A0A0D9S5S0_CHLSB Loading...

Tudor and KH domain-containing protein

Participates in the primary piRNA biogenesis pathway and is required during spermatogenesis to repress transposable elements and prevent their mobilization, which is essential for the germline integrity. The piRNA metabolic process mediates the repression of transposable elements during meiosis by forming complexes composed of piRNAs and Piwi proteins and govern the methylation and subsequent repression of transposons. Required for the final steps of primary piRNA biogenesis by participating in the processing of 31-37 nt intermediates into mature piRNAs. May act in pi-bodies and piP-bodies by transferring piRNA precursors or intermediates to or between these granules.

AlphaFold DB , UniProt , Accession A0A0D9S5S0, Species CHLSB (Chlorocebus sabaeus, Green monkey), Gene TDRKH, Length 561 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	38.7	Very low	54.4	Low	235 Å²	235	136.3 Å²	136.3	100%	1.158	72%	0.721	S	S	*	*				0	113.9	0	-68.6	162.5	70.9	0	0	107.3
2	S	40.7	Very low	56.1	Low	125 Å²	125	129.5 Å²	129.5	87%	0.874	69%	0.693	S	S	*	*			trans	-84.4	114.1	-177.7	-52.2	0	0	0	0	109.3	E4	S2-E4 PolarHBondContact O-N 3.33Å
3	T	48	Very low	57.5	Low	134 Å²	134	127.6 Å²	127.6	82%	0.822	69%	0.689	S	S	*	*			trans	-83.6	111.5	174.1	38.9	0	0	0	0	109.8	R5	T3-R5 PolarHBondContact O-N 2.86Å
4	E	52.7	Low	58.5	Low	187 Å²	187	128.4 Å²	128.4	87%	0.874	69%	0.69	S	S	*	*			trans	-61.6	110.2	175.9	-63.7	-173.9	131.3	0	0	110.3	S2 T6	S2-E4 PolarHBondContact O-N 3.33Å; E4-T6 PolarHBondContact O-N 2.94Å
5	R	49.3	Very low	59.3	Low	226 Å²	226	126.2 Å²	126.2	85%	0.853	67%	0.674	S	S	*	*			trans	-71.5	110	168.8	-80.2	-172.8	172.5	-176.9	-1.7	108.5	T3 S7	T3-R5 PolarHBondContact O-N 2.86Å; R5-S7 PolarHBondContact O-N 2.99Å
6	T	52.3	Low	60.2	Low	97 Å²	97	123.3 Å²	123.3	60%	0.595	65%	0.654	S	S	*	*			trans	-53.9	130.6	177.1	51.8	0	0	0	0	110.9	E4 W8 T9	E4-T6 PolarHBondContact O-N 2.94Å; T6-W8 PolarHBondContact O-N 3.08Å; T6-T9 PolarHBondContact O-N 3.45Å; T6-T9 PolarHBondContact O-OG1 2.86Å
7	S	59.3	Low	60.8	Low	83 Å²	83	121.9 Å²	121.9	58%	0.58	65%	0.645	S	S	*	*	G	3₁₀ helix	trans	-60.5	-16.1	-170.7	54.5	0	0	0	0	114.7	R5 T9 S10	R5-S7 PolarHBondContact O-N 2.99Å; S7-T9 PolarHBondContact O-N 2.76Å; S7-S10 PolarHBondContact O-N 2.71Å; S7-S10 PolarHBondContact O-OG 3.13Å; S7-S10 VanDerWaalsContact O-OG 3.05Å
8	W	59	Low	61.3	Low	170 Å²	170	118.4 Å²	118.4	64%	0.644	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-60	-20.3	170.2	-69.2	86.9	0	0	0	113.7	T6 K16	T6-W8 PolarHBondContact O-N 3.08Å; W8-K16 WeakPolarHBondContact O-CE 3.46Å; W8-K16 PolarHBondContact O-NZ 2.87Å
9	T	63.8	Low	61.6	Low	93 Å²	93	115.9 Å²	115.9	57%	0.571	62%	0.623	S	S	*	*	G	3₁₀ helix	trans	-79.6	-29.1	-179.8	54.9	0	0	0	0	113.9	T6 S7	T6-T9 PolarHBondContact O-N 3.45Å; T6-T9 PolarHBondContact O-OG1 2.86Å; S7-T9 PolarHBondContact O-N 2.76Å
10	S	66.3	Low	62	Low	100 Å²	100	112.7 Å²	112.7	70%	0.699	62%	0.618	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.1	-14.2	-177.7	55.9	0	0	0	0	115.2	S7	S7-S10 PolarHBondContact O-N 2.71Å; S7-S10 PolarHBondContact O-OG 3.13Å; S7-S10 VanDerWaalsContact O-OG 3.05Å
11	L	68.2	Low	62.4	Low	49 Å²	49	113.2 Å²	113.2	26%	0.257	62%	0.62	S	S	.	*	S	Bend	trans	-74.9	135.1	179	-65.9	169.3	0	0	0	112.1	Q15 K16 L19	L11-Q15 HydrophobicContact CB-CB 4.32Å; L11-Q15 HydrophobicContact CD2-CB 4.21Å; L11-K16 HydrophobicContact CB-CD 4.49Å; L11-K16 HydrophobicContact CB-CG 4.08Å; L11-K16 VanDerWaalsContact O-CE 3.31Å; L11-K16 WeakPolarHBondContact O-CE 3.48Å; L11-K16 PolarHBondContact O-NZ 2.81Å; L11-L19 HydrophobicContact CD1-CD1 3.75Å
12	S	74.9	Confident	64	Low	55 Å²	55	103.7 Å²	103.7	39%	0.385	58%	0.582	S	S	.	*			trans	-64.7	159.9	172.9	66.5	0	0	0	0	112.4	I14 Q15 K16	S12-I14 PolarHBondContact O-N 3.11Å; S12-Q15 PolarHBondContact O-N 3.01Å; S12-Q15 VanDerWaalsContact O-N 3.13Å; S12-Q15 VanDerWaalsContact OG-CD 3.31Å; S12-Q15 WeakPolarHBondContact OG-CG 2.96Å; S12-Q15 PolarHBondContact OG-N 2.98Å; S12-Q15 PolarHBondContact OG-OE1 3.01Å; S12-K16 PolarHBondContact O-N 2.81Å
13	T	74.1	Confident	65.6	Low	105 Å²	105	102.6 Å²	102.6	64%	0.644	57%	0.565	S	S	*	*	H	α-helix	trans	-56	-37.8	177.3	-44	0	0	0	0	112.2	K16 I17	T13-K16 PolarHBondContact O-N 2.87Å; T13-I17 HydrophobicContact CG2-CD1 4.18Å; T13-I17 VanDerWaalsContact O-CG1 3.32Å; T13-I17 WeakPolarHBondContact O-CG1 3.38Å; T13-I17 PolarHBondContact O-N 2.91Å
14	I	70.9	Confident	67.3	Low	138 Å²	138	99.7 Å²	99.7	71%	0.708	55%	0.548	S	S	*	.	H	α-helix	trans	-67.4	-44.1	178	-60.6	175.5	0	0	0	110.7	S12 K16 I17 A18	S12-I14 PolarHBondContact O-N 3.11Å; I14-K16 VanDerWaalsContact C-N 3.33Å; I14-K16 PolarHBondContact O-N 2.85Å; I14-I17 PolarHBondContact O-N 2.83Å; I14-A18 WeakPolarHBondContact O-CB 3.44Å; I14-A18 PolarHBondContact O-N 2.63Å
15	Q	70.6	Confident	68.6	Low	96 Å²	96	93.1 Å²	93.1	45%	0.449	53%	0.526	S	S	.	.	H	α-helix	trans	-64.1	-36.8	175.9	-72.8	161.4	-48.1	0	0	112.4	L11 S12 A18 L19	L11-Q15 HydrophobicContact CB-CB 4.32Å; L11-Q15 HydrophobicContact CD2-CB 4.21Å; S12-Q15 PolarHBondContact O-N 3.01Å; S12-Q15 VanDerWaalsContact O-N 3.13Å; S12-Q15 VanDerWaalsContact OG-CD 3.31Å; S12-Q15 WeakPolarHBondContact OG-CG 2.96Å; S12-Q15 PolarHBondContact OG-N 2.98Å; S12-Q15 PolarHBondContact OG-OE1 3.01Å; Q15-A18 PolarHBondContact O-N 2.93Å; Q15-L19 WeakPolarHBondContact O-CB 3.48Å; Q15-L19 WeakPolarHBondContact O-CG 3.5Å; Q15-L19 PolarHBondContact O-N 2.94Å
16	K	74.3	Confident	70	Confident	80 Å²	80	85.6 Å²	85.6	35%	0.348	51%	0.508	S	S	.	.	H	α-helix	trans	-63.5	-44	174.5	-77.1	162	167.3	147	0	112.2	W8 L11 S12 T13 I14 G20	W8-K16 WeakPolarHBondContact O-CE 3.46Å; W8-K16 PolarHBondContact O-NZ 2.87Å; L11-K16 HydrophobicContact CB-CD 4.49Å; L11-K16 HydrophobicContact CB-CG 4.08Å; L11-K16 VanDerWaalsContact O-CE 3.31Å; L11-K16 WeakPolarHBondContact O-CE 3.48Å; L11-K16 PolarHBondContact O-NZ 2.81Å; S12-K16 PolarHBondContact O-N 2.81Å; T13-K16 PolarHBondContact O-N 2.87Å; I14-K16 VanDerWaalsContact C-N 3.33Å; I14-K16 PolarHBondContact O-N 2.85Å; K16-G20 PolarHBondContact O-N 3.1Å
17	I	70.3	Confident	71.5	Confident	99 Å²	99	83.7 Å²	83.7	51%	0.508	50%	0.502	S	S	.	.	H	α-helix	trans	-65.6	-43.2	174.7	-67.5	164.5	0	0	0	110.7	T13 I14 L19 G20 L21	T13-I17 HydrophobicContact CG2-CD1 4.18Å; T13-I17 VanDerWaalsContact O-CG1 3.32Å; T13-I17 WeakPolarHBondContact O-CG1 3.38Å; T13-I17 PolarHBondContact O-N 2.91Å; I14-I17 PolarHBondContact O-N 2.83Å; I17-L19 PolarHBondContact O-N 3.03Å; I17-G20 PolarHBondContact O-N 2.82Å; I17-L21 HydrophobicContact CG2-CD1 3.87Å; I17-L21 HydrophobicContact CG2-CG 4.45Å; I17-L21 WeakPolarHBondContact O-CG 3.45Å; I17-L21 PolarHBondContact O-N 3Å
18	A	69.4	Low	72.7	Confident	60 Å²	60	83.4 Å²	83.4	50%	0.496	50%	0.497	S	S	.	.	H	α-helix	trans	-61.7	-40.4	178.3	0	0	0	0	0	112.8	I14 Q15 G22	I14-A18 WeakPolarHBondContact O-CB 3.44Å; I14-A18 PolarHBondContact O-N 2.63Å; Q15-A18 PolarHBondContact O-N 2.93Å; A18-G22 VanDerWaalsContact O-CA 3.32Å; A18-G22 WeakPolarHBondContact O-CA 3.08Å; A18-G22 PolarHBondContact O-N 3.24Å
19	L	66.8	Low	74	Confident	71 Å²	71	80.1 Å²	80.1	37%	0.372	49%	0.491	S	S	.	.	H	α-helix	trans	-68	-45.4	172.9	-75.4	163.4	0	0	0	111.9	L11 Q15 I17 L21 G22 I23	L11-L19 HydrophobicContact CD1-CD1 3.75Å; Q15-L19 WeakPolarHBondContact O-CB 3.48Å; Q15-L19 WeakPolarHBondContact O-CG 3.5Å; Q15-L19 PolarHBondContact O-N 2.94Å; I17-L19 PolarHBondContact O-N 3.03Å; L19-L21 VanDerWaalsContact C-N 3.29Å; L19-L21 PolarHBondContact O-N 3.03Å; L19-G22 PolarHBondContact O-N 3Å; L19-I23 HydrophobicContact CD2-CD1 4.35Å; L19-I23 WeakPolarHBondContact O-CG1 3.25Å; L19-I23 PolarHBondContact O-N 3.11Å
20	G	69.7	Low	74.9	Confident	51 Å²	51	78.5 Å²	78.5	53%	0.526	49%	0.487	S	S	.	.	H	α-helix	trans	-62.7	-30.1	-179.1	0	0	0	0	0	114.5	K16 I17 P24	K16-G20 PolarHBondContact O-N 3.1Å; I17-G20 PolarHBondContact O-N 2.82Å; G20-P24 WeakPolarHBondContact O-CD 3.36Å; G20-P24 WeakPolarHBondContact O-CG 3.34Å
21	L	70.6	Confident	75.9	Confident	124 Å²	124	80.6 Å²	80.6	65%	0.649	48%	0.48	S	S	*	.	H	α-helix	trans	-94.9	-35.7	175	-62.7	176.5	0	0	0	112.7	I17 L19 A25	I17-L21 HydrophobicContact CG2-CD1 3.87Å; I17-L21 HydrophobicContact CG2-CG 4.45Å; I17-L21 WeakPolarHBondContact O-CG 3.45Å; I17-L21 PolarHBondContact O-N 3Å; L19-L21 VanDerWaalsContact C-N 3.29Å; L19-L21 PolarHBondContact O-N 3.03Å; L21-A25 VanDerWaalsContact O-CB 3.3Å; L21-A25 WeakPolarHBondContact O-CB 3.37Å; L21-A25 PolarHBondContact O-N 3.36Å; L21-A25 VanDerWaalsContact O-N 3.16Å
22	G	71.9	Confident	76.8	Confident	35 Å²	35	82.9 Å²	82.9	36%	0.361	49%	0.492	S	S	.	.	H	α-helix	trans	-68.5	-38.7	-177.4	0	0	0	0	0	113.8	A18 L19 A25 S26	A18-G22 VanDerWaalsContact O-CA 3.32Å; A18-G22 WeakPolarHBondContact O-CA 3.08Å; A18-G22 PolarHBondContact O-N 3.24Å; L19-G22 PolarHBondContact O-N 3Å; G22-A25 PolarHBondContact O-N 3.16Å; G22-S26 WeakPolarHBondContact O-CB 3.46Å; G22-S26 PolarHBondContact O-N 3.18Å; G22-S26 PolarHBondContact O-OG 3.44Å
23	I	75.8	Confident	77.4	Confident	101 Å²	101	85.6 Å²	85.6	52%	0.518	50%	0.501	S	S	.	.	H	α-helix	trans	-66.1	-49.6	179.3	-65	168.2	0	0	0	111.5	L19 A25 S26 A27	L19-I23 HydrophobicContact CD2-CD1 4.35Å; L19-I23 WeakPolarHBondContact O-CG1 3.25Å; L19-I23 PolarHBondContact O-N 3.11Å; I23-A25 PolarHBondContact O-N 2.81Å; I23-S26 PolarHBondContact O-OG 2.86Å; I23-S26 VanDerWaalsContact O-OG 3.12Å; I23-A27 VanDerWaalsContact O-CB 3.25Å; I23-A27 WeakPolarHBondContact O-CB 3.15Å; I23-A27 PolarHBondContact O-N 2.79Å
24	P	82.9	Confident	77.8	Confident	73 Å²	73	87.7 Å²	87.7	47%	0.474	50%	0.498	S	S	.	.	H	α-helix	trans	-61.2	-40	173.2	-25.5	35.4	0	0	0	113.7	G20 T28	G20-P24 WeakPolarHBondContact O-CD 3.36Å; G20-P24 WeakPolarHBondContact O-CG 3.34Å; P24-T28 VanDerWaalsContact O-CB 3.3Å; P24-T28 WeakPolarHBondContact O-CB 3.32Å; P24-T28 PolarHBondContact O-N 2.73Å; P24-T28 PolarHBondContact O-OG1 2.69Å
25	A	79.3	Confident	78.4	Confident	49 Å²	49	87.2 Å²	87.2	41%	0.405	49%	0.488	S	S	.	.	H	α-helix	trans	-64.8	-48.2	179.2	0	0	0	0	0	111.9	L21 G22 I23 T28 I29	L21-A25 VanDerWaalsContact O-CB 3.3Å; L21-A25 WeakPolarHBondContact O-CB 3.37Å; L21-A25 PolarHBondContact O-N 3.36Å; L21-A25 VanDerWaalsContact O-N 3.16Å; G22-A25 PolarHBondContact O-N 3.16Å; I23-A25 PolarHBondContact O-N 2.81Å; A25-T28 PolarHBondContact O-N 3.07Å; A25-I29 VanDerWaalsContact O-CG1 3.32Å; A25-I29 WeakPolarHBondContact O-CG1 3.36Å; A25-I29 PolarHBondContact O-N 3.42Å
26	S	79.5	Confident	78.8	Confident	68 Å²	68	91 Å²	91	48%	0.476	50%	0.498	S	S	.	.	H	α-helix	trans	-66.2	-39	177.1	53.5	0	0	0	0	112.6	G22 I23 T28 I29 A30	G22-S26 WeakPolarHBondContact O-CB 3.46Å; G22-S26 PolarHBondContact O-N 3.18Å; G22-S26 PolarHBondContact O-OG 3.44Å; I23-S26 PolarHBondContact O-OG 2.86Å; I23-S26 VanDerWaalsContact O-OG 3.12Å; S26-T28 VanDerWaalsContact C-N 3.34Å; S26-T28 PolarHBondContact O-N 3.09Å; S26-I29 PolarHBondContact O-N 3.01Å; S26-A30 VanDerWaalsContact O-CB 3.25Å; S26-A30 WeakPolarHBondContact O-CB 3.39Å; S26-A30 PolarHBondContact O-N 2.65Å
27	A	83.2	Confident	78.9	Confident	57 Å²	57	94.2 Å²	94.2	47%	0.471	51%	0.509	S	S	.	.	H	α-helix	trans	-63.6	-38.4	172.6	0	0	0	0	0	112.2	I23 A30 Y31	I23-A27 VanDerWaalsContact O-CB 3.25Å; I23-A27 WeakPolarHBondContact O-CB 3.15Å; I23-A27 PolarHBondContact O-N 2.79Å; A27-A30 PolarHBondContact O-N 2.67Å; A27-Y31 WeakPolarHBondContact O-CB 3.45Å; A27-Y31 PolarHBondContact O-N 3Å
28	T	84.4	Confident	79.2	Confident	77 Å²	77	95.9 Å²	95.9	47%	0.472	51%	0.509	S	S	.	.	H	α-helix	trans	-67.7	-43.5	175.9	-57.2	0	0	0	0	111.4	P24 A25 S26 Y31 I32	P24-T28 VanDerWaalsContact O-CB 3.3Å; P24-T28 WeakPolarHBondContact O-CB 3.32Å; P24-T28 PolarHBondContact O-N 2.73Å; P24-T28 PolarHBondContact O-OG1 2.69Å; A25-T28 PolarHBondContact O-N 3.07Å; S26-T28 VanDerWaalsContact C-N 3.34Å; S26-T28 PolarHBondContact O-N 3.09Å; T28-Y31 PolarHBondContact O-N 2.81Å; T28-I32 HydrophobicContact CG2-CD1 3.92Å; T28-I32 WeakPolarHBondContact O-CB 3.28Å; T28-I32 VanDerWaalsContact O-CG1 3.27Å; T28-I32 WeakPolarHBondContact O-CG1 3.44Å; T28-I32 PolarHBondContact O-N 3.43Å
29	I	86.8	Confident	79.1	Confident	102 Å²	102	96.4 Å²	96.4	52%	0.523	50%	0.501	S	S	.	.	H	α-helix	trans	-64.4	-43.6	175.2	-68.7	164.8	0	0	0	110.5	A25 S26 Y31 I32 L33	A25-I29 VanDerWaalsContact O-CG1 3.32Å; A25-I29 WeakPolarHBondContact O-CG1 3.36Å; A25-I29 PolarHBondContact O-N 3.42Å; S26-I29 PolarHBondContact O-N 3.01Å; I29-Y31 VanDerWaalsContact C-N 3.34Å; I29-Y31 PolarHBondContact O-N 3.14Å; I29-I32 PolarHBondContact O-N 2.74Å; I29-L33 HydrophobicContact CG2-CD1 3.88Å; I29-L33 HydrophobicContact CG2-CG 4.32Å; I29-L33 WeakPolarHBondContact O-CB 3.34Å; I29-L33 VanDerWaalsContact O-CG 3.3Å; I29-L33 WeakPolarHBondContact O-CG 3.21Å; I29-L33 PolarHBondContact O-N 2.73Å
30	A	84.1	Confident	78.7	Confident	58 Å²	58	95.8 Å²	95.8	48%	0.479	50%	0.503	S	S	.	.	H	α-helix	trans	-62.2	-39.9	175.2	0	0	0	0	0	112	S26 A27 L33 Y34	S26-A30 VanDerWaalsContact O-CB 3.25Å; S26-A30 WeakPolarHBondContact O-CB 3.39Å; S26-A30 PolarHBondContact O-N 2.65Å; A27-A30 PolarHBondContact O-N 2.67Å; A30-L33 PolarHBondContact O-N 3.33Å; A30-Y34 WeakPolarHBondContact O-CB 3.42Å; A30-Y34 PolarHBondContact O-N 3.36Å
31	Y	87.1	Confident	78.2	Confident	145 Å²	145	100.8 Å²	100.8	57%	0.569	51%	0.506	S	S	*	.	H	α-helix	trans	-66	-42.1	173.6	177.9	-99.4	0	0	0	112.2	A27 T28 I29 Y34 R35	A27-Y31 WeakPolarHBondContact O-CB 3.45Å; A27-Y31 PolarHBondContact O-N 3Å; T28-Y31 PolarHBondContact O-N 2.81Å; I29-Y31 VanDerWaalsContact C-N 3.34Å; I29-Y31 PolarHBondContact O-N 3.14Å; Y31-Y34 PolarHBondContact O-N 3.46Å; Y31-R35 WeakPolarHBondContact O-CB 3.37Å; Y31-R35 PolarHBondContact O-N 3Å
32	I	87.4	Confident	77.3	Confident	96 Å²	96	99.4 Å²	99.4	49%	0.492	50%	0.496	S	S	.	.	H	α-helix	trans	-65	-41.5	176	-70.7	166.2	0	0	0	110.9	T28 I29 R36	T28-I32 HydrophobicContact CG2-CD1 3.92Å; T28-I32 WeakPolarHBondContact O-CB 3.28Å; T28-I32 VanDerWaalsContact O-CG1 3.27Å; T28-I32 WeakPolarHBondContact O-CG1 3.44Å; T28-I32 PolarHBondContact O-N 3.43Å; I29-I32 PolarHBondContact O-N 2.74Å; I32-R36 WeakPolarHBondContact O-CB 3.5Å; I32-R36 PolarHBondContact O-N 3.44Å
33	L	86.2	Confident	76.2	Confident	113 Å²	113	104.5 Å²	104.5	59%	0.592	51%	0.51	S	S	*	.	H	α-helix	trans	-68	-42.7	176	-71.3	173.4	0	0	0	111.8	I29 A30 R36 Y37	I29-L33 HydrophobicContact CG2-CD1 3.88Å; I29-L33 HydrophobicContact CG2-CG 4.32Å; I29-L33 WeakPolarHBondContact O-CB 3.34Å; I29-L33 VanDerWaalsContact O-CG 3.3Å; I29-L33 WeakPolarHBondContact O-CG 3.21Å; I29-L33 PolarHBondContact O-N 2.73Å; A30-L33 PolarHBondContact O-N 3.33Å; L33-R36 PolarHBondContact O-N 2.93Å; L33-Y37 WeakPolarHBondContact O-CB 3.23Å; L33-Y37 PolarHBondContact O-N 2.89Å
34	Y	82.8	Confident	74.8	Confident	148 Å²	148	110.6 Å²	110.6	58%	0.58	53%	0.527	S	S	*	.	H	α-helix	trans	-63.9	-44.7	174.8	174.8	-101.7	0	0	0	111.7	A30 Y31 Y37 R38	A30-Y34 WeakPolarHBondContact O-CB 3.42Å; A30-Y34 PolarHBondContact O-N 3.36Å; Y31-Y34 PolarHBondContact O-N 3.46Å; Y34-Y37 PolarHBondContact O-N 2.94Å; Y34-R38 VanDerWaalsContact O-CB 3.31Å; Y34-R38 WeakPolarHBondContact O-CB 3.36Å; Y34-R38 PolarHBondContact O-N 3.32Å
35	R	82.9	Confident	73.2	Confident	128 Å²	128	112.5 Å²	112.5	48%	0.483	53%	0.532	S	S	.	.	H	α-helix	trans	-60.8	-50	175.7	178.3	177.8	168.2	163.9	3.9	110.7	Y31 Y37 R38 E39	Y31-R35 WeakPolarHBondContact O-CB 3.37Å; Y31-R35 PolarHBondContact O-N 3Å; R35-Y37 PolarHBondContact O-N 3.33Å; R35-R38 WeakPolarHBondContact O-CB 3.46Å; R35-R38 PolarHBondContact O-N 2.9Å; R35-E39 HydrophobicContact CG-CG 4.39Å; R35-E39 IonicContact CZ-OE1 2.75Å; R35-E39 IonicContact NE-OE1 2.86Å; R35-E39 PolarHBondContact NE-OE1 3.13Å; R35-E39 IonicContact NE-OE2 2.7Å; R35-E39 IonicContact NH2-OE1 3.11Å; R35-E39 PolarHBondContact NH2-OE1 3.25Å; R35-E39 WeakPolarHBondContact O-CB 3.47Å; R35-E39 WeakPolarHBondContact O-CG 3.5Å; R35-E39 PolarHBondContact O-N 2.98Å
36	R	79.3	Confident	71.6	Confident	176 Å²	176	115 Å²	115	66%	0.664	54%	0.543	S	S	*	.	H	α-helix	trans	-65.3	-37.2	178.1	-169.2	174.1	-174.4	170	2.9	112.5	I32 L33 S40	I32-R36 WeakPolarHBondContact O-CB 3.5Å; I32-R36 PolarHBondContact O-N 3.44Å; L33-R36 PolarHBondContact O-N 2.93Å; R36-S40 VanDerWaalsContact O-CB 3.28Å; R36-S40 WeakPolarHBondContact O-CB 3.37Å; R36-S40 PolarHBondContact O-N 3.45Å; R36-S40 PolarHBondContact O-OG 3.28Å; R36-S40 VanDerWaalsContact O-OG 3.09Å
37	Y	76.9	Confident	70.2	Confident	147 Å²	147	120.2 Å²	120.2	58%	0.576	56%	0.557	S	S	*	*	H	α-helix	trans	-65.3	-38.3	173.3	175.1	-104.3	0	0	0	112	L33 Y34 R35 R41	L33-Y37 WeakPolarHBondContact O-CB 3.23Å; L33-Y37 PolarHBondContact O-N 2.89Å; Y34-Y37 PolarHBondContact O-N 2.94Å; R35-Y37 PolarHBondContact O-N 3.33Å; Y37-R41 WeakPolarHBondContact O-CB 3.25Å; Y37-R41 WeakPolarHBondContact O-CG 3.44Å; Y37-R41 PolarHBondContact O-N 2.91Å
38	R	75.7	Confident	68.7	Low	135 Å²	135	121.4 Å²	121.4	51%	0.509	56%	0.558	S	S	.	*	H	α-helix	trans	-66.9	-50.7	173.5	178.8	-179.6	172.4	177.2	-2	111.4	Y34 R35 S40 R41 E42	Y34-R38 VanDerWaalsContact O-CB 3.31Å; Y34-R38 WeakPolarHBondContact O-CB 3.36Å; Y34-R38 PolarHBondContact O-N 3.32Å; R35-R38 WeakPolarHBondContact O-CB 3.46Å; R35-R38 PolarHBondContact O-N 2.9Å; R38-S40 PolarHBondContact O-N 3.45Å; R38-R41 CarbonylContact O-C 3.56Å; R38-R41 WeakPolarHBondContact O-CA 3.43Å; R38-R41 WeakPolarHBondContact O-CB 3.39Å; R38-R41 PolarHBondContact O-N 2.96Å; R38-E42 IonicContact CZ-OE1 2.72Å; R38-E42 VanDerWaalsContact CZ-OE1 3.26Å; R38-E42 IonicContact NE-OE1 2.68Å; R38-E42 PolarHBondContact NE-OE1 2.81Å; R38-E42 IonicContact NE-OE2 3.25Å; R38-E42 IonicContact NH2-OE1 3.49Å; R38-E42 PolarHBondContact NH2-OE1 2.78Å; R38-E42 PolarHBondContact O-N 3.07Å
39	E	67	Low	67.5	Low	70 Å²	70	119.1 Å²	119.1	33%	0.327	55%	0.55	S	S	.	.	H	α-helix	trans	-56.6	-48.5	176.7	-72.7	166.1	157.5	0	0	109.9	R35 R41 E42 E43	R35-E39 HydrophobicContact CG-CG 4.39Å; R35-E39 IonicContact CZ-OE1 2.75Å; R35-E39 IonicContact NE-OE1 2.86Å; R35-E39 PolarHBondContact NE-OE1 3.13Å; R35-E39 IonicContact NE-OE2 2.7Å; R35-E39 IonicContact NH2-OE1 3.11Å; R35-E39 PolarHBondContact NH2-OE1 3.25Å; R35-E39 WeakPolarHBondContact O-CB 3.47Å; R35-E39 WeakPolarHBondContact O-CG 3.5Å; R35-E39 PolarHBondContact O-N 2.98Å; E39-R41 PolarHBondContact O-N 3.45Å; E39-E42 PolarHBondContact O-N 3.46Å; E39-E42 VanDerWaalsContact O-N 3.07Å; E39-E43 WeakPolarHBondContact O-CB 3.42Å; E39-E43 WeakPolarHBondContact O-CG 3.42Å; E39-E43 PolarHBondContact O-N 2.8Å
40	S	59.9	Low	66.2	Low	58 Å²	58	122.3 Å²	122.3	41%	0.406	56%	0.563	S	S	.	*	H	α-helix	trans	-67.4	-13.3	174.5	-63.7	0	0	0	0	115.3	R36 R38	R36-S40 VanDerWaalsContact O-CB 3.28Å; R36-S40 WeakPolarHBondContact O-CB 3.37Å; R36-S40 PolarHBondContact O-N 3.45Å; R36-S40 PolarHBondContact O-OG 3.28Å; R36-S40 VanDerWaalsContact O-OG 3.09Å; R38-S40 PolarHBondContact O-N 3.45Å
41	R	58.5	Low	66	Low	157 Å²	157	125.8 Å²	125.8	59%	0.592	57%	0.573	S	S	*	*	H	α-helix	trans	-89.2	-28.8	169.4	-87.4	-157.9	63.8	171.1	-2.4	113	Y37 R38 E39	Y37-R41 WeakPolarHBondContact O-CB 3.25Å; Y37-R41 WeakPolarHBondContact O-CG 3.44Å; Y37-R41 PolarHBondContact O-N 2.91Å; R38-R41 CarbonylContact O-C 3.56Å; R38-R41 WeakPolarHBondContact O-CA 3.43Å; R38-R41 WeakPolarHBondContact O-CB 3.39Å; R38-R41 PolarHBondContact O-N 2.96Å; E39-R41 PolarHBondContact O-N 3.45Å
42	E	52.7	Low	65.9	Low	94 Å²	94	124.1 Å²	124.1	44%	0.439	57%	0.574	S	S	.	*	H	α-helix	trans	-79.6	-40.5	174.9	-71.9	168.4	167.1	0	0	110.1	R38 E39 R44 L45	R38-E42 IonicContact CZ-OE1 2.72Å; R38-E42 VanDerWaalsContact CZ-OE1 3.26Å; R38-E42 IonicContact NE-OE1 2.68Å; R38-E42 PolarHBondContact NE-OE1 2.81Å; R38-E42 IonicContact NE-OE2 3.25Å; R38-E42 IonicContact NH2-OE1 3.49Å; R38-E42 PolarHBondContact NH2-OE1 2.78Å; R38-E42 PolarHBondContact O-N 3.07Å; E39-E42 PolarHBondContact O-N 3.46Å; E39-E42 VanDerWaalsContact O-N 3.07Å; E42-R44 VanDerWaalsContact C-N 3.33Å; E42-R44 PolarHBondContact O-N 3.19Å; E42-L45 WeakPolarHBondContact O-CB 3.43Å; E42-L45 PolarHBondContact O-N 2.84Å; E42-L45 VanDerWaalsContact O-N 3.11Å
43	E	47.6	Very low	66	Low	142 Å²	142	122.3 Å²	122.3	66%	0.664	57%	0.565	S	S	*	*	G	3₁₀ helix	trans	-63.4	-29.8	174.3	-73.4	179.8	146.1	0	0	113.9	E39 L45	E39-E43 WeakPolarHBondContact O-CB 3.42Å; E39-E43 WeakPolarHBondContact O-CG 3.42Å; E39-E43 PolarHBondContact O-N 2.8Å; E43-L45 PolarHBondContact O-N 2.81Å; E43-L45 VanDerWaalsContact O-N 3.16Å
44	R	46.4	Very low	66.3	Low	229 Å²	229	122.5 Å²	122.5	86%	0.864	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-77.6	10.8	175.3	-156.5	-176	-81	-150.9	-5	112.9	E42	E42-R44 VanDerWaalsContact C-N 3.33Å; E42-R44 PolarHBondContact O-N 3.19Å
45	L	49.9	Very low	66.7	Low	114 Å²	114	118.1 Å²	118.1	60%	0.597	55%	0.549	S	S	*	.	G	3₁₀ helix	trans	-126.4	3.1	-172.4	-117	160.4	0	0	0	114.4	E42 E43	E42-L45 WeakPolarHBondContact O-CB 3.43Å; E42-L45 PolarHBondContact O-N 2.84Å; E42-L45 VanDerWaalsContact O-N 3.11Å; E43-L45 PolarHBondContact O-N 2.81Å; E43-L45 VanDerWaalsContact O-N 3.16Å
46	T	45.8	Very low	67.2	Low	102 Å²	102	118.3 Å²	118.3	63%	0.626	56%	0.555	S	S	*	*			trans	-116.3	41.7	-175.6	50	0	0	0	0	114.6	V48	T46-V48 PolarHBondContact O-N 3.46Å
47	F	49	Very low	67.8	Low	177 Å²	177	110.7 Å²	110.7	78%	0.776	53%	0.527	S	S	*	.			trans	-77.4	68.3	149.6	-163.4	-92.1	0	0	0	108.9	P105	F47-P105 HydrophobicContact CD1-CB 4.27Å
48	V	53.4	Low	68.4	Low	81 Å²	81	110.3 Å²	110.3	49%	0.491	53%	0.525	S	S	.	.			trans	-112	96.1	175.6	176.8	0	0	0	0	106.6	T46 E50 V106	T46-V48 PolarHBondContact O-N 3.46Å; V48-E50 HydrophobicContact CG1-CG 4.28Å; V48-V106 HydrophobicContact CG2-CG2 4.48Å
49	G	57.9	Low	69.2	Low	29 Å²	29	103.9 Å²	103.9	30%	0.299	50%	0.501	S	S	.	.			trans	-66.3	133.5	140.5	0	0	0	0	0	107.1
50	E	60.8	Low	70.2	Confident	170 Å²	170	103.6 Å²	103.6	79%	0.794	51%	0.505	S	S	*	.	S	Bend	trans	-75.4	-13.8	168.7	-63.5	-171	139.5	0	0	111.1	V48 F104	V48-E50 HydrophobicContact CG1-CG 4.28Å; E50-F104 WeakPolarHBondContact O-CE1 3.35Å
51	D	79.1	Confident	71.5	Confident	130 Å²	130	104 Å²	104	70%	0.695	50%	0.5	S	S	*	.	S	Bend	trans	-71.8	138.8	170.3	-51.2	-68	0	0	0	111.5
52	D	85.3	Confident	72.6	Confident	111 Å²	111	102.3 Å²	102.3	59%	0.594	50%	0.499	S	S	*	.			trans	-63	134.3	165.2	-81.6	-36.4	0	0	0	109.7	G103 F104	D52-G103 WeakPolarHBondContact OD1-CA 3.36Å; D52-F104 PolarHBondContact OD1-N 2.79Å
53	I	89.1	Confident	74.1	Confident	58 Å²	58	98.6 Å²	98.6	30%	0.297	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.5	152.6	171.7	67	172	0	0	0	109.8	I55 S102 G103 P105 V108	I53-I55 HydrophobicContact CD1-CD1 3.93Å; I53-I55 HydrophobicContact CD1-CG1 4.38Å; I53-S102 VanDerWaalsContact O-CA 3.25Å; I53-S102 WeakPolarHBondContact O-CA 3.25Å; I53-G103 PolarHBondContact N-O 3.4Å; I53-G103 PolarHBondContact O-N 3.25Å; I53-P105 HydrophobicContact CD1-CB 3.93Å; I53-P105 HydrophobicContact CD1-CG 4.02Å; I53-P105 HydrophobicContact CG1-CG 4.22Å; I53-P105 HydrophobicContact CG2-CG 4.12Å; I53-V108 HydrophobicContact CD1-CB 4.41Å; I53-V108 HydrophobicContact CD1-CG1 4.48Å; I53-V108 HydrophobicContact CG1-CB 4.32Å; I53-V108 HydrophobicContact CG1-CG2 4.02Å
54	E	92.2	Very high	76.1	Confident	116 Å²	116	92.3 Å²	92.3	54%	0.542	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	131.9	174.7	-171.1	149.3	-110	0	0	109.6	L100 I101 S102	E54-L100 HydrophobicContact CG-CD1 3.56Å; E54-L100 HydrophobicContact CG-CD2 4.42Å; E54-L100 HydrophobicContact CG-CG 3.83Å; E54-I101 WeakPolarHBondContact CA-O 3.14Å; E54-S102 WeakPolarHBondContact OE1-CB 3.45Å; E54-S102 PolarHBondContact OE1-OG 3.5Å
55	I	91.8	Very high	78	Confident	56 Å²	56	88.4 Å²	88.4	29%	0.287	45%	0.445	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.2	125.8	-174.5	-65.3	-171.9	0	0	0	109.8	I53 I101 V108	I53-I55 HydrophobicContact CD1-CD1 3.93Å; I53-I55 HydrophobicContact CD1-CG1 4.38Å; I55-I101 PolarHBondContact N-O 2.86Å; I55-I101 PolarHBondContact O-N 3.45Å; I55-V108 HydrophobicContact CB-CG1 4.06Å; I55-V108 HydrophobicContact CD1-CG1 3.8Å; I55-V108 HydrophobicContact CG1-CG1 4.03Å
56	E	92.8	Very high	79.7	Confident	132 Å²	132	86.8 Å²	86.8	62%	0.617	44%	0.437	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.6	139.6	165.1	-67.6	172.5	-151.3	0	0	111.3	V98 L99 L100	E56-V98 HydrophobicContact CB-CG1 4.01Å; E56-V98 HydrophobicContact CG-CG1 3.98Å; E56-L99 CarbonylContact C-O 3.51Å; E56-L99 WeakPolarHBondContact CA-O 3.25Å; E56-L100 HydrophobicContact CG-CD1 4.2Å
57	M	91.3	Very high	81.9	Confident	17 Å²	17	82 Å²	82	8%	0.084	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139	125.9	169.7	-178	178.7	72.8	0	0	110	V59 L99 I101 K112 I115	M57-V59 HydrophobicContact CE-CG1 4.05Å; M57-L99 HydrophobicContact CE-CD1 3.81Å; M57-L99 PolarHBondContact N-O 2.97Å; M57-L99 WeakPolarHBondContact O-CB 3.31Å; M57-L99 PolarHBondContact O-N 3.33Å; M57-I101 HydrophobicContact CB-CD1 4.42Å; M57-I101 HydrophobicContact CE-CD1 3.95Å; M57-I101 HydrophobicContact SD-CD1 4.46Å; M57-K112 HydrophobicContact SD-CD 4.46Å; M57-K112 HydrophobicContact SD-CG 3.86Å; M57-I115 HydrophobicContact CE-CB 3.73Å; M57-I115 HydrophobicContact CE-CD1 3.87Å; M57-I115 HydrophobicContact CE-CG1 4.42Å; M57-I115 HydrophobicContact CE-CG2 3.35Å
58	R	91.3	Very high	83.9	Confident	139 Å²	139	76.3 Å²	76.3	53%	0.525	38%	0.384	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.7	141.9	179	-53.6	-169.4	-172.4	179.5	-2.1	110.9	E96	R58-E96 HydrophobicContact CB-CB 4.28Å; R58-E96 WeakPolarHBondContact CD-OE2 3.34Å; R58-E96 IonicContact NE-OE2 2.78Å; R58-E96 IonicContact NH1-OE2 2.81Å; R58-E96 PolarHBondContact NH1-OE2 3.16Å
59	V	91.1	Very high	85.5	Confident	0 Å²	0	73.5 Å²	73.5	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.3	150	178	-55.9	0	0	0	0	110.6	M57 V64 I67 E96 R97 L99 L119	M57-V59 HydrophobicContact CE-CG1 4.05Å; V59-V64 HydrophobicContact CG2-CG2 3.6Å; V59-I67 HydrophobicContact CB-CD1 4.48Å; V59-I67 HydrophobicContact CG1-CD1 4.28Å; V59-I67 HydrophobicContact CG2-CD1 4.24Å; V59-E96 CarbonylContact O-C 3.18Å; V59-E96 WeakPolarHBondContact O-CA 3.43Å; V59-R97 PolarHBondContact N-O 2.78Å; V59-R97 PolarHBondContact O-N 3.07Å; V59-L99 HydrophobicContact CG1-CD1 3.69Å; V59-L99 HydrophobicContact CG1-CG 4.33Å; V59-L99 HydrophobicContact CG2-CD1 3.94Å; V59-L99 HydrophobicContact CG2-CG 4.06Å; V59-L119 HydrophobicContact CB-CD1 4.34Å; V59-L119 HydrophobicContact CB-CD2 4.13Å; V59-L119 HydrophobicContact CG1-CD1 3.7Å; V59-L119 HydrophobicContact CG1-CD2 4.21Å; V59-L119 HydrophobicContact CG1-CG 4.5Å
60	P	88.8	Confident	87	Confident	63 Å²	63	83.2 Å²	83.2	41%	0.409	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-58.7	138.9	173	-24.1	34.5	0	0	0	112	E62 A63 V64	P60-E62 PolarHBondContact O-N 2.82Å; P60-E62 VanDerWaalsContact O-N 3.14Å; P60-A63 PolarHBondContact O-N 3.45Å; P60-V64 PolarHBondContact O-N 3.47Å
61	Q	85.9	Confident	88.2	Confident	67 Å²	67	84 Å²	84	31%	0.313	40%	0.403	S	S	.	.	H	α-helix	trans	-56.5	-33.1	-174.5	-163.9	-166.2	77.2	0	0	113	A63 V64 D92 D95	Q61-A63 VanDerWaalsContact C-N 3.34Å; Q61-A63 PolarHBondContact O-N 3.27Å; Q61-V64 WeakPolarHBondContact O-CB 3.09Å; Q61-V64 PolarHBondContact O-N 2.86Å; Q61-D92 PolarHBondContact NE2-OD1 3.49Å; Q61-D92 PolarHBondContact NE2-OD2 2.69Å; Q61-D92 VanDerWaalsContact NE2-OD2 3.13Å; Q61-D95 PolarHBondContact N-O 3.47Å
62	E	82.9	Confident	88.8	Confident	122 Å²	122	78.4 Å²	78.4	57%	0.57	38%	0.375	S	S	*	.	H	α-helix	trans	-62.4	-42.6	178.3	-60.7	63.1	-133.8	0	0	110.9	P60 K65	P60-E62 PolarHBondContact O-N 2.82Å; P60-E62 VanDerWaalsContact O-N 3.14Å; E62-K65 PolarHBondContact O-N 2.83Å
63	A	84.6	Confident	89.1	Confident	16 Å²	16	76 Å²	76	13%	0.132	37%	0.371	C	S	.	.	H	α-helix	trans	-76.1	-22.7	-174.8	0	0	0	0	0	112.8	P60 Q61 K65 L66 I67 L119	P60-A63 PolarHBondContact O-N 3.45Å; Q61-A63 VanDerWaalsContact C-N 3.34Å; Q61-A63 PolarHBondContact O-N 3.27Å; A63-K65 PolarHBondContact O-N 3.27Å; A63-L66 WeakPolarHBondContact O-CB 3.3Å; A63-L66 PolarHBondContact O-N 3.45Å; A63-I67 WeakPolarHBondContact O-CG1 3.39Å; A63-I67 PolarHBondContact O-N 3.49Å; A63-L119 HydrophobicContact CB-CD2 3.48Å; A63-L119 VanDerWaalsContact CB-CD2 3.48Å
64	V	88.1	Confident	89.3	Confident	10 Å²	10	75.7 Å²	75.7	6%	0.061	37%	0.37	C	S	.	.	H	α-helix	trans	-53.1	-40.1	173.3	-177.9	0	0	0	0	111.1	V59 P60 Q61 L66 I67 I68 V88 R97	V59-V64 HydrophobicContact CG2-CG2 3.6Å; P60-V64 PolarHBondContact O-N 3.47Å; Q61-V64 WeakPolarHBondContact O-CB 3.09Å; Q61-V64 PolarHBondContact O-N 2.86Å; V64-L66 VanDerWaalsContact C-N 3.27Å; V64-L66 PolarHBondContact O-N 2.89Å; V64-I67 PolarHBondContact O-N 3.4Å; V64-I68 HydrophobicContact CG1-CD1 3.73Å; V64-I68 HydrophobicContact CG1-CG1 4.27Å; V64-I68 WeakPolarHBondContact O-CG1 3.27Å; V64-I68 PolarHBondContact O-N 2.7Å; V64-V88 HydrophobicContact CG1-CG1 3.88Å; V64-R97 HydrophobicContact CG2-CB 3.91Å; V64-R97 HydrophobicContact CG2-CG 4.39Å
65	K	87.3	Confident	89.3	Confident	147 Å²	147	70.8 Å²	70.8	64%	0.639	35%	0.347	S	S	*	.	H	α-helix	trans	-63.9	-31.8	179.5	-67.1	165.1	-175.5	157.2	0	112.3	E62 A63 G69	E62-K65 PolarHBondContact O-N 2.83Å; A63-K65 PolarHBondContact O-N 3.27Å; K65-G69 WeakPolarHBondContact O-CA 3.48Å; K65-G69 PolarHBondContact O-N 3.47Å
66	L	86	Confident	89.4	Confident	80 Å²	80	74.6 Å²	74.6	42%	0.419	36%	0.362	S	S	.	.	H	α-helix	trans	-76.7	-41.2	175.6	-59.4	172.6	0	0	0	111.5	A63 V64 G69 N74 N122	A63-L66 WeakPolarHBondContact O-CB 3.3Å; A63-L66 PolarHBondContact O-N 3.45Å; V64-L66 VanDerWaalsContact C-N 3.27Å; V64-L66 PolarHBondContact O-N 2.89Å; L66-G69 PolarHBondContact O-N 3.47Å; L66-N74 PolarHBondContact O-ND2 3.03Å; L66-N122 HydrophobicContact CD1-CB 3.58Å
67	I	90.5	Very high	89.5	Confident	1 Å²	1	73 Å²	73	1%	0.005	35%	0.354	C	S	.	.	H	α-helix	trans	-63.8	-42.2	177.2	-64	164	0	0	0	111	V59 A63 V64 N74 I75 L78 L99 I115 I118 L119	V59-I67 HydrophobicContact CB-CD1 4.48Å; V59-I67 HydrophobicContact CG1-CD1 4.28Å; V59-I67 HydrophobicContact CG2-CD1 4.24Å; A63-I67 WeakPolarHBondContact O-CG1 3.39Å; A63-I67 PolarHBondContact O-N 3.49Å; V64-I67 PolarHBondContact O-N 3.4Å; I67-N74 CarbonylContact O-C 3.56Å; I67-N74 WeakPolarHBondContact O-CB 3.44Å; I67-I75 PolarHBondContact O-N 3.22Å; I67-I75 VanDerWaalsContact O-N 3.12Å; I67-L78 HydrophobicContact CG2-CD1 4.13Å; I67-L99 HydrophobicContact CD1-CD1 3.98Å; I67-L99 HydrophobicContact CG2-CD1 4.48Å; I67-I115 HydrophobicContact CD1-CG2 3.57Å; I67-I115 HydrophobicContact CG1-CG2 4.06Å; I67-I115 HydrophobicContact CG2-CG1 4.49Å; I67-I118 HydrophobicContact CG1-CG2 4.17Å; I67-L119 HydrophobicContact CD1-CD2 3.95Å
68	I	91	Very high	89.6	Confident	57 Å²	57	72.4 Å²	72.4	29%	0.292	35%	0.352	S	S	.	.	H	α-helix	trans	-68.6	-50.3	173.5	-64.3	173.7	0	0	0	110.4	V64 G72 A73 N74 I75 V88	V64-I68 HydrophobicContact CG1-CD1 3.73Å; V64-I68 HydrophobicContact CG1-CG1 4.27Å; V64-I68 WeakPolarHBondContact O-CG1 3.27Å; V64-I68 PolarHBondContact O-N 2.7Å; I68-G72 CarbonylContact O-C 3.5Å; I68-G72 VanDerWaalsContact O-CA 3.24Å; I68-G72 WeakPolarHBondContact O-CA 3.3Å; I68-A73 PolarHBondContact O-N 3.25Å; I68-N74 PolarHBondContact O-N 2.82Å; I68-N74 VanDerWaalsContact O-N 3.09Å; I68-I75 HydrophobicContact CB-CG2 4.48Å; I68-I75 HydrophobicContact CG2-CG2 4.26Å; I68-I75 PolarHBondContact O-N 3.26Å; I68-I75 VanDerWaalsContact O-N 3.16Å; I68-V88 HydrophobicContact CD1-CG2 4.19Å; I68-V88 HydrophobicContact CG1-CG2 4.21Å
69	G	87.1	Confident	89.8	Confident	22 Å²	22	70.3 Å²	70.3	23%	0.227	34%	0.344	C	S	.	.			trans	71.8	171.9	-175.8	0	0	0	0	0	113.8	K65 L66 Q71 G72	K65-G69 WeakPolarHBondContact O-CA 3.48Å; K65-G69 PolarHBondContact O-N 3.47Å; L66-G69 PolarHBondContact O-N 3.47Å; G69-Q71 PolarHBondContact O-N 3.21Å; G69-G72 PolarHBondContact O-N 3.33Å
70	R	89.1	Confident	89.9	Confident	233 Å²	233	78.7 Å²	78.7	88%	0.879	38%	0.38	S	S	*	.	G	3₁₀ helix	trans	-55.5	127.7	179.8	-62.4	-177.9	-174.5	170.4	3	110.2	G72 A73	R70-G72 PolarHBondContact O-N 2.91Å; R70-G72 VanDerWaalsContact O-N 3.09Å; R70-A73 VanDerWaalsContact O-CB 3.25Å; R70-A73 WeakPolarHBondContact O-CB 3.32Å; R70-A73 PolarHBondContact O-N 3.04Å
71	Q	87.7	Confident	90.2	Very high	188 Å²	188	82.2 Å²	82.2	88%	0.879	39%	0.391	S	S	*	.	G	3₁₀ helix	trans	53.4	24.8	-177.2	-54.7	-178.6	4.7	0	0	115	G69 A73 K76	G69-Q71 PolarHBondContact O-N 3.21Å; Q71-A73 VanDerWaalsContact C-N 3.25Å; Q71-A73 PolarHBondContact O-N 2.98Å; Q71-K76 PolarHBondContact O-NZ 2.8Å
72	G	90.3	Very high	90.6	Very high	11 Å²	11	79.6 Å²	79.6	11%	0.113	38%	0.38	C	S	.	.	G	3₁₀ helix	trans	70.5	17.1	-176	0	0	0	0	0	114.2	I68 G69 R70 N74 I75 K76	I68-G72 CarbonylContact O-C 3.5Å; I68-G72 VanDerWaalsContact O-CA 3.24Å; I68-G72 WeakPolarHBondContact O-CA 3.3Å; G69-G72 PolarHBondContact O-N 3.33Å; R70-G72 PolarHBondContact O-N 2.91Å; R70-G72 VanDerWaalsContact O-N 3.09Å; G72-N74 VanDerWaalsContact C-N 3.34Å; G72-N74 PolarHBondContact O-N 3.03Å; G72-I75 WeakPolarHBondContact O-CG2 3.41Å; G72-K76 WeakPolarHBondContact O-CB 3.45Å; G72-K76 VanDerWaalsContact O-CD 3.27Å; G72-K76 WeakPolarHBondContact O-CD 3.23Å; G72-K76 WeakPolarHBondContact O-CG 3.36Å; G72-K76 PolarHBondContact O-N 3.39Å
73	A	91.9	Very high	91	Very high	60 Å²	60	75.8 Å²	75.8	50%	0.496	37%	0.374	S	S	.	.	H	α-helix	trans	-62.4	-38.5	-175.7	0	0	0	0	0	112.9	I68 R70 Q71 Q77	I68-A73 PolarHBondContact O-N 3.25Å; R70-A73 VanDerWaalsContact O-CB 3.25Å; R70-A73 WeakPolarHBondContact O-CB 3.32Å; R70-A73 PolarHBondContact O-N 3.04Å; Q71-A73 VanDerWaalsContact C-N 3.25Å; Q71-A73 PolarHBondContact O-N 2.98Å; A73-Q77 WeakPolarHBondContact O-CB 3.3Å; A73-Q77 PolarHBondContact O-N 3.3Å
74	N	93.1	Very high	91.5	Very high	53 Å²	53	75.2 Å²	75.2	28%	0.283	37%	0.369	S	S	.	.	H	α-helix	trans	-73.4	-43.7	-177.1	-166	24.2	0	0	0	111.4	L66 I67 I68 G72 K76 Q77 L78	L66-N74 PolarHBondContact O-ND2 3.03Å; I67-N74 CarbonylContact O-C 3.56Å; I67-N74 WeakPolarHBondContact O-CB 3.44Å; I68-N74 PolarHBondContact O-N 2.82Å; I68-N74 VanDerWaalsContact O-N 3.09Å; G72-N74 VanDerWaalsContact C-N 3.34Å; G72-N74 PolarHBondContact O-N 3.03Å; N74-K76 VanDerWaalsContact C-N 3.32Å; N74-K76 PolarHBondContact O-N 2.89Å; N74-Q77 WeakPolarHBondContact O-CB 3.44Å; N74-Q77 PolarHBondContact O-N 2.88Å; N74-Q77 VanDerWaalsContact O-N 3.12Å; N74-L78 PolarHBondContact O-N 3.06Å
