A0A3Q0KUW8_SCHMA Loading...

Smp_202400

AlphaFold DB , UniProt , Accession A0A3Q0KUW8, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 318 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	54.8	Low	63.9	Low	234 Å²	234	112.3 Å²	112.3	100%	1.153	61%	0.609	S	S	*	*				0	129.3	0	-88.3	168.2	159.4	0	0	107.5
2	A	57.5	Low	63.9	Low	96 Å²	96	108.8 Å²	108.8	79%	0.793	59%	0.588	S	S	*	*	P	Polyproline II helix	trans	-81.6	134.3	167.6	0	0	0	0	0	107.9
3	L	61.4	Low	64.1	Low	105 Å²	105	109 Å²	109	55%	0.55	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-63.9	135.5	170.2	-68.3	169.7	0	0	0	108.2	Q7	L3-Q7 HydrophobicContact CB-CB 4.29Å; L3-Q7 HydrophobicContact CD2-CB 4.02Å
4	T	73	Confident	64.5	Low	74 Å²	74	112.4 Å²	112.4	45%	0.454	58%	0.583	S	S	.	*	P	Polyproline II helix	trans	-67.4	156.5	167.2	63.7	0	0	0	0	109.2	D6 Q7 F8	T4-D6 PolarHBondContact O-N 2.8Å; T4-D6 VanDerWaalsContact O-N 3.15Å; T4-Q7 PolarHBondContact O-N 3.14Å; T4-Q7 WeakPolarHBondContact OG1-CG 3.26Å; T4-Q7 PolarHBondContact OG1-N 3.35Å; T4-F8 PolarHBondContact O-N 3.09Å
5	S	62.9	Low	64.5	Low	83 Å²	83	109.3 Å²	109.3	58%	0.58	57%	0.565	S	S	*	*	H	α-helix	trans	-52.8	-37	176.2	-172.5	0	0	0	0	111.7	F8 Q9	S5-F8 PolarHBondContact O-N 3.09Å; S5-Q9 PolarHBondContact O-N 2.99Å
6	D	74.2	Confident	64.7	Low	123 Å²	123	106.9 Å²	106.9	66%	0.658	55%	0.551	S	S	*	*	H	α-helix	trans	-68.7	-40.3	179.5	-55	-24.9	0	0	0	111.8	T4 F8 Q9 L10	T4-D6 PolarHBondContact O-N 2.8Å; T4-D6 VanDerWaalsContact O-N 3.15Å; D6-F8 VanDerWaalsContact C-N 3.33Å; D6-F8 PolarHBondContact O-N 3.21Å; D6-Q9 PolarHBondContact O-N 3.24Å; D6-L10 WeakPolarHBondContact O-CB 3.26Å; D6-L10 PolarHBondContact O-N 3.14Å
7	Q	64.7	Low	65	Low	102 Å²	102	107.1 Å²	107.1	48%	0.477	55%	0.548	S	S	.	.	H	α-helix	trans	-64.6	-37.9	174.9	-75.7	-180	-15.2	0	0	112.1	L3 T4 L11	L3-Q7 HydrophobicContact CB-CB 4.29Å; L3-Q7 HydrophobicContact CD2-CB 4.02Å; T4-Q7 PolarHBondContact O-N 3.14Å; T4-Q7 WeakPolarHBondContact OG1-CG 3.26Å; T4-Q7 PolarHBondContact OG1-N 3.35Å; Q7-L11 WeakPolarHBondContact O-CB 3.33Å; Q7-L11 PolarHBondContact O-N 3.09Å; Q7-L11 VanDerWaalsContact O-N 3.09Å
8	F	57.5	Low	65.2	Low	109 Å²	109	106.7 Å²	106.7	48%	0.478	54%	0.539	S	S	.	.	H	α-helix	trans	-68.8	-44.2	176.8	-176.5	-107	0	0	0	112.1	T4 S5 D6 L10 L11 I12	T4-F8 PolarHBondContact O-N 3.09Å; S5-F8 PolarHBondContact O-N 3.09Å; D6-F8 VanDerWaalsContact C-N 3.33Å; D6-F8 PolarHBondContact O-N 3.21Å; F8-L10 PolarHBondContact O-N 3Å; F8-L11 WeakPolarHBondContact O-CB 3.48Å; F8-L11 PolarHBondContact O-N 3.31Å; F8-I12 HydrophobicContact CD1-CD1 3.86Å; F8-I12 HydrophobicContact CE1-CD1 3.37Å; F8-I12 HydrophobicContact CE1-CG1 4.32Å; F8-I12 HydrophobicContact CZ-CD1 3.77Å; F8-I12 HydrophobicContact CZ-CG1 4.36Å; F8-I12 PolarHBondContact O-N 2.97Å; F8-I12 VanDerWaalsContact O-N 3.07Å
9	Q	60.6	Low	65.3	Low	113 Å²	113	105.1 Å²	105.1	53%	0.528	53%	0.528	S	S	.	.	H	α-helix	trans	-61.6	-43.2	174.6	-77.1	-161.6	41.4	0	0	112.2	S5 D6 L11 I12 Q13	S5-Q9 PolarHBondContact O-N 2.99Å; D6-Q9 PolarHBondContact O-N 3.24Å; Q9-L11 VanDerWaalsContact C-N 3.25Å; Q9-L11 PolarHBondContact O-N 3.38Å; Q9-I12 PolarHBondContact O-N 2.98Å; Q9-Q13 PolarHBondContact O-N 3.31Å
10	L	71.4	Confident	65.7	Low	115 Å²	115	103.5 Å²	103.5	60%	0.602	52%	0.515	S	S	*	.	H	α-helix	trans	-61	-36.7	177	-172	68.3	0	0	0	111.8	D6 F8 R14	D6-L10 WeakPolarHBondContact O-CB 3.26Å; D6-L10 PolarHBondContact O-N 3.14Å; F8-L10 PolarHBondContact O-N 3Å; L10-R14 VanDerWaalsContact O-CB 3.3Å; L10-R14 WeakPolarHBondContact O-CB 3.41Å; L10-R14 PolarHBondContact O-N 3.15Å
11	L	64.7	Low	66	Low	81 Å²	81	106.4 Å²	106.4	42%	0.424	53%	0.525	S	S	.	.	H	α-helix	trans	-65	-45.2	175.5	-177.3	65.9	0	0	0	111.6	Q7 F8 Q9 R14 Q15	Q7-L11 WeakPolarHBondContact O-CB 3.33Å; Q7-L11 PolarHBondContact O-N 3.09Å; Q7-L11 VanDerWaalsContact O-N 3.09Å; F8-L11 WeakPolarHBondContact O-CB 3.48Å; F8-L11 PolarHBondContact O-N 3.31Å; Q9-L11 VanDerWaalsContact C-N 3.25Å; Q9-L11 PolarHBondContact O-N 3.38Å; L11-R14 PolarHBondContact O-N 2.71Å; L11-Q15 WeakPolarHBondContact O-CG 3.33Å; L11-Q15 PolarHBondContact O-N 3.04Å
12	I	63.6	Low	66.8	Low	71 Å²	71	97 Å²	97	36%	0.364	48%	0.482	S	S	.	.	H	α-helix	trans	-59.7	-52.1	176.2	-68.5	171.4	0	0	0	110.1	F8 Q9 R14 Q15 E16	F8-I12 HydrophobicContact CD1-CD1 3.86Å; F8-I12 HydrophobicContact CE1-CD1 3.37Å; F8-I12 HydrophobicContact CE1-CG1 4.32Å; F8-I12 HydrophobicContact CZ-CD1 3.77Å; F8-I12 HydrophobicContact CZ-CG1 4.36Å; F8-I12 PolarHBondContact O-N 2.97Å; F8-I12 VanDerWaalsContact O-N 3.07Å; Q9-I12 PolarHBondContact O-N 2.98Å; I12-R14 VanDerWaalsContact C-N 3.27Å; I12-R14 PolarHBondContact O-N 2.75Å; I12-Q15 PolarHBondContact O-N 3.46Å; I12-E16 HydrophobicContact CG2-CG 4.29Å; I12-E16 WeakPolarHBondContact O-CG 3.3Å; I12-E16 PolarHBondContact O-N 3.12Å
13	Q	67.4	Low	67.4	Low	111 Å²	111	93.5 Å²	93.5	52%	0.519	45%	0.45	S	S	.	.	H	α-helix	trans	-56.9	-42.3	178.9	-73.8	-172.9	-34.6	0	0	111.9	Q9 Q15 E16 Q17	Q9-Q13 PolarHBondContact O-N 3.31Å; Q13-Q15 VanDerWaalsContact C-N 3.34Å; Q13-Q15 PolarHBondContact O-N 3.09Å; Q13-E16 PolarHBondContact O-N 3.06Å; Q13-Q17 WeakPolarHBondContact O-CB 3.43Å; Q13-Q17 VanDerWaalsContact O-CG 3.25Å; Q13-Q17 WeakPolarHBondContact O-CG 3.38Å; Q13-Q17 PolarHBondContact O-N 3.06Å
14	R	70	Confident	68.1	Low	156 Å²	156	93 Å²	93	59%	0.589	45%	0.447	S	S	*	.	H	α-helix	trans	-63.2	-39.5	176.9	-171.7	177.5	-173.4	179.8	1.7	112.1	L10 L11 I12 R18	L10-R14 VanDerWaalsContact O-CB 3.3Å; L10-R14 WeakPolarHBondContact O-CB 3.41Å; L10-R14 PolarHBondContact O-N 3.15Å; L11-R14 PolarHBondContact O-N 2.71Å; I12-R14 VanDerWaalsContact C-N 3.27Å; I12-R14 PolarHBondContact O-N 2.75Å; R14-R18 WeakPolarHBondContact O-CG 3.06Å; R14-R18 PolarHBondContact O-N 3.09Å
15	Q	63.2	Low	68.3	Low	66 Å²	66	92.9 Å²	92.9	31%	0.308	44%	0.443	S	S	.	.	H	α-helix	trans	-70.6	-41.1	177.5	-69.2	-66.9	28.5	0	0	112	L11 I12 Q13 Q17 R18 F19	L11-Q15 WeakPolarHBondContact O-CG 3.33Å; L11-Q15 PolarHBondContact O-N 3.04Å; I12-Q15 PolarHBondContact O-N 3.46Å; Q13-Q15 VanDerWaalsContact C-N 3.34Å; Q13-Q15 PolarHBondContact O-N 3.09Å; Q15-Q17 VanDerWaalsContact C-N 3.3Å; Q15-Q17 PolarHBondContact O-N 3Å; Q15-R18 WeakPolarHBondContact O-CB 3.44Å; Q15-R18 PolarHBondContact O-N 3.28Å; Q15-R18 VanDerWaalsContact OE1-CD 3.23Å; Q15-F19 WeakPolarHBondContact O-CB 3.34Å; Q15-F19 PolarHBondContact O-N 3.48Å
16	E	68.3	Low	68.9	Low	71 Å²	71	90.8 Å²	90.8	33%	0.332	42%	0.424	S	S	.	.	H	α-helix	trans	-60.3	-39.4	173.3	-71	177.6	174.6	0	0	112.2	I12 Q13 F19 R20	I12-E16 HydrophobicContact CG2-CG 4.29Å; I12-E16 WeakPolarHBondContact O-CG 3.3Å; I12-E16 PolarHBondContact O-N 3.12Å; Q13-E16 PolarHBondContact O-N 3.06Å; E16-F19 PolarHBondContact O-N 2.97Å; E16-R20 WeakPolarHBondContact O-CB 3.08Å; E16-R20 WeakPolarHBondContact O-CG 3.25Å; E16-R20 PolarHBondContact O-N 3.23Å; E16-R20 PolarHBondContact O-NE 2.97Å; E16-R20 IonicContact OE2-NH2 3.51Å
17	Q	70.7	Confident	69.2	Low	110 Å²	110	85.2 Å²	85.2	51%	0.514	39%	0.394	S	S	.	.	H	α-helix	trans	-66.2	-40.8	175.3	-73.3	-65.5	-23.3	0	0	112.2	Q13 Q15 R20 K21	Q13-Q17 WeakPolarHBondContact O-CB 3.43Å; Q13-Q17 VanDerWaalsContact O-CG 3.25Å; Q13-Q17 WeakPolarHBondContact O-CG 3.38Å; Q13-Q17 PolarHBondContact O-N 3.06Å; Q15-Q17 VanDerWaalsContact C-N 3.3Å; Q15-Q17 PolarHBondContact O-N 3Å; Q17-R20 PolarHBondContact O-N 3.48Å; Q17-K21 WeakPolarHBondContact O-CB 3.46Å; Q17-K21 PolarHBondContact O-N 3.07Å
18	R	67.9	Low	70.1	Confident	101 Å²	101	83.8 Å²	83.8	38%	0.381	39%	0.39	S	S	.	.	H	α-helix	trans	-62.7	-44.2	174.2	-76.3	169.5	170	-174.7	-5	111.6	R14 Q15 K21 S22	R14-R18 WeakPolarHBondContact O-CG 3.06Å; R14-R18 PolarHBondContact O-N 3.09Å; Q15-R18 WeakPolarHBondContact O-CB 3.44Å; Q15-R18 PolarHBondContact O-N 3.28Å; Q15-R18 VanDerWaalsContact OE1-CD 3.23Å; R18-K21 PolarHBondContact O-N 2.95Å; R18-S22 WeakPolarHBondContact O-CB 3.09Å; R18-S22 PolarHBondContact O-N 3.45Å
19	F	67.3	Low	71.3	Confident	75 Å²	75	84 Å²	84	33%	0.329	39%	0.39	S	S	.	.	H	α-helix	trans	-60.2	-47.5	176.6	-176.6	-108.7	0	0	0	111.3	Q15 E16 K21 S22 Q23 W278 Y299	Q15-F19 WeakPolarHBondContact O-CB 3.34Å; Q15-F19 PolarHBondContact O-N 3.48Å; E16-F19 PolarHBondContact O-N 2.97Å; F19-K21 PolarHBondContact O-N 2.98Å; F19-S22 WeakPolarHBondContact O-CB 3.31Å; F19-S22 PolarHBondContact O-N 2.98Å; F19-Q23 HydrophobicContact CD1-CG 4.44Å; F19-Q23 VanDerWaalsContact CE1-CD 3.42Å; F19-Q23 HydrophobicContact CE1-CG 4.21Å; F19-Q23 HydrophobicContact CZ-CG 4.24Å; F19-Q23 WeakPolarHBondContact O-CG 3.2Å; F19-Q23 PolarHBondContact O-N 3.34Å; F19-W278 HydrophobicContact CE2-CH2 4.43Å; F19-W278 HydrophobicContact CE2-CZ3 4.15Å; F19-W278 HydrophobicContact CZ-CH2 4.5Å; F19-W278 HydrophobicContact CZ-CZ3 4.47Å; F19-Y299 HydrophobicContact CE2-CD2 4.32Å; F19-Y299 HydrophobicContact CE2-CE2 4.39Å
20	R	72.1	Confident	72.2	Confident	73 Å²	73	79 Å²	79	28%	0.275	37%	0.367	S	S	.	.	H	α-helix	trans	-56.2	-47.3	173.9	-81.8	-176.3	-96.2	-140.1	-8.8	112.7	E16 Q17 S22 Q23 L24 Y61	E16-R20 WeakPolarHBondContact O-CB 3.08Å; E16-R20 WeakPolarHBondContact O-CG 3.25Å; E16-R20 PolarHBondContact O-N 3.23Å; E16-R20 PolarHBondContact O-NE 2.97Å; E16-R20 IonicContact OE2-NH2 3.51Å; Q17-R20 PolarHBondContact O-N 3.48Å; R20-S22 VanDerWaalsContact C-N 3.32Å; R20-S22 PolarHBondContact O-N 3.09Å; R20-Q23 PolarHBondContact O-N 3.19Å; R20-L24 PolarHBondContact O-N 2.94Å; R20-Y61 VanDerWaalsContact NH1-CE2 3.26Å; R20-Y61 PolarHBondContact NH1-OH 3.47Å; R20-Y61 PolarHBondContact NH2-OH 3Å
21	K	73.5	Confident	72.9	Confident	166 Å²	166	75.9 Å²	75.9	72%	0.722	35%	0.349	S	S	*	.	H	α-helix	trans	-61.5	-42.8	178.1	-174.2	176.3	-179.6	178.5	0	111.7	Q17 R18 F19 L24 D25	Q17-K21 WeakPolarHBondContact O-CB 3.46Å; Q17-K21 PolarHBondContact O-N 3.07Å; R18-K21 PolarHBondContact O-N 2.95Å; F19-K21 PolarHBondContact O-N 2.98Å; K21-L24 PolarHBondContact O-N 3.41Å; K21-D25 WeakPolarHBondContact O-CB 3.43Å; K21-D25 PolarHBondContact O-N 3.35Å
22	S	70.4	Confident	73.8	Confident	35 Å²	35	74.3 Å²	74.3	25%	0.245	35%	0.348	C	S	.	.	H	α-helix	trans	-64.1	-41.1	178.2	-167	0	0	0	0	112.1	R18 F19 R20 F26 Y316	R18-S22 WeakPolarHBondContact O-CB 3.09Å; R18-S22 PolarHBondContact O-N 3.45Å; F19-S22 WeakPolarHBondContact O-CB 3.31Å; F19-S22 PolarHBondContact O-N 2.98Å; R20-S22 VanDerWaalsContact C-N 3.32Å; R20-S22 PolarHBondContact O-N 3.09Å; S22-F26 WeakPolarHBondContact O-CB 3.34Å; S22-F26 PolarHBondContact O-N 3.07Å; S22-Y316 VanDerWaalsContact OG-CD1 3.23Å; S22-Y316 WeakPolarHBondContact OG-CD1 3.36Å; S22-Y316 WeakPolarHBondContact OG-CE1 3.38Å
23	Q	70.1	Confident	74.5	Confident	24 Å²	24	76.4 Å²	76.4	11%	0.112	36%	0.355	C	S	.	.	H	α-helix	trans	-62	-42.8	175.1	-78.7	-174.2	-25.1	0	0	112.3	F19 R20 F26 I27 L57 W278	F19-Q23 HydrophobicContact CD1-CG 4.44Å; F19-Q23 VanDerWaalsContact CE1-CD 3.42Å; F19-Q23 HydrophobicContact CE1-CG 4.21Å; F19-Q23 HydrophobicContact CZ-CG 4.24Å; F19-Q23 WeakPolarHBondContact O-CG 3.2Å; F19-Q23 PolarHBondContact O-N 3.34Å; R20-Q23 PolarHBondContact O-N 3.19Å; Q23-F26 WeakPolarHBondContact O-CB 3.46Å; Q23-F26 PolarHBondContact O-N 3.06Å; Q23-I27 WeakPolarHBondContact O-CD1 3.49Å; Q23-I27 VanDerWaalsContact O-CG1 3.3Å; Q23-I27 WeakPolarHBondContact O-CG1 3.21Å; Q23-I27 PolarHBondContact O-N 2.98Å; Q23-L57 HydrophobicContact CB-CD2 3.84Å; Q23-L57 HydrophobicContact CG-CD2 4.08Å; Q23-W278 HydrophobicContact CG-CH2 3.95Å; Q23-W278 HydrophobicContact CG-CZ2 4.07Å
