A0A5K4F8F9_SCHMA Loading...

SH3 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4F8F9, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 237 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	46.7	Very low	62.1	Low	201 Å²	201	113.8 Å²	113.8	99%	0.99	58%	0.577	S	S	*	*				0	102	0	-80	-78.3	-161.4	0	0	105.5	L6	M1-L6 HydrophobicContact CB-CD1 4.19Å
2	D	58.7	Low	62.3	Low	127 Å²	127	110.6 Å²	110.6	68%	0.679	56%	0.558	S	S	*	*			trans	-65.3	136.7	-177.8	-66.6	-26.3	0	0	0	109.7	A4 N5 L6	D2-A4 PolarHBondContact O-N 3.24Å; D2-N5 WeakPolarHBondContact O-CB 3.3Å; D2-N5 PolarHBondContact O-N 2.98Å; D2-L6 PolarHBondContact O-N 2.98Å
3	Q	59.8	Low	62.3	Low	159 Å²	159	108 Å²	108	74%	0.743	55%	0.552	S	S	*	*	H	α-helix	trans	-49.5	-35.8	-178.7	-163.6	101.3	-0.1	0	0	112.4	N5 L6 E7	Q3-N5 VanDerWaalsContact C-N 3.32Å; Q3-N5 PolarHBondContact O-N 3.48Å; Q3-L6 PolarHBondContact O-N 2.91Å; Q3-E7 PolarHBondContact O-N 3.3Å; Q3-E7 VanDerWaalsContact O-N 3.13Å
4	A	63.1	Low	62.5	Low	75 Å²	75	108.4 Å²	108.4	62%	0.62	55%	0.55	S	S	*	*	H	α-helix	trans	-63.6	-34.7	178.3	0	0	0	0	0	113.4	D2 E8	D2-A4 PolarHBondContact O-N 3.24Å; A4-E8 WeakPolarHBondContact O-CB 3.42Å; A4-E8 PolarHBondContact O-N 3.1Å
5	N	67.8	Low	62.5	Low	83 Å²	83	108.5 Å²	108.5	44%	0.444	54%	0.541	S	S	.	.	H	α-helix	trans	-74.5	-34.5	-180	-162.2	-20.2	0	0	0	110.9	D2 Q3 V9	D2-N5 WeakPolarHBondContact O-CB 3.3Å; D2-N5 PolarHBondContact O-N 2.98Å; Q3-N5 VanDerWaalsContact C-N 3.32Å; Q3-N5 PolarHBondContact O-N 3.48Å; N5-V9 VanDerWaalsContact O-CG2 3.25Å; N5-V9 WeakPolarHBondContact O-CG2 3.38Å; N5-V9 PolarHBondContact O-N 3.41Å
6	L	60.8	Low	62.3	Low	99 Å²	99	108.2 Å²	108.2	52%	0.518	54%	0.538	S	S	.	.	H	α-helix	trans	-66.8	-38.7	173.1	-86.3	146.7	0	0	0	112.5	M1 D2 Q3 R10	M1-L6 HydrophobicContact CB-CD1 4.19Å; D2-L6 PolarHBondContact O-N 2.98Å; Q3-L6 PolarHBondContact O-N 2.91Å; L6-R10 WeakPolarHBondContact O-CB 3.49Å; L6-R10 PolarHBondContact O-N 3.23Å
7	E	67.3	Low	62.3	Low	112 Å²	112	111.4 Å²	111.4	52%	0.523	55%	0.551	S	S	.	*	H	α-helix	trans	-69.1	-39.7	177.1	-150	65.9	-147.7	0	0	111.5	Q3 R10 E11	Q3-E7 PolarHBondContact O-N 3.3Å; Q3-E7 VanDerWaalsContact O-N 3.13Å; E7-R10 PolarHBondContact O-N 3.27Å; E7-E11 WeakPolarHBondContact O-CB 3.35Å; E7-E11 PolarHBondContact O-N 3.37Å
8	E	65.2	Low	62.4	Low	97 Å²	97	109.5 Å²	109.5	45%	0.453	55%	0.549	S	S	.	.	H	α-helix	trans	-62.4	-46.4	175.8	-175.6	170.5	-159.7	0	0	111.7	A4 E11 E12	A4-E8 WeakPolarHBondContact O-CB 3.42Å; A4-E8 PolarHBondContact O-N 3.1Å; E8-E11 PolarHBondContact O-N 3.35Å; E8-E12 WeakPolarHBondContact O-CG 3.48Å; E8-E12 PolarHBondContact O-N 3.06Å
9	V	61.9	Low	62.5	Low	76 Å²	76	105.5 Å²	105.5	46%	0.461	53%	0.532	S	S	.	.	H	α-helix	trans	-64.7	-41.3	176.6	172.6	0	0	0	0	111.4	N5 E12 T13	N5-V9 VanDerWaalsContact O-CG2 3.25Å; N5-V9 WeakPolarHBondContact O-CG2 3.38Å; N5-V9 PolarHBondContact O-N 3.41Å; V9-E12 PolarHBondContact O-N 3.33Å; V9-T13 WeakPolarHBondContact O-CG2 3.42Å; V9-T13 PolarHBondContact O-N 3.33Å; V9-T13 PolarHBondContact O-OG1 3.49Å
10	R	66.8	Low	63.3	Low	140 Å²	140	113.2 Å²	113.2	53%	0.528	56%	0.555	S	S	.	*	H	α-helix	trans	-61.3	-48.9	176.3	179.1	-175.1	-64.7	-81.9	-1.4	110.9	L6 E7 E12 T13 E14	L6-R10 WeakPolarHBondContact O-CB 3.49Å; L6-R10 PolarHBondContact O-N 3.23Å; E7-R10 PolarHBondContact O-N 3.27Å; R10-E12 VanDerWaalsContact C-N 3.32Å; R10-E12 PolarHBondContact O-N 3.04Å; R10-T13 WeakPolarHBondContact CA-OG1 3.27Å; R10-T13 PolarHBondContact O-N 3.41Å; R10-T13 VanDerWaalsContact O-N 3.12Å; R10-T13 PolarHBondContact O-OG1 2.86Å; R10-E14 WeakPolarHBondContact CG-OE1 3.5Å; R10-E14 WeakPolarHBondContact O-CG 3.48Å; R10-E14 PolarHBondContact O-N 3.42Å
11	E	65.1	Low	64.3	Low	83 Å²	83	111.5 Å²	111.5	39%	0.388	55%	0.548	S	S	.	.	H	α-helix	trans	-60.7	-42.8	179.4	-163.2	-165.8	-169.8	0	0	110.7	E7 E8 T13 E14 W15 R36	E7-E11 WeakPolarHBondContact O-CB 3.35Å; E7-E11 PolarHBondContact O-N 3.37Å; E8-E11 PolarHBondContact O-N 3.35Å; E11-T13 VanDerWaalsContact C-N 3.33Å; E11-T13 PolarHBondContact O-N 3.07Å; E11-E14 PolarHBondContact O-N 3.33Å; E11-W15 PolarHBondContact O-N 3.24Å; E11-R36 VanDerWaalsContact CD-NH2 3.32Å; E11-R36 IonicContact OE2-CZ 4Å; E11-R36 IonicContact OE2-NE 2.79Å; E11-R36 PolarHBondContact OE2-NE 3.41Å; E11-R36 IonicContact OE2-NH2 3.97Å; E11-R36 PolarHBondContact OE2-NH2 3.21Å
12	E	64.3	Low	66.1	Low	75 Å²	75	106.1 Å²	106.1	35%	0.35	53%	0.528	S	S	.	.	H	α-helix	trans	-58.7	-41	173.8	-75.6	-171.4	168	0	0	113.4	E8 V9 R10 E16 R36	E8-E12 WeakPolarHBondContact O-CG 3.48Å; E8-E12 PolarHBondContact O-N 3.06Å; V9-E12 PolarHBondContact O-N 3.33Å; R10-E12 VanDerWaalsContact C-N 3.32Å; R10-E12 PolarHBondContact O-N 3.04Å; E12-E16 PolarHBondContact O-N 3.13Å; E12-R36 IonicContact OE1-NH1 3.45Å; E12-R36 PolarHBondContact OE1-NH1 3.38Å
13	T	62.2	Low	67.4	Low	77 Å²	77	104.8 Å²	104.8	47%	0.472	52%	0.521	S	S	.	.	H	α-helix	trans	-70.5	-28.8	178.9	53.1	0	0	0	0	113.9	V9 R10 E11	V9-T13 WeakPolarHBondContact O-CG2 3.42Å; V9-T13 PolarHBondContact O-N 3.33Å; V9-T13 PolarHBondContact O-OG1 3.49Å; R10-T13 WeakPolarHBondContact CA-OG1 3.27Å; R10-T13 PolarHBondContact O-N 3.41Å; R10-T13 VanDerWaalsContact O-N 3.12Å; R10-T13 PolarHBondContact O-OG1 2.86Å; E11-T13 VanDerWaalsContact C-N 3.33Å; E11-T13 PolarHBondContact O-N 3.07Å
14	E	65.6	Low	68.6	Low	114 Å²	114	100.3 Å²	100.3	53%	0.533	51%	0.505	S	S	.	.	H	α-helix	trans	-75.4	-34.2	179.4	-71.6	177.3	-169.5	0	0	111.8	R10 E11 Q17	R10-E14 WeakPolarHBondContact CG-OE1 3.5Å; R10-E14 WeakPolarHBondContact O-CG 3.48Å; R10-E14 PolarHBondContact O-N 3.42Å; E11-E14 PolarHBondContact O-N 3.33Å; E14-Q17 PolarHBondContact O-N 3.09Å
15	W	62.3	Low	69.4	Low	110 Å²	110	98 Å²	98	42%	0.417	49%	0.485	S	S	.	.	H	α-helix	trans	-76.3	-25.7	179.8	-66.6	116.3	0	0	0	114.1	E11 Q17 C18	E11-W15 PolarHBondContact O-N 3.24Å; W15-Q17 PolarHBondContact O-N 3.41Å; W15-C18 WeakPolarHBondContact O-CB 3.18Å; W15-C18 PolarHBondContact O-N 3.12Å
16	E	58.4	Low	70.2	Confident	103 Å²	103	101.5 Å²	101.5	48%	0.481	49%	0.492	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.8	175.6	-73.5	-171.5	168.3	0	0	113	E12 K29	E12-E16 PolarHBondContact O-N 3.13Å; E16-K29 IonicContact OE1-NZ 3.33Å; E16-K29 PolarHBondContact OE1-NZ 3.32Å
17	Q	63.3	Low	71.4	Confident	163 Å²	163	103.2 Å²	103.2	76%	0.762	50%	0.496	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.8	-4.5	177.6	-59.8	-63.3	-21.7	0	0	113.8	E14 W15 S19	E14-Q17 PolarHBondContact O-N 3.09Å; W15-Q17 PolarHBondContact O-N 3.41Å; Q17-S19 PolarHBondContact O-N 3.04Å
18	C	64.2	Low	72.2	Confident	77 Å²	77	99.6 Å²	99.6	52%	0.52	48%	0.481	S	S	.	.	S	Bend	trans	-73.2	-11.1	-171.4	-65.5	0	0	0	0	114.8	W15	W15-C18 WeakPolarHBondContact O-CB 3.18Å; W15-C18 PolarHBondContact O-N 3.12Å
19	S	64.8	Low	73	Confident	33 Å²	33	100.1 Å²	100.1	23%	0.231	48%	0.482	C	S	.	.			trans	-154.1	134.1	178.2	170.5	0	0	0	0	112.4	Q17 N21 V24	Q17-S19 PolarHBondContact O-N 3.04Å; S19-N21 PolarHBondContact O-N 3Å; S19-N21 WeakPolarHBondContact OG-CA 3.44Å; S19-N21 WeakPolarHBondContact OG-CB 3.33Å; S19-N21 PolarHBondContact OG-N 3.34Å; S19-N21 PolarHBondContact OG-O 3.37Å; S19-V24 WeakPolarHBondContact OG-CB 3.27Å
20	R	77.6	Confident	74.2	Confident	259 Å²	259	100.6 Å²	100.6	98%	0.977	49%	0.485	S	S	*	.	S	Bend	trans	-74.8	-13	170.5	-146.8	166.8	-176.3	138.6	-2.6	112.7
21	N	84.8	Confident	75.3	Confident	78 Å²	78	101.3 Å²	101.3	42%	0.417	49%	0.488	S	S	.	.	S	Bend	trans	-87.9	118.2	171.9	-178.3	-21.3	0	0	0	109.7	S19 D23 V24 A25	S19-N21 PolarHBondContact O-N 3Å; S19-N21 WeakPolarHBondContact OG-CA 3.44Å; S19-N21 WeakPolarHBondContact OG-CB 3.33Å; S19-N21 PolarHBondContact OG-N 3.34Å; S19-N21 PolarHBondContact OG-O 3.37Å; N21-D23 VanDerWaalsContact C-N 3.28Å; N21-D23 PolarHBondContact O-N 3.46Å; N21-D23 PolarHBondContact OD1-N 3.24Å; N21-V24 HydrophobicContact CB-CB 4.39Å; N21-V24 HydrophobicContact CB-CG2 4.11Å; N21-V24 PolarHBondContact O-N 3.03Å; N21-A25 PolarHBondContact O-N 3.43Å
22	P	83.4	Confident	76.3	Confident	89 Å²	89	99.2 Å²	99.2	58%	0.578	48%	0.479	S	S	*	.	H	α-helix	trans	-63.5	-29	-176.4	26.2	-35.3	0	0	0	113.7	A25 R26	P22-A25 PolarHBondContact O-N 3.17Å; P22-R26 WeakPolarHBondContact O-CB 3.44Å; P22-R26 WeakPolarHBondContact O-CG 3.29Å; P22-R26 PolarHBondContact O-N 3.46Å
23	D	86.1	Confident	77.3	Confident	98 Å²	98	99.9 Å²	99.9	52%	0.524	49%	0.485	S	S	.	.	H	α-helix	trans	-71.7	-40.1	-179.9	-71.5	-34.6	0	0	0	112	N21 R26 F27	N21-D23 VanDerWaalsContact C-N 3.28Å; N21-D23 PolarHBondContact O-N 3.46Å; N21-D23 PolarHBondContact OD1-N 3.24Å; D23-R26 PolarHBondContact O-N 2.93Å; D23-R26 IonicContact OD1-NH1 3.23Å; D23-R26 PolarHBondContact OD1-NH1 2.87Å; D23-F27 WeakPolarHBondContact O-CB 3.36Å; D23-F27 PolarHBondContact O-N 3.16Å
24	V	84.9	Confident	78.7	Confident	66 Å²	66	100.3 Å²	100.3	40%	0.4	49%	0.487	S	S	.	.	H	α-helix	trans	-65.7	-42.7	174.7	177.9	0	0	0	0	110	S19 N21 R26 F27 V28	S19-V24 WeakPolarHBondContact OG-CB 3.27Å; N21-V24 HydrophobicContact CB-CB 4.39Å; N21-V24 HydrophobicContact CB-CG2 4.11Å; N21-V24 PolarHBondContact O-N 3.03Å; V24-R26 PolarHBondContact O-N 3.25Å; V24-F27 PolarHBondContact O-N 3.45Å; V24-V28 HydrophobicContact CG1-CG2 4.39Å; V24-V28 WeakPolarHBondContact O-CG2 3.08Å; V24-V28 PolarHBondContact O-N 3.49Å
25	A	81.1	Confident	79.8	Confident	26 Å²	26	98.3 Å²	98.3	22%	0.215	48%	0.478	C	S	.	.	H	α-helix	trans	-60.2	-45	176.6	0	0	0	0	0	111.6	N21 P22 F27 V28 K29	N21-A25 PolarHBondContact O-N 3.43Å; P22-A25 PolarHBondContact O-N 3.17Å; A25-F27 PolarHBondContact O-N 3.35Å; A25-V28 PolarHBondContact O-N 2.94Å; A25-K29 WeakPolarHBondContact O-CB 3.23Å; A25-K29 PolarHBondContact O-N 3.43Å
26	R	84.4	Confident	81	Confident	156 Å²	156	95.4 Å²	95.4	59%	0.589	47%	0.467	S	S	*	.	H	α-helix	trans	-61.6	-42.2	174.4	-78.6	174.5	49.8	-111.1	-10.8	112.9	P22 D23 V24 T30	P22-R26 WeakPolarHBondContact O-CB 3.44Å; P22-R26 WeakPolarHBondContact O-CG 3.29Å; P22-R26 PolarHBondContact O-N 3.46Å; D23-R26 PolarHBondContact O-N 2.93Å; D23-R26 IonicContact OD1-NH1 3.23Å; D23-R26 PolarHBondContact OD1-NH1 2.87Å; V24-R26 PolarHBondContact O-N 3.25Å; R26-T30 WeakPolarHBondContact O-CB 3.39Å; R26-T30 PolarHBondContact O-N 3.31Å; R26-T30 PolarHBondContact O-OG1 3.16Å
27	F	86.4	Confident	82.6	Confident	135 Å²	135	94.6 Å²	94.6	59%	0.592	47%	0.466	S	S	*	.	H	α-helix	trans	-62.9	-47.5	177.8	177.2	-98	0	0	0	111.4	D23 V24 A25 T30 R31	D23-F27 WeakPolarHBondContact O-CB 3.36Å; D23-F27 PolarHBondContact O-N 3.16Å; V24-F27 PolarHBondContact O-N 3.45Å; A25-F27 PolarHBondContact O-N 3.35Å; F27-T30 PolarHBondContact O-N 3.46Å; F27-R31 WeakPolarHBondContact O-CB 3.42Å; F27-R31 PolarHBondContact O-N 2.81Å