75	I	93.4	Very high	91.8	Very high	13 Å²	13	82.1 Å²	82.1	7%	0.067	39%	0.394	C	S	.	.	H	α-helix	trans	-67	-31.6	175.4	-166.8	166.4	0	0	0	112.6	I67 I68 G72 R79 I86 V88	I67-I75 PolarHBondContact O-N 3.22Å; I67-I75 VanDerWaalsContact O-N 3.12Å; I68-I75 HydrophobicContact CB-CG2 4.48Å; I68-I75 HydrophobicContact CG2-CG2 4.26Å; I68-I75 PolarHBondContact O-N 3.26Å; I68-I75 VanDerWaalsContact O-N 3.16Å; G72-I75 WeakPolarHBondContact O-CG2 3.41Å; I75-R79 WeakPolarHBondContact O-CB 3.36Å; I75-R79 VanDerWaalsContact O-CG 3.23Å; I75-R79 WeakPolarHBondContact O-CG 3.48Å; I75-R79 PolarHBondContact O-N 2.94Å; I75-I86 HydrophobicContact CD1-CG2 4.2Å; I75-I86 WeakPolarHBondContact CD1-O 3.38Å; I75-I86 HydrophobicContact CG1-CG2 4.41Å; I75-V88 HydrophobicContact CD1-CG2 3.79Å
76	K	93.7	Very high	92.1	Very high	135 Å²	135	75.1 Å²	75.1	59%	0.587	36%	0.363	S	S	*	.	H	α-helix	trans	-64.7	-42.1	169.5	-71.8	163	-172.4	163	0	111.8	Q71 G72 N74 K80	Q71-K76 PolarHBondContact O-NZ 2.8Å; G72-K76 WeakPolarHBondContact O-CB 3.45Å; G72-K76 VanDerWaalsContact O-CD 3.27Å; G72-K76 WeakPolarHBondContact O-CD 3.23Å; G72-K76 WeakPolarHBondContact O-CG 3.36Å; G72-K76 PolarHBondContact O-N 3.39Å; N74-K76 VanDerWaalsContact C-N 3.32Å; N74-K76 PolarHBondContact O-N 2.89Å; K76-K80 WeakPolarHBondContact O-CB 3.21Å; K76-K80 PolarHBondContact O-N 2.94Å
77	Q	93.4	Very high	92.4	Very high	98 Å²	98	73.4 Å²	73.4	46%	0.458	36%	0.355	S	S	.	.	H	α-helix	trans	-62.3	-48.5	174.8	-172.9	82	-11.8	0	0	111.2	A73 N74 K80 Q81	A73-Q77 WeakPolarHBondContact O-CB 3.3Å; A73-Q77 PolarHBondContact O-N 3.3Å; N74-Q77 WeakPolarHBondContact O-CB 3.44Å; N74-Q77 PolarHBondContact O-N 2.88Å; N74-Q77 VanDerWaalsContact O-N 3.12Å; Q77-K80 PolarHBondContact O-N 2.87Å; Q77-Q81 WeakPolarHBondContact O-CB 3.39Å; Q77-Q81 WeakPolarHBondContact O-CG 3.49Å; Q77-Q81 PolarHBondContact O-N 3.17Å
78	L	94.1	Very high	92.4	Very high	6 Å²	6	75.4 Å²	75.4	3%	0.031	37%	0.367	C	S	.	.	H	α-helix	trans	-57.4	-52.3	177	-81.1	161.3	0	0	0	112.1	I67 N74 K80 Q81 T82 I86 A114 I115 I118	I67-L78 HydrophobicContact CG2-CD1 4.13Å; N74-L78 PolarHBondContact O-N 3.06Å; L78-K80 VanDerWaalsContact C-N 3.3Å; L78-K80 PolarHBondContact O-N 3.3Å; L78-Q81 PolarHBondContact O-N 3Å; L78-T82 WeakPolarHBondContact O-CB 3.29Å; L78-T82 WeakPolarHBondContact O-CG2 3.45Å; L78-T82 PolarHBondContact O-N 3.37Å; L78-T82 PolarHBondContact O-OG1 3.28Å; L78-I86 HydrophobicContact CB-CD1 3.94Å; L78-A114 HydrophobicContact CD2-CB 3.72Å; L78-I115 HydrophobicContact CD1-CG1 4.23Å; L78-I115 HydrophobicContact CD2-CG1 4.35Å; L78-I118 HydrophobicContact CD1-CD1 3.88Å; L78-I118 HydrophobicContact CD2-CD1 4.05Å; L78-I118 HydrophobicContact CG-CD1 4.33Å
79	R	94.8	Very high	92.1	Very high	94 Å²	94	76 Å²	76	36%	0.355	37%	0.37	S	S	.	.	H	α-helix	trans	-55.5	-45.6	175.8	-70.7	171.6	-176.1	-160.3	5	111	I75 G83 I86 D87	I75-R79 WeakPolarHBondContact O-CB 3.36Å; I75-R79 VanDerWaalsContact O-CG 3.23Å; I75-R79 WeakPolarHBondContact O-CG 3.48Å; I75-R79 PolarHBondContact O-N 2.94Å; R79-G83 WeakPolarHBondContact O-CA 3.33Å; R79-G83 PolarHBondContact O-N 2.7Å; R79-I86 HydrophobicContact CG-CB 4.13Å; R79-I86 HydrophobicContact CG-CD1 4.16Å; R79-I86 HydrophobicContact CG-CG1 4.27Å; R79-I86 PolarHBondContact NE-O 3.07Å; R79-I86 PolarHBondContact NH2-O 3.41Å; R79-D87 IonicContact CZ-OD1 3.63Å; R79-D87 IonicContact NH1-OD1 3.39Å; R79-D87 IonicContact NH2-OD1 2.72Å; R79-D87 PolarHBondContact NH2-OD1 2.93Å
80	K	94.8	Very high	91.7	Very high	177 Å²	177	80.7 Å²	80.7	77%	0.77	40%	0.395	S	S	*	.	H	α-helix	trans	-65.5	-38.6	179.1	-175.4	-179.9	177.8	-176.3	0	113.9	K76 Q77 L78	K76-K80 WeakPolarHBondContact O-CB 3.21Å; K76-K80 PolarHBondContact O-N 2.94Å; Q77-K80 PolarHBondContact O-N 2.87Å; L78-K80 VanDerWaalsContact C-N 3.3Å; L78-K80 PolarHBondContact O-N 3.3Å
81	Q	94.1	Very high	91.3	Very high	137 Å²	137	76.5 Å²	76.5	64%	0.64	39%	0.385	S	S	*	.	H	α-helix	trans	-81	-32.8	-177.9	-74.4	-177.7	-24	0	0	113.3	Q77 L78	Q77-Q81 WeakPolarHBondContact O-CB 3.39Å; Q77-Q81 WeakPolarHBondContact O-CG 3.49Å; Q77-Q81 PolarHBondContact O-N 3.17Å; L78-Q81 PolarHBondContact O-N 3Å
82	T	94.3	Very high	91	Very high	11 Å²	11	70.8 Å²	70.8	7%	0.067	36%	0.361	C	S	.	.	H	α-helix	trans	-90.1	-29.6	-175.7	61.5	0	0	0	0	112.4	L78 A84 Q107 K110 A111	L78-T82 WeakPolarHBondContact O-CB 3.29Å; L78-T82 WeakPolarHBondContact O-CG2 3.45Å; L78-T82 PolarHBondContact O-N 3.37Å; L78-T82 PolarHBondContact O-OG1 3.28Å; T82-A84 PolarHBondContact OG1-N 2.71Å; T82-Q107 WeakPolarHBondContact O-CB 3.21Å; T82-Q107 WeakPolarHBondContact O-CG 3.45Å; T82-K110 HydrophobicContact CG2-CB 4.3Å; T82-A111 HydrophobicContact CG2-CB 3.94Å
83	G	92.2	Very high	90.6	Very high	43 Å²	43	73.9 Å²	73.9	44%	0.443	38%	0.377	S	S	.	.			trans	82.1	-8.8	-170.5	0	0	0	0	0	114	R79 Q107	R79-G83 WeakPolarHBondContact O-CA 3.33Å; R79-G83 PolarHBondContact O-N 2.7Å; G83-Q107 PolarHBondContact O-NE2 2.99Å; G83-Q107 PolarHBondContact O-OE1 3.49Å
84	A	94.4	Very high	90.2	Very high	4 Å²	4	73.8 Å²	73.8	3%	0.033	38%	0.382	C	S	.	.			trans	-83	149.9	-176.6	0	0	0	0	0	111.8	T82 I86 I101 Q107 A111	T82-A84 PolarHBondContact OG1-N 2.71Å; A84-I86 HydrophobicContact CB-CG1 4.37Å; A84-I101 HydrophobicContact CB-CG2 4.11Å; A84-Q107 HydrophobicContact CB-CB 4Å; A84-A111 HydrophobicContact CB-CB 3.87Å
85	R	93.8	Very high	89.7	Confident	155 Å²	155	77.9 Å²	77.9	59%	0.585	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73	133.7	159.1	-173.6	171.2	-178.9	158.8	-3.1	108	D87 I101 S102	R85-D87 IonicContact CZ-OD2 2.62Å; R85-D87 IonicContact NE-OD2 3.71Å; R85-D87 PolarHBondContact NE-OD2 2.94Å; R85-D87 IonicContact NH2-OD2 2.72Å; R85-D87 PolarHBondContact NH2-OD2 2.82Å; R85-I101 CarbonylContact O-C 3.59Å; R85-I101 WeakPolarHBondContact O-CA 3.33Å; R85-S102 WeakPolarHBondContact CB-O 3.18Å; R85-S102 PolarHBondContact N-O 3.03Å; R85-S102 PolarHBondContact O-N 3.32Å
86	I	94.6	Very high	89.5	Confident	0 Å²	0	81 Å²	81	0%	0	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	89	-178.4	-55.6	164.8	0	0	0	106.1	I75 L78 R79 A84 L100 I101 A111 I115	I75-I86 HydrophobicContact CD1-CG2 4.2Å; I75-I86 WeakPolarHBondContact CD1-O 3.38Å; I75-I86 HydrophobicContact CG1-CG2 4.41Å; L78-I86 HydrophobicContact CB-CD1 3.94Å; R79-I86 HydrophobicContact CG-CB 4.13Å; R79-I86 HydrophobicContact CG-CD1 4.16Å; R79-I86 HydrophobicContact CG-CG1 4.27Å; R79-I86 PolarHBondContact NE-O 3.07Å; R79-I86 PolarHBondContact NH2-O 3.41Å; A84-I86 HydrophobicContact CB-CG1 4.37Å; I86-L100 CarbonylContact C-O 3.58Å; I86-L100 WeakPolarHBondContact CA-O 3.33Å; I86-I101 HydrophobicContact CG1-CG2 4.3Å; I86-I101 HydrophobicContact CG2-CG1 4.43Å; I86-A111 HydrophobicContact CD1-CB 3.89Å; I86-A111 HydrophobicContact CG1-CB 4.16Å; I86-I115 HydrophobicContact CD1-CD1 4.35Å; I86-I115 HydrophobicContact CG2-CD1 4.02Å
87	D	91.2	Very high	89.3	Confident	44 Å²	44	76.7 Å²	76.7	24%	0.235	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.6	151.9	175.1	-74.5	-29.2	0	0	0	110.5	R79 R85 L100	R79-D87 IonicContact CZ-OD1 3.63Å; R79-D87 IonicContact NH1-OD1 3.39Å; R79-D87 IonicContact NH2-OD1 2.72Å; R79-D87 PolarHBondContact NH2-OD1 2.93Å; R85-D87 IonicContact CZ-OD2 2.62Å; R85-D87 IonicContact NE-OD2 3.71Å; R85-D87 PolarHBondContact NE-OD2 2.94Å; R85-D87 IonicContact NH2-OD2 2.72Å; R85-D87 PolarHBondContact NH2-OD2 2.82Å; D87-L100 PolarHBondContact N-O 3.4Å; D87-L100 PolarHBondContact O-N 2.86Å
88	V	90.4	Very high	89.2	Confident	43 Å²	43	72.7 Å²	72.7	26%	0.261	38%	0.38	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	125.4	-179.1	-173.9	0	0	0	0	106.1	V64 I68 I75 R97 L99	V64-V88 HydrophobicContact CG1-CG1 3.88Å; I68-V88 HydrophobicContact CD1-CG2 4.19Å; I68-V88 HydrophobicContact CG1-CG2 4.21Å; I75-V88 HydrophobicContact CD1-CG2 3.79Å; V88-R97 HydrophobicContact CG1-CG 4.35Å; V88-L99 HydrophobicContact CB-CD2 4.09Å; V88-L99 HydrophobicContact CG1-CD2 3.9Å; V88-L99 HydrophobicContact CG2-CD2 3.75Å
89	D	86.2	Confident	89.1	Confident	68 Å²	68	72.4 Å²	72.4	36%	0.364	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-61.5	147.9	175.9	-159.4	-28.7	0	0	0	109.9	E91 R97 V98	D89-E91 PolarHBondContact OD1-N 3.33Å; D89-E91 VanDerWaalsContact OD1-N 3.11Å; D89-R97 PolarHBondContact O-NH1 2.83Å; D89-V98 HydrophobicContact CB-CB 4.06Å; D89-V98 WeakPolarHBondContact CB-O 3.19Å; D89-V98 PolarHBondContact N-O 3.43Å
90	T	78.5	Confident	89	Confident	121 Å²	121	70.9 Å²	70.9	74%	0.742	38%	0.377	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-74.7	-30.3	173.9	29.4	0	0	0	0	113.1	R97	T90-R97 PolarHBondContact O-NH1 3.49Å; T90-R97 PolarHBondContact O-NH2 2.85Å; T90-R97 VanDerWaalsContact O-NH2 3.08Å
91	E	81	Confident	89.1	Confident	146 Å²	146	62.4 Å²	62.4	68%	0.682	34%	0.341	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.4	152.3	-177.7	-58.2	-167.2	174	0	0	112.5	D89	D89-E91 PolarHBondContact OD1-N 3.33Å; D89-E91 VanDerWaalsContact OD1-N 3.11Å
92	D	80.9	Confident	89	Confident	67 Å²	67	56.7 Å²	56.7	36%	0.358	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.9	141	172.7	-67.7	-65.5	0	0	0	110	Q61 R97	Q61-D92 PolarHBondContact NE2-OD1 3.49Å; Q61-D92 PolarHBondContact NE2-OD2 2.69Å; Q61-D92 VanDerWaalsContact NE2-OD2 3.13Å; D92-R97 IonicContact OD1-CZ 2.62Å; D92-R97 VanDerWaalsContact OD1-CZ 3.24Å; D92-R97 IonicContact OD1-NE 2.62Å; D92-R97 PolarHBondContact OD1-NE 2.9Å; D92-R97 IonicContact OD1-NH2 2.74Å; D92-R97 PolarHBondContact OD1-NH2 2.93Å; D92-R97 IonicContact OD2-CZ 3.24Å; D92-R97 IonicContact OD2-NE 2.67Å; D92-R97 IonicContact OD2-NH2 3.43Å; D92-R97 PolarHBondContact OD2-NH2 3.12Å
93	V	80.8	Confident	89	Confident	77 Å²	77	56.5 Å²	56.5	47%	0.467	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	68.5	177.8	-171.9	0	0	0	0	108.3	E96 V98	V93-E96 CarbonylContact C-O 3.58Å; V93-E96 WeakPolarHBondContact CA-O 3.37Å; V93-E96 PolarHBondContact N-O 3.45Å; V93-V98 HydrophobicContact CG2-CG2 4.1Å
94	G	83.8	Confident	89	Confident	58 Å²	58	59.3 Å²	59.3	60%	0.598	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	-132.2	-168	0	0	0	0	0	110.9	E96	G94-E96 PolarHBondContact O-N 2.88Å
95	D	84.1	Confident	88.8	Confident	139 Å²	139	59.4 Å²	59.4	74%	0.743	32%	0.316	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-6	178.3	-51.7	-38.3	0	0	0	112.7	Q61	Q61-D95 PolarHBondContact N-O 3.47Å
96	E	88.4	Confident	88.5	Confident	77 Å²	77	54.7 Å²	54.7	36%	0.36	31%	0.305	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.5	140.9	175.4	-60.7	-168.5	123.9	0	0	111.8	R58 V59 V93 G94	R58-E96 HydrophobicContact CB-CB 4.28Å; R58-E96 WeakPolarHBondContact CD-OE2 3.34Å; R58-E96 IonicContact NE-OE2 2.78Å; R58-E96 IonicContact NH1-OE2 2.81Å; R58-E96 PolarHBondContact NH1-OE2 3.16Å; V59-E96 CarbonylContact O-C 3.18Å; V59-E96 WeakPolarHBondContact O-CA 3.43Å; V93-E96 CarbonylContact C-O 3.58Å; V93-E96 WeakPolarHBondContact CA-O 3.37Å; V93-E96 PolarHBondContact N-O 3.45Å; G94-E96 PolarHBondContact O-N 2.88Å
97	R	89.4	Confident	88.4	Confident	46 Å²	46	57.1 Å²	57.1	17%	0.174	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115	144.7	167.1	-175.5	166.7	-78.5	-113.9	-1	110.4	V59 V64 V88 D89 T90 D92	V59-R97 PolarHBondContact N-O 2.78Å; V59-R97 PolarHBondContact O-N 3.07Å; V64-R97 HydrophobicContact CG2-CB 3.91Å; V64-R97 HydrophobicContact CG2-CG 4.39Å; V88-R97 HydrophobicContact CG1-CG 4.35Å; D89-R97 PolarHBondContact O-NH1 2.83Å; T90-R97 PolarHBondContact O-NH1 3.49Å; T90-R97 PolarHBondContact O-NH2 2.85Å; T90-R97 VanDerWaalsContact O-NH2 3.08Å; D92-R97 IonicContact OD1-CZ 2.62Å; D92-R97 VanDerWaalsContact OD1-CZ 3.24Å; D92-R97 IonicContact OD1-NE 2.62Å; D92-R97 PolarHBondContact OD1-NE 2.9Å; D92-R97 IonicContact OD1-NH2 2.74Å; D92-R97 PolarHBondContact OD1-NH2 2.93Å; D92-R97 IonicContact OD2-CZ 3.24Å; D92-R97 IonicContact OD2-NE 2.67Å; D92-R97 IonicContact OD2-NH2 3.43Å; D92-R97 PolarHBondContact OD2-NH2 3.12Å
98	V	91.1	Very high	88.5	Confident	13 Å²	13	55 Å²	55	8%	0.079	31%	0.305	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	136.1	-177.6	-174.2	0	0	0	0	110.9	E56 D89 V93	E56-V98 HydrophobicContact CB-CG1 4.01Å; E56-V98 HydrophobicContact CG-CG1 3.98Å; D89-V98 HydrophobicContact CB-CB 4.06Å; D89-V98 WeakPolarHBondContact CB-O 3.19Å; D89-V98 PolarHBondContact N-O 3.43Å; V93-V98 HydrophobicContact CG2-CG2 4.1Å
99	L	92.8	Very high	88.5	Confident	0 Å²	0	57 Å²	57	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.2	124.4	168.3	-60.2	180	0	0	0	108.7	E56 M57 V59 I67 V88 I115	E56-L99 CarbonylContact C-O 3.51Å; E56-L99 WeakPolarHBondContact CA-O 3.25Å; M57-L99 HydrophobicContact CE-CD1 3.81Å; M57-L99 PolarHBondContact N-O 2.97Å; M57-L99 WeakPolarHBondContact O-CB 3.31Å; M57-L99 PolarHBondContact O-N 3.33Å; V59-L99 HydrophobicContact CG1-CD1 3.69Å; V59-L99 HydrophobicContact CG1-CG 4.33Å; V59-L99 HydrophobicContact CG2-CD1 3.94Å; V59-L99 HydrophobicContact CG2-CG 4.06Å; I67-L99 HydrophobicContact CD1-CD1 3.98Å; I67-L99 HydrophobicContact CG2-CD1 4.48Å; V88-L99 HydrophobicContact CB-CD2 4.09Å; V88-L99 HydrophobicContact CG1-CD2 3.9Å; V88-L99 HydrophobicContact CG2-CD2 3.75Å; L99-I115 HydrophobicContact CD1-CD1 4.39Å; L99-I115 HydrophobicContact CD1-CG2 4.16Å
100	L	93.3	Very high	88.9	Confident	62 Å²	62	59.5 Å²	59.5	33%	0.325	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.3	113	178.5	-166.5	67.3	0	0	0	108.6	E54 E56 I86 D87	E54-L100 HydrophobicContact CG-CD1 3.56Å; E54-L100 HydrophobicContact CG-CD2 4.42Å; E54-L100 HydrophobicContact CG-CG 3.83Å; E56-L100 HydrophobicContact CG-CD1 4.2Å; I86-L100 CarbonylContact C-O 3.58Å; I86-L100 WeakPolarHBondContact CA-O 3.33Å; D87-L100 PolarHBondContact N-O 3.4Å; D87-L100 PolarHBondContact O-N 2.86Å
101	I	94.9	Very high	89.6	Confident	0 Å²	0	53.7 Å²	53.7	0%	0	29%	0.292	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.2	113.5	-175	-50.8	-179.7	0	0	0	109.2	E54 I55 M57 A84 R85 I86 V108 A111 I115	E54-I101 WeakPolarHBondContact CA-O 3.14Å; I55-I101 PolarHBondContact N-O 2.86Å; I55-I101 PolarHBondContact O-N 3.45Å; M57-I101 HydrophobicContact CB-CD1 4.42Å; M57-I101 HydrophobicContact CE-CD1 3.95Å; M57-I101 HydrophobicContact SD-CD1 4.46Å; A84-I101 HydrophobicContact CB-CG2 4.11Å; R85-I101 CarbonylContact O-C 3.59Å; R85-I101 WeakPolarHBondContact O-CA 3.33Å; I86-I101 HydrophobicContact CG1-CG2 4.3Å; I86-I101 HydrophobicContact CG2-CG1 4.43Å; I101-V108 HydrophobicContact CB-CG1 4.3Å; I101-V108 HydrophobicContact CG2-CB 4.26Å; I101-V108 HydrophobicContact CG2-CG1 3.85Å; I101-V108 HydrophobicContact CG2-CG2 4.22Å; I101-A111 HydrophobicContact CG2-CB 3.76Å; I101-I115 HydrophobicContact CD1-CD1 3.88Å
102	S	93.6	Very high	90.2	Very high	17 Å²	17	51.3 Å²	51.3	12%	0.119	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	150	-178.4	29.4	0	0	0	0	114.4	I53 E54 R85	I53-S102 VanDerWaalsContact O-CA 3.25Å; I53-S102 WeakPolarHBondContact O-CA 3.25Å; E54-S102 WeakPolarHBondContact OE1-CB 3.45Å; E54-S102 PolarHBondContact OE1-OG 3.5Å; R85-S102 WeakPolarHBondContact CB-O 3.18Å; R85-S102 PolarHBondContact N-O 3.03Å; R85-S102 PolarHBondContact O-N 3.32Å
103	G	92.9	Very high	90.8	Very high	7 Å²	7	51.1 Å²	51.1	7%	0.072	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	142.2	-170.9	-179.2	0	0	0	0	0	111.8	D52 I53 V108	D52-G103 WeakPolarHBondContact OD1-CA 3.36Å; I53-G103 PolarHBondContact N-O 3.4Å; I53-G103 PolarHBondContact O-N 3.25Å; G103-V108 WeakPolarHBondContact O-CG2 3.43Å
104	F	92.2	Very high	91.3	Very high	102 Å²	102	48.8 Å²	48.8	45%	0.447	28%	0.276	S	S	.	.	S	Bend	trans	-58.7	146.8	176.8	-61.9	-66.2	0	0	0	111.3	E50 D52 V106 Q107 V108	E50-F104 WeakPolarHBondContact O-CE1 3.35Å; D52-F104 PolarHBondContact OD1-N 2.79Å; F104-V106 PolarHBondContact O-N 3.39Å; F104-Q107 HydrophobicContact CB-CG 4.27Å; F104-Q107 VanDerWaalsContact N-OE1 3.11Å; F104-Q107 WeakPolarHBondContact O-CA 3.32Å; F104-Q107 WeakPolarHBondContact O-CB 3.49Å; F104-Q107 PolarHBondContact O-N 2.95Å; F104-V108 PolarHBondContact O-N 3.4Å; F104-V108 VanDerWaalsContact O-N 3.1Å
105	P	90.3	Very high	91.8	Very high	5 Å²	5	46 Å²	46	3%	0.032	25%	0.248	C	C	.	.	H	α-helix	trans	-50.4	-37.4	-176	-29.8	33.9	0	0	0	114.9	F47 I53 C109	F47-P105 HydrophobicContact CD1-CB 4.27Å; I53-P105 HydrophobicContact CD1-CB 3.93Å; I53-P105 HydrophobicContact CD1-CG 4.02Å; I53-P105 HydrophobicContact CG1-CG 4.22Å; I53-P105 HydrophobicContact CG2-CG 4.12Å; P105-C109 WeakPolarHBondContact O-CB 3.32Å; P105-C109 PolarHBondContact O-N 3.02Å; P105-C109 PolarHBondContact O-SG 3.25Å
106	V	88.5	Confident	92.1	Very high	57 Å²	57	44.9 Å²	44.9	35%	0.345	24%	0.238	S	C	.	.	H	α-helix	trans	-68.5	-32.7	177.7	178.4	0	0	0	0	112.7	V48 F104 K110	V48-V106 HydrophobicContact CG2-CG2 4.48Å; F104-V106 PolarHBondContact O-N 3.39Å; V106-K110 HydrophobicContact CG1-CD 4.48Å; V106-K110 WeakPolarHBondContact O-CD 3.24Å; V106-K110 VanDerWaalsContact O-CG 3.25Å; V106-K110 WeakPolarHBondContact O-CG 3.49Å; V106-K110 PolarHBondContact O-N 2.84Å
107	Q	92.8	Very high	92.1	Very high	50 Å²	50	46.6 Å²	46.6	23%	0.234	25%	0.245	C	C	.	.	H	α-helix	trans	-73.8	-47	176.3	-61.8	175	-30.9	0	0	110.7	T82 G83 A84 F104 C109 K110 A111	T82-Q107 WeakPolarHBondContact O-CB 3.21Å; T82-Q107 WeakPolarHBondContact O-CG 3.45Å; G83-Q107 PolarHBondContact O-NE2 2.99Å; G83-Q107 PolarHBondContact O-OE1 3.49Å; A84-Q107 HydrophobicContact CB-CB 4Å; F104-Q107 HydrophobicContact CB-CG 4.27Å; F104-Q107 VanDerWaalsContact N-OE1 3.11Å; F104-Q107 WeakPolarHBondContact O-CA 3.32Å; F104-Q107 WeakPolarHBondContact O-CB 3.49Å; F104-Q107 PolarHBondContact O-N 2.95Å; Q107-C109 VanDerWaalsContact C-N 3.35Å; Q107-C109 PolarHBondContact O-N 3.09Å; Q107-K110 WeakPolarHBondContact O-CB 3.42Å; Q107-K110 PolarHBondContact O-N 2.99Å; Q107-K110 VanDerWaalsContact O-N 3.13Å; Q107-A111 PolarHBondContact O-N 2.86Å
108	V	92.6	Very high	92.1	Very high	1 Å²	1	46 Å²	46	1%	0.006	25%	0.245	C	C	.	.	H	α-helix	trans	-61.3	-42.9	178.8	177.8	0	0	0	0	110.9	I53 I55 I101 G103 F104 K110 A111 K112	I53-V108 HydrophobicContact CD1-CB 4.41Å; I53-V108 HydrophobicContact CD1-CG1 4.48Å; I53-V108 HydrophobicContact CG1-CB 4.32Å; I53-V108 HydrophobicContact CG1-CG2 4.02Å; I55-V108 HydrophobicContact CB-CG1 4.06Å; I55-V108 HydrophobicContact CD1-CG1 3.8Å; I55-V108 HydrophobicContact CG1-CG1 4.03Å; I101-V108 HydrophobicContact CB-CG1 4.3Å; I101-V108 HydrophobicContact CG2-CB 4.26Å; I101-V108 HydrophobicContact CG2-CG1 3.85Å; I101-V108 HydrophobicContact CG2-CG2 4.22Å; G103-V108 WeakPolarHBondContact O-CG2 3.43Å; F104-V108 PolarHBondContact O-N 3.4Å; F104-V108 VanDerWaalsContact O-N 3.1Å; V108-K110 PolarHBondContact O-N 3.4Å; V108-A111 PolarHBondContact O-N 3Å; V108-K112 WeakPolarHBondContact O-CB 3.27Å; V108-K112 PolarHBondContact O-N 3.16Å
109	C	90.7	Very high	92	Very high	85 Å²	85	46.7 Å²	46.7	57%	0.574	25%	0.248	S	C	*	.	H	α-helix	trans	-59.5	-42.9	172.6	-75.7	0	0	0	0	113	P105 Q107 A113	P105-C109 WeakPolarHBondContact O-CB 3.32Å; P105-C109 PolarHBondContact O-N 3.02Å; P105-C109 PolarHBondContact O-SG 3.25Å; Q107-C109 VanDerWaalsContact C-N 3.35Å; Q107-C109 PolarHBondContact O-N 3.09Å; C109-A113 WeakPolarHBondContact O-CB 3.16Å; C109-A113 PolarHBondContact O-N 3.12Å
110	K	93.6	Very high	91.7	Very high	119 Å²	119	50.5 Å²	50.5	52%	0.517	27%	0.272	S	S	.	.	H	α-helix	trans	-64.2	-43.5	175.9	-74.6	168.2	-177.4	176.2	0	112	T82 V106 Q107 V108 A113 A114	T82-K110 HydrophobicContact CG2-CB 4.3Å; V106-K110 HydrophobicContact CG1-CD 4.48Å; V106-K110 WeakPolarHBondContact O-CD 3.24Å; V106-K110 VanDerWaalsContact O-CG 3.25Å; V106-K110 WeakPolarHBondContact O-CG 3.49Å; V106-K110 PolarHBondContact O-N 2.84Å; Q107-K110 WeakPolarHBondContact O-CB 3.42Å; Q107-K110 PolarHBondContact O-N 2.99Å; Q107-K110 VanDerWaalsContact O-N 3.13Å; V108-K110 PolarHBondContact O-N 3.4Å; K110-A113 PolarHBondContact O-N 3.09Å; K110-A114 WeakPolarHBondContact O-CB 3.39Å; K110-A114 PolarHBondContact O-N 2.98Å
111	A	94.3	Very high	91.3	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	27%	0.27	C	S	.	.	H	α-helix	trans	-63.7	-46.9	177.8	0	0	0	0	0	111.9	T82 A84 I86 I101 Q107 V108 A113 A114 I115	T82-A111 HydrophobicContact CG2-CB 3.94Å; A84-A111 HydrophobicContact CB-CB 3.87Å; I86-A111 HydrophobicContact CD1-CB 3.89Å; I86-A111 HydrophobicContact CG1-CB 4.16Å; I101-A111 HydrophobicContact CG2-CB 3.76Å; Q107-A111 PolarHBondContact O-N 2.86Å; V108-A111 PolarHBondContact O-N 3Å; A111-A113 PolarHBondContact O-N 3.44Å; A111-A114 PolarHBondContact O-N 3.1Å; A111-I115 VanDerWaalsContact O-CG1 3.29Å; A111-I115 WeakPolarHBondContact O-CG1 3.43Å; A111-I115 PolarHBondContact O-N 2.85Å
112	K	93.7	Very high	90.9	Very high	95 Å²	95	53.6 Å²	53.6	41%	0.413	29%	0.287	S	S	.	.	H	α-helix	trans	-58.4	-45.4	175.6	-175.4	161.3	-173.1	167	0	111.9	M57 V108 H116	M57-K112 HydrophobicContact SD-CD 4.46Å; M57-K112 HydrophobicContact SD-CG 3.86Å; V108-K112 WeakPolarHBondContact O-CB 3.27Å; V108-K112 PolarHBondContact O-N 3.16Å; K112-H116 VanDerWaalsContact O-CB 3.23Å; K112-H116 WeakPolarHBondContact O-CB 3.45Å; K112-H116 PolarHBondContact O-N 2.87Å
113	A	92.4	Very high	90.5	Very high	63 Å²	63	56.2 Å²	56.2	52%	0.521	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-46.1	176.9	0	0	0	0	0	112.8	C109 K110 A111 H116 Q117	C109-A113 WeakPolarHBondContact O-CB 3.16Å; C109-A113 PolarHBondContact O-N 3.12Å; K110-A113 PolarHBondContact O-N 3.09Å; A111-A113 PolarHBondContact O-N 3.44Å; A113-H116 PolarHBondContact O-N 2.84Å; A113-Q117 PolarHBondContact O-N 3.14Å
114	A	92.8	Very high	90.3	Very high	29 Å²	29	61 Å²	61	24%	0.24	33%	0.332	C	S	.	.	H	α-helix	trans	-64.8	-41.4	-179.7	0	0	0	0	0	112.4	L78 K110 A111 Q117 I118	L78-A114 HydrophobicContact CD2-CB 3.72Å; K110-A114 WeakPolarHBondContact O-CB 3.39Å; K110-A114 PolarHBondContact O-N 2.98Å; A111-A114 PolarHBondContact O-N 3.1Å; A114-Q117 PolarHBondContact O-N 3.13Å; A114-I118 WeakPolarHBondContact O-CG1 3.35Å; A114-I118 PolarHBondContact O-N 2.84Å
115	I	92.8	Very high	90.3	Very high	0 Å²	0	58 Å²	58	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-69.1	-42.6	175.7	-62.3	162.1	0	0	0	110.5	M57 I67 L78 I86 L99 I101 A111 Q117 I118 L119	M57-I115 HydrophobicContact CE-CB 3.73Å; M57-I115 HydrophobicContact CE-CD1 3.87Å; M57-I115 HydrophobicContact CE-CG1 4.42Å; M57-I115 HydrophobicContact CE-CG2 3.35Å; I67-I115 HydrophobicContact CD1-CG2 3.57Å; I67-I115 HydrophobicContact CG1-CG2 4.06Å; I67-I115 HydrophobicContact CG2-CG1 4.49Å; L78-I115 HydrophobicContact CD1-CG1 4.23Å; L78-I115 HydrophobicContact CD2-CG1 4.35Å; I86-I115 HydrophobicContact CD1-CD1 4.35Å; I86-I115 HydrophobicContact CG2-CD1 4.02Å; L99-I115 HydrophobicContact CD1-CD1 4.39Å; L99-I115 HydrophobicContact CD1-CG2 4.16Å; I101-I115 HydrophobicContact CD1-CD1 3.88Å; A111-I115 VanDerWaalsContact O-CG1 3.29Å; A111-I115 WeakPolarHBondContact O-CG1 3.43Å; A111-I115 PolarHBondContact O-N 2.85Å; I115-Q117 PolarHBondContact O-N 3.07Å; I115-I118 WeakPolarHBondContact O-CB 3.44Å; I115-I118 PolarHBondContact O-N 3.39Å; I115-L119 HydrophobicContact CG2-CD1 4.39Å; I115-L119 HydrophobicContact CG2-CG 4.39Å; I115-L119 WeakPolarHBondContact O-CG 3.35Å; I115-L119 PolarHBondContact O-N 3.07Å
116	H	90.8	Very high	90.5	Very high	115 Å²	115	60.8 Å²	60.8	53%	0.532	34%	0.342	S	S	.	.	H	α-helix	trans	-60	-35.1	175.6	-170.9	-75.7	0	0	0	112.3	K112 A113 T120	K112-H116 VanDerWaalsContact O-CB 3.23Å; K112-H116 WeakPolarHBondContact O-CB 3.45Å; K112-H116 PolarHBondContact O-N 2.87Å; A113-H116 PolarHBondContact O-N 2.84Å; H116-T120 PolarHBondContact CE1-OG1 2.94Å; H116-T120 PolarHBondContact ND1-OG1 2.95Å; H116-T120 WeakPolarHBondContact O-CB 3.42Å; H116-T120 PolarHBondContact O-N 3.18Å; H116-T120 PolarHBondContact O-OG1 2.82Å
117	Q	89.6	Confident	90.8	Very high	112 Å²	112	60.9 Å²	60.9	52%	0.523	34%	0.338	S	S	.	.	H	α-helix	trans	-64.8	-46.6	171.3	-177.5	177.7	-8.6	0	0	111.4	A113 A114 I115 L119 T120 E121	A113-Q117 PolarHBondContact O-N 3.14Å; A114-Q117 PolarHBondContact O-N 3.13Å; I115-Q117 PolarHBondContact O-N 3.07Å; Q117-L119 VanDerWaalsContact C-N 3.32Å; Q117-L119 PolarHBondContact O-N 2.88Å; Q117-T120 PolarHBondContact O-N 2.62Å; Q117-E121 HydrophobicContact CG-CG 4.19Å; Q117-E121 PolarHBondContact NE2-OE1 2.94Å; Q117-E121 WeakPolarHBondContact O-CB 3.36Å; Q117-E121 WeakPolarHBondContact O-CG 3.21Å; Q117-E121 PolarHBondContact O-N 3.24Å
118	I	89.3	Confident	90.8	Very high	33 Å²	33	64.3 Å²	64.3	17%	0.169	35%	0.354	C	S	.	.	H	α-helix	trans	-58.2	-43.8	176.4	-69.3	164.1	0	0	0	111.1	I67 L78 A114 I115 N122	I67-I118 HydrophobicContact CG1-CG2 4.17Å; L78-I118 HydrophobicContact CD1-CD1 3.88Å; L78-I118 HydrophobicContact CD2-CD1 4.05Å; L78-I118 HydrophobicContact CG-CD1 4.33Å; A114-I118 WeakPolarHBondContact O-CG1 3.35Å; A114-I118 PolarHBondContact O-N 2.84Å; I115-I118 WeakPolarHBondContact O-CB 3.44Å; I115-I118 PolarHBondContact O-N 3.39Å; I118-N122 WeakPolarHBondContact O-CB 3.41Å; I118-N122 PolarHBondContact O-N 3.12Å; I118-N122 VanDerWaalsContact O-N 3.17Å; I118-N122 PolarHBondContact O-ND2 3.24Å
119	L	88.4	Confident	90.8	Very high	28 Å²	28	65.6 Å²	65.6	15%	0.147	36%	0.361	C	S	.	.	H	α-helix	trans	-58.1	-58.3	173.5	-64.4	173.4	0	0	0	110.7	V59 A63 I67 I115 Q117 E121 N122 T123	V59-L119 HydrophobicContact CB-CD1 4.34Å; V59-L119 HydrophobicContact CB-CD2 4.13Å; V59-L119 HydrophobicContact CG1-CD1 3.7Å; V59-L119 HydrophobicContact CG1-CD2 4.21Å; V59-L119 HydrophobicContact CG1-CG 4.5Å; A63-L119 HydrophobicContact CB-CD2 3.48Å; A63-L119 VanDerWaalsContact CB-CD2 3.48Å; I67-L119 HydrophobicContact CD1-CD2 3.95Å; I115-L119 HydrophobicContact CG2-CD1 4.39Å; I115-L119 HydrophobicContact CG2-CG 4.39Å; I115-L119 WeakPolarHBondContact O-CG 3.35Å; I115-L119 PolarHBondContact O-N 3.07Å; Q117-L119 VanDerWaalsContact C-N 3.32Å; Q117-L119 PolarHBondContact O-N 2.88Å; L119-E121 VanDerWaalsContact C-N 3.28Å; L119-E121 PolarHBondContact O-N 2.62Å; L119-N122 CarbonylContact O-C 3.59Å; L119-N122 PolarHBondContact O-N 2.74Å; L119-T123 PolarHBondContact O-N 3.26Å; L119-T123 PolarHBondContact O-OG1 3.4Å
120	T	86.3	Confident	90.9	Very high	80 Å²	80	65.1 Å²	65.1	49%	0.491	36%	0.358	S	S	.	.	H	α-helix	trans	-55.7	-39.9	-177.3	-52.4	0	0	0	0	112.5	H116 Q117	H116-T120 PolarHBondContact CE1-OG1 2.94Å; H116-T120 PolarHBondContact ND1-OG1 2.95Å; H116-T120 WeakPolarHBondContact O-CB 3.42Å; H116-T120 PolarHBondContact O-N 3.18Å; H116-T120 PolarHBondContact O-OG1 2.82Å; Q117-T120 PolarHBondContact O-N 2.62Å
121	E	85.9	Confident	90.8	Very high	63 Å²	63	59.6 Å²	59.6	29%	0.294	34%	0.335	S	S	.	.	H	α-helix	trans	-74.3	-25.5	179.6	-71.1	-171.2	-176	0	0	113.8	Q117 L119 T179 K181	Q117-E121 HydrophobicContact CG-CG 4.19Å; Q117-E121 PolarHBondContact NE2-OE1 2.94Å; Q117-E121 WeakPolarHBondContact O-CB 3.36Å; Q117-E121 WeakPolarHBondContact O-CG 3.21Å; Q117-E121 PolarHBondContact O-N 3.24Å; L119-E121 VanDerWaalsContact C-N 3.28Å; L119-E121 PolarHBondContact O-N 2.62Å; E121-T179 WeakPolarHBondContact O-CB 3.41Å; E121-K181 IonicContact OE1-NZ 3.14Å; E121-K181 PolarHBondContact OE1-NZ 3.44Å; E121-K181 IonicContact OE2-NZ 3.58Å; E121-K181 PolarHBondContact OE2-NZ 2.97Å
122	N	85.4	Confident	90.4	Very high	64 Å²	64	61.2 Å²	61.2	34%	0.342	35%	0.346	S	S	.	.	H	α-helix	trans	-107.5	-3.4	-175.8	-67.5	-97	0	0	0	113.9	L66 I118 L119	L66-N122 HydrophobicContact CD1-CB 3.58Å; I118-N122 WeakPolarHBondContact O-CB 3.41Å; I118-N122 PolarHBondContact O-N 3.12Å; I118-N122 VanDerWaalsContact O-N 3.17Å; I118-N122 PolarHBondContact O-ND2 3.24Å; L119-N122 CarbonylContact O-C 3.59Å; L119-N122 PolarHBondContact O-N 2.74Å
123	T	86.5	Confident	89.9	Confident	73 Å²	73	58.3 Å²	58.3	45%	0.448	33%	0.333	S	S	.	.	S	Bend	trans	-55.4	124.2	171.2	-67.8	0	0	0	0	109.7	L119 V125	L119-T123 PolarHBondContact O-N 3.26Å; L119-T123 PolarHBondContact O-OG1 3.4Å; T123-V125 PolarHBondContact O-N 2.96Å
124	P	87.3	Confident	89.3	Confident	108 Å²	108	61.4 Å²	61.4	70%	0.701	33%	0.332	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70.9	120.5	176.4	28.5	-33.1	0	0	0	109.7	G178	P124-G178 WeakPolarHBondContact CA-O 3.46Å
125	V	92.4	Very high	89	Confident	38 Å²	38	60.1 Å²	60.1	23%	0.23	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	149.1	171.8	-63.4	0	0	0	0	109.5	T123 S177 G178 Q180 V183	T123-V125 PolarHBondContact O-N 2.96Å; V125-S177 WeakPolarHBondContact O-CA 3.34Å; V125-G178 PolarHBondContact N-O 3.13Å; V125-G178 PolarHBondContact O-N 2.81Å; V125-G178 VanDerWaalsContact O-N 3.1Å; V125-Q180 HydrophobicContact CG2-CB 4.36Å; V125-V183 HydrophobicContact CG2-CB 4.2Å; V125-V183 HydrophobicContact CG2-CG2 3.92Å
126	S	94.1	Very high	88.7	Confident	64 Å²	64	60.3 Å²	60.3	45%	0.448	32%	0.322	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	129.1	167.3	-170.7	0	0	0	0	108.9	K175 I176	S126-K175 WeakPolarHBondContact OG-CE 2.98Å; S126-I176 CarbonylContact C-O 3.6Å; S126-I176 WeakPolarHBondContact CA-O 3.45Å; S126-I176 PolarHBondContact OG-O 3.31Å
127	E	94.6	Very high	88.3	Confident	59 Å²	59	57.4 Å²	57.4	28%	0.276	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.4	159.3	-176.2	-62.6	-160.4	-94.4	0	0	109.9	I176 V183 K187	E127-I176 PolarHBondContact N-O 3.23Å; E127-I176 PolarHBondContact O-N 2.71Å; E127-V183 HydrophobicContact CB-CG1 4.03Å; E127-V183 HydrophobicContact CG-CG1 4.01Å; E127-V183 WeakPolarHBondContact OE1-CG1 3.31Å; E127-K187 WeakPolarHBondContact OE1-CE 3.38Å; E127-K187 IonicContact OE1-NZ 4Å; E127-K187 PolarHBondContact OE1-NZ 3.03Å; E127-K187 IonicContact OE2-NZ 3.33Å; E127-K187 PolarHBondContact OE2-NZ 2.94Å
128	Q	93.7	Very high	88.2	Confident	122 Å²	122	55.7 Å²	55.7	57%	0.57	31%	0.312	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-119.2	137.2	178.2	-69.1	173.8	-30.5	0	0	109.3	L173 I174	Q128-L173 HydrophobicContact CB-CD1 3.94Å; Q128-L173 HydrophobicContact CB-CD2 4.29Å; Q128-L173 HydrophobicContact CB-CG 4.07Å; Q128-L173 HydrophobicContact CG-CD2 4.17Å; Q128-L173 HydrophobicContact CG-CG 4.33Å; Q128-I174 WeakPolarHBondContact CA-O 3.42Å
129	L	93.4	Very high	88.2	Confident	27 Å²	27	54.1 Å²	54.1	14%	0.141	30%	0.304	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	122	178.3	-179.3	62.6	0	0	0	108.8	V131 I174 I176 I190 L191	L129-V131 HydrophobicContact CD2-CG1 4.11Å; L129-V131 HydrophobicContact CG-CG1 3.98Å; L129-I174 PolarHBondContact N-O 3.43Å; L129-I174 PolarHBondContact O-N 3.2Å; L129-I176 HydrophobicContact CB-CD1 4.31Å; L129-I176 HydrophobicContact CD2-CD1 4.48Å; L129-I190 HydrophobicContact CD2-CB 4.08Å; L129-I190 HydrophobicContact CD2-CD1 4.47Å; L129-I190 HydrophobicContact CD2-CG2 3.65Å; L129-L191 HydrophobicContact CD1-CD2 4.36Å; L129-L191 HydrophobicContact CD2-CD2 4.45Å; L129-L191 HydrophobicContact CD2-CG 4.39Å
130	S	91.9	Very high	88.2	Confident	75 Å²	75	55.2 Å²	55.2	52%	0.524	31%	0.309	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.2	126.2	170	-175.5	0	0	0	0	109.2	S171	S130-S171 WeakPolarHBondContact OG-CB 3.21Å
131	V	90.8	Very high	88	Confident	3 Å²	3	52.2 Å²	52.2	2%	0.018	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-126.2	154.5	174.6	-58.7	0	0	0	0	110	L129 Q133 V136 I139 S171 R172 I174 I190 V194	L129-V131 HydrophobicContact CD2-CG1 4.11Å; L129-V131 HydrophobicContact CG-CG1 3.98Å; V131-Q133 PolarHBondContact O-N 2.67Å; V131-V136 HydrophobicContact CG2-CG2 3.7Å; V131-I139 HydrophobicContact CB-CD1 4.15Å; V131-I139 HydrophobicContact CG1-CD1 4.12Å; V131-I139 HydrophobicContact CG2-CD1 3.93Å; V131-S171 CarbonylContact O-C 3.59Å; V131-S171 WeakPolarHBondContact O-CA 2.89Å; V131-S171 WeakPolarHBondContact O-CB 3.41Å; V131-R172 PolarHBondContact N-O 2.89Å; V131-R172 PolarHBondContact O-N 3.2Å; V131-I174 HydrophobicContact CG1-CD1 4.13Å; V131-I174 HydrophobicContact CG2-CD1 3.66Å; V131-I174 HydrophobicContact CG2-CG1 4.03Å; V131-I190 HydrophobicContact CG1-CG2 3.98Å; V131-V194 HydrophobicContact CB-CG2 4.18Å; V131-V194 HydrophobicContact CG1-CG2 4.01Å
132	P	87.1	Confident	87.7	Confident	35 Å²	35	60.4 Å²	60.4	23%	0.227	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-59.4	132.8	171.7	-21.4	33.5	0	0	0	111	R134 S135 L170 V194	P132-R134 VanDerWaalsContact C-N 3.25Å; P132-R134 HydrophobicContact CB-CG 3.97Å; P132-R134 PolarHBondContact O-N 2.73Å; P132-S135 PolarHBondContact O-N 3.37Å; P132-L170 WeakPolarHBondContact CA-O 3.31Å; P132-V194 HydrophobicContact CG-CG1 4.42Å
133	Q	82.4	Confident	87.4	Confident	33 Å²	33	60.7 Å²	60.7	15%	0.154	34%	0.34	C	S	.	.	H	α-helix	trans	-55	-42.8	-177.9	169.2	70.9	-30.9	0	0	111.4	V131 S135 V136 E163 L169 L170	V131-Q133 PolarHBondContact O-N 2.67Å; Q133-S135 PolarHBondContact O-N 2.7Å; Q133-S135 VanDerWaalsContact O-N 3.14Å; Q133-V136 VanDerWaalsContact O-CB 3.22Å; Q133-V136 WeakPolarHBondContact O-CB 3.43Å; Q133-V136 VanDerWaalsContact O-CG2 3.31Å; Q133-V136 WeakPolarHBondContact O-CG2 3.5Å; Q133-V136 PolarHBondContact O-N 2.75Å; Q133-E163 VanDerWaalsContact NE2-CD 3.33Å; Q133-E163 PolarHBondContact NE2-OE1 3.31Å; Q133-E163 PolarHBondContact NE2-OE2 2.79Å; Q133-L169 WeakPolarHBondContact CB-O 3.37Å; Q133-L169 WeakPolarHBondContact CG-O 3.48Å; Q133-L170 PolarHBondContact N-O 2.62Å
134	R	80	Confident	87.4	Confident	129 Å²	129	57.7 Å²	57.7	49%	0.487	32%	0.324	S	S	.	.	H	α-helix	trans	-56.2	-26.2	175.2	71.8	-165	-171.5	172.4	-5.1	115.2	P132 E309	P132-R134 VanDerWaalsContact C-N 3.25Å; P132-R134 HydrophobicContact CB-CG 3.97Å; P132-R134 PolarHBondContact O-N 2.73Å; R134-E309 IonicContact NH1-OE1 2.83Å
135	S	87	Confident	87.4	Confident	1 Å²	1	59.2 Å²	59.2	1%	0.007	32%	0.322	C	S	.	.	H	α-helix	trans	-90	-11	179.4	-48.4	0	0	0	0	112.4	P132 Q133 G137 R138 I139 D197	P132-S135 PolarHBondContact O-N 3.37Å; Q133-S135 PolarHBondContact O-N 2.7Å; Q133-S135 VanDerWaalsContact O-N 3.14Å; S135-G137 VanDerWaalsContact C-N 3.33Å; S135-G137 PolarHBondContact O-N 2.91Å; S135-R138 WeakPolarHBondContact O-CB 3.29Å; S135-R138 PolarHBondContact O-N 2.77Å; S135-I139 WeakPolarHBondContact O-CG1 3.39Å; S135-I139 PolarHBondContact O-N 2.91Å; S135-D197 WeakPolarHBondContact CA-OD2 3.33Å; S135-D197 WeakPolarHBondContact CB-OD2 3.23Å; S135-D197 PolarHBondContact OG-OD2 2.98Å
136	V	86.1	Confident	87.4	Confident	4 Å²	4	59.1 Å²	59.1	2%	0.024	32%	0.321	C	S	.	.	H	α-helix	trans	-64	-36.9	-179	178.9	0	0	0	0	111.8	V131 Q133 R138 I139 I140 R172	V131-V136 HydrophobicContact CG2-CG2 3.7Å; Q133-V136 VanDerWaalsContact O-CB 3.22Å; Q133-V136 WeakPolarHBondContact O-CB 3.43Å; Q133-V136 VanDerWaalsContact O-CG2 3.31Å; Q133-V136 WeakPolarHBondContact O-CG2 3.5Å; Q133-V136 PolarHBondContact O-N 2.75Å; V136-R138 VanDerWaalsContact C-N 3.26Å; V136-R138 PolarHBondContact O-N 2.83Å; V136-I139 PolarHBondContact O-N 2.81Å; V136-I139 VanDerWaalsContact O-N 3.15Å; V136-I140 HydrophobicContact CG1-CD1 3.59Å; V136-I140 HydrophobicContact CG1-CG1 4.02Å; V136-I140 WeakPolarHBondContact O-CG1 3.48Å; V136-I140 PolarHBondContact O-N 2.83Å; V136-R172 HydrophobicContact CG2-CB 3.84Å; V136-R172 HydrophobicContact CG2-CG 4.44Å