24	L	77	Confident	75	Confident	93 Å²	93	71.4 Å²	71.4	49%	0.487	33%	0.331	S	S	.	.	H	α-helix	trans	-67.3	-45.3	178.9	-169.1	65.1	0	0	0	111.8	R20 K21 F26 I27 D28	R20-L24 PolarHBondContact O-N 2.94Å; K21-L24 PolarHBondContact O-N 3.41Å; L24-F26 VanDerWaalsContact C-N 3.27Å; L24-F26 PolarHBondContact O-N 3.26Å; L24-I27 PolarHBondContact O-N 3.44Å; L24-I27 VanDerWaalsContact O-N 3.13Å; L24-D28 PolarHBondContact O-N 2.87Å
25	D	77.2	Confident	75.6	Confident	72 Å²	72	68.2 Å²	68.2	39%	0.385	33%	0.326	S	S	.	.	H	α-helix	trans	-58.7	-40.1	174.8	177.5	69.3	0	0	0	111.8	K21 D28 K29	K21-D25 WeakPolarHBondContact O-CB 3.43Å; K21-D25 PolarHBondContact O-N 3.35Å; D25-D28 PolarHBondContact O-N 3.38Å; D25-K29 WeakPolarHBondContact O-CG 3.25Å; D25-K29 PolarHBondContact O-N 2.87Å; D25-K29 IonicContact OD1-NZ 2.69Å; D25-K29 WeakPolarHBondContact OD2-CE 3.48Å; D25-K29 IonicContact OD2-NZ 3.74Å; D25-K29 PolarHBondContact OD2-NZ 3.2Å
26	F	76.1	Confident	76.3	Confident	39 Å²	39	71.5 Å²	71.5	17%	0.171	35%	0.345	C	S	.	.	H	α-helix	trans	-61.1	-47.3	173.7	173.7	-96.5	0	0	0	112.3	S22 Q23 L24 D28 K29 L30 L301 I303 Y316	S22-F26 WeakPolarHBondContact O-CB 3.34Å; S22-F26 PolarHBondContact O-N 3.07Å; Q23-F26 WeakPolarHBondContact O-CB 3.46Å; Q23-F26 PolarHBondContact O-N 3.06Å; L24-F26 VanDerWaalsContact C-N 3.27Å; L24-F26 PolarHBondContact O-N 3.26Å; F26-D28 VanDerWaalsContact C-N 3.27Å; F26-D28 PolarHBondContact O-N 3.28Å; F26-K29 PolarHBondContact O-N 3.46Å; F26-L30 HydrophobicContact CE1-CB 4.27Å; F26-L30 HydrophobicContact CE1-CD2 3.96Å; F26-L30 HydrophobicContact CZ-CB 4.28Å; F26-L30 HydrophobicContact CZ-CD2 4.23Å; F26-L30 WeakPolarHBondContact O-CB 3.42Å; F26-L30 PolarHBondContact O-N 2.87Å; F26-L301 HydrophobicContact CD1-CD2 3.88Å; F26-L301 HydrophobicContact CD2-CD2 4.11Å; F26-L301 HydrophobicContact CE1-CD2 3.28Å; F26-L301 HydrophobicContact CE2-CD2 3.54Å; F26-L301 HydrophobicContact CG-CD2 4.27Å; F26-L301 HydrophobicContact CZ-CD2 3.11Å; F26-I303 HydrophobicContact CZ-CD1 3.88Å; F26-Y316 WeakPolarHBondContact CB-OH 3.04Å; F26-Y316 VanDerWaalsContact CD2-OH 3.3Å; F26-Y316 WeakPolarHBondContact CD2-OH 3.37Å
27	I	80.3	Confident	76.4	Confident	6 Å²	6	71 Å²	71	3%	0.031	34%	0.343	C	S	.	.	H	α-helix	trans	-60.5	-40.2	179.2	-72.1	160.6	0	0	0	110.7	Q23 L24 L30 H31 I50 L53 R54 L57	Q23-I27 WeakPolarHBondContact O-CD1 3.49Å; Q23-I27 VanDerWaalsContact O-CG1 3.3Å; Q23-I27 WeakPolarHBondContact O-CG1 3.21Å; Q23-I27 PolarHBondContact O-N 2.98Å; L24-I27 PolarHBondContact O-N 3.44Å; L24-I27 VanDerWaalsContact O-N 3.13Å; I27-L30 PolarHBondContact O-N 3.03Å; I27-H31 WeakPolarHBondContact O-CB 3.47Å; I27-H31 PolarHBondContact O-N 3.23Å; I27-I50 HydrophobicContact CG2-CD1 4.36Å; I27-I50 HydrophobicContact CG2-CG2 3.65Å; I27-L53 HydrophobicContact CG1-CD2 4.25Å; I27-R54 HydrophobicContact CD1-CG 3.87Å; I27-R54 HydrophobicContact CG2-CG 3.92Å; I27-L57 HydrophobicContact CD1-CD2 3.73Å
28	D	83	Confident	76.5	Confident	73 Å²	73	71.4 Å²	71.4	39%	0.39	36%	0.355	S	S	.	.	H	α-helix	trans	-67.1	-41.8	178.7	-66.7	-14.5	0	0	0	111.6	L24 D25 F26 H31 A32 R54	L24-D28 PolarHBondContact O-N 2.87Å; D25-D28 PolarHBondContact O-N 3.38Å; F26-D28 VanDerWaalsContact C-N 3.27Å; F26-D28 PolarHBondContact O-N 3.28Å; D28-H31 WeakPolarHBondContact O-CB 3.44Å; D28-H31 PolarHBondContact O-N 3.34Å; D28-A32 PolarHBondContact O-N 3.42Å; D28-R54 IonicContact OD1-CZ 3.5Å; D28-R54 IonicContact OD1-NH2 3.74Å; D28-R54 PolarHBondContact OD1-NH2 3.47Å
29	K	82.1	Confident	76.4	Confident	113 Å²	113	68.4 Å²	68.4	49%	0.491	35%	0.349	S	S	.	.	H	α-helix	trans	-64.2	-39.6	173.1	-73.9	169.7	178.2	166.8	0	112.2	D25 F26 A32 K33	D25-K29 WeakPolarHBondContact O-CG 3.25Å; D25-K29 PolarHBondContact O-N 2.87Å; D25-K29 IonicContact OD1-NZ 2.69Å; D25-K29 WeakPolarHBondContact OD2-CE 3.48Å; D25-K29 IonicContact OD2-NZ 3.74Å; D25-K29 PolarHBondContact OD2-NZ 3.2Å; F26-K29 PolarHBondContact O-N 3.46Å; K29-A32 PolarHBondContact O-N 3.3Å; K29-K33 WeakPolarHBondContact O-CG 3.34Å; K29-K33 PolarHBondContact O-N 2.9Å
30	L	80.3	Confident	76.4	Confident	8 Å²	8	66.1 Å²	66.1	4%	0.042	34%	0.339	C	S	.	.	H	α-helix	trans	-64.1	-45.2	176	-178.7	63.7	0	0	0	110.5	F26 I27 A32 K33 L34 I50 L53 I303	F26-L30 HydrophobicContact CE1-CB 4.27Å; F26-L30 HydrophobicContact CE1-CD2 3.96Å; F26-L30 HydrophobicContact CZ-CB 4.28Å; F26-L30 HydrophobicContact CZ-CD2 4.23Å; F26-L30 WeakPolarHBondContact O-CB 3.42Å; F26-L30 PolarHBondContact O-N 2.87Å; I27-L30 PolarHBondContact O-N 3.03Å; L30-A32 PolarHBondContact O-N 3.11Å; L30-K33 PolarHBondContact O-N 2.91Å; L30-L34 HydrophobicContact CD1-CD1 4.05Å; L30-L34 HydrophobicContact CD1-CD2 4.45Å; L30-L34 HydrophobicContact CD1-CG 4.02Å; L30-L34 HydrophobicContact CD2-CD1 4.4Å; L30-L34 HydrophobicContact CG-CD1 3.79Å; L30-L34 HydrophobicContact CG-CG 4.2Å; L30-L34 WeakPolarHBondContact O-CB 3.47Å; L30-L34 VanDerWaalsContact O-CG 3.24Å; L30-L34 WeakPolarHBondContact O-CG 3.42Å; L30-L34 PolarHBondContact O-N 3.13Å; L30-I50 HydrophobicContact CB-CD1 4.31Å; L30-I50 HydrophobicContact CD2-CD1 3.96Å; L30-I50 HydrophobicContact CG-CD1 4Å; L30-L53 HydrophobicContact CD2-CD2 3.74Å; L30-I303 HydrophobicContact CD1-CD1 3.98Å; L30-I303 HydrophobicContact CD2-CD1 4.28Å
31	H	84.9	Confident	75.8	Confident	49 Å²	49	66.3 Å²	66.3	23%	0.227	36%	0.364	C	S	.	.	H	α-helix	trans	-56	-49.8	175.2	179.6	-93.3	0	0	0	111.4	I27 D28 K33 L34 L35 D47 I50	I27-H31 WeakPolarHBondContact O-CB 3.47Å; I27-H31 PolarHBondContact O-N 3.23Å; D28-H31 WeakPolarHBondContact O-CB 3.44Å; D28-H31 PolarHBondContact O-N 3.34Å; H31-K33 VanDerWaalsContact C-N 3.33Å; H31-K33 PolarHBondContact O-N 3.27Å; H31-L34 PolarHBondContact O-N 3Å; H31-L35 WeakPolarHBondContact O-CB 3.4Å; H31-L35 PolarHBondContact O-N 3.29Å; H31-D47 IonicContact CD2-OD1 3.55Å; H31-D47 IonicContact CE1-OD1 3.94Å; H31-D47 IonicContact NE2-OD1 2.7Å; H31-D47 PolarHBondContact NE2-OD1 2.94Å; H31-I50 HydrophobicContact CB-CD1 4.11Å; H31-I50 HydrophobicContact CB-CG1 3.94Å; H31-I50 HydrophobicContact CB-CG2 4.44Å
32	A	84.1	Confident	75.8	Confident	48 Å²	48	60 Å²	60	40%	0.397	35%	0.346	S	S	.	.	H	α-helix	trans	-60.2	-40.2	177.1	0	0	0	0	0	112.8	D28 K29 L30 N36	D28-A32 PolarHBondContact O-N 3.42Å; K29-A32 PolarHBondContact O-N 3.3Å; L30-A32 PolarHBondContact O-N 3.11Å; A32-N36 PolarHBondContact O-N 2.88Å; A32-N36 PolarHBondContact O-ND2 2.87Å
33	K	78.3	Confident	76.4	Confident	116 Å²	116	60.7 Å²	60.7	50%	0.504	35%	0.354	S	S	.	.	H	α-helix	trans	-68.6	-43.4	177.7	-77.2	-174.9	175.3	-174.7	0	112.5	K29 L30 H31 L35 N36 H37 Y311	K29-K33 WeakPolarHBondContact O-CG 3.34Å; K29-K33 PolarHBondContact O-N 2.9Å; L30-K33 PolarHBondContact O-N 2.91Å; H31-K33 VanDerWaalsContact C-N 3.33Å; H31-K33 PolarHBondContact O-N 3.27Å; K33-L35 VanDerWaalsContact C-N 3.33Å; K33-N36 PolarHBondContact O-N 3.42Å; K33-H37 PolarHBondContact O-N 2.75Å; K33-Y311 HydrophobicContact CD-CE1 4.19Å
34	L	78.3	Confident	77.1	Confident	5 Å²	5	65.1 Å²	65.1	3%	0.026	38%	0.383	C	S	.	.	H	α-helix	trans	-66.9	-36.5	179.7	-68.5	173.9	0	0	0	111.7	L30 H31 N36 H37 F40 V46 L49 I50	L30-L34 HydrophobicContact CD1-CD1 4.05Å; L30-L34 HydrophobicContact CD1-CD2 4.45Å; L30-L34 HydrophobicContact CD1-CG 4.02Å; L30-L34 HydrophobicContact CD2-CD1 4.4Å; L30-L34 HydrophobicContact CG-CD1 3.79Å; L30-L34 HydrophobicContact CG-CG 4.2Å; L30-L34 WeakPolarHBondContact O-CB 3.47Å; L30-L34 VanDerWaalsContact O-CG 3.24Å; L30-L34 WeakPolarHBondContact O-CG 3.42Å; L30-L34 PolarHBondContact O-N 3.13Å; H31-L34 PolarHBondContact O-N 3Å; L34-N36 PolarHBondContact O-N 2.78Å; L34-H37 WeakPolarHBondContact O-CB 3.44Å; L34-H37 PolarHBondContact O-N 3.35Å; L34-H37 VanDerWaalsContact O-N 3.09Å; L34-F40 HydrophobicContact CB-CD2 4.46Å; L34-F40 HydrophobicContact CD2-CD2 4.07Å; L34-F40 HydrophobicContact CD2-CE2 3.33Å; L34-F40 HydrophobicContact CD2-CZ 3.6Å; L34-F40 HydrophobicContact CG-CE2 4.48Å; L34-V46 HydrophobicContact CB-CB 4.5Å; L34-V46 HydrophobicContact CB-CG1 3.61Å; L34-V46 HydrophobicContact CB-CG2 4.07Å; L34-V46 HydrophobicContact CD1-CG1 4.31Å; L34-L49 HydrophobicContact CD1-CD2 3.85Å; L34-I50 HydrophobicContact CD1-CD1 4.05Å; L34-I50 HydrophobicContact CD1-CG1 4.4Å
35	L	81.7	Confident	77	Confident	89 Å²	89	65.8 Å²	65.8	47%	0.466	38%	0.383	S	S	.	.	H	α-helix	trans	-64	-29.2	176.7	-163.7	70.2	0	0	0	112.7	H31 K33 A43	H31-L35 WeakPolarHBondContact O-CB 3.4Å; H31-L35 PolarHBondContact O-N 3.29Å; K33-L35 VanDerWaalsContact C-N 3.33Å; L35-A43 HydrophobicContact CD1-CB 3.73Å
36	N	78.1	Confident	77.1	Confident	136 Å²	136	62.4 Å²	62.4	73%	0.727	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.9	-2.3	176.5	-69.7	-57.6	0	0	0	113.3	A32 K33 L34	A32-N36 PolarHBondContact O-N 2.88Å; A32-N36 PolarHBondContact O-ND2 2.87Å; K33-N36 PolarHBondContact O-N 3.42Å; L34-N36 PolarHBondContact O-N 2.78Å
37	H	71.5	Confident	77.6	Confident	61 Å²	61	63.9 Å²	63.9	28%	0.282	38%	0.375	S	S	.	.			trans	-88.9	127.5	-174.7	-170	-91.1	0	0	0	110.9	K33 L34 C39 F40	K33-H37 PolarHBondContact O-N 2.75Å; L34-H37 WeakPolarHBondContact O-CB 3.44Å; L34-H37 PolarHBondContact O-N 3.35Å; L34-H37 VanDerWaalsContact O-N 3.09Å; H37-C39 VanDerWaalsContact CE1-CB 3.47Å; H37-C39 WeakPolarHBondContact CE1-CB 3.38Å; H37-C39 PolarHBondContact CE1-SG 3.01Å; H37-C39 VanDerWaalsContact ND1-CB 3.35Å; H37-C39 WeakPolarHBondContact ND1-CB 3.21Å; H37-C39 PolarHBondContact ND1-N 3.5Å; H37-C39 PolarHBondContact O-N 2.93Å; H37-F40 HydrophobicContact CB-CD2 4.04Å; H37-F40 HydrophobicContact CB-CE2 4.43Å; H37-F40 AromaticContact ND1-CD2 3.9Å; H37-F40 AromaticContact ND1-CE2 3.93Å; H37-F40 PolarHBondContact O-N 2.8Å
38	P	71.8	Confident	77.7	Confident	118 Å²	118	66.5 Å²	66.5	77%	0.766	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.8	-21.3	-174.9	-24.1	32.4	0	0	0	114.9
39	C	67	Low	77.5	Confident	37 Å²	37	65.5 Å²	65.5	25%	0.25	39%	0.392	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.2	-5	-174.1	-56.3	0	0	0	0	115.9	H37 C268 I272	H37-C39 VanDerWaalsContact CE1-CB 3.47Å; H37-C39 WeakPolarHBondContact CE1-CB 3.38Å; H37-C39 PolarHBondContact CE1-SG 3.01Å; H37-C39 VanDerWaalsContact ND1-CB 3.35Å; H37-C39 WeakPolarHBondContact ND1-CB 3.21Å; H37-C39 PolarHBondContact ND1-N 3.5Å; H37-C39 PolarHBondContact O-N 2.93Å; C39-C268 WeakPolarHBondContact CA-SG 3.41Å; C39-C268 WeakPolarHBondContact CB-SG 3.42Å; C39-C268 VanDerWaalsContact SG-SG 3.6Å; C39-I272 HydrophobicContact CB-CD1 4.02Å
40	F	66.1	Low	77.6	Confident	27 Å²	27	60.3 Å²	60.3	12%	0.118	37%	0.369	C	S	.	.	S	Bend	trans	-102.4	125.3	176.5	-67.6	-84.8	0	0	0	109.6	L34 H37 G42 E45 V46 L49 I272	L34-F40 HydrophobicContact CB-CD2 4.46Å; L34-F40 HydrophobicContact CD2-CD2 4.07Å; L34-F40 HydrophobicContact CD2-CE2 3.33Å; L34-F40 HydrophobicContact CD2-CZ 3.6Å; L34-F40 HydrophobicContact CG-CE2 4.48Å; H37-F40 HydrophobicContact CB-CD2 4.04Å; H37-F40 HydrophobicContact CB-CE2 4.43Å; H37-F40 AromaticContact ND1-CD2 3.9Å; H37-F40 AromaticContact ND1-CE2 3.93Å; H37-F40 PolarHBondContact O-N 2.8Å; F40-G42 PolarHBondContact O-N 3.45Å; F40-E45 HydrophobicContact CD1-CG 4.47Å; F40-V46 HydrophobicContact CB-CG2 3.64Å; F40-V46 HydrophobicContact CD1-CG2 4.27Å; F40-V46 HydrophobicContact CG-CG2 3.94Å; F40-L49 HydrophobicContact CE1-CD2 4.08Å; F40-L49 HydrophobicContact CZ-CD2 4.47Å; F40-I272 HydrophobicContact CE1-CD1 3.92Å; F40-I272 HydrophobicContact CE2-CD1 4.11Å; F40-I272 HydrophobicContact CZ-CD1 3.67Å; F40-I272 HydrophobicContact CZ-CG2 4.28Å
41	G	60.9	Low	77.7	Confident	78 Å²	78	63 Å²	63	80%	0.804	39%	0.388	S	S	*	.			trans	-73.9	8.8	-167.3	0	0	0	0	0	115.2	E45	G41-E45 PolarHBondContact N-OE2 3.42Å
