A0A087XE27_POEFO Loading...

Shisa family member 6

AlphaFold DB , UniProt , Accession A0A087XE27, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 460 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	D	91.9	Very high	92	Very high	63 Å²	63	48.6 Å²	48.6	34%	0.337	28%	0.277	S	S	.	.				0	164.9	0	-67.5	-15.5	0	0	0	110.5	C19 R25 F26 C27 R43	D1-C19 WeakPolarHBondContact O-CA 3.27Å; D1-C19 VanDerWaalsContact O-CB 3.31Å; D1-C19 WeakPolarHBondContact O-CB 3.31Å; D1-C19 PolarHBondContact O-N 3.36Å; D1-R25 WeakPolarHBondContact CB-O 3.26Å; D1-R25 PolarHBondContact N-O 3.46Å; D1-F26 WeakPolarHBondContact OD2-CA 3.32Å; D1-F26 WeakPolarHBondContact OD2-CD1 3.33Å; D1-C27 HydrophobicContact CB-CB 4.21Å; D1-C27 PolarHBondContact OD2-N 3.43Å; D1-R43 IonicContact OD1-CZ 3.73Å; D1-R43 IonicContact OD1-NH1 2.69Å; D1-R43 PolarHBondContact OD1-NH1 2.92Å; D1-R43 IonicContact OD2-CZ 3.31Å; D1-R43 VanDerWaalsContact OD2-CZ 3.31Å; D1-R43 IonicContact OD2-NE 3.58Å; D1-R43 IonicContact OD2-NH1 3.88Å; D1-R43 PolarHBondContact OD2-NH1 3.41Å
2	T	94.4	Very high	91.7	Very high	50 Å²	50	55.3 Å²	55.3	31%	0.307	30%	0.304	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.1	134.4	170	-45.9	0	0	0	0	107.6	E16 F17 Q46	T2-E16 HydrophobicContact CG2-CG 3.64Å; T2-E16 WeakPolarHBondContact CG2-OE1 3.36Å; T2-F17 VanDerWaalsContact CG2-O 3.3Å; T2-F17 WeakPolarHBondContact CG2-O 3.3Å; T2-Q46 PolarHBondContact O-NE2 2.91Å
3	C	95.4	Very high	91.7	Very high	0 Å²	0	59.8 Å²	59.8	0%	0	32%	0.315	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	106.9	169.4	-71.5	0	0	0	0	108.4	E16 F17 C27 R34	C3-E16 VanDerWaalsContact O-CA 3.24Å; C3-E16 WeakPolarHBondContact O-CA 3.2Å; C3-E16 WeakPolarHBondContact O-CG 3.35Å; C3-F17 HydrophobicContact CB-CD1 4.14Å; C3-F17 HydrophobicContact CB-CD2 3.96Å; C3-F17 HydrophobicContact CB-CE1 3.73Å; C3-F17 HydrophobicContact CB-CE2 3.53Å; C3-F17 HydrophobicContact CB-CG 4.24Å; C3-F17 HydrophobicContact CB-CZ 3.41Å; C3-F17 VanDerWaalsContact CB-CZ 3.41Å; C3-F17 PolarHBondContact N-O 3.17Å; C3-F17 PolarHBondContact O-N 3.22Å; C3-F17 WeakPolarHBondContact SG-CE2 3.45Å; C3-F17 WeakPolarHBondContact SG-CZ 3.24Å; C3-C27 WeakPolarHBondContact CA-SG 3.32Å; C3-C27 HydrophobicContact CB-CB 4.15Å; C3-C27 WeakPolarHBondContact CB-SG 3.4Å; C3-C27 WeakPolarHBondContact SG-CA 3.46Å; C3-C27 WeakPolarHBondContact SG-CB 3.25Å; C3-C27 CovalentContact SG-SG 2.03Å; C3-C27 PolarHBondContact SG-SG 3.05Å; C3-R34 HydrophobicContact CB-CB 4.2Å