137	G	83.3	Confident	87.4	Confident	54 Å²	54	57.5 Å²	57.5	56%	0.557	31%	0.307	S	S	*	.	H	α-helix	trans	-57.9	-37.4	176	0	0	0	0	0	112.9	S135 G141	S135-G137 VanDerWaalsContact C-N 3.33Å; S135-G137 PolarHBondContact O-N 2.91Å; G137-G141 WeakPolarHBondContact O-CA 3.46Å; G137-G141 PolarHBondContact O-N 2.71Å
138	R	85.9	Confident	87.4	Confident	76 Å²	76	63 Å²	63	29%	0.287	33%	0.325	S	S	.	.	H	α-helix	trans	-72.1	-40.4	174.6	179.1	-176.2	-70.8	-84.7	-6.5	112.7	S135 V136 T146 K193 E196 D197 L200	S135-R138 WeakPolarHBondContact O-CB 3.29Å; S135-R138 PolarHBondContact O-N 2.77Å; V136-R138 VanDerWaalsContact C-N 3.26Å; V136-R138 PolarHBondContact O-N 2.83Å; R138-T146 WeakPolarHBondContact O-CG2 3.36Å; R138-K193 WeakPolarHBondContact CD-O 3.37Å; R138-K193 HydrophobicContact CG-CB 4.34Å; R138-E196 IonicContact NH1-OE2 3.92Å; R138-E196 PolarHBondContact NH1-OE2 3.05Å; R138-D197 IonicContact NE-OD1 3.03Å; R138-D197 PolarHBondContact NE-OD1 2.8Å; R138-D197 IonicContact NH2-OD1 3.65Å; R138-L200 VanDerWaalsContact NH2-CD2 3.25Å
139	I	90	Very high	87.5	Confident	0 Å²	0	60.6 Å²	60.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-65.7	-38.9	178	-64.2	159.3	0	0	0	110.9	V131 S135 V136 T146 I147 I174 I190 K193 V194	V131-I139 HydrophobicContact CB-CD1 4.15Å; V131-I139 HydrophobicContact CG1-CD1 4.12Å; V131-I139 HydrophobicContact CG2-CD1 3.93Å; S135-I139 WeakPolarHBondContact O-CG1 3.39Å; S135-I139 PolarHBondContact O-N 2.91Å; V136-I139 PolarHBondContact O-N 2.81Å; V136-I139 VanDerWaalsContact O-N 3.15Å; I139-T146 WeakPolarHBondContact O-CB 3.29Å; I139-I147 PolarHBondContact O-N 2.81Å; I139-I174 HydrophobicContact CD1-CD1 4.06Å; I139-I174 HydrophobicContact CG2-CD1 4.03Å; I139-I190 HydrophobicContact CD1-CG2 3.84Å; I139-I190 HydrophobicContact CG1-CG2 4.22Å; I139-I190 HydrophobicContact CG2-CG1 4.24Å; I139-I190 HydrophobicContact CG2-CG2 4.23Å; I139-K193 HydrophobicContact CG1-CB 3.97Å; I139-V194 HydrophobicContact CD1-CG2 3.99Å
140	I	87.5	Confident	87.6	Confident	51 Å²	51	59.7 Å²	59.7	26%	0.262	32%	0.317	S	S	.	.	H	α-helix	trans	-74.9	-50	176.2	-65.1	178.8	0	0	0	110.7	V136 G144 T146 I147	V136-I140 HydrophobicContact CG1-CD1 3.59Å; V136-I140 HydrophobicContact CG1-CG1 4.02Å; V136-I140 WeakPolarHBondContact O-CG1 3.48Å; V136-I140 PolarHBondContact O-N 2.83Å; I140-G144 CarbonylContact O-C 3.19Å; I140-G144 VanDerWaalsContact O-CA 3.25Å; I140-G144 WeakPolarHBondContact O-CA 3.36Å; I140-T146 WeakPolarHBondContact O-CB 3.25Å; I140-T146 PolarHBondContact O-N 2.89Å; I140-T146 VanDerWaalsContact O-N 3.09Å; I140-I147 HydrophobicContact CG2-CG2 4.21Å; I140-I147 PolarHBondContact O-N 2.75Å
141	G	82.6	Confident	87.8	Confident	17 Å²	17	57.9 Å²	57.9	18%	0.175	30%	0.304	C	S	.	.			trans	77.2	165.8	-174.8	0	0	0	0	0	113.6	G137 G143 G144 T146	G137-G141 WeakPolarHBondContact O-CA 3.46Å; G137-G141 PolarHBondContact O-N 2.71Å; G141-G143 PolarHBondContact O-N 2.84Å; G141-G144 PolarHBondContact O-N 3.05Å; G141-T146 WeakPolarHBondContact CA-OG1 3.35Å
142	R	80.3	Confident	88.1	Confident	236 Å²	236	66.8 Å²	66.8	89%	0.891	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-57.3	129.9	177.8	-70.3	-178.7	174	-179.9	-4.2	110	G144 E145	R142-G144 PolarHBondContact O-N 3.39Å; R142-E145 WeakPolarHBondContact O-CB 3.33Å; R142-E145 PolarHBondContact O-N 3.46Å
143	G	79.3	Confident	88.5	Confident	69 Å²	69	68.7 Å²	68.7	71%	0.711	36%	0.361	S	S	*	.	G	3₁₀ helix	trans	59.7	9.6	-174.7	0	0	0	0	0	115.7	G141 R148	G141-G143 PolarHBondContact O-N 2.84Å; G143-R148 PolarHBondContact O-NH2 3.24Å
144	G	85.3	Confident	89.2	Confident	11 Å²	11	67.5 Å²	67.5	11%	0.113	36%	0.357	C	S	.	.	G	3₁₀ helix	trans	79	19.1	-170.4	0	0	0	0	0	114.8	I140 G141 R142 I147 R148	I140-G144 CarbonylContact O-C 3.19Å; I140-G144 VanDerWaalsContact O-CA 3.25Å; I140-G144 WeakPolarHBondContact O-CA 3.36Å; G141-G144 PolarHBondContact O-N 3.05Å; R142-G144 PolarHBondContact O-N 3.39Å; G144-I147 WeakPolarHBondContact O-CG2 3.42Å; G144-R148 WeakPolarHBondContact O-CB 3.07Å; G144-R148 WeakPolarHBondContact O-CD 2.89Å; G144-R148 WeakPolarHBondContact O-CG 3.23Å; G144-R148 PolarHBondContact O-N 3.48Å; G144-R148 VanDerWaalsContact O-N 3.12Å; G144-R148 PolarHBondContact O-NE 3.22Å
145	E	88.9	Confident	89.9	Confident	140 Å²	140	63.5 Å²	63.5	65%	0.654	36%	0.356	S	S	*	.	H	α-helix	trans	-58	-50.2	180	-179.4	175.3	-147.1	0	0	112.9	R142 I147 R148 S149	R142-E145 WeakPolarHBondContact O-CB 3.33Å; R142-E145 PolarHBondContact O-N 3.46Å; E145-I147 PolarHBondContact O-N 2.84Å; E145-R148 PolarHBondContact O-N 2.89Å; E145-S149 PolarHBondContact O-N 2.86Å
146	T	92.1	Very high	90.3	Very high	36 Å²	36	63.6 Å²	63.6	22%	0.221	36%	0.357	C	S	.	.	H	α-helix	trans	-62	-47.6	-176.4	-50.2	0	0	0	0	111.2	R138 I139 I140 G141 R148 S149 I150 K193	R138-T146 WeakPolarHBondContact O-CG2 3.36Å; I139-T146 WeakPolarHBondContact O-CB 3.29Å; I140-T146 WeakPolarHBondContact O-CB 3.25Å; I140-T146 PolarHBondContact O-N 2.89Å; I140-T146 VanDerWaalsContact O-N 3.09Å; G141-T146 WeakPolarHBondContact CA-OG1 3.35Å; T146-R148 VanDerWaalsContact C-N 3.34Å; T146-R148 PolarHBondContact O-N 3.4Å; T146-S149 WeakPolarHBondContact O-CA 3.24Å; T146-S149 WeakPolarHBondContact O-CB 3.2Å; T146-S149 PolarHBondContact O-N 3.34Å; T146-S149 VanDerWaalsContact O-N 3.11Å; T146-I150 HydrophobicContact CG2-CD1 4.07Å; T146-I150 HydrophobicContact CG2-CG1 4.48Å; T146-I150 WeakPolarHBondContact O-CG1 3.39Å; T146-I150 PolarHBondContact O-N 2.99Å; T146-K193 HydrophobicContact CG2-CG 4.35Å
147	I	92.9	Very high	90.8	Very high	29 Å²	29	70.4 Å²	70.4	15%	0.149	39%	0.386	C	S	.	.	H	α-helix	trans	-66.2	-34.3	178.9	-172	167.5	0	0	0	112.4	I139 I140 G144 E145 S149 I150 C151 I158	I139-I147 PolarHBondContact O-N 2.81Å; I140-I147 HydrophobicContact CG2-CG2 4.21Å; I140-I147 PolarHBondContact O-N 2.75Å; G144-I147 WeakPolarHBondContact O-CG2 3.42Å; E145-I147 PolarHBondContact O-N 2.84Å; I147-S149 VanDerWaalsContact C-N 3.35Å; I147-I150 PolarHBondContact O-N 3.33Å; I147-C151 WeakPolarHBondContact O-CB 3.34Å; I147-C151 PolarHBondContact O-N 3.49Å; I147-C151 PolarHBondContact O-SG 2.97Å; I147-I158 HydrophobicContact CD1-CB 4.21Å; I147-I158 HydrophobicContact CD1-CG2 3.8Å; I147-I158 HydrophobicContact CG1-CB 4.31Å; I147-I158 HydrophobicContact CG1-CG2 4.27Å
148	R	94.1	Very high	91.3	Very high	175 Å²	175	68.5 Å²	68.5	66%	0.66	36%	0.363	S	S	*	.	H	α-helix	trans	-63.4	-41.7	171.2	-69.3	165.9	-159.1	-162	7.2	111.1	G143 G144 E145 T146 C151 K152	G143-R148 PolarHBondContact O-NH2 3.24Å; G144-R148 WeakPolarHBondContact O-CB 3.07Å; G144-R148 WeakPolarHBondContact O-CD 2.89Å; G144-R148 WeakPolarHBondContact O-CG 3.23Å; G144-R148 PolarHBondContact O-N 3.48Å; G144-R148 VanDerWaalsContact O-N 3.12Å; G144-R148 PolarHBondContact O-NE 3.22Å; E145-R148 PolarHBondContact O-N 2.89Å; T146-R148 VanDerWaalsContact C-N 3.34Å; T146-R148 PolarHBondContact O-N 3.4Å; R148-C151 PolarHBondContact O-N 3.41Å; R148-K152 WeakPolarHBondContact O-CB 3.17Å; R148-K152 PolarHBondContact O-N 3.04Å
149	S	95.9	Very high	91.5	Very high	71 Å²	71	67.7 Å²	67.7	50%	0.497	37%	0.367	S	S	.	.	H	α-helix	trans	-63.1	-46	176.1	-165.4	0	0	0	0	111.5	E145 T146 I147 C151 K152 A153	E145-S149 PolarHBondContact O-N 2.86Å; T146-S149 WeakPolarHBondContact O-CA 3.24Å; T146-S149 WeakPolarHBondContact O-CB 3.2Å; T146-S149 PolarHBondContact O-N 3.34Å; T146-S149 VanDerWaalsContact O-N 3.11Å; I147-S149 VanDerWaalsContact C-N 3.35Å; S149-C151 PolarHBondContact O-N 3.43Å; S149-K152 PolarHBondContact O-N 3.5Å; S149-A153 WeakPolarHBondContact O-CB 3.14Å; S149-A153 PolarHBondContact O-N 2.89Å
150	I	96.4	Very high	91.2	Very high	9 Å²	9	68.9 Å²	68.9	5%	0.046	37%	0.374	C	S	.	.	H	α-helix	trans	-61.8	-45.5	176.1	-62	169.5	0	0	0	110.9	T146 I147 K152 A153 S154 I158 L189 I190 K193	T146-I150 HydrophobicContact CG2-CD1 4.07Å; T146-I150 HydrophobicContact CG2-CG1 4.48Å; T146-I150 WeakPolarHBondContact O-CG1 3.39Å; T146-I150 PolarHBondContact O-N 2.99Å; I147-I150 PolarHBondContact O-N 3.33Å; I150-K152 VanDerWaalsContact C-N 3.33Å; I150-K152 PolarHBondContact O-N 3.02Å; I150-A153 PolarHBondContact O-N 3.41Å; I150-S154 VanDerWaalsContact O-CB 3.29Å; I150-S154 WeakPolarHBondContact O-CB 3.48Å; I150-S154 PolarHBondContact O-N 2.97Å; I150-S154 PolarHBondContact O-OG 3.06Å; I150-I158 HydrophobicContact CB-CD1 4.13Å; I150-I158 HydrophobicContact CG2-CD1 3.45Å; I150-I158 VanDerWaalsContact CG2-CD1 3.45Å; I150-L189 HydrophobicContact CG1-CB 4.18Å; I150-L189 HydrophobicContact CG2-CB 3.78Å; I150-L189 HydrophobicContact CG2-CD1 3.98Å; I150-I190 HydrophobicContact CD1-CG1 4.39Å; I150-I190 HydrophobicContact CG2-CG1 4.43Å; I150-K193 HydrophobicContact CD1-CG 4.39Å
151	C	95.9	Very high	90.5	Very high	37 Å²	37	70 Å²	70	25%	0.25	38%	0.381	C	S	.	.	H	α-helix	trans	-59.5	-43	175.3	-67	0	0	0	0	111.6	I147 R148 S149 G155	I147-C151 WeakPolarHBondContact O-CB 3.34Å; I147-C151 PolarHBondContact O-N 3.49Å; I147-C151 PolarHBondContact O-SG 2.97Å; R148-C151 PolarHBondContact O-N 3.41Å; S149-C151 PolarHBondContact O-N 3.43Å; C151-G155 WeakPolarHBondContact O-CA 3.49Å; C151-G155 PolarHBondContact O-N 3.35Å
152	K	96.4	Very high	89.7	Confident	189 Å²	189	78.5 Å²	78.5	82%	0.822	41%	0.413	S	S	*	.	H	α-helix	trans	-66.1	-39.5	178.6	-177.6	-174.8	174.7	-170.9	0	112.8	R148 S149 I150	R148-K152 WeakPolarHBondContact O-CB 3.17Å; R148-K152 PolarHBondContact O-N 3.04Å; S149-K152 PolarHBondContact O-N 3.5Å; I150-K152 VanDerWaalsContact C-N 3.33Å; I150-K152 PolarHBondContact O-N 3.02Å
153	A	96.6	Very high	88.9	Confident	75 Å²	75	70.8 Å²	70.8	62%	0.62	39%	0.387	S	S	*	.	H	α-helix	trans	-78.9	-35.6	-178.1	0	0	0	0	0	113	S149 I150 L189	S149-A153 WeakPolarHBondContact O-CB 3.14Å; S149-A153 PolarHBondContact O-N 2.89Å; I150-A153 PolarHBondContact O-N 3.41Å; A153-L189 HydrophobicContact CB-CD1 4.03Å
154	S	96.9	Very high	87.6	Confident	8 Å²	8	71.6 Å²	71.6	6%	0.056	38%	0.382	C	S	.	.	H	α-helix	trans	-89.2	-21.3	-179.2	63.2	0	0	0	0	114.6	I150 A156 E182	I150-S154 VanDerWaalsContact O-CB 3.29Å; I150-S154 WeakPolarHBondContact O-CB 3.48Å; I150-S154 PolarHBondContact O-N 2.97Å; I150-S154 PolarHBondContact O-OG 3.06Å; S154-A156 PolarHBondContact O-N 3.2Å; S154-A156 PolarHBondContact OG-N 2.74Å; S154-E182 VanDerWaalsContact O-CA 3.23Å; S154-E182 WeakPolarHBondContact O-CA 3.16Å; S154-E182 WeakPolarHBondContact O-CB 3.47Å; S154-E182 VanDerWaalsContact O-CG 3.24Å; S154-E182 WeakPolarHBondContact O-CG 3.25Å
155	G	94	Very high	85.9	Confident	46 Å²	46	80.4 Å²	80.4	47%	0.474	42%	0.42	S	S	.	.			trans	76.8	-16.4	-169.4	0	0	0	0	0	114.3	C151	C151-G155 WeakPolarHBondContact O-CA 3.49Å; C151-G155 PolarHBondContact O-N 3.35Å
156	A	96.3	Very high	84.1	Confident	3 Å²	3	76.6 Å²	76.6	3%	0.025	42%	0.419	C	S	.	.			trans	-75.6	147.1	-176.8	0	0	0	0	0	112.7	S154 I176 S177 E182 A186	S154-A156 PolarHBondContact O-N 3.2Å; S154-A156 PolarHBondContact OG-N 2.74Å; A156-I176 HydrophobicContact CB-CG2 3.94Å; A156-S177 WeakPolarHBondContact CA-O 3.46Å; A156-E182 HydrophobicContact CB-CB 4.17Å; A156-A186 HydrophobicContact CB-CB 3.74Å
157	K	95.4	Very high	82.5	Confident	146 Å²	146	78.6 Å²	78.6	64%	0.635	43%	0.431	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-84.5	115.7	165.3	177.8	-179	178.5	-179.1	0	109.4	S177	K157-S177 PolarHBondContact N-O 2.96Å; K157-S177 PolarHBondContact O-N 3.31Å; K157-S177 PolarHBondContact O-OG 3.15Å
158	I	95	Very high	81.1	Confident	15 Å²	15	78.7 Å²	78.7	8%	0.077	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.6	145.4	176	-55.5	167.1	0	0	0	109.2	I147 I150 I174 K175 I176 A186 I190	I147-I158 HydrophobicContact CD1-CB 4.21Å; I147-I158 HydrophobicContact CD1-CG2 3.8Å; I147-I158 HydrophobicContact CG1-CB 4.31Å; I147-I158 HydrophobicContact CG1-CG2 4.27Å; I150-I158 HydrophobicContact CB-CD1 4.13Å; I150-I158 HydrophobicContact CG2-CD1 3.45Å; I150-I158 VanDerWaalsContact CG2-CD1 3.45Å; I158-I174 HydrophobicContact CG2-CG2 3.44Å; I158-I174 VanDerWaalsContact CG2-CG2 3.44Å; I158-K175 CarbonylContact C-O 3.58Å; I158-K175 WeakPolarHBondContact CA-O 3.27Å; I158-I176 HydrophobicContact CG1-CG2 4.36Å; I158-A186 HydrophobicContact CD1-CB 4.24Å; I158-A186 HydrophobicContact CG1-CB 4.47Å; I158-I190 HydrophobicContact CD1-CD1 4.1Å; I158-I190 HydrophobicContact CG2-CD1 4.42Å
159	T	89.6	Confident	79.8	Confident	59 Å²	59	74 Å²	74	36%	0.362	42%	0.419	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	120.2	175.2	-60.8	0	0	0	0	108.8	K175	T159-K175 PolarHBondContact N-O 3.14Å; T159-K175 PolarHBondContact O-N 2.94Å
160	C	83.3	Confident	78.8	Confident	24 Å²	24	75.5 Å²	75.5	16%	0.162	42%	0.421	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	119.9	172.1	-53.8	0	0	0	0	107.5
161	D	74.1	Confident	78.1	Confident	76 Å²	76	77.9 Å²	77.9	41%	0.406	44%	0.439	S	S	.	.	P	Polyproline II helix	trans	-60.8	141.4	-179.9	-65.3	-41.5	0	0	0	109.9	R172	D161-R172 VanDerWaalsContact O-CZ 3.25Å; D161-R172 PolarHBondContact O-NE 3.38Å; D161-R172 PolarHBondContact O-NH2 2.87Å
162	K	65.5	Low	77.5	Confident	195 Å²	195	78.5 Å²	78.5	85%	0.848	44%	0.435	S	S	*	.	P	Polyproline II helix	trans	-66.8	150.4	174.4	-80.1	-165.8	172.9	-166.5	0	109.6
163	E	62.4	Low	77.2	Confident	73 Å²	73	72.5 Å²	72.5	34%	0.341	41%	0.412	S	S	.	.	P	Polyproline II helix	trans	-65.4	136.7	-178.7	-164.9	147.5	-155.8	0	0	110.3	Q133	Q133-E163 VanDerWaalsContact NE2-CD 3.33Å; Q133-E163 PolarHBondContact NE2-OE1 3.31Å; Q133-E163 PolarHBondContact NE2-OE2 2.79Å
164	S	52.3	Low	76.9	Confident	86 Å²	86	69 Å²	69	60%	0.601	38%	0.383	S	S	*	.	P	Polyproline II helix	trans	-82.9	118.7	169.6	-60.5	0	0	0	0	107.8
165	E	49.2	Very low	76.8	Confident	197 Å²	197	73.1 Å²	73.1	92%	0.921	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-48.8	136.9	-170.3	-68	167.5	177.3	0	0	113	T167	E165-T167 PolarHBondContact O-N 2.86Å
166	G	52.8	Low	76.9	Confident	60 Å²	60	70.9 Å²	70.9	62%	0.619	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	86.6	-18	173.4	0	0	0	0	0	117.4
167	T	57.7	Low	76.9	Confident	78 Å²	78	72.4 Å²	72.4	48%	0.479	39%	0.388	S	S	.	.			trans	-96.8	114.9	-177.6	-54.5	0	0	0	0	112.7	E165 L169	E165-T167 PolarHBondContact O-N 2.86Å; T167-L169 VanDerWaalsContact C-N 3.34Å; T167-L169 HydrophobicContact CG2-CD2 3.65Å; T167-L169 HydrophobicContact CG2-CG 3.96Å; T167-L169 PolarHBondContact O-N 3.12Å
168	L	63.2	Low	76.8	Confident	30 Å²	30	66.3 Å²	66.3	16%	0.157	37%	0.366	C	S	.	.			trans	-74.3	82.9	175.4	-129.9	174.5	0	0	0	110.7	L170 Y307 V452 Y472 K479	L168-L170 PolarHBondContact O-N 2.82Å; L168-Y307 HydrophobicContact CD1-CD1 3.94Å; L168-Y307 HydrophobicContact CD1-CE1 3.64Å; L168-Y307 HydrophobicContact CD2-CD1 4.02Å; L168-Y307 HydrophobicContact CD2-CD2 4.39Å; L168-Y307 HydrophobicContact CD2-CE1 4.13Å; L168-Y307 HydrophobicContact CD2-CE2 4.49Å; L168-Y307 HydrophobicContact CD2-CG 4.17Å; L168-Y307 HydrophobicContact CG-CD1 3.85Å; L168-Y307 HydrophobicContact CG-CE1 3.47Å; L168-Y307 VanDerWaalsContact CG-CE1 3.47Å; L168-Y307 HydrophobicContact CG-CE2 4.24Å; L168-Y307 HydrophobicContact CG-CG 4.39Å; L168-V452 HydrophobicContact CD1-CG1 4.22Å; L168-V452 HydrophobicContact CD2-CG1 4.3Å; L168-Y472 HydrophobicContact CD1-CD2 3.41Å; L168-Y472 VanDerWaalsContact CD1-CD2 3.41Å; L168-Y472 HydrophobicContact CD1-CE2 3.71Å; L168-Y472 HydrophobicContact CD1-CG 3.97Å; L168-K479 HydrophobicContact CB-CD 3.99Å; L168-K479 HydrophobicContact CD1-CD 4.1Å
169	L	67.6	Low	76.7	Confident	76 Å²	76	66.8 Å²	66.8	40%	0.398	37%	0.37	S	S	.	.			trans	-77.9	119.3	-178.8	-66.8	175.1	0	0	0	110.8	Q133 T167 S171	Q133-L169 WeakPolarHBondContact CB-O 3.37Å; Q133-L169 WeakPolarHBondContact CG-O 3.48Å; T167-L169 VanDerWaalsContact C-N 3.34Å; T167-L169 HydrophobicContact CG2-CD2 3.65Å; T167-L169 HydrophobicContact CG2-CG 3.96Å; T167-L169 PolarHBondContact O-N 3.12Å; L169-S171 PolarHBondContact O-N 2.99Å
170	L	73.3	Confident	76.8	Confident	104 Å²	104	68.3 Å²	68.3	55%	0.545	37%	0.373	S	S	.	.	S	Bend	trans	-67.8	-22.5	175.8	-66.8	174.4	0	0	0	112.9	P132 Q133 L168 T474	P132-L170 WeakPolarHBondContact CA-O 3.31Å; Q133-L170 PolarHBondContact N-O 2.62Å; L168-L170 PolarHBondContact O-N 2.82Å; L170-T474 HydrophobicContact CD2-CG2 4.34Å
171	S	82.3	Confident	77.3	Confident	59 Å²	59	73 Å²	73	41%	0.413	39%	0.391	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.2	143.5	176.1	60.5	0	0	0	0	111.8	S130 V131 L169	S130-S171 WeakPolarHBondContact OG-CB 3.21Å; V131-S171 CarbonylContact O-C 3.59Å; V131-S171 WeakPolarHBondContact O-CA 2.89Å; V131-S171 WeakPolarHBondContact O-CB 3.41Å; L169-S171 PolarHBondContact O-N 2.99Å
172	R	84	Confident	78.3	Confident	49 Å²	49	72.6 Å²	72.6	19%	0.185	39%	0.386	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.1	146.5	177.7	-164.3	-173.9	-166.4	140.7	-7.1	110.6	V131 V136 D161	V131-R172 PolarHBondContact N-O 2.89Å; V131-R172 PolarHBondContact O-N 3.2Å; V136-R172 HydrophobicContact CG2-CB 3.84Å; V136-R172 HydrophobicContact CG2-CG 4.44Å; D161-R172 VanDerWaalsContact O-CZ 3.25Å; D161-R172 PolarHBondContact O-NE 3.38Å; D161-R172 PolarHBondContact O-NH2 2.87Å
173	L	88.8	Confident	79.8	Confident	64 Å²	64	63.3 Å²	63.3	34%	0.335	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	128.7	174.7	-153	63.1	0	0	0	110.5	Q128	Q128-L173 HydrophobicContact CB-CD1 3.94Å; Q128-L173 HydrophobicContact CB-CD2 4.29Å; Q128-L173 HydrophobicContact CB-CG 4.07Å; Q128-L173 HydrophobicContact CG-CD2 4.17Å; Q128-L173 HydrophobicContact CG-CG 4.33Å
174	I	92	Very high	81.4	Confident	0 Å²	0	62.2 Å²	62.2	0%	0	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.3	118.8	170.9	-60.3	-175.9	0	0	0	107.9	Q128 L129 V131 I139 I158 I176 I190	Q128-I174 WeakPolarHBondContact CA-O 3.42Å; L129-I174 PolarHBondContact N-O 3.43Å; L129-I174 PolarHBondContact O-N 3.2Å; V131-I174 HydrophobicContact CG1-CD1 4.13Å; V131-I174 HydrophobicContact CG2-CD1 3.66Å; V131-I174 HydrophobicContact CG2-CG1 4.03Å; I139-I174 HydrophobicContact CD1-CD1 4.06Å; I139-I174 HydrophobicContact CG2-CD1 4.03Å; I158-I174 HydrophobicContact CG2-CG2 3.44Å; I158-I174 VanDerWaalsContact CG2-CG2 3.44Å; I174-I176 HydrophobicContact CG2-CG1 4.18Å; I174-I190 HydrophobicContact CD1-CG2 4.26Å; I174-I190 HydrophobicContact CG2-CD1 4.2Å
175	K	94.5	Very high	83.5	Confident	95 Å²	95	60 Å²	60	41%	0.413	34%	0.337	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	130.3	173.4	-172.5	172	-177.6	172.3	0	109.7	S126 I158 T159	S126-K175 WeakPolarHBondContact OG-CE 2.98Å; I158-K175 CarbonylContact C-O 3.58Å; I158-K175 WeakPolarHBondContact CA-O 3.27Å; T159-K175 PolarHBondContact N-O 3.14Å; T159-K175 PolarHBondContact O-N 2.94Å
176	I	96.3	Very high	85.8	Confident	0 Å²	0	50.7 Å²	50.7	0%	0	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	143	180	-47.6	174.5	0	0	0	107.4	S126 E127 L129 A156 I158 I174 V183 A186 K187 I190	S126-I176 CarbonylContact C-O 3.6Å; S126-I176 WeakPolarHBondContact CA-O 3.45Å; S126-I176 PolarHBondContact OG-O 3.31Å; E127-I176 PolarHBondContact N-O 3.23Å; E127-I176 PolarHBondContact O-N 2.71Å; L129-I176 HydrophobicContact CB-CD1 4.31Å; L129-I176 HydrophobicContact CD2-CD1 4.48Å; A156-I176 HydrophobicContact CB-CG2 3.94Å; I158-I176 HydrophobicContact CG1-CG2 4.36Å; I174-I176 HydrophobicContact CG2-CG1 4.18Å; I176-V183 HydrophobicContact CB-CG1 4.24Å; I176-V183 HydrophobicContact CG2-CB 4.26Å; I176-V183 HydrophobicContact CG2-CG1 3.92Å; I176-V183 HydrophobicContact CG2-CG2 4.06Å; I176-A186 HydrophobicContact CG2-CB 3.71Å; I176-K187 HydrophobicContact CD1-CG 3.67Å; I176-I190 HydrophobicContact CD1-CD1 3.67Å; I176-I190 HydrophobicContact CG1-CD1 4.25Å
177	S	94.7	Very high	87.9	Confident	35 Å²	35	50.1 Å²	50.1	25%	0.245	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.4	137.8	-179.6	50.3	0	0	0	0	112.2	V125 A156 K157	V125-S177 WeakPolarHBondContact O-CA 3.34Å; A156-S177 WeakPolarHBondContact CA-O 3.46Å; K157-S177 PolarHBondContact N-O 2.96Å; K157-S177 PolarHBondContact O-N 3.31Å; K157-S177 PolarHBondContact O-OG 3.15Å
178	G	93.9	Very high	89.8	Confident	18 Å²	18	52.5 Å²	52.5	19%	0.186	28%	0.279	C	S	.	.	E	Extended strand (participates in β ladder)	trans	161.8	-166.2	-175.4	0	0	0	0	0	110.6	P124 V125	P124-G178 WeakPolarHBondContact CA-O 3.46Å; V125-G178 PolarHBondContact N-O 3.13Å; V125-G178 PolarHBondContact O-N 2.81Å; V125-G178 VanDerWaalsContact O-N 3.1Å
179	T	93.3	Very high	91.4	Very high	25 Å²	25	53.3 Å²	53.3	15%	0.153	28%	0.283	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.7	162.8	166.2	62.6	0	0	0	0	111.3	E121 K181 E182 V183	E121-T179 WeakPolarHBondContact O-CB 3.41Å; T179-K181 PolarHBondContact O-N 3.28Å; T179-K181 VanDerWaalsContact O-N 3.13Å; T179-E182 WeakPolarHBondContact CB-OE2 3.35Å; T179-E182 WeakPolarHBondContact CG2-OE2 3.48Å; T179-E182 PolarHBondContact N-OE2 3.02Å; T179-E182 PolarHBondContact O-N 3.29Å; T179-E182 VanDerWaalsContact O-N 3.14Å; T179-E182 WeakPolarHBondContact OG1-CG 3.13Å; T179-E182 PolarHBondContact OG1-N 3.23Å; T179-E182 PolarHBondContact OG1-OE2 2.93Å; T179-V183 WeakPolarHBondContact O-CG2 3.22Å; T179-V183 PolarHBondContact O-N 3.11Å
180	Q	92	Very high	92.7	Very high	90 Å²	90	49.8 Å²	49.8	42%	0.421	26%	0.264	S	S	.	.	H	α-helix	trans	-58.8	-30	-179.4	-171.8	60.9	84.8	0	0	113.4	V125 A184	V125-Q180 HydrophobicContact CG2-CB 4.36Å; Q180-A184 VanDerWaalsContact O-CB 3.29Å; Q180-A184 WeakPolarHBondContact O-CB 3.48Å; Q180-A184 PolarHBondContact O-N 3.29Å
181	K	92.8	Very high	93.8	Very high	124 Å²	124	49.1 Å²	49.1	54%	0.539	26%	0.261	S	S	.	.	H	α-helix	trans	-72.8	-46.1	176.2	-69.4	176.4	176.8	175.5	0	111.6	E121 T179 A184 A185	E121-K181 IonicContact OE1-NZ 3.14Å; E121-K181 PolarHBondContact OE1-NZ 3.44Å; E121-K181 IonicContact OE2-NZ 3.58Å; E121-K181 PolarHBondContact OE2-NZ 2.97Å; T179-K181 PolarHBondContact O-N 3.28Å; T179-K181 VanDerWaalsContact O-N 3.13Å; K181-A184 PolarHBondContact O-N 3.25Å; K181-A185 PolarHBondContact O-N 3.14Å
182	E	95.8	Very high	94.5	Very high	66 Å²	66	50.5 Å²	50.5	31%	0.308	26%	0.261	S	S	.	.	H	α-helix	trans	-64.8	-43.7	178.7	-66.2	164.6	143.2	0	0	111.4	S154 A156 T179 A184 A185 A186	S154-E182 VanDerWaalsContact O-CA 3.23Å; S154-E182 WeakPolarHBondContact O-CA 3.16Å; S154-E182 WeakPolarHBondContact O-CB 3.47Å; S154-E182 VanDerWaalsContact O-CG 3.24Å; S154-E182 WeakPolarHBondContact O-CG 3.25Å; A156-E182 HydrophobicContact CB-CB 4.17Å; T179-E182 WeakPolarHBondContact CB-OE2 3.35Å; T179-E182 WeakPolarHBondContact CG2-OE2 3.48Å; T179-E182 PolarHBondContact N-OE2 3.02Å; T179-E182 PolarHBondContact O-N 3.29Å; T179-E182 VanDerWaalsContact O-N 3.14Å; T179-E182 WeakPolarHBondContact OG1-CG 3.13Å; T179-E182 PolarHBondContact OG1-N 3.23Å; T179-E182 PolarHBondContact OG1-OE2 2.93Å; E182-A184 PolarHBondContact O-N 3.19Å; E182-A185 PolarHBondContact O-N 3.38Å; E182-A186 WeakPolarHBondContact O-CB 3.45Å; E182-A186 PolarHBondContact O-N 2.97Å
183	V	96.5	Very high	94.9	Very high	0 Å²	0	50.5 Å²	50.5	0%	0	26%	0.262	C	S	.	.	H	α-helix	trans	-66.1	-37.6	177.7	175.7	0	0	0	0	111.8	V125 E127 I176 T179 A186 K187	V125-V183 HydrophobicContact CG2-CB 4.2Å; V125-V183 HydrophobicContact CG2-CG2 3.92Å; E127-V183 HydrophobicContact CB-CG1 4.03Å; E127-V183 HydrophobicContact CG-CG1 4.01Å; E127-V183 WeakPolarHBondContact OE1-CG1 3.31Å; I176-V183 HydrophobicContact CB-CG1 4.24Å; I176-V183 HydrophobicContact CG2-CB 4.26Å; I176-V183 HydrophobicContact CG2-CG1 3.92Å; I176-V183 HydrophobicContact CG2-CG2 4.06Å; T179-V183 WeakPolarHBondContact O-CG2 3.22Å; T179-V183 PolarHBondContact O-N 3.11Å; V183-A186 PolarHBondContact O-N 2.98Å; V183-K187 HydrophobicContact CG1-CD 4.49Å; V183-K187 WeakPolarHBondContact O-CB 3.24Å; V183-K187 WeakPolarHBondContact O-CG 2.92Å; V183-K187 PolarHBondContact O-N 2.66Å
184	A	95.6	Very high	95.1	Very high	51 Å²	51	48.1 Å²	48.1	42%	0.421	25%	0.25	S	S	.	.	H	α-helix	trans	-65.4	-43	174.1	0	0	0	0	0	112.3	Q180 K181 E182 K187 H188	Q180-A184 VanDerWaalsContact O-CB 3.29Å; Q180-A184 WeakPolarHBondContact O-CB 3.48Å; Q180-A184 PolarHBondContact O-N 3.29Å; K181-A184 PolarHBondContact O-N 3.25Å; E182-A184 PolarHBondContact O-N 3.19Å; A184-K187 PolarHBondContact O-N 2.89Å; A184-H188 PolarHBondContact O-N 3Å
185	A	97.1	Very high	95.3	Very high	40 Å²	40	50.5 Å²	50.5	33%	0.331	27%	0.267	S	S	.	.	H	α-helix	trans	-63.5	-43.7	175.3	0	0	0	0	0	112	K181 E182 H188 L189	K181-A185 PolarHBondContact O-N 3.14Å; E182-A185 PolarHBondContact O-N 3.38Å; A185-H188 PolarHBondContact O-N 3.21Å; A185-L189 WeakPolarHBondContact O-CG 3.41Å; A185-L189 PolarHBondContact O-N 3.5Å
186	A	97.6	Very high	95.1	Very high	0 Å²	0	48.9 Å²	48.9	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-60.9	-44.9	176	0	0	0	0	0	112.2	A156 I158 I176 E182 V183 H188 L189 I190	A156-A186 HydrophobicContact CB-CB 3.74Å; I158-A186 HydrophobicContact CD1-CB 4.24Å; I158-A186 HydrophobicContact CG1-CB 4.47Å; I176-A186 HydrophobicContact CG2-CB 3.71Å; E182-A186 WeakPolarHBondContact O-CB 3.45Å; E182-A186 PolarHBondContact O-N 2.97Å; V183-A186 PolarHBondContact O-N 2.98Å; A186-H188 PolarHBondContact O-N 2.91Å; A186-L189 PolarHBondContact O-N 2.98Å; A186-I190 WeakPolarHBondContact O-CD1 3.19Å; A186-I190 VanDerWaalsContact O-CG1 3.24Å; A186-I190 WeakPolarHBondContact O-CG1 3.32Å; A186-I190 PolarHBondContact O-N 3.38Å
187	K	96.9	Very high	94.8	Very high	49 Å²	49	49.3 Å²	49.3	21%	0.213	26%	0.263	C	S	.	.	H	α-helix	trans	-57.6	-46.1	173.9	-79.8	174.7	168	178.5	0	112.1	E127 I176 V183 A184 I190 L191	E127-K187 WeakPolarHBondContact OE1-CE 3.38Å; E127-K187 IonicContact OE1-NZ 4Å; E127-K187 PolarHBondContact OE1-NZ 3.03Å; E127-K187 IonicContact OE2-NZ 3.33Å; E127-K187 PolarHBondContact OE2-NZ 2.94Å; I176-K187 HydrophobicContact CD1-CG 3.67Å; V183-K187 HydrophobicContact CG1-CD 4.49Å; V183-K187 WeakPolarHBondContact O-CB 3.24Å; V183-K187 WeakPolarHBondContact O-CG 2.92Å; V183-K187 PolarHBondContact O-N 2.66Å; A184-K187 PolarHBondContact O-N 2.89Å; K187-I190 PolarHBondContact O-N 3.34Å; K187-L191 WeakPolarHBondContact O-CB 3.29Å; K187-L191 VanDerWaalsContact O-CG 3.28Å; K187-L191 WeakPolarHBondContact O-CG 3.42Å; K187-L191 PolarHBondContact O-N 3.47Å
188	H	97.5	Very high	94.7	Very high	128 Å²	128	51.4 Å²	51.4	59%	0.593	27%	0.269	S	S	*	.	H	α-helix	trans	-58.3	-51.8	178.8	-173.3	-71.2	0	0	0	111.4	A184 A185 A186 I190 L191 E192	A184-H188 PolarHBondContact O-N 3Å; A185-H188 PolarHBondContact O-N 3.21Å; A186-H188 PolarHBondContact O-N 2.91Å; H188-I190 VanDerWaalsContact C-N 3.31Å; H188-I190 PolarHBondContact O-N 2.97Å; H188-L191 PolarHBondContact O-N 3.27Å; H188-E192 IonicContact ND1-OE2 3.15Å; H188-E192 WeakPolarHBondContact O-CB 3.34Å; H188-E192 PolarHBondContact O-N 3.15Å
189	L	97.1	Very high	94.6	Very high	47 Å²	47	55.6 Å²	55.6	25%	0.246	28%	0.284	C	S	.	.	H	α-helix	trans	-63.4	-33.5	179.9	-67	169.9	0	0	0	112.9	I150 A153 A185 A186 K193	I150-L189 HydrophobicContact CG1-CB 4.18Å; I150-L189 HydrophobicContact CG2-CB 3.78Å; I150-L189 HydrophobicContact CG2-CD1 3.98Å; A153-L189 HydrophobicContact CB-CD1 4.03Å; A185-L189 WeakPolarHBondContact O-CG 3.41Å; A185-L189 PolarHBondContact O-N 3.5Å; A186-L189 PolarHBondContact O-N 2.98Å; L189-K193 WeakPolarHBondContact O-CG 3.28Å; L189-K193 PolarHBondContact O-N 2.72Å
190	I	95.9	Very high	94.5	Very high	1 Å²	1	56 Å²	56	1%	0.005	29%	0.285	C	S	.	.	H	α-helix	trans	-70.4	-44.5	173.8	-66.9	161.3	0	0	0	110.8	L129 V131 I139 I150 I158 I174 I176 A186 K187 H188 E192 K193 V194	L129-I190 HydrophobicContact CD2-CB 4.08Å; L129-I190 HydrophobicContact CD2-CD1 4.47Å; L129-I190 HydrophobicContact CD2-CG2 3.65Å; V131-I190 HydrophobicContact CG1-CG2 3.98Å; I139-I190 HydrophobicContact CD1-CG2 3.84Å; I139-I190 HydrophobicContact CG1-CG2 4.22Å; I139-I190 HydrophobicContact CG2-CG1 4.24Å; I139-I190 HydrophobicContact CG2-CG2 4.23Å; I150-I190 HydrophobicContact CD1-CG1 4.39Å; I150-I190 HydrophobicContact CG2-CG1 4.43Å; I158-I190 HydrophobicContact CD1-CD1 4.1Å; I158-I190 HydrophobicContact CG2-CD1 4.42Å; I174-I190 HydrophobicContact CD1-CG2 4.26Å; I174-I190 HydrophobicContact CG2-CD1 4.2Å; I176-I190 HydrophobicContact CD1-CD1 3.67Å; I176-I190 HydrophobicContact CG1-CD1 4.25Å; A186-I190 WeakPolarHBondContact O-CD1 3.19Å; A186-I190 VanDerWaalsContact O-CG1 3.24Å; A186-I190 WeakPolarHBondContact O-CG1 3.32Å; A186-I190 PolarHBondContact O-N 3.38Å; K187-I190 PolarHBondContact O-N 3.34Å; H188-I190 VanDerWaalsContact C-N 3.31Å; H188-I190 PolarHBondContact O-N 2.97Å; I190-E192 VanDerWaalsContact C-N 3.34Å; I190-E192 PolarHBondContact O-N 2.87Å; I190-K193 CarbonylContact O-C 3.57Å; I190-K193 PolarHBondContact O-N 3.42Å; I190-K193 VanDerWaalsContact O-N 3.15Å; I190-V194 PolarHBondContact O-N 3.07Å
191	L	95.9	Very high	94.3	Very high	91 Å²	91	54 Å²	54	48%	0.476	27%	0.274	S	S	.	.	H	α-helix	trans	-66.6	-35.1	179.5	-72.2	170.6	0	0	0	112.3	L129 K187 H188 K193 V194 S195	L129-L191 HydrophobicContact CD1-CD2 4.36Å; L129-L191 HydrophobicContact CD2-CD2 4.45Å; L129-L191 HydrophobicContact CD2-CG 4.39Å; K187-L191 WeakPolarHBondContact O-CB 3.29Å; K187-L191 VanDerWaalsContact O-CG 3.28Å; K187-L191 WeakPolarHBondContact O-CG 3.42Å; K187-L191 PolarHBondContact O-N 3.47Å; H188-L191 PolarHBondContact O-N 3.27Å; L191-K193 VanDerWaalsContact C-N 3.33Å; L191-K193 PolarHBondContact O-N 2.72Å; L191-V194 PolarHBondContact O-N 2.72Å; L191-V194 VanDerWaalsContact O-N 3.09Å; L191-S195 PolarHBondContact O-N 2.64Å
192	E	95.9	Very high	94.3	Very high	87 Å²	87	54 Å²	54	41%	0.407	27%	0.274	S	S	.	.	H	α-helix	trans	-56.8	-45.9	168.8	-178.9	176	-167.8	0	0	111.1	H188 I190 V194 S195 E196	H188-E192 IonicContact ND1-OE2 3.15Å; H188-E192 WeakPolarHBondContact O-CB 3.34Å; H188-E192 PolarHBondContact O-N 3.15Å; I190-E192 VanDerWaalsContact C-N 3.34Å; I190-E192 PolarHBondContact O-N 2.87Å; E192-V194 VanDerWaalsContact C-N 3.32Å; E192-V194 PolarHBondContact O-N 3.05Å; E192-S195 PolarHBondContact O-N 3.17Å; E192-E196 PolarHBondContact O-N 3.37Å
193	K	93.1	Very high	94.1	Very high	50 Å²	50	59 Å²	59	22%	0.217	29%	0.289	C	S	.	.	H	α-helix	trans	-68.2	-24.3	173.1	-63.9	-46.9	-178.7	-172.8	0	114.1	R138 I139 T146 I150 L189 I190 L191 E196 D197	R138-K193 WeakPolarHBondContact CD-O 3.37Å; R138-K193 HydrophobicContact CG-CB 4.34Å; I139-K193 HydrophobicContact CG1-CB 3.97Å; T146-K193 HydrophobicContact CG2-CG 4.35Å; I150-K193 HydrophobicContact CD1-CG 4.39Å; L189-K193 WeakPolarHBondContact O-CG 3.28Å; L189-K193 PolarHBondContact O-N 2.72Å; I190-K193 CarbonylContact O-C 3.57Å; I190-K193 PolarHBondContact O-N 3.42Å; I190-K193 VanDerWaalsContact O-N 3.15Å; L191-K193 VanDerWaalsContact C-N 3.33Å; L191-K193 PolarHBondContact O-N 2.72Å; K193-E196 WeakPolarHBondContact CD-OE1 3.19Å; K193-E196 VanDerWaalsContact CD-OE2 3.24Å; K193-E196 WeakPolarHBondContact CD-OE2 3.5Å; K193-E196 IonicContact NZ-OE1 2.71Å; K193-E196 PolarHBondContact NZ-OE1 3.18Å; K193-E196 IonicContact NZ-OE2 3.78Å; K193-E196 PolarHBondContact NZ-OE2 3.35Å; K193-D197 PolarHBondContact O-N 3.25Å
194	V	93.4	Very high	94	Very high	13 Å²	13	59.4 Å²	59.4	8%	0.079	29%	0.292	C	S	.	.	H	α-helix	trans	-72.8	-41.2	168.3	179.2	0	0	0	0	110.8	V131 P132 I139 I190 L191 E192 D197 E198	V131-V194 HydrophobicContact CB-CG2 4.18Å; V131-V194 HydrophobicContact CG1-CG2 4.01Å; P132-V194 HydrophobicContact CG-CG1 4.42Å; I139-V194 HydrophobicContact CD1-CG2 3.99Å; I190-V194 PolarHBondContact O-N 3.07Å; L191-V194 PolarHBondContact O-N 2.72Å; L191-V194 VanDerWaalsContact O-N 3.09Å; E192-V194 VanDerWaalsContact C-N 3.32Å; E192-V194 PolarHBondContact O-N 3.05Å; V194-D197 WeakPolarHBondContact O-CB 3.26Å; V194-D197 PolarHBondContact O-N 3.29Å; V194-D197 VanDerWaalsContact O-N 3.13Å; V194-E198 PolarHBondContact O-N 3.12Å
195	S	94.7	Very high	93.7	Very high	51 Å²	51	59.2 Å²	59.2	36%	0.357	29%	0.29	S	S	.	.	H	α-helix	trans	-61.3	-45.6	177.1	-161.1	0	0	0	0	112.2	L191 E192 D197 E198 E199	L191-S195 PolarHBondContact O-N 2.64Å; E192-S195 PolarHBondContact O-N 3.17Å; S195-D197 PolarHBondContact O-N 2.83Å; S195-E198 PolarHBondContact O-N 2.68Å; S195-E198 VanDerWaalsContact O-N 3.17Å; S195-E199 WeakPolarHBondContact O-CB 3.4Å; S195-E199 WeakPolarHBondContact O-CG 3.38Å; S195-E199 PolarHBondContact O-N 3.49Å; S195-E199 PolarHBondContact OG-OE1 2.99Å
196	E	91.9	Very high	93.4	Very high	60 Å²	60	63 Å²	63	28%	0.28	30%	0.301	S	S	.	.	H	α-helix	trans	-55.2	-36.7	173.6	-76.5	180	-166.7	0	0	113	R138 E192 K193 L200	R138-E196 IonicContact NH1-OE2 3.92Å; R138-E196 PolarHBondContact NH1-OE2 3.05Å; E192-E196 PolarHBondContact O-N 3.37Å; K193-E196 WeakPolarHBondContact CD-OE1 3.19Å; K193-E196 VanDerWaalsContact CD-OE2 3.24Å; K193-E196 WeakPolarHBondContact CD-OE2 3.5Å; K193-E196 IonicContact NZ-OE1 2.71Å; K193-E196 PolarHBondContact NZ-OE1 3.18Å; K193-E196 IonicContact NZ-OE2 3.78Å; K193-E196 PolarHBondContact NZ-OE2 3.35Å; E196-L200 WeakPolarHBondContact O-CB 3.33Å; E196-L200 PolarHBondContact O-N 3.41Å
197	D	89.6	Confident	93.1	Very high	10 Å²	10	64.2 Å²	64.2	5%	0.053	31%	0.309	C	S	.	.	H	α-helix	trans	-72.8	-43.6	179.1	-157	58.3	0	0	0	111.2	S135 R138 K193 V194 S195 L200 R201	S135-D197 WeakPolarHBondContact CA-OD2 3.33Å; S135-D197 WeakPolarHBondContact CB-OD2 3.23Å; S135-D197 PolarHBondContact OG-OD2 2.98Å; R138-D197 IonicContact NE-OD1 3.03Å; R138-D197 PolarHBondContact NE-OD1 2.8Å; R138-D197 IonicContact NH2-OD1 3.65Å; K193-D197 PolarHBondContact O-N 3.25Å; V194-D197 WeakPolarHBondContact O-CB 3.26Å; V194-D197 PolarHBondContact O-N 3.29Å; V194-D197 VanDerWaalsContact O-N 3.13Å; S195-D197 PolarHBondContact O-N 2.83Å; D197-L200 PolarHBondContact O-N 3.42Å; D197-R201 WeakPolarHBondContact O-CB 3.46Å; D197-R201 VanDerWaalsContact O-CD 3.25Å; D197-R201 WeakPolarHBondContact O-CD 3.27Å; D197-R201 WeakPolarHBondContact O-CG 3.4Å; D197-R201 PolarHBondContact O-N 3.31Å; D197-R201 IonicContact OD2-CZ 3.63Å; D197-R201 IonicContact OD2-NE 2.79Å; D197-R201 PolarHBondContact OD2-NE 3.23Å; D197-R201 IonicContact OD2-NH2 3.22Å; D197-R201 PolarHBondContact OD2-NH2 3.22Å
198	E	91.6	Very high	92.8	Very high	78 Å²	78	62.3 Å²	62.3	36%	0.364	30%	0.303	S	S	.	.	H	α-helix	trans	-63.4	-38.3	174	-71.4	-167.9	-167.8	0	0	113.3	V194 S195 R201 K202	V194-E198 PolarHBondContact O-N 3.12Å; S195-E198 PolarHBondContact O-N 2.68Å; S195-E198 VanDerWaalsContact O-N 3.17Å; E198-R201 PolarHBondContact O-N 3.14Å; E198-K202 WeakPolarHBondContact O-CB 3.38Å; E198-K202 WeakPolarHBondContact O-CD 3.42Å; E198-K202 WeakPolarHBondContact O-CG 3.46Å; E198-K202 PolarHBondContact O-N 2.87Å; E198-K202 IonicContact OE2-NZ 2.73Å; E198-K202 PolarHBondContact OE2-NZ 2.82Å