42	G	72.7	Confident	77.5	Confident	34 Å²	34	66.9 Å²	66.9	35%	0.351	41%	0.405	S	S	.	.	S	Bend	trans	150.4	168.1	177.7	0	0	0	0	0	113.2	F40 T44 E45	F40-G42 PolarHBondContact O-N 3.45Å; G42-T44 PolarHBondContact O-N 3.35Å; G42-E45 PolarHBondContact O-N 3.05Å
43	A	83.1	Confident	77.2	Confident	48 Å²	48	66.3 Å²	66.3	40%	0.397	40%	0.395	S	S	.	.	H	α-helix	trans	-54.6	-38.9	-179.4	0	0	0	0	0	113	L35 E45 V46 D47	L35-A43 HydrophobicContact CD1-CB 3.73Å; A43-E45 VanDerWaalsContact C-N 3.32Å; A43-E45 PolarHBondContact O-N 3.33Å; A43-V46 PolarHBondContact O-N 3.2Å; A43-D47 WeakPolarHBondContact O-CB 2.97Å; A43-D47 PolarHBondContact O-N 2.94Å
44	T	83.9	Confident	77.3	Confident	118 Å²	118	65.6 Å²	65.6	72%	0.724	39%	0.389	S	S	*	.	H	α-helix	trans	-59.5	-38.3	-178.9	-46.5	0	0	0	0	113.4	G42 A48	G42-T44 PolarHBondContact O-N 3.35Å; T44-A48 WeakPolarHBondContact O-CB 3.35Å; T44-A48 PolarHBondContact O-N 2.81Å
45	E	75.6	Confident	77.2	Confident	106 Å²	106	69.2 Å²	69.2	50%	0.495	41%	0.411	S	S	.	.	H	α-helix	trans	-71.7	-42.1	-179.7	-173.2	176.5	-165.2	0	0	110.8	F40 G41 G42 A43 A48 L49	F40-E45 HydrophobicContact CD1-CG 4.47Å; G41-E45 PolarHBondContact N-OE2 3.42Å; G42-E45 PolarHBondContact O-N 3.05Å; A43-E45 VanDerWaalsContact C-N 3.32Å; A43-E45 PolarHBondContact O-N 3.33Å; E45-A48 PolarHBondContact O-N 2.77Å; E45-L49 WeakPolarHBondContact O-CB 3.3Å; E45-L49 PolarHBondContact O-N 2.89Å
46	V	80.3	Confident	76.7	Confident	1 Å²	1	68.6 Å²	68.6	1%	0.006	41%	0.406	C	S	.	.	H	α-helix	trans	-63.1	-45.3	174.9	178.7	0	0	0	0	110.6	L34 F40 A43 A48 L49 I50	L34-V46 HydrophobicContact CB-CB 4.5Å; L34-V46 HydrophobicContact CB-CG1 3.61Å; L34-V46 HydrophobicContact CB-CG2 4.07Å; L34-V46 HydrophobicContact CD1-CG1 4.31Å; F40-V46 HydrophobicContact CB-CG2 3.64Å; F40-V46 HydrophobicContact CD1-CG2 4.27Å; F40-V46 HydrophobicContact CG-CG2 3.94Å; A43-V46 PolarHBondContact O-N 3.2Å; V46-A48 VanDerWaalsContact C-N 3.34Å; V46-A48 PolarHBondContact O-N 2.96Å; V46-L49 PolarHBondContact O-N 3.43Å; V46-I50 HydrophobicContact CG1-CG1 4.2Å; V46-I50 WeakPolarHBondContact O-CB 3.33Å; V46-I50 VanDerWaalsContact O-CG1 3.3Å; V46-I50 WeakPolarHBondContact O-CG1 3.23Å; V46-I50 PolarHBondContact O-N 3.28Å
47	D	84.9	Confident	76.4	Confident	71 Å²	71	63.7 Å²	63.7	38%	0.38	38%	0.38	S	S	.	.	H	α-helix	trans	-61.5	-41.2	178.5	-71.9	-22.6	0	0	0	111.9	H31 A43 S51	H31-D47 IonicContact CD2-OD1 3.55Å; H31-D47 IonicContact CE1-OD1 3.94Å; H31-D47 IonicContact NE2-OD1 2.7Å; H31-D47 PolarHBondContact NE2-OD1 2.94Å; A43-D47 WeakPolarHBondContact O-CB 2.97Å; A43-D47 PolarHBondContact O-N 2.94Å; D47-S51 WeakPolarHBondContact O-CB 3.23Å; D47-S51 PolarHBondContact O-N 2.89Å; D47-S51 PolarHBondContact O-OG 2.67Å
48	A	82.8	Confident	76.5	Confident	60 Å²	60	65.4 Å²	65.4	50%	0.496	39%	0.388	S	S	.	.	H	α-helix	trans	-64.8	-42.8	176.3	0	0	0	0	0	111.9	T44 E45 V46 K52	T44-A48 WeakPolarHBondContact O-CB 3.35Å; T44-A48 PolarHBondContact O-N 2.81Å; E45-A48 PolarHBondContact O-N 2.77Å; V46-A48 VanDerWaalsContact C-N 3.34Å; V46-A48 PolarHBondContact O-N 2.96Å; A48-K52 WeakPolarHBondContact O-CB 3.22Å; A48-K52 PolarHBondContact O-N 3.46Å
49	L	78.9	Confident	76.3	Confident	53 Å²	53	64.1 Å²	64.1	28%	0.277	38%	0.375	S	S	.	.	H	α-helix	trans	-64	-47.6	177	178.8	66.6	0	0	0	111.6	L34 F40 E45 V46 S51 K52 L53 L274	L34-L49 HydrophobicContact CD1-CD2 3.85Å; F40-L49 HydrophobicContact CE1-CD2 4.08Å; F40-L49 HydrophobicContact CZ-CD2 4.47Å; E45-L49 WeakPolarHBondContact O-CB 3.3Å; E45-L49 PolarHBondContact O-N 2.89Å; V46-L49 PolarHBondContact O-N 3.43Å; L49-S51 VanDerWaalsContact C-N 3.35Å; L49-K52 PolarHBondContact O-N 2.89Å; L49-L53 PolarHBondContact O-N 3.2Å; L49-L274 HydrophobicContact CD1-CD1 4.28Å; L49-L274 HydrophobicContact CD2-CD1 3.7Å
50	I	84.4	Confident	76.1	Confident	3 Å²	3	67.1 Å²	67.1	2%	0.015	39%	0.388	C	S	.	.	H	α-helix	trans	-65.3	-39.5	179.2	-70.5	-65.5	0	0	0	111.2	I27 L30 H31 L34 V46 K52 L53 R54	I27-I50 HydrophobicContact CG2-CD1 4.36Å; I27-I50 HydrophobicContact CG2-CG2 3.65Å; L30-I50 HydrophobicContact CB-CD1 4.31Å; L30-I50 HydrophobicContact CD2-CD1 3.96Å; L30-I50 HydrophobicContact CG-CD1 4Å; H31-I50 HydrophobicContact CB-CD1 4.11Å; H31-I50 HydrophobicContact CB-CG1 3.94Å; H31-I50 HydrophobicContact CB-CG2 4.44Å; L34-I50 HydrophobicContact CD1-CD1 4.05Å; L34-I50 HydrophobicContact CD1-CG1 4.4Å; V46-I50 HydrophobicContact CG1-CG1 4.2Å; V46-I50 WeakPolarHBondContact O-CB 3.33Å; V46-I50 VanDerWaalsContact O-CG1 3.3Å; V46-I50 WeakPolarHBondContact O-CG1 3.23Å; V46-I50 PolarHBondContact O-N 3.28Å; I50-K52 VanDerWaalsContact C-N 3.34Å; I50-K52 PolarHBondContact O-N 3.46Å; I50-L53 PolarHBondContact O-N 3.29Å; I50-R54 WeakPolarHBondContact O-CG 3.42Å; I50-R54 PolarHBondContact O-N 3.47Å
51	S	82	Confident	75.8	Confident	64 Å²	64	69 Å²	69	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-61.4	-43.7	174.4	-62.7	0	0	0	0	111.5	D47 L49 R54 T55	D47-S51 WeakPolarHBondContact O-CB 3.23Å; D47-S51 PolarHBondContact O-N 2.89Å; D47-S51 PolarHBondContact O-OG 2.67Å; L49-S51 VanDerWaalsContact C-N 3.35Å; S51-R54 PolarHBondContact O-N 2.94Å; S51-T55 WeakPolarHBondContact O-CG2 3.31Å; S51-T55 PolarHBondContact O-N 2.71Å; S51-T55 PolarHBondContact O-OG1 3.44Å
52	K	81.2	Confident	75.7	Confident	131 Å²	131	71.6 Å²	71.6	57%	0.57	38%	0.38	S	S	*	.	H	α-helix	trans	-61.8	-46.1	176.6	-171.6	178	179.1	-175.8	0	111.7	A48 L49 I50 R54 T55 E56	A48-K52 WeakPolarHBondContact O-CB 3.22Å; A48-K52 PolarHBondContact O-N 3.46Å; L49-K52 PolarHBondContact O-N 2.89Å; I50-K52 VanDerWaalsContact C-N 3.34Å; I50-K52 PolarHBondContact O-N 3.46Å; K52-R54 VanDerWaalsContact C-N 3.35Å; K52-R54 PolarHBondContact O-N 3.42Å; K52-T55 WeakPolarHBondContact CA-OG1 3.41Å; K52-T55 PolarHBondContact O-N 3.14Å; K52-T55 PolarHBondContact O-OG1 3.48Å; K52-E56 PolarHBondContact O-N 3.42Å
53	L	78.7	Confident	74.8	Confident	36 Å²	36	75 Å²	75	19%	0.188	39%	0.394	C	S	.	.	H	α-helix	trans	-59.9	-43.7	177.3	-175.1	66	0	0	0	111.8	I27 L30 L49 I50 E56 L57 V276	I27-L53 HydrophobicContact CG1-CD2 4.25Å; L30-L53 HydrophobicContact CD2-CD2 3.74Å; L49-L53 PolarHBondContact O-N 3.2Å; I50-L53 PolarHBondContact O-N 3.29Å; L53-E56 PolarHBondContact O-N 3.24Å; L53-L57 WeakPolarHBondContact O-CB 3.42Å; L53-L57 PolarHBondContact O-N 3.35Å; L53-V276 HydrophobicContact CD1-CG2 4.12Å
54	R	80.5	Confident	73.1	Confident	102 Å²	102	78.3 Å²	78.3	39%	0.385	41%	0.405	S	S	.	.	H	α-helix	trans	-59.5	-46.1	174.8	-79.6	179.2	176.1	158.1	-0	112.2	I27 D28 I50 S51 K52 E56 L57 E58	I27-R54 HydrophobicContact CD1-CG 3.87Å; I27-R54 HydrophobicContact CG2-CG 3.92Å; D28-R54 IonicContact OD1-CZ 3.5Å; D28-R54 IonicContact OD1-NH2 3.74Å; D28-R54 PolarHBondContact OD1-NH2 3.47Å; I50-R54 WeakPolarHBondContact O-CG 3.42Å; I50-R54 PolarHBondContact O-N 3.47Å; S51-R54 PolarHBondContact O-N 2.94Å; K52-R54 VanDerWaalsContact C-N 3.35Å; K52-R54 PolarHBondContact O-N 3.42Å; R54-E56 VanDerWaalsContact C-N 3.34Å; R54-E56 PolarHBondContact O-N 2.98Å; R54-L57 PolarHBondContact O-N 3.27Å; R54-E58 WeakPolarHBondContact O-CB 3.5Å; R54-E58 PolarHBondContact O-N 3.19Å
55	T	75.9	Confident	71.5	Confident	80 Å²	80	76.9 Å²	76.9	49%	0.491	39%	0.391	S	S	.	.	H	α-helix	trans	-65.8	-36.5	-179.7	53.7	0	0	0	0	113	S51 K52 N59	S51-T55 WeakPolarHBondContact O-CG2 3.31Å; S51-T55 PolarHBondContact O-N 2.71Å; S51-T55 PolarHBondContact O-OG1 3.44Å; K52-T55 WeakPolarHBondContact CA-OG1 3.41Å; K52-T55 PolarHBondContact O-N 3.14Å; K52-T55 PolarHBondContact O-OG1 3.48Å; T55-N59 PolarHBondContact O-N 3.13Å; T55-N59 VanDerWaalsContact O-N 3.08Å; T55-N59 PolarHBondContact O-ND2 3.42Å; T55-N59 VanDerWaalsContact O-ND2 3.12Å
56	E	71.6	Confident	70	Confident	76 Å²	76	79.8 Å²	79.8	36%	0.355	40%	0.398	S	S	.	.	H	α-helix	trans	-68.1	-43	178	-171.5	160.2	-159.1	0	0	111	K52 L53 R54 E58 N59 D60 I132	K52-E56 PolarHBondContact O-N 3.42Å; L53-E56 PolarHBondContact O-N 3.24Å; R54-E56 VanDerWaalsContact C-N 3.34Å; R54-E56 PolarHBondContact O-N 2.98Å; E56-E58 VanDerWaalsContact C-N 3.34Å; E56-E58 PolarHBondContact O-N 2.69Å; E56-N59 WeakPolarHBondContact O-CB 3.35Å; E56-N59 PolarHBondContact O-N 3.37Å; E56-N59 VanDerWaalsContact O-N 3.17Å; E56-D60 PolarHBondContact O-N 3.34Å; E56-I132 WeakPolarHBondContact OE1-CD1 3.49Å
57	L	71	Confident	68.3	Low	34 Å²	34	82.9 Å²	82.9	18%	0.178	42%	0.424	C	S	.	.	H	α-helix	trans	-63.2	-39	176.7	-160	61.7	0	0	0	113.2	Q23 I27 L53 R54 N59 D60 Y61	Q23-L57 HydrophobicContact CB-CD2 3.84Å; Q23-L57 HydrophobicContact CG-CD2 4.08Å; I27-L57 HydrophobicContact CD1-CD2 3.73Å; L53-L57 WeakPolarHBondContact O-CB 3.42Å; L53-L57 PolarHBondContact O-N 3.35Å; R54-L57 PolarHBondContact O-N 3.27Å; L57-N59 VanDerWaalsContact C-N 3.35Å; L57-D60 PolarHBondContact O-N 3.44Å; L57-Y61 PolarHBondContact O-N 3.15Å
58	E	72.7	Confident	66.4	Low	97 Å²	97	81.1 Å²	81.1	45%	0.453	42%	0.422	S	S	.	.	H	α-helix	trans	-67	-35.6	175.1	-178.4	62.6	-153	0	0	112	R54 E56 Y61 R62	R54-E58 WeakPolarHBondContact O-CB 3.5Å; R54-E58 PolarHBondContact O-N 3.19Å; E56-E58 VanDerWaalsContact C-N 3.34Å; E56-E58 PolarHBondContact O-N 2.69Å; E58-Y61 PolarHBondContact O-N 3.26Å; E58-R62 PolarHBondContact O-N 2.99Å; E58-R62 VanDerWaalsContact O-N 3.12Å; E58-R62 IonicContact OE1-NH2 2.67Å; E58-R62 PolarHBondContact OE1-NH2 2.83Å
59	N	68.7	Low	64.5	Low	91 Å²	91	82.9 Å²	82.9	49%	0.487	42%	0.42	S	S	.	.	H	α-helix	trans	-69.4	-37.5	176.8	-71.4	-27.8	0	0	0	112.4	T55 E56 L57 Y61 R62 T63	T55-N59 PolarHBondContact O-N 3.13Å; T55-N59 VanDerWaalsContact O-N 3.08Å; T55-N59 PolarHBondContact O-ND2 3.42Å; T55-N59 VanDerWaalsContact O-ND2 3.12Å; E56-N59 WeakPolarHBondContact O-CB 3.35Å; E56-N59 PolarHBondContact O-N 3.37Å; E56-N59 VanDerWaalsContact O-N 3.17Å; L57-N59 VanDerWaalsContact C-N 3.35Å; N59-Y61 VanDerWaalsContact C-N 3.28Å; N59-Y61 PolarHBondContact O-N 3.34Å; N59-R62 PolarHBondContact O-N 3.37Å; N59-T63 WeakPolarHBondContact O-CB 3.46Å; N59-T63 PolarHBondContact O-N 3.34Å; N59-T63 PolarHBondContact O-OG1 3.27Å
60	D	62.9	Low	62.9	Low	99 Å²	99	84 Å²	84	53%	0.529	43%	0.433	S	S	.	.	H	α-helix	trans	-61.1	-38.8	174.9	-79.3	-12.9	0	0	0	111.3	E56 L57	E56-D60 PolarHBondContact O-N 3.34Å; L57-D60 PolarHBondContact O-N 3.44Å
61	Y	60.1	Low	60.8	Low	66 Å²	66	89.1 Å²	89.1	26%	0.259	46%	0.459	S	S	.	.	H	α-helix	trans	-65.2	-47	174.4	-178.9	-94.1	0	0	0	112	R20 L57 E58 N59 T63 N64 E65	R20-Y61 VanDerWaalsContact NH1-CE2 3.26Å; R20-Y61 PolarHBondContact NH1-OH 3.47Å; R20-Y61 PolarHBondContact NH2-OH 3Å; L57-Y61 PolarHBondContact O-N 3.15Å; E58-Y61 PolarHBondContact O-N 3.26Å; N59-Y61 VanDerWaalsContact C-N 3.28Å; N59-Y61 PolarHBondContact O-N 3.34Å; Y61-T63 VanDerWaalsContact C-N 3.28Å; Y61-T63 PolarHBondContact O-N 3.15Å; Y61-N64 WeakPolarHBondContact O-CB 3.39Å; Y61-N64 PolarHBondContact O-N 2.99Å; Y61-N64 VanDerWaalsContact O-N 3.15Å; Y61-E65 HydrophobicContact CE1-CG 4.44Å; Y61-E65 WeakPolarHBondContact CE1-OE1 3.3Å; Y61-E65 PolarHBondContact OH-OE1 3.02Å
62	R	58.5	Low	58.9	Low	134 Å²	134	90.6 Å²	90.6	51%	0.506	46%	0.462	S	S	.	.	H	α-helix	trans	-66.3	-30.2	-177.9	-166.4	176.1	-57.8	-121	-8	113.4	E58 N59 N64 E65 Y66	E58-R62 PolarHBondContact O-N 2.99Å; E58-R62 VanDerWaalsContact O-N 3.12Å; E58-R62 IonicContact OE1-NH2 2.67Å; E58-R62 PolarHBondContact OE1-NH2 2.83Å; N59-R62 PolarHBondContact O-N 3.37Å; R62-N64 PolarHBondContact O-N 3.39Å; R62-E65 PolarHBondContact O-N 3.37Å; R62-E65 VanDerWaalsContact O-N 3.15Å; R62-Y66 PolarHBondContact O-N 2.96Å
