0.407	S	S	*	.	G	3₁₀ helix	trans	-63.7	-18	-177.9	0	0	0	0	0	114.4
276	A	62.3	Low	75.5	Confident	71 Å²	71	68.2 Å²	68.2	59%	0.587	41%	0.413	S	S	*	.	G	3₁₀ helix	trans	-78	-24.1	174.9	0	0	0	0	0	112.4	D274 M278 F279	D274-A276 PolarHBondContact O-N 3.12Å; D274-A276 VanDerWaalsContact O-N 3.14Å; D274-A276 PolarHBondContact OD1-N 2.83Å; A276-M278 PolarHBondContact O-N 2.94Å; A276-F279 PolarHBondContact O-N 2.67Å
277	A	60.1	Low	75.1	Confident	18 Å²	18	69.2 Å²	69.2	15%	0.149	42%	0.418	C	S	.	.	G	3₁₀ helix	trans	-62.1	-22.4	177	0	0	0	0	0	113.5	Q272 D274 F279 A280 P283	Q272-A277 HydrophobicContact CB-CB 4.01Å; Q272-A277 WeakPolarHBondContact O-CB 3.49Å; D274-A277 WeakPolarHBondContact O-CB 3.44Å; D274-A277 PolarHBondContact O-N 2.89Å; D274-A277 PolarHBondContact OD1-N 3.24Å; A277-F279 PolarHBondContact O-N 2.7Å; A277-A280 PolarHBondContact O-N 2.99Å; A277-P283 HydrophobicContact CB-CB 3.95Å
278	M	59	Low	74.6	Confident	168 Å²	168	69.5 Å²	69.5	83%	0.828	42%	0.421	S	S	*	.	G	3₁₀ helix	trans	-67.2	-17.4	176.8	-71.9	-132.2	-87.7	0	0	113.9	A276	A276-M278 PolarHBondContact O-N 2.94Å
279	F	65.1	Low	74.4	Confident	190 Å²	190	69.5 Å²	69.5	83%	0.833	43%	0.432	S	S	*	.	G	3₁₀ helix	trans	-116.7	3	179.7	-57.7	-77	0	0	0	113.2	A276 A277	A276-F279 PolarHBondContact O-N 2.67Å; A277-F279 PolarHBondContact O-N 2.7Å
280	A	63.7	Low	74.3	Confident	43 Å²	43	74.3 Å²	74.3	36%	0.355	46%	0.456	S	S	.	.			trans	-88.8	130	178	0	0	0	0	0	110.7	A277 D282	A277-A280 PolarHBondContact O-N 2.99Å; A280-D282 VanDerWaalsContact C-N 3.26Å; A280-D282 PolarHBondContact O-N 3.36Å
281	A	62.2	Low	74.6	Confident	117 Å²	117	74 Å²	74	97%	0.967	45%	0.452	S	S	*	.	S	Bend	trans	-64.4	-28.4	178.9	0	0	0	0	0	113.3
282	D	68.6	Low	75.1	Confident	66 Å²	66	70.6 Å²	70.6	35%	0.353	42%	0.424	S	S	.	.			trans	-137	103.4	168.6	-166.4	-9.1	0	0	0	109	A280 K284 Y301	A280-D282 VanDerWaalsContact C-N 3.26Å; A280-D282 PolarHBondContact O-N 3.36Å; D282-K284 PolarHBondContact O-N 3.09Å; D282-K284 VanDerWaalsContact O-N 3.11Å; D282-K284 WeakPolarHBondContact OD1-CB 3.4Å; D282-K284 WeakPolarHBondContact OD1-CD 3.33Å; D282-K284 WeakPolarHBondContact OD1-CG 3.34Å; D282-K284 PolarHBondContact OD1-N 3.37Å; D282-K284 IonicContact OD1-NZ 3.56Å; D282-Y301 PolarHBondContact OD2-OH 3.15Å
283	P	75.7	Confident	75.9	Confident	42 Å²	42	69.1 Å²	69.1	27%	0.273	42%	0.421	S	S	.	.			trans	-77.1	10.7	-176.1	32.2	-36	0	0	0	113.1	Q272 A277	Q272-P283 WeakPolarHBondContact CB-O 3.43Å; Q272-P283 WeakPolarHBondContact CG-O 3.37Å; Q272-P283 PolarHBondContact N-O 3.3Å; A277-P283 HydrophobicContact CB-CB 3.95Å
284	K	82	Confident	77.1	Confident	64 Å²	64	69.8 Å²	69.8	28%	0.278	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	136.7	-174.8	-62.7	168.8	-162.4	150.1	0	110.9	E128 V269 V270 D282	E128-K284 VanDerWaalsContact CD-CE 3.4Å; E128-K284 HydrophobicContact CG-CD 3.94Å; E128-K284 WeakPolarHBondContact OE1-CE 3.38Å; E128-K284 IonicContact OE1-NZ 2.85Å; E128-K284 PolarHBondContact OE1-NZ 3.21Å; E128-K284 VanDerWaalsContact OE1-NZ 3.14Å; E128-K284 IonicContact OE2-NZ 3.35Å; E128-K284 PolarHBondContact OE2-NZ 3.05Å; V269-K284 HydrophobicContact CB-CB 4.4Å; V269-K284 HydrophobicContact CG2-CD 4.48Å; V270-K284 WeakPolarHBondContact O-CA 3.46Å; D282-K284 PolarHBondContact O-N 3.09Å; D282-K284 VanDerWaalsContact O-N 3.11Å; D282-K284 WeakPolarHBondContact OD1-CB 3.4Å; D282-K284 WeakPolarHBondContact OD1-CD 3.33Å; D282-K284 WeakPolarHBondContact OD1-CG 3.34Å; D282-K284 PolarHBondContact OD1-N 3.37Å; D282-K284 IonicContact OD1-NZ 3.56Å
285	K	87.3	Confident	78.2	Confident	104 Å²	104	67.3 Å²	67.3	45%	0.452	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.3	142.9	173.3	-73.2	-174.2	174.3	162.6	0	111.6	V269 V270 Q272	V269-K285 WeakPolarHBondContact CA-O 3.33Å; V270-K285 PolarHBondContact N-O 2.9Å; V270-K285 PolarHBondContact O-N 3.47Å; Q272-K285 VanDerWaalsContact CD-CD 3.49Å; Q272-K285 VanDerWaalsContact CD-CE 3.43Å; Q272-K285 VanDerWaalsContact CD-NZ 3.33Å; Q272-K285 HydrophobicContact CG-CD 4Å; Q272-K285 HydrophobicContact CG-CG 4.19Å; Q272-K285 VanDerWaalsContact OE1-NZ 3.11Å