4	W	95.1	Very high	91.8	Very high	102 Å²	102	59.4 Å²	59.4	39%	0.386	31%	0.313	S	S	.	.			trans	-59	142.9	174.5	-59.5	-25.1	0	0	0	110.3	R34 Q46 K47 Y52	W4-R34 PolarHBondContact O-NH1 3.46Å; W4-Q46 HydrophobicContact CD2-CB 4.48Å; W4-Q46 HydrophobicContact CE3-CB 3.92Å; W4-Q46 HydrophobicContact CZ3-CB 4.17Å; W4-K47 HydrophobicContact CH2-CG 3.94Å; W4-K47 HydrophobicContact CZ3-CG 4.19Å; W4-Y52 HydrophobicContact CB-CE1 3.79Å; W4-Y52 HydrophobicContact CE3-CE1 4.17Å; W4-Y52 HydrophobicContact CE3-CE2 4.4Å; W4-Y52 AromaticContact CE3-CZ 3.79Å
5	G	93.9	Very high	91.9	Very high	4 Å²	4	66.7 Å²	66.7	4%	0.041	34%	0.341	C	S	.	.			trans	-59.6	155.8	178.7	0	0	0	0	0	112.6	D14 Y52	G5-D14 CarbonylContact C-O 3.59Å; G5-D14 WeakPolarHBondContact CA-O 3.47Å; G5-Y52 WeakPolarHBondContact O-CD1 3.47Å; G5-Y52 WeakPolarHBondContact O-CE1 3.07Å
6	Y	93.7	Very high	92.1	Very high	4 Å²	4	68.7 Å²	68.7	2%	0.016	35%	0.349	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-159.4	158.4	-170.1	64.5	-88.6	0	0	0	112.7	D8 Y13 D14 F32 R34 N51	Y6-D8 HydrophobicContact CE2-CB 4.17Å; Y6-Y13 CarbonylContact O-C 3.51Å; Y6-Y13 WeakPolarHBondContact O-CA 3.13Å; Y6-Y13 WeakPolarHBondContact O-CD2 3.25Å; Y6-D14 HydrophobicContact CD1-CB 4.08Å; Y6-D14 HydrophobicContact CD2-CB 4.33Å; Y6-D14 HydrophobicContact CE1-CB 3.63Å; Y6-D14 HydrophobicContact CE2-CB 3.88Å; Y6-D14 WeakPolarHBondContact CE2-OD2 3.36Å; Y6-D14 HydrophobicContact CG-CB 4.41Å; Y6-D14 PolarHBondContact N-O 3.46Å; Y6-D14 PolarHBondContact O-N 2.73Å; Y6-D14 PolarHBondContact OH-OD2 2.95Å; Y6-F32 VanDerWaalsContact CE2-C 3.44Å; Y6-F32 WeakPolarHBondContact CE2-O 3.34Å; Y6-R34 VanDerWaalsContact CB-NH2 3.3Å; Y6-R34 HydrophobicContact CD1-CB 4.31Å; Y6-R34 VanDerWaalsContact CD1-CD 3.48Å; Y6-R34 HydrophobicContact CD1-CG 3.81Å; Y6-R34 HydrophobicContact CE1-CB 3.6Å; Y6-R34 HydrophobicContact CE1-CG 3.53Å; Y6-R34 PolarHBondContact OH-N 3.24Å; Y6-R34 VanDerWaalsContact OH-N 3.13Å; Y6-N51 WeakPolarHBondContact CA-O 3.41Å