63	T	53.1	Low	56.9	Low	105 Å²	105	91.9 Å²	91.9	64%	0.644	47%	0.47	S	S	*	.	H	α-helix	trans	-66.8	-19.7	178.4	-55.4	0	0	0	0	111.9	N59 Y61	N59-T63 WeakPolarHBondContact O-CB 3.46Å; N59-T63 PolarHBondContact O-N 3.34Å; N59-T63 PolarHBondContact O-OG1 3.27Å; Y61-T63 VanDerWaalsContact C-N 3.28Å; Y61-T63 PolarHBondContact O-N 3.15Å
64	N	48.6	Very low	55.2	Low	117 Å²	117	93 Å²	93	63%	0.626	48%	0.481	S	S	*	.	H	α-helix	trans	-81.6	-30.7	172.3	-168.5	24.2	0	0	0	113.3	Y61 R62	Y61-N64 WeakPolarHBondContact O-CB 3.39Å; Y61-N64 PolarHBondContact O-N 2.99Å; Y61-N64 VanDerWaalsContact O-N 3.15Å; R62-N64 PolarHBondContact O-N 3.39Å
65	E	49.5	Very low	53.5	Low	89 Å²	89	93.3 Å²	93.3	42%	0.416	49%	0.489	S	S	.	.	H	α-helix	trans	-78.5	-29.2	-179.1	-80.9	177.9	168	0	0	113.2	Y61 R62 A67 G68 E69	Y61-E65 HydrophobicContact CE1-CG 4.44Å; Y61-E65 WeakPolarHBondContact CE1-OE1 3.3Å; Y61-E65 PolarHBondContact OH-OE1 3.02Å; R62-E65 PolarHBondContact O-N 3.37Å; R62-E65 VanDerWaalsContact O-N 3.15Å; E65-A67 VanDerWaalsContact C-N 3.27Å; E65-A67 PolarHBondContact O-N 3.02Å; E65-G68 PolarHBondContact O-N 3.41Å; E65-G68 VanDerWaalsContact O-N 3.14Å; E65-E69 PolarHBondContact O-N 3.03Å
66	Y	44.3	Very low	52	Low	167 Å²	167	97.2 Å²	97.2	66%	0.655	50%	0.502	S	S	*	.	H	α-helix	trans	-70.4	-17.4	177.6	-107.4	-86.9	0	0	0	114.8	R62	R62-Y66 PolarHBondContact O-N 2.96Å
67	A	44.8	Very low	50.7	Low	65 Å²	65	97.6 Å²	97.6	54%	0.537	51%	0.513	S	S	.	.	H	α-helix	trans	-79.6	-28.3	172.5	0	0	0	0	0	112.1	E65 S70	E65-A67 VanDerWaalsContact C-N 3.27Å; E65-A67 PolarHBondContact O-N 3.02Å; A67-S70 PolarHBondContact O-OG 3.5Å
68	G	44.3	Very low	49.4	Very low	34 Å²	34	101.8 Å²	101.8	35%	0.351	54%	0.535	S	S	.	.	H	α-helix	trans	-79	-36.3	176.5	0	0	0	0	0	113.1	E65 S70 L71 N72	E65-G68 PolarHBondContact O-N 3.41Å; E65-G68 VanDerWaalsContact O-N 3.14Å; G68-S70 PolarHBondContact O-N 3Å; G68-L71 PolarHBondContact O-N 3.44Å; G68-N72 PolarHBondContact O-ND2 3.34Å; G68-N72 PolarHBondContact O-OD1 3.47Å
69	E	43.7	Very low	48.1	Very low	97 Å²	97	103.3 Å²	103.3	45%	0.453	55%	0.547	S	S	.	.	H	α-helix	trans	-71.4	-28	-174.6	-70.3	176	172.5	0	0	114	E65 L71 N72	E65-E69 PolarHBondContact O-N 3.03Å; E69-L71 PolarHBondContact O-N 3.35Å; E69-N72 PolarHBondContact O-N 3.07Å
70	S	45.3	Very low	46.8	Very low	77 Å²	77	106.7 Å²	106.7	54%	0.538	56%	0.564	S	S	.	*	H	α-helix	trans	-68	-21.2	176.9	74.4	0	0	0	0	114.2	A67 G68	A67-S70 PolarHBondContact O-OG 3.5Å; G68-S70 PolarHBondContact O-N 3Å
71	L	39.3	Very low	45.7	Very low	110 Å²	110	107.5 Å²	107.5	58%	0.576	58%	0.577	S	S	*	*	H	α-helix	trans	-86.7	-22.1	177.8	-63.9	178.2	0	0	0	112.1	G68 E69 I75	G68-L71 PolarHBondContact O-N 3.44Å; E69-L71 PolarHBondContact O-N 3.35Å; L71-I75 WeakPolarHBondContact O-CD1 3.34Å; L71-I75 VanDerWaalsContact O-CG1 3.25Å; L71-I75 WeakPolarHBondContact O-CG1 3.45Å; L71-I75 PolarHBondContact O-N 3.42Å
72	N	41.8	Very low	44.7	Very low	95 Å²	95	109.2 Å²	109.2	51%	0.508	61%	0.605	S	S	.	*	H	α-helix	trans	-81.1	-35.8	-173.1	-50.9	-15.1	0	0	0	111.4	G68 E69 I75 Q76	G68-N72 PolarHBondContact O-ND2 3.34Å; G68-N72 PolarHBondContact O-OD1 3.47Å; E69-N72 PolarHBondContact O-N 3.07Å; N72-I75 PolarHBondContact O-N 3.03Å; N72-Q76 PolarHBondContact O-N 3.48Å
73	E	40.6	Very low	43.9	Very low	158 Å²	158	107.3 Å²	107.3	74%	0.738	62%	0.618	S	S	*	*	H	α-helix	trans	-75.6	-25	178.4	-148	171.4	-166.5	0	0	112.4	S77	E73-S77 PolarHBondContact O-N 3.05Å; E73-S77 PolarHBondContact O-OG 3.08Å
74	S	42.6	Very low	43.2	Very low	59 Å²	59	108.5 Å²	108.5	41%	0.413	63%	0.625	S	S	.	*	H	α-helix	trans	-76.8	-28.9	174	-176.8	0	0	0	0	113.2	S77 N78	S74-S77 PolarHBondContact O-OG 3.17Å; S74-N78 PolarHBondContact O-ND2 3.12Å
75	I	43.4	Very low	43	Very low	109 Å²	109	110.8 Å²	110.8	56%	0.559	64%	0.636	S	S	*	*	H	α-helix	trans	-80.9	-29.7	-179.7	-67	167.8	0	0	0	111.5	L71 N72 N79	L71-I75 WeakPolarHBondContact O-CD1 3.34Å; L71-I75 VanDerWaalsContact O-CG1 3.25Å; L71-I75 WeakPolarHBondContact O-CG1 3.45Å; L71-I75 PolarHBondContact O-N 3.42Å; N72-I75 PolarHBondContact O-N 3.03Å; I75-N79 PolarHBondContact O-ND2 3.43Å
76	Q	45.9	Very low	42.7	Very low	162 Å²	162	115.1 Å²	115.1	76%	0.757	66%	0.656	S	S	*	*	H	α-helix	trans	-81.2	-28.4	175.8	-97.4	174.8	3.8	0	0	114.2	N72	N72-Q76 PolarHBondContact O-N 3.48Å
77	S	44.5	Very low	42.5	Very low	84 Å²	84	114.5 Å²	114.5	59%	0.587	66%	0.663	S	S	*	*	H	α-helix	trans	-80.7	-14.2	-179	51.5	0	0	0	0	114.8	E73 S74	E73-S77 PolarHBondContact O-N 3.05Å; E73-S77 PolarHBondContact O-OG 3.08Å; S74-S77 PolarHBondContact O-OG 3.17Å
78	N	43.7	Very low	42.5	Very low	122 Å²	122	119.9 Å²	119.9	65%	0.652	68%	0.678	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.7	0.6	-179.3	-76.2	-48.1	0	0	0	115.1	S74	S74-N78 PolarHBondContact O-ND2 3.12Å
79	N	45.1	Very low	42.2	Very low	130 Å²	130	124.1 Å²	124.1	70%	0.695	70%	0.699	S	S	*	*	S	Bend	trans	-106.5	18.4	-174.1	-77.8	-51.3	0	0	0	114.8	I75	I75-N79 PolarHBondContact O-ND2 3.43Å
80	L	39.9	Very low	42.2	Very low	162 Å²	162	125.2 Å²	125.2	85%	0.848	72%	0.717	S	S	*	*	S	Bend	trans	-117.2	44.9	-174.5	-104.2	154.9	0	0	0	113.3
81	S	40.1	Very low	42.1	Very low	115 Å²	115	127 Å²	127	80%	0.804	73%	0.729	S	S	*	*			trans	-163.3	79.5	161.2	72.1	0	0	0	0	113.7
82	A	38.9	Very low	42.2	Very low	102 Å²	102	127 Å²	127	84%	0.843	74%	0.736	S	S	*	*			trans	-161.7	66.1	157.8	0	0	0	0	0	110.6	V84	A82-V84 PolarHBondContact O-N 2.77Å
83	A	42	Very low	42.3	Very low	95 Å²	95	129.4 Å²	129.4	79%	0.785	75%	0.754	S	S	*	*			trans	-68.2	119	165.1	0	0	0	0	0	109.5
84	V	39.6	Very low	42.5	Very low	129 Å²	129	129.3 Å²	129.3	78%	0.782	76%	0.758	S	S	*	*			trans	57	106.2	138.9	-171.8	0	0	0	0	116.7	A82	A82-V84 PolarHBondContact O-N 2.77Å
85	I	44.4	Very low	42.6	Very low	166 Å²	166	131.6 Å²	131.6	85%	0.851	77%	0.771	S	S	*	*				-161.7	114.5	126.7	-87	143.6	0	0	0	107
86	H	42.1	Very low	42.2	Very low	180 Å²	180	132 Å²	132	83%	0.833	78%	0.778	S	S	*	*			trans	-76.4	128.7	165.6	-96.8	-87.1	0	0	0	109
87	D	41.4	Very low	42.2	Very low	153 Å²	153	129.2 Å²	129.2	82%	0.818	78%	0.777	S	S	*	*				-172	149.6	116.8	-115.9	-22.7	0	0	0	113.1
88	Q	44.1	Very low	42.3	Very low	179 Å²	179	133.6 Å²	133.6	84%	0.836	79%	0.788	S	S	*	*			trans	-65.2	158.1	-159.6	-76.2	-173.7	-74.4	0	0	118.1
89	P	37.6	Very low	42.4	Very low	122 Å²	122	134.3 Å²	134.3	79%	0.792	80%	0.797	S	S	*	*			trans	-96.3	145.8	179.9	37.5	-30.6	0	0	0	113.1
90	S	44.6	Very low	42.2	Very low	120 Å²	120	133.5 Å²	133.5	84%	0.839	80%	0.801	S	S	*	*			trans	-136.8	101.3	167.1	-175.3	0	0	0	0	112.6
91	S	41.9	Very low	42.6	Very low	114 Å²	114	131.1 Å²	131.1	80%	0.797	80%	0.795	S	S	*	*			trans	54.6	141.2	148.1	-140.9	0	0	0	0	122.8
92	P	41.2	Very low	42.7	Very low	111 Å²	111	131 Å²	131	72%	0.721	79%	0.789	S	S	*	*			trans	-102.2	148.1	-167	38.8	-29.1	0	0	0	114.4
93	V	44.5	Very low	43	Very low	146 Å²	146	134.9 Å²	134.9	89%	0.885	79%	0.789	S	S	*	*			trans	-143.2	119.5	165.2	-177.4	0	0	0	0	109.6
94	L	44.5	Very low	42.8	Very low	156 Å²	156	133.4 Å²	133.4	82%	0.817	78%	0.783	S	S	*	*			trans	-99.8	-179.8	168.4	-76.1	178.8	0	0	0	109.5
95	P	45.4	Very low	43.2	Very low	106 Å²	106	133.4 Å²	133.4	69%	0.688	79%	0.786	S	S	*	*			cis	-139.4	-165.9	-20	23.9	2.3	0	0	0	114.5
96	V	34	Very low	43.1	Very low	118 Å²	118	131.5 Å²	131.5	72%	0.715	79%	0.788	S	S	*	*			trans	85.6	128.2	156.4	-151.7	0	0	0	0	114.6
97	S	46.6	Very low	42.6	Very low	104 Å²	104	130 Å²	130	73%	0.727	79%	0.785	S	S	*	*				-158.3	146.5	55.7	-46.3	0	0	0	0	117
98	E	46	Very low	42.7	Very low	175 Å²	175	131.1 Å²	131.1	82%	0.818	79%	0.789	S	S	*	*			trans	20	135.4	138.6	-63.7	177.7	134.4	0	0	123.5
99	T	46.8	Very low	42.5	Very low	138 Å²	138	128.8 Å²	128.8	85%	0.847	78%	0.782	S	S	*	*				-178.1	128.3	108.4	-67.8	0	0	0	0	111.7
100	C	41.2	Very low	42.9	Very low	113 Å²	113	127.5 Å²	127.5	76%	0.764	77%	0.774	S	S	*	*			trans	-94.3	-156.6	-178.9	-54.1	0	0	0	0	112.4
101	P	47.4	Very low	42.7	Very low	112 Å²	112	129.4 Å²	129.4	73%	0.727	77%	0.77	S	S	*	*			cis	-135.2	-169	-45.2	23.2	0.6	0	0	0	114.3
102	V	42.4	Very low	42.5	Very low	111 Å²	111	129.9 Å²	129.9	67%	0.673	77%	0.768	S	S	*	*			trans	117.3	104.8	139.3	-168.8	0	0	0	0	117.6
103	H	46.4	Very low	42.4	Very low	184 Å²	184	132.3 Å²	132.3	85%	0.852	77%	0.767	S	S	*	*				175.3	113.7	117.1	-105.7	-78.9	0	0	0	111.1
104	G	36.5	Very low	42	Very low	65 Å²	65	136.9 Å²	136.9	67%	0.67	77%	0.768	S	S	*	*			trans	-103.5	-151.1	159.7	0	0	0	0	0	110.2
105	P	47.6	Very low	41.7	Very low	128 Å²	128	133.4 Å²	133.4	83%	0.831	76%	0.762	S	S	*	*			cis	-133.3	178.3	-39.7	37.5	-21.6	0	0	0	111.1
106	S	42.2	Very low	41	Very low	127 Å²	127	132.9 Å²	132.9	89%	0.888	76%	0.761	S	S	*	*			trans	177.1	141.4	135.2	32.9	0	0	0	0	114.5
107	L	32.4	Very low	41	Very low	148 Å²	148	133.9 Å²	133.9	78%	0.775	76%	0.762	S	S	*	*			trans	-101.2	137	-171.1	-171.1	90.7	0	0	0	109.6
108	I	42.9	Very low	40.6	Very low	176 Å²	176	137.1 Å²	137.1	90%	0.903	77%	0.766	S	S	*	*			trans	-136.7	130.7	162.2	-54	178.9	0	0	0	109.2
109	N	40	Very low	39.9	Very low	130 Å²	130	134.1 Å²	134.1	70%	0.695	76%	0.764	S	S	*	*			trans	-103	-162.2	-162	-130.3	7.3	0	0	0	109.3
110	P	45.9	Very low	39	Very low	96 Å²	96	132.9 Å²	132.9	62%	0.623	76%	0.761	S	S	*	*				-137.9	-159	-72.2	37.1	-14.1	0	0	0	113.6
111	E	41.4	Very low	38.4	Very low	160 Å²	160	132.3 Å²	132.3	75%	0.748	76%	0.759	S	S	*	*			trans	98.2	118.4	163.5	-58.7	-161.6	112.4	0	0	117.6
112	T	38.3	Very low	37.6	Very low	124 Å²	124	132.3 Å²	132.3	76%	0.761	76%	0.761	S	S	*	*				-160.6	121.4	70.3	-65.8	0	0	0	0	114.2
113	K	37.2	Very low	37	Very low	161 Å²	161	134.2 Å²	134.2	70%	0.7	76%	0.763	S	S	*	*			trans	43.8	113.4	139	-62.8	-178.7	-179.6	174.1	0	121.2
114	R	37.3	Very low	36	Very low	243 Å²	243	136.9 Å²	136.9	92%	0.917	77%	0.765	S	S	*	*				89.7	140.4	91.2	-77.9	-141.1	-171.9	-176.5	3.8	113
115	A	37	Very low	35.6	Very low	82 Å²	82	137.5 Å²	137.5	68%	0.678	75%	0.753	S	S	*	*			cis	-150.4	142.9	11.4	0	0	0	0	0	112.3
116	S	32.5	Very low	34.7	Very low	96 Å²	96	138.1 Å²	138.1	67%	0.671	75%	0.75	S	S	*	*			trans	-7	130.7	147.9	56.4	0	0	0	0	120.6
117	N	33.8	Very low	34.1	Very low	138 Å²	138	138.1 Å²	138.1	74%	0.738	74%	0.738	S	S	*	*				173.9	141.6	103.9	-94.9	-4.2	0	0	0	113.2
118	E	37.3	Very low	33.8	Very low	173 Å²	173	139.5 Å²	139.5	81%	0.808	75%	0.746	S	S	*	*			trans	80	110.3	145.4	-68.2	175.5	176.2	0	0	121.8
119	S	30.9	Very low	33.1	Very low	111 Å²	111	137.2 Å²	137.2	78%	0.776	74%	0.735	S	S	*	*			trans	-50.6	139.9	154.4	46.5	0	0	0	0	114.3
120	S	28.7	Very low	32.5	Very low	113 Å²	113	135.3 Å²	135.3	79%	0.79	73%	0.731	S	S	*	*			trans	-178.2	113.8	148	-80.7	0	0	0	0	108.4
121	S	28.9	Very low	31.7	Very low	101 Å²	101	134.8 Å²	134.8	71%	0.706	74%	0.735	S	S	*	*				93	119.2	95.4	72.7	0	0	0	0	113.2
122	S	29.8	Very low	31.3	Very low	112 Å²	112	132.4 Å²	132.4	78%	0.783	73%	0.726	S	S	*	*			trans	6.2	117.9	152	56.2	0	0	0	0	118.3
123	Q	29.2	Very low	30.8	Very low	151 Å²	151	136.1 Å²	136.1	71%	0.706	73%	0.732	S	S	*	*			trans	-150.2	103.3	147.7	-132.1	168.6	-53.2	0	0	109.7	D125	Q123-D125 VanDerWaalsContact CB-OD2 3.31Å; Q123-D125 WeakPolarHBondContact CB-OD2 3.44Å; Q123-D125 VanDerWaalsContact CD-OD1 3.31Å; Q123-D125 VanDerWaalsContact CG-CG 3.43Å; Q123-D125 WeakPolarHBondContact CG-OD1 3.23Å; Q123-D125 VanDerWaalsContact CG-OD2 3.23Å; Q123-D125 WeakPolarHBondContact CG-OD2 3.37Å; Q123-D125 PolarHBondContact NE2-OD1 2.77Å; Q123-D125 PolarHBondContact NE2-OD2 3.43Å; Q123-D125 PolarHBondContact O-N 2.98Å
124	R	27	Very low	30.5	Very low	240 Å²	240	135.2 Å²	135.2	91%	0.906	73%	0.733	S	S	*	*			trans	-65.5	108.6	149.8	-74.3	-179.1	172.2	97.3	-1.2	103.7	N126	R124-N126 PolarHBondContact O-OD1 3.46Å