199	E	93.4	Very high	92.3	Very high	106 Å²	106	63.2 Å²	63.2	50%	0.495	31%	0.307	S	S	.	.	H	α-helix	trans	-68.1	-43.1	176.6	-75	169.2	-140.3	0	0	111.7	S195 R201 K202 R203	S195-E199 WeakPolarHBondContact O-CB 3.4Å; S195-E199 WeakPolarHBondContact O-CG 3.38Å; S195-E199 PolarHBondContact O-N 3.49Å; S195-E199 PolarHBondContact OG-OE1 2.99Å; E199-R201 VanDerWaalsContact C-N 3.27Å; E199-R201 PolarHBondContact O-N 3.47Å; E199-K202 PolarHBondContact O-N 3.28Å; E199-R203 WeakPolarHBondContact O-CG 3.25Å; E199-R203 PolarHBondContact O-N 2.86Å
200	L	90.1	Very high	91.7	Very high	34 Å²	34	65.8 Å²	65.8	18%	0.178	33%	0.325	C	S	.	.	H	α-helix	trans	-57.9	-42.4	170.8	176.5	61.5	0	0	0	111	R138 E196 D197 R203 I204 L331	R138-L200 VanDerWaalsContact NH2-CD2 3.25Å; E196-L200 WeakPolarHBondContact O-CB 3.33Å; E196-L200 PolarHBondContact O-N 3.41Å; D197-L200 PolarHBondContact O-N 3.42Å; L200-R203 WeakPolarHBondContact O-CB 3.11Å; L200-R203 PolarHBondContact O-N 2.88Å; L200-I204 HydrophobicContact CD1-CD1 3.94Å; L200-I204 HydrophobicContact CD1-CG1 4.23Å; L200-I204 HydrophobicContact CD2-CD1 4.37Å; L200-I204 HydrophobicContact CG-CD1 3.75Å; L200-I204 HydrophobicContact CG-CG1 4.45Å; L200-I204 VanDerWaalsContact O-CG1 3.32Å; L200-I204 WeakPolarHBondContact O-CG1 3.32Å; L200-I204 PolarHBondContact O-N 3.48Å; L200-L331 HydrophobicContact CD1-CD1 3.65Å
201	R	88	Confident	91.4	Very high	48 Å²	48	67.2 Å²	67.2	18%	0.181	33%	0.33	C	S	.	.	H	α-helix	trans	-66.3	-42.5	179.2	-73.1	163.2	-177.9	-63.5	-15.5	113.2	D197 E198 E199 R203 I204 A205 E309	D197-R201 WeakPolarHBondContact O-CB 3.46Å; D197-R201 VanDerWaalsContact O-CD 3.25Å; D197-R201 WeakPolarHBondContact O-CD 3.27Å; D197-R201 WeakPolarHBondContact O-CG 3.4Å; D197-R201 PolarHBondContact O-N 3.31Å; D197-R201 IonicContact OD2-CZ 3.63Å; D197-R201 IonicContact OD2-NE 2.79Å; D197-R201 PolarHBondContact OD2-NE 3.23Å; D197-R201 IonicContact OD2-NH2 3.22Å; D197-R201 PolarHBondContact OD2-NH2 3.22Å; E198-R201 PolarHBondContact O-N 3.14Å; E199-R201 VanDerWaalsContact C-N 3.27Å; E199-R201 PolarHBondContact O-N 3.47Å; R201-R203 VanDerWaalsContact C-N 3.27Å; R201-R203 PolarHBondContact O-N 3.12Å; R201-I204 PolarHBondContact O-N 3.38Å; R201-A205 WeakPolarHBondContact O-CB 3.27Å; R201-A205 PolarHBondContact O-N 2.84Å; R201-E309 IonicContact CZ-OE1 3.05Å; R201-E309 IonicContact CZ-OE2 2.99Å; R201-E309 IonicContact NH1-OE1 2.57Å; R201-E309 PolarHBondContact NH1-OE1 2.87Å; R201-E309 IonicContact NH1-OE2 3.23Å; R201-E309 PolarHBondContact NH1-OE2 3.13Å; R201-E309 IonicContact NH2-OE1 3.17Å; R201-E309 IonicContact NH2-OE2 3.9Å; R201-E309 PolarHBondContact NH2-OE2 2.99Å
202	K	91.8	Very high	90.5	Very high	124 Å²	124	66 Å²	66	54%	0.539	33%	0.327	S	S	.	.	H	α-helix	trans	-59.1	-41	173.9	-71.4	156.1	-166.9	158.2	0	110.5	E198 E199 H206	E198-K202 WeakPolarHBondContact O-CB 3.38Å; E198-K202 WeakPolarHBondContact O-CD 3.42Å; E198-K202 WeakPolarHBondContact O-CG 3.46Å; E198-K202 PolarHBondContact O-N 2.87Å; E198-K202 IonicContact OE2-NZ 2.73Å; E198-K202 PolarHBondContact OE2-NZ 2.82Å; E199-K202 PolarHBondContact O-N 3.28Å; K202-H206 WeakPolarHBondContact O-CB 3.22Å; K202-H206 PolarHBondContact O-N 2.91Å
203	R	93.4	Very high	89.6	Confident	170 Å²	170	65.7 Å²	65.7	64%	0.642	33%	0.332	S	S	*	.	H	α-helix	trans	-66.5	-44	174.6	-69.9	173.3	62.2	-178.5	-0.4	113.2	E199 L200 R201 S207 L331	E199-R203 WeakPolarHBondContact O-CG 3.25Å; E199-R203 PolarHBondContact O-N 2.86Å; L200-R203 WeakPolarHBondContact O-CB 3.11Å; L200-R203 PolarHBondContact O-N 2.88Å; R201-R203 VanDerWaalsContact C-N 3.27Å; R201-R203 PolarHBondContact O-N 3.12Å; R203-S207 WeakPolarHBondContact O-CB 3.41Å; R203-S207 PolarHBondContact O-N 3.02Å; R203-L331 HydrophobicContact CB-CD1 4.36Å
204	I	92.8	Very high	88.9	Confident	9 Å²	9	65 Å²	65	5%	0.046	33%	0.328	C	S	.	.	H	α-helix	trans	-63.3	-47.7	177.3	-70.7	164.1	0	0	0	110.8	L200 R201 H206 S207 A208 Y311 V326 G327 L331	L200-I204 HydrophobicContact CD1-CD1 3.94Å; L200-I204 HydrophobicContact CD1-CG1 4.23Å; L200-I204 HydrophobicContact CD2-CD1 4.37Å; L200-I204 HydrophobicContact CG-CD1 3.75Å; L200-I204 HydrophobicContact CG-CG1 4.45Å; L200-I204 VanDerWaalsContact O-CG1 3.32Å; L200-I204 WeakPolarHBondContact O-CG1 3.32Å; L200-I204 PolarHBondContact O-N 3.48Å; R201-I204 PolarHBondContact O-N 3.38Å; I204-H206 PolarHBondContact O-N 3.09Å; I204-S207 WeakPolarHBondContact O-CB 3.48Å; I204-S207 PolarHBondContact O-N 2.87Å; I204-A208 WeakPolarHBondContact O-CB 3.34Å; I204-A208 PolarHBondContact O-N 3.26Å; I204-Y311 VanDerWaalsContact CG2-OH 3.28Å; I204-Y311 WeakPolarHBondContact CG2-OH 3.42Å; I204-V326 HydrophobicContact CD1-CG1 4.48Å; I204-V326 HydrophobicContact CG2-CG1 4.03Å; I204-G327 WeakPolarHBondContact CD1-O 3.46Å; I204-L331 HydrophobicContact CG1-CD1 4.13Å; I204-L331 HydrophobicContact CG1-CD2 4.06Å; I204-L331 HydrophobicContact CG1-CG 3.86Å
205	A	90.6	Very high	88.2	Confident	47 Å²	47	67.3 Å²	67.3	39%	0.388	34%	0.337	S	S	.	.	H	α-helix	trans	-59.3	-47.2	178.3	0	0	0	0	0	111.5	R201 S207 A208 E209	R201-A205 WeakPolarHBondContact O-CB 3.27Å; R201-A205 PolarHBondContact O-N 2.84Å; A205-S207 VanDerWaalsContact C-N 3.33Å; A205-S207 PolarHBondContact O-N 2.86Å; A205-A208 WeakPolarHBondContact O-CB 3.36Å; A205-A208 PolarHBondContact O-N 3.44Å; A205-E209 WeakPolarHBondContact O-CG 3.32Å; A205-E209 PolarHBondContact O-N 3.19Å
206	H	91	Very high	86.8	Confident	119 Å²	119	70.6 Å²	70.6	55%	0.551	35%	0.347	S	S	*	.	H	α-helix	trans	-66	-34.5	178.4	-171.2	47.3	0	0	0	113.3	K202 I204 E209	K202-H206 WeakPolarHBondContact O-CB 3.22Å; K202-H206 PolarHBondContact O-N 2.91Å; I204-H206 PolarHBondContact O-N 3.09Å; H206-E209 IonicContact CG-OE2 2.72Å; H206-E209 IonicContact ND1-OE2 3.59Å; H206-E209 PolarHBondContact ND1-OE2 3.11Å
207	S	91.6	Very high	85.5	Confident	26 Å²	26	71.6 Å²	71.6	18%	0.182	36%	0.358	C	S	.	.	H	α-helix	trans	-64.4	-45.1	172.1	-156.1	0	0	0	0	111	R203 I204 A205 E209 T210 R211 D334	R203-S207 WeakPolarHBondContact O-CB 3.41Å; R203-S207 PolarHBondContact O-N 3.02Å; I204-S207 WeakPolarHBondContact O-CB 3.48Å; I204-S207 PolarHBondContact O-N 2.87Å; A205-S207 VanDerWaalsContact C-N 3.33Å; A205-S207 PolarHBondContact O-N 2.86Å; S207-E209 PolarHBondContact O-N 2.87Å; S207-T210 PolarHBondContact O-N 3.41Å; S207-T210 PolarHBondContact O-OG1 3.22Å; S207-R211 PolarHBondContact O-N 2.94Å; S207-D334 VanDerWaalsContact CB-OD2 3.31Å; S207-D334 WeakPolarHBondContact CB-OD2 3.39Å; S207-D334 PolarHBondContact OG-OD2 3.03Å
208	A	89.9	Confident	84.2	Confident	9 Å²	9	73.2 Å²	73.2	7%	0.074	37%	0.367	C	S	.	.	H	α-helix	trans	-62.4	-38.5	177.5	0	0	0	0	0	113.3	I204 A205 T210 R211 W448	I204-A208 WeakPolarHBondContact O-CB 3.34Å; I204-A208 PolarHBondContact O-N 3.26Å; A205-A208 WeakPolarHBondContact O-CB 3.36Å; A205-A208 PolarHBondContact O-N 3.44Å; A208-T210 PolarHBondContact O-N 2.91Å; A208-R211 WeakPolarHBondContact O-CB 3.5Å; A208-R211 PolarHBondContact O-N 3.48Å; A208-R211 VanDerWaalsContact O-N 3.11Å; A208-W448 HydrophobicContact CB-CB 3.81Å
209	E	87.1	Confident	82.3	Confident	148 Å²	148	73.3 Å²	73.3	69%	0.692	38%	0.376	S	S	*	.	H	α-helix	trans	-57.2	-25.5	172.2	-73.4	165.6	178.2	0	0	113.3	A205 H206 S207	A205-E209 WeakPolarHBondContact O-CG 3.32Å; A205-E209 PolarHBondContact O-N 3.19Å; H206-E209 IonicContact CG-OE2 2.72Å; H206-E209 IonicContact ND1-OE2 3.59Å; H206-E209 PolarHBondContact ND1-OE2 3.11Å; S207-E209 PolarHBondContact O-N 2.87Å
210	T	84.9	Confident	80.6	Confident	100 Å²	100	70.8 Å²	70.8	61%	0.613	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-5.3	179	65.6	0	0	0	0	114.4	S207 A208	S207-T210 PolarHBondContact O-N 3.41Å; S207-T210 PolarHBondContact O-OG1 3.22Å; A208-T210 PolarHBondContact O-N 2.91Å
211	R	87.8	Confident	79.2	Confident	31 Å²	31	71.7 Å²	71.7	12%	0.117	37%	0.369	C	S	.	.	S	Bend	trans	-72.7	131.2	177.3	-71.1	179.2	171.7	-160.5	-5	110.4	S207 A208 D334 W448	S207-R211 PolarHBondContact O-N 2.94Å; A208-R211 WeakPolarHBondContact O-CB 3.5Å; A208-R211 PolarHBondContact O-N 3.48Å; A208-R211 VanDerWaalsContact O-N 3.11Å; R211-D334 IonicContact CZ-OD1 2.73Å; R211-D334 IonicContact NE-OD1 3.87Å; R211-D334 PolarHBondContact NE-OD1 3.23Å; R211-D334 IonicContact NH2-OD1 3.71Å; R211-D334 PolarHBondContact NH2-OD1 2.88Å; R211-D334 IonicContact NH2-OD2 2.79Å; R211-W448 HydrophobicContact CB-CD2 4.27Å; R211-W448 HydrophobicContact CB-CG 4.22Å; R211-W448 HydrophobicContact CB-CZ2 4.3Å; R211-W448 VanDerWaalsContact NH1-CZ3 3.27Å
212	V	77.3	Confident	77.5	Confident	67 Å²	67	76.1 Å²	76.1	41%	0.406	39%	0.386	S	S	.	.	P	Polyproline II helix	trans	-70.1	133.5	176.9	-172.3	0	0	0	0	110.1	R214 N367	V212-R214 PolarHBondContact O-N 3.43Å; V212-N367 HydrophobicContact CB-CB 4.19Å; V212-N367 HydrophobicContact CG1-CB 3.9Å; V212-N367 HydrophobicContact CG2-CB 4.07Å
213	P	77.1	Confident	75.4	Confident	80 Å²	80	77.1 Å²	77.1	52%	0.519	39%	0.392	S	S	.	.	P	Polyproline II helix	trans	-57.6	130.7	174.5	-25.3	34.8	0	0	0	111.7
214	R	79.2	Confident	73.3	Confident	35 Å²	35	74.8 Å²	74.8	13%	0.132	39%	0.392	C	S	.	.			trans	-94.7	-20.9	178	-63	-170.8	69.4	100.4	4.8	113.5	V212 Y371 F391 D393 A446 W448	V212-R214 PolarHBondContact O-N 3.43Å; R214-Y371 VanDerWaalsContact NH1-CE1 3.27Å; R214-Y371 VanDerWaalsContact NH1-CE2 3.34Å; R214-F391 VanDerWaalsContact CD-CD1 3.48Å; R214-D393 IonicContact CZ-OD1 3.02Å; R214-D393 IonicContact CZ-OD2 2.82Å; R214-D393 VanDerWaalsContact NE-CG 3.29Å; R214-D393 IonicContact NE-OD1 2.71Å; R214-D393 PolarHBondContact NE-OD1 3.26Å; R214-D393 IonicContact NE-OD2 2.74Å; R214-D393 PolarHBondContact NE-OD2 3.47Å; R214-D393 IonicContact NH2-OD1 3.2Å; R214-D393 PolarHBondContact NH2-OD1 2.97Å; R214-D393 IonicContact NH2-OD2 3.33Å; R214-D393 PolarHBondContact NH2-OD2 3.28Å; R214-A446 HydrophobicContact CB-CB 4.35Å; R214-W448 HydrophobicContact CG-CZ2 4.37Å
215	K	77.4	Confident	71.3	Confident	61 Å²	61	78.7 Å²	78.7	27%	0.265	41%	0.413	S	S	.	.	S	Bend	trans	-110.4	135.1	-178.5	-165.9	157	-168.1	-175.2	0	109.2	S315 D440 C445 A446	K215-S315 PolarHBondContact NZ-O 2.86Å; K215-D440 WeakPolarHBondContact CD-OD2 3.4Å; K215-D440 WeakPolarHBondContact CE-OD2 3.22Å; K215-D440 IonicContact NZ-OD1 2.74Å; K215-D440 PolarHBondContact NZ-OD1 3.49Å; K215-D440 IonicContact NZ-OD2 2.73Å; K215-D440 PolarHBondContact NZ-OD2 3.46Å; K215-C445 HydrophobicContact CD-CB 4.43Å; K215-A446 HydrophobicContact CB-CB 3.79Å
216	Q	66.9	Low	68.8	Low	120 Å²	120	81.9 Å²	81.9	56%	0.561	43%	0.427	S	S	*	.			trans	-64	153.1	179.5	-71.5	-173.2	-0.2	0	0	111.8	R221	Q216-R221 PolarHBondContact O-NH2 3.21Å
217	P	64.1	Low	66.2	Low	81 Å²	81	84.1 Å²	84.1	53%	0.526	44%	0.438	S	S	.	.			trans	-62.6	138.2	175.8	-19.8	32.1	0	0	0	112.4	S219 V220	P217-S219 PolarHBondContact O-N 2.82Å; P217-S219 VanDerWaalsContact O-N 3.11Å; P217-V220 HydrophobicContact CB-CG2 4.31Å; P217-V220 HydrophobicContact CG-CG2 4.4Å; P217-V220 PolarHBondContact O-N 2.85Å
218	I	62.5	Low	63.9	Low	44 Å²	44	88.8 Å²	88.8	23%	0.226	47%	0.467	C	S	.	.	H	α-helix	trans	-51.7	-35.6	178.5	-69.9	170	0	0	0	112.7	V220 R221 D437 D440 R441	I218-V220 PolarHBondContact O-N 2.91Å; I218-R221 PolarHBondContact O-N 3.35Å; I218-D437 WeakPolarHBondContact CG2-OD1 3.32Å; I218-D437 WeakPolarHBondContact CG2-OD2 3.41Å; I218-D440 HydrophobicContact CD1-CB 4.15Å; I218-R441 HydrophobicContact CD1-CB 3.84Å; I218-R441 HydrophobicContact CD1-CG 4.27Å
219	S	51	Low	61.2	Low	81 Å²	81	92.3 Å²	92.3	57%	0.566	51%	0.505	S	S	*	.	H	α-helix	trans	-61.2	-31.1	178.4	56.2	0	0	0	0	113.7	P217	P217-S219 PolarHBondContact O-N 2.82Å; P217-S219 VanDerWaalsContact O-N 3.11Å
220	V	58.9	Low	58.5	Low	53 Å²	53	89 Å²	89	32%	0.321	51%	0.51	S	S	.	.	H	α-helix	trans	-76.5	-42	-178.4	-176.7	0	0	0	0	110.8	P217 I218 R222 E223 D224	P217-V220 HydrophobicContact CB-CG2 4.31Å; P217-V220 HydrophobicContact CG-CG2 4.4Å; P217-V220 PolarHBondContact O-N 2.85Å; I218-V220 PolarHBondContact O-N 2.91Å; V220-R222 PolarHBondContact O-N 3.3Å; V220-E223 PolarHBondContact O-N 3.18Å; V220-D224 PolarHBondContact O-N 3.15Å
221	R	59	Low	56.1	Low	53 Å²	53	89.5 Å²	89.5	20%	0.2	53%	0.525	C	S	.	.	H	α-helix	trans	-51.4	-44.3	177.5	-65.7	-169.8	-177.9	106.7	30	112.6	Q216 I218 E223 D224 I225 D437 D440	Q216-R221 PolarHBondContact O-NH2 3.21Å; I218-R221 PolarHBondContact O-N 3.35Å; R221-E223 VanDerWaalsContact C-N 3.27Å; R221-E223 PolarHBondContact O-N 2.79Å; R221-D224 PolarHBondContact O-N 2.92Å; R221-I225 WeakPolarHBondContact O-CD1 3.33Å; R221-I225 VanDerWaalsContact O-CG1 3.3Å; R221-I225 WeakPolarHBondContact O-CG1 3.35Å; R221-I225 PolarHBondContact O-N 3.24Å; R221-D437 IonicContact NH1-OD1 2.8Å; R221-D440 IonicContact CZ-OD2 3.81Å; R221-D440 IonicContact NH1-OD2 2.72Å; R221-D440 PolarHBondContact NH1-OD2 2.74Å; R221-D440 IonicContact NH2-OD2 3.16Å
222	R	53.5	Low	53.6	Low	140 Å²	140	91.6 Å²	91.6	53%	0.528	56%	0.556	S	S	.	*	H	α-helix	trans	-69.8	-24.4	-176.7	-61.5	-179.2	-175.1	-163	-0.7	112.7	V220 T226 D437	V220-R222 PolarHBondContact O-N 3.3Å; R222-T226 PolarHBondContact O-OG1 3.41Å; R222-D437 IonicContact CZ-OD2 3.64Å; R222-D437 IonicContact NE-OD2 2.97Å; R222-D437 PolarHBondContact NE-OD2 2.9Å; R222-D437 IonicContact NH2-OD2 3.87Å; R222-D437 PolarHBondContact NH2-OD2 2.96Å
223	E	47.8	Very low	51.3	Low	146 Å²	146	97.3 Å²	97.3	68%	0.682	58%	0.578	S	S	*	*	H	α-helix	trans	-74	-43.5	173.7	-66.8	-178.2	163.9	0	0	110.6	V220 R221 I225 T226	V220-E223 PolarHBondContact O-N 3.18Å; R221-E223 VanDerWaalsContact C-N 3.27Å; R221-E223 PolarHBondContact O-N 2.79Å; E223-I225 VanDerWaalsContact C-N 3.25Å; E223-I225 PolarHBondContact O-N 2.97Å; E223-T226 PolarHBondContact O-N 3.02Å; E223-T226 VanDerWaalsContact O-N 3.09Å
224	D	49.7	Very low	49.3	Very low	120 Å²	120	99.3 Å²	99.3	64%	0.642	59%	0.591	S	S	*	*	H	α-helix	trans	-61.6	-29	175.9	-72.1	-38	0	0	0	113.6	V220 R221 T226	V220-D224 PolarHBondContact O-N 3.15Å; R221-D224 PolarHBondContact O-N 2.92Å; D224-T226 VanDerWaalsContact C-N 3.34Å
225	I	48.9	Very low	47	Very low	92 Å²	92	102.8 Å²	102.8	47%	0.472	63%	0.627	S	S	.	*	T	Hydrogen-bonded Turn	trans	-77.7	-17.4	177.9	-63.8	160.1	0	0	0	112.4	R221 E223 E227 E433	R221-I225 WeakPolarHBondContact O-CD1 3.33Å; R221-I225 VanDerWaalsContact O-CG1 3.3Å; R221-I225 WeakPolarHBondContact O-CG1 3.35Å; R221-I225 PolarHBondContact O-N 3.24Å; E223-I225 VanDerWaalsContact C-N 3.25Å; E223-I225 PolarHBondContact O-N 2.97Å; I225-E227 PolarHBondContact O-N 2.96Å; I225-E433 WeakPolarHBondContact CD1-OE1 3.28Å
226	T	39.8	Very low	44.7	Very low	113 Å²	113	105.8 Å²	105.8	69%	0.693	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-92.8	21.1	-168.4	-52.7	0	0	0	0	114.2	R222 E223 D224	R222-T226 PolarHBondContact O-OG1 3.41Å; E223-T226 PolarHBondContact O-N 3.02Å; E223-T226 VanDerWaalsContact O-N 3.09Å; D224-T226 VanDerWaalsContact C-N 3.34Å
227	E	35.8	Very low	43.2	Very low	167 Å²	167	106.3 Å²	106.3	78%	0.78	64%	0.643	S	S	*	*	S	Bend	trans	-94.6	117.3	171.4	-88.5	-71.2	160.7	0	0	111.8	I225 G229	I225-E227 PolarHBondContact O-N 2.96Å; E227-G229 PolarHBondContact O-N 3.23Å
228	P	42.8	Very low	41.5	Very low	123 Å²	123	111.2 Å²	111.2	80%	0.799	66%	0.656	S	S	*	*			trans	-89.9	99.7	-162.7	33.6	-36.2	0	0	0	115.8
229	G	33.1	Very low	40.1	Very low	83 Å²	83	115.5 Å²	115.5	86%	0.856	68%	0.679	S	S	*	*			trans	114.2	113.8	135.7	0	0	0	0	0	118.6	E227	E227-G229 PolarHBondContact O-N 3.23Å
230	G	30.4	Very low	39	Very low	78 Å²	78	118.2 Å²	118.2	80%	0.804	69%	0.692	S	S	*	*			trans	179.6	120.4	167.6	0	0	0	0	0	111	G232	G230-G232 PolarHBondContact O-N 2.87Å
231	A	34.3	Very low	37.6	Very low	112 Å²	112	121 Å²	121	93%	0.926	71%	0.714	S	S	*	*			trans	-67.1	120.7	-166.2	0	0	0	0	0	115.2
232	G	35.8	Very low	36	Very low	74 Å²	74	123.5 Å²	123.5	76%	0.763	74%	0.74	S	S	*	*			trans	73.4	87.5	133	0	0	0	0	0	119.6	G230	G230-G232 PolarHBondContact O-N 2.87Å
233	E	29.3	Very low	34.8	Very low	187 Å²	187	122.2 Å²	122.2	87%	0.874	75%	0.752	S	S	*	*			trans	-153.5	157.2	146.1	-109	172.1	-172.7	0	0	108.4
234	P	34.7	Very low	33.7	Very low	122 Å²	122	123.3 Å²	123.3	79%	0.792	76%	0.759	S	S	*	*			trans	-69.1	153.1	-176.7	28.6	-33.3	0	0	0	112.2	L236	P234-L236 PolarHBondContact O-N 3.47Å
235	A	31.1	Very low	32.6	Very low	109 Å²	109	126.2 Å²	126.2	90%	0.901	77%	0.769	S	S	*	*			trans	-68.7	96.4	-163.1	0	0	0	0	0	114.4
236	L	29.7	Very low	31.7	Very low	124 Å²	124	127.8 Å²	127.8	65%	0.649	79%	0.785	S	S	*	*			trans	-80.5	115.8	164.5	-164.8	79.1	0	0	0	110	P234	P234-L236 PolarHBondContact O-N 3.47Å
237	W	33.8	Very low	31	Very low	131 Å²	131	127.2 Å²	127.2	50%	0.496	79%	0.792	S	S	.	*			trans	-55.6	133.6	176.4	57.9	-75.2	0	0	0	112.1	N239 L379 D396	W237-N239 WeakPolarHBondContact CZ3-ND2 3.3Å; W237-L379 HydrophobicContact CZ2-CD1 4.25Å; W237-D396 WeakPolarHBondContact CH2-OD1 3.45Å; W237-D396 WeakPolarHBondContact CH2-OD2 3.4Å
238	K	29.8	Very low	30.6	Very low	184 Å²	184	123.8 Å²	123.8	80%	0.8	79%	0.792	S	S	*	*			trans	-125.7	99.3	-176.1	-77.1	172.5	-176.7	164.5	0	111.4
239	N	33.1	Very low	30	Very low	133 Å²	133	124.2 Å²	124.2	71%	0.711	80%	0.795	S	S	*	*			trans	-75.4	136	175.6	-74.5	-2.5	0	0	0	112.1	W237 S241	W237-N239 WeakPolarHBondContact CZ3-ND2 3.3Å; N239-S241 PolarHBondContact O-N 2.86Å
240	T	26.9	Very low	29.7	Very low	138 Å²	138	128.3 Å²	128.3	85%	0.847	80%	0.796	S	S	*	*			trans	-83.2	101.4	-179.4	43.2	0	0	0	0	112	S242	T240-S242 PolarHBondContact O-N 2.88Å
241	S	29.5	Very low	29.5	Very low	111 Å²	111	131.4 Å²	131.4	78%	0.776	80%	0.799	S	S	*	*			trans	-75.2	87.3	177	61.8	0	0	0	0	112.2	N239 S243	N239-S241 PolarHBondContact O-N 2.86Å; S241-S243 PolarHBondContact O-N 2.71Å; S241-S243 VanDerWaalsContact O-N 3.1Å
242	S	26.8	Very low	29.1	Very low	106 Å²	106	131.7 Å²	131.7	74%	0.741	79%	0.79	S	S	*	*			trans	-77.1	89.3	172.8	-166.7	0	0	0	0	111.4	T240 M244	T240-S242 PolarHBondContact O-N 2.88Å; S242-M244 PolarHBondContact O-N 2.84Å
243	S	26.9	Very low	29.2	Very low	113 Å²	113	133.8 Å²	133.8	79%	0.79	79%	0.79	S	S	*	*			trans	-74.6	118.4	174.6	-56.3	0	0	0	0	111.3	S241	S241-S243 PolarHBondContact O-N 2.71Å; S241-S243 VanDerWaalsContact O-N 3.1Å
244	M	25.8	Very low	29.6	Very low	170 Å²	170	130.1 Å²	130.1	84%	0.837	78%	0.782	S	S	*	*			trans	-121.9	99.8	177.9	-166.3	101.5	71.6	0	0	110.5	S242	S242-M244 PolarHBondContact O-N 2.84Å
245	E	26.5	Very low	30.1	Very low	181 Å²	181	129.7 Å²	129.7	85%	0.846	78%	0.779	S	S	*	*			trans	-77.8	143.1	173.3	-75.7	-158.3	148.9	0	0	112.7
246	P	30.6	Very low	30	Very low	125 Å²	125	134.8 Å²	134.8	81%	0.812	78%	0.781	S	S	*	*			trans	-98.3	107.2	159	33.9	-26.2	0	0	0	111.1
247	A	24.3	Very low	29.8	Very low	100 Å²	100	132.8 Å²	132.8	83%	0.826	79%	0.79	S	S	*	*			trans	-73.3	144.6	177.8	0	0	0	0	0	113.3
248	A	26.6	Very low	29.4	Very low	95 Å²	95	130.7 Å²	130.7	79%	0.785	81%	0.809	S	S	*	*			trans	-135.3	142.8	173	0	0	0	0	0	111.7
249	P	31.5	Very low	29.3	Very low	133 Å²	133	125.2 Å²	125.2	86%	0.864	81%	0.806	S	S	*	*			trans	-88.9	159.5	-168.3	34.4	-36.6	0	0	0	115.9
250	L	26	Very low	29	Very low	169 Å²	169	126.4 Å²	126.4	89%	0.885	81%	0.812	S	S	*	*			trans	-71.8	135.8	-175.3	-68.6	147.4	0	0	0	115.1
251	V	26	Very low	29.1	Very low	142 Å²	142	128.4 Å²	128.4	86%	0.861	81%	0.814	S	S	*	*			trans	-143.4	139.9	150.2	-175.9	0	0	0	0	110.6
252	T	26.7	Very low	28.9	Very low	119 Å²	119	127.8 Å²	127.8	73%	0.73	82%	0.815	S	S	*	*			trans	-137.6	167.6	166.9	58.8	0	0	0	0	106.7
253	P	36.9	Very low	29	Very low	117 Å²	117	129.5 Å²	129.5	76%	0.76	82%	0.821	S	S	*	*			cis	-142.9	-130.6	32.8	34	-4.6	0	0	0	115.3
254	P	38.8	Very low	28.9	Very low	111 Å²	111	130.6 Å²	130.6	72%	0.721	82%	0.823	S	S	*	*				-131.5	-151.6	-110.1	42.8	-21.9	0	0	0	114.2
255	P	44.3	Very low	29	Very low	112 Å²	112	128.8 Å²	128.8	73%	0.727	82%	0.821	S	S	*	*				-126.6	-177.2	-61.8	32.5	-13.5	0	0	0	112.9
256	K	29.2	Very low	29.6	Very low	217 Å²	217	125 Å²	125	94%	0.943	81%	0.812	S	S	*	*			trans	-176.1	141.1	143.4	-108.1	158.4	-172.9	174.9	0	115.8
257	G	25.9	Very low	29.3	Very low	81 Å²	81	127 Å²	127	84%	0.835	81%	0.808	S	S	*	*			trans	97.8	120.8	149	0	0	0	0	0	117.8
258	G	25.6	Very low	29.5	Very low	87 Å²	87	130.1 Å²	130.1	90%	0.897	81%	0.805	S	S	*	*			trans	-92.5	-167.1	170.9	0	0	0	0	0	113.4
259	G	26.5	Very low	29.4	Very low	70 Å²	70	129.2 Å²	129.2	72%	0.722	81%	0.805	S	S	*	*			cis	171.1	-167.9	2.8	0	0	0	0	0	112.2
260	N	28.7	Very low	28.9	Very low	158 Å²	158	127.8 Å²	127.8	85%	0.845	80%	0.799	S	S	*	*			trans	65.6	112.4	177.6	-63	-4.3	0	0	0	115.9
261	M	27.1	Very low	28.8	Very low	180 Å²	180	131.4 Å²	131.4	89%	0.887	80%	0.801	S	S	*	*				82	109.7	67.2	-79.2	-155.1	81.1	0	0	115.4
262	A	26.6	Very low	28.6	Very low	97 Å²	97	133.5 Å²	133.5	80%	0.802	80%	0.801	S	S	*	*				-171.2	141.4	122.9	0	0	0	0	0	111.2
263	V	28.4	Very low	28.7	Very low	143 Å²	143	137.5 Å²	137.5	87%	0.867	81%	0.808	S	S	*	*			trans	-130.8	119.3	167.6	170.6	0	0	0	0	107.9
264	V	25.8	Very low	28.3	Very low	136 Å²	136	138.1 Å²	138.1	82%	0.824	81%	0.812	S	S	*	*			trans	-145.6	126.8	162.2	-176.7	0	0	0	0	110.3
265	V	26.8	Very low	27.7	Very low	131 Å²	131	137.8 Å²	137.8	79%	0.794	81%	0.813	S	S	*	*			trans	-136.5	132.5	163	173.1	0	0	0	0	102.1
266	P	38.6	Very low	26.9	Very low	102 Å²	102	140 Å²	140	66%	0.662	82%	0.819	S	S	*	*				-163.4	-178.6	75.3	46	-24.6	0	0	0	120.4
267	K	25.4	Very low	26.7	Very low	168 Å²	168	136.4 Å²	136.4	73%	0.73	81%	0.809	S	S	*	*			trans	90.2	108.1	141.4	-90.8	-171.7	177.3	-102.3	0	122.7
268	E	28	Very low	26.8	Very low	164 Å²	164	138 Å²	138	77%	0.766	81%	0.808	S	S	*	*				46.8	130.7	113.6	-62.2	177.6	146.1	0	0	121.5
269	G	23.9	Very low	26.8	Very low	77 Å²	77	143.4 Å²	143.4	79%	0.794	81%	0.807	S	S	*	*			trans	-161.7	150.7	163.3	0	0	0	0	0	112.4
270	S	21.5	Very low	27	Very low	103 Å²	103	149.1 Å²	149.1	72%	0.72	82%	0.815	S	S	*	*			trans	-161.8	168.1	-173.4	-112.4	0	0	0	0	111.1
271	W	24	Very low	27.3	Very low	244 Å²	244	152 Å²	152	92%	0.924	82%	0.82	S	S	*	*			cis	-115.3	-128	13.5	-54.4	67.6	0	0	0	111.1
272	E	23.3	Very low	27.4	Very low	187 Å²	187	148.8 Å²	148.8	87%	0.874	82%	0.815	S	S	*	*			cis	-144.7	173.5	8.9	-75.8	-178.1	106.6	0	0	110.8
273	K	28.7	Very low	27.5	Very low	203 Å²	203	147.4 Å²	147.4	88%	0.883	81%	0.811	S	S	*	*			trans	-112	147.3	161.8	-81	-171.5	176.8	-174.3	0	110.1
274	P	26.6	Very low	27.5	Very low	129 Å²	129	145.7 Å²	145.7	84%	0.838	81%	0.811	S	S	*	*			trans	-104.4	172	146.7	28.1	-14.1	0	0	0	111.7
275	S	26.5	Very low	27.7	Very low	105 Å²	105	148.2 Å²	148.2	73%	0.734	81%	0.814	S	S	*	*			trans	-134.7	145.8	-163.5	54.7	0	0	0	0	115.3
276	D	27.6	Very low	27.8	Very low	159 Å²	159	146.3 Å²	146.3	85%	0.85	81%	0.812	S	S	*	*			trans	67.3	146.7	150	-63.9	-18.5	0	0	0	123.8
277	D	26.6	Very low	27.5	Very low	140 Å²	140	148.5 Å²	148.5	75%	0.749	82%	0.817	S	S	*	*			trans	67.1	102	156	-120.5	-14.1	0	0	0	121.6
278	S	26.3	Very low	27.7	Very low	116 Å²	116	145.7 Å²	145.7	81%	0.811	82%	0.815	S	S	*	*				-156.1	129.2	122	49.5	0	0	0	0	111.9	Q280	S278-Q280 PolarHBondContact O-N 2.7Å
279	F	27.3	Very low	28.1	Very low	199 Å²	199	147.2 Å²	147.2	87%	0.873	82%	0.823	S	S	*	*			trans	-73.7	119.9	172.5	-95	-107.5	0	0	0	111.3
280	Q	29.5	Very low	28.3	Very low	190 Å²	190	151.7 Å²	151.7	89%	0.888	83%	0.825	S	S	*	*			trans	-134.1	143.9	154.4	-89.7	-170.7	-8.1	0	0	111.8	S278	S278-Q280 PolarHBondContact O-N 2.7Å
281	K	35.8	Very low	28.8	Very low	218 Å²	218	152.1 Å²	152.1	95%	0.948	83%	0.828	S	S	*	*			trans	-109.8	93	-167.5	-176.4	-178.6	-179.5	179.7	0	109.9
282	S	28.7	Very low	29.2	Very low	113 Å²	113	147.2 Å²	147.2	79%	0.79	82%	0.817	S	S	*	*			trans	-107.9	152.2	171	42.8	0	0	0	0	110.6
283	G	27.7	Very low	29.9	Very low	68 Å²	68	145.8 Å²	145.8	70%	0.701	81%	0.808	S	S	*	*	P	Polyproline II helix	trans	-71.9	154.6	-167.6	0	0	0	0	0	114.2	Q285	G283-Q285 PolarHBondContact O-N 2.86Å; G283-Q285 VanDerWaalsContact O-N 3.17Å
284	A	30.2	Very low	30.6	Very low	107 Å²	107	142.6 Å²	142.6	88%	0.884	80%	0.797	S	S	*	*	P	Polyproline II helix	trans	-58.9	117.5	165	0	0	0	0	0	108.9	A286	A284-A286 PolarHBondContact O-N 3.42Å
285	Q	28	Very low	31.6	Very low	190 Å²	190	137.3 Å²	137.3	89%	0.888	76%	0.761	S	S	*	*	P	Polyproline II helix	trans	-69.6	126.7	168.3	-69.6	-178.4	-62.8	0	0	107.6	G283	G283-Q285 PolarHBondContact O-N 2.86Å; G283-Q285 VanDerWaalsContact O-N 3.17Å
286	A	30.9	Very low	32.4	Very low	90 Å²	90	136.6 Å²	136.6	74%	0.744	75%	0.754	S	S	*	*	P	Polyproline II helix	trans	-59.8	139.3	170.6	0	0	0	0	0	109.1	A284	A284-A286 PolarHBondContact O-N 3.42Å
287	I	30.6	Very low	33.3	Very low	149 Å²	149	133.2 Å²	133.2	76%	0.764	74%	0.743	S	S	*	*	P	Polyproline II helix	trans	-56.6	130.2	161.5	-58.7	168.3	0	0	0	105.8	E289	I287-E289 PolarHBondContact O-N 2.67Å; I287-E289 VanDerWaalsContact O-N 3.16Å
288	P	29.9	Very low	34.6	Very low	108 Å²	108	127 Å²	127	70%	0.701	71%	0.71	S	S	*	*	P	Polyproline II helix	trans	-58	123.6	174.3	-21.6	32.8	0	0	0	108.8	M290	P288-M290 PolarHBondContact O-N 2.77Å
289	E	37	Very low	35.6	Very low	196 Å²	196	127.2 Å²	127.2	92%	0.916	70%	0.702	S	S	*	*			trans	-58.9	107.1	169.4	-77.1	178.4	123.9	0	0	107.5	I287 S291	I287-E289 PolarHBondContact O-N 2.67Å; I287-E289 VanDerWaalsContact O-N 3.16Å; E289-S291 PolarHBondContact O-N 3.41Å
290	M	28.2	Very low	36.8	Very low	171 Å²	171	120.2 Å²	120.2	84%	0.842	67%	0.672	S	S	*	*			trans	-64.3	120.5	174.1	-70.9	-175.7	174.7	0	0	107.1	P288 M292	P288-M290 PolarHBondContact O-N 2.77Å; M290-M292 VanDerWaalsContact C-N 3.28Å; M290-M292 PolarHBondContact O-N 3.09Å
291	S	30.8	Very low	37.6	Very low	113 Å²	113	115 Å²	115	79%	0.79	66%	0.656	S	S	*	*			trans	-61.8	90.5	174.3	170.3	0	0	0	0	109	E289 F293	E289-S291 PolarHBondContact O-N 3.41Å; S291-F293 PolarHBondContact O-N 3.46Å
292	M	33.5	Very low	38.4	Very low	141 Å²	141	106.8 Å²	106.8	70%	0.695	62%	0.62	S	S	*	*			trans	-55.8	110.2	165	-71.9	-160.2	-56	0	0	107.1	M290 E294	M290-M292 VanDerWaalsContact C-N 3.28Å; M290-M292 PolarHBondContact O-N 3.09Å; M292-E294 HydrophobicContact CB-CG 4.19Å; M292-E294 HydrophobicContact CE-CG 4.4Å; M292-E294 WeakPolarHBondContact CE-OE1 3.42Å; M292-E294 PolarHBondContact O-N 3.5Å
293	F	37.5	Very low	39.4	Very low	157 Å²	157	108.4 Å²	108.4	69%	0.689	62%	0.615	S	S	*	*			trans	-75.2	78.7	167.4	-169.4	-96.9	0	0	0	106.7	S291 I295 L410	S291-F293 PolarHBondContact O-N 3.46Å; F293-I295 VanDerWaalsContact C-N 3.31Å; F293-I295 HydrophobicContact CD1-CD1 4.37Å; F293-I295 HydrophobicContact CD1-CG1 3.68Å; F293-I295 HydrophobicContact CE1-CD1 4.48Å; F293-I295 HydrophobicContact CE1-CG1 3.86Å; F293-I295 PolarHBondContact O-N 3.29Å; F293-L410 HydrophobicContact CE1-CD1 4.4Å
294	E	43.1	Very low	40.4	Very low	136 Å²	136	108.6 Å²	108.6	64%	0.636	61%	0.61	S	S	*	*			trans	-61.6	95.8	173.9	-71.3	-171	161.7	0	0	108.3	M292 P296	M292-E294 HydrophobicContact CB-CG 4.19Å; M292-E294 HydrophobicContact CE-CG 4.4Å; M292-E294 WeakPolarHBondContact CE-OE1 3.42Å; M292-E294 PolarHBondContact O-N 3.5Å; E294-P296 VanDerWaalsContact O-CD 3.32Å; E294-P296 WeakPolarHBondContact O-CD 3.43Å; E294-P296 VanDerWaalsContact O-N 3.12Å
295	I	48.6	Very low	41.5	Very low	17 Å²	17	108.3 Å²	108.3	9%	0.087	59%	0.594	C	S	.	*			trans	-62.9	114.2	168.8	-60.4	-173.1	0	0	0	105.3	F293 S297 I359 L410 F414	F293-I295 VanDerWaalsContact C-N 3.31Å; F293-I295 HydrophobicContact CD1-CD1 4.37Å; F293-I295 HydrophobicContact CD1-CG1 3.68Å; F293-I295 HydrophobicContact CE1-CD1 4.48Å; F293-I295 HydrophobicContact CE1-CG1 3.86Å; F293-I295 PolarHBondContact O-N 3.29Å; I295-S297 PolarHBondContact O-N 2.72Å; I295-I359 HydrophobicContact CD1-CG1 4.45Å; I295-L410 HydrophobicContact CD1-CB 4.32Å; I295-L410 HydrophobicContact CD1-CD2 3.84Å; I295-L410 HydrophobicContact CD1-CG 4.5Å; I295-F414 HydrophobicContact CB-CD2 4.45Å; I295-F414 HydrophobicContact CB-CE1 4.37Å; I295-F414 HydrophobicContact CB-CE2 3.82Å; I295-F414 HydrophobicContact CB-CZ 3.79Å; I295-F414 HydrophobicContact CD1-CE1 3.89Å; I295-F414 HydrophobicContact CD1-CZ 3.67Å; I295-F414 HydrophobicContact CG1-CZ 4.14Å; I295-F414 HydrophobicContact CG2-CD1 4.35Å; I295-F414 HydrophobicContact CG2-CD2 4.33Å; I295-F414 HydrophobicContact CG2-CE1 4.12Å; I295-F414 HydrophobicContact CG2-CE2 4.11Å; I295-F414 HydrophobicContact CG2-CG 4.46Å; I295-F414 HydrophobicContact CG2-CZ 4.03Å
296	P	43.6	Very low	43.4	Very low	91 Å²	91	103 Å²	103	59%	0.591	57%	0.569	S	S	*	*	P	Polyproline II helix	trans	-61.8	129.6	-166.1	22.2	-33	0	0	0	109.9	E294	E294-P296 VanDerWaalsContact O-CD 3.32Å; E294-P296 WeakPolarHBondContact O-CD 3.43Å; E294-P296 VanDerWaalsContact O-N 3.12Å
297	S	45.6	Very low	45.7	Very low	88 Å²	88	101 Å²	101	62%	0.615	54%	0.542	S	S	*	.	P	Polyproline II helix	trans	-47.3	138.2	164.6	-54.8	0	0	0	0	108.7	I295 D299	I295-S297 PolarHBondContact O-N 2.72Å; S297-D299 PolarHBondContact O-N 2.83Å
298	P	53.3	Low	48.3	Very low	10 Å²	10	94.8 Å²	94.8	7%	0.065	51%	0.511	C	S	.	.	P	Polyproline II helix	trans	-56.7	118.9	-172	21.5	-32.9	0	0	0	110.5	F300 I417	P298-F300 HydrophobicContact CG-CE2 4.45Å; P298-F300 HydrophobicContact CG-CZ 4.05Å; P298-F300 VanDerWaalsContact O-CD2 3.23Å; P298-F300 WeakPolarHBondContact O-CD2 3.48Å; P298-F300 WeakPolarHBondContact O-CE2 3.46Å; P298-F300 WeakPolarHBondContact O-CG 3.5Å; P298-F300 PolarHBondContact O-N 3.31Å; P298-I417 HydrophobicContact CG-CD1 3.85Å; P298-I417 HydrophobicContact CG-CG1 3.68Å
299	D	47.5	Very low	51.1	Low	119 Å²	119	91.7 Å²	91.7	64%	0.636	49%	0.487	S	S	*	.			trans	-45.1	109.4	-173.3	173.7	33.5	0	0	0	112.3	S297 S301	S297-D299 PolarHBondContact O-N 2.83Å; D299-S301 VanDerWaalsContact CG-OG 3.26Å; D299-S301 PolarHBondContact O-N 2.88Å; D299-S301 VanDerWaalsContact O-N 3.09Å; D299-S301 WeakPolarHBondContact OD1-CB 3.24Å; D299-S301 PolarHBondContact OD1-N 3.36Å; D299-S301 WeakPolarHBondContact OD2-CB 3.46Å; D299-S301 PolarHBondContact OD2-OG 3.17Å
300	F	53.2	Low	53.9	Low	53 Å²	53	82.3 Å²	82.3	23%	0.232	44%	0.443	C	S	.	.			trans	-84.3	40	-178.5	-66.2	-72.9	0	0	0	111.7	P298 F302 I417 Y458	P298-F300 HydrophobicContact CG-CE2 4.45Å; P298-F300 HydrophobicContact CG-CZ 4.05Å; P298-F300 VanDerWaalsContact O-CD2 3.23Å; P298-F300 WeakPolarHBondContact O-CD2 3.48Å; P298-F300 WeakPolarHBondContact O-CE2 3.46Å; P298-F300 WeakPolarHBondContact O-CG 3.5Å; P298-F300 PolarHBondContact O-N 3.31Å; F300-F302 PolarHBondContact O-N 2.98Å; F300-I417 HydrophobicContact CE1-CD1 4.05Å; F300-I417 HydrophobicContact CE1-CG1 4.31Å; F300-I417 HydrophobicContact CE1-CG2 3.79Å; F300-I417 HydrophobicContact CZ-CD1 4.35Å; F300-I417 HydrophobicContact CZ-CG1 4.14Å; F300-I417 HydrophobicContact CZ-CG2 3.72Å; F300-Y458 HydrophobicContact CB-CE1 4.47Å
301	S	45.3	Very low	57.1	Low	80 Å²	80	74.5 Å²	74.5	56%	0.559	40%	0.404	S	S	*	.			trans	-71.7	24.6	175.2	56.7	0	0	0	0	114.1	D299	D299-S301 VanDerWaalsContact CG-OG 3.26Å; D299-S301 PolarHBondContact O-N 2.88Å; D299-S301 VanDerWaalsContact O-N 3.09Å; D299-S301 WeakPolarHBondContact OD1-CB 3.24Å; D299-S301 PolarHBondContact OD1-N 3.36Å; D299-S301 WeakPolarHBondContact OD2-CB 3.46Å; D299-S301 PolarHBondContact OD2-OG 3.17Å
302	F	53.2	Low	60.3	Low	45 Å²	45	69.1 Å²	69.1	20%	0.197	37%	0.367	C	S	.	.	P	Polyproline II helix	trans	-79.5	145.2	168.1	-55.9	-68.7	0	0	0	110	F300 E306 L308 I325 I455	F300-F302 PolarHBondContact O-N 2.98Å; F302-E306 WeakPolarHBondContact CA-OE2 3.37Å; F302-L308 HydrophobicContact CD1-CD1 4.42Å; F302-L308 HydrophobicContact CD1-CD2 3.8Å; F302-L308 HydrophobicContact CD2-CD1 4.13Å; F302-L308 HydrophobicContact CE1-CD1 4.48Å; F302-L308 HydrophobicContact CE1-CD2 3.72Å; F302-L308 HydrophobicContact CE2-CD1 4.2Å; F302-L308 HydrophobicContact CG-CD1 4.24Å; F302-L308 HydrophobicContact CG-CD2 4.4Å; F302-L308 HydrophobicContact CZ-CD1 4.38Å; F302-L308 HydrophobicContact CZ-CD2 4.28Å; F302-I325 HydrophobicContact CE2-CD1 4.01Å; F302-I325 HydrophobicContact CZ-CD1 4.21Å; F302-I455 HydrophobicContact CB-CD1 3.99Å
303	H	50.2	Low	63.2	Low	148 Å²	148	62.6 Å²	62.6	69%	0.685	34%	0.335	S	S	*	.	P	Polyproline II helix	trans	-82.7	154.5	174.7	-67.6	-55.3	0	0	0	111.2	E306	H303-E306 PolarHBondContact N-OE2 2.85Å; H303-E306 VanDerWaalsContact O-CB 3.23Å; H303-E306 WeakPolarHBondContact O-CB 3.29Å; H303-E306 PolarHBondContact O-N 2.98Å; H303-E306 VanDerWaalsContact O-N 3.14Å
304	A	48.1	Very low	66	Low	71 Å²	71	55.4 Å²	55.4	59%	0.587	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-53.9	148.7	163	0	0	0	0	0	109.5	E306	A304-E306 PolarHBondContact O-N 3.23Å
305	D	54	Low	68.5	Low	102 Å²	102	49.7 Å²	49.7	55%	0.545	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.2	-2.8	-170.1	-57.6	-69.2	0	0	0	117.4	K454	D305-K454 WeakPolarHBondContact OD1-CE 3.34Å; D305-K454 IonicContact OD1-NZ 2.76Å; D305-K454 PolarHBondContact OD1-NZ 3.06Å
306	E	67.8	Low	70.7	Confident	79 Å²	79	54.2 Å²	54.2	37%	0.369	30%	0.3	S	S	.	.			trans	-69.7	139.5	175.5	-167.9	164.6	-178	0	0	112.7	F302 H303 A304 L308	F302-E306 WeakPolarHBondContact CA-OE2 3.37Å; H303-E306 PolarHBondContact N-OE2 2.85Å; H303-E306 VanDerWaalsContact O-CB 3.23Å; H303-E306 WeakPolarHBondContact O-CB 3.29Å; H303-E306 PolarHBondContact O-N 2.98Å; H303-E306 VanDerWaalsContact O-N 3.14Å; A304-E306 PolarHBondContact O-N 3.23Å; E306-L308 HydrophobicContact CG-CD2 4.39Å
307	Y	78.8	Confident	73.1	Confident	46 Å²	46	52.4 Å²	52.4	18%	0.18	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.6	125.5	178.6	-65.9	-75	0	0	0	111.2	L168 V452 A453 K454 Y472	L168-Y307 HydrophobicContact CD1-CD1 3.94Å; L168-Y307 HydrophobicContact CD1-CE1 3.64Å; L168-Y307 HydrophobicContact CD2-CD1 4.02Å; L168-Y307 HydrophobicContact CD2-CD2 4.39Å; L168-Y307 HydrophobicContact CD2-CE1 4.13Å; L168-Y307 HydrophobicContact CD2-CE2 4.49Å; L168-Y307 HydrophobicContact CD2-CG 4.17Å; L168-Y307 HydrophobicContact CG-CD1 3.85Å; L168-Y307 HydrophobicContact CG-CE1 3.47Å; L168-Y307 VanDerWaalsContact CG-CE1 3.47Å; L168-Y307 HydrophobicContact CG-CE2 4.24Å; L168-Y307 HydrophobicContact CG-CG 4.39Å; Y307-V452 HydrophobicContact CD1-CG1 4.02Å; Y307-V452 HydrophobicContact CG-CG1 4.44Å; Y307-A453 CarbonylContact C-O 3.57Å; Y307-A453 WeakPolarHBondContact CA-O 3.27Å; Y307-K454 HydrophobicContact CD1-CB 3.65Å; Y307-K454 HydrophobicContact CD1-CG 3.82Å; Y307-K454 HydrophobicContact CE1-CB 3.54Å; Y307-K454 HydrophobicContact CE1-CD 3.67Å; Y307-K454 HydrophobicContact CE1-CG 3.48Å; Y307-K454 VanDerWaalsContact CE1-CG 3.48Å; Y307-Y472 HydrophobicContact CE1-CE2 4.33Å