7	Y	92.6	Very high	92.2	Very high	40 Å²	40	68.6 Å²	68.6	16%	0.157	35%	0.346	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.7	125	167.4	-70.6	-87.7	0	0	0	109.9	G11 Q12 Y13 F32 N51 N53 T54	Y7-G11 WeakPolarHBondContact CD1-O 3.36Å; Y7-Q12 WeakPolarHBondContact CA-O 3.49Å; Y7-Y13 HydrophobicContact CD1-CD2 4.46Å; Y7-Y13 AromaticContact CD2-CD2 3.91Å; Y7-Y13 HydrophobicContact CD2-CD2 3.91Å; Y7-Y13 HydrophobicContact CE1-CD2 4.07Å; Y7-Y13 HydrophobicContact CE1-CG 4.27Å; Y7-Y13 AromaticContact CE2-CD2 3.42Å; Y7-Y13 HydrophobicContact CE2-CD2 3.42Å; Y7-Y13 VanDerWaalsContact CE2-CD2 3.42Å; Y7-Y13 AromaticContact CE2-CE2 3.98Å; Y7-Y13 HydrophobicContact CE2-CE2 3.98Å; Y7-Y13 HydrophobicContact CE2-CG 4.32Å; Y7-Y13 HydrophobicContact CG-CD2 4.36Å; Y7-Y13 AromaticContact CZ-CD2 3.48Å; Y7-Y13 VanDerWaalsContact CZ-CD2 3.48Å; Y7-Y13 AromaticContact CZ-CG 3.91Å; Y7-F32 WeakPolarHBondContact O-CD1 3.12Å; Y7-N51 PolarHBondContact N-O 2.97Å; Y7-N51 PolarHBondContact O-ND2 3.41Å; Y7-N53 WeakPolarHBondContact CD2-O 3.4Å; Y7-T54 HydrophobicContact CE1-CG2 3.98Å; Y7-T54 HydrophobicContact CE2-CG2 4.22Å; Y7-T54 WeakPolarHBondContact OH-CG2 3.48Å
8	D	91.3	Very high	92.4	Very high	33 Å²	33	69.5 Å²	69.5	18%	0.176	36%	0.359	C	S	.	.			trans	-74.8	-166.9	178.5	87.6	-42.5	0	0	0	111.9	Y6 S10 G11 Q12	Y6-D8 HydrophobicContact CE2-CB 4.17Å; D8-S10 VanDerWaalsContact C-N 3.35Å; D8-S10 WeakPolarHBondContact OD1-CA 3.49Å; D8-S10 PolarHBondContact OD1-N 3.26Å; D8-S10 PolarHBondContact OD1-OG 3.23Å; D8-S10 WeakPolarHBondContact OD2-CB 3.32Å; D8-S10 PolarHBondContact OD2-N 3.41Å; D8-S10 PolarHBondContact OD2-OG 2.81Å; D8-G11 PolarHBondContact OD1-N 3.48Å; D8-Q12 PolarHBondContact N-O 3.01Å; D8-Q12 PolarHBondContact OD1-N 3.07Å
9	V	88.9	Confident	92.5	Very high	130 Å²	130	66.3 Å²	66.3	79%	0.788	34%	0.344	S	S	*	.	S	Bend	trans	-76.5	-16.1	175.5	-61.6	0	0	0	0	114.4	F32	V9-F32 HydrophobicContact CG1-CB 3.8Å; V9-F32 HydrophobicContact CG1-CD1 4.47Å; V9-F32 HydrophobicContact CG1-CG 4.17Å
10	S	88.9	Confident	92.4	Very high	85 Å²	85	70.7 Å²	70.7	59%	0.594	37%	0.368	S	S	*	.	S	Bend	trans	-91	-11.8	174.7	70.3	0	0	0	0	113.8	D8	D8-S10 VanDerWaalsContact C-N 3.35Å; D8-S10 WeakPolarHBondContact OD1-CA 3.49Å; D8-S10 PolarHBondContact OD1-N 3.26Å; D8-S10 PolarHBondContact OD1-OG 3.23Å; D8-S10 WeakPolarHBondContact OD2-CB 3.32Å; D8-S10 PolarHBondContact OD2-N 3.41Å; D8-S10 PolarHBondContact OD2-OG 2.81Å
11	G	85.6	Confident	92.2	Very high	24 Å²	24	71.4 Å²	71.4	25%	0.247	37%	0.372	C	S	.	.	S	Bend	trans	89.8	8.2	-175.1	0	0	0	0	0	113.7	Y7 D8	Y7-G11 WeakPolarHBondContact CD1-O 3.36Å; D8-G11 PolarHBondContact OD1-N 3.48Å