125	D	27.9	Very low	30.1	Very low	78 Å²	78	128 Å²	128	42%	0.417	73%	0.726	S	S	.	*			trans	-118.1	85.9	176.5	-83	-34	0	0	0	109.1	Q123 I127	Q123-D125 VanDerWaalsContact CB-OD2 3.31Å; Q123-D125 WeakPolarHBondContact CB-OD2 3.44Å; Q123-D125 VanDerWaalsContact CD-OD1 3.31Å; Q123-D125 VanDerWaalsContact CG-CG 3.43Å; Q123-D125 WeakPolarHBondContact CG-OD1 3.23Å; Q123-D125 VanDerWaalsContact CG-OD2 3.23Å; Q123-D125 WeakPolarHBondContact CG-OD2 3.37Å; Q123-D125 PolarHBondContact NE2-OD1 2.77Å; Q123-D125 PolarHBondContact NE2-OD2 3.43Å; Q123-D125 PolarHBondContact O-N 2.98Å; D125-I127 HydrophobicContact CB-CD1 4.4Å; D125-I127 HydrophobicContact CB-CG1 4.34Å; D125-I127 PolarHBondContact O-N 3.28Å
126	N	28.2	Very low	29.7	Very low	141 Å²	141	129 Å²	129	75%	0.754	73%	0.734	S	S	*	*				-3.1	70.9	119.8	31.1	-75.7	0	0	0	116.2	R124	R124-N126 PolarHBondContact O-OD1 3.46Å
127	I	29	Very low	29.9	Very low	127 Å²	127	131 Å²	131	65%	0.651	74%	0.742	S	S	*	*			trans	-151.1	86.3	165.3	-48.8	175.3	0	0	0	109.8	D125 L129	D125-I127 HydrophobicContact CB-CD1 4.4Å; D125-I127 HydrophobicContact CB-CG1 4.34Å; D125-I127 PolarHBondContact O-N 3.28Å; I127-L129 HydrophobicContact CG2-CB 4.5Å
128	L	27.1	Very low	29.8	Very low	177 Å²	177	130.3 Å²	130.3	93%	0.927	75%	0.745	S	S	*	*			trans	-116	63	161.1	-137	137	0	0	0	108.4	S130	L128-S130 PolarHBondContact O-N 2.94Å
129	L	27.4	Very low	29.6	Very low	128 Å²	128	126.7 Å²	126.7	67%	0.67	75%	0.745	S	S	*	*			trans	-83.6	95.3	166.4	-98.3	158.5	0	0	0	107.5	I127 A131	I127-L129 HydrophobicContact CG2-CB 4.5Å; L129-A131 PolarHBondContact O-N 3.36Å
130	S	27.9	Very low	29.9	Very low	90 Å²	90	129.7 Å²	129.7	63%	0.629	75%	0.746	S	S	*	*			trans	-69.7	80.6	164.4	47.9	0	0	0	0	109.1	L128 I132	L128-S130 PolarHBondContact O-N 2.94Å; S130-I132 PolarHBondContact O-N 3.31Å; S130-I132 VanDerWaalsContact O-N 3.09Å
131	A	29.7	Very low	30.3	Very low	85 Å²	85	132.2 Å²	132.2	70%	0.702	75%	0.745	S	S	*	*			trans	-68.7	103.3	168.8	0	0	0	0	0	109.2	L129 K133	L129-A131 PolarHBondContact O-N 3.36Å; A131-K133 PolarHBondContact O-N 2.86Å
132	I	31.9	Very low	30.9	Very low	110 Å²	110	135.6 Å²	135.6	56%	0.564	75%	0.75	S	S	*	*			trans	-68.9	99.4	170.1	-62.6	168.2	0	0	0	108.1	E56 S130 I134	E56-I132 WeakPolarHBondContact OE1-CD1 3.49Å; S130-I132 PolarHBondContact O-N 3.31Å; S130-I132 VanDerWaalsContact O-N 3.09Å; I132-I134 HydrophobicContact CG2-CD1 3.7Å; I132-I134 HydrophobicContact CG2-CG1 3.75Å
133	K	29.2	Very low	31.5	Very low	201 Å²	201	136.7 Å²	136.7	87%	0.874	75%	0.752	S	S	*	*			trans	-94.2	98.2	175.3	-173.4	176.5	-176.9	177	0	109.2	A131	A131-K133 PolarHBondContact O-N 2.86Å
134	I	29.9	Very low	31.9	Very low	143 Å²	143	137.4 Å²	137.4	73%	0.733	76%	0.755	S	S	*	*	P	Polyproline II helix	trans	-99.7	131.6	172.9	-61.5	169.6	0	0	0	108.8	I132	I132-I134 HydrophobicContact CG2-CD1 3.7Å; I132-I134 HydrophobicContact CG2-CG1 3.75Å
135	A	29.1	Very low	32.5	Very low	92 Å²	92	133.4 Å²	133.4	76%	0.76	75%	0.752	S	S	*	*	P	Polyproline II helix	trans	-61.4	145.4	-161.3	0	0	0	0	0	115.9
136	A	27.7	Very low	33.1	Very low	102 Å²	102	138.7 Å²	138.7	84%	0.843	77%	0.771	S	S	*	*	P	Polyproline II helix	trans	-86.1	144.9	172.2	0	0	0	0	0	111.9
137	V	36.6	Very low	33.5	Very low	138 Å²	138	136.5 Å²	136.5	84%	0.836	77%	0.767	S	S	*	*			trans	-123.5	140.1	170	173.7	0	0	0	0	108.2
138	P	33.2	Very low	33.9	Very low	124 Å²	124	135.6 Å²	135.6	81%	0.805	77%	0.772	S	S	*	*			trans	-91.5	168.3	-151.3	36.2	-34.3	0	0	0	115.9
139	A	32.4	Very low	34.4	Very low	97 Å²	97	132 Å²	132	80%	0.802	76%	0.762	S	S	*	*			trans	-60.4	157.5	-166.9	0	0	0	0	0	117.7
140	H	37.4	Very low	35	Very low	173 Å²	173	131.3 Å²	131.3	80%	0.801	76%	0.763	S	S	*	*			trans	-124.1	135.6	143.3	-170.6	-82.9	0	0	0	109.3
141	E	37	Very low	35.7	Very low	166 Å²	166	134 Å²	134	78%	0.776	77%	0.769	S	S	*	*			trans	-74.9	153.9	-175.7	-61.7	175.5	151.1	0	0	112.3
142	E	42.4	Very low	36.2	Very low	173 Å²	173	135.9 Å²	135.9	81%	0.808	77%	0.767	S	S	*	*			trans	174.9	100.4	137.8	-97.1	174.7	-160.2	0	0	107.3
143	T	40.9	Very low	36.3	Very low	135 Å²	135	136 Å²	136	83%	0.828	77%	0.773	S	S	*	*				110.1	124.4	75.2	-68.9	0	0	0	0	110.1
144	E	37.6	Very low	36.6	Very low	165 Å²	165	134.8 Å²	134.8	77%	0.771	77%	0.771	S	S	*	*			trans	-47.3	149.5	-175.9	-76.1	175.7	120	0	0	117.4
145	N	40.9	Very low	37.1	Very low	156 Å²	156	132.4 Å²	132.4	83%	0.834	77%	0.772	S	S	*	*				175.2	97.2	103	52.3	4.6	0	0	0	117
146	K	39.4	Very low	37.6	Very low	189 Å²	189	133.3 Å²	133.3	82%	0.822	77%	0.77	S	S	*	*				39.7	108.7	120.9	-140.9	163	-174	175.4	0	123
147	S	36.3	Very low	38	Very low	96 Å²	96	135.6 Å²	135.6	67%	0.671	77%	0.769	S	S	*	*				83.5	123.8	120.9	-67	0	0	0	0	125.4
148	S	39.1	Very low	37.9	Very low	108 Å²	108	136.2 Å²	136.2	76%	0.755	76%	0.762	S	S	*	*				74.4	151.8	126.1	68.6	0	0	0	0	120.7
149	S	36.7	Very low	38	Very low	101 Å²	101	136.2 Å²	136.2	71%	0.706	75%	0.754	S	S	*	*			cis	179.4	178.8	-24.1	64.4	0	0	0	0	107.1
150	V	39.3	Very low	38.2	Very low	114 Å²	114	137.6 Å²	137.6	69%	0.691	75%	0.748	S	S	*	*			trans	90.8	101.2	163.7	-163.5	0	0	0	0	115.2
151	L	43.2	Very low	37.9	Very low	145 Å²	145	137.1 Å²	137.1	76%	0.759	75%	0.746	S	S	*	*				80.3	117.4	62.3	-72.7	-179.6	0	0	0	115.3
152	N	40.9	Very low	37.9	Very low	125 Å²	125	136 Å²	136	67%	0.668	75%	0.746	S	S	*	*				152.9	114.8	115.1	-77.3	-40.2	0	0	0	111.7
153	T	34	Very low	37.4	Very low	113 Å²	113	134 Å²	134	69%	0.693	75%	0.745	S	S	*	*				84.2	129.1	97.7	-35.9	0	0	0	0	109.7
154	E	35.7	Very low	37.3	Very low	175 Å²	175	137 Å²	137	82%	0.818	75%	0.747	S	S	*	*			cis	-174.1	119.1	49.2	-157	158.5	-177.5	0	0	107.2
155	A	39.7	Very low	37	Very low	93 Å²	93	136.3 Å²	136.3	77%	0.769	75%	0.748	S	S	*	*				98.2	140	111.7	0	0	0	0	0	116.1
156	P	39.1	Very low	36.7	Very low	111 Å²	111	135.1 Å²	135.1	72%	0.721	75%	0.746	S	S	*	*			trans	-117.9	168.4	-153.5	36.7	-19	0	0	0	113.5
157	N	37.3	Very low	36.4	Very low	151 Å²	151	131 Å²	131	81%	0.807	74%	0.741	S	S	*	*			trans	166.5	140.2	157	-90.4	-3.1	0	0	0	106.1
158	E	32.8	Very low	36.1	Very low	151 Å²	151	134.5 Å²	134.5	71%	0.706	75%	0.753	S	S	*	*			cis	-176.2	158	-2.4	-146.1	-170.1	152.2	0	0	103
159	I	35.3	Very low	35.8	Very low	123 Å²	123	138.3 Å²	138.3	63%	0.631	76%	0.758	S	S	*	*			trans	83.5	111.9	151.2	-57.3	158	0	0	0	119.3
160	N	36.7	Very low	35.4	Very low	127 Å²	127	138.6 Å²	138.6	68%	0.679	76%	0.76	S	S	*	*			trans	86.3	119	138.3	-73.5	-8.3	0	0	0	124.6
161	H	31.7	Very low	35.2	Very low	163 Å²	163	140.1 Å²	140.1	76%	0.755	77%	0.765	S	S	*	*			trans	69	136	132.3	-62.7	-59.7	0	0	0	121.9
162	D	37.8	Very low	34.7	Very low	143 Å²	143	140.7 Å²	140.7	77%	0.765	77%	0.768	S	S	*	*			trans	87.1	96.8	158.4	-72.8	-43.1	0	0	0	121.1
163	T	30.4	Very low	34.2	Very low	130 Å²	130	143.2 Å²	143.2	80%	0.798	78%	0.776	S	S	*	*				36.8	94.8	121	-44.2	0	0	0	0	116.8
164	K	40.4	Very low	33.8	Very low	199 Å²	199	144.3 Å²	144.3	87%	0.865	78%	0.778	S	S	*	*			trans	-148.5	114	154.1	-161.4	171	-177.5	177.2	0	110.6
165	N	31.4	Very low	33.6	Very low	149 Å²	149	141.1 Å²	141.1	80%	0.797	78%	0.775	S	S	*	*			trans	-45.7	136.2	164.8	-66.1	-30.9	0	0	0	110.4
166	V	33.3	Very low	33.1	Very low	131 Å²	131	142.2 Å²	142.2	79%	0.794	77%	0.772	S	S	*	*			trans	-177.9	125.9	139.9	158.5	0	0	0	0	110.3
167	S	33.1	Very low	32.5	Very low	102 Å²	102	143.2 Å²	143.2	71%	0.713	77%	0.77	S	S	*	*			trans	55.2	118.9	154.4	65.8	0	0	0	0	121.6
168	N	29.9	Very low	32	Very low	171 Å²	171	142 Å²	142	91%	0.914	77%	0.767	S	S	*	*			trans	-67.4	124.3	165.3	-54.1	-22.9	0	0	0	110.9
169	E	32.2	Very low	31.8	Very low	188 Å²	188	141.4 Å²	141.4	88%	0.879	77%	0.768	S	S	*	*			trans	-136.9	118.9	160.3	-159.3	168.3	-168	0	0	107.7
170	S	29.8	Very low	31.5	Very low	107 Å²	107	140.8 Å²	140.8	75%	0.748	77%	0.772	S	S	*	*			trans	-66.3	139.6	-177.4	48.5	0	0	0	0	112
171	N	34.3	Very low	31	Very low	146 Å²	146	142 Å²	142	78%	0.781	78%	0.779	S	S	*	*			trans	-159.7	135.1	145.1	-118.5	-13.1	0	0	0	112.4	Q173	N171-Q173 PolarHBondContact O-N 2.94Å
172	D	32.4	Very low	31.2	Very low	156 Å²	156	140.9 Å²	140.9	83%	0.834	78%	0.777	S	S	*	*			trans	-53.4	116.8	-176.6	-55.4	-59.9	0	0	0	112.4
173	Q	30	Very low	30.9	Very low	179 Å²	179	141.3 Å²	141.3	84%	0.836	78%	0.78	S	S	*	*			trans	-122.4	113.5	166	-75	-80.7	-8.1	0	0	106.4	N171 S175	N171-Q173 PolarHBondContact O-N 2.94Å; Q173-S175 PolarHBondContact O-N 3.45Å; Q173-S175 VanDerWaalsContact O-N 3.11Å
174	N	27.3	Very low	31.1	Very low	135 Å²	135	142.2 Å²	142.2	72%	0.722	77%	0.77	S	S	*	*			trans	-34.5	118.4	165.9	-90.6	22.2	0	0	0	109.9	V176	N174-V176 HydrophobicContact CB-CG2 4.45Å; N174-V176 PolarHBondContact O-N 3.06Å
175	S	31.2	Very low	30.8	Very low	108 Å²	108	142.6 Å²	142.6	76%	0.755	77%	0.772	S	S	*	*			trans	-69.6	82.2	168.2	43.5	0	0	0	0	108.7	Q173 I177	Q173-S175 PolarHBondContact O-N 3.45Å; Q173-S175 VanDerWaalsContact O-N 3.11Å; S175-I177 VanDerWaalsContact C-N 3.34Å; S175-I177 PolarHBondContact O-N 3.4Å
176	V	28	Very low	30.8	Very low	116 Å²	116	141.7 Å²	141.7	70%	0.703	77%	0.767	S	S	*	*			trans	-67.5	98.8	163.4	-178.6	0	0	0	0	106.4	N174 V178	N174-V176 HydrophobicContact CB-CG2 4.45Å; N174-V176 PolarHBondContact O-N 3.06Å; V176-V178 HydrophobicContact CG1-CG2 3.77Å; V176-V178 PolarHBondContact O-N 3.33Å; V176-V178 VanDerWaalsContact O-N 3.07Å
177	I	27.1	Very low	30.7	Very low	133 Å²	133	141.4 Å²	141.4	68%	0.682	76%	0.761	S	S	*	*			trans	-75.3	94.8	172.7	-61.1	171.9	0	0	0	106.8	S175 L179	S175-I177 VanDerWaalsContact C-N 3.34Å; S175-I177 PolarHBondContact O-N 3.4Å; I177-L179 HydrophobicContact CG2-CB 4.49Å; I177-L179 HydrophobicContact CG2-CD1 3.57Å; I177-L179 HydrophobicContact CG2-CG 3.64Å
178	V	25.8	Very low	30.6	Very low	125 Å²	125	141.9 Å²	141.9	76%	0.758	77%	0.765	S	S	*	*			trans	-88	113.4	164.4	-175.9	0	0	0	0	106.7	V176	V176-V178 HydrophobicContact CG1-CG2 3.77Å; V176-V178 PolarHBondContact O-N 3.33Å; V176-V178 VanDerWaalsContact O-N 3.07Å
179	L	29.1	Very low	31.1	Very low	138 Å²	138	143.3 Å²	143.3	72%	0.723	76%	0.759	S	S	*	*			trans	-126.4	151.1	175.6	-77.8	177.6	0	0	0	109.5	I177	I177-L179 HydrophobicContact CG2-CB 4.49Å; I177-L179 HydrophobicContact CG2-CD1 3.57Å; I177-L179 HydrophobicContact CG2-CG 3.64Å
180	P	30.2	Very low	30.8	Very low	110 Å²	110	140.3 Å²	140.3	71%	0.714	75%	0.752	S	S	*	*			trans	-72	150.7	-148.3	29.3	-34.6	0	0	0	113.2	L182	P180-L182 PolarHBondContact O-N 3.28Å; P180-L182 VanDerWaalsContact O-N 3.11Å
181	D	26.2	Very low	30.7	Very low	154 Å²	154	140.1 Å²	140.1	82%	0.824	75%	0.751	S	S	*	*			trans	-43.2	113.5	173.3	-65.2	-36.5	0	0	0	110.4	D183	D181-D183 VanDerWaalsContact C-N 3.32Å; D181-D183 PolarHBondContact O-N 2.87Å
182	L	34.4	Very low	30.4	Very low	138 Å²	138	137.9 Å²	137.9	72%	0.723	74%	0.743	S	S	*	*			trans	-93.8	70	178.5	-152.4	93.2	0	0	0	109.3	P180 Y184	P180-L182 PolarHBondContact O-N 3.28Å; P180-L182 VanDerWaalsContact O-N 3.11Å; L182-Y184 PolarHBondContact O-N 3.25Å
183	D	33.4	Very low	30.1	Very low	153 Å²	153	138 Å²	138	82%	0.818	74%	0.738	S	S	*	*			trans	-73.7	73.9	162.7	-62.7	-16.1	0	0	0	108.2	D181	D181-D183 VanDerWaalsContact C-N 3.32Å; D181-D183 PolarHBondContact O-N 2.87Å
184	Y	33.6	Very low	30.1	Very low	148 Å²	148	137.8 Å²	137.8	58%	0.58	74%	0.735	S	S	*	*			trans	-152	72	172.4	-154.1	-92.4	0	0	0	111.9	L182 D187	L182-Y184 PolarHBondContact O-N 3.25Å; Y184-D187 WeakPolarHBondContact CE1-OD2 3.44Å; Y184-D187 PolarHBondContact OH-OD2 3.2Å
185	F	34.3	Very low	30.1	Very low	207 Å²	207	135.6 Å²	135.6	91%	0.908	73%	0.73	S	S	*	*			trans	-119	69.4	151.1	-70.5	-73.7	0	0	0	107.9
186	D	31.1	Very low	30.1	Very low	130 Å²	130	140.4 Å²	140.4	70%	0.695	73%	0.733	S	S	*	*			trans	-128.8	86	162.7	-169.1	17.2	0	0	0	107.4