286	P	91.2	Very high	79.8	Confident	20 Å²	20	64.5 Å²	64.5	13%	0.13	37%	0.374	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.8	148.4	171.5	25.9	-31.9	0	0	0	111	F126 R299	F126-P286 HydrophobicContact CB-CB 4.21Å; F126-P286 HydrophobicContact CD2-CB 3.84Å; F126-P286 HydrophobicContact CD2-CG 4.19Å; F126-P286 HydrophobicContact CE2-CB 4.34Å; F126-P286 HydrophobicContact CE2-CG 4.18Å; F126-P286 HydrophobicContact CG-CB 3.99Å; P286-R299 VanDerWaalsContact CG-NH2 3.28Å
287	I	89.3	Confident	81.5	Confident	20 Å²	20	63.4 Å²	63.4	10%	0.103	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-74.8	156.4	177.2	-62.2	174.5	0	0	0	109.8	T225 R229 N267 Q268 V270 I292	T225-I287 HydrophobicContact CG2-CG2 4.45Å; R229-I287 VanDerWaalsContact CD-CD1 3.42Å; R229-I287 HydrophobicContact CG-CD1 3.95Å; N267-I287 PolarHBondContact ND2-O 3.44Å; N267-I287 WeakPolarHBondContact OD1-CB 3.38Å; Q268-I287 HydrophobicContact CB-CD1 3.84Å; Q268-I287 WeakPolarHBondContact O-CG1 3.21Å; Q268-I287 PolarHBondContact O-N 2.79Å; V270-I287 HydrophobicContact CG1-CD1 3.71Å; V270-I287 HydrophobicContact CG1-CG1 3.77Å; V270-I287 HydrophobicContact CG2-CG1 4.19Å; I287-I292 WeakPolarHBondContact O-CG2 3.45Å
288	G	85.9	Confident	83.3	Confident	7 Å²	7	63 Å²	63	7%	0.072	36%	0.356	C	S	.	.	T	Hydrogen-bonded Turn	trans	100.2	-18.4	176.4	0	0	0	0	0	114.1	Q242	Q242-G288 PolarHBondContact NE2-O 2.81Å; Q242-G288 PolarHBondContact OE1-O 2.83Å
289	G	88	Confident	85.1	Confident	39 Å²	39	55.8 Å²	55.8	40%	0.402	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.1	-146.4	173.6	0	0	0	0	0	112.8	I291 I292 A293	G289-I291 VanDerWaalsContact C-N 3.25Å; G289-I291 PolarHBondContact O-N 2.84Å; G289-I292 WeakPolarHBondContact O-CG2 3.49Å; G289-A293 PolarHBondContact O-N 3.22Å
290	N	88.6	Confident	86.7	Confident	124 Å²	124	46.9 Å²	46.9	66%	0.663	28%	0.28	S	S	*	.	H	α-helix	trans	-68.3	-24.1	-174	-63.2	-9.6	0	0	0	113.2	A293 H294	N290-A293 PolarHBondContact O-N 3.35Å; N290-H294 PolarHBondContact O-CD2 2.91Å; N290-H294 PolarHBondContact O-N 2.78Å
291	I	92	Very high	88.3	Confident	51 Å²	51	45.9 Å²	45.9	26%	0.262	27%	0.267	S	S	.	.	H	α-helix	trans	-64.8	-48.9	-177.6	-62.5	-171.5	0	0	0	110.9	Q242 A246 L249 G289 A293 A295	Q242-I291 HydrophobicContact CB-CD1 3.6Å; Q242-I291 HydrophobicContact CG-CD1 4.23Å; Q242-I291 VanDerWaalsContact O-CD1 3.3Å; Q242-I291 WeakPolarHBondContact O-CD1 3.21Å; Q242-I291 VanDerWaalsContact OE1-CG1 3.25Å; A246-I291 HydrophobicContact CB-CD1 4.23Å; A246-I291 HydrophobicContact CB-CG2 3.74Å; L249-I291 HydrophobicContact CD1-CG2 3.97Å; G289-I291 VanDerWaalsContact C-N 3.25Å; G289-I291 PolarHBondContact O-N 2.84Å; I291-A293 VanDerWaalsContact C-N 3.33Å; I291-A295 WeakPolarHBondContact O-CB 3.3Å; I291-A295 PolarHBondContact O-N 2.72Å; I291-A295 VanDerWaalsContact O-N 3.16Å
292	I	92.2	Very high	90.1	Very high	0 Å²	0	40.3 Å²	40.3	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-70.6	-33.4	177.1	-159.8	167.6	0	0	0	111.8	T225 L249 I265 I287 G289 H294 A295 S296	T225-I292 HydrophobicContact CG2-CD1 4.12Å; L249-I292 HydrophobicContact CD1-CB 4.04Å; L249-I292 HydrophobicContact CD1-CG1 4.08Å; L249-I292 HydrophobicContact CD2-CG1 4.24Å; I265-I292 HydrophobicContact CD1-CD1 3.85Å; I265-I292 HydrophobicContact CD1-CG1 4.05Å; I287-I292 WeakPolarHBondContact O-CG2 3.45Å; G289-I292 WeakPolarHBondContact O-CG2 3.49Å; I292-H294 VanDerWaalsContact C-N 3.34Å; I292-H294 PolarHBondContact O-N 2.78Å; I292-A295 PolarHBondContact O-N 3.16Å; I292-S296 WeakPolarHBondContact O-CB 3.29Å; I292-S296 PolarHBondContact O-N 3.45Å; I292-S296 PolarHBondContact O-OG 3.34Å
293	A	88.9	Confident	91.4	Very high	19 Å²	19	41.6 Å²	41.6	16%	0.157	22%	0.221	C	C	.	.	H	α-helix	trans	-61.3	-41.5	178.1	0	0	0	0	0	112	G289 N290 I291 R299	G289-A293 PolarHBondContact O-N 3.22Å; N290-A293 PolarHBondContact O-N 3.35Å; I291-A293 VanDerWaalsContact C-N 3.33Å; A293-R299 VanDerWaalsContact CB-NH1 3.28Å