12	Q	88.3	Confident	91.7	Very high	128 Å²	128	72.8 Å²	72.8	60%	0.598	38%	0.383	S	S	*	.			trans	-75.1	139.2	170.1	-179.4	169.2	-17.4	0	0	110.4	Y7 D8	Y7-Q12 WeakPolarHBondContact CA-O 3.49Å; D8-Q12 PolarHBondContact N-O 3.01Å; D8-Q12 PolarHBondContact OD1-N 3.07Å
13	Y	92.1	Very high	91.4	Very high	114 Å²	114	75.4 Å²	75.4	45%	0.447	40%	0.395	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	109	173.8	-174.7	-112.2	0	0	0	111.3	Y6 Y7	Y6-Y13 CarbonylContact O-C 3.51Å; Y6-Y13 WeakPolarHBondContact O-CA 3.13Å; Y6-Y13 WeakPolarHBondContact O-CD2 3.25Å; Y7-Y13 HydrophobicContact CD1-CD2 4.46Å; Y7-Y13 AromaticContact CD2-CD2 3.91Å; Y7-Y13 HydrophobicContact CD2-CD2 3.91Å; Y7-Y13 HydrophobicContact CE1-CD2 4.07Å; Y7-Y13 HydrophobicContact CE1-CG 4.27Å; Y7-Y13 AromaticContact CE2-CD2 3.42Å; Y7-Y13 HydrophobicContact CE2-CD2 3.42Å; Y7-Y13 VanDerWaalsContact CE2-CD2 3.42Å; Y7-Y13 AromaticContact CE2-CE2 3.98Å; Y7-Y13 HydrophobicContact CE2-CE2 3.98Å; Y7-Y13 HydrophobicContact CE2-CG 4.32Å; Y7-Y13 HydrophobicContact CG-CD2 4.36Å; Y7-Y13 AromaticContact CZ-CD2 3.48Å; Y7-Y13 VanDerWaalsContact CZ-CD2 3.48Å; Y7-Y13 AromaticContact CZ-CG 3.91Å
14	D	93.2	Very high	91.2	Very high	54 Å²	54	79.5 Å²	79.5	29%	0.289	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79	125.7	166.2	-83.4	-31.5	0	0	0	109.7	G5 Y6	G5-D14 CarbonylContact C-O 3.59Å; G5-D14 WeakPolarHBondContact CA-O 3.47Å; Y6-D14 HydrophobicContact CD1-CB 4.08Å; Y6-D14 HydrophobicContact CD2-CB 4.33Å; Y6-D14 HydrophobicContact CE1-CB 3.63Å; Y6-D14 HydrophobicContact CE2-CB 3.88Å; Y6-D14 WeakPolarHBondContact CE2-OD2 3.36Å; Y6-D14 HydrophobicContact CG-CB 4.41Å; Y6-D14 PolarHBondContact N-O 3.46Å; Y6-D14 PolarHBondContact O-N 2.73Å; Y6-D14 PolarHBondContact OH-OD2 2.95Å
15	K	93.2	Very high	91.2	Very high	169 Å²	169	81.2 Å²	81.2	74%	0.735	42%	0.42	S	S	*	.	P	Polyproline II helix	trans	-74.3	150.7	-178.6	-175.7	177.4	174.7	-178.3	0	111.6	F17	K15-F17 WeakPolarHBondContact O-CD1 3.31Å
16	E	94.8	Very high	91.3	Very high	99 Å²	99	83.1 Å²	83.1	46%	0.463	43%	0.427	S	S	.	.	P	Polyproline II helix	trans	-53.3	136.1	171.3	177.4	164.6	-156.4	0	0	113.5	T2 C3	T2-E16 HydrophobicContact CG2-CG 3.64Å; T2-E16 WeakPolarHBondContact CG2-OE1 3.36Å; C3-E16 VanDerWaalsContact O-CA 3.24Å; C3-E16 WeakPolarHBondContact O-CA 3.2Å; C3-E16 WeakPolarHBondContact O-CG 3.35Å