187	D	31.5	Very low	30.3	Very low	125 Å²	125	144.1 Å²	144.1	67%	0.668	74%	0.74	S	S	*	*	S	Bend	trans	-152	89.4	164.3	-89.3	-36.6	0	0	0	109.5	Y184	Y184-D187 WeakPolarHBondContact CE1-OD2 3.44Å; Y184-D187 PolarHBondContact OH-OD2 3.2Å
188	S	31.1	Very low	30.5	Very low	113 Å²	113	144.5 Å²	144.5	79%	0.79	74%	0.743	S	S	*	*			trans	68	61.6	156.2	76.3	0	0	0	0	119
189	Y	39.9	Very low	30.8	Very low	201 Å²	201	147.1 Å²	147.1	79%	0.788	75%	0.747	S	S	*	*			trans	-87.3	115.2	153.7	-116	-94.5	0	0	0	109.6	S191	Y189-S191 VanDerWaalsContact C-N 3.29Å; Y189-S191 PolarHBondContact O-N 3.18Å
190	V	27.1	Very low	31.1	Very low	124 Å²	124	151 Å²	151	75%	0.752	75%	0.753	S	S	*	*			trans	-64.7	99.6	156.2	170.6	0	0	0	0	106	V192	V190-V192 HydrophobicContact CG1-CG2 4.44Å; V190-V192 PolarHBondContact O-N 3.09Å
191	S	27.1	Very low	31.3	Very low	103 Å²	103	155.1 Å²	155.1	72%	0.72	76%	0.759	S	S	*	*			trans	-58.9	103.8	165.4	-60.9	0	0	0	0	107.8	Y189 E193	Y189-S191 VanDerWaalsContact C-N 3.29Å; Y189-S191 PolarHBondContact O-N 3.18Å; S191-E193 PolarHBondContact O-N 2.91Å
192	V	26.7	Very low	31.7	Very low	99 Å²	99	156.7 Å²	156.7	60%	0.6	76%	0.763	S	S	*	*			trans	-75.1	87.9	160.6	-177.8	0	0	0	0	105.7	V190 F194	V190-V192 HydrophobicContact CG1-CG2 4.44Å; V190-V192 PolarHBondContact O-N 3.09Å; V192-F194 HydrophobicContact CB-CE2 4.27Å; V192-F194 HydrophobicContact CG1-CD2 3.87Å; V192-F194 HydrophobicContact CG1-CE1 4.11Å; V192-F194 HydrophobicContact CG1-CE2 3.32Å; V192-F194 HydrophobicContact CG1-CG 4.47Å; V192-F194 HydrophobicContact CG1-CZ 3.46Å; V192-F194 VanDerWaalsContact CG1-CZ 3.46Å; V192-F194 PolarHBondContact O-N 3.29Å; V192-F194 VanDerWaalsContact O-N 3.14Å
193	E	27.9	Very low	31.7	Very low	159 Å²	159	154.7 Å²	154.7	74%	0.743	76%	0.761	S	S	*	*			trans	-67.7	104.2	173.4	-170.5	-176.2	164.7	0	0	108.7	S191 S195	S191-E193 PolarHBondContact O-N 2.91Å; E193-S195 PolarHBondContact OE1-OG 2.81Å
194	F	28.2	Very low	31.9	Very low	175 Å²	175	154.5 Å²	154.5	77%	0.768	76%	0.76	S	S	*	*			trans	-92.5	92.2	163.2	-68.8	-70.2	0	0	0	108.3	V192 Y196	V192-F194 HydrophobicContact CB-CE2 4.27Å; V192-F194 HydrophobicContact CG1-CD2 3.87Å; V192-F194 HydrophobicContact CG1-CE1 4.11Å; V192-F194 HydrophobicContact CG1-CE2 3.32Å; V192-F194 HydrophobicContact CG1-CG 4.47Å; V192-F194 HydrophobicContact CG1-CZ 3.46Å; V192-F194 VanDerWaalsContact CG1-CZ 3.46Å; V192-F194 PolarHBondContact O-N 3.29Å; V192-F194 VanDerWaalsContact O-N 3.14Å; F194-Y196 PolarHBondContact O-N 2.91Å; F194-Y196 VanDerWaalsContact O-N 3.09Å
195	S	28.6	Very low	31.8	Very low	89 Å²	89	153.6 Å²	153.6	62%	0.622	77%	0.77	S	S	*	*			trans	-68.6	104.2	172.1	-36.3	0	0	0	0	109.5	E193 K197	E193-S195 PolarHBondContact OE1-OG 2.81Å; S195-K197 PolarHBondContact O-N 2.86Å
196	Y	31.4	Very low	32	Very low	208 Å²	208	152 Å²	152	82%	0.816	77%	0.77	S	S	*	*			trans	-79.6	100.8	172.9	-130.7	-90.6	0	0	0	109.3	F194 N198	F194-Y196 PolarHBondContact O-N 2.91Å; F194-Y196 VanDerWaalsContact O-N 3.09Å; Y196-N198 PolarHBondContact O-N 3.11Å; Y196-N198 VanDerWaalsContact O-N 3.14Å
197	K	31.6	Very low	32.2	Very low	194 Å²	194	151.4 Å²	151.4	84%	0.843	77%	0.766	S	S	*	*			trans	-67.5	108	166	-80.9	-154.3	173.5	-169.9	0	109.4	S195	S195-K197 PolarHBondContact O-N 2.86Å
198	N	31.5	Very low	32.7	Very low	141 Å²	141	151 Å²	151	75%	0.754	76%	0.764	S	S	*	*			trans	-90.6	93.8	166.1	174.4	18.4	0	0	0	109.1	Y196	Y196-N198 PolarHBondContact O-N 3.11Å; Y196-N198 VanDerWaalsContact O-N 3.14Å
199	E	31.6	Very low	33.1	Very low	181 Å²	181	151.6 Å²	151.6	85%	0.846	76%	0.759	S	S	*	*			trans	-108.8	110.2	164.8	-165.5	173.1	-178.6	0	0	109.1	K201	E199-K201 PolarHBondContact O-N 2.7Å
200	R	34.8	Very low	32.9	Very low	220 Å²	220	150.5 Å²	150.5	83%	0.83	76%	0.761	S	S	*	*			trans	-81	107.1	179.5	179.5	-175.9	-73	-167.8	-2.3	109.9
201	K	35.9	Very low	33.3	Very low	196 Å²	196	151.6 Å²	151.6	85%	0.852	76%	0.758	S	S	*	*			trans	25.6	112.3	148.6	-72.3	-175.6	173.7	-177.3	0	118.4	E199	E199-K201 PolarHBondContact O-N 2.7Å
202	M	35	Very low	33.9	Very low	186 Å²	186	152.3 Å²	152.3	92%	0.916	76%	0.763	S	S	*	*				-132.4	114.5	129.6	-160	78.7	173.1	0	0	107
203	S	32.6	Very low	34.3	Very low	96 Å²	96	152.8 Å²	152.8	67%	0.671	76%	0.762	S	S	*	*			trans	-66.1	136.3	172.8	39.4	0	0	0	0	110.6
204	D	39.1	Very low	34.7	Very low	150 Å²	150	152 Å²	152	80%	0.802	77%	0.768	S	S	*	*			trans	-167	119.8	138.3	-87.7	-29.1	0	0	0	110.5
205	V	30.3	Very low	35	Very low	128 Å²	128	149.2 Å²	149.2	78%	0.776	77%	0.765	S	S	*	*			trans	29.3	114.8	151.5	-175.1	0	0	0	0	117.7
206	L	38.5	Very low	35.2	Very low	174 Å²	174	152.1 Å²	152.1	91%	0.911	77%	0.773	S	S	*	*				-165.9	124.9	121.5	-98.8	164.3	0	0	0	111
207	N	36.3	Very low	35.4	Very low	117 Å²	117	150 Å²	150	63%	0.626	78%	0.775	S	S	*	*			trans	-85.8	136.5	174.8	167.4	47.9	0	0	0	109.1
208	D	41.1	Very low	35.5	Very low	116 Å²	116	146.8 Å²	146.8	62%	0.62	77%	0.766	S	S	*	*				159.5	110.5	128.6	-85.9	-38.4	0	0	0	110.8
209	N	40.5	Very low	35.8	Very low	126 Å²	126	146.1 Å²	146.1	67%	0.674	77%	0.768	S	S	*	*				56.7	118.9	125.4	-38.4	-26.2	0	0	0	118.9
210	Q	35.9	Very low	36.1	Very low	179 Å²	179	144.4 Å²	144.4	84%	0.836	76%	0.764	S	S	*	*				139.6	98.3	112.3	-163.7	169.5	-0.6	0	0	113.2
211	E	35.8	Very low	36.4	Very low	147 Å²	147	142.4 Å²	142.4	69%	0.687	76%	0.758	S	S	*	*			trans	18.8	117.3	131.5	-161.4	178.5	167.5	0	0	118	N213	E211-N213 VanDerWaalsContact CG-OD1 3.26Å; E211-N213 WeakPolarHBondContact CG-OD1 3.48Å; E211-N213 PolarHBondContact OE1-ND2 2.71Å
212	S	38.7	Very low	37.1	Very low	118 Å²	118	138.1 Å²	138.1	83%	0.825	75%	0.75	S	S	*	*			trans	-140.3	122.6	146.8	43.8	0	0	0	0	110.5
213	N	34.8	Very low	37.3	Very low	109 Å²	109	135.2 Å²	135.2	58%	0.583	74%	0.739	S	S	*	*			trans	-95.8	133.5	-173.9	-48.2	-38.3	0	0	0	108.5	E211	E211-N213 VanDerWaalsContact CG-OD1 3.26Å; E211-N213 WeakPolarHBondContact CG-OD1 3.48Å; E211-N213 PolarHBondContact OE1-ND2 2.71Å
214	T	36.1	Very low	37.5	Very low	142 Å²	142	138.4 Å²	138.4	87%	0.871	75%	0.748	S	S	*	*			trans	-139.1	81.9	163.6	58	0	0	0	0	111.4
215	T	35.1	Very low	37.3	Very low	116 Å²	116	136 Å²	136	71%	0.712	74%	0.743	S	S	*	*			trans	-1.2	124.7	137.6	-46.5	0	0	0	0	119.6
216	L	33.5	Very low	37.6	Very low	151 Å²	151	138.4 Å²	138.4	79%	0.791	75%	0.75	S	S	*	*			trans	48.7	134	136.5	-52.7	169.4	0	0	0	120.8
217	I	34.1	Very low	37.3	Very low	164 Å²	164	134.9 Å²	134.9	84%	0.841	74%	0.741	S	S	*	*				-154.6	133	100.3	-65.2	-154.1	0	0	0	109.8
218	D	33.3	Very low	37	Very low	125 Å²	125	134.7 Å²	134.7	67%	0.668	74%	0.744	S	S	*	*			trans	-85.7	140.4	174.5	168.8	30.4	0	0	0	111.1
219	T	38.2	Very low	36.6	Very low	127 Å²	127	136 Å²	136	78%	0.779	75%	0.751	S	S	*	*			trans	-151.4	94.3	160.7	56.7	0	0	0	0	111.4
220	D	39.1	Very low	36.3	Very low	146 Å²	146	138.5 Å²	138.5	78%	0.781	76%	0.758	S	S	*	*			trans	33.9	119.7	133	-62.3	-35.5	0	0	0	121.5
221	Y	39.8	Very low	36.1	Very low	178 Å²	178	136.3 Å²	136.3	70%	0.698	76%	0.757	S	S	*	*			trans	-92.5	144.7	166	-177.3	-85.3	0	0	0	110.6	N223	Y221-N223 HydrophobicContact CD1-CB 4.16Å; Y221-N223 VanDerWaalsContact CE1-CA 3.43Å; Y221-N223 HydrophobicContact CE1-CB 3.83Å; Y221-N223 VanDerWaalsContact CE1-N 3.29Å; Y221-N223 WeakPolarHBondContact CE1-OD1 3.36Å
222	P	50.8	Low	36.1	Very low	106 Å²	106	134.7 Å²	134.7	69%	0.688	76%	0.759	S	S	*	*			trans	-102.5	114.6	158.3	32.1	-22	0	0	0	111.3	D224	P222-D224 PolarHBondContact O-N 3.36Å
223	N	38.7	Very low	35.7	Very low	125 Å²	125	138.5 Å²	138.5	67%	0.668	76%	0.755	S	S	*	*			trans	-77.7	104.4	163.5	-89.2	-57.9	0	0	0	108.1	Y221 S225	Y221-N223 HydrophobicContact CD1-CB 4.16Å; Y221-N223 VanDerWaalsContact CE1-CA 3.43Å; Y221-N223 HydrophobicContact CE1-CB 3.83Å; Y221-N223 VanDerWaalsContact CE1-N 3.29Å; Y221-N223 WeakPolarHBondContact CE1-OD1 3.36Å; N223-S225 PolarHBondContact O-N 2.87Å; N223-S225 VanDerWaalsContact O-N 3.13Å
224	D	37.4	Very low	35.5	Very low	162 Å²	162	141.1 Å²	141.1	87%	0.866	76%	0.762	S	S	*	*			trans	-78.8	90.6	163.9	-81.9	-18.8	0	0	0	109.5	P222	P222-D224 PolarHBondContact O-N 3.36Å
225	S	36.2	Very low	35.3	Very low	100 Å²	100	144.6 Å²	144.6	70%	0.699	77%	0.765	S	S	*	*			trans	-85.5	123.3	155.4	-61	0	0	0	0	108.5	N223	N223-S225 PolarHBondContact O-N 2.87Å; N223-S225 VanDerWaalsContact O-N 3.13Å
226	L	35.2	Very low	35	Very low	178 Å²	178	147.9 Å²	147.9	93%	0.932	77%	0.77	S	S	*	*			trans	159.9	127.8	158.6	-87.7	155.6	0	0	0	105.7
227	S	33.6	Very low	35	Very low	101 Å²	101	149.4 Å²	149.4	71%	0.706	77%	0.773	S	S	*	*			cis	-164.4	142.5	42.3	169.4	0	0	0	0	109.3
228	T	29.5	Very low	34.9	Very low	113 Å²	113	147.1 Å²	147.1	69%	0.693	77%	0.766	S	S	*	*			trans	-63	176.6	168.9	47.3	0	0	0	0	113
229	N	32	Very low	34.6	Very low	143 Å²	143	149.2 Å²	149.2	77%	0.765	78%	0.776	S	S	*	*			trans	91.4	125.1	168.9	-24.5	-27	0	0	0	111.8
230	E	34.7	Very low	34.3	Very low	178 Å²	178	147.4 Å²	147.4	83%	0.832	77%	0.769	S	S	*	*			cis	-171.6	137.3	24.6	-178.7	175	171.5	0	0	107.4
231	V	31.3	Very low	34.1	Very low	134 Å²	134	148.2 Å²	148.2	81%	0.812	77%	0.767	S	S	*	*			trans	-93.3	134.3	172.7	172.8	0	0	0	0	109.5
232	P	35.5	Very low	33.5	Very low	113 Å²	113	147.4 Å²	147.4	73%	0.734	77%	0.77	S	S	*	*			trans	-126.3	102.1	147.6	32.1	-17.1	0	0	0	109.7
233	R	30.6	Very low	33	Very low	197 Å²	197	148 Å²	148	74%	0.743	78%	0.776	S	S	*	*				51.6	100.5	93.5	-166.8	-178.1	-139	-161.7	4.9	115.1
234	K	31.5	Very low	32.7	Very low	165 Å²	165	149.1 Å²	149.1	72%	0.717	78%	0.783	S	S	*	*			trans	67.8	106.8	143.3	-59.4	179.1	-176.6	-166.3	0	118.2
235	F	31.2	Very low	32.9	Very low	215 Å²	215	148.5 Å²	148.5	94%	0.943	79%	0.785	S	S	*	*			trans	-98.4	115.4	142.5	-77.6	-82.3	0	0	0	109.3
236	K	28.9	Very low	32.8	Very low	185 Å²	185	147 Å²	147	80%	0.804	79%	0.785	S	S	*	*			trans	-114.4	102.5	163.8	177	169.5	-177.1	173.6	0	104.2
237	E	34.1	Very low	32.7	Very low	183 Å²	183	146.1 Å²	146.1	86%	0.855	78%	0.781	S	S	*	*			trans	-104	123.8	172	-165.7	162.8	-169.8	0	0	109.1
238	T	32.6	Very low	32.9	Very low	115 Å²	115	149.7 Å²	149.7	71%	0.706	79%	0.791	S	S	*	*			trans	-89.3	149.3	-176.2	32.6	0	0	0	0	111
239	I	26.7	Very low	33.1	Very low	169 Å²	169	152.4 Å²	152.4	87%	0.867	80%	0.796	S	S	*	*			trans	-55.4	163.3	174	-57.5	154	0	0	0	112.9
240	S	31.3	Very low	33.1	Very low	90 Å²	90	150 Å²	150	63%	0.629	79%	0.79	S	S	*	*			trans	109.8	140	161.7	-106	0	0	0	0	114.2
241	E	34.1	Very low	32.9	Very low	162 Å²	162	148.4 Å²	148.4	76%	0.757	79%	0.788	S	S	*	*			cis	-167	142.2	3.5	-137	157.4	153.8	0	0	106.6
242	E	28.8	Very low	32.9	Very low	162 Å²	162	149 Å²	149	76%	0.757	79%	0.791	S	S	*	*			trans	33.4	116.9	141	-162	162.8	-165.2	0	0	120.7
243	S	38.7	Very low	32.8	Very low	117 Å²	117	150 Å²	150	82%	0.818	80%	0.795	S	S	*	*			trans	-146.2	102.7	139.4	56.1	0	0	0	0	111.4
244	N	33	Very low	32.9	Very low	149 Å²	149	146.8 Å²	146.8	80%	0.797	79%	0.793	S	S	*	*			trans	-100.9	103.6	162.1	-80.7	-28.9	0	0	0	108.1
245	V	40.9	Very low	33	Very low	150 Å²	150	143.7 Å²	143.7	91%	0.909	79%	0.789	S	S	*	*			trans	-157	126.4	162.7	-169.4	0	0	0	0	104.9
246	G	34.7	Very low	33	Very low	69 Å²	69	141.5 Å²	141.5	71%	0.711	78%	0.782	S	S	*	*			cis	155.8	140.3	16.6	0	0	0	0	0	105
247	D	33.2	Very low	33.1	Very low	159 Å²	159	139.5 Å²	139.5	85%	0.85	78%	0.78	S	S	*	*			trans	-28.6	137.5	-178	-73.5	-47.6	0	0	0	117.5
248	L	38.1	Very low	33	Very low	175 Å²	175	138.8 Å²	138.8	92%	0.916	78%	0.781	S	S	*	*			trans	-158.7	127	134.5	-108.3	158.2	0	0	0	111.9
249	E	33.9	Very low	32.7	Very low	171 Å²	171	142.7 Å²	142.7	80%	0.799	79%	0.789	S	S	*	*			trans	-67.4	138.8	-170.8	-66.5	169.8	124.4	0	0	115.5