294	H	88.8	Confident	92.3	Very high	163 Å²	163	44.9 Å²	44.9	76%	0.755	23%	0.231	S	C	*	.	H	α-helix	trans	-80.8	-25.9	177.9	-71.8	-58.5	0	0	0	114	N290 I292	N290-H294 PolarHBondContact O-CD2 2.91Å; N290-H294 PolarHBondContact O-N 2.78Å; I292-H294 VanDerWaalsContact C-N 3.34Å; I292-H294 PolarHBondContact O-N 2.78Å
295	A	92.1	Very high	92.9	Very high	24 Å²	24	42.9 Å²	42.9	20%	0.198	23%	0.228	C	C	.	.	H	α-helix	trans	-78.9	-29.3	179.3	0	0	0	0	0	112.9	L249 I291 I292	L249-A295 HydrophobicContact CB-CB 3.87Å; L249-A295 HydrophobicContact CD1-CB 3.94Å; L249-A295 HydrophobicContact CG-CB 4.35Å; I291-A295 WeakPolarHBondContact O-CB 3.3Å; I291-A295 PolarHBondContact O-N 2.72Å; I291-A295 VanDerWaalsContact O-N 3.16Å; I292-A295 PolarHBondContact O-N 3.16Å
296	S	94	Very high	93.1	Very high	5 Å²	5	49 Å²	49	4%	0.035	25%	0.249	C	C	.	.			trans	-86.7	125.1	-178.4	-49.2	0	0	0	0	110	I292	I292-S296 WeakPolarHBondContact O-CB 3.29Å; I292-S296 PolarHBondContact O-N 3.45Å; I292-S296 PolarHBondContact O-OG 3.34Å
297	T	96.1	Very high	93.2	Very high	48 Å²	48	50.3 Å²	50.3	29%	0.294	27%	0.266	S	S	.	.	S	Bend	trans	-73.3	-42.7	179.8	-48.2	0	0	0	0	111.3	I122 P318	I122-T297 PolarHBondContact O-N 3.48Å; T297-P318 HydrophobicContact CG2-CG 3.85Å; T297-P318 WeakPolarHBondContact O-CD 3.21Å
298	T	98.1	Very high	93.5	Very high	10 Å²	10	54.1 Å²	54.1	6%	0.061	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.7	132.2	179.4	-63.1	0	0	0	0	109.4	I122 T123 E124 L300 D316 L320	I122-T298 PolarHBondContact O-N 2.92Å; T123-T298 CarbonylContact C-O 3.6Å; T123-T298 WeakPolarHBondContact CA-O 3.13Å; E124-T298 PolarHBondContact N-O 3.34Å; T298-L300 HydrophobicContact CG2-CD2 3.94Å; T298-L300 HydrophobicContact CG2-CG 4.38Å; T298-D316 CarbonylContact C-O 3.6Å; T298-D316 WeakPolarHBondContact CA-O 3.38Å; T298-L320 HydrophobicContact CG2-CD1 4.47Å
299	R	98.2	Very high	94	Very high	16 Å²	16	54.5 Å²	54.5	6%	0.06	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.9	122.7	-177.5	-52.5	-178.3	72.6	-169.2	5.7	110	E124 F126 P286 A293 Y315 D316	E124-R299 HydrophobicContact CB-CG 4.34Å; E124-R299 IonicContact OE1-NH2 2.79Å; E124-R299 PolarHBondContact OE1-NH2 2.98Å; E124-R299 IonicContact OE2-CZ 3.33Å; E124-R299 IonicContact OE2-NE 3.01Å; E124-R299 PolarHBondContact OE2-NE 3.25Å; E124-R299 IonicContact OE2-NH2 3.35Å; E124-R299 PolarHBondContact OE2-NH2 3.41Å; F126-R299 HydrophobicContact CE1-CB 4.11Å; P286-R299 VanDerWaalsContact CG-NH2 3.28Å; A293-R299 VanDerWaalsContact CB-NH1 3.28Å; R299-Y315 WeakPolarHBondContact O-CB 3.08Å; R299-Y315 PolarHBondContact O-N 3.28Å; R299-D316 HydrophobicContact CB-CB 4.07Å; R299-D316 HydrophobicContact CG-CB 4.01Å; R299-D316 PolarHBondContact N-O 3.43Å; R299-D316 PolarHBondContact O-N 3.39Å
300	L	98.3	Very high	94.5	Very high	3 Å²	3	53.4 Å²	53.4	2%	0.016	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.4	119.9	-177	-55.2	-177.1	0	0	0	110.2	L113 T123 E124 L125 F126 T298 K313 I314	L113-L300 HydrophobicContact CD1-CD1 4.4Å; L113-L300 HydrophobicContact CD2-CD1 3.96Å; L113-L300 HydrophobicContact CD2-CD2 3.83Å; T123-L300 HydrophobicContact CG2-CD1 4.07Å; T123-L300 HydrophobicContact CG2-CG 4.28Å; E124-L300 PolarHBondContact O-N 3.49Å; L125-L300 HydrophobicContact CD2-CB 3.87Å; L125-L300 HydrophobicContact CD2-CD1 3.71Å; L125-L300 HydrophobicContact CD2-CG 4.19Å; F126-L300 WeakPolarHBondContact CD1-O 3.31Å; F126-L300 PolarHBondContact N-O 3.35Å; T298-L300 HydrophobicContact CG2-CD2 3.94Å; T298-L300 HydrophobicContact CG2-CG 4.38Å; L300-K313 WeakPolarHBondContact CA-O 3.35Å; L300-I314 HydrophobicContact CD2-CG1 3.91Å