28	V	83.8	Confident	84.2	Confident	36 Å²	36	93 Å²	93	22%	0.218	45%	0.453	C	S	.	.	H	α-helix	trans	-61.9	-46.2	177.3	172.4	0	0	0	0	110.8	V24 A25 T30 R31 N32	V24-V28 HydrophobicContact CG1-CG2 4.39Å; V24-V28 WeakPolarHBondContact O-CG2 3.08Å; V24-V28 PolarHBondContact O-N 3.49Å; A25-V28 PolarHBondContact O-N 2.94Å; V28-T30 VanDerWaalsContact C-N 3.3Å; V28-T30 PolarHBondContact O-N 2.88Å; V28-R31 PolarHBondContact O-N 3.48Å; V28-N32 WeakPolarHBondContact O-CB 3.44Å; V28-N32 PolarHBondContact O-N 2.9Å
29	K	82.7	Confident	85.6	Confident	108 Å²	108	94 Å²	94	47%	0.47	45%	0.453	S	S	.	.	H	α-helix	trans	-56.4	-45	176	-173.9	168.5	-172	160.7	0	111.9	E16 A25 L33	E16-K29 IonicContact OE1-NZ 3.33Å; E16-K29 PolarHBondContact OE1-NZ 3.32Å; A25-K29 WeakPolarHBondContact O-CB 3.23Å; A25-K29 PolarHBondContact O-N 3.43Å; K29-L33 WeakPolarHBondContact O-CB 3.4Å; K29-L33 PolarHBondContact O-N 3.19Å
30	T	87.1	Confident	87	Confident	86 Å²	86	98.8 Å²	98.8	53%	0.528	47%	0.471	S	S	.	.	H	α-helix	trans	-64.9	-45.1	177.9	-54.3	0	0	0	0	111.4	R26 F27 V28 L33 V34	R26-T30 WeakPolarHBondContact O-CB 3.39Å; R26-T30 PolarHBondContact O-N 3.31Å; R26-T30 PolarHBondContact O-OG1 3.16Å; F27-T30 PolarHBondContact O-N 3.46Å; V28-T30 VanDerWaalsContact C-N 3.3Å; V28-T30 PolarHBondContact O-N 2.88Å; T30-L33 PolarHBondContact O-N 2.89Å; T30-V34 WeakPolarHBondContact O-CG2 3.29Å; T30-V34 PolarHBondContact O-N 3.42Å
31	R	88.8	Confident	87.8	Confident	155 Å²	155	89.6 Å²	89.6	59%	0.585	45%	0.446	S	S	*	.	H	α-helix	trans	-62.3	-44.6	178	-174.7	-180	-178.7	177	0.5	111.9	F27 V28 L33 V34 E35	F27-R31 WeakPolarHBondContact O-CB 3.42Å; F27-R31 PolarHBondContact O-N 2.81Å; V28-R31 PolarHBondContact O-N 3.48Å; R31-L33 VanDerWaalsContact C-N 3.35Å; R31-L33 PolarHBondContact O-N 3.36Å; R31-V34 PolarHBondContact O-N 3.32Å; R31-E35 PolarHBondContact O-N 3.33Å
32	N	85.7	Confident	88.4	Confident	39 Å²	39	89.2 Å²	89.2	21%	0.209	44%	0.444	C	S	.	.	H	α-helix	trans	-64.1	-41.2	178.8	-72.3	-1.3	0	0	0	111.2	V28 V34 E35 R36	V28-N32 WeakPolarHBondContact O-CB 3.44Å; V28-N32 PolarHBondContact O-N 2.9Å; N32-V34 VanDerWaalsContact C-N 3.33Å; N32-V34 PolarHBondContact O-N 2.92Å; N32-E35 PolarHBondContact O-N 2.95Å; N32-R36 WeakPolarHBondContact O-CB 3.48Å; N32-R36 WeakPolarHBondContact O-CG 3.24Å; N32-R36 PolarHBondContact O-N 3.44Å
33	L	86.8	Confident	88.9	Confident	90 Å²	90	93.2 Å²	93.2	47%	0.471	45%	0.448	S	S	.	.	H	α-helix	trans	-59.8	-43.1	173.9	-179.7	63.2	0	0	0	112	K29 T30 R31 R36 N37	K29-L33 WeakPolarHBondContact O-CB 3.4Å; K29-L33 PolarHBondContact O-N 3.19Å; T30-L33 PolarHBondContact O-N 2.89Å; R31-L33 VanDerWaalsContact C-N 3.35Å; R31-L33 PolarHBondContact O-N 3.36Å; L33-R36 PolarHBondContact O-N 2.99Å; L33-N37 WeakPolarHBondContact O-CB 3.3Å; L33-N37 VanDerWaalsContact O-CG 3.23Å; L33-N37 PolarHBondContact O-N 2.84Å; L33-N37 PolarHBondContact O-ND2 3.45Å
34	V	90	Very high	89.3	Confident	85 Å²	85	91.1 Å²	91.1	52%	0.515	44%	0.441	S	S	.	.	H	α-helix	trans	-62.3	-45.2	176.2	171.2	0	0	0	0	111.3	T30 R31 N32 N37 R38	T30-V34 WeakPolarHBondContact O-CG2 3.29Å; T30-V34 PolarHBondContact O-N 3.42Å; R31-V34 PolarHBondContact O-N 3.32Å; N32-V34 VanDerWaalsContact C-N 3.33Å; N32-V34 PolarHBondContact O-N 2.92Å; V34-N37 PolarHBondContact O-N 3.46Å; V34-R38 PolarHBondContact O-N 2.92Å
35	E	89.1	Confident	89.9	Confident	73 Å²	73	93.1 Å²	93.1	34%	0.341	45%	0.446	S	S	.	.	H	α-helix	trans	-65.8	-40.4	177.3	-72.8	-58.2	146.1	0	0	112.5	R31 N32 N37 R38 L39	R31-E35 PolarHBondContact O-N 3.33Å; N32-E35 PolarHBondContact O-N 2.95Å; E35-N37 PolarHBondContact O-N 2.87Å; E35-R38 WeakPolarHBondContact O-CB 3.5Å; E35-R38 PolarHBondContact O-N 2.84Å; E35-R38 IonicContact OE1-NE 2.8Å; E35-R38 IonicContact OE2-CZ 3.32Å; E35-R38 IonicContact OE2-NE 2.96Å; E35-R38 PolarHBondContact OE2-NE 2.82Å; E35-R38 IonicContact OE2-NH2 3.33Å; E35-R38 PolarHBondContact OE2-NH2 3.24Å; E35-L39 WeakPolarHBondContact O-CB 3.44Å; E35-L39 WeakPolarHBondContact O-CG 3.33Å; E35-L39 PolarHBondContact O-N 3.46Å
36	R	88.5	Confident	90.7	Very high	49 Å²	49	96.9 Å²	96.9	19%	0.185	46%	0.462	C	S	.	.	H	α-helix	trans	-60.1	-45.8	173.7	-75.4	-173.9	-170.9	136	-4	111.7	E11 E12 N32 L33 R38 L39 Q40	E11-R36 VanDerWaalsContact CD-NH2 3.32Å; E11-R36 IonicContact OE2-CZ 4Å; E11-R36 IonicContact OE2-NE 2.79Å; E11-R36 PolarHBondContact OE2-NE 3.41Å; E11-R36 IonicContact OE2-NH2 3.97Å; E11-R36 PolarHBondContact OE2-NH2 3.21Å; E12-R36 IonicContact OE1-NH1 3.45Å; E12-R36 PolarHBondContact OE1-NH1 3.38Å; N32-R36 WeakPolarHBondContact O-CB 3.48Å; N32-R36 WeakPolarHBondContact O-CG 3.24Å; N32-R36 PolarHBondContact O-N 3.44Å; L33-R36 PolarHBondContact O-N 2.99Å; R36-R38 VanDerWaalsContact C-N 3.29Å; R36-R38 PolarHBondContact O-N 3.35Å; R36-L39 PolarHBondContact O-N 2.88Å; R36-Q40 WeakPolarHBondContact O-CB 3.37Å; R36-Q40 PolarHBondContact O-N 3.42Å
37	N	92.1	Very high	91.3	Very high	85 Å²	85	93.2 Å²	93.2	46%	0.455	45%	0.454	S	S	.	.	H	α-helix	trans	-60.3	-40.7	175.7	-72.3	-27.1	0	0	0	111.7	L33 V34 E35 S41	L33-N37 WeakPolarHBondContact O-CB 3.3Å; L33-N37 VanDerWaalsContact O-CG 3.23Å; L33-N37 PolarHBondContact O-N 2.84Å; L33-N37 PolarHBondContact O-ND2 3.45Å; V34-N37 PolarHBondContact O-N 3.46Å; E35-N37 PolarHBondContact O-N 2.87Å; N37-S41 WeakPolarHBondContact O-CB 3.48Å; N37-S41 PolarHBondContact O-N 3.44Å
38	R	95.6	Very high	91.8	Very high	129 Å²	129	92.5 Å²	92.5	49%	0.487	45%	0.45	S	S	.	.	H	α-helix	trans	-62.9	-47.4	175.3	-170.2	-176.7	71.4	86.6	2	111.5	V34 E35 R36 S41 L42	V34-R38 PolarHBondContact O-N 2.92Å; E35-R38 WeakPolarHBondContact O-CB 3.5Å; E35-R38 PolarHBondContact O-N 2.84Å; E35-R38 IonicContact OE1-NE 2.8Å; E35-R38 IonicContact OE2-CZ 3.32Å; E35-R38 IonicContact OE2-NE 2.96Å; E35-R38 PolarHBondContact OE2-NE 2.82Å; E35-R38 IonicContact OE2-NH2 3.33Å; E35-R38 PolarHBondContact OE2-NH2 3.24Å; R36-R38 VanDerWaalsContact C-N 3.29Å; R36-R38 PolarHBondContact O-N 3.35Å; R38-S41 WeakPolarHBondContact O-CB 3.49Å; R38-S41 PolarHBondContact O-N 3.42Å; R38-L42 HydrophobicContact CG-CD1 4.49Å; R38-L42 WeakPolarHBondContact O-CG 3.26Å; R38-L42 PolarHBondContact O-N 3.15Å
39	L	94.7	Very high	92.4	Very high	99 Å²	99	96.6 Å²	96.6	52%	0.518	47%	0.467	S	S	.	.	H	α-helix	trans	-64.5	-40.7	178.5	-71.3	174.4	0	0	0	112	E35 R36 S41 L42 R43	E35-L39 WeakPolarHBondContact O-CB 3.44Å; E35-L39 WeakPolarHBondContact O-CG 3.33Å; E35-L39 PolarHBondContact O-N 3.46Å; R36-L39 PolarHBondContact O-N 2.88Å; L39-S41 VanDerWaalsContact C-N 3.34Å; L39-S41 PolarHBondContact O-N 3.34Å; L39-L42 PolarHBondContact O-N 2.92Å; L39-R43 WeakPolarHBondContact O-CB 3.27Å; L39-R43 PolarHBondContact O-N 3.17Å
40	Q	93.4	Very high	93.2	Very high	134 Å²	134	96.4 Å²	96.4	63%	0.626	47%	0.471	S	S	*	.	H	α-helix	trans	-63.8	-40.3	175.6	-171.9	-179.5	9.7	0	0	111.5	R36 R43 S44	R36-Q40 WeakPolarHBondContact O-CB 3.37Å; R36-Q40 PolarHBondContact O-N 3.42Å; Q40-R43 PolarHBondContact O-N 2.84Å; Q40-S44 WeakPolarHBondContact O-CB 3.48Å; Q40-S44 PolarHBondContact O-N 3.39Å
41	S	94.4	Very high	93.6	Very high	65 Å²	65	98.5 Å²	98.5	46%	0.455	47%	0.474	S	S	.	.	H	α-helix	trans	-62.3	-47.9	174.3	-171.5	0	0	0	0	111.7	N37 R38 L39 R43 S44 Q45	N37-S41 WeakPolarHBondContact O-CB 3.48Å; N37-S41 PolarHBondContact O-N 3.44Å; R38-S41 WeakPolarHBondContact O-CB 3.49Å; R38-S41 PolarHBondContact O-N 3.42Å; L39-S41 VanDerWaalsContact C-N 3.34Å; L39-S41 PolarHBondContact O-N 3.34Å; S41-R43 PolarHBondContact O-N 3.38Å; S41-S44 PolarHBondContact O-N 3.34Å; S41-Q45 WeakPolarHBondContact O-CG 3.44Å; S41-Q45 PolarHBondContact O-N 2.85Å
42	L	96.7	Very high	94	Very high	70 Å²	70	100.2 Å²	100.2	37%	0.366	48%	0.481	S	S	.	.	H	α-helix	trans	-60.3	-44.6	176.2	-75.7	171.1	0	0	0	111.9	R38 L39 S44 Q45 L46	R38-L42 HydrophobicContact CG-CD1 4.49Å; R38-L42 WeakPolarHBondContact O-CG 3.26Å; R38-L42 PolarHBondContact O-N 3.15Å; L39-L42 PolarHBondContact O-N 2.92Å; L42-S44 PolarHBondContact O-N 3.02Å; L42-Q45 WeakPolarHBondContact O-CB 3.45Å; L42-Q45 PolarHBondContact O-N 3.25Å; L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.47Å
43	R	95.2	Very high	94.6	Very high	173 Å²	173	102.3 Å²	102.3	65%	0.653	49%	0.49	S	S	*	.	H	α-helix	trans	-58.4	-47.9	175.7	-176.7	178.3	176.9	-151	-0.6	111.2	L39 Q40 S41 Q45 L46 D47	L39-R43 WeakPolarHBondContact O-CB 3.27Å; L39-R43 PolarHBondContact O-N 3.17Å; Q40-R43 PolarHBondContact O-N 2.84Å; S41-R43 PolarHBondContact O-N 3.38Å; R43-Q45 VanDerWaalsContact C-N 3.28Å; R43-Q45 PolarHBondContact O-N 2.86Å; R43-L46 PolarHBondContact O-N 3.15Å; R43-D47 IonicContact NE-OD2 2.82Å; R43-D47 WeakPolarHBondContact O-CB 3.4Å; R43-D47 VanDerWaalsContact O-CG 3.27Å; R43-D47 PolarHBondContact O-N 2.99Å
44	S	94.9	Very high	95.1	Very high	54 Å²	54	102.9 Å²	102.9	38%	0.378	49%	0.493	S	S	.	.	H	α-helix	trans	-61.7	-35.2	177.4	-175.4	0	0	0	0	112.8	Q40 S41 L42 K48	Q40-S44 WeakPolarHBondContact O-CB 3.48Å; Q40-S44 PolarHBondContact O-N 3.39Å; S41-S44 PolarHBondContact O-N 3.34Å; L42-S44 PolarHBondContact O-N 3.02Å; S44-K48 VanDerWaalsContact O-CG 3.29Å; S44-K48 WeakPolarHBondContact O-CG 3.33Å; S44-K48 PolarHBondContact O-N 3.31Å; S44-K48 VanDerWaalsContact O-N 3.14Å
45	Q	97.1	Very high	95.4	Very high	108 Å²	108	106.1 Å²	106.1	51%	0.505	50%	0.5	S	S	.	.	H	α-helix	trans	-66.9	-45.4	174.5	-73	176	-12.3	0	0	111.9	S41 L42 R43 K48 Q49	S41-Q45 WeakPolarHBondContact O-CG 3.44Å; S41-Q45 PolarHBondContact O-N 2.85Å; L42-Q45 WeakPolarHBondContact O-CB 3.45Å; L42-Q45 PolarHBondContact O-N 3.25Å; R43-Q45 VanDerWaalsContact C-N 3.28Å; R43-Q45 PolarHBondContact O-N 2.86Å; Q45-K48 PolarHBondContact O-N 3.46Å; Q45-Q49 WeakPolarHBondContact O-CG 3.31Å; Q45-Q49 PolarHBondContact O-N 3.04Å
46	L	97.8	Very high	95.8	Very high	106 Å²	106	108 Å²	108	56%	0.555	50%	0.504	S	S	*	.	H	α-helix	trans	-64.7	-42.7	177.5	-70.6	172.2	0	0	0	111.9	L42 R43 K48 Q49 L50	L42-L46 WeakPolarHBondContact O-CG 3.44Å; L42-L46 PolarHBondContact O-N 3.47Å; R43-L46 PolarHBondContact O-N 3.15Å; L46-K48 VanDerWaalsContact C-N 3.3Å; L46-K48 PolarHBondContact O-N 3.03Å; L46-Q49 PolarHBondContact O-N 3.04Å; L46-Q49 VanDerWaalsContact O-N 3.15Å; L46-L50 WeakPolarHBondContact O-CB 3.33Å; L46-L50 PolarHBondContact O-N 3.48Å
47	D	97.1	Very high	96.2	Very high	79 Å²	79	110 Å²	110	42%	0.422	52%	0.517	S	S	.	.	H	α-helix	trans	-59.7	-42.7	176.6	-71.8	-21.5	0	0	0	110.9	R43 L50 E51	R43-D47 IonicContact NE-OD2 2.82Å; R43-D47 WeakPolarHBondContact O-CB 3.4Å; R43-D47 VanDerWaalsContact O-CG 3.27Å; R43-D47 PolarHBondContact O-N 2.99Å; D47-L50 PolarHBondContact O-N 3.11Å; D47-E51 WeakPolarHBondContact O-CB 3.35Å; D47-E51 PolarHBondContact O-N 2.75Å