250	S	31.4	Very low	32.7	Very low	91 Å²	91	139.9 Å²	139.9	64%	0.636	78%	0.784	S	S	*	*				63.7	125.3	125.8	101.9	0	0	0	0	122.8
251	N	30	Very low	32.5	Very low	146 Å²	146	141 Å²	141	78%	0.781	79%	0.792	S	S	*	*			trans	70.9	114.3	132.1	-55.9	-20.3	0	0	0	120
252	V	32.3	Very low	32	Very low	145 Å²	145	141.6 Å²	141.6	88%	0.879	80%	0.8	S	S	*	*				-161	113.5	112.1	171	0	0	0	0	107.3
253	V	33.1	Very low	32	Very low	134 Å²	134	136.6 Å²	136.6	81%	0.812	79%	0.792	S	S	*	*			trans	-105.7	124.5	172.8	170	0	0	0	0	108
254	D	32.7	Very low	31.3	Very low	131 Å²	131	140 Å²	140	70%	0.701	79%	0.792	S	S	*	*			trans	-87	121.2	170.7	-177	13.9	0	0	0	109.3	H256	D254-H256 PolarHBondContact O-N 3.31Å
255	P	33.7	Very low	31.1	Very low	100 Å²	100	138.9 Å²	138.9	65%	0.649	79%	0.793	S	S	*	*			trans	-100.6	60.9	-169.9	39	-32.9	0	0	0	111.8
256	H	31.5	Very low	30.6	Very low	169 Å²	169	137 Å²	137	78%	0.782	78%	0.782	S	S	*	*			trans	-139.9	12	176.1	-79.6	-53.3	0	0	0	117	D254	D254-H256 PolarHBondContact O-N 3.31Å
257	D	30.4	Very low	30.3	Very low	143 Å²	143	142.1 Å²	142.1	77%	0.765	78%	0.784	S	S	*	*			trans	-138.8	108.5	175.4	-146.9	5.3	0	0	0	110.4
258	L	30.9	Very low	30.4	Very low	167 Å²	167	137.4 Å²	137.4	87%	0.874	76%	0.763	S	S	*	*			trans	166.4	95.2	139.2	-85	164	0	0	0	109.7
259	F	28.2	Very low	30.1	Very low	198 Å²	198	135.3 Å²	135.3	87%	0.868	75%	0.753	S	S	*	*			trans	-41	127.6	158.9	-95.2	-111.9	0	0	0	113.2
260	S	25.4	Very low	30.1	Very low	110 Å²	110	135.6 Å²	135.6	77%	0.769	75%	0.751	S	S	*	*			trans	48.2	96.6	131.7	-174.6	0	0	0	0	119.1
261	S	26.6	Very low	30.3	Very low	113 Å²	113	139.7 Å²	139.7	79%	0.79	76%	0.76	S	S	*	*				-153.7	116.6	127.2	114.7	0	0	0	0	109	G263	S261-G263 PolarHBondContact O-N 3.01Å
262	N	23.6	Very low	30.6	Very low	174 Å²	174	135 Å²	135	93%	0.93	73%	0.734	S	S	*	*			trans	-80.1	99.9	179.4	-155.3	31.8	0	0	0	107.9
263	G	28.8	Very low	31	Very low	57 Å²	57	131 Å²	131	59%	0.588	72%	0.717	S	S	*	*			trans	-164	106.2	-179.5	0	0	0	0	0	110.8	S261	S261-G263 PolarHBondContact O-N 3.01Å
264	F	24.8	Very low	31.6	Very low	190 Å²	190	127 Å²	127	83%	0.833	69%	0.691	S	S	*	*			trans	-52.7	131	-179.6	-68.9	-94.2	0	0	0	111.6	V266	F264-V266 PolarHBondContact O-N 2.73Å
265	P	29.3	Very low	32.2	Very low	124 Å²	124	125.4 Å²	125.4	81%	0.805	68%	0.681	S	S	*	*			trans	-72.7	98.1	169.3	29.6	-30.3	0	0	0	108.1	K267	P265-K267 PolarHBondContact O-N 3.12Å
266	V	28.8	Very low	33	Very low	111 Å²	111	123 Å²	123	67%	0.673	66%	0.664	S	S	*	*			trans	-66.3	103.7	164.9	175.6	0	0	0	0	106.3	F264 C268	F264-V266 PolarHBondContact O-N 2.73Å; V266-C268 PolarHBondContact O-N 3.23Å
267	K	29	Very low	33.8	Very low	177 Å²	177	116.8 Å²	116.8	77%	0.77	64%	0.639	S	S	*	*			trans	-66.2	99.7	172.2	-160.6	177.6	-174.3	-179	0	106.7	P265 D269	P265-K267 PolarHBondContact O-N 3.12Å; K267-D269 VanDerWaalsContact C-N 3.27Å; K267-D269 PolarHBondContact O-N 2.83Å
268	C	36	Very low	34.9	Very low	60 Å²	60	114 Å²	114	41%	0.405	62%	0.617	S	S	.	*			trans	-69.1	90.5	174	-62.4	0	0	0	0	108.3	C39 V266 K270	C39-C268 WeakPolarHBondContact CA-SG 3.41Å; C39-C268 WeakPolarHBondContact CB-SG 3.42Å; C39-C268 VanDerWaalsContact SG-SG 3.6Å; V266-C268 PolarHBondContact O-N 3.23Å; C268-K270 VanDerWaalsContact C-N 3.33Å; C268-K270 PolarHBondContact O-N 2.87Å
269	D	30.7	Very low	35.7	Very low	131 Å²	131	109 Å²	109	70%	0.701	59%	0.591	S	S	*	*			trans	-63.8	99.2	171.6	-86.6	-25.5	0	0	0	108.9	K267	K267-D269 VanDerWaalsContact C-N 3.27Å; K267-D269 PolarHBondContact O-N 2.83Å
270	K	34.2	Very low	36.6	Very low	176 Å²	176	105.5 Å²	105.5	77%	0.765	57%	0.573	S	S	*	*	S	Bend	trans	39.6	106.7	145.9	-68.4	174.3	179.9	173.9	0	115.9	C268	C268-K270 VanDerWaalsContact C-N 3.33Å; C268-K270 PolarHBondContact O-N 2.87Å
271	H	36.7	Very low	37.6	Very low	177 Å²	177	104.3 Å²	104.3	82%	0.819	56%	0.556	S	S	*	*			trans	79.1	87.8	164.9	-47.2	-69.6	0	0	0	115.7	A273	H271-A273 PolarHBondContact O-N 3.25Å
272	I	36.6	Very low	38.5	Very low	47 Å²	47	104.4 Å²	104.4	24%	0.241	55%	0.547	C	S	.	.			trans	-73.4	107	164.5	-55.3	-176.5	0	0	0	107.8	C39 F40 L274 Q305	C39-I272 HydrophobicContact CB-CD1 4.02Å; F40-I272 HydrophobicContact CE1-CD1 3.92Å; F40-I272 HydrophobicContact CE2-CD1 4.11Å; F40-I272 HydrophobicContact CZ-CD1 3.67Å; F40-I272 HydrophobicContact CZ-CG2 4.28Å; I272-L274 HydrophobicContact CG2-CD1 3.8Å; I272-Q305 HydrophobicContact CG2-CB 4.49Å; I272-Q305 HydrophobicContact CG2-CG 3.99Å
273	A	39.5	Very low	39.8	Very low	63 Å²	63	98.5 Å²	98.5	52%	0.521	52%	0.519	S	S	.	.			trans	-85.2	113	169.8	0	0	0	0	0	109	H271 S304 Q305	H271-A273 PolarHBondContact O-N 3.25Å; A273-S304 VanDerWaalsContact O-O 3.04Å; A273-Q305 WeakPolarHBondContact O-CA 3.43Å
274	L	45.3	Very low	40.7	Very low	50 Å²	50	99.7 Å²	99.7	26%	0.262	51%	0.514	S	S	.	.			trans	-89.8	128.3	169.4	-80.6	95.8	0	0	0	110.1	L49 I272 I303	L49-L274 HydrophobicContact CD1-CD1 4.28Å; L49-L274 HydrophobicContact CD2-CD1 3.7Å; I272-L274 HydrophobicContact CG2-CD1 3.8Å; L274-I303 HydrophobicContact CD2-CG2 3.55Å; L274-I303 HydrophobicContact CG-CG2 4.08Å
275	I	46.7	Very low	41.6	Very low	96 Å²	96	96.5 Å²	96.5	49%	0.492	51%	0.51	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.7	123.6	168.3	-61.1	169.4	0	0	0	107.5	T277 I303 S304	I275-T277 HydrophobicContact CG2-CG2 4.01Å; I275-I303 WeakPolarHBondContact O-CA 3.09Å; I275-S304 PolarHBondContact N-O 3.43Å; I275-S304 PolarHBondContact O-N 3.35Å
276	V	50.1	Low	42.2	Very low	49 Å²	49	96.6 Å²	96.6	30%	0.297	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.9	113.7	176.9	-178.6	0	0	0	0	108.1	L53 L301 R302 I303	L53-V276 HydrophobicContact CD1-CG2 4.12Å; V276-L301 HydrophobicContact CG1-CD1 3.21Å; V276-L301 HydrophobicContact CG1-CD2 4.21Å; V276-L301 HydrophobicContact CG1-CG 3.94Å; V276-R302 WeakPolarHBondContact CA-O 3.46Å; V276-I303 HydrophobicContact CG2-CG1 4.33Å
277	T	48.7	Very low	43.1	Very low	40 Å²	40	103 Å²	103	25%	0.245	51%	0.51	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.7	132.6	176.8	51.5	0	0	0	0	112	I275 L301 R302	I275-T277 HydrophobicContact CG2-CG2 4.01Å; T277-L301 CarbonylContact O-C 3.46Å; T277-L301 VanDerWaalsContact O-CA 3.23Å; T277-L301 WeakPolarHBondContact O-CA 3.47Å; T277-R302 PolarHBondContact N-O 3.03Å; T277-R302 PolarHBondContact O-N 3.41Å; T277-R302 WeakPolarHBondContact OG1-CB 3.24Å
278	W	51.8	Low	43.7	Very low	83 Å²	83	96.7 Å²	96.7	31%	0.314	50%	0.495	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.6	120.2	169.9	-62.6	93.8	0	0	0	109.1	F19 Q23 Y299 Q300 L301 Y316	F19-W278 HydrophobicContact CE2-CH2 4.43Å; F19-W278 HydrophobicContact CE2-CZ3 4.15Å; F19-W278 HydrophobicContact CZ-CH2 4.5Å; F19-W278 HydrophobicContact CZ-CZ3 4.47Å; Q23-W278 HydrophobicContact CG-CH2 3.95Å; Q23-W278 HydrophobicContact CG-CZ2 4.07Å; W278-Y299 HydrophobicContact CE3-CG 4.45Å; W278-Q300 CarbonylContact C-O 3.5Å; W278-Q300 WeakPolarHBondContact CA-O 3.48Å; W278-L301 HydrophobicContact CD2-CD1 3.7Å; W278-L301 HydrophobicContact CE3-CD1 4.09Å; W278-L301 HydrophobicContact CG-CD1 4.12Å; W278-L301 HydrophobicContact CH2-CD1 4.3Å; W278-L301 HydrophobicContact CZ2-CD1 3.92Å; W278-L301 HydrophobicContact CZ3-CD1 4.38Å; W278-Y316 HydrophobicContact CH2-CE2 4.36Å; W278-Y316 HydrophobicContact CZ3-CD2 4.02Å; W278-Y316 AromaticContact CZ3-CE2 3.92Å; W278-Y316 HydrophobicContact CZ3-CE2 3.92Å
279	L	48.8	Very low	44.1	Very low	63 Å²	63	103.8 Å²	103.8	33%	0.33	52%	0.523	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.4	122.4	172.5	-61.4	170.6	0	0	0	108.6	Y299 Q300	L279-Y299 CarbonylContact O-C 3.55Å; L279-Y299 WeakPolarHBondContact O-CA 3.3Å; L279-Q300 HydrophobicContact CB-CB 4.18Å; L279-Q300 PolarHBondContact N-O 3.24Å; L279-Q300 PolarHBondContact O-N 3.23Å
280	Y	46	Very low	44.4	Very low	124 Å²	124	100.7 Å²	100.7	49%	0.486	52%	0.522	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.1	116.1	168.9	178.6	-101.6	0	0	0	108.6	D282 S297 Y299	Y280-D282 HydrophobicContact CE1-CB 4.39Å; Y280-D282 WeakPolarHBondContact CE1-OD1 3.21Å; Y280-S297 WeakPolarHBondContact CE2-OG 3.5Å; Y280-S297 PolarHBondContact OH-OG 3.32Å; Y280-S297 VanDerWaalsContact OH-OG 3.07Å; Y280-Y299 HydrophobicContact CD2-CD1 4.37Å; Y280-Y299 AromaticContact CD2-CE1 3.9Å; Y280-Y299 HydrophobicContact CD2-CE1 3.9Å; Y280-Y299 AromaticContact CD2-CZ 3.97Å
281	E	48.2	Very low	44.6	Very low	85 Å²	85	100.5 Å²	100.5	40%	0.397	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.2	111	171.4	-74.1	-173.7	-172.8	0	0	109.3	S297 G298 Q300	E281-S297 VanDerWaalsContact O-CA 3.31Å; E281-S297 WeakPolarHBondContact O-CA 3.47Å; E281-S297 PolarHBondContact O-OG 3.3Å; E281-S297 VanDerWaalsContact O-OG 3.09Å; E281-G298 PolarHBondContact N-O 3.21Å; E281-G298 PolarHBondContact O-N 2.98Å; E281-Q300 PolarHBondContact OE1-NE2 3.03Å
282	D	44.1	Very low	44.5	Very low	115 Å²	115	101 Å²	101	62%	0.615	52%	0.524	S	S	*	.			trans	-64.8	133.5	173.1	-104.9	-41.1	0	0	0	110.3	Y280 T284	Y280-D282 HydrophobicContact CE1-CB 4.39Å; Y280-D282 WeakPolarHBondContact CE1-OD1 3.21Å; D282-T284 PolarHBondContact O-N 3.27Å
283	P	50.6	Low	44.7	Very low	51 Å²	51	106.1 Å²	106.1	33%	0.331	55%	0.546	S	S	.	.			trans	-67.5	100.1	178.4	28	-29.8	0	0	0	108.4	V285 K295	P283-V285 PolarHBondContact O-N 3.49Å; P283-K295 WeakPolarHBondContact CA-O 3.13Å; P283-K295 WeakPolarHBondContact CB-O 3.22Å
284	T	48.6	Very low	44.6	Very low	81 Å²	81	111.3 Å²	111.3	50%	0.497	56%	0.56	S	S	.	*			trans	-73.7	103.6	177.5	-54.6	0	0	0	0	108.2	D282 F286	D282-T284 PolarHBondContact O-N 3.27Å; T284-F286 HydrophobicContact CG2-CD2 4.12Å; T284-F286 HydrophobicContact CG2-CE2 3.68Å; T284-F286 HydrophobicContact CG2-CZ 3.99Å; T284-F286 WeakPolarHBondContact O-CD2 3.33Å; T284-F286 PolarHBondContact O-N 3.01Å
285	V	44.1	Very low	44.5	Very low	124 Å²	124	114.5 Å²	114.5	75%	0.752	57%	0.572	S	S	*	*			trans	-68.6	98.3	174	-176.9	0	0	0	0	108.8	P283 R287	P283-V285 PolarHBondContact O-N 3.49Å; V285-R287 PolarHBondContact O-N 3.01Å
286	F	41.9	Very low	44.3	Very low	126 Å²	126	116.1 Å²	116.1	55%	0.553	58%	0.575	S	S	*	*			trans	-74.1	111.6	168.4	-75.6	-87.2	0	0	0	108.7	T284 G288 K295	T284-F286 HydrophobicContact CG2-CD2 4.12Å; T284-F286 HydrophobicContact CG2-CE2 3.68Å; T284-F286 HydrophobicContact CG2-CZ 3.99Å; T284-F286 WeakPolarHBondContact O-CD2 3.33Å; T284-F286 PolarHBondContact O-N 3.01Å; F286-G288 PolarHBondContact O-N 2.98Å; F286-K295 HydrophobicContact CD2-CD 4.27Å; F286-K295 HydrophobicContact CE2-CD 4.06Å
287	R	46.6	Very low	43.9	Very low	245 Å²	245	114.5 Å²	114.5	93%	0.925	57%	0.566	S	S	*	*			trans	-77.5	74.2	167	-176.2	-178.7	-72.1	-95.3	-2.4	108.2	V285	V285-R287 PolarHBondContact O-N 3.01Å
288	G	41.4	Very low	43.7	Very low	44 Å²	44	112.9 Å²	112.9	45%	0.454	56%	0.557	S	S	.	*			trans	-94.2	134.2	167.7	0	0	0	0	0	110	F286 G290	F286-G288 PolarHBondContact O-N 2.98Å; G288-G290 PolarHBondContact O-N 3.31Å; G288-G290 VanDerWaalsContact O-N 3.09Å
289	E	45.1	Very low	43.3	Very low	210 Å²	210	113 Å²	113	98%	0.981	56%	0.558	S	S	*	*	S	Bend	trans	-66.7	103.2	173	-74	-178.1	146.4	0	0	109.7
290	G	36.9	Very low	43.1	Very low	66 Å²	66	111.4 Å²	111.4	68%	0.68	55%	0.549	S	S	*	.	S	Bend	trans	100.7	116.2	176.6	0	0	0	0	0	111.7	G288	G288-G290 PolarHBondContact O-N 3.31Å; G288-G290 VanDerWaalsContact O-N 3.09Å
291	E	38.9	Very low	43	Very low	172 Å²	172	106.1 Å²	106.1	80%	0.804	53%	0.529	S	S	*	.			trans	72.1	101.3	-176.2	-58.2	-175.3	165.4	0	0	114.6	E293	E291-E293 PolarHBondContact O-N 3.09Å; E291-E293 VanDerWaalsContact O-N 3.09Å
292	F	35.2	Very low	42.8	Very low	188 Å²	188	107.4 Å²	107.4	83%	0.825	53%	0.53	S	S	*	.			trans	-74.6	90.4	165.2	-66.7	-84.2	0	0	0	108	E294	F292-E294 PolarHBondContact O-N 3.27Å