301	Y	97.8	Very high	94.9	Very high	21 Å²	21	49 Å²	49	8%	0.082	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91	116.9	175.1	178.7	-136.1	0	0	0	110.5	F126 D282 R303 C312 K313	F126-Y301 AromaticContact CD2-CD2 3.75Å; F126-Y301 HydrophobicContact CD2-CD2 3.75Å; F126-Y301 HydrophobicContact CD2-CE2 4.46Å; F126-Y301 AromaticContact CE2-CD2 3.42Å; F126-Y301 HydrophobicContact CE2-CD2 3.42Å; F126-Y301 VanDerWaalsContact CE2-CD2 3.42Å; F126-Y301 HydrophobicContact CE2-CE2 4.22Å; F126-Y301 AromaticContact CE2-CG 3.89Å; F126-Y301 HydrophobicContact CE2-CG 3.89Å; F126-Y301 HydrophobicContact CZ-CD2 4.09Å; F126-Y301 HydrophobicContact CZ-CG 4.12Å; F126-Y301 WeakPolarHBondContact O-CA 3.3Å; D282-Y301 PolarHBondContact OD2-OH 3.15Å; Y301-R303 HydrophobicContact CE1-CB 4.44Å; Y301-C312 CarbonylContact O-C 3.6Å; Y301-C312 WeakPolarHBondContact O-CA 3.43Å; Y301-K313 PolarHBondContact N-O 3.04Å; Y301-K313 PolarHBondContact O-N 3.14Å
302	L	98.1	Very high	95.2	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	23%	0.233	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	126.1	177.5	-55	-171.8	0	0	0	110.8	F126 G127 T131 K133 I311 C312 F327	F126-L302 PolarHBondContact O-N 3.13Å; G127-L302 WeakPolarHBondContact CA-O 3.43Å; T131-L302 WeakPolarHBondContact CB-O 3.4Å; T131-L302 VanDerWaalsContact CG2-O 3.29Å; T131-L302 WeakPolarHBondContact CG2-O 3.37Å; K133-L302 HydrophobicContact CG-CD1 3.94Å; L302-I311 WeakPolarHBondContact CA-O 3.29Å; L302-C312 HydrophobicContact CD2-CB 3.64Å; L302-F327 HydrophobicContact CD1-CZ 4.49Å; L302-F327 HydrophobicContact CD2-CE1 4.09Å; L302-F327 HydrophobicContact CD2-CZ 4.3Å
303	R	96.1	Very high	95.5	Very high	93 Å²	93	49.2 Å²	49.2	35%	0.351	24%	0.244	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	156.8	173.6	65.6	-177.4	177.2	169.2	-3.2	112	Y301 R310 I311 E324	Y301-R303 HydrophobicContact CE1-CB 4.44Å; R303-R310 WeakPolarHBondContact O-CA 3.32Å; R303-I311 HydrophobicContact CG-CB 3.81Å; R303-I311 HydrophobicContact CG-CG2 4.39Å; R303-I311 PolarHBondContact N-O 2.97Å; R303-I311 PolarHBondContact O-N 3.14Å; R303-E324 IonicContact CZ-OE1 2.8Å; R303-E324 IonicContact CZ-OE2 3.14Å; R303-E324 VanDerWaalsContact NH2-CD 3.33Å; R303-E324 IonicContact NH2-OE1 3.91Å; R303-E324 PolarHBondContact NH2-OE1 2.98Å; R303-E324 VanDerWaalsContact NH2-OE1 3.12Å; R303-E324 IonicContact NH2-OE2 3.97Å; R303-E324 PolarHBondContact NH2-OE2 3.35Å
304	K	95.4	Very high	95.9	Very high	111 Å²	111	48.4 Å²	48.4	48%	0.483	24%	0.236	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	130.9	-179.7	-164.5	-174.5	173.4	-170.1	0	110.5
305	G	93.7	Very high	96.2	Very high	21 Å²	21	45.9 Å²	45.9	22%	0.216	22%	0.221	C	C	.	.			trans	-91.4	-155.5	168.6	0	0	0	0	0	112.1	T309	G305-T309 WeakPolarHBondContact CA-O 3.44Å; G305-T309 PolarHBondContact N-O 3.12Å
306	R	92.9	Very high	96.4	Very high	232 Å²	232	48.4 Å²	48.4	88%	0.875	23%	0.231	S	C	*	.	S	Bend	trans	-81.4	132.1	173.8	-172.1	178.2	177.7	-177.7	-2.1	110	E308 T309	R306-E308 PolarHBondContact O-N 3.06Å; R306-T309 PolarHBondContact N-OG1 2.79Å; R306-T309 WeakPolarHBondContact O-CB 3.5Å; R306-T309 PolarHBondContact O-N 2.72Å; R306-T309 VanDerWaalsContact O-N 3.14Å; R306-T309 PolarHBondContact O-OG1 2.64Å
307	G	93.1	Very high	96.5	Very high	48 Å²	48	49.1 Å²	49.1	50%	0.495	24%	0.236	S	C	.	.	T	Hydrogen-bonded Turn	trans	61.6	-123.5	178.8	0	0	0	0	0	113.4	R310	G307-R310 PolarHBondContact O-NH1 3.1Å; G307-R310 VanDerWaalsContact O-NH1 3.14Å
308	E	94.1	Very high	96.4	Very high	100 Å²	100	51.7 Å²	51.7	47%	0.467	25%	0.254	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	-15.2	178.4	71.3	-79	-171.2	0	0	113.7	R306 R310 A328 I329	R306-E308 PolarHBondContact O-N 3.06Å; E308-R310 VanDerWaalsContact C-NH1 3.33Å; E308-R310 PolarHBondContact O-NH1 2.97Å; E308-R310 VanDerWaalsContact O-NH1 3.12Å; E308-A328 HydrophobicContact CG-CB 4.27Å; E308-I329 PolarHBondContact O-N 3.34Å