17	F	94.2	Very high	91.4	Very high	68 Å²	68	83 Å²	83	30%	0.298	43%	0.427	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.9	147.7	178.3	62.2	-95.1	0	0	0	113.5	T2 C3 K15 R34	T2-F17 VanDerWaalsContact CG2-O 3.3Å; T2-F17 WeakPolarHBondContact CG2-O 3.3Å; C3-F17 HydrophobicContact CB-CD1 4.14Å; C3-F17 HydrophobicContact CB-CD2 3.96Å; C3-F17 HydrophobicContact CB-CE1 3.73Å; C3-F17 HydrophobicContact CB-CE2 3.53Å; C3-F17 HydrophobicContact CB-CG 4.24Å; C3-F17 HydrophobicContact CB-CZ 3.41Å; C3-F17 VanDerWaalsContact CB-CZ 3.41Å; C3-F17 PolarHBondContact N-O 3.17Å; C3-F17 PolarHBondContact O-N 3.22Å; C3-F17 WeakPolarHBondContact SG-CE2 3.45Å; C3-F17 WeakPolarHBondContact SG-CZ 3.24Å; K15-F17 WeakPolarHBondContact O-CD1 3.31Å; F17-R34 HydrophobicContact CZ-CB 4.18Å; F17-R34 WeakPolarHBondContact CZ-O 3.38Å
18	S	95.4	Very high	91.5	Very high	84 Å²	84	81.1 Å²	81.1	59%	0.587	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98	125.3	-175.2	-61.4	0	0	0	0	113	N20	S18-N20 VanDerWaalsContact C-N 3.31Å; S18-N20 PolarHBondContact O-N 2.87Å
19	C	94.4	Very high	91.7	Very high	9 Å²	9	81.3 Å²	81.3	6%	0.061	43%	0.43	C	S	.	.			trans	-81.7	77	175.1	-61.4	0	0	0	0	110.7	D1 H24 C36	D1-C19 WeakPolarHBondContact O-CA 3.27Å; D1-C19 VanDerWaalsContact O-CB 3.31Å; D1-C19 WeakPolarHBondContact O-CB 3.31Å; D1-C19 PolarHBondContact O-N 3.36Å; C19-H24 WeakPolarHBondContact CB-O 3.49Å; C19-C36 WeakPolarHBondContact CA-SG 3.17Å; C19-C36 HydrophobicContact CB-CB 3.73Å; C19-C36 WeakPolarHBondContact CB-SG 3.1Å; C19-C36 WeakPolarHBondContact SG-CA 3.33Å; C19-C36 WeakPolarHBondContact SG-CB 3.38Å; C19-C36 CovalentContact SG-SG 2.04Å; C19-C36 PolarHBondContact SG-SG 2.83Å
20	N	89.9	Confident	92	Very high	154 Å²	154	77.7 Å²	77.7	82%	0.824	41%	0.41	S	S	*	.			trans	-95.4	3	-174.2	-163.2	39.9	0	0	0	114.3	S18	S18-N20 VanDerWaalsContact C-N 3.31Å; S18-N20 PolarHBondContact O-N 2.87Å
21	N	88.4	Confident	92.2	Very high	86 Å²	86	74.9 Å²	74.9	46%	0.46	39%	0.39	S	S	.	.			trans	-79.1	139.1	177.6	-176.7	-40.2	0	0	0	109.9	D23 H24 R25	N21-D23 PolarHBondContact O-N 2.95Å; N21-D23 VanDerWaalsContact O-N 3.14Å; N21-D23 PolarHBondContact OD1-N 3.43Å; N21-H24 HydrophobicContact CB-CB 4.22Å; N21-H24 CarbonylContact O-C 3.54Å; N21-H24 PolarHBondContact O-N 3.01Å; N21-R25 WeakPolarHBondContact O-CG 3.08Å