48	K	96.6	Very high	96.3	Very high	119 Å²	119	108.8 Å²	108.8	52%	0.517	52%	0.516	S	S	.	.	H	α-helix	trans	-62.1	-49.8	172.7	-73.8	172.2	-175.8	175.8	0	111	S44 Q45 L46 L50 E51 W52	S44-K48 VanDerWaalsContact O-CG 3.29Å; S44-K48 WeakPolarHBondContact O-CG 3.33Å; S44-K48 PolarHBondContact O-N 3.31Å; S44-K48 VanDerWaalsContact O-N 3.14Å; Q45-K48 PolarHBondContact O-N 3.46Å; L46-K48 VanDerWaalsContact C-N 3.3Å; L46-K48 PolarHBondContact O-N 3.03Å; K48-L50 VanDerWaalsContact C-N 3.27Å; K48-L50 PolarHBondContact O-N 3.09Å; K48-E51 WeakPolarHBondContact O-CB 3.5Å; K48-E51 PolarHBondContact O-N 3.31Å; K48-E51 VanDerWaalsContact O-N 3.14Å; K48-W52 PolarHBondContact O-N 2.87Å
49	Q	97.2	Very high	96.3	Very high	123 Å²	123	106.4 Å²	106.4	58%	0.575	51%	0.512	S	S	*	.	H	α-helix	trans	-56.8	-43.5	179.1	-74.5	178.1	-13	0	0	111.9	Q45 L46 E51 W52 E53	Q45-Q49 WeakPolarHBondContact O-CG 3.31Å; Q45-Q49 PolarHBondContact O-N 3.04Å; L46-Q49 PolarHBondContact O-N 3.04Å; L46-Q49 VanDerWaalsContact O-N 3.15Å; Q49-E51 PolarHBondContact O-N 3.01Å; Q49-W52 PolarHBondContact O-N 2.92Å; Q49-E53 WeakPolarHBondContact O-CG 3.25Å; Q49-E53 PolarHBondContact O-N 3.49Å
50	L	97.7	Very high	96.3	Very high	103 Å²	103	105.2 Å²	105.2	54%	0.539	50%	0.504	S	S	.	.	H	α-helix	trans	-60.8	-44.9	176	-178.8	62.1	0	0	0	111.9	L46 D47 K48 W52 E53 L54	L46-L50 WeakPolarHBondContact O-CB 3.33Å; L46-L50 PolarHBondContact O-N 3.48Å; D47-L50 PolarHBondContact O-N 3.11Å; K48-L50 VanDerWaalsContact C-N 3.27Å; K48-L50 PolarHBondContact O-N 3.09Å; L50-W52 VanDerWaalsContact C-N 3.3Å; L50-W52 PolarHBondContact O-N 3.49Å; L50-E53 PolarHBondContact O-N 2.91Å; L50-L54 HydrophobicContact CD1-CD1 4.37Å; L50-L54 HydrophobicContact CD1-CG 4.31Å; L50-L54 HydrophobicContact CG-CD1 4.13Å; L50-L54 HydrophobicContact CG-CG 4.49Å; L50-L54 WeakPolarHBondContact O-CB 3.32Å; L50-L54 VanDerWaalsContact O-CG 3.29Å; L50-L54 WeakPolarHBondContact O-CG 3.11Å; L50-L54 PolarHBondContact O-N 3.15Å
51	E	97.2	Very high	96.4	Very high	130 Å²	130	108.6 Å²	108.6	61%	0.607	51%	0.511	S	S	*	.	H	α-helix	trans	-59.4	-40.8	176.7	-171.7	-176.6	-178.6	0	0	112	D47 K48 Q49 K55	D47-E51 WeakPolarHBondContact O-CB 3.35Å; D47-E51 PolarHBondContact O-N 2.75Å; K48-E51 WeakPolarHBondContact O-CB 3.5Å; K48-E51 PolarHBondContact O-N 3.31Å; K48-E51 VanDerWaalsContact O-N 3.14Å; Q49-E51 PolarHBondContact O-N 3.01Å; E51-K55 WeakPolarHBondContact O-CB 3.23Å; E51-K55 PolarHBondContact O-N 3.09Å
52	W	97.3	Very high	96.4	Very high	192 Å²	192	112 Å²	112	73%	0.727	51%	0.514	S	S	*	.	H	α-helix	trans	-67.8	-42.9	178.4	-76.3	59.2	0	0	0	112.1	K48 Q49 L50 K55 R56	K48-W52 PolarHBondContact O-N 2.87Å; Q49-W52 PolarHBondContact O-N 2.92Å; L50-W52 VanDerWaalsContact C-N 3.3Å; L50-W52 PolarHBondContact O-N 3.49Å; W52-K55 PolarHBondContact O-N 2.95Å; W52-R56 PolarHBondContact O-N 3.3Å
53	E	96.8	Very high	96.4	Very high	82 Å²	82	114.7 Å²	114.7	38%	0.383	53%	0.525	S	S	.	.	H	α-helix	trans	-62.3	-45.4	175.3	-73	-66.8	140.1	0	0	111.6	Q49 L50 K55 R56 L57	Q49-E53 WeakPolarHBondContact O-CG 3.25Å; Q49-E53 PolarHBondContact O-N 3.49Å; L50-E53 PolarHBondContact O-N 2.91Å; E53-K55 VanDerWaalsContact C-N 3.31Å; E53-K55 PolarHBondContact O-N 3.17Å; E53-R56 WeakPolarHBondContact O-CB 3.46Å; E53-R56 PolarHBondContact O-N 3.33Å; E53-R56 IonicContact OE1-CZ 3.04Å; E53-R56 IonicContact OE1-NH1 3Å; E53-R56 PolarHBondContact OE1-NH1 3.33Å; E53-R56 IonicContact OE1-NH2 2.63Å; E53-R56 IonicContact OE2-CZ 3.99Å; E53-R56 IonicContact OE2-NH1 3.82Å; E53-R56 PolarHBondContact OE2-NH1 2.89Å; E53-R56 IonicContact OE2-NH2 3.59Å; E53-R56 PolarHBondContact OE2-NH2 3.07Å; E53-L57 WeakPolarHBondContact O-CG 3.48Å; E53-L57 PolarHBondContact O-N 3Å
54	L	97	Very high	96.3	Very high	103 Å²	103	113 Å²	113	54%	0.539	52%	0.523	S	S	.	.	H	α-helix	trans	-61.3	-40.7	175.8	-72.8	174.6	0	0	0	111.8	L50 S58	L50-L54 HydrophobicContact CD1-CD1 4.37Å; L50-L54 HydrophobicContact CD1-CG 4.31Å; L50-L54 HydrophobicContact CG-CD1 4.13Å; L50-L54 HydrophobicContact CG-CG 4.49Å; L50-L54 WeakPolarHBondContact O-CB 3.32Å; L50-L54 VanDerWaalsContact O-CG 3.29Å; L50-L54 WeakPolarHBondContact O-CG 3.11Å; L50-L54 PolarHBondContact O-N 3.15Å; L54-S58 VanDerWaalsContact O-CB 3.3Å; L54-S58 WeakPolarHBondContact O-CB 3.49Å; L54-S58 PolarHBondContact O-N 2.75Å
55	K	97.2	Very high	96.3	Very high	152 Å²	152	113 Å²	113	66%	0.661	53%	0.525	S	S	*	.	H	α-helix	trans	-65.3	-40.7	175.6	-171.3	175.2	-177.3	176.5	0	111.7	E51 W52 E53 S58 L59	E51-K55 WeakPolarHBondContact O-CB 3.23Å; E51-K55 PolarHBondContact O-N 3.09Å; W52-K55 PolarHBondContact O-N 2.95Å; E53-K55 VanDerWaalsContact C-N 3.31Å; E53-K55 PolarHBondContact O-N 3.17Å; K55-S58 PolarHBondContact O-N 3Å; K55-L59 WeakPolarHBondContact O-CG 3.38Å; K55-L59 PolarHBondContact O-N 2.95Å; K55-L59 VanDerWaalsContact O-N 3.14Å
56	R	97.1	Very high	96.2	Very high	114 Å²	114	112.1 Å²	112.1	43%	0.43	52%	0.524	S	S	.	.	H	α-helix	trans	-61.2	-51.8	175.2	-168.5	-176.6	79.9	-134.4	-13.4	111	W52 E53 S58 L59 E60	W52-R56 PolarHBondContact O-N 3.3Å; E53-R56 WeakPolarHBondContact O-CB 3.46Å; E53-R56 PolarHBondContact O-N 3.33Å; E53-R56 IonicContact OE1-CZ 3.04Å; E53-R56 IonicContact OE1-NH1 3Å; E53-R56 PolarHBondContact OE1-NH1 3.33Å; E53-R56 IonicContact OE1-NH2 2.63Å; E53-R56 IonicContact OE2-CZ 3.99Å; E53-R56 IonicContact OE2-NH1 3.82Å; E53-R56 PolarHBondContact OE2-NH1 2.89Å; E53-R56 IonicContact OE2-NH2 3.59Å; E53-R56 PolarHBondContact OE2-NH2 3.07Å; R56-S58 VanDerWaalsContact C-N 3.26Å; R56-S58 PolarHBondContact O-N 3.13Å; R56-L59 WeakPolarHBondContact O-CB 3.47Å; R56-L59 PolarHBondContact O-N 2.94Å; R56-L59 VanDerWaalsContact O-N 3.07Å; R56-E60 IonicContact NE-OE1 2.72Å; R56-E60 PolarHBondContact NE-OE1 3.32Å; R56-E60 PolarHBondContact O-N 3.13Å
57	L	96.9	Very high	96.1	Very high	89 Å²	89	110.9 Å²	110.9	47%	0.466	52%	0.521	S	S	.	.	H	α-helix	trans	-60.2	-36	178	-71.6	173	0	0	0	112.3	E53 L59 E60 R61	E53-L57 WeakPolarHBondContact O-CG 3.48Å; E53-L57 PolarHBondContact O-N 3Å; L57-L59 VanDerWaalsContact C-N 3.34Å; L57-E60 PolarHBondContact O-N 2.95Å; L57-R61 VanDerWaalsContact O-CB 3.23Å; L57-R61 WeakPolarHBondContact O-CB 3.48Å; L57-R61 PolarHBondContact O-N 3.37Å
58	S	95.6	Very high	96	Very high	60 Å²	60	112.6 Å²	112.6	42%	0.42	53%	0.529	S	S	.	.	H	α-helix	trans	-64.1	-37.3	175.2	-176.8	0	0	0	0	112.8	L54 K55 R56 R62	L54-S58 VanDerWaalsContact O-CB 3.3Å; L54-S58 WeakPolarHBondContact O-CB 3.49Å; L54-S58 PolarHBondContact O-N 2.75Å; K55-S58 PolarHBondContact O-N 3Å; R56-S58 VanDerWaalsContact C-N 3.26Å; R56-S58 PolarHBondContact O-N 3.13Å; S58-R62 PolarHBondContact O-N 3.36Å
59	L	94.7	Very high	95.8	Very high	80 Å²	80	109.9 Å²	109.9	42%	0.419	52%	0.518	S	S	.	.	H	α-helix	trans	-68.8	-50.7	173.6	-69.4	171.8	0	0	0	111.2	K55 R56 L57 R61 R62 E63	K55-L59 WeakPolarHBondContact O-CG 3.38Å; K55-L59 PolarHBondContact O-N 2.95Å; K55-L59 VanDerWaalsContact O-N 3.14Å; R56-L59 WeakPolarHBondContact O-CB 3.47Å; R56-L59 PolarHBondContact O-N 2.94Å; R56-L59 VanDerWaalsContact O-N 3.07Å; L57-L59 VanDerWaalsContact C-N 3.34Å; L59-R61 VanDerWaalsContact C-N 3.3Å; L59-R61 PolarHBondContact O-N 2.91Å; L59-R62 WeakPolarHBondContact O-CB 3.44Å; L59-R62 PolarHBondContact O-N 2.86Å; L59-E63 WeakPolarHBondContact O-CG 3.43Å; L59-E63 PolarHBondContact O-N 3.21Å
60	E	94.9	Very high	95.7	Very high	73 Å²	73	108.2 Å²	108.2	34%	0.341	51%	0.514	S	S	.	.	H	α-helix	trans	-56.1	-46	177.8	-72.3	174.9	-160.7	0	0	111	R56 L57 R62 E63 F64	R56-E60 IonicContact NE-OE1 2.72Å; R56-E60 PolarHBondContact NE-OE1 3.32Å; R56-E60 PolarHBondContact O-N 3.13Å; L57-E60 PolarHBondContact O-N 2.95Å; E60-R62 VanDerWaalsContact C-N 3.27Å; E60-R62 PolarHBondContact O-N 3.32Å; E60-E63 PolarHBondContact O-N 2.92Å; E60-F64 HydrophobicContact CB-CE2 4.47Å; E60-F64 WeakPolarHBondContact O-CD2 3.45Å; E60-F64 PolarHBondContact O-N 3.47Å
61	R	95.5	Very high	95.5	Very high	205 Å²	205	107.1 Å²	107.1	77%	0.774	51%	0.508	S	S	*	.	H	α-helix	trans	-58	-38.9	176.7	-176.2	-179	175.1	-149	-0.7	112.3	L57 L59 A65	L57-R61 VanDerWaalsContact O-CB 3.23Å; L57-R61 WeakPolarHBondContact O-CB 3.48Å; L57-R61 PolarHBondContact O-N 3.37Å; L59-R61 VanDerWaalsContact C-N 3.3Å; L59-R61 PolarHBondContact O-N 2.91Å; R61-A65 WeakPolarHBondContact O-CB 3.42Å; R61-A65 PolarHBondContact O-N 2.95Å
62	R	94.9	Very high	95.3	Very high	138 Å²	138	108.5 Å²	108.5	52%	0.521	51%	0.508	S	S	.	.	H	α-helix	trans	-68.1	-44.9	177.3	-170.4	-177.8	-54.4	133.8	12.2	111.2	S58 L59 E60 F64 A65 D66	S58-R62 PolarHBondContact O-N 3.36Å; L59-R62 WeakPolarHBondContact O-CB 3.44Å; L59-R62 PolarHBondContact O-N 2.86Å; E60-R62 VanDerWaalsContact C-N 3.27Å; E60-R62 PolarHBondContact O-N 3.32Å; R62-F64 VanDerWaalsContact C-N 3.34Å; R62-F64 PolarHBondContact O-N 2.97Å; R62-A65 WeakPolarHBondContact O-CB 3.37Å; R62-A65 PolarHBondContact O-N 3.07Å; R62-A65 VanDerWaalsContact O-N 3.15Å; R62-D66 PolarHBondContact O-N 3.1Å
63	E	94.8	Very high	95.1	Very high	126 Å²	126	104.1 Å²	104.1	59%	0.589	49%	0.494	S	S	*	.	H	α-helix	trans	-60.5	-43.2	176.7	-68.2	176.9	174.9	0	0	111.5	L59 E60 A65 D66 V67	L59-E63 WeakPolarHBondContact O-CG 3.43Å; L59-E63 PolarHBondContact O-N 3.21Å; E60-E63 PolarHBondContact O-N 2.92Å; E63-A65 PolarHBondContact O-N 3.37Å; E63-D66 PolarHBondContact O-N 2.84Å; E63-V67 WeakPolarHBondContact O-CG2 3.36Å; E63-V67 PolarHBondContact O-N 2.93Å
64	F	94.8	Very high	94.8	Very high	138 Å²	138	107.4 Å²	107.4	61%	0.605	50%	0.503	S	S	*	.	H	α-helix	trans	-61.4	-42.3	173.5	-80	-65.4	0	0	0	112.4	E60 R62 V67 L68	E60-F64 HydrophobicContact CB-CE2 4.47Å; E60-F64 WeakPolarHBondContact O-CD2 3.45Å; E60-F64 PolarHBondContact O-N 3.47Å; R62-F64 VanDerWaalsContact C-N 3.34Å; R62-F64 PolarHBondContact O-N 2.97Å; F64-V67 PolarHBondContact O-N 2.98Å; F64-L68 WeakPolarHBondContact O-CG 3.42Å; F64-L68 PolarHBondContact O-N 3.13Å
65	A	94.3	Very high	94.4	Very high	53 Å²	53	108.2 Å²	108.2	44%	0.438	50%	0.503	S	S	.	.	H	α-helix	trans	-62.9	-41.5	176.6	0	0	0	0	0	112	R61 R62 E63 L68 E69	R61-A65 WeakPolarHBondContact O-CB 3.42Å; R61-A65 PolarHBondContact O-N 2.95Å; R62-A65 WeakPolarHBondContact O-CB 3.37Å; R62-A65 PolarHBondContact O-N 3.07Å; R62-A65 VanDerWaalsContact O-N 3.15Å; E63-A65 PolarHBondContact O-N 3.37Å; A65-L68 PolarHBondContact O-N 3.03Å; A65-E69 WeakPolarHBondContact O-CB 3.3Å; A65-E69 PolarHBondContact O-N 3.15Å