309	T	97.1	Very high	96.2	Very high	15 Å²	15	54.7 Å²	54.7	9%	0.092	27%	0.274	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.9	151.5	179.4	68.4	0	0	0	0	112.5	G305 R306 M326 F327 A337	G305-T309 WeakPolarHBondContact CA-O 3.44Å; G305-T309 PolarHBondContact N-O 3.12Å; R306-T309 PolarHBondContact N-OG1 2.79Å; R306-T309 WeakPolarHBondContact O-CB 3.5Å; R306-T309 PolarHBondContact O-N 2.72Å; R306-T309 VanDerWaalsContact O-N 3.14Å; R306-T309 PolarHBondContact O-OG1 2.64Å; T309-M326 HydrophobicContact CG2-SD 3.95Å; T309-F327 CarbonylContact C-O 3.5Å; T309-F327 VanDerWaalsContact CA-O 3.31Å; T309-F327 WeakPolarHBondContact CA-O 3.47Å; T309-A337 HydrophobicContact CG2-CB 3.96Å
310	R	97.9	Very high	96.1	Very high	17 Å²	17	54.9 Å²	54.9	6%	0.064	28%	0.277	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.9	154.1	177.7	-61.8	-60.9	179.8	-80.6	-8.8	108	R130 T131 R303 G307 E308 M326 F327 I329	R130-R310 PolarHBondContact O-NE 3.03Å; R130-R310 PolarHBondContact O-NH2 3.31Å; T131-R310 WeakPolarHBondContact O-CD 3.43Å; T131-R310 WeakPolarHBondContact O-CG 3.36Å; R303-R310 WeakPolarHBondContact O-CA 3.32Å; G307-R310 PolarHBondContact O-NH1 3.1Å; G307-R310 VanDerWaalsContact O-NH1 3.14Å; E308-R310 VanDerWaalsContact C-NH1 3.33Å; E308-R310 PolarHBondContact O-NH1 2.97Å; E308-R310 VanDerWaalsContact O-NH1 3.12Å; R310-M326 WeakPolarHBondContact O-CA 3.47Å; R310-M326 WeakPolarHBondContact O-CG 3.32Å; R310-F327 HydrophobicContact CB-CD1 3.87Å; R310-F327 HydrophobicContact CB-CD2 4.1Å; R310-F327 HydrophobicContact CB-CE1 3.38Å; R310-F327 HydrophobicContact CB-CE2 3.66Å; R310-F327 HydrophobicContact CB-CG 4.22Å; R310-F327 HydrophobicContact CB-CZ 3.28Å; R310-F327 HydrophobicContact CG-CE1 4.46Å; R310-F327 HydrophobicContact CG-CE2 3.96Å; R310-F327 HydrophobicContact CG-CZ 3.9Å; R310-F327 PolarHBondContact N-O 3.42Å; R310-F327 PolarHBondContact O-N 2.92Å; R310-I329 HydrophobicContact CG-CD1 4Å; R310-I329 HydrophobicContact CG-CG1 4.19Å
311	I	97.9	Very high	96	Very high	32 Å²	32	58.7 Å²	58.7	16%	0.164	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	129.5	177.4	-57.4	168.8	0	0	0	107.1	L302 R303 E324 A325	L302-I311 WeakPolarHBondContact CA-O 3.29Å; R303-I311 HydrophobicContact CG-CB 3.81Å; R303-I311 HydrophobicContact CG-CG2 4.39Å; R303-I311 PolarHBondContact N-O 2.97Å; R303-I311 PolarHBondContact O-N 3.14Å; I311-E324 HydrophobicContact CG2-CB 4.19Å; I311-E324 WeakPolarHBondContact CG2-OE2 3.37Å; I311-A325 WeakPolarHBondContact CA-O 3.39Å
312	C	98.4	Very high	95.9	Very high	2 Å²	2	64.3 Å²	64.3	1%	0.014	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	128.3	171.4	-178.9	0	0	0	0	108.8	L109 L112 Y301 L302 E324 A325 F327	L109-C312 HydrophobicContact CD2-CB 3.43Å; L109-C312 VanDerWaalsContact CD2-CB 3.43Å; L112-C312 HydrophobicContact CD2-CB 4.19Å; Y301-C312 CarbonylContact O-C 3.6Å; Y301-C312 WeakPolarHBondContact O-CA 3.43Å; L302-C312 HydrophobicContact CD2-CB 3.64Å; C312-E324 CarbonylContact O-C 3.49Å; C312-E324 VanDerWaalsContact O-CA 3.23Å; C312-E324 WeakPolarHBondContact O-CA 3.06Å; C312-A325 PolarHBondContact N-O 3.11Å; C312-A325 PolarHBondContact O-N 2.98Å; C312-F327 HydrophobicContact CB-CD1 4.26Å; C312-F327 HydrophobicContact CB-CE1 4.01Å
313	K	98	Very high	95.8	Very high	53 Å²	53	66.2 Å²	66.2	23%	0.23	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	134.5	172.5	179.2	176	-179.7	-172.7	0	109.6	L300 Y301 Y315 E322 A323 E324	L300-K313 WeakPolarHBondContact CA-O 3.35Å; Y301-K313 PolarHBondContact N-O 3.04Å; Y301-K313 PolarHBondContact O-N 3.14Å; K313-Y315 PolarHBondContact O-N 3.3Å; K313-E322 WeakPolarHBondContact CE-OE2 3.36Å; K313-E322 IonicContact NZ-OE2 3.76Å; K313-E322 PolarHBondContact NZ-OE2 3.43Å; K313-A323 WeakPolarHBondContact CA-O 3.28Å; K313-E324 HydrophobicContact CB-CG 3.81Å; K313-E324 HydrophobicContact CD-CG 4.2Å; K313-E324 HydrophobicContact CG-CG 3.83Å
314	I	98.1	Very high	95.9	Very high	1 Å²	1	66.2 Å²	66.2	1%	0.005	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.7	115.7	165.1	-63.1	176	0	0	0	107.7	L112 L300 L320 A323	L112-I314 HydrophobicContact CD1-CD1 3.71Å; L112-I314 HydrophobicContact CD1-CG1 3.94Å; L112-I314 HydrophobicContact CD2-CG1 4.13Å; L112-I314 HydrophobicContact CG-CD1 3.78Å; L112-I314 HydrophobicContact CG-CG1 3.88Å; L112-I314 WeakPolarHBondContact O-CD1 3.36Å; L300-I314 HydrophobicContact CD2-CG1 3.91Å; I314-L320 HydrophobicContact CD1-CB 3.64Å; I314-L320 HydrophobicContact CD1-CD1 3.76Å; I314-L320 HydrophobicContact CD1-CG 4.3Å; I314-L320 HydrophobicContact CG2-CB 4.41Å; I314-A323 PolarHBondContact N-O 2.8Å