308	L	85.4	Confident	75.6	Confident	20 Å²	20	48.2 Å²	48.2	11%	0.105	25%	0.254	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.2	136.1	-178.5	-58.5	177.4	0	0	0	110.2	F302 E306 V310 I325 V452 A453 I455	F302-L308 HydrophobicContact CD1-CD1 4.42Å; F302-L308 HydrophobicContact CD1-CD2 3.8Å; F302-L308 HydrophobicContact CD2-CD1 4.13Å; F302-L308 HydrophobicContact CE1-CD1 4.48Å; F302-L308 HydrophobicContact CE1-CD2 3.72Å; F302-L308 HydrophobicContact CE2-CD1 4.2Å; F302-L308 HydrophobicContact CG-CD1 4.24Å; F302-L308 HydrophobicContact CG-CD2 4.4Å; F302-L308 HydrophobicContact CZ-CD1 4.38Å; F302-L308 HydrophobicContact CZ-CD2 4.28Å; E306-L308 HydrophobicContact CG-CD2 4.39Å; L308-V310 HydrophobicContact CB-CG1 4.15Å; L308-I325 HydrophobicContact CD1-CD1 4.09Å; L308-I325 HydrophobicContact CD1-CG1 4.5Å; L308-V452 CarbonylContact O-C 3.57Å; L308-V452 WeakPolarHBondContact O-CA 3.43Å; L308-A453 PolarHBondContact N-O 2.64Å; L308-A453 PolarHBondContact O-N 2.65Å; L308-I455 HydrophobicContact CD1-CD1 4.31Å
309	E	89.4	Confident	77.6	Confident	42 Å²	42	49.5 Å²	49.5	20%	0.196	26%	0.261	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	132.2	165.7	-74.9	169.5	135.6	0	0	109.2	R134 R201 V326 L451 V452	R134-E309 IonicContact NH1-OE1 2.83Å; R201-E309 IonicContact CZ-OE1 3.05Å; R201-E309 IonicContact CZ-OE2 2.99Å; R201-E309 IonicContact NH1-OE1 2.57Å; R201-E309 PolarHBondContact NH1-OE1 2.87Å; R201-E309 IonicContact NH1-OE2 3.23Å; R201-E309 PolarHBondContact NH1-OE2 3.13Å; R201-E309 IonicContact NH2-OE1 3.17Å; R201-E309 IonicContact NH2-OE2 3.9Å; R201-E309 PolarHBondContact NH2-OE2 2.99Å; E309-V326 HydrophobicContact CB-CB 3.94Å; E309-V326 HydrophobicContact CB-CG1 4.48Å; E309-V326 HydrophobicContact CB-CG2 4.41Å; E309-V326 WeakPolarHBondContact O-CB 3.35Å; E309-V326 PolarHBondContact O-N 3.17Å; E309-L451 CarbonylContact C-O 3.55Å; E309-L451 VanDerWaalsContact CA-O 3.28Å; E309-L451 WeakPolarHBondContact CA-O 3.5Å; E309-V452 HydrophobicContact CG-CG2 4.43Å
310	V	94.4	Very high	79.8	Confident	0 Å²	0	45.3 Å²	45.3	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.6	154.1	-170.9	-58.4	0	0	0	0	112	L308 I323 Q324 I325 P450 L451 A453 L471	L308-V310 HydrophobicContact CB-CG1 4.15Å; V310-I323 HydrophobicContact CB-CB 4.28Å; V310-I323 HydrophobicContact CG1-CD1 3.94Å; V310-Q324 CarbonylContact C-O 3.51Å; V310-Q324 VanDerWaalsContact CA-O 3.29Å; V310-Q324 WeakPolarHBondContact CA-O 3.5Å; V310-I325 HydrophobicContact CG1-CG1 4.43Å; V310-P450 WeakPolarHBondContact O-CA 3.28Å; V310-L451 HydrophobicContact CG2-CB 4.14Å; V310-L451 PolarHBondContact N-O 3.29Å; V310-L451 PolarHBondContact O-N 2.69Å; V310-A453 HydrophobicContact CG1-CB 3.83Å; V310-A453 HydrophobicContact CG2-CB 3.91Å; V310-L471 HydrophobicContact CG2-CD1 3.66Å
311	Y	96.3	Very high	81.9	Confident	6 Å²	6	42.8 Å²	42.8	2%	0.024	23%	0.226	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.3	144.8	158.5	-55.7	-43.8	0	0	0	108.9	I204 I323 Q324 V326 W448 P450	I204-Y311 VanDerWaalsContact CG2-OH 3.28Å; I204-Y311 WeakPolarHBondContact CG2-OH 3.42Å; Y311-I323 CarbonylContact O-C 3.51Å; Y311-I323 WeakPolarHBondContact O-CA 3.32Å; Y311-I323 WeakPolarHBondContact O-CB 3.37Å; Y311-Q324 HydrophobicContact CD2-CB 4.43Å; Y311-Q324 PolarHBondContact N-O 2.99Å; Y311-Q324 PolarHBondContact O-N 3.06Å; Y311-V326 HydrophobicContact CD1-CG2 3.77Å; Y311-V326 HydrophobicContact CD2-CG2 4.07Å; Y311-V326 HydrophobicContact CE1-CG2 3.65Å; Y311-V326 HydrophobicContact CE2-CG2 3.98Å; Y311-V326 HydrophobicContact CG-CG2 3.98Å; Y311-W448 WeakPolarHBondContact CD1-O 3.16Å; Y311-W448 HydrophobicContact CD2-CE3 4.12Å; Y311-W448 HydrophobicContact CE1-CB 4.44Å; Y311-W448 WeakPolarHBondContact CE1-O 3.46Å; Y311-W448 HydrophobicContact CG-CE3 4.42Å; Y311-P450 HydrophobicContact CD1-CB 4.4Å; Y311-P450 HydrophobicContact CE1-CB 4Å
312	V	97.1	Very high	84.3	Confident	1 Å²	1	40 Å²	40	1%	0.006	20%	0.203	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	112.4	160.4	176.7	0	0	0	0	107.1	F321 W322 I323 T443 C445 A446 L451 L471	V312-F321 HydrophobicContact CG1-CD2 4.25Å; V312-F321 HydrophobicContact CG2-CD2 4.21Å; V312-F321 HydrophobicContact CG2-CE2 4.3Å; V312-W322 CarbonylContact C-O 3.57Å; V312-W322 WeakPolarHBondContact CA-O 3.46Å; V312-I323 HydrophobicContact CG2-CG2 4.34Å; V312-T443 HydrophobicContact CG2-CG2 4Å; V312-C445 HydrophobicContact CG1-CB 4.11Å; V312-A446 PolarHBondContact O-N 3.18Å; V312-L451 HydrophobicContact CG2-CD1 4.13Å; V312-L471 HydrophobicContact CG2-CD2 3.96Å
313	S	95.9	Very high	86.4	Confident	3 Å²	3	38.2 Å²	38.2	2%	0.021	20%	0.196	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	-31.2	-173.5	53.4	0	0	0	0	113.1	W322 F391	S313-W322 PolarHBondContact N-O 3.33Å; S313-W322 PolarHBondContact OG-O 3.49Å; S313-F391 CarbonylContact C-O 3.55Å; S313-F391 VanDerWaalsContact CB-O 3.23Å; S313-F391 WeakPolarHBondContact CB-O 3.5Å; S313-F391 PolarHBondContact OG-O 3.07Å
314	A	95.8	Very high	88.6	Confident	6 Å²	6	31.3 Å²	31.3	5%	0.05	16%	0.164	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-148.5	161.3	171.7	0	0	0	0	0	109.7	W322 F391 D393	A314-W322 HydrophobicContact CB-CB 4.24Å; A314-W322 HydrophobicContact CB-CD2 4.22Å; A314-W322 HydrophobicContact CB-CE3 3.66Å; A314-W322 HydrophobicContact CB-CG 4.48Å; A314-W322 HydrophobicContact CB-CZ3 4.41Å; A314-W322 PolarHBondContact O-N 2.99Å; A314-F391 WeakPolarHBondContact CB-O 3.39Å; A314-D393 HydrophobicContact CB-CB 4.2Å
315	S	96.1	Very high	90.6	Very high	16 Å²	16	28.7 Å²	28.7	11%	0.112	14%	0.14	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.5	131.4	174.7	176.2	0	0	0	0	110.3	K215 F439	K215-S315 PolarHBondContact NZ-O 2.86Å; S315-F439 WeakPolarHBondContact OG-CD1 3.35Å; S315-F439 VanDerWaalsContact OG-CE1 3.31Å; S315-F439 WeakPolarHBondContact OG-CE1 3.3Å
316	E	93.2	Very high	92.5	Very high	113 Å²	113	24.9 Å²	24.9	53%	0.528	12%	0.12	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-88	-57.7	162.8	179.2	178.2	-163.2	0	0	109	H320 W322	E316-H320 PolarHBondContact N-O 3.32Å; E316-H320 IonicContact OE2-CE1 3.42Å; E316-H320 IonicContact OE2-CG 3.17Å; E316-H320 IonicContact OE2-ND1 2.65Å; E316-H320 PolarHBondContact OE2-ND1 2.99Å; E316-W322 HydrophobicContact CB-CH2 4.41Å; E316-W322 HydrophobicContact CB-CZ3 4.19Å
317	H	95.4	Very high	93.5	Very high	52 Å²	52	22 Å²	22	24%	0.241	11%	0.111	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.9	167.8	177	63.9	16.9	0	0	0	112.3	N319 H320 W431 L436	H317-N319 PolarHBondContact ND1-N 2.89Å; H317-N319 PolarHBondContact O-N 3.22Å; H317-H320 WeakPolarHBondContact CE1-CB 3.03Å; H317-H320 PolarHBondContact CE1-N 3.49Å; H317-H320 PolarHBondContact N-O 2.82Å; H317-H320 VanDerWaalsContact N-O 3.14Å; H317-H320 WeakPolarHBondContact ND1-CB 3.46Å; H317-H320 PolarHBondContact ND1-N 2.74Å; H317-H320 CarbonylContact O-C 3.55Å; H317-H320 PolarHBondContact O-N 2.93Å; H317-W431 HydrophobicContact CB-CB 4.41Å; H317-W431 HydrophobicContact CB-CG 4.11Å; H317-W431 AromaticContact CD2-CD1 3.54Å; H317-W431 AromaticContact CG-CD1 3.7Å; H317-L436 HydrophobicContact CB-CD2 3.45Å; H317-L436 VanDerWaalsContact CB-CD2 3.45Å
318	P	97.3	Very high	93.9	Very high	0 Å²	0	23.3 Å²	23.3	0%	0	13%	0.128	C	C	.	.	T	Hydrogen-bonded Turn	trans	-58.2	-16.1	-174.7	-25.7	33.9	0	0	0	116.3	F321 L421 W431 F439 L486	P318-F321 WeakPolarHBondContact O-CE1 3.39Å; P318-L421 HydrophobicContact CB-CD1 4.01Å; P318-L421 WeakPolarHBondContact O-CB 3.46Å; P318-L421 WeakPolarHBondContact O-CG 3.45Å; P318-L421 PolarHBondContact O-N 2.71Å; P318-W431 HydrophobicContact CB-CH2 3.87Å; P318-W431 HydrophobicContact CB-CZ2 3.7Å; P318-W431 HydrophobicContact CB-CZ3 4.38Å; P318-W431 HydrophobicContact CG-CD2 4.02Å; P318-W431 HydrophobicContact CG-CE3 3.94Å; P318-W431 HydrophobicContact CG-CH2 3.87Å; P318-W431 HydrophobicContact CG-CZ2 3.94Å; P318-W431 HydrophobicContact CG-CZ3 3.86Å; P318-F439 HydrophobicContact CB-CD2 4.14Å; P318-F439 HydrophobicContact CB-CE2 4.29Å; P318-F439 HydrophobicContact CB-CG 4.28Å; P318-F439 HydrophobicContact CG-CB 3.92Å; P318-F439 HydrophobicContact CG-CD1 4.2Å; P318-F439 HydrophobicContact CG-CD2 4.07Å; P318-F439 HydrophobicContact CG-CG 3.8Å; P318-L486 HydrophobicContact CB-CD1 4.06Å; P318-L486 HydrophobicContact CG-CD1 3.88Å
319	N	95.2	Very high	94.1	Very high	38 Å²	38	25 Å²	25	20%	0.203	13%	0.132	C	C	.	.	T	Hydrogen-bonded Turn	trans	-96.5	-2.4	172.4	-69.4	115.6	0	0	0	115.3	H317 S420 I424 W431	H317-N319 PolarHBondContact ND1-N 2.89Å; H317-N319 PolarHBondContact O-N 3.22Å; N319-S420 VanDerWaalsContact C-OG 3.3Å; N319-S420 WeakPolarHBondContact CA-OG 3.19Å; N319-S420 PolarHBondContact ND2-OG 3Å; N319-S420 VanDerWaalsContact O-CB 3.24Å; N319-S420 WeakPolarHBondContact O-CB 3.37Å; N319-S420 PolarHBondContact O-OG 3.01Å; N319-I424 PolarHBondContact ND2-O 2.9Å; N319-W431 VanDerWaalsContact OD1-CZ2 3.27Å; N319-W431 WeakPolarHBondContact OD1-CZ2 3.38Å; N319-W431 PolarHBondContact OD1-NE1 2.71Å
320	H	94.4	Very high	94.3	Very high	31 Å²	31	23.1 Å²	23.1	14%	0.144	12%	0.124	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-154.2	100.7	178.3	-174.7	-135.1	0	0	0	109.6	E316 H317 W322 C419 W466	E316-H320 PolarHBondContact N-O 3.32Å; E316-H320 IonicContact OE2-CE1 3.42Å; E316-H320 IonicContact OE2-CG 3.17Å; E316-H320 IonicContact OE2-ND1 2.65Å; E316-H320 PolarHBondContact OE2-ND1 2.99Å; H317-H320 WeakPolarHBondContact CE1-CB 3.03Å; H317-H320 PolarHBondContact CE1-N 3.49Å; H317-H320 PolarHBondContact N-O 2.82Å; H317-H320 VanDerWaalsContact N-O 3.14Å; H317-H320 WeakPolarHBondContact ND1-CB 3.46Å; H317-H320 PolarHBondContact ND1-N 2.74Å; H317-H320 CarbonylContact O-C 3.55Å; H317-H320 PolarHBondContact O-N 2.93Å; H320-W322 AromaticContact CE1-CH2 3.44Å; H320-W322 VanDerWaalsContact CE1-CH2 3.44Å; H320-W322 WeakPolarHBondContact CE1-CH2 3.31Å; H320-W322 AromaticContact CE1-CZ2 3.41Å; H320-W322 VanDerWaalsContact CE1-CZ2 3.41Å; H320-W322 WeakPolarHBondContact CE1-CZ2 3.25Å; H320-W322 AromaticContact ND1-CH2 3.79Å; H320-W322 AromaticContact NE2-CH2 4Å; H320-W322 AromaticContact NE2-CZ2 3.6Å; H320-C419 WeakPolarHBondContact CA-O 3.37Å; H320-W466 AromaticContact CD2-CH2 3.67Å; H320-W466 AromaticContact CD2-CZ3 3.84Å; H320-W466 AromaticContact NE2-CH2 3.58Å; H320-W466 AromaticContact NE2-CZ2 3.9Å
321	F	96.6	Very high	94.3	Very high	0 Å²	0	24.8 Å²	24.8	0%	0	13%	0.133	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	166	179.7	63.6	-87.2	0	0	0	110.4	V312 P318 I323 C419 L421 F439 I469 L471	V312-F321 HydrophobicContact CG1-CD2 4.25Å; V312-F321 HydrophobicContact CG2-CD2 4.21Å; V312-F321 HydrophobicContact CG2-CE2 4.3Å; P318-F321 WeakPolarHBondContact O-CE1 3.39Å; F321-I323 HydrophobicContact CD2-CG2 4.01Å; F321-I323 HydrophobicContact CE2-CG2 3.68Å; F321-C419 HydrophobicContact CD2-CB 4.18Å; F321-C419 HydrophobicContact CE1-CB 4.24Å; F321-C419 HydrophobicContact CE2-CB 3.78Å; F321-C419 HydrophobicContact CZ-CB 3.81Å; F321-C419 PolarHBondContact N-O 2.88Å; F321-C419 VanDerWaalsContact N-O 3.08Å; F321-C419 PolarHBondContact O-N 3.04Å; F321-L421 HydrophobicContact CE1-CD2 4.18Å; F321-L421 HydrophobicContact CE1-CG 4.02Å; F321-L421 HydrophobicContact CZ-CD2 4.08Å; F321-L421 HydrophobicContact CZ-CG 4.42Å; F321-F439 HydrophobicContact CB-CE1 4.07Å; F321-F439 HydrophobicContact CB-CZ 4.48Å; F321-F439 HydrophobicContact CD1-CE1 4.01Å; F321-F439 AromaticContact CD1-CZ 3.68Å; F321-F439 HydrophobicContact CD1-CZ 3.68Å; F321-F439 HydrophobicContact CD2-CZ 4.21Å; F321-F439 AromaticContact CE1-CZ 3.86Å; F321-F439 HydrophobicContact CE1-CZ 3.86Å; F321-F439 HydrophobicContact CE2-CZ 4.36Å; F321-F439 AromaticContact CG-CE1 3.97Å; F321-F439 HydrophobicContact CG-CE1 3.97Å; F321-F439 AromaticContact CG-CZ 3.87Å; F321-F439 HydrophobicContact CG-CZ 3.87Å; F321-F439 HydrophobicContact CZ-CZ 4.2Å; F321-I469 HydrophobicContact CE2-CD1 4.02Å; F321-I469 HydrophobicContact CZ-CD1 3.87Å; F321-I469 HydrophobicContact CZ-CG1 4.04Å; F321-L471 HydrophobicContact CE2-CD2 4.26Å; F321-L471 HydrophobicContact CZ-CD2 4.41Å
322	W	96.7	Very high	94.3	Very high	21 Å²	21	29.2 Å²	29.2	8%	0.08	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-113.7	132.7	-173.5	-64.4	-96.9	0	0	0	111.6	V312 S313 A314 E316 H320 Y387 A416 I417	V312-W322 CarbonylContact C-O 3.57Å; V312-W322 WeakPolarHBondContact CA-O 3.46Å; S313-W322 PolarHBondContact N-O 3.33Å; S313-W322 PolarHBondContact OG-O 3.49Å; A314-W322 HydrophobicContact CB-CB 4.24Å; A314-W322 HydrophobicContact CB-CD2 4.22Å; A314-W322 HydrophobicContact CB-CE3 3.66Å; A314-W322 HydrophobicContact CB-CG 4.48Å; A314-W322 HydrophobicContact CB-CZ3 4.41Å; A314-W322 PolarHBondContact O-N 2.99Å; E316-W322 HydrophobicContact CB-CH2 4.41Å; E316-W322 HydrophobicContact CB-CZ3 4.19Å; H320-W322 AromaticContact CE1-CH2 3.44Å; H320-W322 VanDerWaalsContact CE1-CH2 3.44Å; H320-W322 WeakPolarHBondContact CE1-CH2 3.31Å; H320-W322 AromaticContact CE1-CZ2 3.41Å; H320-W322 VanDerWaalsContact CE1-CZ2 3.41Å; H320-W322 WeakPolarHBondContact CE1-CZ2 3.25Å; H320-W322 AromaticContact ND1-CH2 3.79Å; H320-W322 AromaticContact NE2-CH2 4Å; H320-W322 AromaticContact NE2-CZ2 3.6Å; W322-Y387 HydrophobicContact CZ2-CE2 4.26Å; W322-Y387 AromaticContact NE1-CE2 3.69Å; W322-Y387 AromaticContact NE1-CZ 3.74Å; W322-Y387 PolarHBondContact NE1-OH 3.31Å; W322-A416 HydrophobicContact CB-CB 4.32Å; W322-A416 HydrophobicContact CG-CB 4.45Å; W322-I417 WeakPolarHBondContact CA-O 3.31Å
323	I	96.4	Very high	94.2	Very high	7 Å²	7	29.2 Å²	29.2	4%	0.036	15%	0.154	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111	149.7	172.9	68.4	175.8	0	0	0	112.5	V310 Y311 V312 F321 I417 C419 I469	V310-I323 HydrophobicContact CB-CB 4.28Å; V310-I323 HydrophobicContact CG1-CD1 3.94Å; Y311-I323 CarbonylContact O-C 3.51Å; Y311-I323 WeakPolarHBondContact O-CA 3.32Å; Y311-I323 WeakPolarHBondContact O-CB 3.37Å; V312-I323 HydrophobicContact CG2-CG2 4.34Å; F321-I323 HydrophobicContact CD2-CG2 4.01Å; F321-I323 HydrophobicContact CE2-CG2 3.68Å; I323-I417 HydrophobicContact CD1-CB 4.48Å; I323-I417 HydrophobicContact CD1-CG2 4.38Å; I323-I417 HydrophobicContact CG1-CB 3.76Å; I323-I417 HydrophobicContact CG1-CG2 4.11Å; I323-I417 PolarHBondContact N-O 3.07Å; I323-I417 PolarHBondContact O-N 2.93Å; I323-C419 WeakPolarHBondContact CD1-SG 3.32Å; I323-C419 VanDerWaalsContact CG1-SG 3.58Å; I323-I469 HydrophobicContact CD1-CD1 4.34Å; I323-I469 HydrophobicContact CG2-CD1 4.33Å
324	Q	95.6	Very high	94.2	Very high	3 Å²	3	29.9 Å²	29.9	1%	0.014	16%	0.157	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	132.7	161.4	-68.9	177.6	-1	0	0	109.2	V310 Y311 D390 F391	V310-Q324 CarbonylContact C-O 3.51Å; V310-Q324 VanDerWaalsContact CA-O 3.29Å; V310-Q324 WeakPolarHBondContact CA-O 3.5Å; Y311-Q324 HydrophobicContact CD2-CB 4.43Å; Y311-Q324 PolarHBondContact N-O 2.99Å; Y311-Q324 PolarHBondContact O-N 3.06Å; Q324-D390 PolarHBondContact NE2-O 2.91Å; Q324-F391 VanDerWaalsContact NE2-CD1 3.25Å
325	I	92	Very high	94.3	Very high	17 Å²	17	35.1 Å²	35.1	9%	0.087	18%	0.179	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-79.3	124.9	177.4	-66.7	167.4	0	0	0	110.2	F302 L308 V310 R329 S330 I417	F302-I325 HydrophobicContact CE2-CD1 4.01Å; F302-I325 HydrophobicContact CZ-CD1 4.21Å; L308-I325 HydrophobicContact CD1-CD1 4.09Å; L308-I325 HydrophobicContact CD1-CG1 4.5Å; V310-I325 HydrophobicContact CG1-CG1 4.43Å; I325-R329 VanDerWaalsContact CD1-NH2 3.27Å; I325-S330 PolarHBondContact O-OG 3.1Å; I325-I417 HydrophobicContact CD1-CD1 3.58Å; I325-I417 HydrophobicContact CG1-CD1 4.01Å
326	V	92	Very high	94.3	Very high	22 Å²	22	35 Å²	35	13%	0.133	18%	0.176	C	C	.	.			trans	-74.7	130.2	-176.2	179.2	0	0	0	0	110.6	I204 E309 Y311 S330 P450	I204-V326 HydrophobicContact CD1-CG1 4.48Å; I204-V326 HydrophobicContact CG2-CG1 4.03Å; E309-V326 HydrophobicContact CB-CB 3.94Å; E309-V326 HydrophobicContact CB-CG1 4.48Å; E309-V326 HydrophobicContact CB-CG2 4.41Å; E309-V326 WeakPolarHBondContact O-CB 3.35Å; E309-V326 PolarHBondContact O-N 3.17Å; Y311-V326 HydrophobicContact CD1-CG2 3.77Å; Y311-V326 HydrophobicContact CD2-CG2 4.07Å; Y311-V326 HydrophobicContact CE1-CG2 3.65Å; Y311-V326 HydrophobicContact CE2-CG2 3.98Å; Y311-V326 HydrophobicContact CG-CG2 3.98Å; V326-S330 WeakPolarHBondContact CA-OG 3.36Å; V326-P450 HydrophobicContact CG2-CB 4.42Å
327	G	89.3	Confident	94.5	Very high	17 Å²	17	30.5 Å²	30.5	18%	0.175	16%	0.157	C	C	.	.	S	Bend	trans	157.3	-148.8	176.9	0	0	0	0	0	113.3	I204 R329 S330	I204-G327 WeakPolarHBondContact CD1-O 3.46Å; G327-R329 PolarHBondContact O-N 2.71Å; G327-S330 PolarHBondContact N-OG 3.19Å; G327-S330 WeakPolarHBondContact O-CB 3.44Å; G327-S330 PolarHBondContact O-N 3.2Å; G327-S330 VanDerWaalsContact O-N 3.12Å; G327-S330 PolarHBondContact O-OG 3.49Å
328	S	87.8	Confident	94.5	Very high	75 Å²	75	33.3 Å²	33.3	52%	0.524	17%	0.174	S	C	.	.	H	α-helix	trans	-58.8	-32.1	175.4	59.2	0	0	0	0	112.7	S330 L331 Q332	S328-S330 VanDerWaalsContact C-N 3.32Å; S328-S330 PolarHBondContact O-N 2.97Å; S328-L331 PolarHBondContact O-N 2.86Å; S328-Q332 WeakPolarHBondContact O-CG 3.48Å; S328-Q332 PolarHBondContact O-N 2.71Å; S328-Q332 PolarHBondContact O-OE1 2.89Å
329	R	89.3	Confident	94.6	Very high	54 Å²	54	36.9 Å²	36.9	20%	0.204	19%	0.19	C	C	.	.	H	α-helix	trans	-60.2	-37.7	175.5	-84.6	-166.4	-71.2	-171.7	-7.8	113.1	I325 G327 L331 Q332 L333	I325-R329 VanDerWaalsContact CD1-NH2 3.27Å; G327-R329 PolarHBondContact O-N 2.71Å; R329-L331 PolarHBondContact O-N 3.36Å; R329-Q332 WeakPolarHBondContact O-CB 3.24Å; R329-Q332 PolarHBondContact O-N 3.33Å; R329-Q332 VanDerWaalsContact O-N 3.16Å; R329-L333 PolarHBondContact O-N 3.23Å
330	S	93.2	Very high	94.7	Very high	3 Å²	3	35.1 Å²	35.1	2%	0.021	18%	0.181	C	C	.	.	H	α-helix	trans	-59.8	-48.1	176.5	-40.4	0	0	0	0	110.9	I325 V326 G327 S328 Q332 L333 D334	I325-S330 PolarHBondContact O-OG 3.1Å; V326-S330 WeakPolarHBondContact CA-OG 3.36Å; G327-S330 PolarHBondContact N-OG 3.19Å; G327-S330 WeakPolarHBondContact O-CB 3.44Å; G327-S330 PolarHBondContact O-N 3.2Å; G327-S330 VanDerWaalsContact O-N 3.12Å; G327-S330 PolarHBondContact O-OG 3.49Å; S328-S330 VanDerWaalsContact C-N 3.32Å; S328-S330 PolarHBondContact O-N 2.97Å; S330-Q332 VanDerWaalsContact C-N 3.3Å; S330-Q332 PolarHBondContact O-N 3.36Å; S330-L333 WeakPolarHBondContact O-CB 3.34Å; S330-L333 PolarHBondContact O-N 3.05Å; S330-D334 PolarHBondContact O-N 2.83Å; S330-D334 VanDerWaalsContact O-OD2 3.1Å
331	L	94.7	Very high	94.8	Very high	36 Å²	36	34.6 Å²	34.6	19%	0.188	18%	0.18	C	C	.	.	H	α-helix	trans	-67.4	-28.5	176.4	-61.2	-179.4	0	0	0	113.1	L200 R203 I204 S328 R329 K335	L200-L331 HydrophobicContact CD1-CD1 3.65Å; R203-L331 HydrophobicContact CB-CD1 4.36Å; I204-L331 HydrophobicContact CG1-CD1 4.13Å; I204-L331 HydrophobicContact CG1-CD2 4.06Å; I204-L331 HydrophobicContact CG1-CG 3.86Å; S328-L331 PolarHBondContact O-N 2.86Å; R329-L331 PolarHBondContact O-N 3.36Å; L331-K335 WeakPolarHBondContact O-CB 3.22Å; L331-K335 PolarHBondContact O-N 2.92Å
332	Q	95.9	Very high	94.8	Very high	98 Å²	98	42.4 Å²	42.4	46%	0.458	22%	0.216	S	C	.	.	H	α-helix	trans	-71.3	-37.9	173.3	-70.9	170.4	-57.8	0	0	111.6	S328 R329 S330 L336 L412	S328-Q332 WeakPolarHBondContact O-CG 3.48Å; S328-Q332 PolarHBondContact O-N 2.71Å; S328-Q332 PolarHBondContact O-OE1 2.89Å; R329-Q332 WeakPolarHBondContact O-CB 3.24Å; R329-Q332 PolarHBondContact O-N 3.33Å; R329-Q332 VanDerWaalsContact O-N 3.16Å; S330-Q332 VanDerWaalsContact C-N 3.3Å; S330-Q332 PolarHBondContact O-N 3.36Å; Q332-L336 WeakPolarHBondContact O-CB 3.43Å; Q332-L336 PolarHBondContact O-N 3.3Å; Q332-L412 HydrophobicContact CB-CD1 3.85Å; Q332-L412 HydrophobicContact CB-CD2 4.28Å
333	L	96.6	Very high	94.9	Very high	1 Å²	1	45.4 Å²	45.4	1%	0.005	23%	0.231	C	C	.	.	H	α-helix	trans	-66.1	-44.2	172	179.9	58.9	0	0	0	111.6	R329 S330 K335 L336 V337 D390 F391 L412 Q415	R329-L333 PolarHBondContact O-N 3.23Å; S330-L333 WeakPolarHBondContact O-CB 3.34Å; S330-L333 PolarHBondContact O-N 3.05Å; L333-K335 VanDerWaalsContact C-N 3.29Å; L333-K335 PolarHBondContact O-N 3.17Å; L333-L336 HydrophobicContact CD1-CD2 4.44Å; L333-L336 WeakPolarHBondContact O-CB 3.31Å; L333-L336 PolarHBondContact O-N 2.57Å; L333-L336 VanDerWaalsContact O-N 3.12Å; L333-V337 HydrophobicContact CD1-CG2 4.15Å; L333-V337 WeakPolarHBondContact O-CG2 3.32Å; L333-V337 PolarHBondContact O-N 3.4Å; L333-D390 HydrophobicContact CD1-CB 3.61Å; L333-D390 HydrophobicContact CD2-CB 4.25Å; L333-F391 HydrophobicContact CD1-CE2 4.27Å; L333-F391 HydrophobicContact CD1-CZ 4.41Å; L333-F391 HydrophobicContact CD2-CE1 4.22Å; L333-F391 HydrophobicContact CD2-CE2 4.27Å; L333-F391 HydrophobicContact CD2-CZ 3.83Å; L333-F391 HydrophobicContact CG-CZ 4.23Å; L333-L412 HydrophobicContact CB-CD2 4.26Å; L333-Q415 HydrophobicContact CB-CG 4.26Å; L333-Q415 HydrophobicContact CD1-CG 4.27Å; L333-Q415 HydrophobicContact CD2-CB 4.02Å; L333-Q415 HydrophobicContact CD2-CG 4.14Å; L333-Q415 HydrophobicContact CG-CG 4.45Å
334	D	95.4	Very high	94.9	Very high	17 Å²	17	45.5 Å²	45.5	9%	0.091	23%	0.231	C	C	.	.	H	α-helix	trans	-60	-42.3	177.1	-58.5	-30	0	0	0	110.8	S207 R211 S330 N338	S207-D334 VanDerWaalsContact CB-OD2 3.31Å; S207-D334 WeakPolarHBondContact CB-OD2 3.39Å; S207-D334 PolarHBondContact OG-OD2 3.03Å; R211-D334 IonicContact CZ-OD1 2.73Å; R211-D334 IonicContact NE-OD1 3.87Å; R211-D334 PolarHBondContact NE-OD1 3.23Å; R211-D334 IonicContact NH2-OD1 3.71Å; R211-D334 PolarHBondContact NH2-OD1 2.88Å; R211-D334 IonicContact NH2-OD2 2.79Å; S330-D334 PolarHBondContact O-N 2.83Å; S330-D334 VanDerWaalsContact O-OD2 3.1Å; D334-N338 PolarHBondContact O-N 2.66Å; D334-N338 PolarHBondContact O-ND2 3.09Å
335	K	96.7	Very high	94.8	Very high	117 Å²	117	51.1 Å²	51.1	51%	0.509	26%	0.257	S	S	.	.	H	α-helix	trans	-61.8	-45.7	172.4	-176.5	176.8	-179	-75	0	111.9	L331 L333 N338 E339	L331-K335 WeakPolarHBondContact O-CB 3.22Å; L331-K335 PolarHBondContact O-N 2.92Å; L333-K335 VanDerWaalsContact C-N 3.29Å; L333-K335 PolarHBondContact O-N 3.17Å; K335-N338 PolarHBondContact O-N 3.25Å; K335-E339 VanDerWaalsContact CE-OE1 3.31Å; K335-E339 WeakPolarHBondContact CE-OE1 3.48Å; K335-E339 HydrophobicContact CG-CG 4.38Å; K335-E339 IonicContact NZ-OE1 2.64Å; K335-E339 PolarHBondContact NZ-OE1 3.05Å; K335-E339 IonicContact NZ-OE2 2.65Å; K335-E339 PolarHBondContact NZ-OE2 3.11Å; K335-E339 WeakPolarHBondContact O-CG 3.39Å; K335-E339 PolarHBondContact O-N 3.1Å
336	L	97.8	Very high	94.8	Very high	12 Å²	12	57 Å²	57	6%	0.063	29%	0.289	C	S	.	.	H	α-helix	trans	-59.8	-48	-180	177.3	62.8	0	0	0	112.1	Q332 L333 N338 E339 M340 F409 L412	Q332-L336 WeakPolarHBondContact O-CB 3.43Å; Q332-L336 PolarHBondContact O-N 3.3Å; L333-L336 HydrophobicContact CD1-CD2 4.44Å; L333-L336 WeakPolarHBondContact O-CB 3.31Å; L333-L336 PolarHBondContact O-N 2.57Å; L333-L336 VanDerWaalsContact O-N 3.12Å; L336-N338 VanDerWaalsContact C-N 3.32Å; L336-N338 PolarHBondContact O-N 3.3Å; L336-E339 PolarHBondContact O-N 2.95Å; L336-M340 HydrophobicContact CD1-CG 3.99Å; L336-M340 HydrophobicContact CD1-SD 4.01Å; L336-M340 HydrophobicContact CG-CG 4.41Å; L336-M340 HydrophobicContact CG-SD 4.08Å; L336-M340 WeakPolarHBondContact O-CB 3.44Å; L336-M340 WeakPolarHBondContact O-CG 3.29Å; L336-M340 PolarHBondContact O-N 3.29Å; L336-F409 HydrophobicContact CD1-CB 3.88Å; L336-F409 HydrophobicContact CD1-CD1 3.41Å; L336-F409 VanDerWaalsContact CD1-CD1 3.41Å; L336-F409 HydrophobicContact CD1-CE1 4.19Å; L336-F409 HydrophobicContact CD1-CG 3.92Å; L336-L412 HydrophobicContact CB-CD2 4.43Å; L336-L412 HydrophobicContact CD2-CB 4.28Å; L336-L412 HydrophobicContact CD2-CD2 3.83Å
337	V	96.4	Very high	94.8	Very high	19 Å²	19	57.6 Å²	57.6	12%	0.115	29%	0.294	C	S	.	.	H	α-helix	trans	-61.9	-41	178.9	174.1	0	0	0	0	111.1	L333 T341 Y371 F391	L333-V337 HydrophobicContact CD1-CG2 4.15Å; L333-V337 WeakPolarHBondContact O-CG2 3.32Å; L333-V337 PolarHBondContact O-N 3.4Å; V337-T341 VanDerWaalsContact O-CB 3.28Å; V337-T341 WeakPolarHBondContact O-CB 3.4Å; V337-T341 PolarHBondContact O-N 3.43Å; V337-T341 PolarHBondContact O-OG1 3.34Å; V337-Y371 HydrophobicContact CB-CE1 4.36Å; V337-Y371 HydrophobicContact CG1-CD1 4.27Å; V337-Y371 HydrophobicContact CG1-CE1 3.61Å; V337-Y371 HydrophobicContact CG2-CD1 3.9Å; V337-Y371 HydrophobicContact CG2-CE1 3.71Å; V337-F391 HydrophobicContact CG2-CE2 4.28Å; V337-F391 HydrophobicContact CG2-CZ 4.28Å
338	N	96.3	Very high	94.8	Very high	112 Å²	112	62.3 Å²	62.3	60%	0.599	32%	0.319	S	S	*	.	H	α-helix	trans	-64.6	-46.2	175.5	-79.1	-67.4	0	0	0	112.3	D334 K335 L336 T341 Q342	D334-N338 PolarHBondContact O-N 2.66Å; D334-N338 PolarHBondContact O-ND2 3.09Å; K335-N338 PolarHBondContact O-N 3.25Å; L336-N338 VanDerWaalsContact C-N 3.32Å; L336-N338 PolarHBondContact O-N 3.3Å; N338-T341 PolarHBondContact O-N 3.05Å; N338-Q342 WeakPolarHBondContact O-CB 3.34Å; N338-Q342 PolarHBondContact O-N 2.9Å
339	E	97.9	Very high	94.9	Very high	74 Å²	74	62.6 Å²	62.6	35%	0.346	32%	0.319	S	S	.	.	H	α-helix	trans	-70	-34.5	-179.8	-71.9	178.9	143.4	0	0	113	K335 L336 H343 F409	K335-E339 VanDerWaalsContact CE-OE1 3.31Å; K335-E339 WeakPolarHBondContact CE-OE1 3.48Å; K335-E339 HydrophobicContact CG-CG 4.38Å; K335-E339 IonicContact NZ-OE1 2.64Å; K335-E339 PolarHBondContact NZ-OE1 3.05Å; K335-E339 IonicContact NZ-OE2 2.65Å; K335-E339 PolarHBondContact NZ-OE2 3.11Å; K335-E339 WeakPolarHBondContact O-CG 3.39Å; K335-E339 PolarHBondContact O-N 3.1Å; L336-E339 PolarHBondContact O-N 2.95Å; E339-H343 VanDerWaalsContact O-CB 3.31Å; E339-H343 WeakPolarHBondContact O-CB 3.24Å; E339-H343 PolarHBondContact O-N 3.45Å; E339-H343 VanDerWaalsContact O-N 3.12Å; E339-F409 HydrophobicContact CB-CE1 3.94Å; E339-F409 HydrophobicContact CB-CZ 4.36Å
340	M	97.9	Very high	94.6	Very high	1 Å²	1	64.7 Å²	64.7	1%	0.005	33%	0.331	C	S	.	.	H	α-helix	trans	-64.8	-48.2	170.1	-75.9	-173.7	65.1	0	0	111.1	L336 Q342 H343 Y344 A361 W370 Y371 R372 L405 F409	L336-M340 HydrophobicContact CD1-CG 3.99Å; L336-M340 HydrophobicContact CD1-SD 4.01Å; L336-M340 HydrophobicContact CG-CG 4.41Å; L336-M340 HydrophobicContact CG-SD 4.08Å; L336-M340 WeakPolarHBondContact O-CB 3.44Å; L336-M340 WeakPolarHBondContact O-CG 3.29Å; L336-M340 PolarHBondContact O-N 3.29Å; M340-Q342 PolarHBondContact O-N 3.41Å; M340-H343 PolarHBondContact O-N 2.87Å; M340-H343 VanDerWaalsContact O-N 3.11Å; M340-Y344 HydrophobicContact CB-CD2 4.25Å; M340-Y344 HydrophobicContact CE-CD2 4.44Å; M340-Y344 HydrophobicContact CE-CE2 4.11Å; M340-Y344 HydrophobicContact CG-CE2 4.44Å; M340-Y344 WeakPolarHBondContact O-CD2 3.47Å; M340-Y344 PolarHBondContact O-N 3.06Å; M340-A361 HydrophobicContact CE-CB 3.85Å; M340-W370 HydrophobicContact CB-CB 4.18Å; M340-Y371 WeakPolarHBondContact CE-O 3.37Å; M340-R372 HydrophobicContact CE-CG 3.88Å; M340-R372 HydrophobicContact SD-CG 3.54Å; M340-R372 VanDerWaalsContact SD-CG 3.54Å; M340-L405 HydrophobicContact CE-CD1 3.51Å; M340-L405 HydrophobicContact SD-CD1 4.19Å; M340-F409 HydrophobicContact CB-CE2 4.41Å; M340-F409 HydrophobicContact CB-CZ 4.43Å; M340-F409 HydrophobicContact CG-CB 4.45Å; M340-F409 HydrophobicContact CG-CD1 3.96Å; M340-F409 HydrophobicContact CG-CD2 3.65Å; M340-F409 HydrophobicContact CG-CE1 3.98Å; M340-F409 HydrophobicContact CG-CE2 3.67Å; M340-F409 HydrophobicContact CG-CG 3.79Å; M340-F409 HydrophobicContact CG-CZ 3.83Å; M340-F409 HydrophobicContact SD-CB 4.42Å; M340-F409 HydrophobicContact SD-CD2 4.44Å; M340-F409 HydrophobicContact SD-CG 4.38Å
341	T	96.9	Very high	94.4	Very high	21 Å²	21	72.8 Å²	72.8	13%	0.129	37%	0.374	C	S	.	.	H	α-helix	trans	-59.7	-49.7	179.6	-57	0	0	0	0	110.8	V337 N338 H343 Y344 E345 S369 W370	V337-T341 VanDerWaalsContact O-CB 3.28Å; V337-T341 WeakPolarHBondContact O-CB 3.4Å; V337-T341 PolarHBondContact O-N 3.43Å; V337-T341 PolarHBondContact O-OG1 3.34Å; N338-T341 PolarHBondContact O-N 3.05Å; T341-H343 PolarHBondContact O-N 3.38Å; T341-Y344 PolarHBondContact O-N 2.89Å; T341-E345 WeakPolarHBondContact O-CB 3.14Å; T341-E345 PolarHBondContact O-N 2.85Å; T341-S369 WeakPolarHBondContact OG1-CA 3.49Å; T341-W370 PolarHBondContact OG1-N 2.97Å
342	Q	97.2	Very high	94.2	Very high	163 Å²	163	72.6 Å²	72.6	76%	0.762	37%	0.373	S	S	*	.	H	α-helix	trans	-58.6	-32	176.2	-172	-178.1	12.7	0	0	113	N338 M340	N338-Q342 WeakPolarHBondContact O-CB 3.34Å; N338-Q342 PolarHBondContact O-N 2.9Å; M340-Q342 PolarHBondContact O-N 3.41Å
343	H	97.1	Very high	94.1	Very high	85 Å²	85	73.1 Å²	73.1	39%	0.394	38%	0.383	S	S	.	.	H	α-helix	trans	-78.5	-41.1	179.2	-172	42.7	0	0	0	113.4	E339 M340 T341 R406 F409	E339-H343 VanDerWaalsContact O-CB 3.31Å; E339-H343 WeakPolarHBondContact O-CB 3.24Å; E339-H343 PolarHBondContact O-N 3.45Å; E339-H343 VanDerWaalsContact O-N 3.12Å; M340-H343 PolarHBondContact O-N 2.87Å; M340-H343 VanDerWaalsContact O-N 3.11Å; T341-H343 PolarHBondContact O-N 3.38Å; H343-R406 PolarHBondContact CD2-NH1 2.86Å; H343-R406 PolarHBondContact CE1-NH1 2.76Å; H343-R406 PolarHBondContact ND1-NH1 2.84Å; H343-R406 PolarHBondContact NE2-NH1 2.9Å; H343-F409 HydrophobicContact CB-CE2 4.33Å; H343-F409 HydrophobicContact CB-CZ 4.24Å; H343-F409 AromaticContact CD2-CE2 3.87Å
344	Y	96.9	Very high	94	Very high	9 Å²	9	74.4 Å²	74.4	4%	0.035	39%	0.391	C	S	.	.	H	α-helix	trans	-103.8	-22.6	-166.8	-67.2	-65.3	0	0	0	115.2	M340 T341 N346 S347 A361 W370 R403 A404 L405 R406 F409	M340-Y344 HydrophobicContact CB-CD2 4.25Å; M340-Y344 HydrophobicContact CE-CD2 4.44Å; M340-Y344 HydrophobicContact CE-CE2 4.11Å; M340-Y344 HydrophobicContact CG-CE2 4.44Å; M340-Y344 WeakPolarHBondContact O-CD2 3.47Å; M340-Y344 PolarHBondContact O-N 3.06Å; T341-Y344 PolarHBondContact O-N 2.89Å; Y344-N346 PolarHBondContact O-N 3.03Å; Y344-N346 VanDerWaalsContact O-N 3.09Å; Y344-S347 VanDerWaalsContact O-CB 3.29Å; Y344-S347 WeakPolarHBondContact O-CB 3.42Å; Y344-S347 PolarHBondContact O-N 2.99Å; Y344-S347 PolarHBondContact O-OG 2.62Å; Y344-A361 HydrophobicContact CD1-CB 4.44Å; Y344-A361 HydrophobicContact CD2-CB 3.8Å; Y344-A361 HydrophobicContact CE1-CB 4.08Å; Y344-A361 HydrophobicContact CE2-CB 3.42Å; Y344-A361 VanDerWaalsContact CE2-CB 3.42Å; Y344-A361 HydrophobicContact CG-CB 4.3Å; Y344-W370 VanDerWaalsContact CB-CE3 3.49Å; Y344-W370 HydrophobicContact CD2-CB 4.45Å; Y344-W370 HydrophobicContact CD2-CD2 4.49Å; Y344-W370 HydrophobicContact CD2-CE3 4.22Å; Y344-W370 HydrophobicContact CG-CD2 4.18Å; Y344-W370 AromaticContact CG-CE3 3.94Å; Y344-W370 HydrophobicContact CG-CE3 3.94Å; Y344-W370 HydrophobicContact CG-CZ3 4.32Å; Y344-W370 WeakPolarHBondContact O-CZ2 3.39Å; Y344-R403 HydrophobicContact CD1-CB 3.72Å; Y344-R403 HydrophobicContact CD1-CG 3.78Å; Y344-R403 HydrophobicContact CE1-CB 3.61Å; Y344-R403 HydrophobicContact CE1-CG 4.2Å; Y344-A404 PolarHBondContact OH-O 3.46Å; Y344-L405 HydrophobicContact CE2-CD1 4.45Å; Y344-L405 WeakPolarHBondContact OH-CA 3.41Å; Y344-R406 PolarHBondContact OH-N 3.43Å; Y344-F409 HydrophobicContact CD2-CE2 4.47Å; Y344-F409 AromaticContact CE2-CD2 3.96Å; Y344-F409 HydrophobicContact CE2-CD2 3.96Å; Y344-F409 AromaticContact CE2-CE2 3.66Å; Y344-F409 HydrophobicContact CE2-CE2 3.66Å
345	E	94.6	Very high	94	Very high	120 Å²	120	79.1 Å²	79.1	56%	0.561	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-51.8	-38	-176.6	-179.5	-171.8	-138.1	0	0	113.4	T341	T341-E345 WeakPolarHBondContact O-CB 3.14Å; T341-E345 PolarHBondContact O-N 2.85Å
346	N	90.8	Very high	94	Very high	142 Å²	142	78.7 Å²	78.7	76%	0.759	42%	0.419	S	S	*	.	T	Hydrogen-bonded Turn	trans	-108.7	19.8	-179	-67.2	-92	0	0	0	112.6	Y344	Y344-N346 PolarHBondContact O-N 3.03Å; Y344-N346 VanDerWaalsContact O-N 3.09Å
347	S	92	Very high	93.9	Very high	33 Å²	33	79.9 Å²	79.9	23%	0.231	44%	0.435	C	S	.	.	P	Polyproline II helix	trans	-82	136.6	-178.6	67.7	0	0	0	0	112.8	Y344 R403	Y344-S347 VanDerWaalsContact O-CB 3.29Å; Y344-S347 WeakPolarHBondContact O-CB 3.42Å; Y344-S347 PolarHBondContact O-N 2.99Å; Y344-S347 PolarHBondContact O-OG 2.62Å; S347-R403 PolarHBondContact O-NH2 2.68Å; S347-R403 PolarHBondContact OG-NE 2.76Å
348	V	90	Very high	93.9	Very high	117 Å²	117	81.9 Å²	81.9	71%	0.709	45%	0.445	S	S	*	.	P	Polyproline II helix	trans	-70.1	142.9	175.5	-174.9	0	0	0	0	109.7	E350 R403	V348-E350 PolarHBondContact O-N 3.09Å; V348-R403 PolarHBondContact O-NE 3.06Å
349	P	88.8	Confident	94	Very high	81 Å²	81	78.4 Å²	78.4	53%	0.526	43%	0.426	S	S	.	.	P	Polyproline II helix	trans	-53.2	135.6	172.3	-28.6	36.6	0	0	0	113.6
350	E	83.4	Confident	94	Very high	97 Å²	97	75.1 Å²	75.1	45%	0.453	41%	0.411	S	S	.	.	P	Polyproline II helix	trans	-97.3	152.9	177.3	-61.7	176.2	143.1	0	0	109.9	V348 L352 R403 A404	V348-E350 PolarHBondContact O-N 3.09Å; E350-L352 HydrophobicContact CB-CB 4.47Å; E350-L352 PolarHBondContact O-N 3.35Å; E350-R403 WeakPolarHBondContact OE2-CA 3.41Å; E350-A404 PolarHBondContact OE2-N 2.9Å
351	D	88.8	Confident	94	Very high	173 Å²	173	75 Å²	75	93%	0.925	41%	0.411	S	S	*	.			trans	-78.7	67.7	171.4	-164.6	17	0	0	0	109.4
352	L	91.2	Very high	94	Very high	32 Å²	32	74 Å²	74	17%	0.168	40%	0.404	C	S	.	.			trans	-86.4	122.8	-167.5	-170.6	70.5	0	0	0	111	E350 V354 L399 L402 A404	E350-L352 HydrophobicContact CB-CB 4.47Å; E350-L352 PolarHBondContact O-N 3.35Å; L352-V354 HydrophobicContact CD2-CG1 3.61Å; L352-V354 HydrophobicContact CG-CG1 3.69Å; L352-L399 HydrophobicContact CB-CD1 4.41Å; L352-L399 HydrophobicContact CD2-CD1 4.39Å; L352-L402 HydrophobicContact CD2-CB 3.89Å; L352-A404 HydrophobicContact CD1-CB 4.01Å
353	T	93.5	Very high	93.9	Very high	109 Å²	109	67.5 Å²	67.5	67%	0.669	38%	0.376	S	S	*	.			trans	-96	132.3	164.7	-57.1	0	0	0	0	108.7
354	V	95.1	Very high	93.5	Very high	28 Å²	28	64.5 Å²	64.5	17%	0.17	36%	0.363	C	S	.	.			trans	-132.2	153.9	-179.8	-56.5	0	0	0	0	111.5	L352 D358 V360 V375 L384 L399	L352-V354 HydrophobicContact CD2-CG1 3.61Å; L352-V354 HydrophobicContact CG-CG1 3.69Å; V354-D358 WeakPolarHBondContact CA-OD2 3.42Å; V354-V360 HydrophobicContact CG1-CG1 4.06Å; V354-V375 HydrophobicContact CB-CG2 4.39Å; V354-L384 HydrophobicContact CG2-CD1 3.71Å; V354-L384 HydrophobicContact CG2-CD2 4.34Å; V354-L399 HydrophobicContact CG1-CD1 4Å; V354-L399 HydrophobicContact CG2-CD1 3.88Å
355	H	95.9	Very high	92.8	Very high	116 Å²	116	69.6 Å²	69.6	54%	0.537	40%	0.397	S	S	.	.			trans	-131	162.1	178.3	-46.5	83.9	0	0	0	110.2	G357 D358	H355-G357 PolarHBondContact O-N 3.48Å; H355-D358 IonicContact CG-OD2 3.73Å; H355-D358 PolarHBondContact N-OD2 2.84Å; H355-D358 IonicContact ND1-OD2 3.11Å; H355-D358 PolarHBondContact ND1-OD2 3.07Å; H355-D358 VanDerWaalsContact ND1-OD2 3.11Å; H355-D358 WeakPolarHBondContact O-CB 3.3Å; H355-D358 PolarHBondContact O-N 3.08Å; H355-D358 VanDerWaalsContact O-N 3.11Å
356	V	96.4	Very high	92.2	Very high	108 Å²	108	69.4 Å²	69.4	66%	0.655	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.6	128.1	173.1	177.5	0	0	0	0	109.7	L376	V356-L376 VanDerWaalsContact CG1-O 3.28Å; V356-L376 WeakPolarHBondContact CG1-O 3.41Å; V356-L376 WeakPolarHBondContact CG2-O 3.33Å