22	T	82	Confident	92.6	Very high	92 Å²	92	78 Å²	78	56%	0.564	40%	0.397	S	S	*	.	S	Bend	trans	-55.8	-29.8	178.2	49.2	0	0	0	0	113.6	R25	T22-R25 PolarHBondContact O-NE 3.12Å; T22-R25 PolarHBondContact O-NH2 3.14Å; T22-R25 VanDerWaalsContact O-NH2 3.13Å
23	D	87.8	Confident	92.9	Very high	104 Å²	104	77 Å²	77	56%	0.556	40%	0.395	S	S	*	.	S	Bend	trans	-105.4	-16.7	-170.9	-63.5	21.5	0	0	0	110.7	N21 A38	N21-D23 PolarHBondContact O-N 2.95Å; N21-D23 VanDerWaalsContact O-N 3.14Å; N21-D23 PolarHBondContact OD1-N 3.43Å; D23-A38 WeakPolarHBondContact O-CA 3.44Å; D23-A38 WeakPolarHBondContact O-CB 3.25Å
24	H	91.7	Very high	93	Very high	86 Å²	86	72 Å²	72	40%	0.398	38%	0.376	S	S	.	.			trans	-129	72.4	178.7	-59.4	-10.7	0	0	0	109.7	C19 N21 C36 C37	C19-H24 WeakPolarHBondContact CB-O 3.49Å; N21-H24 HydrophobicContact CB-CB 4.22Å; N21-H24 CarbonylContact O-C 3.54Å; N21-H24 PolarHBondContact O-N 3.01Å; H24-C36 HydrophobicContact CB-CB 3.9Å; H24-C37 CarbonylContact C-O 3.42Å; H24-C37 WeakPolarHBondContact CA-O 3.31Å
25	R	94.5	Very high	93.1	Very high	138 Å²	138	74.3 Å²	74.3	52%	0.521	38%	0.383	S	S	.	.			trans	-91.4	-19.3	-174.5	-62.3	-175	-159.6	-136.3	-1.7	114.5	D1 N21 T22 C37	D1-R25 WeakPolarHBondContact CB-O 3.26Å; D1-R25 PolarHBondContact N-O 3.46Å; N21-R25 WeakPolarHBondContact O-CG 3.08Å; T22-R25 PolarHBondContact O-NE 3.12Å; T22-R25 PolarHBondContact O-NH2 3.14Å; T22-R25 VanDerWaalsContact O-NH2 3.13Å; R25-C37 PolarHBondContact N-O 2.93Å
26	F	95.6	Very high	93.3	Very high	45 Å²	45	68 Å²	68	20%	0.197	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.3	143	-171.8	-55.4	-70.2	0	0	0	111.2	D1 C28 C36 C37 A38 R40 R43	D1-F26 WeakPolarHBondContact OD2-CA 3.32Å; D1-F26 WeakPolarHBondContact OD2-CD1 3.33Å; F26-C28 PolarHBondContact O-SG 3.1Å; F26-C28 VanDerWaalsContact O-SG 3.38Å; F26-C36 CarbonylContact O-C 3.4Å; F26-C36 VanDerWaalsContact O-CA 3.32Å; F26-C36 WeakPolarHBondContact O-CA 3.37Å; F26-C37 PolarHBondContact N-O 2.84Å; F26-C37 VanDerWaalsContact N-O 3.1Å; F26-C37 PolarHBondContact O-N 3.39Å; F26-A38 WeakPolarHBondContact CD2-O 3.42Å; F26-A38 WeakPolarHBondContact CE2-O 3.2Å; F26-R40 HydrophobicContact CD1-CB 4.42Å; F26-R40 HydrophobicContact CD1-CG 4.24Å; F26-R40 HydrophobicContact CD2-CB 4.14Å; F26-R40 HydrophobicContact CE1-CB 4.04Å; F26-R40 HydrophobicContact CE1-CG 3.78Å; F26-R40 HydrophobicContact CE2-CB 3.72Å; F26-R40 HydrophobicContact CE2-CG 4.39Å; F26-R40 HydrophobicContact CG-CB 4.48Å; F26-R40 HydrophobicContact CZ-CB 3.67Å; F26-R40 HydrophobicContact CZ-CG 3.87Å; F26-R43 HydrophobicContact CB-CB 4.35Å