66	D	94.4	Very high	94	Very high	90 Å²	90	105.8 Å²	105.8	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-64.3	-41.4	176.5	-71.5	-22.6	0	0	0	111.5	R62 E63 E69 N70	R62-D66 PolarHBondContact O-N 3.1Å; E63-D66 PolarHBondContact O-N 2.84Å; D66-E69 PolarHBondContact O-N 3.35Å; D66-N70 VanDerWaalsContact O-CB 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.43Å; D66-N70 PolarHBondContact O-N 3.47Å; D66-N70 PolarHBondContact O-ND2 2.96Å
67	V	95.6	Very high	93.5	Very high	80 Å²	80	106 Å²	106	49%	0.485	50%	0.499	S	S	.	.	H	α-helix	trans	-62.1	-45	174.7	170.9	0	0	0	0	111.2	E63 F64 N70 L71	E63-V67 WeakPolarHBondContact O-CG2 3.36Å; E63-V67 PolarHBondContact O-N 2.93Å; F64-V67 PolarHBondContact O-N 2.98Å; V67-N70 PolarHBondContact O-N 2.83Å; V67-L71 HydrophobicContact CG1-CD1 4.08Å; V67-L71 WeakPolarHBondContact O-CG 3.48Å; V67-L71 PolarHBondContact O-N 3.11Å
68	L	94.6	Very high	92.8	Very high	114 Å²	114	104.9 Å²	104.9	60%	0.597	50%	0.495	S	S	*	.	H	α-helix	trans	-64.4	-42.7	177.8	-72.7	176.3	0	0	0	112.2	F64 A65 N70 L71 R72	F64-L68 WeakPolarHBondContact O-CG 3.42Å; F64-L68 PolarHBondContact O-N 3.13Å; A65-L68 PolarHBondContact O-N 3.03Å; L68-N70 VanDerWaalsContact C-N 3.33Å; L68-N70 PolarHBondContact O-N 3.48Å; L68-L71 HydrophobicContact CD2-CD1 4.46Å; L68-L71 WeakPolarHBondContact O-CB 3.48Å; L68-L71 PolarHBondContact O-N 2.87Å; L68-R72 PolarHBondContact O-N 2.96Å
69	E	93.7	Very high	91.8	Very high	62 Å²	62	105.4 Å²	105.4	29%	0.29	49%	0.493	S	S	.	.	H	α-helix	trans	-66.5	-37.1	177.2	-176.4	58.1	-164.3	0	0	111.5	A65 D66 R72 K73	A65-E69 WeakPolarHBondContact O-CB 3.3Å; A65-E69 PolarHBondContact O-N 3.15Å; D66-E69 PolarHBondContact O-N 3.35Å; E69-R72 PolarHBondContact O-N 3.29Å; E69-R72 IonicContact OE1-CZ 3.72Å; E69-R72 IonicContact OE1-NE 3.59Å; E69-R72 IonicContact OE1-NH2 2.96Å; E69-R72 PolarHBondContact OE1-NH2 2.91Å; E69-R72 IonicContact OE2-CZ 3.36Å; E69-R72 IonicContact OE2-NE 2.87Å; E69-R72 PolarHBondContact OE2-NE 3.32Å; E69-R72 IonicContact OE2-NH2 3.26Å; E69-R72 PolarHBondContact OE2-NH2 3.34Å; E69-K73 HydrophobicContact CG-CD 4.31Å; E69-K73 WeakPolarHBondContact O-CB 3.43Å; E69-K73 WeakPolarHBondContact O-CG 3.29Å; E69-K73 PolarHBondContact O-N 2.9Å; E69-K73 VanDerWaalsContact OE1-CE 3.25Å; E69-K73 WeakPolarHBondContact OE1-CE 3.44Å; E69-K73 IonicContact OE1-NZ 2.73Å
70	N	94	Very high	90.9	Very high	89 Å²	89	105.4 Å²	105.4	48%	0.476	49%	0.491	S	S	.	.	H	α-helix	trans	-65.9	-36.2	173	-75.4	-36.6	0	0	0	112.6	D66 V67 L68 R74	D66-N70 VanDerWaalsContact O-CB 3.31Å; D66-N70 WeakPolarHBondContact O-CB 3.43Å; D66-N70 PolarHBondContact O-N 3.47Å; D66-N70 PolarHBondContact O-ND2 2.96Å; V67-N70 PolarHBondContact O-N 2.83Å; L68-N70 VanDerWaalsContact C-N 3.33Å; L68-N70 PolarHBondContact O-N 3.48Å; N70-R74 WeakPolarHBondContact O-CB 3.42Å; N70-R74 WeakPolarHBondContact O-CG 3.46Å; N70-R74 PolarHBondContact O-N 3.26Å; N70-R74 VanDerWaalsContact O-N 3.09Å
71	L	94.2	Very high	89.7	Confident	80 Å²	80	109.3 Å²	109.3	42%	0.419	50%	0.502	S	S	.	.	H	α-helix	trans	-65.4	-46.4	171.8	-80.4	164	0	0	0	111.3	V67 L68 K73 R74 H75	V67-L71 HydrophobicContact CG1-CD1 4.08Å; V67-L71 WeakPolarHBondContact O-CG 3.48Å; V67-L71 PolarHBondContact O-N 3.11Å; L68-L71 HydrophobicContact CD2-CD1 4.46Å; L68-L71 WeakPolarHBondContact O-CB 3.48Å; L68-L71 PolarHBondContact O-N 2.87Å; L71-K73 PolarHBondContact O-N 2.9Å; L71-R74 WeakPolarHBondContact O-CB 3.47Å; L71-R74 PolarHBondContact O-N 3.45Å; L71-R74 VanDerWaalsContact O-N 3.15Å; L71-H75 PolarHBondContact O-N 3.19Å
72	R	93.3	Very high	88.4	Confident	159 Å²	159	104.1 Å²	104.1	60%	0.6	49%	0.49	S	S	*	.	H	α-helix	trans	-57.9	-49.9	177.2	-169.5	176.5	77.8	134.7	8.2	111.7	L68 E69 R74 H75 E76	L68-R72 PolarHBondContact O-N 2.96Å; E69-R72 PolarHBondContact O-N 3.29Å; E69-R72 IonicContact OE1-CZ 3.72Å; E69-R72 IonicContact OE1-NE 3.59Å; E69-R72 IonicContact OE1-NH2 2.96Å; E69-R72 PolarHBondContact OE1-NH2 2.91Å; E69-R72 IonicContact OE2-CZ 3.36Å; E69-R72 IonicContact OE2-NE 2.87Å; E69-R72 PolarHBondContact OE2-NE 3.32Å; E69-R72 IonicContact OE2-NH2 3.26Å; E69-R72 PolarHBondContact OE2-NH2 3.34Å; R72-R74 VanDerWaalsContact C-N 3.29Å; R72-R74 PolarHBondContact O-N 3.01Å; R72-H75 WeakPolarHBondContact O-CB 3.4Å; R72-H75 PolarHBondContact O-N 2.63Å; R72-E76 PolarHBondContact O-N 2.98Å
73	K	93.1	Very high	87.1	Confident	100 Å²	100	102.2 Å²	102.2	44%	0.435	49%	0.494	S	S	.	.	H	α-helix	trans	-60.2	-35.6	175.8	-74	172.5	179.3	166.6	0	112.8	E69 L71 K77	E69-K73 HydrophobicContact CG-CD 4.31Å; E69-K73 WeakPolarHBondContact O-CB 3.43Å; E69-K73 WeakPolarHBondContact O-CG 3.29Å; E69-K73 PolarHBondContact O-N 2.9Å; E69-K73 VanDerWaalsContact OE1-CE 3.25Å; E69-K73 WeakPolarHBondContact OE1-CE 3.44Å; E69-K73 IonicContact OE1-NZ 2.73Å; L71-K73 PolarHBondContact O-N 2.9Å; K73-K77 VanDerWaalsContact O-CG 3.26Å; K73-K77 WeakPolarHBondContact O-CG 3.46Å; K73-K77 PolarHBondContact O-N 3.08Å; K73-K77 VanDerWaalsContact O-N 3.13Å
74	R	90.8	Very high	85.6	Confident	151 Å²	151	103.4 Å²	103.4	57%	0.57	49%	0.493	S	S	*	.	H	α-helix	trans	-68.3	-44.1	175	-81.2	-171.5	-69.4	163	-9.5	111.5	N70 L71 R72 K77 V78	N70-R74 WeakPolarHBondContact O-CB 3.42Å; N70-R74 WeakPolarHBondContact O-CG 3.46Å; N70-R74 PolarHBondContact O-N 3.26Å; N70-R74 VanDerWaalsContact O-N 3.09Å; L71-R74 WeakPolarHBondContact O-CB 3.47Å; L71-R74 PolarHBondContact O-N 3.45Å; L71-R74 VanDerWaalsContact O-N 3.15Å; R72-R74 VanDerWaalsContact C-N 3.29Å; R72-R74 PolarHBondContact O-N 3.01Å; R74-K77 PolarHBondContact O-N 3.17Å; R74-V78 WeakPolarHBondContact O-CG2 3.42Å; R74-V78 PolarHBondContact O-N 3.07Å
75	H	89.1	Confident	84.1	Confident	119 Å²	119	100.2 Å²	100.2	55%	0.551	49%	0.485	S	S	*	.	H	α-helix	trans	-59.7	-48.2	176.8	-164.9	-80.8	0	0	0	110.9	L71 R72 K77 V78 D79	L71-H75 PolarHBondContact O-N 3.19Å; R72-H75 WeakPolarHBondContact O-CB 3.4Å; R72-H75 PolarHBondContact O-N 2.63Å; H75-K77 VanDerWaalsContact C-N 3.31Å; H75-K77 PolarHBondContact O-N 3Å; H75-V78 WeakPolarHBondContact O-CA 3.29Å; H75-V78 WeakPolarHBondContact O-CB 3.36Å; H75-V78 PolarHBondContact O-N 2.72Å; H75-D79 IonicContact CE1-OD1 3.49Å; H75-D79 PolarHBondContact CE1-OD1 2.89Å; H75-D79 IonicContact CE1-OD2 3.09Å; H75-D79 PolarHBondContact CE1-OD2 3.31Å; H75-D79 IonicContact CG-OD2 3.95Å; H75-D79 IonicContact ND1-OD1 3.75Å; H75-D79 IonicContact ND1-OD2 2.75Å; H75-D79 PolarHBondContact ND1-OD2 3.32Å; H75-D79 PolarHBondContact O-N 2.86Å
76	E	88	Confident	82.5	Confident	101 Å²	101	102.9 Å²	102.9	47%	0.472	49%	0.491	S	S	.	.	H	α-helix	trans	-59.8	-40.2	177.6	-169.2	-176	174.1	0	0	112.4	R72 V78 D79 Q80	R72-E76 PolarHBondContact O-N 2.98Å; E76-V78 VanDerWaalsContact C-N 3.34Å; E76-V78 PolarHBondContact O-N 3.02Å; E76-D79 PolarHBondContact O-N 3.47Å; E76-Q80 WeakPolarHBondContact O-CB 3.33Å; E76-Q80 VanDerWaalsContact O-CG 3.27Å; E76-Q80 WeakPolarHBondContact O-CG 3.48Å; E76-Q80 PolarHBondContact O-N 3.31Å
77	K	86.5	Confident	81.1	Confident	120 Å²	120	105.3 Å²	105.3	52%	0.522	50%	0.497	S	S	.	.	H	α-helix	trans	-64.4	-36.9	174	-75.2	173.3	-176.4	-179.6	0	112.5	K73 R74 H75 R81	K73-K77 VanDerWaalsContact O-CG 3.26Å; K73-K77 WeakPolarHBondContact O-CG 3.46Å; K73-K77 PolarHBondContact O-N 3.08Å; K73-K77 VanDerWaalsContact O-N 3.13Å; R74-K77 PolarHBondContact O-N 3.17Å; H75-K77 VanDerWaalsContact C-N 3.31Å; H75-K77 PolarHBondContact O-N 3Å; K77-R81 VanDerWaalsContact O-CG 3.24Å; K77-R81 WeakPolarHBondContact O-CG 3.42Å; K77-R81 PolarHBondContact O-N 3.02Å
78	V	82.4	Confident	79.4	Confident	65 Å²	65	106.4 Å²	106.4	39%	0.394	50%	0.501	S	S	.	.	H	α-helix	trans	-68.1	-45.5	175.9	170.3	0	0	0	0	110	R74 H75 E76 Q80 R81 N82	R74-V78 WeakPolarHBondContact O-CG2 3.42Å; R74-V78 PolarHBondContact O-N 3.07Å; H75-V78 WeakPolarHBondContact O-CA 3.29Å; H75-V78 WeakPolarHBondContact O-CB 3.36Å; H75-V78 PolarHBondContact O-N 2.72Å; E76-V78 VanDerWaalsContact C-N 3.34Å; E76-V78 PolarHBondContact O-N 3.02Å; V78-Q80 PolarHBondContact O-N 3.23Å; V78-R81 WeakPolarHBondContact O-CB 3.47Å; V78-R81 PolarHBondContact O-N 3.34Å; V78-R81 VanDerWaalsContact O-N 3.15Å; V78-N82 WeakPolarHBondContact O-CB 3.37Å; V78-N82 VanDerWaalsContact O-CG 3.24Å; V78-N82 PolarHBondContact O-N 2.93Å; V78-N82 PolarHBondContact O-ND2 3.19Å
79	D	74.6	Confident	77.8	Confident	70 Å²	70	105.2 Å²	105.2	37%	0.374	50%	0.495	S	S	.	.	H	α-helix	trans	-60.4	-45.6	176.3	-65.6	-27.1	0	0	0	111.3	H75 E76 R81 N82 V83	H75-D79 IonicContact CE1-OD1 3.49Å; H75-D79 PolarHBondContact CE1-OD1 2.89Å; H75-D79 IonicContact CE1-OD2 3.09Å; H75-D79 PolarHBondContact CE1-OD2 3.31Å; H75-D79 IonicContact CG-OD2 3.95Å; H75-D79 IonicContact ND1-OD1 3.75Å; H75-D79 IonicContact ND1-OD2 2.75Å; H75-D79 PolarHBondContact ND1-OD2 3.32Å; H75-D79 PolarHBondContact O-N 2.86Å; E76-D79 PolarHBondContact O-N 3.47Å; D79-R81 VanDerWaalsContact C-N 3.33Å; D79-R81 PolarHBondContact O-N 3.14Å; D79-N82 PolarHBondContact O-N 3.39Å; D79-V83 VanDerWaalsContact O-CG2 3.29Å; D79-V83 WeakPolarHBondContact O-CG2 3.48Å; D79-V83 PolarHBondContact O-N 3.29Å
80	Q	74.5	Confident	76.2	Confident	81 Å²	81	106.9 Å²	106.9	38%	0.379	51%	0.505	S	S	.	.	H	α-helix	trans	-60.6	-39.6	175.1	-74.3	-178.2	22	0	0	112.6	E76 V78 R84	E76-Q80 WeakPolarHBondContact O-CB 3.33Å; E76-Q80 VanDerWaalsContact O-CG 3.27Å; E76-Q80 WeakPolarHBondContact O-CG 3.48Å; E76-Q80 PolarHBondContact O-N 3.31Å; V78-Q80 PolarHBondContact O-N 3.23Å; Q80-R84 VanDerWaalsContact O-CG 3.3Å; Q80-R84 WeakPolarHBondContact O-CG 3.46Å; Q80-R84 PolarHBondContact O-N 2.9Å
81	R	71.7	Confident	74.6	Confident	154 Å²	154	107.3 Å²	107.3	58%	0.581	51%	0.507	S	S	*	.	H	α-helix	trans	-66.1	-43.1	174.6	-74	172.8	-164.6	166.3	2.2	110.9	K77 V78 D79 V83 R84 T85	K77-R81 VanDerWaalsContact O-CG 3.24Å; K77-R81 WeakPolarHBondContact O-CG 3.42Å; K77-R81 PolarHBondContact O-N 3.02Å; V78-R81 WeakPolarHBondContact O-CB 3.47Å; V78-R81 PolarHBondContact O-N 3.34Å; V78-R81 VanDerWaalsContact O-N 3.15Å; D79-R81 VanDerWaalsContact C-N 3.33Å; D79-R81 PolarHBondContact O-N 3.14Å; R81-V83 VanDerWaalsContact C-N 3.33Å; R81-V83 PolarHBondContact O-N 3.32Å; R81-R84 PolarHBondContact O-N 2.98Å; R81-T85 WeakPolarHBondContact O-CB 3.34Å; R81-T85 PolarHBondContact O-N 2.96Å; R81-T85 PolarHBondContact O-OG1 3.36Å