357	G	94.6	Very high	91.9	Very high	38 Å²	38	64.4 Å²	64.4	39%	0.392	38%	0.378	S	S	.	.	T	Hydrogen-bonded Turn	trans	99.9	-19.3	-174.4	0	0	0	0	0	114.8	H355 V375	H355-G357 PolarHBondContact O-N 3.48Å; G357-V375 PolarHBondContact N-O 2.8Å
358	D	96.7	Very high	91.6	Very high	60 Å²	60	64.6 Å²	64.6	32%	0.321	39%	0.385	S	S	.	.			trans	-62.5	141.1	179.5	-75.7	-21.4	0	0	0	111.4	V354 H355 R374 V375	V354-D358 WeakPolarHBondContact CA-OD2 3.42Å; H355-D358 IonicContact CG-OD2 3.73Å; H355-D358 PolarHBondContact N-OD2 2.84Å; H355-D358 IonicContact ND1-OD2 3.11Å; H355-D358 PolarHBondContact ND1-OD2 3.07Å; H355-D358 VanDerWaalsContact ND1-OD2 3.11Å; H355-D358 WeakPolarHBondContact O-CB 3.3Å; H355-D358 PolarHBondContact O-N 3.08Å; H355-D358 VanDerWaalsContact O-N 3.11Å; D358-R374 WeakPolarHBondContact O-CA 3.42Å; D358-V375 PolarHBondContact O-N 3.25Å
359	I	97.9	Very high	91.8	Very high	40 Å²	40	60.3 Å²	60.3	21%	0.205	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.3	116.3	176.8	-46.3	-60	0	0	0	109.4	I295 A373 R374 L405 F414	I295-I359 HydrophobicContact CD1-CG1 4.45Å; I359-A373 CarbonylContact C-O 3.58Å; I359-A373 WeakPolarHBondContact CA-O 3.34Å; I359-R374 HydrophobicContact CD1-CB 3.78Å; I359-R374 HydrophobicContact CD1-CG 3.98Å; I359-L405 HydrophobicContact CG2-CD2 3.62Å; I359-F414 HydrophobicContact CD1-CZ 3.88Å; I359-F414 HydrophobicContact CG1-CZ 4.15Å; I359-F414 HydrophobicContact CG2-CE1 4.48Å
360	V	97.6	Very high	92.2	Very high	4 Å²	4	57.1 Å²	57.1	2%	0.024	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	163.5	-172.8	-65.7	0	0	0	0	111.4	V354 A373 V375 L386 L402	V354-V360 HydrophobicContact CG1-CG1 4.06Å; V360-A373 HydrophobicContact CG2-CB 4.17Å; V360-A373 WeakPolarHBondContact CG2-O 3.42Å; V360-A373 PolarHBondContact N-O 3.03Å; V360-A373 PolarHBondContact O-N 3.32Å; V360-V375 HydrophobicContact CG1-CG2 4.21Å; V360-V375 HydrophobicContact CG2-CG2 4.02Å; V360-L386 HydrophobicContact CG2-CD2 4.38Å; V360-L402 HydrophobicContact CB-CD2 4.45Å; V360-L402 HydrophobicContact CG2-CD1 4.14Å; V360-L402 HydrophobicContact CG2-CD2 3.81Å
361	A	98.1	Very high	92.9	Very high	0 Å²	0	53.2 Å²	53.2	0%	0	32%	0.318	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90	126.9	163.9	0	0	0	0	0	109.1	M340 Y344 W370 Y371 R403 L405	M340-A361 HydrophobicContact CE-CB 3.85Å; Y344-A361 HydrophobicContact CD1-CB 4.44Å; Y344-A361 HydrophobicContact CD2-CB 3.8Å; Y344-A361 HydrophobicContact CE1-CB 4.08Å; Y344-A361 HydrophobicContact CE2-CB 3.42Å; Y344-A361 VanDerWaalsContact CE2-CB 3.42Å; Y344-A361 HydrophobicContact CG-CB 4.3Å; A361-W370 HydrophobicContact CB-CE3 4.08Å; A361-W370 HydrophobicContact CB-CZ3 4.4Å; A361-Y371 WeakPolarHBondContact CA-O 3.37Å; A361-R403 HydrophobicContact CB-CB 4.28Å; A361-R403 PolarHBondContact N-O 3.38Å; A361-R403 PolarHBondContact O-N 3.47Å; A361-L405 HydrophobicContact CB-CD1 3.99Å
362	A	96.9	Very high	93.3	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.7	137.9	-178.5	0	0	0	0	0	111.3	W370 Y371 A373 L386 F388 L402	A362-W370 WeakPolarHBondContact O-CA 3.48Å; A362-Y371 PolarHBondContact N-O 2.67Å; A362-Y371 PolarHBondContact O-N 2.8Å; A362-A373 HydrophobicContact CB-CB 3.87Å; A362-L386 HydrophobicContact CB-CD1 3.9Å; A362-F388 HydrophobicContact CB-CE1 4.25Å; A362-L402 HydrophobicContact CB-CD2 3.55Å
363	P	95.3	Very high	93.6	Very high	25 Å²	25	43.6 Å²	43.6	16%	0.162	27%	0.267	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.5	148.7	171.6	32.3	-32.2	0	0	0	110.7	W370 D401	P363-W370 HydrophobicContact CB-CD2 4.06Å; P363-W370 HydrophobicContact CB-CE3 4.44Å; P363-W370 HydrophobicContact CB-CH2 4.36Å; P363-W370 HydrophobicContact CB-CZ2 3.96Å; P363-W370 HydrophobicContact CG-CH2 4.14Å; P363-W370 HydrophobicContact CG-CZ2 4.16Å; P363-W370 HydrophobicContact CG-CZ3 4.41Å; P363-D401 VanDerWaalsContact CD-O 3.3Å; P363-D401 WeakPolarHBondContact CD-O 3.41Å; P363-D401 HydrophobicContact CG-CB 4.44Å
364	L	89.4	Confident	93.9	Very high	23 Å²	23	42.3 Å²	42.3	12%	0.12	25%	0.25	C	C	.	.			trans	-101.3	111.2	164.9	-170.1	71.5	0	0	0	109.7	T366 N367 G368 S369 Y371 F388	L364-T366 WeakPolarHBondContact CD2-OG1 3.11Å; L364-T366 WeakPolarHBondContact CG-OG1 2.9Å; L364-T366 PolarHBondContact O-N 3.25Å; L364-N367 PolarHBondContact O-N 2.96Å; L364-N367 VanDerWaalsContact O-N 3.12Å; L364-N367 PolarHBondContact O-OD1 2.88Å; L364-G368 PolarHBondContact O-N 3.06Å; L364-S369 PolarHBondContact N-O 3.14Å; L364-Y371 HydrophobicContact CB-CD2 3.79Å; L364-Y371 HydrophobicContact CB-CE2 3.58Å; L364-Y371 HydrophobicContact CD2-CE2 4.11Å; L364-Y371 HydrophobicContact CG-CE2 4.49Å; L364-F388 HydrophobicContact CD1-CE2 3.98Å; L364-F388 HydrophobicContact CD1-CZ 3.94Å
365	P	82.8	Confident	94	Very high	115 Å²	115	41.1 Å²	41.1	75%	0.747	24%	0.243	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.7	-22.2	-172.8	-27.6	36.1	0	0	0	115.5	N367	P365-N367 VanDerWaalsContact C-N 3.3Å; P365-N367 PolarHBondContact O-N 3.36Å
366	T	81.9	Confident	94	Very high	116 Å²	116	38.6 Å²	38.6	71%	0.712	23%	0.233	S	C	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-18.6	179.4	56.7	0	0	0	0	113.8	L364	L364-T366 WeakPolarHBondContact CD2-OG1 3.11Å; L364-T366 WeakPolarHBondContact CG-OG1 2.9Å; L364-T366 PolarHBondContact O-N 3.25Å
367	N	83.5	Confident	93.9	Very high	38 Å²	38	34.2 Å²	34.2	20%	0.203	21%	0.21	C	C	.	.	T	Hydrogen-bonded Turn	trans	-142.1	-2	-176.5	74.9	9	0	0	0	115.7	V212 L364 P365 S369 Y371	V212-N367 HydrophobicContact CB-CB 4.19Å; V212-N367 HydrophobicContact CG1-CB 3.9Å; V212-N367 HydrophobicContact CG2-CB 4.07Å; L364-N367 PolarHBondContact O-N 2.96Å; L364-N367 VanDerWaalsContact O-N 3.12Å; L364-N367 PolarHBondContact O-OD1 2.88Å; P365-N367 VanDerWaalsContact C-N 3.3Å; P365-N367 PolarHBondContact O-N 3.36Å; N367-S369 PolarHBondContact O-N 2.71Å; N367-S369 VanDerWaalsContact O-N 3.07Å; N367-S369 VanDerWaalsContact OD1-CB 3.26Å; N367-S369 WeakPolarHBondContact OD1-CB 3.4Å; N367-S369 PolarHBondContact OD1-N 2.9Å; N367-S369 PolarHBondContact OD1-OG 2.92Å; N367-Y371 PolarHBondContact ND2-OH 2.91Å
368	G	86.4	Confident	94	Very high	37 Å²	37	37.2 Å²	37.2	38%	0.381	22%	0.221	S	C	.	.			trans	69.9	-3	179.2	0	0	0	0	0	115.4	L364	L364-G368 PolarHBondContact O-N 3.06Å
369	S	94.3	Very high	93.9	Very high	26 Å²	26	36.9 Å²	36.9	18%	0.182	22%	0.219	C	C	.	.			trans	-79.2	151.2	-179.2	-57.1	0	0	0	0	111.2	T341 L364 N367 Y371	T341-S369 WeakPolarHBondContact OG1-CA 3.49Å; L364-S369 PolarHBondContact N-O 3.14Å; N367-S369 PolarHBondContact O-N 2.71Å; N367-S369 VanDerWaalsContact O-N 3.07Å; N367-S369 VanDerWaalsContact OD1-CB 3.26Å; N367-S369 WeakPolarHBondContact OD1-CB 3.4Å; N367-S369 PolarHBondContact OD1-N 2.9Å; N367-S369 PolarHBondContact OD1-OG 2.92Å; S369-Y371 WeakPolarHBondContact CB-OH 3.37Å; S369-Y371 WeakPolarHBondContact O-CD2 3.21Å; S369-Y371 WeakPolarHBondContact O-CE2 3.5Å
370	W	97.1	Very high	93.8	Very high	15 Å²	15	44.5 Å²	44.5	6%	0.057	25%	0.253	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	138.9	-179	-72.3	70	0	0	0	112	M340 T341 Y344 A361 A362 P363 D401 R403	M340-W370 HydrophobicContact CB-CB 4.18Å; T341-W370 PolarHBondContact OG1-N 2.97Å; Y344-W370 VanDerWaalsContact CB-CE3 3.49Å; Y344-W370 HydrophobicContact CD2-CB 4.45Å; Y344-W370 HydrophobicContact CD2-CD2 4.49Å; Y344-W370 HydrophobicContact CD2-CE3 4.22Å; Y344-W370 HydrophobicContact CG-CD2 4.18Å; Y344-W370 AromaticContact CG-CE3 3.94Å; Y344-W370 HydrophobicContact CG-CE3 3.94Å; Y344-W370 HydrophobicContact CG-CZ3 4.32Å; Y344-W370 WeakPolarHBondContact O-CZ2 3.39Å; A361-W370 HydrophobicContact CB-CE3 4.08Å; A361-W370 HydrophobicContact CB-CZ3 4.4Å; A362-W370 WeakPolarHBondContact O-CA 3.48Å; P363-W370 HydrophobicContact CB-CD2 4.06Å; P363-W370 HydrophobicContact CB-CE3 4.44Å; P363-W370 HydrophobicContact CB-CH2 4.36Å; P363-W370 HydrophobicContact CB-CZ2 3.96Å; P363-W370 HydrophobicContact CG-CH2 4.14Å; P363-W370 HydrophobicContact CG-CZ2 4.16Å; P363-W370 HydrophobicContact CG-CZ3 4.41Å; W370-D401 VanDerWaalsContact CH2-O 3.24Å; W370-D401 WeakPolarHBondContact CH2-O 3.32Å; W370-R403 HydrophobicContact CH2-CG 3.77Å; W370-R403 HydrophobicContact CZ3-CB 4.28Å; W370-R403 HydrophobicContact CZ3-CG 3.69Å
371	Y	97.4	Very high	93.6	Very high	15 Å²	15	48.7 Å²	48.7	6%	0.059	28%	0.275	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	158.7	-171.2	-62.7	-75.7	0	0	0	111.1	R214 V337 M340 A361 A362 L364 N367 S369 F388 F391	R214-Y371 VanDerWaalsContact NH1-CE1 3.27Å; R214-Y371 VanDerWaalsContact NH1-CE2 3.34Å; V337-Y371 HydrophobicContact CB-CE1 4.36Å; V337-Y371 HydrophobicContact CG1-CD1 4.27Å; V337-Y371 HydrophobicContact CG1-CE1 3.61Å; V337-Y371 HydrophobicContact CG2-CD1 3.9Å; V337-Y371 HydrophobicContact CG2-CE1 3.71Å; M340-Y371 WeakPolarHBondContact CE-O 3.37Å; A361-Y371 WeakPolarHBondContact CA-O 3.37Å; A362-Y371 PolarHBondContact N-O 2.67Å; A362-Y371 PolarHBondContact O-N 2.8Å; L364-Y371 HydrophobicContact CB-CD2 3.79Å; L364-Y371 HydrophobicContact CB-CE2 3.58Å; L364-Y371 HydrophobicContact CD2-CE2 4.11Å; L364-Y371 HydrophobicContact CG-CE2 4.49Å; N367-Y371 PolarHBondContact ND2-OH 2.91Å; S369-Y371 WeakPolarHBondContact CB-OH 3.37Å; S369-Y371 WeakPolarHBondContact O-CD2 3.21Å; S369-Y371 WeakPolarHBondContact O-CE2 3.5Å; Y371-F388 HydrophobicContact CD2-CE1 4.44Å; Y371-F388 HydrophobicContact CG-CD1 4.33Å; Y371-F388 HydrophobicContact CG-CE1 4.47Å; Y371-F391 HydrophobicContact CD1-CD2 4.04Å; Y371-F391 AromaticContact CD1-CE2 3.5Å; Y371-F391 HydrophobicContact CD1-CE2 3.5Å; Y371-F391 VanDerWaalsContact CD1-CE2 3.5Å; Y371-F391 HydrophobicContact CD1-CZ 4.28Å; Y371-F391 HydrophobicContact CE1-CD2 4.34Å; Y371-F391 AromaticContact CE1-CE2 3.6Å; Y371-F391 HydrophobicContact CE1-CE2 3.6Å; Y371-F391 AromaticContact CE1-CZ 3.91Å; Y371-F391 HydrophobicContact CE1-CZ 3.91Å
372	R	98.2	Very high	93.4	Very high	2 Å²	2	51.1 Å²	51.1	1%	0.008	30%	0.301	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.7	130.1	167.2	-56.3	-168.4	-64.1	177.3	3.6	108.4	M340 V389 D390 L405 F409 L412 P413	M340-R372 HydrophobicContact CE-CG 3.88Å; M340-R372 HydrophobicContact SD-CG 3.54Å; M340-R372 VanDerWaalsContact SD-CG 3.54Å; R372-V389 HydrophobicContact CB-CG2 3.6Å; R372-V389 PolarHBondContact O-N 2.96Å; R372-D390 IonicContact CZ-OD1 3.43Å; R372-D390 IonicContact CZ-OD2 3.51Å; R372-D390 IonicContact NE-OD1 3.24Å; R372-D390 IonicContact NE-OD2 3.26Å; R372-D390 PolarHBondContact NE-OD2 2.91Å; R372-D390 VanDerWaalsContact NH2-CG 3.32Å; R372-D390 IonicContact NH2-OD1 3.12Å; R372-D390 PolarHBondContact NH2-OD1 3.46Å; R372-D390 IonicContact NH2-OD2 3.66Å; R372-D390 PolarHBondContact NH2-OD2 3.41Å; R372-D390 VanDerWaalsContact NH2-OD2 3.12Å; R372-L405 HydrophobicContact CB-CD2 4.24Å; R372-L405 HydrophobicContact CG-CD1 4.25Å; R372-L405 HydrophobicContact CG-CD2 3.82Å; R372-F409 VanDerWaalsContact CD-O 3.31Å; R372-F409 WeakPolarHBondContact CD-O 3.47Å; R372-F409 PolarHBondContact NH1-O 3.03Å; R372-L412 VanDerWaalsContact CZ-O 3.31Å; R372-L412 PolarHBondContact NH1-O 2.72Å; R372-L412 PolarHBondContact NH2-O 2.79Å; R372-P413 PolarHBondContact NH2-O 2.94Å
373	A	97.6	Very high	93.4	Very high	0 Å²	0	52.9 Å²	52.9	0%	0	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.7	144.4	178	0	0	0	0	0	110.6	I359 V360 A362 L386 Y387 F388	I359-A373 CarbonylContact C-O 3.58Å; I359-A373 WeakPolarHBondContact CA-O 3.34Å; V360-A373 HydrophobicContact CG2-CB 4.17Å; V360-A373 WeakPolarHBondContact CG2-O 3.42Å; V360-A373 PolarHBondContact N-O 3.03Å; V360-A373 PolarHBondContact O-N 3.32Å; A362-A373 HydrophobicContact CB-CB 3.87Å; A373-L386 HydrophobicContact CB-CB 4.14Å; A373-L386 HydrophobicContact CB-CD1 4.47Å; A373-L386 HydrophobicContact CB-CD2 4.26Å; A373-Y387 CarbonylContact C-O 3.54Å; A373-Y387 VanDerWaalsContact CA-O 3.32Å; A373-Y387 WeakPolarHBondContact CA-O 3.42Å; A373-F388 HydrophobicContact CB-CD1 4.12Å; A373-F388 HydrophobicContact CB-CE1 4.25Å
374	R	97.9	Very high	93.4	Very high	83 Å²	83	52.4 Å²	52.4	31%	0.313	31%	0.306	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	130.9	166.2	179.5	-174.2	-66.7	153.1	-0.4	108.6	D358 I359 L376 L386 Y387 V389	D358-R374 WeakPolarHBondContact O-CA 3.42Å; I359-R374 HydrophobicContact CD1-CB 3.78Å; I359-R374 HydrophobicContact CD1-CG 3.98Å; R374-L376 PolarHBondContact O-N 3.12Å; R374-L386 WeakPolarHBondContact O-CA 3.23Å; R374-Y387 HydrophobicContact CB-CD1 4.41Å; R374-Y387 PolarHBondContact N-O 3.38Å; R374-Y387 PolarHBondContact O-N 3.18Å; R374-V389 HydrophobicContact CB-CG1 3.89Å
375	V	97.6	Very high	93.8	Very high	3 Å²	3	53.3 Å²	53.3	2%	0.018	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	121.9	171.9	-179.6	0	0	0	0	109.6	V354 G357 D358 V360 L384 L386	V354-V375 HydrophobicContact CB-CG2 4.39Å; G357-V375 PolarHBondContact N-O 2.8Å; D358-V375 PolarHBondContact O-N 3.25Å; V360-V375 HydrophobicContact CG1-CG2 4.21Å; V360-V375 HydrophobicContact CG2-CG2 4.02Å; V375-L384 HydrophobicContact CG1-CD2 4.27Å; V375-L386 HydrophobicContact CG2-CD2 4.09Å
376	L	95.6	Very high	94.4	Very high	62 Å²	62	48 Å²	48	33%	0.325	28%	0.276	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.5	-34	176.9	-60.8	-173.7	0	0	0	112.5	V356 R374 D385 N394	V356-L376 VanDerWaalsContact CG1-O 3.28Å; V356-L376 WeakPolarHBondContact CG1-O 3.41Å; V356-L376 WeakPolarHBondContact CG2-O 3.33Å; R374-L376 PolarHBondContact O-N 3.12Å; L376-D385 HydrophobicContact CB-CB 4.1Å; L376-D385 WeakPolarHBondContact CB-OD2 3.16Å; L376-D385 WeakPolarHBondContact CD1-OD2 3.23Å; L376-D385 PolarHBondContact N-O 2.72Å; L376-N394 WeakPolarHBondContact CD1-ND2 2.98Å
377	G	95.7	Very high	95.1	Very high	17 Å²	17	43.4 Å²	43.4	18%	0.175	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	170.1	-158.9	-175.9	0	0	0	0	0	112.8	L384 D385	G377-L384 WeakPolarHBondContact O-CA 3.46Å; G377-L384 WeakPolarHBondContact O-CD2 3.36Å; G377-D385 PolarHBondContact O-N 2.87Å
378	T	96.4	Very high	95.7	Very high	101 Å²	101	41.8 Å²	41.8	62%	0.62	24%	0.237	S	C	*	.	E	Extended strand (participates in β ladder)	trans	-124.3	128.9	175.5	-47	0	0	0	0	109	N383	T378-N383 WeakPolarHBondContact CA-O 3.36Å; T378-N383 WeakPolarHBondContact CG2-O 3.47Å
379	L	94.9	Very high	96.2	Very high	53 Å²	53	40.1 Å²	40.1	28%	0.277	22%	0.22	S	C	.	.			trans	-80.1	163.7	177.6	-61.3	179.5	0	0	0	111.4	W237 N381 G382 N383 D385 D396	W237-L379 HydrophobicContact CZ2-CD1 4.25Å; L379-N381 WeakPolarHBondContact CB-OD1 3.48Å; L379-N381 PolarHBondContact O-N 3.28Å; L379-N381 VanDerWaalsContact O-N 3.12Å; L379-G382 PolarHBondContact O-N 3.17Å; L379-N383 PolarHBondContact N-O 3.27Å; L379-D385 HydrophobicContact CD2-CB 3.93Å; L379-D385 HydrophobicContact CG-CB 4.05Å; L379-D396 HydrophobicContact CD1-CB 3.63Å
380	E	94.8	Very high	96.3	Very high	200 Å²	200	39 Å²	39	94%	0.935	21%	0.212	S	C	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-26	179.3	-58.9	-170.3	158.1	0	0	113.8	G382	E380-G382 PolarHBondContact O-N 3.09Å
381	N	93.5	Very high	96.2	Very high	91 Å²	91	38.8 Å²	38.8	49%	0.487	21%	0.211	S	C	.	.	T	Hydrogen-bonded Turn	trans	-76.6	-6.7	176.4	67.9	4.1	0	0	0	113.6	L379 N383 D396	L379-N381 WeakPolarHBondContact CB-OD1 3.48Å; L379-N381 PolarHBondContact O-N 3.28Å; L379-N381 VanDerWaalsContact O-N 3.12Å; N381-N383 VanDerWaalsContact OD1-CB 3.28Å; N381-N383 WeakPolarHBondContact OD1-CB 3.37Å; N381-N383 PolarHBondContact OD1-N 3.34Å; N381-D396 PolarHBondContact ND2-OD2 3.28Å
382	G	93.8	Very high	96.1	Very high	52 Å²	52	38.1 Å²	38.1	54%	0.536	21%	0.209	S	C	.	.	S	Bend	trans	85.9	-0.3	-177	0	0	0	0	0	115.4	L379 E380	L379-G382 PolarHBondContact O-N 3.17Å; E380-G382 PolarHBondContact O-N 3.09Å
383	N	96.3	Very high	95.9	Very high	37 Å²	37	39.5 Å²	39.5	20%	0.198	22%	0.216	C	C	.	.	P	Polyproline II helix	trans	-76.7	158.8	168.7	-68.1	-10.2	0	0	0	110.5	T378 L379 N381 D396 P398	T378-N383 WeakPolarHBondContact CA-O 3.36Å; T378-N383 WeakPolarHBondContact CG2-O 3.47Å; L379-N383 PolarHBondContact N-O 3.27Å; N381-N383 VanDerWaalsContact OD1-CB 3.28Å; N381-N383 WeakPolarHBondContact OD1-CB 3.37Å; N381-N383 PolarHBondContact OD1-N 3.34Å; N383-D396 HydrophobicContact CB-CB 4.1Å; N383-D396 WeakPolarHBondContact CB-OD2 3.43Å; N383-D396 PolarHBondContact ND2-OD2 3.02Å; N383-P398 WeakPolarHBondContact OD1-CG 3.48Å
384	L	96.9	Very high	95.6	Very high	15 Å²	15	43.7 Å²	43.7	8%	0.079	24%	0.239	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.9	136.2	172.6	-66.3	164.6	0	0	0	109.6	V354 V375 G377 L386 D396 C397 L399 L402	V354-L384 HydrophobicContact CG2-CD1 3.71Å; V354-L384 HydrophobicContact CG2-CD2 4.34Å; V375-L384 HydrophobicContact CG1-CD2 4.27Å; G377-L384 WeakPolarHBondContact O-CA 3.46Å; G377-L384 WeakPolarHBondContact O-CD2 3.36Å; L384-L386 HydrophobicContact CB-CD2 4.39Å; L384-D396 VanDerWaalsContact O-CA 3.22Å; L384-D396 WeakPolarHBondContact O-CA 3.3Å; L384-D396 WeakPolarHBondContact O-CB 3.46Å; L384-C397 PolarHBondContact N-O 3.27Å; L384-C397 PolarHBondContact O-N 3.24Å; L384-L399 HydrophobicContact CD1-CB 3.98Å; L384-L399 HydrophobicContact CD1-CD1 3.91Å; L384-L402 HydrophobicContact CD1-CD1 3.46Å; L384-L402 VanDerWaalsContact CD1-CD1 3.46Å
385	D	97	Very high	95.3	Very high	42 Å²	42	40.8 Å²	40.8	23%	0.225	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	133	171.9	-177.2	20.8	0	0	0	109.3	L376 G377 L379	L376-D385 HydrophobicContact CB-CB 4.1Å; L376-D385 WeakPolarHBondContact CB-OD2 3.16Å; L376-D385 WeakPolarHBondContact CD1-OD2 3.23Å; L376-D385 PolarHBondContact N-O 2.72Å; G377-D385 PolarHBondContact O-N 2.87Å; L379-D385 HydrophobicContact CD2-CB 3.93Å; L379-D385 HydrophobicContact CG-CB 4.05Å
386	L	96.4	Very high	95.2	Very high	2 Å²	2	42.4 Å²	42.4	1%	0.01	24%	0.244	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-133.7	134.4	-167	-59	175.2	0	0	0	111.4	V360 A362 A373 R374 V375 L384 N394 G395 C397 L402	V360-L386 HydrophobicContact CG2-CD2 4.38Å; A362-L386 HydrophobicContact CB-CD1 3.9Å; A373-L386 HydrophobicContact CB-CB 4.14Å; A373-L386 HydrophobicContact CB-CD1 4.47Å; A373-L386 HydrophobicContact CB-CD2 4.26Å; R374-L386 WeakPolarHBondContact O-CA 3.23Å; V375-L386 HydrophobicContact CG2-CD2 4.09Å; L384-L386 HydrophobicContact CB-CD2 4.39Å; L386-N394 CarbonylContact O-C 3.57Å; L386-N394 WeakPolarHBondContact O-CA 3.33Å; L386-G395 WeakPolarHBondContact CA-O 3.5Å; L386-G395 VanDerWaalsContact CB-O 3.31Å; L386-G395 WeakPolarHBondContact CB-O 3.28Å; L386-G395 PolarHBondContact N-O 3.25Å; L386-G395 PolarHBondContact O-N 2.99Å; L386-C397 HydrophobicContact CD1-CB 4.48Å; L386-L402 HydrophobicContact CD1-CD2 4.09Å; L386-L402 HydrophobicContact CD2-CD2 4.42Å
387	Y	96.1	Very high	95.1	Very high	20 Å²	20	39.8 Å²	39.8	8%	0.078	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-107.6	118.5	170.6	170.8	-112.2	0	0	0	110.4	W322 A373 R374 V389 E418	W322-Y387 HydrophobicContact CZ2-CE2 4.26Å; W322-Y387 AromaticContact NE1-CE2 3.69Å; W322-Y387 AromaticContact NE1-CZ 3.74Å; W322-Y387 PolarHBondContact NE1-OH 3.31Å; A373-Y387 CarbonylContact C-O 3.54Å; A373-Y387 VanDerWaalsContact CA-O 3.32Å; A373-Y387 WeakPolarHBondContact CA-O 3.42Å; R374-Y387 HydrophobicContact CB-CD1 4.41Å; R374-Y387 PolarHBondContact N-O 3.38Å; R374-Y387 PolarHBondContact O-N 3.18Å; Y387-V389 HydrophobicContact CD1-CG1 3.85Å; Y387-V389 HydrophobicContact CE1-CG1 4.14Å; Y387-V389 PolarHBondContact O-N 3.11Å; Y387-E418 PolarHBondContact OH-OE1 3.24Å
388	F	96.7	Very high	95.1	Very high	4 Å²	4	40.7 Å²	40.7	2%	0.018	23%	0.233	C	C	.	.			trans	-78.8	89.6	-179.5	-66.8	-71	0	0	0	110.7	A362 L364 Y371 A373 D390 F391 G392 D393	A362-F388 HydrophobicContact CB-CE1 4.25Å; L364-F388 HydrophobicContact CD1-CE2 3.98Å; L364-F388 HydrophobicContact CD1-CZ 3.94Å; Y371-F388 HydrophobicContact CD2-CE1 4.44Å; Y371-F388 HydrophobicContact CG-CD1 4.33Å; Y371-F388 HydrophobicContact CG-CE1 4.47Å; A373-F388 HydrophobicContact CB-CD1 4.12Å; A373-F388 HydrophobicContact CB-CE1 4.25Å; F388-D390 PolarHBondContact O-N 3.17Å; F388-F391 HydrophobicContact CB-CB 4.36Å; F388-F391 PolarHBondContact O-N 3.19Å; F388-G392 PolarHBondContact O-N 2.88Å; F388-D393 WeakPolarHBondContact CB-O 3.37Å; F388-D393 WeakPolarHBondContact CD2-O 3.35Å; F388-D393 PolarHBondContact N-O 3.42Å
389	V	96.4	Very high	95.1	Very high	2 Å²	2	39.4 Å²	39.4	1%	0.012	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-53	-16.9	-171.5	-63.3	0	0	0	0	116.8	R372 R374 Y387 F414 A416	R372-V389 HydrophobicContact CB-CG2 3.6Å; R372-V389 PolarHBondContact O-N 2.96Å; R374-V389 HydrophobicContact CB-CG1 3.89Å; Y387-V389 HydrophobicContact CD1-CG1 3.85Å; Y387-V389 HydrophobicContact CE1-CG1 4.14Å; Y387-V389 PolarHBondContact O-N 3.11Å; V389-F414 HydrophobicContact CB-CB 4.37Å; V389-F414 HydrophobicContact CB-CD1 3.57Å; V389-F414 HydrophobicContact CB-CD2 4.39Å; V389-F414 HydrophobicContact CB-CE1 3.84Å; V389-F414 HydrophobicContact CB-CG 3.87Å; V389-F414 HydrophobicContact CB-CZ 4.33Å; V389-F414 HydrophobicContact CG1-CD1 4.3Å; V389-F414 HydrophobicContact CG1-CE1 4.12Å; V389-F414 HydrophobicContact CG1-CE2 4.46Å; V389-F414 HydrophobicContact CG1-CZ 4.18Å; V389-F414 HydrophobicContact CG2-CD1 3.39Å; V389-F414 HydrophobicContact CG2-CE1 3.51Å; V389-F414 HydrophobicContact CG2-CG 4.21Å; V389-F414 HydrophobicContact CG2-CZ 4.37Å; V389-A416 WeakPolarHBondContact O-CB 3.49Å; V389-A416 PolarHBondContact O-N 2.75Å
390	D	96.7	Very high	95	Very high	3 Å²	3	42.8 Å²	42.8	2%	0.016	23%	0.234	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.7	-10.5	176.4	-69.6	-50.6	0	0	0	114.4	Q324 L333 R372 F388 Q415	Q324-D390 PolarHBondContact NE2-O 2.91Å; L333-D390 HydrophobicContact CD1-CB 3.61Å; L333-D390 HydrophobicContact CD2-CB 4.25Å; R372-D390 IonicContact CZ-OD1 3.43Å; R372-D390 IonicContact CZ-OD2 3.51Å; R372-D390 IonicContact NE-OD1 3.24Å; R372-D390 IonicContact NE-OD2 3.26Å; R372-D390 PolarHBondContact NE-OD2 2.91Å; R372-D390 VanDerWaalsContact NH2-CG 3.32Å; R372-D390 IonicContact NH2-OD1 3.12Å; R372-D390 PolarHBondContact NH2-OD1 3.46Å; R372-D390 IonicContact NH2-OD2 3.66Å; R372-D390 PolarHBondContact NH2-OD2 3.41Å; R372-D390 VanDerWaalsContact NH2-OD2 3.12Å; F388-D390 PolarHBondContact O-N 3.17Å; D390-Q415 HydrophobicContact CB-CB 4.1Å; D390-Q415 WeakPolarHBondContact OD1-CG 3.35Å; D390-Q415 PolarHBondContact OD1-N 3.03Å
391	F	95.2	Very high	95.1	Very high	11 Å²	11	35.5 Å²	35.5	5%	0.048	20%	0.202	C	C	.	.	T	Hydrogen-bonded Turn	trans	-126.7	-30.5	-172.3	-67.6	-83.1	0	0	0	113.5	R214 S313 A314 Q324 L333 V337 Y371 F388 D393 W448	R214-F391 VanDerWaalsContact CD-CD1 3.48Å; S313-F391 CarbonylContact C-O 3.55Å; S313-F391 VanDerWaalsContact CB-O 3.23Å; S313-F391 WeakPolarHBondContact CB-O 3.5Å; S313-F391 PolarHBondContact OG-O 3.07Å; A314-F391 WeakPolarHBondContact CB-O 3.39Å; Q324-F391 VanDerWaalsContact NE2-CD1 3.25Å; L333-F391 HydrophobicContact CD1-CE2 4.27Å; L333-F391 HydrophobicContact CD1-CZ 4.41Å; L333-F391 HydrophobicContact CD2-CE1 4.22Å; L333-F391 HydrophobicContact CD2-CE2 4.27Å; L333-F391 HydrophobicContact CD2-CZ 3.83Å; L333-F391 HydrophobicContact CG-CZ 4.23Å; V337-F391 HydrophobicContact CG2-CE2 4.28Å; V337-F391 HydrophobicContact CG2-CZ 4.28Å; Y371-F391 HydrophobicContact CD1-CD2 4.04Å; Y371-F391 AromaticContact CD1-CE2 3.5Å; Y371-F391 HydrophobicContact CD1-CE2 3.5Å; Y371-F391 VanDerWaalsContact CD1-CE2 3.5Å; Y371-F391 HydrophobicContact CD1-CZ 4.28Å; Y371-F391 HydrophobicContact CE1-CD2 4.34Å; Y371-F391 AromaticContact CE1-CE2 3.6Å; Y371-F391 HydrophobicContact CE1-CE2 3.6Å; Y371-F391 AromaticContact CE1-CZ 3.91Å; Y371-F391 HydrophobicContact CE1-CZ 3.91Å; F388-F391 HydrophobicContact CB-CB 4.36Å; F388-F391 PolarHBondContact O-N 3.19Å; F391-D393 WeakPolarHBondContact CB-OD1 3.4Å; F391-W448 AromaticContact CD1-CH2 3.69Å; F391-W448 HydrophobicContact CD1-CH2 3.69Å; F391-W448 HydrophobicContact CD1-CZ3 4.29Å; F391-W448 AromaticContact CE1-CH2 3.66Å; F391-W448 HydrophobicContact CE1-CH2 3.66Å; F391-W448 HydrophobicContact CE1-CZ2 4.44Å; F391-W448 HydrophobicContact CE1-CZ3 4.23Å
392	G	94.2	Very high	95.2	Very high	1 Å²	1	31.2 Å²	31.2	1%	0.01	18%	0.179	C	C	.	.			trans	87.6	0.2	176.7	0	0	0	0	0	114.7	F388	F388-G392 PolarHBondContact O-N 2.88Å
393	D	93.4	Very high	95.3	Very high	31 Å²	31	29.4 Å²	29.4	17%	0.166	16%	0.156	C	C	.	.			trans	-88.8	155.6	172.2	60.6	-46.7	0	0	0	112.2	R214 A314 F388 F391	R214-D393 IonicContact CZ-OD1 3.02Å; R214-D393 IonicContact CZ-OD2 2.82Å; R214-D393 VanDerWaalsContact NE-CG 3.29Å; R214-D393 IonicContact NE-OD1 2.71Å; R214-D393 PolarHBondContact NE-OD1 3.26Å; R214-D393 IonicContact NE-OD2 2.74Å; R214-D393 PolarHBondContact NE-OD2 3.47Å; R214-D393 IonicContact NH2-OD1 3.2Å; R214-D393 PolarHBondContact NH2-OD1 2.97Å; R214-D393 IonicContact NH2-OD2 3.33Å; R214-D393 PolarHBondContact NH2-OD2 3.28Å; A314-D393 HydrophobicContact CB-CB 4.2Å; F388-D393 WeakPolarHBondContact CB-O 3.37Å; F388-D393 WeakPolarHBondContact CD2-O 3.35Å; F388-D393 PolarHBondContact N-O 3.42Å; F391-D393 WeakPolarHBondContact CB-OD1 3.4Å
394	N	92.4	Very high	95.4	Very high	87 Å²	87	29.9 Å²	29.9	47%	0.465	17%	0.165	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-95.7	162.9	173.1	-75.1	38.6	0	0	0	111.6	L376 L386	L376-N394 WeakPolarHBondContact CD1-ND2 2.98Å; L386-N394 CarbonylContact O-C 3.57Å; L386-N394 WeakPolarHBondContact O-CA 3.33Å
395	G	91.9	Very high	95.4	Very high	23 Å²	23	30.4 Å²	30.4	24%	0.237	17%	0.168	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-165.7	-177	166	0	0	0	0	0	110.7	L386	L386-G395 WeakPolarHBondContact CA-O 3.5Å; L386-G395 VanDerWaalsContact CB-O 3.31Å; L386-G395 WeakPolarHBondContact CB-O 3.28Å; L386-G395 PolarHBondContact N-O 3.25Å; L386-G395 PolarHBondContact O-N 2.99Å
396	D	94.8	Very high	95.3	Very high	37 Å²	37	32.6 Å²	32.6	20%	0.198	17%	0.173	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	152.8	178	75.5	-46.1	0	0	0	112.6	W237 L379 N381 N383 L384	W237-D396 WeakPolarHBondContact CH2-OD1 3.45Å; W237-D396 WeakPolarHBondContact CH2-OD2 3.4Å; L379-D396 HydrophobicContact CD1-CB 3.63Å; N381-D396 PolarHBondContact ND2-OD2 3.28Å; N383-D396 HydrophobicContact CB-CB 4.1Å; N383-D396 WeakPolarHBondContact CB-OD2 3.43Å; N383-D396 PolarHBondContact ND2-OD2 3.02Å; L384-D396 VanDerWaalsContact O-CA 3.22Å; L384-D396 WeakPolarHBondContact O-CA 3.3Å; L384-D396 WeakPolarHBondContact O-CB 3.46Å
397	C	94.3	Very high	95.3	Very high	6 Å²	6	37 Å²	37	4%	0.041	20%	0.204	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-153.7	160.4	164.7	82	0	0	0	0	113	L384 L386 L402	L384-C397 PolarHBondContact N-O 3.27Å; L384-C397 PolarHBondContact O-N 3.24Å; L386-C397 HydrophobicContact CD1-CB 4.48Å; C397-L402 WeakPolarHBondContact SG-CD2 3.35Å
398	P	95.4	Very high	95.3	Very high	36 Å²	36	39.7 Å²	39.7	23%	0.234	22%	0.22	C	C	.	.			trans	-61.6	144.7	168	-20.8	31.6	0	0	0	112.2	N383 K400 D401	N383-P398 WeakPolarHBondContact OD1-CG 3.48Å; P398-K400 VanDerWaalsContact C-N 3.25Å; P398-K400 HydrophobicContact CB-CD 4.4Å; P398-K400 HydrophobicContact CB-CG 3.73Å; P398-K400 PolarHBondContact O-N 2.82Å; P398-K400 VanDerWaalsContact O-N 3.16Å; P398-D401 WeakPolarHBondContact CD-OD2 3.36Å; P398-D401 WeakPolarHBondContact CG-OD2 3.36Å; P398-D401 PolarHBondContact O-N 3.25Å
399	L	95.5	Very high	95.3	Very high	74 Å²	74	39.7 Å²	39.7	39%	0.387	22%	0.22	S	C	.	.	G	3₁₀ helix	trans	-51.6	-39.7	177.5	174.4	59.1	0	0	0	113.7	L352 V354 L384 D401 L402	L352-L399 HydrophobicContact CB-CD1 4.41Å; L352-L399 HydrophobicContact CD2-CD1 4.39Å; V354-L399 HydrophobicContact CG1-CD1 4Å; V354-L399 HydrophobicContact CG2-CD1 3.88Å; L384-L399 HydrophobicContact CD1-CB 3.98Å; L384-L399 HydrophobicContact CD1-CD1 3.91Å; L399-D401 PolarHBondContact O-N 3.28Å; L399-L402 HydrophobicContact CD1-CD1 4.31Å; L399-L402 WeakPolarHBondContact O-CB 3.49Å; L399-L402 PolarHBondContact O-N 3.17Å; L399-L402 VanDerWaalsContact O-N 3.1Å
400	K	94.3	Very high	95.3	Very high	124 Å²	124	41.7 Å²	41.7	54%	0.539	23%	0.23	S	C	.	.	G	3₁₀ helix	trans	-57.7	-19.6	177.1	56.8	162.3	-173	82.6	0	114.8	P398 R403	P398-K400 VanDerWaalsContact C-N 3.25Å; P398-K400 HydrophobicContact CB-CD 4.4Å; P398-K400 HydrophobicContact CB-CG 3.73Å; P398-K400 PolarHBondContact O-N 2.82Å; P398-K400 VanDerWaalsContact O-N 3.16Å; K400-R403 PolarHBondContact O-NH1 2.72Å
401	D	95.1	Very high	95.1	Very high	47 Å²	47	46.2 Å²	46.2	25%	0.251	26%	0.262	S	S	.	.	G	3₁₀ helix	trans	-99.4	-8.1	-176.5	-55.8	-34.3	0	0	0	111.9	P363 W370 P398 L399	P363-D401 VanDerWaalsContact CD-O 3.3Å; P363-D401 WeakPolarHBondContact CD-O 3.41Å; P363-D401 HydrophobicContact CG-CB 4.44Å; W370-D401 VanDerWaalsContact CH2-O 3.24Å; W370-D401 WeakPolarHBondContact CH2-O 3.32Å; P398-D401 WeakPolarHBondContact CD-OD2 3.36Å; P398-D401 WeakPolarHBondContact CG-OD2 3.36Å; P398-D401 PolarHBondContact O-N 3.25Å; L399-D401 PolarHBondContact O-N 3.28Å
402	L	96.1	Very high	95.1	Very high	1 Å²	1	46.7 Å²	46.7	1%	0.005	27%	0.265	C	S	.	.			trans	-80.9	159.9	169.9	-65.4	179.6	0	0	0	112.5	L352 V360 A362 L384 L386 C397 L399	L352-L402 HydrophobicContact CD2-CB 3.89Å; V360-L402 HydrophobicContact CB-CD2 4.45Å; V360-L402 HydrophobicContact CG2-CD1 4.14Å; V360-L402 HydrophobicContact CG2-CD2 3.81Å; A362-L402 HydrophobicContact CB-CD2 3.55Å; L384-L402 HydrophobicContact CD1-CD1 3.46Å; L384-L402 VanDerWaalsContact CD1-CD1 3.46Å; L386-L402 HydrophobicContact CD1-CD2 4.09Å; L386-L402 HydrophobicContact CD2-CD2 4.42Å; C397-L402 WeakPolarHBondContact SG-CD2 3.35Å; L399-L402 HydrophobicContact CD1-CD1 4.31Å; L399-L402 WeakPolarHBondContact O-CB 3.49Å; L399-L402 PolarHBondContact O-N 3.17Å; L399-L402 VanDerWaalsContact O-N 3.1Å
403	R	97.1	Very high	95.1	Very high	14 Å²	14	48.8 Å²	48.8	5%	0.053	28%	0.278	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	155.6	170.9	-55.8	-68.9	179.3	-91.8	-3	111.1	Y344 S347 V348 E350 A361 W370 K400 L405	Y344-R403 HydrophobicContact CD1-CB 3.72Å; Y344-R403 HydrophobicContact CD1-CG 3.78Å; Y344-R403 HydrophobicContact CE1-CB 3.61Å; Y344-R403 HydrophobicContact CE1-CG 4.2Å; S347-R403 PolarHBondContact O-NH2 2.68Å; S347-R403 PolarHBondContact OG-NE 2.76Å; V348-R403 PolarHBondContact O-NE 3.06Å; E350-R403 WeakPolarHBondContact OE2-CA 3.41Å; A361-R403 HydrophobicContact CB-CB 4.28Å; A361-R403 PolarHBondContact N-O 3.38Å; A361-R403 PolarHBondContact O-N 3.47Å; W370-R403 HydrophobicContact CH2-CG 3.77Å; W370-R403 HydrophobicContact CZ3-CB 4.28Å; W370-R403 HydrophobicContact CZ3-CG 3.69Å; K400-R403 PolarHBondContact O-NH1 2.72Å; R403-L405 PolarHBondContact O-N 3.32Å
404	A	96.6	Very high	95.2	Very high	48 Å²	48	48.3 Å²	48.3	40%	0.397	28%	0.275	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	130	169.7	0	0	0	0	0	110.4	Y344 E350 L352 R406	Y344-A404 PolarHBondContact OH-O 3.46Å; E350-A404 PolarHBondContact OE2-N 2.9Å; L352-A404 HydrophobicContact CD1-CB 4.01Å; A404-R406 PolarHBondContact O-N 2.94Å
405	L	97.3	Very high	95.3	Very high	25 Å²	25	44.5 Å²	44.5	13%	0.131	25%	0.254	C	S	.	.	P	Polyproline II helix	trans	-76.3	123.5	-179	-172.5	59	0	0	0	110.9	M340 Y344 I359 A361 R372 R403 F409 L410	M340-L405 HydrophobicContact CE-CD1 3.51Å; M340-L405 HydrophobicContact SD-CD1 4.19Å; Y344-L405 HydrophobicContact CE2-CD1 4.45Å; Y344-L405 WeakPolarHBondContact OH-CA 3.41Å; I359-L405 HydrophobicContact CG2-CD2 3.62Å; A361-L405 HydrophobicContact CB-CD1 3.99Å; R372-L405 HydrophobicContact CB-CD2 4.24Å; R372-L405 HydrophobicContact CG-CD1 4.25Å; R372-L405 HydrophobicContact CG-CD2 3.82Å; R403-L405 PolarHBondContact O-N 3.32Å; L405-F409 HydrophobicContact CD1-CB 3.8Å; L405-F409 HydrophobicContact CD1-CD2 3.98Å; L405-F409 HydrophobicContact CD1-CG 4.38Å; L405-F409 HydrophobicContact CG-CB 4.28Å; L405-L410 HydrophobicContact CD2-CD2 3.45Å; L405-L410 VanDerWaalsContact CD2-CD2 3.45Å; L405-L410 HydrophobicContact CG-CD2 4Å
406	R	96.2	Very high	95.5	Very high	89 Å²	89	43.9 Å²	43.9	34%	0.336	25%	0.247	S	C	.	.	P	Polyproline II helix	trans	-65.5	136.6	-179.7	-153.2	175.6	69	-151.9	4.5	110.3	H343 Y344 A404 D408 F409	H343-R406 PolarHBondContact CD2-NH1 2.86Å; H343-R406 PolarHBondContact CE1-NH1 2.76Å; H343-R406 PolarHBondContact ND1-NH1 2.84Å; H343-R406 PolarHBondContact NE2-NH1 2.9Å; Y344-R406 PolarHBondContact OH-N 3.43Å; A404-R406 PolarHBondContact O-N 2.94Å; R406-D408 VanDerWaalsContact C-N 3.3Å; R406-D408 WeakPolarHBondContact CB-OD1 3.48Å; R406-D408 VanDerWaalsContact CG-OD1 3.26Å; R406-D408 WeakPolarHBondContact CG-OD1 3.43Å; R406-D408 IonicContact CZ-OD1 3.56Å; R406-D408 IonicContact CZ-OD2 3.48Å; R406-D408 IonicContact NE-OD1 2.72Å; R406-D408 PolarHBondContact NE-OD1 3.21Å; R406-D408 IonicContact NE-OD2 3.39Å; R406-D408 PolarHBondContact NE-OD2 3.49Å; R406-D408 IonicContact NH2-OD1 3.56Å; R406-D408 IonicContact NH2-OD2 2.72Å; R406-D408 PolarHBondContact NH2-OD2 3.16Å; R406-D408 PolarHBondContact O-N 2.77Å; R406-F409 HydrophobicContact CB-CD2 3.66Å; R406-F409 HydrophobicContact CB-CE2 4.01Å; R406-F409 HydrophobicContact CB-CG 4.44Å; R406-F409 VanDerWaalsContact NH2-CZ 3.31Å; R406-F409 WeakPolarHBondContact O-CB 3.44Å; R406-F409 PolarHBondContact O-N 3.34Å
407	S	95.4	Very high	95.4	Very high	95 Å²	95	42.5 Å²	42.5	66%	0.664	24%	0.239	S	C	*	.	G	3₁₀ helix	trans	-64.4	-27.7	-166.4	51.5	0	0	0	0	114.9	F409 L410	S407-F409 VanDerWaalsContact C-N 3.32Å; S407-L410 VanDerWaalsContact O-CB 3.3Å; S407-L410 WeakPolarHBondContact O-CB 3.04Å; S407-L410 PolarHBondContact O-N 3.4Å
408	D	95.8	Very high	95.3	Very high	76 Å²	76	44.4 Å²	44.4	41%	0.406	25%	0.248	S	C	.	.	G	3₁₀ helix	trans	-69.4	-28.1	173.3	62.4	-43.3	0	0	0	112.7	R406 L410 S411	R406-D408 VanDerWaalsContact C-N 3.3Å; R406-D408 WeakPolarHBondContact CB-OD1 3.48Å; R406-D408 VanDerWaalsContact CG-OD1 3.26Å; R406-D408 WeakPolarHBondContact CG-OD1 3.43Å; R406-D408 IonicContact CZ-OD1 3.56Å; R406-D408 IonicContact CZ-OD2 3.48Å; R406-D408 IonicContact NE-OD1 2.72Å; R406-D408 PolarHBondContact NE-OD1 3.21Å; R406-D408 IonicContact NE-OD2 3.39Å; R406-D408 PolarHBondContact NE-OD2 3.49Å; R406-D408 IonicContact NH2-OD1 3.56Å; R406-D408 IonicContact NH2-OD2 2.72Å; R406-D408 PolarHBondContact NH2-OD2 3.16Å; R406-D408 PolarHBondContact O-N 2.77Å; D408-L410 PolarHBondContact O-N 3.44Å; D408-S411 WeakPolarHBondContact O-CB 3.48Å; D408-S411 PolarHBondContact O-N 3.48Å; D408-S411 PolarHBondContact O-OG 3.3Å