315	Y	95.6	Very high	96	Very high	111 Å²	111	61.4 Å²	61.4	44%	0.435	33%	0.329	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	-38.3	-178.6	-168.5	-90	0	0	0	111.9	F126 R299 K313	F126-Y315 HydrophobicContact CE1-CD1 4.29Å; F126-Y315 HydrophobicContact CE1-CD2 4.45Å; F126-Y315 AromaticContact CE1-CG 3.95Å; F126-Y315 HydrophobicContact CE1-CG 3.95Å; F126-Y315 HydrophobicContact CE2-CD2 4.49Å; F126-Y315 HydrophobicContact CZ-CD1 4Å; F126-Y315 AromaticContact CZ-CD2 3.61Å; F126-Y315 HydrophobicContact CZ-CD2 3.61Å; F126-Y315 HydrophobicContact CZ-CE1 4.5Å; F126-Y315 HydrophobicContact CZ-CE2 4.12Å; F126-Y315 AromaticContact CZ-CG 3.53Å; F126-Y315 HydrophobicContact CZ-CG 3.53Å; R299-Y315 WeakPolarHBondContact O-CB 3.08Å; R299-Y315 PolarHBondContact O-N 3.28Å; K313-Y315 PolarHBondContact O-N 3.3Å
316	D	95.5	Very high	96.2	Very high	76 Å²	76	64.7 Å²	64.7	41%	0.406	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-154.3	136.9	177.9	-172.6	26.6	0	0	0	109.1	T298 R299	T298-D316 CarbonylContact C-O 3.6Å; T298-D316 WeakPolarHBondContact CA-O 3.38Å; R299-D316 HydrophobicContact CB-CB 4.07Å; R299-D316 HydrophobicContact CG-CB 4.01Å; R299-D316 PolarHBondContact N-O 3.43Å; R299-D316 PolarHBondContact O-N 3.39Å
317	S	96.6	Very high	96.5	Very high	20 Å²	20	53.7 Å²	53.7	14%	0.14	30%	0.298	C	S	.	.			trans	-166.3	141.7	176.2	-177.3	0	0	0	0	109.7	C319 L320	S317-C319 VanDerWaalsContact C-N 3.3Å; S317-C319 PolarHBondContact O-N 2.83Å; S317-L320 WeakPolarHBondContact OG-CB 3.41Å; S317-L320 PolarHBondContact OG-N 2.67Å
318	P	94.1	Very high	96.7	Very high	103 Å²	103	51.4 Å²	51.4	67%	0.669	28%	0.275	S	S	*	.	S	Bend	trans	-72.2	-22	177.2	29.3	-37.1	0	0	0	113.7	T297	T297-P318 HydrophobicContact CG2-CG 3.85Å; T297-P318 WeakPolarHBondContact O-CD 3.21Å
319	C	92.9	Very high	96.9	Very high	73 Å²	73	48.3 Å²	48.3	49%	0.493	26%	0.261	S	S	.	.	S	Bend	trans	-124.6	-24.7	-172.1	58.8	0	0	0	0	114.1	S317	S317-C319 VanDerWaalsContact C-N 3.3Å; S317-C319 PolarHBondContact O-N 2.83Å
320	L	95.8	Very high	96.9	Very high	20 Å²	20	49.2 Å²	49.2	11%	0.105	27%	0.266	C	S	.	.	S	Bend	trans	-94.1	134.7	-176.1	-55.4	173.7	0	0	0	111.2	L113 Q114 T298 I314 S317	L113-L320 HydrophobicContact CD2-CD1 4.06Å; Q114-L320 HydrophobicContact CB-CD2 3.97Å; Q114-L320 HydrophobicContact CG-CD2 3.68Å; T298-L320 HydrophobicContact CG2-CD1 4.47Å; I314-L320 HydrophobicContact CD1-CB 3.64Å; I314-L320 HydrophobicContact CD1-CD1 3.76Å; I314-L320 HydrophobicContact CD1-CG 4.3Å; I314-L320 HydrophobicContact CG2-CB 4.41Å; S317-L320 WeakPolarHBondContact OG-CB 3.41Å; S317-L320 PolarHBondContact OG-N 2.67Å
321	P	95.8	Very high	96.8	Very high	82 Å²	82	52.3 Å²	52.3	53%	0.532	29%	0.294	S	S	.	.			trans	-69.7	154.4	174.5	30.5	-34.7	0	0	0	111.3	A323	P321-A323 PolarHBondContact O-N 3.14Å; P321-A323 VanDerWaalsContact O-N 3.08Å
322	E	96.1	Very high	96.8	Very high	140 Å²	140	53.6 Å²	53.6	65%	0.654	30%	0.302	S	S	*	.	S	Bend	trans	-60.4	114.8	169.7	-79.5	-163.5	-143.4	0	0	110.4	K313	K313-E322 WeakPolarHBondContact CE-OE2 3.36Å; K313-E322 IonicContact NZ-OE2 3.76Å; K313-E322 PolarHBondContact NZ-OE2 3.43Å
323	A	97.3	Very high	96.7	Very high	40 Å²	40	53.5 Å²	53.5	33%	0.331	30%	0.301	S	S	.	.			trans	-150	167.2	178.1	0	0	0	0	0	110.5	L112 K313 I314 P321	L112-A323 HydrophobicContact CD1-CB 3.49Å; L112-A323 VanDerWaalsContact CD1-CB 3.49Å; K313-A323 WeakPolarHBondContact CA-O 3.28Å; I314-A323 PolarHBondContact N-O 2.8Å; P321-A323 PolarHBondContact O-N 3.14Å; P321-A323 VanDerWaalsContact O-N 3.08Å