82	N	67.1	Low	73	Confident	96 Å²	96	106.1 Å²	106.1	51%	0.513	51%	0.506	S	S	.	.	H	α-helix	trans	-62.5	-40.9	178.2	-69.8	-16.1	0	0	0	111.4	V78 D79 T85 L86	V78-N82 WeakPolarHBondContact O-CB 3.37Å; V78-N82 VanDerWaalsContact O-CG 3.24Å; V78-N82 PolarHBondContact O-N 2.93Å; V78-N82 PolarHBondContact O-ND2 3.19Å; D79-N82 PolarHBondContact O-N 3.39Å; N82-T85 PolarHBondContact O-N 3.33Å; N82-L86 VanDerWaalsContact O-CB 3.29Å; N82-L86 WeakPolarHBondContact O-CB 3.46Å; N82-L86 PolarHBondContact O-N 3.37Å
83	V	67.8	Low	71.4	Confident	98 Å²	98	103.2 Å²	103.2	59%	0.594	50%	0.502	S	S	*	.	H	α-helix	trans	-63.6	-44	174.2	172.7	0	0	0	0	111.7	D79 R81 L86 K87	D79-V83 VanDerWaalsContact O-CG2 3.29Å; D79-V83 WeakPolarHBondContact O-CG2 3.48Å; D79-V83 PolarHBondContact O-N 3.29Å; R81-V83 VanDerWaalsContact C-N 3.33Å; R81-V83 PolarHBondContact O-N 3.32Å; V83-L86 PolarHBondContact O-N 3.31Å; V83-K87 WeakPolarHBondContact O-CB 3.42Å; V83-K87 PolarHBondContact O-N 3.05Å
84	R	63.6	Low	69.8	Low	151 Å²	151	102.3 Å²	102.3	57%	0.57	51%	0.505	S	S	*	.	H	α-helix	trans	-65.4	-42.7	176.2	-70.1	177.7	-148.7	169.4	6.6	111.9	Q80 R81 K87 N88	Q80-R84 VanDerWaalsContact O-CG 3.3Å; Q80-R84 WeakPolarHBondContact O-CG 3.46Å; Q80-R84 PolarHBondContact O-N 2.9Å; R81-R84 PolarHBondContact O-N 2.98Å; R84-K87 PolarHBondContact O-N 2.91Å; R84-N88 WeakPolarHBondContact O-CB 3.39Å; R84-N88 PolarHBondContact O-N 3.09Å; R84-N88 PolarHBondContact O-OD1 3.41Å
85	T	63.2	Low	68.2	Low	72 Å²	72	102.3 Å²	102.3	44%	0.442	51%	0.506	S	S	.	.	H	α-helix	trans	-63.4	-42.3	176.6	-58.1	0	0	0	0	110.9	R81 N82 N88 N89	R81-T85 WeakPolarHBondContact O-CB 3.34Å; R81-T85 PolarHBondContact O-N 2.96Å; R81-T85 PolarHBondContact O-OG1 3.36Å; N82-T85 PolarHBondContact O-N 3.33Å; T85-N88 PolarHBondContact O-N 2.91Å; T85-N89 WeakPolarHBondContact O-CB 3.49Å; T85-N89 PolarHBondContact O-N 3.15Å; T85-N89 PolarHBondContact O-ND2 3.49Å
86	L	59.5	Low	66.8	Low	109 Å²	109	100.5 Å²	100.5	57%	0.571	50%	0.5	S	S	*	.	H	α-helix	trans	-61.8	-47.7	174.9	-173.8	64.3	0	0	0	110.8	N82 V83 N88 N89 L90	N82-L86 VanDerWaalsContact O-CB 3.29Å; N82-L86 WeakPolarHBondContact O-CB 3.46Å; N82-L86 PolarHBondContact O-N 3.37Å; V83-L86 PolarHBondContact O-N 3.31Å; L86-N88 VanDerWaalsContact C-N 3.32Å; L86-N88 PolarHBondContact O-N 3.07Å; L86-N89 PolarHBondContact O-N 2.79Å; L86-L90 HydrophobicContact CD1-CD1 3.68Å; L86-L90 HydrophobicContact CG-CD1 3.65Å; L86-L90 WeakPolarHBondContact O-CD1 3.45Å; L86-L90 PolarHBondContact O-N 2.96Å
87	K	65.1	Low	65.3	Low	140 Å²	140	99.8 Å²	99.8	61%	0.609	51%	0.505	S	S	*	.	H	α-helix	trans	-60.4	-40.6	177	-170.2	174.4	-178.4	177.5	0	112.4	V83 R84 N91	V83-K87 WeakPolarHBondContact O-CB 3.42Å; V83-K87 PolarHBondContact O-N 3.05Å; R84-K87 PolarHBondContact O-N 2.91Å; K87-N91 WeakPolarHBondContact O-CB 3.43Å; K87-N91 VanDerWaalsContact O-CG 3.29Å; K87-N91 PolarHBondContact O-N 3.39Å
88	N	60.3	Low	64	Low	104 Å²	104	99.3 Å²	99.3	56%	0.556	50%	0.504	S	S	*	.	H	α-helix	trans	-68.5	-38.6	177.1	-71.1	-4.4	0	0	0	112	R84 T85 L86 N91 S92	R84-N88 WeakPolarHBondContact O-CB 3.39Å; R84-N88 PolarHBondContact O-N 3.09Å; R84-N88 PolarHBondContact O-OD1 3.41Å; T85-N88 PolarHBondContact O-N 2.91Å; L86-N88 VanDerWaalsContact C-N 3.32Å; L86-N88 PolarHBondContact O-N 3.07Å; N88-N91 PolarHBondContact O-N 2.92Å; N88-S92 VanDerWaalsContact O-CB 3.23Å; N88-S92 WeakPolarHBondContact O-CB 3.47Å; N88-S92 PolarHBondContact O-N 3.4Å
89	N	60.7	Low	62.8	Low	88 Å²	88	103.1 Å²	103.1	47%	0.471	51%	0.512	S	S	.	.	H	α-helix	trans	-68.8	-38.5	176.7	-72	-19.4	0	0	0	111.9	T85 L86 N93	T85-N89 WeakPolarHBondContact O-CB 3.49Å; T85-N89 PolarHBondContact O-N 3.15Å; T85-N89 PolarHBondContact O-ND2 3.49Å; L86-N89 PolarHBondContact O-N 2.79Å; N89-N93 WeakPolarHBondContact O-CB 3.43Å; N89-N93 VanDerWaalsContact O-CG 3.28Å; N89-N93 PolarHBondContact O-N 2.85Å; N89-N93 PolarHBondContact O-ND2 3.3Å
90	L	60.9	Low	62	Low	98 Å²	98	103.9 Å²	103.9	51%	0.513	52%	0.516	S	S	.	.	H	α-helix	trans	-64	-46.7	172.2	-87.6	101.9	0	0	0	111.4	L86 S92 N93 V94	L86-L90 HydrophobicContact CD1-CD1 3.68Å; L86-L90 HydrophobicContact CG-CD1 3.65Å; L86-L90 WeakPolarHBondContact O-CD1 3.45Å; L86-L90 PolarHBondContact O-N 2.96Å; L90-S92 VanDerWaalsContact C-N 3.35Å; L90-S92 PolarHBondContact O-N 3.14Å; L90-N93 PolarHBondContact O-N 3.44Å; L90-V94 VanDerWaalsContact O-CG2 3.27Å; L90-V94 WeakPolarHBondContact O-CG2 3.34Å; L90-V94 PolarHBondContact O-N 3.25Å
91	N	61.1	Low	61.1	Low	97 Å²	97	108.4 Å²	108.4	52%	0.519	53%	0.529	S	S	.	.	H	α-helix	trans	-64.7	-38.8	178.6	-73.3	-6.1	0	0	0	112.3	K87 N88 V94 Y95	K87-N91 WeakPolarHBondContact O-CB 3.43Å; K87-N91 VanDerWaalsContact O-CG 3.29Å; K87-N91 PolarHBondContact O-N 3.39Å; N88-N91 PolarHBondContact O-N 2.92Å; N91-V94 PolarHBondContact O-N 2.93Å; N91-Y95 WeakPolarHBondContact O-CB 3.43Å; N91-Y95 PolarHBondContact O-N 3.01Å
92	S	59.7	Low	60.5	Low	56 Å²	56	107.1 Å²	107.1	39%	0.392	53%	0.528	S	S	.	.	H	α-helix	trans	-62.7	-47.8	174.3	-179.6	0	0	0	0	111	N88 L90 V94 Y95 I96	N88-S92 VanDerWaalsContact O-CB 3.23Å; N88-S92 WeakPolarHBondContact O-CB 3.47Å; N88-S92 PolarHBondContact O-N 3.4Å; L90-S92 VanDerWaalsContact C-N 3.35Å; L90-S92 PolarHBondContact O-N 3.14Å; S92-V94 VanDerWaalsContact C-N 3.34Å; S92-V94 PolarHBondContact O-N 3.38Å; S92-Y95 PolarHBondContact O-N 3.48Å; S92-I96 WeakPolarHBondContact O-CB 3.34Å; S92-I96 WeakPolarHBondContact O-CD1 3.25Å; S92-I96 WeakPolarHBondContact O-CG1 3.37Å; S92-I96 PolarHBondContact O-N 3.18Å
93	N	59.4	Low	60	Low	98 Å²	98	107.7 Å²	107.7	52%	0.524	53%	0.527	S	S	.	.	H	α-helix	trans	-64.1	-37.7	177.8	-76	-21.2	0	0	0	112.1	N89 L90 I96 C97	N89-N93 WeakPolarHBondContact O-CB 3.43Å; N89-N93 VanDerWaalsContact O-CG 3.28Å; N89-N93 PolarHBondContact O-N 2.85Å; N89-N93 PolarHBondContact O-ND2 3.3Å; L90-N93 PolarHBondContact O-N 3.44Å; N93-I96 PolarHBondContact O-N 3.47Å; N93-C97 VanDerWaalsContact O-CB 3.27Å; N93-C97 WeakPolarHBondContact O-CB 3.34Å; N93-C97 PolarHBondContact O-N 3.33Å; N93-C97 PolarHBondContact O-SG 2.97Å
94	V	59.1	Low	59.4	Low	81 Å²	81	107.7 Å²	107.7	49%	0.491	52%	0.524	S	S	.	.	H	α-helix	trans	-63.2	-45.4	173.4	171.8	0	0	0	0	110.7	L90 N91 S92 I96 C97 E98	L90-V94 VanDerWaalsContact O-CG2 3.27Å; L90-V94 WeakPolarHBondContact O-CG2 3.34Å; L90-V94 PolarHBondContact O-N 3.25Å; N91-V94 PolarHBondContact O-N 2.93Å; S92-V94 VanDerWaalsContact C-N 3.34Å; S92-V94 PolarHBondContact O-N 3.38Å; V94-I96 PolarHBondContact O-N 2.94Å; V94-C97 PolarHBondContact O-N 2.97Å; V94-E98 WeakPolarHBondContact O-CB 3.38Å; V94-E98 WeakPolarHBondContact O-CG 3.41Å; V94-E98 PolarHBondContact O-N 3.27Å
95	Y	58.3	Low	59	Low	151 Å²	151	108.1 Å²	108.1	59%	0.592	53%	0.526	S	S	*	.	H	α-helix	trans	-66.9	-37.1	178.8	-153.4	-94.6	0	0	0	112.5	N91 S92 E98 R99	N91-Y95 WeakPolarHBondContact O-CB 3.43Å; N91-Y95 PolarHBondContact O-N 3.01Å; S92-Y95 PolarHBondContact O-N 3.48Å; Y95-E98 PolarHBondContact O-N 3.14Å; Y95-R99 WeakPolarHBondContact O-CB 3.44Å; Y95-R99 PolarHBondContact O-N 2.95Å
96	I	59.1	Low	58.5	Low	81 Å²	81	113 Å²	113	42%	0.415	54%	0.537	S	S	.	.	H	α-helix	trans	-66.2	-45.7	174.4	-67.8	163.8	0	0	0	110.1	S92 N93 V94 E98 R99 N100	S92-I96 WeakPolarHBondContact O-CB 3.34Å; S92-I96 WeakPolarHBondContact O-CD1 3.25Å; S92-I96 WeakPolarHBondContact O-CG1 3.37Å; S92-I96 PolarHBondContact O-N 3.18Å; N93-I96 PolarHBondContact O-N 3.47Å; V94-I96 PolarHBondContact O-N 2.94Å; I96-E98 PolarHBondContact O-N 2.85Å; I96-R99 PolarHBondContact O-N 3.2Å; I96-N100 WeakPolarHBondContact O-CB 3.36Å; I96-N100 PolarHBondContact O-N 3.03Å; I96-N100 PolarHBondContact O-ND2 3.14Å
97	C	57.6	Low	58.2	Low	86 Å²	86	113 Å²	113	58%	0.581	54%	0.537	S	S	*	.	H	α-helix	trans	-61.4	-40.5	175.5	-73.3	0	0	0	0	112.3	N93 V94 R101	N93-C97 VanDerWaalsContact O-CB 3.27Å; N93-C97 WeakPolarHBondContact O-CB 3.34Å; N93-C97 PolarHBondContact O-N 3.33Å; N93-C97 PolarHBondContact O-SG 2.97Å; V94-C97 PolarHBondContact O-N 2.97Å; C97-R101 WeakPolarHBondContact O-CB 3.4Å; C97-R101 PolarHBondContact O-N 2.96Å
98	E	58.7	Low	57.6	Low	109 Å²	109	113.8 Å²	113.8	51%	0.509	55%	0.548	S	S	.	.	H	α-helix	trans	-67.4	-38	175.1	-79.5	-171.9	169.9	0	0	112.9	V94 Y95 I96 R101 K102	V94-E98 WeakPolarHBondContact O-CB 3.38Å; V94-E98 WeakPolarHBondContact O-CG 3.41Å; V94-E98 PolarHBondContact O-N 3.27Å; Y95-E98 PolarHBondContact O-N 3.14Å; I96-E98 PolarHBondContact O-N 2.85Å; E98-R101 PolarHBondContact O-N 2.8Å; E98-K102 PolarHBondContact O-N 2.84Å
99	R	57.2	Low	57.3	Low	146 Å²	146	112.9 Å²	112.9	55%	0.551	55%	0.55	S	S	*	.	H	α-helix	trans	-66	-44.2	177.1	-151.3	-178	-162	121.2	1	110.8	Y95 I96 R101 K102 H103	Y95-R99 WeakPolarHBondContact O-CB 3.44Å; Y95-R99 PolarHBondContact O-N 2.95Å; I96-R99 PolarHBondContact O-N 3.2Å; R99-R101 VanDerWaalsContact C-N 3.34Å; R99-R101 PolarHBondContact O-N 2.84Å; R99-K102 PolarHBondContact O-N 3.08Å; R99-K102 VanDerWaalsContact O-N 3.16Å; R99-H103 PolarHBondContact O-CD2 3.49Å; R99-H103 PolarHBondContact O-N 3.46Å
100	N	57.3	Low	56.8	Low	86 Å²	86	112.4 Å²	112.4	46%	0.46	55%	0.546	S	S	.	.	H	α-helix	trans	-62.7	-41	176.4	-66.1	-15.6	0	0	0	111.3	I96 K102 H103 D104	I96-N100 WeakPolarHBondContact O-CB 3.36Å; I96-N100 PolarHBondContact O-N 3.03Å; I96-N100 PolarHBondContact O-ND2 3.14Å; N100-K102 VanDerWaalsContact C-N 3.25Å; N100-K102 PolarHBondContact O-N 2.98Å; N100-H103 PolarHBondContact O-N 3.48Å; N100-H103 VanDerWaalsContact O-N 3.12Å; N100-D104 PolarHBondContact O-N 3.35Å
101	R	56.2	Low	56.1	Low	175 Å²	175	112 Å²	112	66%	0.66	55%	0.545	S	S	*	.	H	α-helix	trans	-66.1	-22.5	176.5	-171.6	176.9	158.2	-171.3	-5.7	114.1	C97 E98 R99 R105	C97-R101 WeakPolarHBondContact O-CB 3.4Å; C97-R101 PolarHBondContact O-N 2.96Å; E98-R101 PolarHBondContact O-N 2.8Å; R99-R101 VanDerWaalsContact C-N 3.34Å; R99-R101 PolarHBondContact O-N 2.84Å; R101-R105 PolarHBondContact O-NE 3.24Å
102	K	58.9	Low	55.8	Low	128 Å²	128	114.4 Å²	114.4	56%	0.557	56%	0.555	S	S	*	*	H	α-helix	trans	-80.9	-41.7	170.3	-71	-177.9	-176	178.1	0	110.9	E98 R99 N100 R105 Y106	E98-K102 PolarHBondContact O-N 2.84Å; R99-K102 PolarHBondContact O-N 3.08Å; R99-K102 VanDerWaalsContact O-N 3.16Å; N100-K102 VanDerWaalsContact C-N 3.25Å; N100-K102 PolarHBondContact O-N 2.98Å; K102-R105 PolarHBondContact O-N 3.38Å; K102-Y106 VanDerWaalsContact O-CD2 3.3Å; K102-Y106 WeakPolarHBondContact O-CD2 3.47Å; K102-Y106 PolarHBondContact O-N 2.81Å
103	H	57.2	Low	55.4	Low	108 Å²	108	118.1 Å²	118.1	50%	0.5	57%	0.57	S	S	.	*	H	α-helix	trans	-66.4	-38.2	177.8	-73.1	-62.5	0	0	0	113.2	R99 N100 R105 Y106 L107	R99-H103 PolarHBondContact O-CD2 3.49Å; R99-H103 PolarHBondContact O-N 3.46Å; N100-H103 PolarHBondContact O-N 3.48Å; N100-H103 VanDerWaalsContact O-N 3.12Å; H103-R105 VanDerWaalsContact C-N 3.27Å; H103-R105 PolarHBondContact O-N 2.96Å; H103-Y106 PolarHBondContact O-N 2.83Å; H103-Y106 VanDerWaalsContact O-N 3.09Å; H103-L107 PolarHBondContact O-N 3.43Å