409	F	97.5	Very high	95.3	Very high	4 Å²	4	42.7 Å²	42.7	2%	0.018	24%	0.237	C	C	.	.	G	3₁₀ helix	trans	-70.4	-7.8	171.6	-61.3	-37.2	0	0	0	113.3	L336 E339 M340 H343 Y344 R372 L405 R406 S407	L336-F409 HydrophobicContact CD1-CB 3.88Å; L336-F409 HydrophobicContact CD1-CD1 3.41Å; L336-F409 VanDerWaalsContact CD1-CD1 3.41Å; L336-F409 HydrophobicContact CD1-CE1 4.19Å; L336-F409 HydrophobicContact CD1-CG 3.92Å; E339-F409 HydrophobicContact CB-CE1 3.94Å; E339-F409 HydrophobicContact CB-CZ 4.36Å; M340-F409 HydrophobicContact CB-CE2 4.41Å; M340-F409 HydrophobicContact CB-CZ 4.43Å; M340-F409 HydrophobicContact CG-CB 4.45Å; M340-F409 HydrophobicContact CG-CD1 3.96Å; M340-F409 HydrophobicContact CG-CD2 3.65Å; M340-F409 HydrophobicContact CG-CE1 3.98Å; M340-F409 HydrophobicContact CG-CE2 3.67Å; M340-F409 HydrophobicContact CG-CG 3.79Å; M340-F409 HydrophobicContact CG-CZ 3.83Å; M340-F409 HydrophobicContact SD-CB 4.42Å; M340-F409 HydrophobicContact SD-CD2 4.44Å; M340-F409 HydrophobicContact SD-CG 4.38Å; H343-F409 HydrophobicContact CB-CE2 4.33Å; H343-F409 HydrophobicContact CB-CZ 4.24Å; H343-F409 AromaticContact CD2-CE2 3.87Å; Y344-F409 HydrophobicContact CD2-CE2 4.47Å; Y344-F409 AromaticContact CE2-CD2 3.96Å; Y344-F409 HydrophobicContact CE2-CD2 3.96Å; Y344-F409 AromaticContact CE2-CE2 3.66Å; Y344-F409 HydrophobicContact CE2-CE2 3.66Å; R372-F409 VanDerWaalsContact CD-O 3.31Å; R372-F409 WeakPolarHBondContact CD-O 3.47Å; R372-F409 PolarHBondContact NH1-O 3.03Å; L405-F409 HydrophobicContact CD1-CB 3.8Å; L405-F409 HydrophobicContact CD1-CD2 3.98Å; L405-F409 HydrophobicContact CD1-CG 4.38Å; L405-F409 HydrophobicContact CG-CB 4.28Å; R406-F409 HydrophobicContact CB-CD2 3.66Å; R406-F409 HydrophobicContact CB-CE2 4.01Å; R406-F409 HydrophobicContact CB-CG 4.44Å; R406-F409 VanDerWaalsContact NH2-CZ 3.31Å; R406-F409 WeakPolarHBondContact O-CB 3.44Å; R406-F409 PolarHBondContact O-N 3.34Å; S407-F409 VanDerWaalsContact C-N 3.32Å
410	L	95.2	Very high	95.2	Very high	44 Å²	44	40.2 Å²	40.2	23%	0.23	23%	0.225	C	C	.	.	G	3₁₀ helix	trans	-82.1	-12.9	168.9	-50.1	178.3	0	0	0	112.8	F293 I295 L405 S407 D408 L412	F293-L410 HydrophobicContact CE1-CD1 4.4Å; I295-L410 HydrophobicContact CD1-CB 4.32Å; I295-L410 HydrophobicContact CD1-CD2 3.84Å; I295-L410 HydrophobicContact CD1-CG 4.5Å; L405-L410 HydrophobicContact CD2-CD2 3.45Å; L405-L410 VanDerWaalsContact CD2-CD2 3.45Å; L405-L410 HydrophobicContact CG-CD2 4Å; S407-L410 VanDerWaalsContact O-CB 3.3Å; S407-L410 WeakPolarHBondContact O-CB 3.04Å; S407-L410 PolarHBondContact O-N 3.4Å; D408-L410 PolarHBondContact O-N 3.44Å; L410-L412 VanDerWaalsContact C-N 3.3Å; L410-L412 PolarHBondContact O-N 2.59Å
411	S	93.9	Very high	95.3	Very high	97 Å²	97	34.5 Å²	34.5	68%	0.678	20%	0.201	S	C	*	.	S	Bend	trans	-66.8	-25.4	-171.2	-49.2	0	0	0	0	114.7	D408	D408-S411 WeakPolarHBondContact O-CB 3.48Å; D408-S411 PolarHBondContact O-N 3.48Å; D408-S411 PolarHBondContact O-OG 3.3Å
412	L	94.2	Very high	95.3	Very high	21 Å²	21	32.5 Å²	32.5	11%	0.11	19%	0.191	C	C	.	.	S	Bend	trans	-86.2	126.2	172	-173.8	66.2	0	0	0	108	Q332 L333 L336 R372 L410 Q415	Q332-L412 HydrophobicContact CB-CD1 3.85Å; Q332-L412 HydrophobicContact CB-CD2 4.28Å; L333-L412 HydrophobicContact CB-CD2 4.26Å; L336-L412 HydrophobicContact CB-CD2 4.43Å; L336-L412 HydrophobicContact CD2-CB 4.28Å; L336-L412 HydrophobicContact CD2-CD2 3.83Å; R372-L412 VanDerWaalsContact CZ-O 3.31Å; R372-L412 PolarHBondContact NH1-O 2.72Å; R372-L412 PolarHBondContact NH2-O 2.79Å; L410-L412 VanDerWaalsContact C-N 3.3Å; L410-L412 PolarHBondContact O-N 2.59Å; L412-Q415 HydrophobicContact CD2-CG 4.05Å; L412-Q415 HydrophobicContact CG-CG 4.4Å
413	P	94.3	Very high	95.2	Very high	45 Å²	45	35 Å²	35	29%	0.292	20%	0.2	S	C	.	.	P	Polyproline II helix	trans	-54.8	163.3	171.8	-26.7	35.8	0	0	0	111.9	R372 Q415	R372-P413 PolarHBondContact NH2-O 2.94Å; P413-Q415 PolarHBondContact O-N 3.4Å; P413-Q415 PolarHBondContact O-NE2 3.41Å
414	F	95.1	Very high	95.2	Very high	22 Å²	22	34.7 Å²	34.7	10%	0.096	20%	0.199	C	C	.	.	P	Polyproline II helix	trans	-61.6	134.5	172.6	-61	-35.5	0	0	0	110.7	I295 I359 V389	I295-F414 HydrophobicContact CB-CD2 4.45Å; I295-F414 HydrophobicContact CB-CE1 4.37Å; I295-F414 HydrophobicContact CB-CE2 3.82Å; I295-F414 HydrophobicContact CB-CZ 3.79Å; I295-F414 HydrophobicContact CD1-CE1 3.89Å; I295-F414 HydrophobicContact CD1-CZ 3.67Å; I295-F414 HydrophobicContact CG1-CZ 4.14Å; I295-F414 HydrophobicContact CG2-CD1 4.35Å; I295-F414 HydrophobicContact CG2-CD2 4.33Å; I295-F414 HydrophobicContact CG2-CE1 4.12Å; I295-F414 HydrophobicContact CG2-CE2 4.11Å; I295-F414 HydrophobicContact CG2-CG 4.46Å; I295-F414 HydrophobicContact CG2-CZ 4.03Å; I359-F414 HydrophobicContact CD1-CZ 3.88Å; I359-F414 HydrophobicContact CG1-CZ 4.15Å; I359-F414 HydrophobicContact CG2-CE1 4.48Å; V389-F414 HydrophobicContact CB-CB 4.37Å; V389-F414 HydrophobicContact CB-CD1 3.57Å; V389-F414 HydrophobicContact CB-CD2 4.39Å; V389-F414 HydrophobicContact CB-CE1 3.84Å; V389-F414 HydrophobicContact CB-CG 3.87Å; V389-F414 HydrophobicContact CB-CZ 4.33Å; V389-F414 HydrophobicContact CG1-CD1 4.3Å; V389-F414 HydrophobicContact CG1-CE1 4.12Å; V389-F414 HydrophobicContact CG1-CE2 4.46Å; V389-F414 HydrophobicContact CG1-CZ 4.18Å; V389-F414 HydrophobicContact CG2-CD1 3.39Å; V389-F414 HydrophobicContact CG2-CE1 3.51Å; V389-F414 HydrophobicContact CG2-CG 4.21Å; V389-F414 HydrophobicContact CG2-CZ 4.37Å
415	Q	95.8	Very high	95.2	Very high	6 Å²	6	33.3 Å²	33.3	3%	0.028	19%	0.188	C	C	.	.			trans	-95.1	-18	-172.2	-62.8	-55.8	-62.4	0	0	114.8	L333 D390 L412 P413	L333-Q415 HydrophobicContact CB-CG 4.26Å; L333-Q415 HydrophobicContact CD1-CG 4.27Å; L333-Q415 HydrophobicContact CD2-CB 4.02Å; L333-Q415 HydrophobicContact CD2-CG 4.14Å; L333-Q415 HydrophobicContact CG-CG 4.45Å; D390-Q415 HydrophobicContact CB-CB 4.1Å; D390-Q415 WeakPolarHBondContact OD1-CG 3.35Å; D390-Q415 PolarHBondContact OD1-N 3.03Å; L412-Q415 HydrophobicContact CD2-CG 4.05Å; L412-Q415 HydrophobicContact CG-CG 4.4Å; P413-Q415 PolarHBondContact O-N 3.4Å; P413-Q415 PolarHBondContact O-NE2 3.41Å
416	A	95.2	Very high	95.2	Very high	11 Å²	11	33.3 Å²	33.3	9%	0.091	19%	0.189	C	C	.	.			trans	-81.4	132.9	171.9	0	0	0	0	0	110.5	W322 V389	W322-A416 HydrophobicContact CB-CB 4.32Å; W322-A416 HydrophobicContact CG-CB 4.45Å; V389-A416 WeakPolarHBondContact O-CB 3.49Å; V389-A416 PolarHBondContact O-N 2.75Å
417	I	92.8	Very high	95.2	Very high	8 Å²	8	31.7 Å²	31.7	4%	0.041	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.8	115.6	178.9	-65.8	162.1	0	0	0	108.8	P298 F300 W322 I323 I325 C419 P467	P298-I417 HydrophobicContact CG-CD1 3.85Å; P298-I417 HydrophobicContact CG-CG1 3.68Å; F300-I417 HydrophobicContact CE1-CD1 4.05Å; F300-I417 HydrophobicContact CE1-CG1 4.31Å; F300-I417 HydrophobicContact CE1-CG2 3.79Å; F300-I417 HydrophobicContact CZ-CD1 4.35Å; F300-I417 HydrophobicContact CZ-CG1 4.14Å; F300-I417 HydrophobicContact CZ-CG2 3.72Å; W322-I417 WeakPolarHBondContact CA-O 3.31Å; I323-I417 HydrophobicContact CD1-CB 4.48Å; I323-I417 HydrophobicContact CD1-CG2 4.38Å; I323-I417 HydrophobicContact CG1-CB 3.76Å; I323-I417 HydrophobicContact CG1-CG2 4.11Å; I323-I417 PolarHBondContact N-O 3.07Å; I323-I417 PolarHBondContact O-N 2.93Å; I325-I417 HydrophobicContact CD1-CD1 3.58Å; I325-I417 HydrophobicContact CG1-CD1 4.01Å; I417-C419 PolarHBondContact O-N 3.48Å; I417-C419 PolarHBondContact O-SG 3.02Å; I417-C419 VanDerWaalsContact O-SG 3.38Å; I417-P467 HydrophobicContact CG2-CG 4.36Å
418	E	93.3	Very high	95.1	Very high	46 Å²	46	29.1 Å²	29.1	22%	0.215	18%	0.18	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-64.2	124.4	176	-72	148.6	-162.9	0	0	110.5	Y387 W466 P467	Y387-E418 PolarHBondContact OH-OE1 3.24Å; E418-W466 HydrophobicContact CB-CD2 4.23Å; E418-W466 HydrophobicContact CB-CG 4.17Å; E418-W466 HydrophobicContact CB-CZ2 4.31Å; E418-W466 HydrophobicContact CG-CZ2 4.47Å; E418-W466 PolarHBondContact OE2-NE1 2.95Å; E418-P467 WeakPolarHBondContact O-CD 3.41Å
419	C	93.9	Very high	95	Very high	0 Å²	0	33.2 Å²	33.2	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	159.2	-172.1	-70.3	0	0	0	0	112.4	H320 F321 I323 I417 I469	H320-C419 WeakPolarHBondContact CA-O 3.37Å; F321-C419 HydrophobicContact CD2-CB 4.18Å; F321-C419 HydrophobicContact CE1-CB 4.24Å; F321-C419 HydrophobicContact CE2-CB 3.78Å; F321-C419 HydrophobicContact CZ-CB 3.81Å; F321-C419 PolarHBondContact N-O 2.88Å; F321-C419 VanDerWaalsContact N-O 3.08Å; F321-C419 PolarHBondContact O-N 3.04Å; I323-C419 WeakPolarHBondContact CD1-SG 3.32Å; I323-C419 VanDerWaalsContact CG1-SG 3.58Å; I417-C419 PolarHBondContact O-N 3.48Å; I417-C419 PolarHBondContact O-SG 3.02Å; I417-C419 VanDerWaalsContact O-SG 3.38Å; C419-I469 HydrophobicContact CB-CD1 4.05Å; C419-I469 HydrophobicContact CB-CG1 4.38Å
420	S	95.1	Very high	94.9	Very high	21 Å²	21	40.2 Å²	40.2	15%	0.147	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.7	144.6	172.7	-156.4	0	0	0	0	110.2	N319 A422 P467 K468 I469	N319-S420 VanDerWaalsContact C-OG 3.3Å; N319-S420 WeakPolarHBondContact CA-OG 3.19Å; N319-S420 PolarHBondContact ND2-OG 3Å; N319-S420 VanDerWaalsContact O-CB 3.24Å; N319-S420 WeakPolarHBondContact O-CB 3.37Å; N319-S420 PolarHBondContact O-OG 3.01Å; S420-A422 PolarHBondContact O-N 2.73Å; S420-P467 PolarHBondContact N-O 2.85Å; S420-K468 CarbonylContact O-C 3.59Å; S420-K468 WeakPolarHBondContact O-CA 3.28Å; S420-I469 PolarHBondContact O-N 2.83Å
421	L	96.3	Very high	95	Very high	4 Å²	4	39.7 Å²	39.7	2%	0.021	23%	0.23	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-67.4	127.8	172.9	-76.1	-173	0	0	0	110.9	P318 F321 R423 I424 F439 I469 L471 L486	P318-L421 HydrophobicContact CB-CD1 4.01Å; P318-L421 WeakPolarHBondContact O-CB 3.46Å; P318-L421 WeakPolarHBondContact O-CG 3.45Å; P318-L421 PolarHBondContact O-N 2.71Å; F321-L421 HydrophobicContact CE1-CD2 4.18Å; F321-L421 HydrophobicContact CE1-CG 4.02Å; F321-L421 HydrophobicContact CZ-CD2 4.08Å; F321-L421 HydrophobicContact CZ-CG 4.42Å; L421-R423 PolarHBondContact O-N 3.12Å; L421-I424 HydrophobicContact CB-CB 3.77Å; L421-I424 HydrophobicContact CB-CG1 3.93Å; L421-I424 HydrophobicContact CB-CG2 4.31Å; L421-I424 HydrophobicContact CD1-CB 4.4Å; L421-I424 HydrophobicContact CD1-CG1 4.23Å; L421-I424 HydrophobicContact CD1-CG2 4.23Å; L421-F439 HydrophobicContact CD1-CD2 4.41Å; L421-F439 HydrophobicContact CD1-CE2 3.88Å; L421-F439 HydrophobicContact CD2-CE2 4.44Å; L421-F439 HydrophobicContact CG-CE2 4.21Å; L421-I469 CarbonylContact C-O 3.55Å; L421-I469 WeakPolarHBondContact CA-O 3.36Å; L421-L471 HydrophobicContact CD2-CB 3.84Å; L421-L486 HydrophobicContact CD1-CD1 4.23Å
422	A	94.4	Very high	95.1	Very high	5 Å²	5	39.9 Å²	39.9	4%	0.041	22%	0.22	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.2	128.1	178.1	0	0	0	0	0	110.8	S420 I424 K468 I469 Y470	S420-A422 PolarHBondContact O-N 2.73Å; A422-I424 PolarHBondContact O-N 2.96Å; A422-K468 HydrophobicContact CB-CB 4.14Å; A422-I469 PolarHBondContact N-O 2.96Å; A422-Y470 HydrophobicContact CB-CD1 4.09Å; A422-Y470 HydrophobicContact CB-CD2 4.1Å; A422-Y470 HydrophobicContact CB-CE1 3.96Å; A422-Y470 HydrophobicContact CB-CE2 3.99Å; A422-Y470 HydrophobicContact CB-CG 4.15Å
423	R	94.2	Very high	95.1	Very high	53 Å²	53	44.1 Å²	44.1	20%	0.2	24%	0.24	C	C	.	.	T	Hydrogen-bonded Turn	trans	59.9	25	177.4	-57.1	173.7	62	-126.7	-12.8	115.1	L421 Y470 E494 L495	L421-R423 PolarHBondContact O-N 3.12Å; R423-Y470 WeakPolarHBondContact CD-OH 3.38Å; R423-E494 IonicContact CZ-OE1 3.75Å; R423-E494 IonicContact NH1-OE1 2.7Å; R423-E494 PolarHBondContact NH1-OE1 3.41Å; R423-E494 IonicContact NH2-OE1 2.71Å; R423-E494 PolarHBondContact NH2-OE1 2.83Å; R423-E494 CarbonylContact O-C 3.56Å; R423-E494 WeakPolarHBondContact O-CA 3.36Å; R423-L495 HydrophobicContact CB-CB 4.41Å; R423-L495 PolarHBondContact NE-O 2.96Å; R423-L495 PolarHBondContact NH2-O 3.28Å; R423-L495 PolarHBondContact O-N 3.16Å
424	I	97.1	Very high	95.2	Very high	9 Å²	9	47.4 Å²	47.4	5%	0.046	25%	0.251	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-115.3	138.2	177.5	-63.7	-60.9	0	0	0	110.6	N319 L421 A422 W431 V487 A492	N319-I424 PolarHBondContact ND2-O 2.9Å; L421-I424 HydrophobicContact CB-CB 3.77Å; L421-I424 HydrophobicContact CB-CG1 3.93Å; L421-I424 HydrophobicContact CB-CG2 4.31Å; L421-I424 HydrophobicContact CD1-CB 4.4Å; L421-I424 HydrophobicContact CD1-CG1 4.23Å; L421-I424 HydrophobicContact CD1-CG2 4.23Å; A422-I424 PolarHBondContact O-N 2.96Å; I424-W431 HydrophobicContact CG2-CH2 3.7Å; I424-W431 HydrophobicContact CG2-CZ2 3.99Å; I424-V487 HydrophobicContact CD1-CG2 3.75Å; I424-A492 HydrophobicContact CG2-CB 4.04Å
425	A	96.5	Very high	95.3	Very high	18 Å²	18	46.3 Å²	46.3	15%	0.149	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-139.5	159.5	171.9	0	0	0	0	0	109.8	A492 I493 L495	A425-A492 CarbonylContact O-C 3.56Å; A425-A492 WeakPolarHBondContact O-CA 3.45Å; A425-A492 WeakPolarHBondContact O-CB 3.44Å; A425-I493 HydrophobicContact CB-CD1 4.47Å; A425-I493 HydrophobicContact CB-CG1 3.99Å; A425-I493 PolarHBondContact N-O 3.07Å; A425-I493 PolarHBondContact O-N 3.1Å; A425-L495 HydrophobicContact CB-CD1 4.16Å; A425-L495 HydrophobicContact CB-CD2 4Å; A425-L495 HydrophobicContact CB-CG 4.14Å
426	P	97.5	Very high	95.3	Very high	26 Å²	26	48.7 Å²	48.7	17%	0.169	26%	0.259	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.5	154.9	173.4	25.5	-33.9	0	0	0	111.6	Q430 W431	P426-Q430 WeakPolarHBondContact CB-O 3.31Å; P426-W431 HydrophobicContact CB-CD2 3.77Å; P426-W431 HydrophobicContact CB-CE3 4.05Å; P426-W431 HydrophobicContact CB-CG 4.07Å; P426-W431 HydrophobicContact CB-CZ2 4.33Å; P426-W431 HydrophobicContact CB-CZ3 4.45Å; P426-W431 HydrophobicContact CG-CD2 4.46Å
427	S	95.4	Very high	95.4	Very high	54 Å²	54	48.8 Å²	48.8	38%	0.378	26%	0.258	S	S	.	.	S	Bend	trans	-78.4	-19.3	176.6	54.3	0	0	0	0	114.2	G490 Y491	S427-G490 WeakPolarHBondContact CB-O 3.38Å; S427-G490 PolarHBondContact OG-O 2.75Å; S427-Y491 PolarHBondContact N-O 3.24Å; S427-Y491 PolarHBondContact OG-O 3.02Å
428	G	93.8	Very high	95.6	Very high	42 Å²	42	49.7 Å²	49.7	43%	0.433	26%	0.262	S	S	.	.	S	Bend	trans	-117.1	-163.1	170.1	0	0	0	0	0	112.6	Q430	G428-Q430 PolarHBondContact O-N 2.92Å
429	D	93	Very high	95.8	Very high	162 Å²	162	47.5 Å²	47.5	87%	0.866	25%	0.251	S	S	*	.	S	Bend	trans	-64.7	-23.2	-177.2	-64.4	-33.2	0	0	0	113.7
430	Q	95.3	Very high	95.9	Very high	151 Å²	151	48 Å²	48	71%	0.706	25%	0.254	S	S	*	.	S	Bend	trans	-145.9	169.6	-179.3	-68.3	-65.4	-75.3	0	0	109.9	P426 G428	P426-Q430 WeakPolarHBondContact CB-O 3.31Å; G428-Q430 PolarHBondContact O-N 2.92Å
431	W	97.1	Very high	96	Very high	33 Å²	33	52.2 Å²	52.2	13%	0.125	27%	0.267	C	S	.	.			trans	-74.2	128.4	172.9	-73.7	103.4	0	0	0	111.6	H317 P318 N319 I424 P426 A435 L436 Y491 A492	H317-W431 HydrophobicContact CB-CB 4.41Å; H317-W431 HydrophobicContact CB-CG 4.11Å; H317-W431 AromaticContact CD2-CD1 3.54Å; H317-W431 AromaticContact CG-CD1 3.7Å; P318-W431 HydrophobicContact CB-CH2 3.87Å; P318-W431 HydrophobicContact CB-CZ2 3.7Å; P318-W431 HydrophobicContact CB-CZ3 4.38Å; P318-W431 HydrophobicContact CG-CD2 4.02Å; P318-W431 HydrophobicContact CG-CE3 3.94Å; P318-W431 HydrophobicContact CG-CH2 3.87Å; P318-W431 HydrophobicContact CG-CZ2 3.94Å; P318-W431 HydrophobicContact CG-CZ3 3.86Å; N319-W431 VanDerWaalsContact OD1-CZ2 3.27Å; N319-W431 WeakPolarHBondContact OD1-CZ2 3.38Å; N319-W431 PolarHBondContact OD1-NE1 2.71Å; I424-W431 HydrophobicContact CG2-CH2 3.7Å; I424-W431 HydrophobicContact CG2-CZ2 3.99Å; P426-W431 HydrophobicContact CB-CD2 3.77Å; P426-W431 HydrophobicContact CB-CE3 4.05Å; P426-W431 HydrophobicContact CB-CG 4.07Å; P426-W431 HydrophobicContact CB-CZ2 4.33Å; P426-W431 HydrophobicContact CB-CZ3 4.45Å; P426-W431 HydrophobicContact CG-CD2 4.46Å; W431-A435 HydrophobicContact CE3-CB 3.85Å; W431-A435 HydrophobicContact CZ3-CB 4.3Å; W431-L436 HydrophobicContact CB-CD2 3.78Å; W431-L436 HydrophobicContact CG-CD2 4.38Å; W431-Y491 VanDerWaalsContact CZ3-O 3.28Å; W431-Y491 WeakPolarHBondContact CZ3-O 3.36Å; W431-A492 HydrophobicContact CH2-CB 3.73Å; W431-A492 HydrophobicContact CZ3-CB 3.96Å
432	E	96.2	Very high	96	Very high	101 Å²	101	52.4 Å²	52.4	47%	0.472	27%	0.268	S	S	.	.			trans	-73.9	150.1	174.4	-60.9	179.8	148.2	0	0	111.2	E434 A435 L436	E432-E434 VanDerWaalsContact C-N 3.32Å; E432-E434 PolarHBondContact O-N 2.76Å; E432-A435 HydrophobicContact CB-CB 4.4Å; E432-A435 WeakPolarHBondContact O-CA 3.5Å; E432-A435 VanDerWaalsContact O-CB 3.24Å; E432-A435 WeakPolarHBondContact O-CB 3.48Å; E432-A435 PolarHBondContact O-N 3.39Å; E432-L436 PolarHBondContact O-N 2.82Å
433	E	94.9	Very high	96.1	Very high	110 Å²	110	52.2 Å²	52.2	51%	0.514	27%	0.266	S	S	.	.	H	α-helix	trans	-62	-40.1	-176.4	-175.3	164.7	-149.7	0	0	111.8	I225 A435 L436 D437	I225-E433 WeakPolarHBondContact CD1-OE1 3.28Å; E433-A435 PolarHBondContact O-N 2.93Å; E433-L436 WeakPolarHBondContact O-CB 3.43Å; E433-L436 PolarHBondContact O-N 2.92Å; E433-L436 VanDerWaalsContact O-N 3.1Å; E433-D437 WeakPolarHBondContact O-CB 3.26Å; E433-D437 PolarHBondContact O-N 3.23Å
434	E	96.1	Very high	96.1	Very high	113 Å²	113	52.2 Å²	52.2	53%	0.528	27%	0.268	S	S	.	.	H	α-helix	trans	-61.4	-26.6	173.7	-66	87.5	163	0	0	113.4	E432 E438 Y491	E432-E434 VanDerWaalsContact C-N 3.32Å; E432-E434 PolarHBondContact O-N 2.76Å; E434-E438 VanDerWaalsContact O-CB 3.29Å; E434-E438 WeakPolarHBondContact O-CB 3.46Å; E434-E438 PolarHBondContact O-N 3.12Å; E434-Y491 HydrophobicContact CB-CE1 3.9Å
435	A	96.9	Very high	96	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	27%	0.269	C	S	.	.	H	α-helix	trans	-76.1	-37	174.5	0	0	0	0	0	112.1	W431 E432 E433 F439 Y491	W431-A435 HydrophobicContact CE3-CB 3.85Å; W431-A435 HydrophobicContact CZ3-CB 4.3Å; E432-A435 HydrophobicContact CB-CB 4.4Å; E432-A435 WeakPolarHBondContact O-CA 3.5Å; E432-A435 VanDerWaalsContact O-CB 3.24Å; E432-A435 WeakPolarHBondContact O-CB 3.48Å; E432-A435 PolarHBondContact O-N 3.39Å; E433-A435 PolarHBondContact O-N 2.93Å; A435-F439 WeakPolarHBondContact O-CB 3.49Å; A435-F439 PolarHBondContact O-N 2.85Å; A435-Y491 HydrophobicContact CB-CD1 3.95Å; A435-Y491 HydrophobicContact CB-CD2 4.28Å; A435-Y491 HydrophobicContact CB-CG 3.72Å
436	L	96.9	Very high	95.8	Very high	55 Å²	55	51.5 Å²	51.5	29%	0.288	26%	0.263	S	S	.	.	H	α-helix	trans	-64.2	-46.6	173.1	-52	-175.6	0	0	0	110.3	H317 W431 E432 E433 E438 F439 D440	H317-L436 HydrophobicContact CB-CD2 3.45Å; H317-L436 VanDerWaalsContact CB-CD2 3.45Å; W431-L436 HydrophobicContact CB-CD2 3.78Å; W431-L436 HydrophobicContact CG-CD2 4.38Å; E432-L436 PolarHBondContact O-N 2.82Å; E433-L436 WeakPolarHBondContact O-CB 3.43Å; E433-L436 PolarHBondContact O-N 2.92Å; E433-L436 VanDerWaalsContact O-N 3.1Å; L436-E438 PolarHBondContact O-N 3.32Å; L436-F439 PolarHBondContact O-N 3.44Å; L436-D440 PolarHBondContact O-N 3.32Å
437	D	95.8	Very high	95.6	Very high	14 Å²	14	55 Å²	55	8%	0.075	28%	0.28	C	S	.	.	H	α-helix	trans	-65.1	-38.4	-179.4	-138.1	33.6	0	0	0	111.6	I218 R221 R222 E433 R441	I218-D437 WeakPolarHBondContact CG2-OD1 3.32Å; I218-D437 WeakPolarHBondContact CG2-OD2 3.41Å; R221-D437 IonicContact NH1-OD1 2.8Å; R222-D437 IonicContact CZ-OD2 3.64Å; R222-D437 IonicContact NE-OD2 2.97Å; R222-D437 PolarHBondContact NE-OD2 2.9Å; R222-D437 IonicContact NH2-OD2 3.87Å; R222-D437 PolarHBondContact NH2-OD2 2.96Å; E433-D437 WeakPolarHBondContact O-CB 3.26Å; E433-D437 PolarHBondContact O-N 3.23Å; D437-R441 VanDerWaalsContact O-CB 3.31Å; D437-R441 WeakPolarHBondContact O-CB 3.31Å; D437-R441 PolarHBondContact O-N 3.48Å; D437-R441 VanDerWaalsContact O-N 3.09Å
438	E	97.5	Very high	95.5	Very high	26 Å²	26	53.2 Å²	53.2	12%	0.121	27%	0.265	C	S	.	.	H	α-helix	trans	-71.8	-35.2	173.3	-176.1	70.9	169.6	0	0	112.5	E434 L436 R441 L442 L486 K489 Y491	E434-E438 VanDerWaalsContact O-CB 3.29Å; E434-E438 WeakPolarHBondContact O-CB 3.46Å; E434-E438 PolarHBondContact O-N 3.12Å; L436-E438 PolarHBondContact O-N 3.32Å; E438-R441 PolarHBondContact O-N 2.89Å; E438-R441 IonicContact OE1-CZ 3.73Å; E438-R441 IonicContact OE1-NE 2.86Å; E438-R441 IonicContact OE1-NH2 3.51Å; E438-R441 PolarHBondContact OE1-NH2 2.84Å; E438-R441 IonicContact OE2-CZ 2.71Å; E438-R441 IonicContact OE2-NE 2.66Å; E438-R441 PolarHBondContact OE2-NE 2.94Å; E438-R441 IonicContact OE2-NH2 3.99Å; E438-R441 PolarHBondContact OE2-NH2 2.67Å; E438-L442 HydrophobicContact CG-CD1 3.91Å; E438-L442 HydrophobicContact CG-CG 4.28Å; E438-L442 WeakPolarHBondContact O-CB 3.47Å; E438-L442 VanDerWaalsContact O-CG 3.27Å; E438-L442 WeakPolarHBondContact O-CG 3.37Å; E438-L442 PolarHBondContact O-N 3.07Å; E438-L486 HydrophobicContact CB-CD2 4.4Å; E438-L486 HydrophobicContact CG-CD2 4.16Å; E438-K489 HydrophobicContact CG-CD 3.77Å; E438-K489 WeakPolarHBondContact OE1-CD 3.48Å; E438-K489 WeakPolarHBondContact OE1-CE 3.47Å; E438-K489 IonicContact OE1-NZ 3.72Å; E438-K489 PolarHBondContact OE1-NZ 3.19Å; E438-Y491 HydrophobicContact CB-CD2 4.2Å; E438-Y491 HydrophobicContact CB-CE2 3.7Å; E438-Y491 HydrophobicContact CG-CD2 4.27Å; E438-Y491 HydrophobicContact CG-CE2 3.86Å
439	F	97.9	Very high	95.5	Very high	0 Å²	0	53.5 Å²	53.5	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-66.3	-45	174.3	-179.1	-109.8	0	0	0	111.7	S315 P318 F321 L421 A435 L436 R441 L442 T443 I482 L486	S315-F439 WeakPolarHBondContact OG-CD1 3.35Å; S315-F439 VanDerWaalsContact OG-CE1 3.31Å; S315-F439 WeakPolarHBondContact OG-CE1 3.3Å; P318-F439 HydrophobicContact CB-CD2 4.14Å; P318-F439 HydrophobicContact CB-CE2 4.29Å; P318-F439 HydrophobicContact CB-CG 4.28Å; P318-F439 HydrophobicContact CG-CB 3.92Å; P318-F439 HydrophobicContact CG-CD1 4.2Å; P318-F439 HydrophobicContact CG-CD2 4.07Å; P318-F439 HydrophobicContact CG-CG 3.8Å; F321-F439 HydrophobicContact CB-CE1 4.07Å; F321-F439 HydrophobicContact CB-CZ 4.48Å; F321-F439 HydrophobicContact CD1-CE1 4.01Å; F321-F439 AromaticContact CD1-CZ 3.68Å; F321-F439 HydrophobicContact CD1-CZ 3.68Å; F321-F439 HydrophobicContact CD2-CZ 4.21Å; F321-F439 AromaticContact CE1-CZ 3.86Å; F321-F439 HydrophobicContact CE1-CZ 3.86Å; F321-F439 HydrophobicContact CE2-CZ 4.36Å; F321-F439 AromaticContact CG-CE1 3.97Å; F321-F439 HydrophobicContact CG-CE1 3.97Å; F321-F439 AromaticContact CG-CZ 3.87Å; F321-F439 HydrophobicContact CG-CZ 3.87Å; F321-F439 HydrophobicContact CZ-CZ 4.2Å; L421-F439 HydrophobicContact CD1-CD2 4.41Å; L421-F439 HydrophobicContact CD1-CE2 3.88Å; L421-F439 HydrophobicContact CD2-CE2 4.44Å; L421-F439 HydrophobicContact CG-CE2 4.21Å; A435-F439 WeakPolarHBondContact O-CB 3.49Å; A435-F439 PolarHBondContact O-N 2.85Å; L436-F439 PolarHBondContact O-N 3.44Å; F439-R441 VanDerWaalsContact C-N 3.27Å; F439-R441 PolarHBondContact O-N 2.85Å; F439-L442 PolarHBondContact O-N 3.18Å; F439-T443 HydrophobicContact CD1-CG2 4.37Å; F439-T443 HydrophobicContact CD2-CG2 3.79Å; F439-T443 HydrophobicContact CE1-CG2 4.07Å; F439-T443 HydrophobicContact CE2-CG2 3.44Å; F439-T443 VanDerWaalsContact CE2-CG2 3.44Å; F439-T443 HydrophobicContact CG-CG2 4.26Å; F439-T443 HydrophobicContact CZ-CG2 3.61Å; F439-T443 WeakPolarHBondContact O-CB 3.4Å; F439-T443 VanDerWaalsContact O-CG2 3.32Å; F439-T443 WeakPolarHBondContact O-CG2 3.49Å; F439-T443 PolarHBondContact O-N 2.87Å; F439-T443 PolarHBondContact O-OG1 2.97Å; F439-I482 HydrophobicContact CD2-CG2 3.9Å; F439-I482 HydrophobicContact CE2-CG2 3.98Å; F439-L486 HydrophobicContact CB-CD1 4.48Å; F439-L486 HydrophobicContact CD2-CD1 4.04Å
440	D	96.3	Very high	95.5	Very high	11 Å²	11	48.8 Å²	48.8	6%	0.059	23%	0.233	C	C	.	.	H	α-helix	trans	-51.9	-47.9	169.7	-99.5	9.3	0	0	0	110.7	K215 I218 R221 L436 T443 H444 C445	K215-D440 WeakPolarHBondContact CD-OD2 3.4Å; K215-D440 WeakPolarHBondContact CE-OD2 3.22Å; K215-D440 IonicContact NZ-OD1 2.74Å; K215-D440 PolarHBondContact NZ-OD1 3.49Å; K215-D440 IonicContact NZ-OD2 2.73Å; K215-D440 PolarHBondContact NZ-OD2 3.46Å; I218-D440 HydrophobicContact CD1-CB 4.15Å; R221-D440 IonicContact CZ-OD2 3.81Å; R221-D440 IonicContact NH1-OD2 2.72Å; R221-D440 PolarHBondContact NH1-OD2 2.74Å; R221-D440 IonicContact NH2-OD2 3.16Å; L436-D440 PolarHBondContact O-N 3.32Å; D440-T443 PolarHBondContact O-N 2.92Å; D440-T443 PolarHBondContact O-OG1 2.94Å; D440-H444 WeakPolarHBondContact O-CA 3.31Å; D440-H444 PolarHBondContact O-N 3.25Å; D440-C445 HydrophobicContact CB-CB 4.42Å; D440-C445 PolarHBondContact O-N 2.79Å; D440-C445 VanDerWaalsContact OD1-CB 3.3Å; D440-C445 WeakPolarHBondContact OD1-CB 3.22Å
441	R	96.1	Very high	95.4	Very high	110 Å²	110	41.7 Å²	41.7	42%	0.415	20%	0.2	S	C	.	.	H	α-helix	trans	-71.4	-30	-177	-161.6	-152.6	56.6	59.3	-3	114	I218 D437 E438 F439	I218-R441 HydrophobicContact CD1-CB 3.84Å; I218-R441 HydrophobicContact CD1-CG 4.27Å; D437-R441 VanDerWaalsContact O-CB 3.31Å; D437-R441 WeakPolarHBondContact O-CB 3.31Å; D437-R441 PolarHBondContact O-N 3.48Å; D437-R441 VanDerWaalsContact O-N 3.09Å; E438-R441 PolarHBondContact O-N 2.89Å; E438-R441 IonicContact OE1-CZ 3.73Å; E438-R441 IonicContact OE1-NE 2.86Å; E438-R441 IonicContact OE1-NH2 3.51Å; E438-R441 PolarHBondContact OE1-NH2 2.84Å; E438-R441 IonicContact OE2-CZ 2.71Å; E438-R441 IonicContact OE2-NE 2.66Å; E438-R441 PolarHBondContact OE2-NE 2.94Å; E438-R441 IonicContact OE2-NH2 3.99Å; E438-R441 PolarHBondContact OE2-NH2 2.67Å; F439-R441 VanDerWaalsContact C-N 3.27Å; F439-R441 PolarHBondContact O-N 2.85Å
442	L	96.5	Very high	95.2	Very high	8 Å²	8	40.8 Å²	40.8	4%	0.042	20%	0.198	C	C	.	.	H	α-helix	trans	-80.1	-35.9	174.9	-75.5	170.4	0	0	0	111.7	E438 F439 L480 I482 E485 L486	E438-L442 HydrophobicContact CG-CD1 3.91Å; E438-L442 HydrophobicContact CG-CG 4.28Å; E438-L442 WeakPolarHBondContact O-CB 3.47Å; E438-L442 VanDerWaalsContact O-CG 3.27Å; E438-L442 WeakPolarHBondContact O-CG 3.37Å; E438-L442 PolarHBondContact O-N 3.07Å; F439-L442 PolarHBondContact O-N 3.18Å; L442-L480 HydrophobicContact CD2-CD2 4.05Å; L442-I482 HydrophobicContact CB-CD1 4.46Å; L442-I482 HydrophobicContact CB-CG1 4.38Å; L442-I482 HydrophobicContact CB-CG2 3.95Å; L442-I482 HydrophobicContact CD1-CG2 4.22Å; L442-E485 HydrophobicContact CD1-CB 4.25Å; L442-E485 HydrophobicContact CD1-CG 3.82Å; L442-E485 HydrophobicContact CD2-CG 3.89Å; L442-L486 HydrophobicContact CD1-CD2 4.19Å; L442-L486 HydrophobicContact CD1-CG 4.41Å
443	T	96.3	Very high	95	Very high	0 Å²	0	36.1 Å²	36.1	0%	0	18%	0.176	C	C	.	.	H	α-helix	trans	-86.4	-17.3	-178.4	57.7	0	0	0	0	114.3	V312 F439 D440 C445 L451 L471 I482	V312-T443 HydrophobicContact CG2-CG2 4Å; F439-T443 HydrophobicContact CD1-CG2 4.37Å; F439-T443 HydrophobicContact CD2-CG2 3.79Å; F439-T443 HydrophobicContact CE1-CG2 4.07Å; F439-T443 HydrophobicContact CE2-CG2 3.44Å; F439-T443 VanDerWaalsContact CE2-CG2 3.44Å; F439-T443 HydrophobicContact CG-CG2 4.26Å; F439-T443 HydrophobicContact CZ-CG2 3.61Å; F439-T443 WeakPolarHBondContact O-CB 3.4Å; F439-T443 VanDerWaalsContact O-CG2 3.32Å; F439-T443 WeakPolarHBondContact O-CG2 3.49Å; F439-T443 PolarHBondContact O-N 2.87Å; F439-T443 PolarHBondContact O-OG1 2.97Å; D440-T443 PolarHBondContact O-N 2.92Å; D440-T443 PolarHBondContact O-OG1 2.94Å; T443-C445 VanDerWaalsContact C-N 3.34Å; T443-L451 HydrophobicContact CG2-CD1 4.33Å; T443-L451 WeakPolarHBondContact O-CD1 3.48Å; T443-L471 HydrophobicContact CG2-CD2 3.85Å; T443-I482 HydrophobicContact CG2-CD1 3.98Å; T443-I482 HydrophobicContact CG2-CG2 4.21Å
444	H	94.7	Very high	94.7	Very high	54 Å²	54	32.1 Å²	32.1	25%	0.25	16%	0.157	C	C	.	.	T	Hydrogen-bonded Turn	trans	57.1	49.3	-169.5	-61.1	-90.2	0	0	0	111	D440 A446 D447 K449	D440-H444 WeakPolarHBondContact O-CA 3.31Å; D440-H444 PolarHBondContact O-N 3.25Å; H444-A446 PolarHBondContact O-N 2.92Å; H444-D447 HydrophobicContact CB-CB 4.02Å; H444-D447 WeakPolarHBondContact O-CB 3.5Å; H444-D447 PolarHBondContact O-N 2.87Å; H444-K449 HydrophobicContact CB-CB 3.89Å; H444-K449 PolarHBondContact CD2-NZ 2.84Å; H444-K449 PolarHBondContact NE2-NZ 3.43Å
445	C	95.3	Very high	94.3	Very high	9 Å²	9	27.2 Å²	27.2	6%	0.061	14%	0.135	C	C	.	.	T	Hydrogen-bonded Turn	trans	-56.7	122.7	-176.4	-178.5	0	0	0	0	111.4	K215 V312 D440 T443 D447	K215-C445 HydrophobicContact CD-CB 4.43Å; V312-C445 HydrophobicContact CG1-CB 4.11Å; D440-C445 HydrophobicContact CB-CB 4.42Å; D440-C445 PolarHBondContact O-N 2.79Å; D440-C445 VanDerWaalsContact OD1-CB 3.3Å; D440-C445 WeakPolarHBondContact OD1-CB 3.22Å; T443-C445 VanDerWaalsContact C-N 3.34Å; C445-D447 PolarHBondContact O-N 2.93Å
446	A	93.1	Very high	93.8	Very high	2 Å²	2	29.4 Å²	29.4	2%	0.017	15%	0.15	C	C	.	.	T	Hydrogen-bonded Turn	trans	62.9	9	-175.1	0	0	0	0	0	116.9	R214 K215 V312 H444 W448	R214-A446 HydrophobicContact CB-CB 4.35Å; K215-A446 HydrophobicContact CB-CB 3.79Å; V312-A446 PolarHBondContact O-N 3.18Å; H444-A446 PolarHBondContact O-N 2.92Å; A446-W448 VanDerWaalsContact O-CE2 3.31Å; A446-W448 PolarHBondContact O-NE1 2.93Å
447	D	92.4	Very high	93.2	Very high	101 Å²	101	28.6 Å²	28.6	54%	0.54	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-94.4	0.3	173.4	-80.9	-18.8	0	0	0	113.1	H444 C445 K449	H444-D447 HydrophobicContact CB-CB 4.02Å; H444-D447 WeakPolarHBondContact O-CB 3.5Å; H444-D447 PolarHBondContact O-N 2.87Å; C445-D447 PolarHBondContact O-N 2.93Å; D447-K449 PolarHBondContact O-N 3.36Å; D447-K449 VanDerWaalsContact O-N 3.1Å
448	W	93.3	Very high	92.7	Very high	16 Å²	16	32.4 Å²	32.4	6%	0.061	16%	0.163	C	C	.	.	T	Hydrogen-bonded Turn	trans	58.7	23.1	174.4	-34.9	106.7	0	0	0	116.1	A208 R211 R214 Y311 F391 A446	A208-W448 HydrophobicContact CB-CB 3.81Å; R211-W448 HydrophobicContact CB-CD2 4.27Å; R211-W448 HydrophobicContact CB-CG 4.22Å; R211-W448 HydrophobicContact CB-CZ2 4.3Å; R211-W448 VanDerWaalsContact NH1-CZ3 3.27Å; R214-W448 HydrophobicContact CG-CZ2 4.37Å; Y311-W448 WeakPolarHBondContact CD1-O 3.16Å; Y311-W448 HydrophobicContact CD2-CE3 4.12Å; Y311-W448 HydrophobicContact CE1-CB 4.44Å; Y311-W448 WeakPolarHBondContact CE1-O 3.46Å; Y311-W448 HydrophobicContact CG-CE3 4.42Å; F391-W448 AromaticContact CD1-CH2 3.69Å; F391-W448 HydrophobicContact CD1-CH2 3.69Å; F391-W448 HydrophobicContact CD1-CZ3 4.29Å; F391-W448 AromaticContact CE1-CH2 3.66Å; F391-W448 HydrophobicContact CE1-CH2 3.66Å; F391-W448 HydrophobicContact CE1-CZ2 4.44Å; F391-W448 HydrophobicContact CE1-CZ3 4.23Å; A446-W448 VanDerWaalsContact O-CE2 3.31Å; A446-W448 PolarHBondContact O-NE1 2.93Å
449	K	93.1	Very high	91.7	Very high	48 Å²	48	33.9 Å²	33.9	21%	0.209	17%	0.173	C	C	.	.			trans	-76.6	129.3	168.1	179.2	178	139.4	-171.5	0	109.5	H444 D447 D473 S475	H444-K449 HydrophobicContact CB-CB 3.89Å; H444-K449 PolarHBondContact CD2-NZ 2.84Å; H444-K449 PolarHBondContact NE2-NZ 3.43Å; D447-K449 PolarHBondContact O-N 3.36Å; D447-K449 VanDerWaalsContact O-N 3.1Å; K449-D473 WeakPolarHBondContact CE-OD1 3.35Å; K449-D473 IonicContact NZ-OD1 2.77Å; K449-D473 PolarHBondContact NZ-OD1 2.93Å; K449-D473 IonicContact NZ-OD2 3.42Å; K449-D473 PolarHBondContact NZ-OD2 2.9Å; K449-S475 PolarHBondContact NZ-OG 2.97Å; K449-S475 VanDerWaalsContact NZ-OG 3.17Å
450	P	93.1	Very high	90.6	Very high	63 Å²	63	40.9 Å²	40.9	41%	0.409	21%	0.206	S	C	.	.			trans	-74.1	135.2	-179.6	29.4	-33.9	0	0	0	112.1	V310 Y311 V326	V310-P450 WeakPolarHBondContact O-CA 3.28Å; Y311-P450 HydrophobicContact CD1-CB 4.4Å; Y311-P450 HydrophobicContact CE1-CB 4Å; V326-P450 HydrophobicContact CG2-CB 4.42Å
451	L	94.6	Very high	89.4	Confident	1 Å²	1	43.4 Å²	43.4	1%	0.005	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	171.3	169.4	-57.6	175.9	0	0	0	109.7	E309 V310 V312 T443 L471 D473 I482	E309-L451 CarbonylContact C-O 3.55Å; E309-L451 VanDerWaalsContact CA-O 3.28Å; E309-L451 WeakPolarHBondContact CA-O 3.5Å; V310-L451 HydrophobicContact CG2-CB 4.14Å; V310-L451 PolarHBondContact N-O 3.29Å; V310-L451 PolarHBondContact O-N 2.69Å; V312-L451 HydrophobicContact CG2-CD1 4.13Å; T443-L451 HydrophobicContact CG2-CD1 4.33Å; T443-L451 WeakPolarHBondContact O-CD1 3.48Å; L451-L471 HydrophobicContact CB-CD1 4.01Å; L451-L471 HydrophobicContact CB-CG 4.47Å; L451-L471 HydrophobicContact CD1-CD1 4.05Å; L451-L471 HydrophobicContact CD1-CD2 3.78Å; L451-L471 HydrophobicContact CD1-CG 3.87Å; L451-D473 HydrophobicContact CD2-CB 3.95Å; L451-I482 HydrophobicContact CD1-CD1 3.91Å; L451-I482 HydrophobicContact CD2-CD1 4.29Å
452	V	92	Very high	88.4	Confident	15 Å²	15	41.1 Å²	41.1	9%	0.091	23%	0.232	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	118.1	170.7	-177.6	0	0	0	0	109.6	L168 Y307 L308 E309 Y472 T474	L168-V452 HydrophobicContact CD1-CG1 4.22Å; L168-V452 HydrophobicContact CD2-CG1 4.3Å; Y307-V452 HydrophobicContact CD1-CG1 4.02Å; Y307-V452 HydrophobicContact CG-CG1 4.44Å; L308-V452 CarbonylContact O-C 3.57Å; L308-V452 WeakPolarHBondContact O-CA 3.43Å; E309-V452 HydrophobicContact CG-CG2 4.43Å; V452-Y472 PolarHBondContact N-O 2.87Å; V452-Y472 WeakPolarHBondContact O-CB 3.33Å; V452-Y472 WeakPolarHBondContact O-CD2 3.28Å; V452-Y472 PolarHBondContact O-N 3.21Å; V452-T474 HydrophobicContact CG2-CG2 4.11Å
453	A	92.1	Very high	87.1	Confident	2 Å²	2	48.1 Å²	48.1	2%	0.017	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.9	150.4	168.7	0	0	0	0	0	111	Y307 L308 V310 I469 Y470 L471	Y307-A453 CarbonylContact C-O 3.57Å; Y307-A453 WeakPolarHBondContact CA-O 3.27Å; L308-A453 PolarHBondContact N-O 2.64Å; L308-A453 PolarHBondContact O-N 2.65Å; V310-A453 HydrophobicContact CG1-CB 3.83Å; V310-A453 HydrophobicContact CG2-CB 3.91Å; A453-I469 HydrophobicContact CB-CD1 4Å; A453-Y470 CarbonylContact C-O 3.19Å; A453-Y470 VanDerWaalsContact CA-O 3.3Å; A453-Y470 WeakPolarHBondContact CA-O 3.43Å; A453-L471 HydrophobicContact CB-CD1 4.05Å
454	K	88.7	Confident	85.8	Confident	27 Å²	27	50.5 Å²	50.5	12%	0.117	29%	0.285	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.1	125.9	165.7	-171.5	-159.7	173.4	-167.3	0	109	D305 Y307 S456 I469 Y470 Y472	D305-K454 WeakPolarHBondContact OD1-CE 3.34Å; D305-K454 IonicContact OD1-NZ 2.76Å; D305-K454 PolarHBondContact OD1-NZ 3.06Å; Y307-K454 HydrophobicContact CD1-CB 3.65Å; Y307-K454 HydrophobicContact CD1-CG 3.82Å; Y307-K454 HydrophobicContact CE1-CB 3.54Å; Y307-K454 HydrophobicContact CE1-CD 3.67Å; Y307-K454 HydrophobicContact CE1-CG 3.48Å; Y307-K454 VanDerWaalsContact CE1-CG 3.48Å; K454-S456 PolarHBondContact O-N 2.92Å; K454-I469 CarbonylContact O-C 3.59Å; K454-I469 VanDerWaalsContact O-CA 3.27Å; K454-I469 WeakPolarHBondContact O-CA 3.44Å; K454-Y470 HydrophobicContact CB-CD2 4.49Å; K454-Y470 HydrophobicContact CD-CD2 4.2Å; K454-Y470 PolarHBondContact N-O 3.33Å; K454-Y470 PolarHBondContact O-N 2.96Å; K454-Y472 HydrophobicContact CB-CE2 4.13Å