324	E	97.7	Very high	96.8	Very high	93 Å²	93	51 Å²	51	44%	0.435	29%	0.29	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.6	147.8	176.3	-57.6	-166.6	173.2	0	0	110.7	R303 I311 C312 K313	R303-E324 IonicContact CZ-OE1 2.8Å; R303-E324 IonicContact CZ-OE2 3.14Å; R303-E324 VanDerWaalsContact NH2-CD 3.33Å; R303-E324 IonicContact NH2-OE1 3.91Å; R303-E324 PolarHBondContact NH2-OE1 2.98Å; R303-E324 VanDerWaalsContact NH2-OE1 3.12Å; R303-E324 IonicContact NH2-OE2 3.97Å; R303-E324 PolarHBondContact NH2-OE2 3.35Å; I311-E324 HydrophobicContact CG2-CB 4.19Å; I311-E324 WeakPolarHBondContact CG2-OE2 3.37Å; C312-E324 CarbonylContact O-C 3.49Å; C312-E324 VanDerWaalsContact O-CA 3.23Å; C312-E324 WeakPolarHBondContact O-CA 3.06Å; K313-E324 HydrophobicContact CB-CG 3.81Å; K313-E324 HydrophobicContact CD-CG 4.2Å; K313-E324 HydrophobicContact CG-CG 3.83Å
325	A	97.9	Very high	96.8	Very high	11 Å²	11	51 Å²	51	9%	0.091	29%	0.291	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	150.9	169.6	0	0	0	0	0	110.7	E108 L109 L112 I311 C312	E108-A325 HydrophobicContact CB-CB 4.31Å; E108-A325 WeakPolarHBondContact O-CB 3.32Å; L109-A325 HydrophobicContact CD2-CB 4.35Å; L112-A325 HydrophobicContact CB-CB 3.84Å; L112-A325 HydrophobicContact CD2-CB 3.82Å; L112-A325 HydrophobicContact CG-CB 4.27Å; I311-A325 WeakPolarHBondContact CA-O 3.39Å; C312-A325 PolarHBondContact N-O 3.11Å; C312-A325 PolarHBondContact O-N 2.98Å
326	M	97.8	Very high	96.8	Very high	90 Å²	90	48.2 Å²	48.2	44%	0.443	28%	0.283	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	140.3	176.4	-167	178	-60.7	0	0	110.1	T309 R310 A337	T309-M326 HydrophobicContact CG2-SD 3.95Å; R310-M326 WeakPolarHBondContact O-CA 3.47Å; R310-M326 WeakPolarHBondContact O-CG 3.32Å; M326-A337 HydrophobicContact CG-CB 4.12Å; M326-A337 HydrophobicContact SD-CB 4.1Å
327	F	98	Very high	96.6	Very high	0 Å²	0	46.1 Å²	46.1	0%	0	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	169	173.2	69.8	-82.6	0	0	0	110.1	L109 L302 T309 R310 C312 I329 V334	L109-F327 HydrophobicContact CD1-CB 3.87Å; L109-F327 HydrophobicContact CD1-CD1 3.9Å; L109-F327 HydrophobicContact CD1-CD2 4.24Å; L109-F327 HydrophobicContact CD1-CE1 4.46Å; L109-F327 HydrophobicContact CD1-CG 3.76Å; L109-F327 HydrophobicContact CD2-CB 4.44Å; L109-F327 HydrophobicContact CD2-CD1 3.84Å; L109-F327 HydrophobicContact CD2-CE1 4.46Å; L109-F327 HydrophobicContact CD2-CG 4.39Å; L109-F327 HydrophobicContact CG-CB 3.93Å; L109-F327 HydrophobicContact CG-CD1 4.14Å; L109-F327 HydrophobicContact CG-CG 4.19Å; L302-F327 HydrophobicContact CD1-CZ 4.49Å; L302-F327 HydrophobicContact CD2-CE1 4.09Å; L302-F327 HydrophobicContact CD2-CZ 4.3Å; T309-F327 CarbonylContact C-O 3.5Å; T309-F327 VanDerWaalsContact CA-O 3.31Å; T309-F327 WeakPolarHBondContact CA-O 3.47Å; R310-F327 HydrophobicContact CB-CD1 3.87Å; R310-F327 HydrophobicContact CB-CD2 4.1Å; R310-F327 HydrophobicContact CB-CE1 3.38Å; R310-F327 HydrophobicContact CB-CE2 3.66Å; R310-F327 HydrophobicContact CB-CG 4.22Å; R310-F327 HydrophobicContact CB-CZ 3.28Å; R310-F327 HydrophobicContact CG-CE1 4.46Å; R310-F327 HydrophobicContact CG-CE2 3.96Å; R310-F327 HydrophobicContact CG-CZ 3.9Å; R310-F327 PolarHBondContact N-O 3.42Å; R310-F327 PolarHBondContact O-N 2.92Å; C312-F327 HydrophobicContact CB-CD1 4.26Å; C312-F327 HydrophobicContact CB-CE1 4.01Å; F327-I329 HydrophobicContact CE2-CG1 4.34Å; F327-V334 HydrophobicContact CD2-CG1 3.71Å; F327-V334 HydrophobicContact CD2-CG2 4.43Å; F327-V334 HydrophobicContact CE2-CG1 4.29Å; F327-V334 HydrophobicContact CE2-CG2 4.32Å; F327-V334 HydrophobicContact CG-CG1 4.4Å
328	A	98.1	Very high	96	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	30%	0.303	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.1	153.2	175.9	0	0	0	0	0	111.8	E308 G335	E308-A328 HydrophobicContact CG-CB 4.27Å; A328-G335 PolarHBondContact N-O 3.03Å; A328-G335 PolarHBondContact O-N 3.04Å