104	D	54.5	Low	55	Low	98 Å²	98	119.7 Å²	119.7	52%	0.524	58%	0.579	S	S	.	*	H	α-helix	trans	-65.6	-30.3	176.3	-74.4	-20.7	0	0	0	112.6	N100 Y106 L107 N108	N100-D104 PolarHBondContact O-N 3.35Å; D104-Y106 VanDerWaalsContact C-N 3.32Å; D104-Y106 PolarHBondContact O-N 3.32Å; D104-L107 PolarHBondContact O-N 3.48Å; D104-N108 PolarHBondContact O-N 3.39Å
105	R	54.6	Low	54.6	Low	160 Å²	160	122 Å²	122	60%	0.604	59%	0.587	S	S	*	*	H	α-helix	trans	-70.2	-27.9	174.1	-79.8	-168.3	-79.4	174.4	-4.5	113.2	R101 K102 H103 S109	R101-R105 PolarHBondContact O-NE 3.24Å; K102-R105 PolarHBondContact O-N 3.38Å; H103-R105 VanDerWaalsContact C-N 3.27Å; H103-R105 PolarHBondContact O-N 2.96Å; R105-S109 PolarHBondContact O-OG 2.99Å
106	Y	53.8	Low	53.9	Low	173 Å²	173	121.9 Å²	121.9	68%	0.678	60%	0.596	S	S	*	*	H	α-helix	trans	-79.8	-29.2	172.9	-81.7	-81.4	0	0	0	112.2	K102 H103 D104 S109 I110	K102-Y106 VanDerWaalsContact O-CD2 3.3Å; K102-Y106 WeakPolarHBondContact O-CD2 3.47Å; K102-Y106 PolarHBondContact O-N 2.81Å; H103-Y106 PolarHBondContact O-N 2.83Å; H103-Y106 VanDerWaalsContact O-N 3.09Å; D104-Y106 VanDerWaalsContact C-N 3.32Å; D104-Y106 PolarHBondContact O-N 3.32Å; Y106-S109 PolarHBondContact O-OG 3.22Å; Y106-S109 VanDerWaalsContact O-OG 3.06Å; Y106-I110 WeakPolarHBondContact O-CG1 3.45Å
107	L	53.4	Low	53.3	Low	111 Å²	111	123.3 Å²	123.3	58%	0.581	61%	0.61	S	S	*	*	H	α-helix	trans	-75.5	-34	176.7	-69.7	172.5	0	0	0	112.5	H103 D104 S109 I110	H103-L107 PolarHBondContact O-N 3.43Å; D104-L107 PolarHBondContact O-N 3.48Å; L107-S109 VanDerWaalsContact C-N 3.26Å; L107-S109 PolarHBondContact O-N 3.19Å; L107-I110 HydrophobicContact CD2-CD1 4.29Å; L107-I110 PolarHBondContact O-N 2.96Å
108	N	52	Low	52.6	Low	156 Å²	156	129.5 Å²	129.5	83%	0.834	63%	0.627	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.4	-5.6	175.3	-84.8	8.9	0	0	0	114.8	D104	D104-N108 PolarHBondContact O-N 3.39Å
109	S	54.6	Low	51.8	Low	84 Å²	84	127 Å²	127	59%	0.587	63%	0.631	S	S	*	*	T	Hydrogen-bonded Turn	trans	-102.8	0.6	173.2	62.9	0	0	0	0	113.5	R105 Y106 L107 N111	R105-S109 PolarHBondContact O-OG 2.99Å; Y106-S109 PolarHBondContact O-OG 3.22Å; Y106-S109 VanDerWaalsContact O-OG 3.06Å; L107-S109 VanDerWaalsContact C-N 3.26Å; L107-S109 PolarHBondContact O-N 3.19Å; S109-N111 PolarHBondContact O-N 3.06Å
110	I	49.8	Very low	50.8	Low	78 Å²	78	127.9 Å²	127.9	40%	0.4	65%	0.645	S	S	.	*			trans	-86.8	97.9	171.6	-63.6	166	0	0	0	106.7	Y106 L107 M112 I115	Y106-I110 WeakPolarHBondContact O-CG1 3.45Å; L107-I110 HydrophobicContact CD2-CD1 4.29Å; L107-I110 PolarHBondContact O-N 2.96Å; I110-M112 HydrophobicContact CG2-CG 4.44Å; I110-M112 HydrophobicContact CG2-SD 3.67Å; I110-M112 PolarHBondContact O-N 2.98Å; I110-I115 HydrophobicContact CG2-CD1 4.48Å
111	N	45.4	Very low	49.8	Very low	90 Å²	90	133.4 Å²	133.4	48%	0.481	67%	0.666	S	S	.	*			trans	-58.5	102.1	163.1	179.3	20.8	0	0	0	107.9	S109 N113 D114	S109-N111 PolarHBondContact O-N 3.06Å; N111-N113 PolarHBondContact O-N 3.21Å; N111-N113 PolarHBondContact OD1-ND2 2.85Å; N111-N113 VanDerWaalsContact OD1-ND2 3.1Å; N111-D114 PolarHBondContact ND2-OD2 3.5Å
112	M	54.9	Low	49	Very low	148 Å²	148	132.3 Å²	132.3	73%	0.729	67%	0.673	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	11.4	-176	-68.3	-67	-107.5	0	0	113.9	I110	I110-M112 HydrophobicContact CG2-CG 4.44Å; I110-M112 HydrophobicContact CG2-SD 3.67Å; I110-M112 PolarHBondContact O-N 2.98Å
113	N	51	Low	47.7	Very low	134 Å²	134	131.8 Å²	131.8	72%	0.717	69%	0.685	S	S	*	*	T	Hydrogen-bonded Turn	trans	-93.6	-9.8	-178.8	-65.9	-44.5	0	0	0	114.3	N111	N111-N113 PolarHBondContact O-N 3.21Å; N111-N113 PolarHBondContact OD1-ND2 2.85Å; N111-N113 VanDerWaalsContact OD1-ND2 3.1Å
114	D	52.2	Low	46.7	Very low	131 Å²	131	133.8 Å²	133.8	70%	0.701	70%	0.698	S	S	*	*	S	Bend	trans	-119.2	7.9	-172.4	-62.5	-40.4	0	0	0	114.9	N111	N111-D114 PolarHBondContact ND2-OD2 3.5Å
115	I	49.9	Very low	45.8	Very low	129 Å²	129	135.7 Å²	135.7	66%	0.662	71%	0.713	S	S	*	*			trans	-133.4	66.6	-178	-45.4	174.6	0	0	0	110.2	I110	I110-I115 HydrophobicContact CG2-CD1 4.48Å
116	L	43.7	Very low	45.1	Very low	148 Å²	148	133.8 Å²	133.8	78%	0.775	72%	0.72	S	S	*	*			trans	-123.9	102.2	166	-90.6	162.8	0	0	0	108.9	K118	L116-K118 PolarHBondContact O-N 3.2Å
117	P	46.9	Very low	44.5	Very low	112 Å²	112	130.6 Å²	130.6	73%	0.727	72%	0.723	S	S	*	*			trans	-68.4	114.9	157.4	0.2	16.5	0	0	0	106.8	G119	P117-G119 PolarHBondContact O-N 3.35Å
118	K	43.3	Very low	43.8	Very low	216 Å²	216	133.3 Å²	133.3	94%	0.939	74%	0.738	S	S	*	*			trans	-60.5	97	168.4	-66.3	177	179.1	177.3	0	108.1	L116	L116-K118 PolarHBondContact O-N 3.2Å
119	G	40.4	Very low	43.3	Very low	56 Å²	56	132 Å²	132	58%	0.577	74%	0.736	S	S	*	*			trans	176.3	123.7	177	0	0	0	0	0	113.4	P117	P117-G119 PolarHBondContact O-N 3.35Å
120	L	37.7	Very low	42.7	Very low	164 Å²	164	133.1 Å²	133.1	86%	0.859	74%	0.744	S	S	*	*			trans	75.3	77.7	162.8	-63.4	113.6	0	0	0	117.1	N122	L120-N122 PolarHBondContact O-N 2.79Å
121	F	35.1	Very low	42.3	Very low	202 Å²	202	134.5 Å²	134.5	89%	0.886	76%	0.76	S	S	*	*			trans	-60.8	120.8	135.9	-92.3	-96.8	0	0	0	108.5
122	N	40.3	Very low	42.2	Very low	153 Å²	153	135.9 Å²	135.9	82%	0.818	77%	0.772	S	S	*	*			trans	-158.9	115	145	-94.6	-15.9	0	0	0	109.1	L120	L120-N122 PolarHBondContact O-N 2.79Å
123	S	31.1	Very low	41.6	Very low	116 Å²	116	136.3 Å²	136.3	81%	0.811	78%	0.778	S	S	*	*			trans	-57.5	128.7	178.1	-57.9	0	0	0	0	113
124	I	37.2	Very low	41	Very low	150 Å²	150	135.4 Å²	135.4	77%	0.769	78%	0.781	S	S	*	*			trans	-140.6	110.6	147.9	-59.5	-177.6	0	0	0	108.6	T126	I124-T126 HydrophobicContact CG2-CG2 4.44Å
125	T	35.6	Very low	40.5	Very low	138 Å²	138	134.2 Å²	134.2	85%	0.847	78%	0.784	S	S	*	*			trans	-68.9	119.8	161.7	38.7	0	0	0	0	109.9
126	T	39.8	Very low	39.9	Very low	120 Å²	120	133.1 Å²	133.1	74%	0.736	79%	0.787	S	S	*	*			trans	-140.4	121	158.3	31.8	0	0	0	0	110.1	I124	I124-T126 HydrophobicContact CG2-CG2 4.44Å
127	S	40.2	Very low	39.6	Very low	107 Å²	107	133.8 Å²	133.8	75%	0.748	79%	0.791	S	S	*	*			trans	-56.5	130.4	175.2	46.7	0	0	0	0	112.8	T129	S127-T129 PolarHBondContact O-N 3.33Å
128	N	39	Very low	39.4	Very low	167 Å²	167	134.6 Å²	134.6	89%	0.893	79%	0.794	S	S	*	*			trans	-70.6	112.1	167.1	-77.8	-16	0	0	0	110.1	S130	N128-S130 PolarHBondContact O-N 3.23Å
129	T	41.3	Very low	39.3	Very low	129 Å²	129	131.5 Å²	131.5	79%	0.791	79%	0.786	S	S	*	*			trans	-72.5	112.3	166	48.1	0	0	0	0	109.6	S127 S131	S127-T129 PolarHBondContact O-N 3.33Å; T129-S131 PolarHBondContact O-N 3.28Å
130	S	43.1	Very low	39.2	Very low	108 Å²	108	134.2 Å²	134.2	76%	0.755	79%	0.794	S	S	*	*			trans	-75.1	104.4	165	54.1	0	0	0	0	109.4	N128 T132	N128-S130 PolarHBondContact O-N 3.23Å; S130-T132 PolarHBondContact O-N 3.44Å
131	S	40.2	Very low	39.1	Very low	106 Å²	106	135.9 Å²	135.9	74%	0.741	79%	0.794	S	S	*	*			trans	-75.7	102.1	169	55.8	0	0	0	0	109.3	T129	T129-S131 PolarHBondContact O-N 3.28Å
132	T	44.5	Very low	39.3	Very low	120 Å²	120	132.9 Å²	132.9	74%	0.736	79%	0.792	S	S	*	*			trans	-79.7	114.2	166.7	48.1	0	0	0	0	108.9	S130 S134	S130-T132 PolarHBondContact O-N 3.44Å; T132-S134 PolarHBondContact O-N 3.06Å
133	N	41.9	Very low	39.2	Very low	157 Å²	157	131.7 Å²	131.7	84%	0.84	79%	0.79	S	S	*	*			trans	-64.7	100.3	171.3	-65.9	-27.5	0	0	0	109.4	S135	N133-S135 PolarHBondContact O-N 2.9Å
134	S	37.9	Very low	39.7	Very low	114 Å²	114	131 Å²	131	80%	0.797	79%	0.785	S	S	*	*			trans	-84.1	100.3	168.5	45.5	0	0	0	0	109.4	T132 S136	T132-S134 PolarHBondContact O-N 3.06Å; S134-S136 PolarHBondContact O-N 3.05Å
135	S	42.7	Very low	39.9	Very low	107 Å²	107	129.2 Å²	129.2	75%	0.748	79%	0.786	S	S	*	*			trans	-81	104.4	165	42	0	0	0	0	109	N133 L137	N133-S135 PolarHBondContact O-N 2.9Å; S135-L137 PolarHBondContact O-N 3.29Å
136	S	35.7	Very low	40.4	Very low	106 Å²	106	128.2 Å²	128.2	74%	0.741	78%	0.781	S	S	*	*			trans	-69.5	117.4	171.7	69.1	0	0	0	0	109.6	S134 T138	S134-S136 PolarHBondContact O-N 3.05Å; S136-T138 PolarHBondContact O-N 3.38Å
137	L	38.2	Very low	40.3	Very low	161 Å²	161	128.8 Å²	128.8	84%	0.843	78%	0.78	S	S	*	*			trans	-72.1	111.2	163.2	-89.5	91.9	0	0	0	108.8	S135	S135-L137 PolarHBondContact O-N 3.29Å
138	T	43.5	Very low	40.7	Very low	129 Å²	129	130.3 Å²	130.3	79%	0.791	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-74.7	118.5	163.5	30.1	0	0	0	0	109.4	S136	S136-T138 PolarHBondContact O-N 3.38Å
139	I	39.4	Very low	41.1	Very low	152 Å²	152	127.8 Å²	127.8	78%	0.779	77%	0.769	S	S	*	*	P	Polyproline II helix	trans	-70.4	127.9	173.3	-62.2	169	0	0	0	108.5	K141	I139-K141 PolarHBondContact O-N 3.02Å
140	P	39	Very low	41.2	Very low	113 Å²	113	130.8 Å²	130.8	73%	0.734	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-70.2	127.6	171.1	-9.6	24.9	0	0	0	109.9	V142	P140-V142 PolarHBondContact O-N 2.98Å
141	K	36.5	Very low	41.1	Very low	198 Å²	198	132.5 Å²	132.5	86%	0.861	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-57.4	121.8	176	-154.3	167.3	-177.5	173.6	0	109.7	I139 V143	I139-K141 PolarHBondContact O-N 3.02Å; K141-V143 PolarHBondContact O-N 3.3Å; K141-V143 VanDerWaalsContact O-N 3.15Å
142	V	39.6	Very low	41.2	Very low	139 Å²	139	134.9 Å²	134.9	84%	0.842	78%	0.775	S	S	*	*			trans	-64.4	111.2	172.6	-177.7	0	0	0	0	107.6	P140	P140-V142 PolarHBondContact O-N 2.98Å
143	V	38.3	Very low	41	Very low	129 Å²	129	136.5 Å²	136.5	78%	0.782	78%	0.779	S	S	*	*	P	Polyproline II helix	trans	-81.7	119.5	168.8	-176.2	0	0	0	0	106.6	K141	K141-V143 PolarHBondContact O-N 3.3Å; K141-V143 VanDerWaalsContact O-N 3.15Å
144	S	39.6	Very low	40.9	Very low	102 Å²	102	135.4 Å²	135.4	71%	0.713	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-51.2	133.6	175	46.5	0	0	0	0	112
145	S	41.3	Very low	40.9	Very low	111 Å²	111	141.2 Å²	141.2	78%	0.776	78%	0.783	S	S	*	*	P	Polyproline II helix	trans	-54.1	142.7	173.4	-61.9	0	0	0	0	112
146	P	47.3	Very low	40.7	Very low	117 Å²	117	143.8 Å²	143.8	76%	0.76	79%	0.788	S	S	*	*	P	Polyproline II helix	trans	-70	131.4	174.2	28.4	-30.8	0	0	0	110.3	I148	P146-I148 PolarHBondContact O-N 3.4Å
147	D	37.8	Very low	40.9	Very low	133 Å²	133	146 Å²	146	71%	0.711	79%	0.791	S	S	*	*			trans	-67.2	113.9	175.2	-156	-17.9	0	0	0	109.6	T149	D147-T149 PolarHBondContact O-N 2.88Å; D147-T149 PolarHBondContact OD1-OG1 3.29Å