455	I	86.9	Confident	85	Confident	10 Å²	10	51.2 Å²	51.2	5%	0.051	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	128.5	176.1	-55.2	177.7	0	0	0	109.3	F302 L308 Y458 P467 I469	F302-I455 HydrophobicContact CB-CD1 3.99Å; L308-I455 HydrophobicContact CD1-CD1 4.31Å; I455-Y458 HydrophobicContact CG2-CE2 3.95Å; I455-P467 HydrophobicContact CG2-CB 4.4Å; I455-I469 HydrophobicContact CG1-CG2 4.49Å
456	S	86.9	Confident	84.4	Confident	46 Å²	46	53.7 Å²	53.7	32%	0.322	30%	0.301	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.2	-49.8	178	-166.6	0	0	0	0	112	K454 K468 Y470	K454-S456 PolarHBondContact O-N 2.92Å; S456-K468 WeakPolarHBondContact CB-O 3.36Å; S456-K468 PolarHBondContact N-O 2.85Å; S456-Y470 VanDerWaalsContact OG-CE2 3.27Å; S456-Y470 WeakPolarHBondContact OG-CE2 3.33Å
457	S	85.6	Confident	84.2	Confident	38 Å²	38	53.8 Å²	53.8	27%	0.266	30%	0.302	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-164.5	175.3	179.7	54.8	0	0	0	0	109.8	P467 K468	S457-P467 WeakPolarHBondContact O-CA 3.39Å; S457-K468 PolarHBondContact N-O 2.93Å; S457-K468 PolarHBondContact O-N 3.11Å; S457-K468 VanDerWaalsContact OG-CD 3.26Å; S457-K468 WeakPolarHBondContact OG-CD 3.36Å
458	Y	83.8	Confident	84.2	Confident	93 Å²	93	51.2 Å²	51.2	37%	0.365	29%	0.286	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.7	138	176.7	-65.6	-94	0	0	0	110	F300 I455 P467	F300-Y458 HydrophobicContact CB-CE1 4.47Å; I455-Y458 HydrophobicContact CG2-CE2 3.95Å; Y458-P467 HydrophobicContact CD1-CB 4.08Å; Y458-P467 HydrophobicContact CE1-CB 3.97Å
459	V	77.6	Confident	84.2	Confident	57 Å²	57	50.6 Å²	50.6	35%	0.345	28%	0.284	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.3	133.1	170	178.4	0	0	0	0	107.9	T465 W466 K468	V459-T465 CarbonylContact O-C 3.43Å; V459-T465 WeakPolarHBondContact O-CA 3.41Å; V459-W466 PolarHBondContact N-O 3.12Å; V459-W466 PolarHBondContact O-N 3.45Å; V459-K468 HydrophobicContact CG2-CD 3.86Å; V459-K468 HydrophobicContact CG2-CG 3.97Å
460	Q	75.3	Confident	84.3	Confident	148 Å²	148	50 Å²	50	69%	0.692	28%	0.28	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93	113.8	174.1	-174.1	173.5	-3.5	0	0	110.2	G462 S464 T465	Q460-G462 WeakPolarHBondContact CG-O 3.28Å; Q460-G462 PolarHBondContact NE2-O 3.07Å; Q460-S464 CarbonylContact C-O 3.59Å; Q460-T465 HydrophobicContact CB-CG2 4.3Å; Q460-T465 HydrophobicContact CG-CG2 4.3Å
461	T	71.2	Confident	84.4	Confident	64 Å²	64	47 Å²	47	39%	0.393	26%	0.261	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	83.8	179.7	-53.4	0	0	0	0	108.2	I463 S464 W466	T461-I463 PolarHBondContact O-N 2.99Å; T461-S464 PolarHBondContact N-O 2.92Å; T461-S464 PolarHBondContact O-N 2.79Å; T461-W466 HydrophobicContact CG2-CH2 4.4Å; T461-W466 HydrophobicContact CG2-CZ2 4.5Å; T461-W466 HydrophobicContact CG2-CZ3 4.47Å
462	G	74.4	Confident	84.4	Confident	61 Å²	61	47.6 Å²	47.6	63%	0.629	26%	0.263	S	S	*	.	T	Hydrogen-bonded Turn	trans	68.7	-115.2	-173.2	0	0	0	0	0	111.9	Q460	Q460-G462 WeakPolarHBondContact CG-O 3.28Å; Q460-G462 PolarHBondContact NE2-O 3.07Å
463	I	68.6	Low	84.4	Confident	155 Å²	155	47.6 Å²	47.6	80%	0.795	26%	0.262	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86	-19.7	174.6	61.7	172.7	0	0	0	113.1	T461	T461-I463 PolarHBondContact O-N 2.99Å
464	S	69	Low	84.2	Confident	51 Å²	51	49.2 Å²	49.2	36%	0.357	27%	0.272	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.4	152	-178	-61.3	0	0	0	0	111.8	Q460 T461	Q460-S464 CarbonylContact C-O 3.59Å; T461-S464 PolarHBondContact N-O 2.92Å; T461-S464 PolarHBondContact O-N 2.79Å
465	T	77.2	Confident	83.9	Confident	68 Å²	68	51.1 Å²	51.1	42%	0.417	29%	0.289	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.2	124.7	168.5	47.4	0	0	0	0	110.6	V459 Q460	V459-T465 CarbonylContact O-C 3.43Å; V459-T465 WeakPolarHBondContact O-CA 3.41Å; Q460-T465 HydrophobicContact CB-CG2 4.3Å; Q460-T465 HydrophobicContact CG-CG2 4.3Å
466	W	83.6	Confident	83.3	Confident	62 Å²	62	57.3 Å²	57.3	24%	0.235	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.7	123.5	-178.1	-66.8	-13	0	0	0	110	H320 E418 V459 T461 K468	H320-W466 AromaticContact CD2-CH2 3.67Å; H320-W466 AromaticContact CD2-CZ3 3.84Å; H320-W466 AromaticContact NE2-CH2 3.58Å; H320-W466 AromaticContact NE2-CZ2 3.9Å; E418-W466 HydrophobicContact CB-CD2 4.23Å; E418-W466 HydrophobicContact CB-CG 4.17Å; E418-W466 HydrophobicContact CB-CZ2 4.31Å; E418-W466 HydrophobicContact CG-CZ2 4.47Å; E418-W466 PolarHBondContact OE2-NE1 2.95Å; V459-W466 PolarHBondContact N-O 3.12Å; V459-W466 PolarHBondContact O-N 3.45Å; T461-W466 HydrophobicContact CG2-CH2 4.4Å; T461-W466 HydrophobicContact CG2-CZ2 4.5Å; T461-W466 HydrophobicContact CG2-CZ3 4.47Å; W466-K468 PolarHBondContact O-N 3.32Å
467	P	90.1	Very high	82.4	Confident	4 Å²	4	58 Å²	58	3%	0.026	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.6	128.7	175.8	27.8	-35.2	0	0	0	112.4	I417 E418 S420 I455 S457 Y458 I469	I417-P467 HydrophobicContact CG2-CG 4.36Å; E418-P467 WeakPolarHBondContact O-CD 3.41Å; S420-P467 PolarHBondContact N-O 2.85Å; I455-P467 HydrophobicContact CG2-CB 4.4Å; S457-P467 WeakPolarHBondContact O-CA 3.39Å; Y458-P467 HydrophobicContact CD1-CB 4.08Å; Y458-P467 HydrophobicContact CE1-CB 3.97Å; P467-I469 HydrophobicContact CB-CG2 3.88Å; P467-I469 HydrophobicContact CG-CG2 4.31Å
468	K	91.8	Very high	81.9	Confident	47 Å²	47	64.4 Å²	64.4	20%	0.204	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-73.2	118.2	157	-84.6	168.3	164.6	176.8	0	107.4	S420 A422 S456 S457 V459 W466 D498	S420-K468 CarbonylContact O-C 3.59Å; S420-K468 WeakPolarHBondContact O-CA 3.28Å; A422-K468 HydrophobicContact CB-CB 4.14Å; S456-K468 WeakPolarHBondContact CB-O 3.36Å; S456-K468 PolarHBondContact N-O 2.85Å; S457-K468 PolarHBondContact N-O 2.93Å; S457-K468 PolarHBondContact O-N 3.11Å; S457-K468 VanDerWaalsContact OG-CD 3.26Å; S457-K468 WeakPolarHBondContact OG-CD 3.36Å; V459-K468 HydrophobicContact CG2-CD 3.86Å; V459-K468 HydrophobicContact CG2-CG 3.97Å; W466-K468 PolarHBondContact O-N 3.32Å; K468-D498 IonicContact NZ-OD1 2.72Å; K468-D498 IonicContact NZ-OD2 3.97Å; K468-D498 PolarHBondContact NZ-OD2 2.84Å
469	I	93.6	Very high	81.9	Confident	2 Å²	2	64.7 Å²	64.7	1%	0.01	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.5	142.6	-177.4	67.5	174.4	0	0	0	112.9	F321 I323 C419 S420 L421 A422 A453 K454 I455 P467 L471	F321-I469 HydrophobicContact CE2-CD1 4.02Å; F321-I469 HydrophobicContact CZ-CD1 3.87Å; F321-I469 HydrophobicContact CZ-CG1 4.04Å; I323-I469 HydrophobicContact CD1-CD1 4.34Å; I323-I469 HydrophobicContact CG2-CD1 4.33Å; C419-I469 HydrophobicContact CB-CD1 4.05Å; C419-I469 HydrophobicContact CB-CG1 4.38Å; S420-I469 PolarHBondContact O-N 2.83Å; L421-I469 CarbonylContact C-O 3.55Å; L421-I469 WeakPolarHBondContact CA-O 3.36Å; A422-I469 PolarHBondContact N-O 2.96Å; A453-I469 HydrophobicContact CB-CD1 4Å; K454-I469 CarbonylContact O-C 3.59Å; K454-I469 VanDerWaalsContact O-CA 3.27Å; K454-I469 WeakPolarHBondContact O-CA 3.44Å; I455-I469 HydrophobicContact CG1-CG2 4.49Å; P467-I469 HydrophobicContact CB-CG2 3.88Å; P467-I469 HydrophobicContact CG-CG2 4.31Å; I469-L471 HydrophobicContact CD1-CD1 4.36Å
470	Y	94.3	Very high	82.6	Confident	36 Å²	36	64.8 Å²	64.8	14%	0.141	36%	0.362	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-82.5	143	158.1	-57.1	-85.2	0	0	0	108.6	A422 R423 A453 K454 S456 Y472	A422-Y470 HydrophobicContact CB-CD1 4.09Å; A422-Y470 HydrophobicContact CB-CD2 4.1Å; A422-Y470 HydrophobicContact CB-CE1 3.96Å; A422-Y470 HydrophobicContact CB-CE2 3.99Å; A422-Y470 HydrophobicContact CB-CG 4.15Å; R423-Y470 WeakPolarHBondContact CD-OH 3.38Å; A453-Y470 CarbonylContact C-O 3.19Å; A453-Y470 VanDerWaalsContact CA-O 3.3Å; A453-Y470 WeakPolarHBondContact CA-O 3.43Å; K454-Y470 HydrophobicContact CB-CD2 4.49Å; K454-Y470 HydrophobicContact CD-CD2 4.2Å; K454-Y470 PolarHBondContact N-O 3.33Å; K454-Y470 PolarHBondContact O-N 2.96Å; S456-Y470 VanDerWaalsContact OG-CE2 3.27Å; S456-Y470 WeakPolarHBondContact OG-CE2 3.33Å; Y470-Y472 WeakPolarHBondContact CB-OH 3.35Å
471	L	95.8	Very high	83.6	Confident	0 Å²	0	59.1 Å²	59.1	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	130.5	-174.7	-167.2	65.8	0	0	0	110.9	V310 V312 F321 L421 T443 L451 A453 I469 I482	V310-L471 HydrophobicContact CG2-CD1 3.66Å; V312-L471 HydrophobicContact CG2-CD2 3.96Å; F321-L471 HydrophobicContact CE2-CD2 4.26Å; F321-L471 HydrophobicContact CZ-CD2 4.41Å; L421-L471 HydrophobicContact CD2-CB 3.84Å; T443-L471 HydrophobicContact CG2-CD2 3.85Å; L451-L471 HydrophobicContact CB-CD1 4.01Å; L451-L471 HydrophobicContact CB-CG 4.47Å; L451-L471 HydrophobicContact CD1-CD1 4.05Å; L451-L471 HydrophobicContact CD1-CD2 3.78Å; L451-L471 HydrophobicContact CD1-CG 3.87Å; A453-L471 HydrophobicContact CB-CD1 4.05Å; I469-L471 HydrophobicContact CD1-CD1 4.36Å; L471-I482 HydrophobicContact CD2-CD1 4.15Å; L471-I482 HydrophobicContact CG-CD1 4.11Å; L471-I482 PolarHBondContact O-N 2.73Å
472	Y	93.8	Very high	84.8	Confident	14 Å²	14	56 Å²	56	6%	0.055	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.4	132.2	-168	-53.9	-68.8	0	0	0	113.1	L168 Y307 V452 K454 Y470 K479 L480 D481	L168-Y472 HydrophobicContact CD1-CD2 3.41Å; L168-Y472 VanDerWaalsContact CD1-CD2 3.41Å; L168-Y472 HydrophobicContact CD1-CE2 3.71Å; L168-Y472 HydrophobicContact CD1-CG 3.97Å; Y307-Y472 HydrophobicContact CE1-CE2 4.33Å; V452-Y472 PolarHBondContact N-O 2.87Å; V452-Y472 WeakPolarHBondContact O-CB 3.33Å; V452-Y472 WeakPolarHBondContact O-CD2 3.28Å; V452-Y472 PolarHBondContact O-N 3.21Å; K454-Y472 HydrophobicContact CB-CE2 4.13Å; Y470-Y472 WeakPolarHBondContact CB-OH 3.35Å; Y472-K479 HydrophobicContact CD1-CD 4.19Å; Y472-K479 HydrophobicContact CD1-CG 3.93Å; Y472-K479 HydrophobicContact CE1-CD 4.34Å; Y472-K479 HydrophobicContact CG-CG 4.3Å; Y472-K479 PolarHBondContact OH-NZ 3.12Å; Y472-L480 CarbonylContact C-O 3.56Å; Y472-L480 WeakPolarHBondContact CA-O 3.39Å; Y472-D481 HydrophobicContact CD1-CB 3.91Å; Y472-D481 HydrophobicContact CE1-CB 3.76Å; Y472-D481 WeakPolarHBondContact CE1-OD2 3.49Å
473	D	93.5	Very high	85.9	Confident	14 Å²	14	53.2 Å²	53.2	8%	0.075	29%	0.288	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	131.5	160.5	-174	3.2	0	0	0	109.4	K449 L451 S475 L480	K449-D473 WeakPolarHBondContact CE-OD1 3.35Å; K449-D473 IonicContact NZ-OD1 2.77Å; K449-D473 PolarHBondContact NZ-OD1 2.93Å; K449-D473 IonicContact NZ-OD2 3.42Å; K449-D473 PolarHBondContact NZ-OD2 2.9Å; L451-D473 HydrophobicContact CD2-CB 3.95Å; D473-S475 VanDerWaalsContact CG-OG 3.24Å; D473-S475 WeakPolarHBondContact OD1-CB 3.44Å; D473-S475 PolarHBondContact OD1-N 2.99Å; D473-S475 PolarHBondContact OD1-OG 2.91Å; D473-S475 PolarHBondContact OD2-OG 3.25Å; D473-S475 VanDerWaalsContact OD2-OG 3.05Å; D473-L480 HydrophobicContact CB-CB 4.39Å; D473-L480 PolarHBondContact N-O 3.34Å; D473-L480 PolarHBondContact O-N 2.72Å
474	T	87.4	Confident	87.2	Confident	36 Å²	36	49.5 Å²	49.5	22%	0.221	27%	0.27	C	S	.	.			trans	-120.3	3	177.4	61	0	0	0	0	113.2	L170 V452 N476 G477	L170-T474 HydrophobicContact CD2-CG2 4.34Å; V452-T474 HydrophobicContact CG2-CG2 4.11Å; T474-N476 VanDerWaalsContact C-N 3.32Å; T474-N476 PolarHBondContact O-N 3.42Å; T474-G477 PolarHBondContact O-N 2.73Å
475	S	81.1	Confident	88.6	Confident	68 Å²	68	49.1 Å²	49.1	48%	0.476	26%	0.262	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.1	-35.5	-171	56.4	0	0	0	0	114.2	K449 D473 G477	K449-S475 PolarHBondContact NZ-OG 2.97Å; K449-S475 VanDerWaalsContact NZ-OG 3.17Å; D473-S475 VanDerWaalsContact CG-OG 3.24Å; D473-S475 WeakPolarHBondContact OD1-CB 3.44Å; D473-S475 PolarHBondContact OD1-N 2.99Å; D473-S475 PolarHBondContact OD1-OG 2.91Å; D473-S475 PolarHBondContact OD2-OG 3.25Å; D473-S475 VanDerWaalsContact OD2-OG 3.05Å; S475-G477 VanDerWaalsContact C-N 3.29Å; S475-G477 PolarHBondContact O-N 2.72Å
476	N	74	Confident	89.6	Confident	139 Å²	139	45.9 Å²	45.9	74%	0.743	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	-87.5	16	-178.6	-70	-51.4	0	0	0	114.1	T474 K478	T474-N476 VanDerWaalsContact C-N 3.32Å; T474-N476 PolarHBondContact O-N 3.42Å; N476-K478 PolarHBondContact O-N 3.39Å
477	G	68.6	Low	90.2	Very high	62 Å²	62	45 Å²	45	64%	0.639	24%	0.243	S	C	*	.	S	Bend	trans	68.8	1.5	-176.3	0	0	0	0	0	114.7	T474 S475	T474-G477 PolarHBondContact O-N 2.73Å; S475-G477 VanDerWaalsContact C-N 3.29Å; S475-G477 PolarHBondContact O-N 2.72Å
478	K	75.1	Confident	90.6	Very high	172 Å²	172	52.1 Å²	52.1	75%	0.748	28%	0.276	S	S	*	.	S	Bend	trans	-111.6	144.5	166.8	-65.2	-177.7	179.7	-179.7	0	108.4	N476	N476-K478 PolarHBondContact O-N 3.39Å
479	K	84.6	Confident	90.9	Very high	98 Å²	98	53.7 Å²	53.7	43%	0.426	28%	0.283	S	S	.	.			trans	-78.2	114.9	166.8	178.3	-172.3	176.1	-174.8	0	108.5	L168 Y472	L168-K479 HydrophobicContact CB-CD 3.99Å; L168-K479 HydrophobicContact CD1-CD 4.1Å; Y472-K479 HydrophobicContact CD1-CD 4.19Å; Y472-K479 HydrophobicContact CD1-CG 3.93Å; Y472-K479 HydrophobicContact CE1-CD 4.34Å; Y472-K479 HydrophobicContact CG-CG 4.3Å; Y472-K479 PolarHBondContact OH-NZ 3.12Å
480	L	92.4	Very high	91.1	Very high	60 Å²	60	55.6 Å²	55.6	31%	0.314	30%	0.303	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	126.8	166.2	-179.6	64.7	0	0	0	108.2	L442 Y472 D473 E485	L442-L480 HydrophobicContact CD2-CD2 4.05Å; Y472-L480 CarbonylContact C-O 3.56Å; Y472-L480 WeakPolarHBondContact CA-O 3.39Å; D473-L480 HydrophobicContact CB-CB 4.39Å; D473-L480 PolarHBondContact N-O 3.34Å; D473-L480 PolarHBondContact O-N 2.72Å; L480-E485 HydrophobicContact CD1-CB 4.07Å; L480-E485 HydrophobicContact CD1-CG 4.17Å; L480-E485 HydrophobicContact CD2-CG 4.47Å
481	D	95.1	Very high	91.2	Very high	28 Å²	28	56.7 Å²	56.7	15%	0.15	31%	0.308	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	119	170.7	-174.4	-46.6	0	0	0	108.7	Y472 G483 L484 E485	Y472-D481 HydrophobicContact CD1-CB 3.91Å; Y472-D481 HydrophobicContact CE1-CB 3.76Å; Y472-D481 WeakPolarHBondContact CE1-OD2 3.49Å; D481-G483 VanDerWaalsContact C-N 3.35Å; D481-G483 WeakPolarHBondContact OD1-CA 3.24Å; D481-G483 PolarHBondContact OD1-N 2.92Å; D481-L484 HydrophobicContact CB-CB 4.05Å; D481-L484 HydrophobicContact CB-CD1 4.04Å; D481-L484 HydrophobicContact CB-CG 4.11Å; D481-L484 PolarHBondContact OD1-N 3.11Å; D481-E485 VanDerWaalsContact O-CB 3.25Å; D481-E485 WeakPolarHBondContact O-CB 3.26Å; D481-E485 PolarHBondContact O-N 3.43Å
482	I	97.4	Very high	91.3	Very high	0 Å²	0	56.9 Å²	56.9	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-71.1	-33.3	-174	-65.4	179.8	0	0	0	111	F439 L442 T443 L451 L471 L486	F439-I482 HydrophobicContact CD2-CG2 3.9Å; F439-I482 HydrophobicContact CE2-CG2 3.98Å; L442-I482 HydrophobicContact CB-CD1 4.46Å; L442-I482 HydrophobicContact CB-CG1 4.38Å; L442-I482 HydrophobicContact CB-CG2 3.95Å; L442-I482 HydrophobicContact CD1-CG2 4.22Å; T443-I482 HydrophobicContact CG2-CD1 3.98Å; T443-I482 HydrophobicContact CG2-CG2 4.21Å; L451-I482 HydrophobicContact CD1-CD1 3.91Å; L451-I482 HydrophobicContact CD2-CD1 4.29Å; L471-I482 HydrophobicContact CD2-CD1 4.15Å; L471-I482 HydrophobicContact CG-CD1 4.11Å; L471-I482 PolarHBondContact O-N 2.73Å; I482-L486 WeakPolarHBondContact O-CG 3.3Å; I482-L486 PolarHBondContact O-N 3.15Å
483	G	97	Very high	91.5	Very high	2 Å²	2	60.1 Å²	60.1	2%	0.021	33%	0.327	C	S	.	.	H	α-helix	trans	-67.4	-49.2	175.6	0	0	0	0	0	111.4	D481 E485 L486 V487	D481-G483 VanDerWaalsContact C-N 3.35Å; D481-G483 WeakPolarHBondContact OD1-CA 3.24Å; D481-G483 PolarHBondContact OD1-N 2.92Å; G483-E485 VanDerWaalsContact C-N 3.29Å; G483-E485 PolarHBondContact O-N 3.37Å; G483-L486 PolarHBondContact O-N 3.12Å; G483-V487 WeakPolarHBondContact O-CG2 3.46Å; G483-V487 PolarHBondContact O-N 3.29Å; G483-V487 VanDerWaalsContact O-N 3.11Å
484	L	96.3	Very high	91.6	Very high	77 Å²	77	64 Å²	64	40%	0.403	34%	0.344	S	S	.	.	H	α-helix	trans	-67.8	-28	178.8	-59.8	178.6	0	0	0	112.9	D481 V487 H488 E494	D481-L484 HydrophobicContact CB-CB 4.05Å; D481-L484 HydrophobicContact CB-CD1 4.04Å; D481-L484 HydrophobicContact CB-CG 4.11Å; D481-L484 PolarHBondContact OD1-N 3.11Å; L484-V487 PolarHBondContact O-N 3.48Å; L484-H488 WeakPolarHBondContact O-CB 3.21Å; L484-H488 PolarHBondContact O-N 3.46Å; L484-E494 HydrophobicContact CD2-CG 4.34Å
485	E	97.4	Very high	91.9	Very high	43 Å²	43	65.8 Å²	65.8	20%	0.201	35%	0.352	C	S	.	.	H	α-helix	trans	-70.6	-34.6	173.9	-178.1	65.6	-170.3	0	0	112.1	L442 L480 D481 G483 H488 K489	L442-E485 HydrophobicContact CD1-CB 4.25Å; L442-E485 HydrophobicContact CD1-CG 3.82Å; L442-E485 HydrophobicContact CD2-CG 3.89Å; L480-E485 HydrophobicContact CD1-CB 4.07Å; L480-E485 HydrophobicContact CD1-CG 4.17Å; L480-E485 HydrophobicContact CD2-CG 4.47Å; D481-E485 VanDerWaalsContact O-CB 3.25Å; D481-E485 WeakPolarHBondContact O-CB 3.26Å; D481-E485 PolarHBondContact O-N 3.43Å; G483-E485 VanDerWaalsContact C-N 3.29Å; G483-E485 PolarHBondContact O-N 3.37Å; E485-H488 PolarHBondContact O-N 3.16Å; E485-K489 VanDerWaalsContact CD-CE 3.42Å; E485-K489 WeakPolarHBondContact O-CD 3.41Å; E485-K489 WeakPolarHBondContact O-CE 3.48Å; E485-K489 WeakPolarHBondContact O-CG 3.18Å; E485-K489 PolarHBondContact O-N 2.91Å; E485-K489 WeakPolarHBondContact OE1-CE 3.31Å; E485-K489 IonicContact OE1-NZ 3.89Å; E485-K489 PolarHBondContact OE1-NZ 3.25Å
486	L	98	Very high	92.2	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	36%	0.362	C	S	.	.	H	α-helix	trans	-65.5	-41.4	169.2	-69.6	174.3	0	0	0	111.6	P318 L421 E438 F439 L442 I482 G483 K489 G490 Y491 A492	P318-L486 HydrophobicContact CB-CD1 4.06Å; P318-L486 HydrophobicContact CG-CD1 3.88Å; L421-L486 HydrophobicContact CD1-CD1 4.23Å; E438-L486 HydrophobicContact CB-CD2 4.4Å; E438-L486 HydrophobicContact CG-CD2 4.16Å; F439-L486 HydrophobicContact CB-CD1 4.48Å; F439-L486 HydrophobicContact CD2-CD1 4.04Å; L442-L486 HydrophobicContact CD1-CD2 4.19Å; L442-L486 HydrophobicContact CD1-CG 4.41Å; I482-L486 WeakPolarHBondContact O-CG 3.3Å; I482-L486 PolarHBondContact O-N 3.15Å; G483-L486 PolarHBondContact O-N 3.12Å; L486-K489 PolarHBondContact O-N 2.94Å; L486-G490 PolarHBondContact O-N 3.11Å; L486-Y491 HydrophobicContact CD2-CD2 4.06Å; L486-Y491 PolarHBondContact O-N 3.43Å; L486-Y491 VanDerWaalsContact O-N 3.15Å; L486-A492 HydrophobicContact CB-CB 3.86Å
487	V	97.9	Very high	92.4	Very high	43 Å²	43	67.6 Å²	67.6	26%	0.261	36%	0.358	S	S	.	.	H	α-helix	trans	-63.6	-42.2	174.8	177.7	0	0	0	0	110.9	I424 G483 L484 K489 G490 A492 E494	I424-V487 HydrophobicContact CD1-CG2 3.75Å; G483-V487 WeakPolarHBondContact O-CG2 3.46Å; G483-V487 PolarHBondContact O-N 3.29Å; G483-V487 VanDerWaalsContact O-N 3.11Å; L484-V487 PolarHBondContact O-N 3.48Å; V487-K489 PolarHBondContact O-N 3.2Å; V487-G490 PolarHBondContact O-N 3.1Å; V487-A492 WeakPolarHBondContact CA-O 3.35Å; V487-A492 HydrophobicContact CG2-CB 3.83Å; V487-E494 HydrophobicContact CG2-CB 4.37Å
488	H	97.6	Very high	92	Very high	153 Å²	153	69.8 Å²	69.8	71%	0.708	36%	0.355	S	S	*	.	H	α-helix	trans	-61.6	-29.2	178.1	-174.7	40.7	0	0	0	113.1	L484 E485	L484-H488 WeakPolarHBondContact O-CB 3.21Å; L484-H488 PolarHBondContact O-N 3.46Å; E485-H488 PolarHBondContact O-N 3.16Å
489	K	97.4	Very high	90.6	Very high	80 Å²	80	69 Å²	69	35%	0.348	36%	0.357	S	S	.	.	H	α-helix	trans	-84.6	-10.9	176.2	-68.3	163.3	-159	-81.4	0	114.2	E438 E485 L486 V487 Y491	E438-K489 HydrophobicContact CG-CD 3.77Å; E438-K489 WeakPolarHBondContact OE1-CD 3.48Å; E438-K489 WeakPolarHBondContact OE1-CE 3.47Å; E438-K489 IonicContact OE1-NZ 3.72Å; E438-K489 PolarHBondContact OE1-NZ 3.19Å; E485-K489 VanDerWaalsContact CD-CE 3.42Å; E485-K489 WeakPolarHBondContact O-CD 3.41Å; E485-K489 WeakPolarHBondContact O-CE 3.48Å; E485-K489 WeakPolarHBondContact O-CG 3.18Å; E485-K489 PolarHBondContact O-N 2.91Å; E485-K489 WeakPolarHBondContact OE1-CE 3.31Å; E485-K489 IonicContact OE1-NZ 3.89Å; E485-K489 PolarHBondContact OE1-NZ 3.25Å; L486-K489 PolarHBondContact O-N 2.94Å; V487-K489 PolarHBondContact O-N 3.2Å; K489-Y491 HydrophobicContact CB-CD2 3.73Å; K489-Y491 HydrophobicContact CB-CE2 3.94Å; K489-Y491 HydrophobicContact CB-CG 4.38Å; K489-Y491 HydrophobicContact CD-CD2 4.15Å; K489-Y491 HydrophobicContact CD-CE2 4.01Å
490	G	97.4	Very high	88.5	Confident	43 Å²	43	71.8 Å²	71.8	44%	0.443	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	86.3	3	-177.4	0	0	0	0	0	115.2	S427 L486 V487 A492	S427-G490 WeakPolarHBondContact CB-O 3.38Å; S427-G490 PolarHBondContact OG-O 2.75Å; L486-G490 PolarHBondContact O-N 3.11Å; V487-G490 PolarHBondContact O-N 3.1Å; G490-A492 VanDerWaalsContact C-N 3.29Å
491	Y	97.9	Very high	85.9	Confident	58 Å²	58	78.7 Å²	78.7	23%	0.227	40%	0.403	C	S	.	.	S	Bend	trans	-75.5	-18	176.7	-64.8	-41.9	0	0	0	113.6	S427 W431 E434 A435 E438 L486 K489	S427-Y491 PolarHBondContact N-O 3.24Å; S427-Y491 PolarHBondContact OG-O 3.02Å; W431-Y491 VanDerWaalsContact CZ3-O 3.28Å; W431-Y491 WeakPolarHBondContact CZ3-O 3.36Å; E434-Y491 HydrophobicContact CB-CE1 3.9Å; A435-Y491 HydrophobicContact CB-CD1 3.95Å; A435-Y491 HydrophobicContact CB-CD2 4.28Å; A435-Y491 HydrophobicContact CB-CG 3.72Å; E438-Y491 HydrophobicContact CB-CD2 4.2Å; E438-Y491 HydrophobicContact CB-CE2 3.7Å; E438-Y491 HydrophobicContact CG-CD2 4.27Å; E438-Y491 HydrophobicContact CG-CE2 3.86Å; L486-Y491 HydrophobicContact CD2-CD2 4.06Å; L486-Y491 PolarHBondContact O-N 3.43Å; L486-Y491 VanDerWaalsContact O-N 3.15Å; K489-Y491 HydrophobicContact CB-CD2 3.73Å; K489-Y491 HydrophobicContact CB-CE2 3.94Å; K489-Y491 HydrophobicContact CB-CG 4.38Å; K489-Y491 HydrophobicContact CD-CD2 4.15Å; K489-Y491 HydrophobicContact CD-CE2 4.01Å
492	A	97.8	Very high	83.2	Confident	4 Å²	4	84.4 Å²	84.4	3%	0.033	43%	0.433	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	163.9	-172.5	0	0	0	0	0	112.2	I424 A425 W431 L486 V487 G490	I424-A492 HydrophobicContact CG2-CB 4.04Å; A425-A492 CarbonylContact O-C 3.56Å; A425-A492 WeakPolarHBondContact O-CA 3.45Å; A425-A492 WeakPolarHBondContact O-CB 3.44Å; W431-A492 HydrophobicContact CH2-CB 3.73Å; W431-A492 HydrophobicContact CZ3-CB 3.96Å; L486-A492 HydrophobicContact CB-CB 3.86Å; V487-A492 WeakPolarHBondContact CA-O 3.35Å; V487-A492 HydrophobicContact CG2-CB 3.83Å; G490-A492 VanDerWaalsContact C-N 3.29Å
493	I	97.1	Very high	80.1	Confident	83 Å²	83	94.7 Å²	94.7	43%	0.426	47%	0.472	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	146.6	167.1	58.9	177.3	0	0	0	111	A425 L495	A425-I493 HydrophobicContact CB-CD1 4.47Å; A425-I493 HydrophobicContact CB-CG1 3.99Å; A425-I493 PolarHBondContact N-O 3.07Å; A425-I493 PolarHBondContact O-N 3.1Å; I493-L495 HydrophobicContact CD1-CD2 4.48Å
494	E	96.7	Very high	77.2	Confident	94 Å²	94	98.9 Å²	98.9	44%	0.439	51%	0.506	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.3	119.1	172.5	-167.2	-174.2	164.9	0	0	109.4	R423 L484 V487	R423-E494 IonicContact CZ-OE1 3.75Å; R423-E494 IonicContact NH1-OE1 2.7Å; R423-E494 PolarHBondContact NH1-OE1 3.41Å; R423-E494 IonicContact NH2-OE1 2.71Å; R423-E494 PolarHBondContact NH2-OE1 2.83Å; R423-E494 CarbonylContact O-C 3.56Å; R423-E494 WeakPolarHBondContact O-CA 3.36Å; L484-E494 HydrophobicContact CD2-CG 4.34Å; V487-E494 HydrophobicContact CG2-CB 4.37Å
495	L	92.4	Very high	74.1	Confident	74 Å²	74	101.6 Å²	101.6	39%	0.387	53%	0.525	S	S	.	.	P	Polyproline II helix	trans	-77.7	154.3	175.5	-59.3	178.2	0	0	0	110.7	R423 A425 I493	R423-L495 HydrophobicContact CB-CB 4.41Å; R423-L495 PolarHBondContact NE-O 2.96Å; R423-L495 PolarHBondContact NH2-O 3.28Å; R423-L495 PolarHBondContact O-N 3.16Å; A425-L495 HydrophobicContact CB-CD1 4.16Å; A425-L495 HydrophobicContact CB-CD2 4Å; A425-L495 HydrophobicContact CB-CG 4.14Å; I493-L495 HydrophobicContact CD1-CD2 4.48Å
496	P	88.4	Confident	71	Confident	106 Å²	106	104 Å²	104	69%	0.688	55%	0.545	S	S	*	.	P	Polyproline II helix	trans	-53.7	163	166.1	-24.6	35.2	0	0	0	112.6
497	E	77.1	Confident	68	Low	139 Å²	139	109.6 Å²	109.6	65%	0.65	58%	0.575	S	S	*	*	P	Polyproline II helix	trans	-65.5	141.9	162.8	-73.8	-175.2	136.2	0	0	109.9	I499	E497-I499 VanDerWaalsContact C-N 3.32Å; E497-I499 PolarHBondContact O-N 2.85Å
498	D	60	Low	65.3	Low	108 Å²	108	115.2 Å²	115.2	58%	0.578	60%	0.6	S	S	*	*			trans	-65.2	90	173.2	-63.3	-53.4	0	0	0	108.6	K468 E500	K468-D498 IonicContact NZ-OD1 2.72Å; K468-D498 IonicContact NZ-OD2 3.97Å; K468-D498 PolarHBondContact NZ-OD2 2.84Å; D498-E500 PolarHBondContact O-N 2.88Å; D498-E500 VanDerWaalsContact O-N 3.12Å
499	I	45.7	Very low	62.2	Low	155 Å²	155	116.1 Å²	116.1	80%	0.795	61%	0.61	S	S	*	*			trans	-61.9	116.4	176	-59.5	177.7	0	0	0	107.8	E497 E501	E497-I499 VanDerWaalsContact C-N 3.32Å; E497-I499 PolarHBondContact O-N 2.85Å; I499-E501 PolarHBondContact O-N 2.66Å; I499-E501 VanDerWaalsContact O-N 3.12Å
500	E	42.5	Very low	59.3	Low	158 Å²	158	119.6 Å²	119.6	74%	0.738	62%	0.624	S	S	*	*			trans	-51.7	119.1	178.9	-62.7	-175	137.3	0	0	111.5	D498 N502	D498-E500 PolarHBondContact O-N 2.88Å; D498-E500 VanDerWaalsContact O-N 3.12Å; E500-N502 HydrophobicContact CB-CB 4.35Å; E500-N502 PolarHBondContact O-N 3.2Å
501	E	37.3	Very low	56.3	Low	205 Å²	205	124.9 Å²	124.9	96%	0.958	64%	0.643	S	S	*	*	T	Hydrogen-bonded Turn	trans	-70	30.3	171	-66	-160.1	128.8	0	0	112.9	I499	I499-E501 PolarHBondContact O-N 2.66Å; I499-E501 VanDerWaalsContact O-N 3.12Å
502	N	37	Very low	53.1	Low	148 Å²	148	131.2 Å²	131.2	79%	0.791	68%	0.677	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.4	9.5	-177.7	-133.7	-8.9	0	0	0	112.7	E500	E500-N502 HydrophobicContact CB-CB 4.35Å; E500-N502 PolarHBondContact O-N 3.2Å
503	R	32.5	Very low	49.9	Very low	216 Å²	216	136 Å²	136	82%	0.815	72%	0.717	S	S	*	*	S	Bend	trans	-92.6	99.2	167.9	-169.6	172.5	-61	-174.5	5.2	110.1	V505	R503-V505 PolarHBondContact O-N 2.94Å
504	A	36.4	Very low	46.8	Very low	89 Å²	89	138 Å²	138	74%	0.736	73%	0.732	S	S	*	*	P	Polyproline II helix	trans	-50.2	129.6	172.5	0	0	0	0	0	111.1	P506	A504-P506 VanDerWaalsContact O-CD 3.29Å; A504-P506 WeakPolarHBondContact O-CD 3.29Å
505	V	30.7	Very low	43.6	Very low	134 Å²	134	142.2 Å²	142.2	81%	0.812	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-59	119.5	-171.4	-178.2	0	0	0	0	110.9	R503 D507	R503-V505 PolarHBondContact O-N 2.94Å; V505-D507 PolarHBondContact O-N 3.09Å
506	P	33	Very low	40.7	Very low	95 Å²	95	145.4 Å²	145.4	62%	0.617	78%	0.775	S	S	*	*	P	Polyproline II helix	trans	-66.4	124.9	171.3	-19.9	33.7	0	0	0	110.3	A504 M508	A504-P506 VanDerWaalsContact O-CD 3.29Å; A504-P506 WeakPolarHBondContact O-CD 3.29Å; P506-M508 PolarHBondContact O-N 3.43Å
507	D	35.4	Very low	37.9	Very low	117 Å²	117	148 Å²	148	63%	0.626	78%	0.783	S	S	*	*	S	Bend	trans	-75.9	63.6	-172.1	-164.3	22	0	0	0	112.6	V505 K510	V505-D507 PolarHBondContact O-N 3.09Å; D507-K510 IonicContact OD1-NZ 2.99Å; D507-K510 PolarHBondContact OD1-NZ 2.9Å; D507-K510 IonicContact OD2-NZ 3.24Å; D507-K510 PolarHBondContact OD2-NZ 3.47Å
508	M	40.2	Very low	35.5	Very low	160 Å²	160	145 Å²	145	79%	0.788	78%	0.783	S	S	*	*			trans	-134.2	17.6	-170.6	-77	-88.3	70	0	0	115.2	P506	P506-M508 PolarHBondContact O-N 3.43Å
509	L	34.1	Very low	34.1	Very low	173 Å²	173	145.1 Å²	145.1	91%	0.906	79%	0.792	S	S	*	*			trans	-134.9	61.5	165.5	-75.7	-179.6	0	0	0	111.9
510	K	35.3	Very low	33.3	Very low	152 Å²	152	146.4 Å²	146.4	66%	0.661	80%	0.799	S	S	*	*			trans	-108	94.6	153.9	-68.7	-169.2	-170	85.9	0	108.7	D507	D507-K510 IonicContact OD1-NZ 2.99Å; D507-K510 PolarHBondContact OD1-NZ 2.9Å; D507-K510 IonicContact OD2-NZ 3.24Å; D507-K510 PolarHBondContact OD2-NZ 3.47Å
511	D	34.1	Very low	32.7	Very low	155 Å²	155	144.2 Å²	144.2	83%	0.829	80%	0.801	S	S	*	*	S	Bend	trans	175.2	164.9	139	-90.4	-17.5	0	0	0	110
512	M	32.2	Very low	32.5	Very low	190 Å²	190	140.7 Å²	140.7	94%	0.936	79%	0.794	S	S	*	*			trans	70.2	58.1	174.3	-54.2	-168.3	67.7	0	0	117.9
513	A	28.8	Very low	32.1	Very low	106 Å²	106	141.7 Å²	141.7	88%	0.876	80%	0.798	S	S	*	*			trans	-146.5	75.2	154.6	0	0	0	0	0	111.6
514	T	32.4	Very low	32	Very low	123 Å²	123	139.6 Å²	139.6	76%	0.755	80%	0.803	S	S	*	*			trans	-93.3	131	167.9	47.6	0	0	0	0	110.2
515	E	30.1	Very low	31.6	Very low	183 Å²	183	141.8 Å²	141.8	86%	0.855	81%	0.807	S	S	*	*			trans	63.7	117.6	166.1	-58.2	169.8	-155.5	0	0	114.3
516	T	31	Very low	31.4	Very low	142 Å²	142	144.6 Å²	144.6	87%	0.871	81%	0.811	S	S	*	*			cis	-145	170.9	29.7	47.1	0	0	0	0	113.8
517	D	29.5	Very low	31.1	Very low	160 Å²	160	146.2 Å²	146.2	86%	0.856	82%	0.82	S	S	*	*			trans	-92.7	169.3	-169.2	-175.8	33	0	0	0	115.3
518	A	27.7	Very low	30.7	Very low	77 Å²	77	150.6 Å²	150.6	64%	0.636	83%	0.833	S	S	*	*			trans	110.5	130.5	148.8	0	0	0	0	0	119.2
519	S	30.8	Very low	30.1	Very low	110 Å²	110	152.2 Å²	152.2	77%	0.769	84%	0.836	S	S	*	*	S	Bend	trans	80.5	77.1	164.2	-49.3	0	0	0	0	118.9
520	L	28.4	Very low	29.7	Very low	181 Å²	181	151 Å²	151	95%	0.948	83%	0.83	S	S	*	*				-165.9	43	124.3	-107.3	170.8	0	0	0	113.3
521	S	30.1	Very low	29.4	Very low	113 Å²	113	149.6 Å²	149.6	79%	0.79	84%	0.839	S	S	*	*			trans	-111.6	43.7	-173.9	64.9	0	0	0	0	113.8
522	T	32.2	Very low	28.9	Very low	131 Å²	131	145.9 Å²	145.9	80%	0.804	84%	0.837	S	S	*	*	S	Bend	trans	-150.2	78.7	-179.1	-4.6	0	0	0	0	112.1
523	L	29.4	Very low	28.6	Very low	168 Å²	168	145.9 Å²	145.9	88%	0.88	84%	0.835	S	S	*	*	S	Bend	trans	-172.5	-3.3	154.7	-109.2	167.3	0	0	0	115.8
524	L	30.9	Very low	28.8	Very low	173 Å²	173	148.3 Å²	148.3	91%	0.906	83%	0.832	S	S	*	*			trans	-122	58.9	-177.2	-70.7	177.6	0	0	0	114.3
525	T	27	Very low	28.4	Very low	134 Å²	134	148.6 Å²	148.6	82%	0.822	83%	0.833	S	S	*	*			trans	-147.9	93.1	165.3	51.8	0	0	0	0	112.7
526	E	27.1	Very low	28.3	Very low	194 Å²	194	148 Å²	148	91%	0.907	83%	0.83	S	S	*	*			trans	170.8	135.7	142.4	-98.7	177	-160.2	0	0	108.2
527	T	27.2	Very low	28	Very low	129 Å²	129	148.3 Å²	148.3	79%	0.791	83%	0.832	S	S	*	*			cis	-130.1	152.3	6.7	56.1	0	0	0	0	111.7
528	K	26.1	Very low	27.9	Very low	208 Å²	208	147.9 Å²	147.9	90%	0.904	83%	0.829	S	S	*	*			trans	-139.7	99.4	173.5	-177.5	174.6	-178.8	170.8	0	111.8
529	K	27.3	Very low	28	Very low	195 Å²	195	149.8 Å²	149.8	85%	0.848	84%	0.838	S	S	*	*			trans	-166.3	145.4	167.4	-102	-169.5	169.4	179.8	0	108.2
530	N	26.1	Very low	27.8	Very low	147 Å²	147	149.8 Å²	149.8	79%	0.786	84%	0.836	S	S	*	*			cis	-119	175.5	-1.9	-78.9	-22.6	0	0	0	110.3
531	S	28.3	Very low	27.6	Very low	123 Å²	123	148.3 Å²	148.3	86%	0.86	83%	0.829	S	S	*	*			trans	-116.7	143.1	171.2	58.2	0	0	0	0	112.2
532	G	24.8	Very low	27.7	Very low	76 Å²	76	148.6 Å²	148.6	78%	0.784	83%	0.831	S	S	*	*			trans	130.3	134.3	-179.7	0	0	0	0	0	109.6
533	E	25.4	Very low	27.4	Very low	191 Å²	191	150.3 Å²	150.3	89%	0.893	83%	0.834	S	S	*	*			cis	-118.8	173.1	13.2	-70.3	176.6	100.9	0	0	113.7
534	I	32.3	Very low	27.6	Very low	156 Å²	156	148 Å²	148	80%	0.8	83%	0.832	S	S	*	*			trans	-102	119.7	172.5	-61.2	168.5	0	0	0	108.1
535	T	25.4	Very low	27.6	Very low	129 Å²	129	149.4 Å²	149.4	79%	0.791	83%	0.834	S	S	*	*			trans	-127.1	132.3	167.2	45.3	0	0	0	0	110.3
536	H	27.6	Very low	27.7	Very low	171 Å²	171	147.4 Å²	147.4	79%	0.792	83%	0.831	S	S	*	*	P	Polyproline II helix	trans	-77.5	122.4	-176.2	-62.3	-100.4	0	0	0	111
537	T	25.1	Very low	27.9	Very low	148 Å²	148	142.8 Å²	142.8	91%	0.908	83%	0.826	S	S	*	*	P	Polyproline II helix	trans	-82.4	118.1	156.1	31.2	0	0	0	0	109.2
538	L	27	Very low	28	Very low	151 Å²	151	141.8 Å²	141.8	79%	0.791	83%	0.825	S	S	*	*	P	Polyproline II helix	trans	-82.8	139.5	-173.8	-76.6	162.8	0	0	0	112.1	C540	L538-C540 PolarHBondContact O-N 3.17Å
539	S	29.8	Very low	28.2	Very low	118 Å²	118	140.3 Å²	140.3	83%	0.825	82%	0.823	S	S	*	*			trans	-68.6	108.9	164.6	56.2	0	0	0	0	111
540	C	25.4	Very low	28.3	Very low	109 Å²	109	136.5 Å²	136.5	74%	0.736	82%	0.821	S	S	*	*			trans	-155.4	152.2	170.2	-90.6	0	0	0	0	108.5	L538	L538-C540 PolarHBondContact O-N 3.17Å
541	L	25.7	Very low	28.5	Very low	151 Å²	151	133.4 Å²	133.4	79%	0.791	82%	0.823	S	S	*	*			cis	-171.5	149	-28.5	-122.3	176.5	0	0	0	104.5	L543	L541-L543 PolarHBondContact O-N 3.47Å
542	S	32.2	Very low	28.7	Very low	118 Å²	118	134.8 Å²	134.8	83%	0.825	82%	0.821	S	S	*	*			trans	-66.1	123.8	177.2	-54.9	0	0	0	0	111.3
543	L	26.1	Very low	29.1	Very low	168 Å²	168	137.9 Å²	137.9	88%	0.88	82%	0.82	S	S	*	*			trans	-121.2	113.6	161.3	-74.6	176.6	0	0	0	109.6	L541	L541-L543 PolarHBondContact O-N 3.47Å
544	S	32.8	Very low	29.4	Very low	120 Å²	120	134.8 Å²	134.8	84%	0.839	81%	0.81	S	S	*	*			trans	-78.7	135.1	161.2	53.7	0	0	0	0	109.1
545	E	30.8	Very low	29.5	Very low	201 Å²	201	136 Å²	136	94%	0.939	82%	0.816	S	S	*	*			trans	-129.4	149.5	165.6	-166.8	153.8	-129.1	0	0	110.5
546	A	29.4	Very low	30.2	Very low	93 Å²	93	138.6 Å²	138.6	77%	0.769	82%	0.82	S	S	*	*			trans	-131.7	123	-173	0	0	0	0	0	110.8
547	A	31.5	Very low	30.8	Very low	97 Å²	97	137.6 Å²	137.6	80%	0.802	82%	0.82	S	S	*	*			trans	-109.2	122.2	156.1	0	0	0	0	0	106.5
548	S	28.9	Very low	31.5	Very low	108 Å²	108	138.1 Å²	138.1	76%	0.755	82%	0.818	S	S	*	*			cis	65.4	69.8	39	-154.8	0	0	0	0	112.6
549	M	30	Very low	32.2	Very low	177 Å²	177	140.3 Å²	140.3	87%	0.872	82%	0.817	S	S	*	*			trans	-122.3	102.6	154.5	-79.8	-90.9	66.7	0	0	108.3
550	S	30.4	Very low	32.6	Very low	115 Å²	115	142.3 Å²	142.3	80%	0.804	82%	0.817	S	S	*	*			trans	-77.7	125.6	167.4	52.5	0	0	0	0	109.5
551	G	29.3	Very low	33.2	Very low	81 Å²	81	148.9 Å²	148.9	84%	0.835	84%	0.844	S	S	*	*			trans	-158	71.2	178.7	0	0	0	0	0	109.4
552	D	32	Very low	33.6	Very low	152 Å²	152	148.8 Å²	148.8	81%	0.813	85%	0.846	S	S	*	*			trans	-101.1	116.2	-178	-174.6	20.5	0	0	0	108.9
553	D	34	Very low	33.7	Very low	142 Å²	142	150.4 Å²	150.4	76%	0.759	85%	0.847	S	S	*	*			trans	-159.1	97.4	160.7	-124.9	-27.6	0	0	0	112.2
554	N	31.2	Very low	34.1	Very low	126 Å²	126	149.4 Å²	149.4	67%	0.674	85%	0.845	S	S	*	*			trans	29.8	118.3	139.5	-57	-74.9	0	0	0	120.1
555	L	35	Very low	34.2	Very low	180 Å²	180	151.1 Å²	151.1	94%	0.942	85%	0.846	S	S	*	*			trans	-146.9	139.5	130.9	-106	171.2	0	0	0	109
556	E	39.2	Very low	34.4	Very low	185 Å²	185	148 Å²	148	86%	0.864	84%	0.84	S	S	*	*			trans	-84.6	164.3	-166.5	-64.3	179.1	113.8	0	0	114
557	D	40.3	Very low	34.7	Very low	149 Å²	149	151.7 Å²	151.7	80%	0.797	85%	0.845	S	S	*	*			trans	-57	149	164.8	-73.7	-59.8	0	0	0	111.5
558	D	40.5	Very low	34.9	Very low	160 Å²	160	155.6 Å²	155.6	86%	0.856	85%	0.848	S	S	*	*			trans	-143	145.3	140.7	-149.9	-6.8	0	0	0	111.4
559	Y	41.9	Very low	35.4	Very low	197 Å²	197	159.2 Å²	159.2	77%	0.773	86%	0.855	S	S	*	*			trans	-98.6	165.2	-177.9	-97.2	-107.7	0	0	0	111
560	L	38.8	Very low	35.8	Very low	159 Å²	159	157.8 Å²	157.8	83%	0.832	85%	0.854	S	S	*	*			trans	96.6	92.5	165.9	-53.6	163.4	0	0	0	117.3
561	L	37.4	Very low	36.3	Very low	247 Å²	247	161.6 Å²	161.6	100%	1.293	86%	0.858	S	S	*	*				-170.8	0	93.9	-101	163.1	0	0	0	113.2

Retrieved 561 of 561 residues in 119.5 ms (Link to these results)

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