293	E	40.9	Very low	42.8	Very low	153 Å²	153	102.1 Å²	102.1	72%	0.715	50%	0.502	S	S	*	.			trans	-79.2	100.2	157.9	-74.2	-158.8	159.5	0	0	108.3	E291 K295	E291-E293 PolarHBondContact O-N 3.09Å; E291-E293 VanDerWaalsContact O-N 3.09Å; E293-K295 PolarHBondContact O-N 3.3Å; E293-K295 VanDerWaalsContact O-N 3.12Å
294	E	37.5	Very low	42.7	Very low	173 Å²	173	100.8 Å²	100.8	81%	0.808	49%	0.494	S	S	*	.			trans	-70	101.9	169.1	-166.4	169.7	-160.8	0	0	107.9	F292 K296	F292-E294 PolarHBondContact O-N 3.27Å; E294-K296 PolarHBondContact O-N 3.02Å; E294-K296 VanDerWaalsContact O-N 3.09Å
295	K	42.1	Very low	42.5	Very low	116 Å²	116	99.5 Å²	99.5	50%	0.504	48%	0.482	S	S	.	.			trans	-65.4	110.8	168.8	-74.1	-173.2	175.8	177.2	0	107.6	P283 F286 E293 S297	P283-K295 WeakPolarHBondContact CA-O 3.13Å; P283-K295 WeakPolarHBondContact CB-O 3.22Å; F286-K295 HydrophobicContact CD2-CD 4.27Å; F286-K295 HydrophobicContact CE2-CD 4.06Å; E293-K295 PolarHBondContact O-N 3.3Å; E293-K295 VanDerWaalsContact O-N 3.12Å; K295-S297 PolarHBondContact O-N 3.06Å
296	K	42.7	Very low	42.6	Very low	131 Å²	131	103.4 Å²	103.4	57%	0.57	49%	0.489	S	S	*	.			trans	-60.3	132.4	-179.5	-67.5	177.9	-177.4	174.2	0	110.1	E294 E317	E294-K296 PolarHBondContact O-N 3.02Å; E294-K296 VanDerWaalsContact O-N 3.09Å; K296-E317 HydrophobicContact CD-CB 4.33Å; K296-E317 VanDerWaalsContact CD-CD 3.43Å; K296-E317 HydrophobicContact CD-CG 3.89Å; K296-E317 VanDerWaalsContact CD-OE1 3.26Å; K296-E317 WeakPolarHBondContact CD-OE1 3.43Å; K296-E317 IonicContact NZ-OE1 2.75Å; K296-E317 PolarHBondContact NZ-OE1 2.96Å; K296-E317 IonicContact NZ-OE2 2.71Å; K296-E317 PolarHBondContact NZ-OE2 2.79Å
297	S	41.2	Very low	42.5	Very low	15 Å²	15	101.2 Å²	101.2	11%	0.105	50%	0.502	C	S	.	.			trans	-62.3	138.1	166.3	-174.2	0	0	0	0	109	Y280 E281 K295	Y280-S297 WeakPolarHBondContact CE2-OG 3.5Å; Y280-S297 PolarHBondContact OH-OG 3.32Å; Y280-S297 VanDerWaalsContact OH-OG 3.07Å; E281-S297 VanDerWaalsContact O-CA 3.31Å; E281-S297 WeakPolarHBondContact O-CA 3.47Å; E281-S297 PolarHBondContact O-OG 3.3Å; E281-S297 VanDerWaalsContact O-OG 3.09Å; K295-S297 PolarHBondContact O-N 3.06Å
298	G	45.3	Very low	42.2	Very low	5 Å²	5	95.6 Å²	95.6	5%	0.052	49%	0.486	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.7	153.9	178.1	0	0	0	0	0	114.4	E281 Y316	E281-G298 PolarHBondContact N-O 3.21Å; E281-G298 PolarHBondContact O-N 2.98Å; G298-Y316 WeakPolarHBondContact CA-O 3.39Å
299	Y	43.2	Very low	42.3	Very low	87 Å²	87	97.2 Å²	97.2	34%	0.341	49%	0.487	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	131	168.7	-64.3	-84.6	0	0	0	109.5	F19 W278 L279 Y280 Y316	F19-Y299 HydrophobicContact CE2-CD2 4.32Å; F19-Y299 HydrophobicContact CE2-CE2 4.39Å; W278-Y299 HydrophobicContact CE3-CG 4.45Å; L279-Y299 CarbonylContact O-C 3.55Å; L279-Y299 WeakPolarHBondContact O-CA 3.3Å; Y280-Y299 HydrophobicContact CD2-CD1 4.37Å; Y280-Y299 AromaticContact CD2-CE1 3.9Å; Y280-Y299 HydrophobicContact CD2-CE1 3.9Å; Y280-Y299 AromaticContact CD2-CZ 3.97Å; Y299-Y316 PolarHBondContact N-O 2.86Å; Y299-Y316 WeakPolarHBondContact O-CD2 3.39Å; Y299-Y316 PolarHBondContact O-N 2.87Å
300	Q	44.1	Very low	42.4	Very low	29 Å²	29	90 Å²	90	14%	0.136	46%	0.455	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.2	130.3	168.3	-68.4	-135.3	60	0	0	110.5	W278 L279 E281 N315	W278-Q300 CarbonylContact C-O 3.5Å; W278-Q300 WeakPolarHBondContact CA-O 3.48Å; L279-Q300 HydrophobicContact CB-CB 4.18Å; L279-Q300 PolarHBondContact N-O 3.24Å; L279-Q300 PolarHBondContact O-N 3.23Å; E281-Q300 PolarHBondContact OE1-NE2 3.03Å; Q300-N315 VanDerWaalsContact CD-OD1 3.31Å; Q300-N315 WeakPolarHBondContact CG-OD1 3.39Å
301	L	43.8	Very low	42.6	Very low	12 Å²	12	90.1 Å²	90.1	6%	0.063	44%	0.435	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99	120.1	171.9	-164.7	69.3	0	0	0	110	F26 V276 T277 W278	F26-L301 HydrophobicContact CD1-CD2 3.88Å; F26-L301 HydrophobicContact CD2-CD2 4.11Å; F26-L301 HydrophobicContact CE1-CD2 3.28Å; F26-L301 HydrophobicContact CE2-CD2 3.54Å; F26-L301 HydrophobicContact CG-CD2 4.27Å; F26-L301 HydrophobicContact CZ-CD2 3.11Å; V276-L301 HydrophobicContact CG1-CD1 3.21Å; V276-L301 HydrophobicContact CG1-CD2 4.21Å; V276-L301 HydrophobicContact CG1-CG 3.94Å; T277-L301 CarbonylContact O-C 3.46Å; T277-L301 VanDerWaalsContact O-CA 3.23Å; T277-L301 WeakPolarHBondContact O-CA 3.47Å; W278-L301 HydrophobicContact CD2-CD1 3.7Å; W278-L301 HydrophobicContact CE3-CD1 4.09Å; W278-L301 HydrophobicContact CG-CD1 4.12Å; W278-L301 HydrophobicContact CH2-CD1 4.3Å; W278-L301 HydrophobicContact CZ2-CD1 3.92Å; W278-L301 HydrophobicContact CZ3-CD1 4.38Å
302	R	44.2	Very low	42.6	Very low	113 Å²	113	86 Å²	86	43%	0.426	42%	0.423	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	131.4	169.8	-57.6	-174.6	-179.1	-159.9	0.1	110.4	V276 T277	V276-R302 WeakPolarHBondContact CA-O 3.46Å; T277-R302 PolarHBondContact N-O 3.03Å; T277-R302 PolarHBondContact O-N 3.41Å; T277-R302 WeakPolarHBondContact OG1-CB 3.24Å
303	I	45.6	Very low	42.9	Very low	4 Å²	4	83.6 Å²	83.6	2%	0.021	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.1	122.9	168.3	-62.1	179.9	0	0	0	109	F26 L30 L274 I275 V276 L310 Y311	F26-I303 HydrophobicContact CZ-CD1 3.88Å; L30-I303 HydrophobicContact CD1-CD1 3.98Å; L30-I303 HydrophobicContact CD2-CD1 4.28Å; L274-I303 HydrophobicContact CD2-CG2 3.55Å; L274-I303 HydrophobicContact CG-CG2 4.08Å; I275-I303 WeakPolarHBondContact O-CA 3.09Å; V276-I303 HydrophobicContact CG2-CG1 4.33Å; I303-L310 HydrophobicContact CG2-CB 4.38Å; I303-L310 PolarHBondContact O-N 3.3Å; I303-Y311 HydrophobicContact CB-CD2 4.19Å; I303-Y311 HydrophobicContact CD1-CD2 4.49Å; I303-Y311 HydrophobicContact CG2-CD2 4.42Å; I303-Y311 PolarHBondContact O-N 2.97Å
304	S	48	Very low	43	Very low	23 Å²	23	78.2 Å²	78.2	16%	0.161	40%	0.4	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.2	143.8	178.4	-57	0	0	0	0	112.4	A273 I275 E308	A273-S304 VanDerWaalsContact O-O 3.04Å; I275-S304 PolarHBondContact N-O 3.43Å; I275-S304 PolarHBondContact O-N 3.35Å; S304-E308 CarbonylContact C-O 3.43Å; S304-E308 WeakPolarHBondContact CA-O 3.4Å; S304-E308 WeakPolarHBondContact CB-O 3.48Å
305	Q	43.2	Very low	43.1	Very low	54 Å²	54	74.4 Å²	74.4	25%	0.252	39%	0.385	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	123.9	168.4	179.3	-173.6	2.9	0	0	109.4	I272 A273 G307 E308 L310	I272-Q305 HydrophobicContact CG2-CB 4.49Å; I272-Q305 HydrophobicContact CG2-CG 3.99Å; A273-Q305 WeakPolarHBondContact O-CA 3.43Å; Q305-G307 PolarHBondContact O-N 2.99Å; Q305-E308 PolarHBondContact N-O 3.28Å; Q305-E308 WeakPolarHBondContact O-CA 3.47Å; Q305-E308 WeakPolarHBondContact O-CB 3.35Å; Q305-E308 PolarHBondContact O-N 2.98Å; Q305-L310 HydrophobicContact CB-CD1 3.47Å; Q305-L310 VanDerWaalsContact CB-CD1 3.47Å; Q305-L310 HydrophobicContact CG-CD1 4.5Å
306	K	47	Very low	43.1	Very low	206 Å²	206	71 Å²	71	90%	0.896	37%	0.37	S	S	*	.	T	Hydrogen-bonded Turn	trans	46.5	36.6	170.6	-153.9	179.3	180	-179.9	0	115.2
307	G	39.4	Very low	42.6	Very low	79 Å²	79	70.9 Å²	70.9	81%	0.814	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	90.7	-6	-179.3	0	0	0	0	0	115.4	Q305	Q305-G307 PolarHBondContact O-N 2.99Å
308	E	40.4	Very low	42.6	Very low	127 Å²	127	75.6 Å²	75.6	59%	0.593	40%	0.404	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-92	130.9	169.7	-65.8	-173.3	157.3	0	0	110.1	S304 Q305 L310	S304-E308 CarbonylContact C-O 3.43Å; S304-E308 WeakPolarHBondContact CA-O 3.4Å; S304-E308 WeakPolarHBondContact CB-O 3.48Å; Q305-E308 PolarHBondContact N-O 3.28Å; Q305-E308 WeakPolarHBondContact O-CA 3.47Å; Q305-E308 WeakPolarHBondContact O-CB 3.35Å; Q305-E308 PolarHBondContact O-N 2.98Å; E308-L310 PolarHBondContact O-N 3Å
309	V	44.3	Very low	42.4	Very low	78 Å²	78	79.2 Å²	79.2	47%	0.473	42%	0.422	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.1	107.8	169.5	176.8	0	0	0	0	106.7	Y311 P312	V309-Y311 VanDerWaalsContact C-N 3.31Å; V309-Y311 WeakPolarHBondContact CG1-O 3.46Å; V309-P312 HydrophobicContact CG1-CB 4.5Å
310	L	46.1	Very low	42.4	Very low	59 Å²	59	78.7 Å²	78.7	31%	0.309	43%	0.426	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-74	-29.9	178	-123.9	107.5	0	0	0	111.2	I303 Q305 E308	I303-L310 HydrophobicContact CG2-CB 4.38Å; I303-L310 PolarHBondContact O-N 3.3Å; Q305-L310 HydrophobicContact CB-CD1 3.47Å; Q305-L310 VanDerWaalsContact CB-CD1 3.47Å; Q305-L310 HydrophobicContact CG-CD1 4.5Å; E308-L310 PolarHBondContact O-N 3Å
311	Y	42.7	Very low	42.3	Very low	68 Å²	68	81.5 Å²	81.5	27%	0.267	44%	0.442	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-144.9	120.6	178.7	-67.7	-81.6	0	0	0	111	K33 I303 V309	K33-Y311 HydrophobicContact CD-CE1 4.19Å; I303-Y311 HydrophobicContact CB-CD2 4.19Å; I303-Y311 HydrophobicContact CD1-CD2 4.49Å; I303-Y311 HydrophobicContact CG2-CD2 4.42Å; I303-Y311 PolarHBondContact O-N 2.97Å; V309-Y311 VanDerWaalsContact C-N 3.31Å; V309-Y311 WeakPolarHBondContact CG1-O 3.46Å
312	P	38.7	Very low	42.2	Very low	86 Å²	86	85.6 Å²	85.6	56%	0.558	46%	0.464	S	S	*	.			trans	-92.2	155	147.6	31.4	-20.5	0	0	0	110	V309	V309-P312 HydrophobicContact CG1-CB 4.5Å
313	L	40.5	Very low	42.1	Very low	137 Å²	137	83.9 Å²	83.9	72%	0.717	47%	0.467	S	S	*	.			trans	84.9	93.5	162.7	-62.5	128.8	0	0	0	118.6
314	A	42.8	Very low	41.9	Very low	41 Å²	41	89.2 Å²	89.2	34%	0.339	50%	0.497	S	S	.	.				-140.4	112.8	122.8	0	0	0	0	0	106.6	Y316	A314-Y316 HydrophobicContact CB-CE2 4.23Å; A314-Y316 PolarHBondContact O-N 3.01Å
315	N	39.3	Very low	41.4	Very low	93 Å²	93	93.9 Å²	93.9	50%	0.497	52%	0.521	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.3	111.9	162.7	-74.7	-17.9	0	0	0	106.1	Q300 E317	Q300-N315 VanDerWaalsContact CD-OD1 3.31Å; Q300-N315 WeakPolarHBondContact CG-OD1 3.39Å; N315-E317 PolarHBondContact O-N 3.39Å
316	Y	42	Very low	41.3	Very low	45 Å²	45	97 Å²	97	18%	0.176	54%	0.541	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	100.6	166.7	-71	-78.5	0	0	0	107.9	S22 F26 W278 G298 Y299 A314	S22-Y316 VanDerWaalsContact OG-CD1 3.23Å; S22-Y316 WeakPolarHBondContact OG-CD1 3.36Å; S22-Y316 WeakPolarHBondContact OG-CE1 3.38Å; F26-Y316 WeakPolarHBondContact CB-OH 3.04Å; F26-Y316 VanDerWaalsContact CD2-OH 3.3Å; F26-Y316 WeakPolarHBondContact CD2-OH 3.37Å; W278-Y316 HydrophobicContact CH2-CE2 4.36Å; W278-Y316 HydrophobicContact CZ3-CD2 4.02Å; W278-Y316 AromaticContact CZ3-CE2 3.92Å; W278-Y316 HydrophobicContact CZ3-CE2 3.92Å; G298-Y316 WeakPolarHBondContact CA-O 3.39Å; Y299-Y316 PolarHBondContact N-O 2.86Å; Y299-Y316 WeakPolarHBondContact O-CD2 3.39Å; Y299-Y316 PolarHBondContact O-N 2.87Å; A314-Y316 HydrophobicContact CB-CE2 4.23Å; A314-Y316 PolarHBondContact O-N 3.01Å
317	E	34.1	Very low	40.8	Very low	128 Å²	128	87.9 Å²	87.9	60%	0.598	51%	0.512	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-64.5	128.5	169.6	-57.8	-172.1	156.3	0	0	109.2	K296 N315	K296-E317 HydrophobicContact CD-CB 4.33Å; K296-E317 VanDerWaalsContact CD-CD 3.43Å; K296-E317 HydrophobicContact CD-CG 3.89Å; K296-E317 VanDerWaalsContact CD-OE1 3.26Å; K296-E317 WeakPolarHBondContact CD-OE1 3.43Å; K296-E317 IonicContact NZ-OE1 2.75Å; K296-E317 PolarHBondContact NZ-OE1 2.96Å; K296-E317 IonicContact NZ-OE2 2.71Å; K296-E317 PolarHBondContact NZ-OE2 2.79Å; N315-E317 PolarHBondContact O-N 3.39Å
318	S	39.5	Very low	40.9	Very low	114 Å²	114	88.7 Å²	88.7	80%	0.797	48%	0.484	S	S	*	.			trans	-91.6	0	172.6	91.6	0	0	0	0	112.8

Retrieved 318 of 318 residues in 54 ms (Link to these results)

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