329	I	97.7	Very high	94.5	Very high	35 Å²	35	59.4 Å²	59.4	18%	0.179	33%	0.333	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	103.3	169.9	-56.9	173.7	0	0	0	107.3	Q135 E308 R310 F327	Q135-I329 HydrophobicContact CB-CD1 4.37Å; Q135-I329 HydrophobicContact CB-CG2 4.22Å; Q135-I329 HydrophobicContact CG-CD1 4.26Å; Q135-I329 HydrophobicContact CG-CG2 3.97Å; E308-I329 PolarHBondContact O-N 3.34Å; R310-I329 HydrophobicContact CG-CD1 4Å; R310-I329 HydrophobicContact CG-CG1 4.19Å; F327-I329 HydrophobicContact CE2-CG1 4.34Å
330	N	97.1	Very high	94.6	Very high	35 Å²	35	58.8 Å²	58.8	19%	0.187	33%	0.325	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.2	174.1	-177.9	-61.2	-34.3	0	0	0	111.2	R170 D332 G333	R170-N330 PolarHBondContact NH2-O 2.81Å; N330-D332 WeakPolarHBondContact CB-OD1 3.35Å; N330-D332 PolarHBondContact O-N 3.4Å; N330-G333 PolarHBondContact N-O 3.18Å; N330-G333 PolarHBondContact O-N 3.27Å
331	A	96.9	Very high	94.5	Very high	81 Å²	81	60.8 Å²	60.8	67%	0.669	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.5	-33.8	175.2	0	0	0	0	0	111.7	R170 A173	R170-A331 PolarHBondContact NH1-O 2.88Å; A173-A331 WeakPolarHBondContact CB-O 3.22Å
332	D	97.2	Very high	94.4	Very high	60 Å²	60	59.6 Å²	59.6	32%	0.321	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-96.7	20.4	-177.7	64.4	-26.6	0	0	0	113.7	R177 N330	R177-D332 HydrophobicContact CB-CB 4.13Å; R177-D332 WeakPolarHBondContact CD-O 3.38Å; R177-D332 WeakPolarHBondContact CD-OD2 3.44Å; R177-D332 HydrophobicContact CG-CB 4.39Å; R177-D332 IonicContact NE-OD2 3.04Å; N330-D332 WeakPolarHBondContact CB-OD1 3.35Å; N330-D332 PolarHBondContact O-N 3.4Å
333	G	97.6	Very high	94.3	Very high	0 Å²	0	54.9 Å²	54.9	0%	0	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	106.5	-160.3	175	0	0	0	0	0	114.6	N330	N330-G333 PolarHBondContact N-O 3.18Å; N330-G333 PolarHBondContact O-N 3.27Å
334	V	98.4	Very high	94.1	Very high	0 Å²	0	55.8 Å²	55.8	0%	0	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.1	129.1	173.1	168.7	0	0	0	0	109.9	G105 L109 L136 T139 R177 F327	G105-V334 CarbonylContact C-O 3.54Å; L109-V334 HydrophobicContact CD1-CG1 3.97Å; L136-V334 HydrophobicContact CB-CG2 4.22Å; L136-V334 HydrophobicContact CD1-CB 4.38Å; L136-V334 HydrophobicContact CD1-CG1 4.24Å; L136-V334 HydrophobicContact CD1-CG2 4.22Å; T139-V334 HydrophobicContact CG2-CB 4.25Å; T139-V334 PolarHBondContact OG1-N 3.2Å; T139-V334 VanDerWaalsContact OG1-N 3.09Å; R177-V334 PolarHBondContact NH1-O 3.35Å; F327-V334 HydrophobicContact CD2-CG1 3.71Å; F327-V334 HydrophobicContact CD2-CG2 4.43Å; F327-V334 HydrophobicContact CE2-CG1 4.29Å; F327-V334 HydrophobicContact CE2-CG2 4.32Å; F327-V334 HydrophobicContact CG-CG1 4.4Å
335	G	97.9	Very high	93.9	Very high	1 Å²	1	53.3 Å²	53.3	1%	0.01	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-150.2	-175.2	177.8	0	0	0	0	0	112.5	A328	A328-G335 PolarHBondContact N-O 3.03Å; A328-G335 PolarHBondContact O-N 3.04Å
336	D	96.8	Very high	93.6	Very high	53 Å²	53	56.4 Å²	56.4	28%	0.283	31%	0.31	S	S	.	.	P	Polyproline II helix	trans	-67.1	147.6	178.1	-59.4	-40.4	0	0	0	111	S106 K107 E108 K338	S106-D336 WeakPolarHBondContact CA-OD1 3.34Å; S106-D336 WeakPolarHBondContact CB-OD1 3.49Å; S106-D336 PolarHBondContact OG-OD1 3.14Å; K107-D336 PolarHBondContact N-OD1 3.12Å; E108-D336 PolarHBondContact N-OD1 3.41Å; D336-K338 PolarHBondContact O-N 3.43Å
337	A	90.3	Very high	93.3	Very high	31 Å²	31	53.8 Å²	53.8	26%	0.256	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-65.1	132.8	171.7	0	0	0	0	0	109.3	T309 M326	T309-A337 HydrophobicContact CG2-CB 3.96Å; M326-A337 HydrophobicContact CG-CB 4.12Å; M326-A337 HydrophobicContact SD-CB 4.1Å
338	K	84.3	Confident	92.9	Very high	161 Å²	161	58.3 Å²	58.3	70%	0.7	33%	0.325	S	S	*	.	P	Polyproline II helix	trans	-82.5	138.2	171.1	-62.6	-176.7	-178.1	-179.8	0	108.2	D336	D336-K338 PolarHBondContact O-N 3.43Å
339	D	62.7	Low	92.4	Very high	242 Å²	242	63.5 Å²	63.5	100%	1.294	36%	0.355	S	S	*	.			trans	-59.3	0	173.7	-64.7	-33.3	0	0	0	112.2

Retrieved 339 of 339 residues in 487.9 ms (Link to these results)

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