148	I	47.8	Very low	40.9	Very low	139 Å²	139	146 Å²	146	71%	0.713	79%	0.792	S	S	*	*			trans	-84.2	5.8	-170.4	-17.3	175.1	0	0	0	112.5	P146 K150 L151	P146-I148 PolarHBondContact O-N 3.4Å; I148-K150 PolarHBondContact O-N 3.41Å; I148-K150 VanDerWaalsContact O-N 3.13Å; I148-L151 HydrophobicContact CG2-CD1 4.45Å
149	T	46.9	Very low	40.8	Very low	113 Å²	113	149 Å²	149	69%	0.693	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-78.7	9.1	-172.5	50.8	0	0	0	0	115	D147	D147-T149 PolarHBondContact O-N 2.88Å; D147-T149 PolarHBondContact OD1-OG1 3.29Å
150	K	44.9	Very low	40.8	Very low	192 Å²	192	148.7 Å²	148.7	84%	0.835	79%	0.794	S	S	*	*	T	Hydrogen-bonded Turn	trans	-118.6	10.2	-179.7	-67.4	-173	179.5	-179.9	0	115.9	I148	I148-K150 PolarHBondContact O-N 3.41Å; I148-K150 VanDerWaalsContact O-N 3.13Å
151	L	40.3	Very low	40.8	Very low	144 Å²	144	149.8 Å²	149.8	75%	0.754	79%	0.794	S	S	*	*			trans	-99.2	18.3	-179.2	-81.5	169.6	0	0	0	115.3	I148	I148-L151 HydrophobicContact CG2-CD1 4.45Å
152	L	42.7	Very low	40.9	Very low	157 Å²	157	147.2 Å²	147.2	82%	0.822	79%	0.79	S	S	*	*	S	Bend	trans	-102.9	99.6	160.8	-117.8	75.4	0	0	0	107.1
153	N	40.5	Very low	40.9	Very low	153 Å²	153	147.6 Å²	147.6	82%	0.818	79%	0.787	S	S	*	*	S	Bend	trans	151	56	156	-75.8	-16.2	0	0	0	112.5
154	T	39.3	Very low	41.1	Very low	134 Å²	134	147.2 Å²	147.2	82%	0.822	79%	0.79	S	S	*	*			trans	-166.7	92.1	158.7	40.6	0	0	0	0	110.4
155	R	37.6	Very low	40.8	Very low	237 Å²	237	150.4 Å²	150.4	89%	0.894	80%	0.799	S	S	*	*			trans	-173	72.5	139	-136.7	169.1	-172.7	154.6	1.8	112
156	N	38.5	Very low	40.9	Very low	161 Å²	161	154.2 Å²	154.2	86%	0.861	80%	0.802	S	S	*	*			trans	-99.3	117.3	150.8	-107	-6.6	0	0	0	106.6
157	N	39.6	Very low	40.4	Very low	151 Å²	151	156.7 Å²	156.7	81%	0.807	80%	0.803	S	S	*	*			trans	143.3	94	158.6	-77.2	-17	0	0	0	109.9
158	N	39.6	Very low	40.7	Very low	162 Å²	162	158.1 Å²	158.1	87%	0.866	81%	0.809	S	S	*	*			trans	-147.6	105	139.3	-121.6	-1.2	0	0	0	109.7
159	K	39.8	Very low	40.4	Very low	191 Å²	191	157.1 Å²	157.1	83%	0.83	81%	0.805	S	S	*	*			trans	-60.6	127.8	160.3	-89.4	173.9	169.1	173.3	0	108.1
160	N	39.9	Very low	40.2	Very low	146 Å²	146	157.5 Å²	157.5	78%	0.781	81%	0.81	S	S	*	*				179	114.6	126.8	-90.4	-12.3	0	0	0	111.8
161	N	38.3	Very low	39.8	Very low	137 Å²	137	155.7 Å²	155.7	73%	0.733	81%	0.808	S	S	*	*			trans	38.3	107.9	134.7	-69.5	-1	0	0	0	119.6
162	N	39.5	Very low	39.7	Very low	144 Å²	144	154.1 Å²	154.1	77%	0.77	81%	0.806	S	S	*	*				169.9	135.2	98.6	-88.5	-24.3	0	0	0	112.2
163	N	39.6	Very low	39.4	Very low	147 Å²	147	152 Å²	152	79%	0.786	80%	0.8	S	S	*	*			trans	54.8	99.4	150.1	-66.3	-11.7	0	0	0	119.9
164	S	42.2	Very low	39.2	Very low	121 Å²	121	151.8 Å²	151.8	85%	0.846	80%	0.797	S	S	*	*				159.4	127.8	103.5	53.6	0	0	0	0	110.5	K166	S164-K166 PolarHBondContact O-N 3.37Å; S164-K166 VanDerWaalsContact O-N 3.14Å
165	N	33.8	Very low	39	Very low	168 Å²	168	153.1 Å²	153.1	90%	0.898	79%	0.794	S	S	*	*			trans	-61.5	106.6	-177.1	-72.3	-26.8	0	0	0	112.3
166	K	43.8	Very low	39.1	Very low	192 Å²	192	147.7 Å²	147.7	84%	0.835	79%	0.787	S	S	*	*			trans	-142.3	108	142.2	-74.1	-166.8	-179.7	175.5	0	108.7	S164 L168	S164-K166 PolarHBondContact O-N 3.37Å; S164-K166 VanDerWaalsContact O-N 3.14Å; K166-L168 PolarHBondContact O-N 3.13Å
167	H	36.7	Very low	38.9	Very low	168 Å²	168	148.8 Å²	148.8	78%	0.778	79%	0.787	S	S	*	*			trans	-57.3	96.7	174.5	-173.7	-82.8	0	0	0	110	N169	H167-N169 PolarHBondContact CE1-OD1 3.33Å; H167-N169 PolarHBondContact ND1-OD1 2.98Å
168	L	43	Very low	38.9	Very low	163 Å²	163	147.5 Å²	147.5	85%	0.853	79%	0.785	S	S	*	*			trans	-83.6	113	167.4	-87.9	116.6	0	0	0	108.3	K166	K166-L168 PolarHBondContact O-N 3.13Å
169	N	42.1	Very low	38.7	Very low	118 Å²	118	144.6 Å²	144.6	63%	0.631	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-58	141.6	172.3	-66.9	-27.2	0	0	0	110.3	H167 I171	H167-N169 PolarHBondContact CE1-OD1 3.33Å; H167-N169 PolarHBondContact ND1-OD1 2.98Å; N169-I171 PolarHBondContact O-N 3.42Å
170	P	42.5	Very low	38.5	Very low	121 Å²	121	143.1 Å²	143.1	79%	0.786	78%	0.778	S	S	*	*	P	Polyproline II helix	trans	-65.1	133.8	177.1	25.7	-31.6	0	0	0	110.9
171	I	37.2	Very low	38.4	Very low	154 Å²	154	139.9 Å²	139.9	79%	0.79	77%	0.768	S	S	*	*	P	Polyproline II helix	trans	-64.8	132.4	175.5	-61.8	169.3	0	0	0	108.7	N169 T173	N169-I171 PolarHBondContact O-N 3.42Å; I171-T173 PolarHBondContact O-N 2.91Å
172	P	37.5	Very low	38.4	Very low	111 Å²	111	140.6 Å²	140.6	72%	0.721	78%	0.777	S	S	*	*	P	Polyproline II helix	trans	-64	125.3	175.8	-15.5	28.5	0	0	0	110.5	I174	P172-I174 PolarHBondContact O-N 3.42Å
173	T	35.6	Very low	38.4	Very low	114 Å²	114	141.1 Å²	141.1	70%	0.699	78%	0.775	S	S	*	*			trans	-74.8	114.7	170.5	-58.1	0	0	0	0	108.1	I171 H175	I171-T173 PolarHBondContact O-N 2.91Å; T173-H175 PolarHBondContact O-N 3.24Å
174	I	36.9	Very low	38.4	Very low	148 Å²	148	144.3 Å²	144.3	76%	0.759	78%	0.782	S	S	*	*			trans	-79.8	109.8	171.7	-59.5	174.4	0	0	0	106.9	P172 T176	P172-I174 PolarHBondContact O-N 3.42Å; I174-T176 PolarHBondContact O-N 3.46Å
175	H	36.5	Very low	38.2	Very low	161 Å²	161	144.2 Å²	144.2	75%	0.745	78%	0.775	S	S	*	*			trans	-72.5	108.7	167.9	-69.7	-78.5	0	0	0	108.3	T173 E177	T173-H175 PolarHBondContact O-N 3.24Å; H175-E177 PolarHBondContact O-N 3.39Å
176	T	37.9	Very low	38.7	Very low	123 Å²	123	141 Å²	141	76%	0.755	77%	0.766	S	S	*	*			trans	-75.1	98.7	162.4	37.3	0	0	0	0	107.9	I174 T178	I174-T176 PolarHBondContact O-N 3.46Å; T176-T178 PolarHBondContact O-N 2.95Å
177	E	34.3	Very low	38.6	Very low	185 Å²	185	141 Å²	141	86%	0.864	77%	0.766	S	S	*	*			trans	-57.3	109.1	165	-68.5	-175.3	174	0	0	108	H175 S179	H175-E177 PolarHBondContact O-N 3.39Å; E177-S179 PolarHBondContact O-N 3.05Å; E177-S179 VanDerWaalsContact O-N 3.13Å
178	T	39.5	Very low	38.8	Very low	124 Å²	124	138.1 Å²	138.1	76%	0.761	76%	0.762	S	S	*	*			trans	-77	97.9	167.2	-36.6	0	0	0	0	105	T176 N180	T176-T178 PolarHBondContact O-N 2.95Å; T178-N180 PolarHBondContact O-N 3.41Å; T178-N180 VanDerWaalsContact O-N 3.11Å
179	S	36.7	Very low	38.8	Very low	101 Å²	101	135.2 Å²	135.2	71%	0.706	75%	0.748	S	S	*	*			trans	-58.7	114.3	169.8	35.9	0	0	0	0	108.1	E177 S181	E177-S179 PolarHBondContact O-N 3.05Å; E177-S179 VanDerWaalsContact O-N 3.13Å; S179-S181 PolarHBondContact O-N 2.88Å
180	N	34.2	Very low	39	Very low	159 Å²	159	134.9 Å²	134.9	85%	0.85	75%	0.745	S	S	*	*			trans	-66.3	81.7	170	-75.5	-29.6	0	0	0	108.8	T178	T178-N180 PolarHBondContact O-N 3.41Å; T178-N180 VanDerWaalsContact O-N 3.11Å
181	S	37.8	Very low	39.3	Very low	79 Å²	79	135 Å²	135	55%	0.552	73%	0.731	S	S	*	*			trans	-83.6	112	163.5	71.3	0	0	0	0	108.6	S179 E183	S179-S181 PolarHBondContact O-N 2.88Å; S181-E183 PolarHBondContact O-N 2.92Å
182	T	39.2	Very low	39.9	Very low	151 Å²	151	131.3 Å²	131.3	93%	0.926	71%	0.71	S	S	*	*			trans	-72.7	40.5	170.1	31.9	0	0	0	0	112.7
183	E	40.3	Very low	40.9	Very low	155 Å²	155	130.2 Å²	130.2	72%	0.724	70%	0.697	S	S	*	*			trans	-93.1	134.6	168.6	-96.4	-178.1	159.3	0	0	109.8	S181 V185	S181-E183 PolarHBondContact O-N 2.92Å; E183-V185 PolarHBondContact O-N 3.49Å
184	K	39.4	Very low	41.8	Very low	215 Å²	215	130.5 Å²	130.5	94%	0.935	69%	0.689	S	S	*	*			trans	-65.1	83	176.3	-66.7	-174.3	178.3	-178.5	0	109.1	S186	K184-S186 PolarHBondContact O-N 3.42Å
185	V	37	Very low	42.3	Very low	118 Å²	118	130.3 Å²	130.3	72%	0.715	68%	0.68	S	S	*	*			trans	-74.1	99.3	176.2	-175.6	0	0	0	0	107.7	E183	E183-V185 PolarHBondContact O-N 3.49Å
186	S	43.9	Very low	43.7	Very low	101 Å²	101	124.2 Å²	124.2	71%	0.706	65%	0.654	S	S	*	*			trans	-43.1	139.3	162	48.5	0	0	0	0	110.2	K184	K184-S186 PolarHBondContact O-N 3.42Å
187	K	43.3	Very low	45	Very low	191 Å²	191	127 Å²	127	83%	0.83	66%	0.664	S	S	*	*	S	Bend	trans	-26.9	134	179.7	-76.6	172.8	176.4	172.7	0	112.7	N189	K187-N189 PolarHBondContact O-N 2.79Å
188	P	41	Very low	46.9	Very low	108 Å²	108	122.6 Å²	122.6	70%	0.701	65%	0.654	S	S	*	*			trans	-52.2	120.6	176.8	23	-32	0	0	0	108.1	I190	P188-I190 HydrophobicContact CB-CG1 4.42Å; P188-I190 HydrophobicContact CG-CG1 4.47Å; P188-I190 PolarHBondContact O-N 3.21Å
189	N	41.9	Very low	47.8	Very low	103 Å²	103	118.3 Å²	118.3	55%	0.551	64%	0.635	S	S	*	*			trans	-69.9	88.5	173	-159	12.9	0	0	0	105.8	K187 Y191	K187-N189 PolarHBondContact O-N 2.79Å; N189-Y191 VanDerWaalsContact C-N 3.31Å; N189-Y191 HydrophobicContact CB-CE2 4.33Å; N189-Y191 PolarHBondContact ND2-OH 2.92Å; N189-Y191 VanDerWaalsContact O-CD2 3.32Å; N189-Y191 WeakPolarHBondContact O-CD2 3.43Å; N189-Y191 PolarHBondContact O-N 2.96Å
190	I	46.6	Very low	48.7	Very low	111 Å²	111	119.8 Å²	119.8	57%	0.569	63%	0.63	S	S	*	*			trans	-71	95.3	178.3	-61.1	170.6	0	0	0	106	P188 H192	P188-I190 HydrophobicContact CB-CG1 4.42Å; P188-I190 HydrophobicContact CG-CG1 4.47Å; P188-I190 PolarHBondContact O-N 3.21Å; I190-H192 PolarHBondContact O-N 3.22Å; I190-H192 VanDerWaalsContact O-N 3.1Å
191	Y	48.4	Very low	50.4	Low	123 Å²	123	119.9 Å²	119.9	48%	0.482	62%	0.619	S	S	.	*			trans	-63.6	108.5	164.2	-62.4	-79.6	0	0	0	107	N189 L193	N189-Y191 VanDerWaalsContact C-N 3.31Å; N189-Y191 HydrophobicContact CB-CE2 4.33Å; N189-Y191 PolarHBondContact ND2-OH 2.92Å; N189-Y191 VanDerWaalsContact O-CD2 3.32Å; N189-Y191 WeakPolarHBondContact O-CD2 3.43Å; N189-Y191 PolarHBondContact O-N 2.96Å; Y191-L193 PolarHBondContact O-N 3.46Å; Y191-L193 VanDerWaalsContact O-N 3.08Å
192	H	50.9	Low	51.2	Low	77 Å²	77	119.9 Å²	119.9	36%	0.356	61%	0.612	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-75.4	99.5	170.3	-66.8	-75.7	0	0	0	107.6	I190 F194	I190-H192 PolarHBondContact O-N 3.22Å; I190-H192 VanDerWaalsContact O-N 3.1Å; H192-F194 HydrophobicContact CB-CD2 4.14Å; H192-F194 HydrophobicContact CB-CE2 3.6Å; H192-F194 HydrophobicContact CB-CZ 4.42Å
193	L	57	Low	52	Low	87 Å²	87	118.5 Å²	118.5	46%	0.455	60%	0.595	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-76.2	120.1	165.7	-81.5	152.1	0	0	0	108.1	Y191 W201 H203	Y191-L193 PolarHBondContact O-N 3.46Å; Y191-L193 VanDerWaalsContact O-N 3.08Å; L193-W201 HydrophobicContact CB-CE3 3.96Å; L193-W201 HydrophobicContact CB-CZ3 4.02Å; L193-W201 HydrophobicContact CD2-CB 4.32Å; L193-W201 HydrophobicContact CD2-CD2 4.46Å; L193-W201 HydrophobicContact CD2-CE3 3.93Å; L193-H203 WeakPolarHBondContact CD2-NE2 3.34Å
194	F	56	Low	52.7	Low	121 Å²	121	114.4 Å²	114.4	53%	0.531	58%	0.577	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-108.2	134.3	168.9	-73.8	-88.7	0	0	0	109	H192 I202 L204	H192-F194 HydrophobicContact CB-CD2 4.14Å; H192-F194 HydrophobicContact CB-CE2 3.6Å; H192-F194 HydrophobicContact CB-CZ 4.42Å; F194-I202 PolarHBondContact N-O 3.33Å; F194-I202 PolarHBondContact O-N 2.97Å; F194-L204 HydrophobicContact CD2-CD1 3.75Å; F194-L204 HydrophobicContact CE2-CD1 3.74Å
195	Y	46.5	Very low	53.1	Low	144 Å²	144	109.9 Å²	109.9	57%	0.565	56%	0.563	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-91.2	123	168.9	-165.7	-104.2	0	0	0	107.9	G199 W201	Y195-G199 WeakPolarHBondContact OH-CA 3.43Å; Y195-W201 AromaticContact CD2-CD2 3.84Å; Y195-W201 HydrophobicContact CD2-CD2 3.84Å; Y195-W201 AromaticContact CD2-CE2 3.55Å; Y195-W201 HydrophobicContact CD2-CE3 4.21Å; Y195-W201 HydrophobicContact CD2-CG 4.37Å; Y195-W201 HydrophobicContact CD2-CH2 4.1Å; Y195-W201 AromaticContact CD2-CZ2 3.69Å; Y195-W201 HydrophobicContact CD2-CZ2 3.69Å; Y195-W201 HydrophobicContact CD2-CZ3 4.34Å; Y195-W201 AromaticContact CD2-NE1 3.88Å; Y195-W201 HydrophobicContact CE2-CZ2 4.28Å; Y195-W201 AromaticContact CE2-NE1 3.94Å; Y195-W201 HydrophobicContact CG-CZ2 4.49Å
196	T	66.7	Low	53.5	Low	32 Å²	32	109.5 Å²	109.5	20%	0.196	55%	0.552	C	S	.	*			trans	-84.4	156.7	178.3	52.6	0	0	0	0	111.2	S198 G199 E200 I202	T196-S198 WeakPolarHBondContact CB-OG 3.48Å; T196-S198 PolarHBondContact O-N 3.21Å; T196-S198 VanDerWaalsContact O-N 3.09Å; T196-S198 PolarHBondContact OG1-OG 3.06Å; T196-G199 PolarHBondContact O-N 2.71Å; T196-E200 PolarHBondContact N-O 3.12Å; T196-E200 PolarHBondContact OG1-N 3.25Å; T196-E200 PolarHBondContact OG1-O 3.41Å; T196-I202 HydrophobicContact CG2-CD1 3.4Å; T196-I202 HydrophobicContact CG2-CG1 3.88Å
197	D	63.8	Low	53.4	Low	182 Å²	182	109.7 Å²	109.7	97%	0.973	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61	-16.6	172.9	-64.6	-20.3	0	0	0	112.5
198	S	74.1	Confident	53.1	Low	93 Å²	93	107.9 Å²	107.9	65%	0.65	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.9	-4.5	172.7	50	0	0	0	0	114.5	T196	T196-S198 WeakPolarHBondContact CB-OG 3.48Å; T196-S198 PolarHBondContact O-N 3.21Å; T196-S198 VanDerWaalsContact O-N 3.09Å; T196-S198 PolarHBondContact OG1-OG 3.06Å
199	G	59.1	Low	53.1	Low	34 Å²	34	107 Å²	107	35%	0.351	54%	0.54	S	S	.	.	S	Bend	trans	85.7	12	178.6	0	0	0	0	0	115.5	Y195 T196	Y195-G199 WeakPolarHBondContact OH-CA 3.43Å; T196-G199 PolarHBondContact O-N 2.71Å
200	E	56.7	Low	52.8	Low	132 Å²	132	109.5 Å²	109.5	62%	0.617	55%	0.553	S	S	*	*	P	Polyproline II helix	trans	-101.9	142.1	178.4	-66	-174.5	164.5	0	0	111.7	T196	T196-E200 PolarHBondContact N-O 3.12Å; T196-E200 PolarHBondContact OG1-N 3.25Å; T196-E200 PolarHBondContact OG1-O 3.41Å
201	W	67.9	Low	52.4	Low	160 Å²	160	110.8 Å²	110.8	61%	0.606	56%	0.559	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-86.5	119.3	172	-70.4	100.8	0	0	0	110.2	L193 Y195	L193-W201 HydrophobicContact CB-CE3 3.96Å; L193-W201 HydrophobicContact CB-CZ3 4.02Å; L193-W201 HydrophobicContact CD2-CB 4.32Å; L193-W201 HydrophobicContact CD2-CD2 4.46Å; L193-W201 HydrophobicContact CD2-CE3 3.93Å; Y195-W201 AromaticContact CD2-CD2 3.84Å; Y195-W201 HydrophobicContact CD2-CD2 3.84Å; Y195-W201 AromaticContact CD2-CE2 3.55Å; Y195-W201 HydrophobicContact CD2-CE3 4.21Å; Y195-W201 HydrophobicContact CD2-CG 4.37Å; Y195-W201 HydrophobicContact CD2-CH2 4.1Å; Y195-W201 AromaticContact CD2-CZ2 3.69Å; Y195-W201 HydrophobicContact CD2-CZ2 3.69Å; Y195-W201 HydrophobicContact CD2-CZ3 4.34Å; Y195-W201 AromaticContact CD2-NE1 3.88Å; Y195-W201 HydrophobicContact CE2-CZ2 4.28Å; Y195-W201 AromaticContact CE2-NE1 3.94Å; Y195-W201 HydrophobicContact CG-CZ2 4.49Å
202	I	56.3	Low	51.8	Low	79 Å²	79	109.6 Å²	109.6	41%	0.405	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-102.5	122.7	174.4	-57.1	179.3	0	0	0	109	F194 T196	F194-I202 PolarHBondContact N-O 3.33Å; F194-I202 PolarHBondContact O-N 2.97Å; T196-I202 HydrophobicContact CG2-CD1 3.4Å; T196-I202 HydrophobicContact CG2-CG1 3.88Å
203	H	54.3	Low	51.2	Low	123 Å²	123	109.9 Å²	109.9	57%	0.569	59%	0.585	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-84.8	111.7	170.4	-76.6	-129.9	0	0	0	109.4	L193 N205	L193-H203 WeakPolarHBondContact CD2-NE2 3.34Å; H203-N205 PolarHBondContact O-N 3.31Å
204	L	54.7	Low	50.3	Low	69 Å²	69	111.9 Å²	111.9	36%	0.361	60%	0.603	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-86.7	96.9	167.5	-70	174.8	0	0	0	109.5	F194 K206	F194-L204 HydrophobicContact CD2-CD1 3.75Å; F194-L204 HydrophobicContact CE2-CD1 3.74Å; L204-K206 PolarHBondContact O-N 3.17Å; L204-K206 VanDerWaalsContact O-N 3.07Å
205	N	48.9	Very low	49.4	Very low	119 Å²	119	111.3 Å²	111.3	64%	0.636	61%	0.614	S	S	*	*			trans	-68.9	98.4	162.3	-77.2	-15.7	0	0	0	108.1	H203	H203-N205 PolarHBondContact O-N 3.31Å
206	K	45.4	Very low	49.2	Very low	110 Å²	110	109.9 Å²	109.9	48%	0.478	63%	0.625	S	S	.	*			trans	-67.1	127.6	165.8	-86.1	178	177.3	170.2	0	107.8	L204 L209	L204-K206 PolarHBondContact O-N 3.17Å; L204-K206 VanDerWaalsContact O-N 3.07Å; K206-L209 HydrophobicContact CG-CB 4.49Å; K206-L209 HydrophobicContact CG-CD1 4.31Å
207	P	42.7	Very low	47.8	Very low	105 Å²	105	112.3 Å²	112.3	68%	0.682	65%	0.649	S	S	*	*	S	Bend		-127.4	132.5	102.1	32.7	-23	0	0	0	109.6
208	N	35.4	Very low	46.7	Very low	154 Å²	154	109.4 Å²	109.4	82%	0.824	64%	0.642	S	S	*	*			trans	80.1	39.8	167.1	-47.9	-31	0	0	0	118.7	N210	N208-N210 PolarHBondContact O-N 2.95Å
209	L	40.9	Very low	45.2	Very low	90 Å²	90	114.4 Å²	114.4	47%	0.471	65%	0.653	S	S	.	*			trans	-75.3	73	157.5	-87.7	148.7	0	0	0	110.1	K206 I211	K206-L209 HydrophobicContact CG-CB 4.49Å; K206-L209 HydrophobicContact CG-CD1 4.31Å; L209-I211 HydrophobicContact CB-CD1 4.49Å; L209-I211 HydrophobicContact CB-CG1 4.2Å; L209-I211 HydrophobicContact CD2-CD1 3.87Å; L209-I211 HydrophobicContact CD2-CG1 3.57Å; L209-I211 PolarHBondContact O-N 3.48Å; L209-I211 VanDerWaalsContact O-N 3.07Å
210	N	36.7	Very low	44.2	Very low	154 Å²	154	118.5 Å²	118.5	82%	0.824	68%	0.675	S	S	*	*			trans	-69	82.4	151.5	-111.1	-10.4	0	0	0	106.2	N208 S212	N208-N210 PolarHBondContact O-N 2.95Å; N210-S212 PolarHBondContact O-N 3.44Å
211	I	37.7	Very low	43.2	Very low	138 Å²	138	118.3 Å²	118.3	71%	0.708	69%	0.689	S	S	*	*			trans	-79.3	88.7	167.9	-56.7	166.3	0	0	0	105.5	L209 A213	L209-I211 HydrophobicContact CB-CD1 4.49Å; L209-I211 HydrophobicContact CB-CG1 4.2Å; L209-I211 HydrophobicContact CD2-CD1 3.87Å; L209-I211 HydrophobicContact CD2-CG1 3.57Å; L209-I211 PolarHBondContact O-N 3.48Å; L209-I211 VanDerWaalsContact O-N 3.07Å; I211-A213 PolarHBondContact O-N 3.48Å
212	S	35.6	Very low	41.9	Very low	98 Å²	98	115.3 Å²	115.3	69%	0.685	70%	0.698	S	S	*	*			trans	-54.2	124.1	164.1	-50	0	0	0	0	108.1	N210	N210-S212 PolarHBondContact O-N 3.44Å
213	A	39.1	Very low	41	Very low	84 Å²	84	116.9 Å²	116.9	69%	0.694	72%	0.716	S	S	*	*			trans	-54.3	141.2	169.4	0	0	0	0	0	109.2	I211 S215	I211-A213 PolarHBondContact O-N 3.48Å; A213-S215 PolarHBondContact O-N 2.99Å
214	P	38.4	Very low	40.5	Very low	128 Å²	128	115.6 Å²	115.6	83%	0.831	72%	0.721	S	S	*	*			trans	-63.6	106.6	172	25.5	-30.5	0	0	0	108.2	S216	P214-S216 PolarHBondContact O-N 3.03Å; P214-S216 VanDerWaalsContact O-N 3.11Å
215	S	37.2	Very low	40	Very low	109 Å²	109	122 Å²	122	76%	0.762	75%	0.746	S	S	*	*			trans	-66.6	106.8	164.5	64.1	0	0	0	0	107.2	A213 A217	A213-S215 PolarHBondContact O-N 2.99Å; S215-A217 PolarHBondContact O-N 2.73Å
216	S	42.4	Very low	39.7	Very low	114 Å²	114	119.7 Å²	119.7	80%	0.797	75%	0.751	S	S	*	*			trans	-63.3	107.4	164.8	43.2	0	0	0	0	108	P214 S218	P214-S216 PolarHBondContact O-N 3.03Å; P214-S216 VanDerWaalsContact O-N 3.11Å; S216-S218 PolarHBondContact O-N 2.82Å
217	A	36.7	Very low	39.3	Very low	84 Å²	84	122.2 Å²	122.2	69%	0.694	77%	0.766	S	S	*	*			trans	-67	111.1	177.3	0	0	0	0	0	110.4	S215	S215-A217 PolarHBondContact O-N 2.73Å
218	S	39.7	Very low	39.3	Very low	121 Å²	121	126.5 Å²	126.5	85%	0.846	77%	0.774	S	S	*	*			trans	-94.8	101.5	156.1	-70.1	0	0	0	0	108	S216	S216-S218 PolarHBondContact O-N 2.82Å
219	K	42.5	Very low	39.7	Very low	198 Å²	198	129.1 Å²	129.1	86%	0.861	77%	0.773	S	S	*	*			trans	-75.1	118.2	171	-72.1	175.6	174.5	175.1	0	109.4
220	S	38.3	Very low	39.8	Very low	119 Å²	119	131.4 Å²	131.4	83%	0.832	79%	0.791	S	S	*	*			trans	-177.5	92.6	144.2	34.9	0	0	0	0	109.3
221	S	36.7	Very low	40.3	Very low	129 Å²	129	134 Å²	134	90%	0.902	80%	0.795	S	S	*	*			trans	-92.8	120.1	163.8	49.4	0	0	0	0	108.7
222	A	40.3	Very low	40.8	Very low	96 Å²	96	132.6 Å²	132.6	79%	0.793	80%	0.798	S	S	*	*			trans	-133.9	111	163.1	0	0	0	0	0	108.7
223	S	36.4	Very low	40.9	Very low	113 Å²	113	138.4 Å²	138.4	79%	0.79	81%	0.805	S	S	*	*			trans	49.5	110.2	140.8	-168.1	0	0	0	0	119.8
224	S	43.7	Very low	41.5	Very low	96 Å²	96	139.8 Å²	139.8	67%	0.671	81%	0.809	S	S	*	*				176.2	130.3	107.5	-100.2	0	0	0	0	113
225	K	44.5	Very low	41.7	Very low	203 Å²	203	141.4 Å²	141.4	88%	0.883	81%	0.806	S	S	*	*			trans	51.9	107.7	140.5	-68.9	175.6	175.5	172.2	0	119
226	G	43	Very low	42.3	Very low	71 Å²	71	143.5 Å²	143.5	73%	0.732	81%	0.809	S	S	*	*				94.5	105.9	122.9	0	0	0	0	0	116.5
227	M	38	Very low	42.5	Very low	162 Å²	162	150.9 Å²	150.9	80%	0.798	83%	0.831	S	S	*	*				179.4	122.5	122	-98.5	157.9	74.6	0	0	108.5	Y229	M227-Y229 HydrophobicContact CE-CE2 3.8Å
228	K	42	Very low	42.8	Very low	196 Å²	196	154.3 Å²	154.3	85%	0.852	84%	0.838	S	S	*	*			trans	-77.7	125.9	171.9	-65.3	178.2	176.6	-177.9	0	108.2
229	Y	44.3	Very low	42.9	Very low	208 Å²	208	156 Å²	156	82%	0.816	84%	0.837	S	S	*	*			trans	-143.7	110.7	151.2	-75.5	-72.7	0	0	0	108.9	M227	M227-Y229 HydrophobicContact CE-CE2 3.8Å
230	T	43.1	Very low	42.9	Very low	138 Å²	138	153.7 Å²	153.7	85%	0.847	84%	0.836	S	S	*	*			trans	-82.6	130.9	166.4	50.1	0	0	0	0	109
231	K	45.8	Very low	43.2	Very low	208 Å²	208	155.7 Å²	155.7	90%	0.904	84%	0.836	S	S	*	*			trans	-152.2	142.8	149.8	-134.8	170.3	-175.8	179.1	0	111.4
232	S	49	Very low	43.6	Very low	110 Å²	110	157.4 Å²	157.4	77%	0.769	83%	0.832	S	S	*	*			trans	-76.2	164.2	-158.2	40.8	0	0	0	0	116.1
233	W	36.9	Very low	43.9	Very low	220 Å²	220	161.5 Å²	161.5	83%	0.833	83%	0.834	S	S	*	*			trans	-59.5	155.9	172.8	-73.4	60	0	0	0	114.5
234	S	53.6	Low	44.4	Very low	112 Å²	112	164.9 Å²	164.9	78%	0.783	84%	0.838	S	S	*	*			trans	-147.4	107.3	141.9	58.8	0	0	0	0	108.7
235	E	42.1	Very low	44.4	Very low	163 Å²	163	170.2 Å²	170.2	76%	0.762	85%	0.85	S	S	*	*			trans	-68.6	134.4	156.6	-117.5	164.9	175.3	0	0	107.6
236	N	50	Low	44.4	Very low	153 Å²	153	167.5 Å²	167.5	82%	0.818	85%	0.848	S	S	*	*			trans	-126.4	126.8	160.6	-92.6	-4.3	0	0	0	107.1
237	E	45.4	Very low	44.6	Very low	269 Å²	269	176.3 Å²	176.3	100%	1.257	86%	0.858	S	S	*	*			trans	17.4	0	160.3	-72	173.9	149.1	0	0	120.6

Retrieved 237 of 237 residues in 290.5 ms (Link to these results)

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