27	C	96.3	Very high	93.3	Very high	0 Å²	0	64 Å²	64	0%	0	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.2	122.4	169	-174.7	0	0	0	0	108.7	D1 C3 R43 L44	D1-C27 HydrophobicContact CB-CB 4.21Å; D1-C27 PolarHBondContact OD2-N 3.43Å; C3-C27 WeakPolarHBondContact CA-SG 3.32Å; C3-C27 HydrophobicContact CB-CB 4.15Å; C3-C27 WeakPolarHBondContact CB-SG 3.4Å; C3-C27 WeakPolarHBondContact SG-CA 3.46Å; C3-C27 WeakPolarHBondContact SG-CB 3.25Å; C3-C27 CovalentContact SG-SG 2.03Å; C3-C27 PolarHBondContact SG-SG 3.05Å; C27-R43 CarbonylContact O-C 3.41Å; C27-R43 VanDerWaalsContact O-CA 3.28Å; C27-R43 WeakPolarHBondContact O-CA 3.34Å; C27-L44 PolarHBondContact O-N 3Å
28	C	96.1	Very high	93.3	Very high	1 Å²	1	64 Å²	64	1%	0.007	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	167.2	-170.3	-50.2	0	0	0	0	111.1	F26 R34 F35 C37 K42	F26-C28 PolarHBondContact O-SG 3.1Å; F26-C28 VanDerWaalsContact O-SG 3.38Å; C28-R34 WeakPolarHBondContact O-CA 3.35Å; C28-F35 HydrophobicContact CB-CD2 4.29Å; C28-F35 HydrophobicContact CB-CE2 3.95Å; C28-F35 HydrophobicContact CB-CZ 4.3Å; C28-F35 PolarHBondContact N-O 2.89Å; C28-F35 PolarHBondContact O-N 2.74Å; C28-C37 HydrophobicContact CB-CB 3.67Å; C28-C37 WeakPolarHBondContact CB-SG 3.44Å; C28-C37 WeakPolarHBondContact SG-CB 3.44Å; C28-C37 CovalentContact SG-SG 2.03Å; C28-C37 PolarHBondContact SG-SG 3.38Å; C28-K42 WeakPolarHBondContact CA-O 3.02Å; C28-K42 VanDerWaalsContact CB-O 3.28Å; C28-K42 WeakPolarHBondContact CB-O 3.45Å
29	G	94.5	Very high	93.2	Very high	38 Å²	38	63.1 Å²	63.1	39%	0.392	34%	0.344	S	S	.	.	E	Extended strand (participates in β ladder)	trans	113.4	-135.2	178.5	0	0	0	0	0	112.7	L33 F35	G29-L33 WeakPolarHBondContact CA-O 3.36Å; G29-F35 VanDerWaalsContact CA-CE1 3.47Å
30	S	94.4	Very high	93.1	Very high	54 Å²	54	72 Å²	72	38%	0.378	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	171.8	177.1	83.7	0	0	0	0	110.7	F32 L33 R34 L44	S30-F32 PolarHBondContact O-N 3.11Å; S30-F32 VanDerWaalsContact O-N 3.15Å; S30-F32 PolarHBondContact OG-N 2.7Å; S30-L33 PolarHBondContact N-O 3.17Å; S30-L33 CarbonylContact O-C 3.55Å; S30-L33 PolarHBondContact O-N 2.65Å; S30-L33 VanDerWaalsContact O-O 3.05Å; S30-L33 PolarHBondContact OG-N 3.01Å; S30-R34 VanDerWaalsContact O-CG 3.32Å; S30-R34 WeakPolarHBondContact O-CG 3.15Å; S30-L44 VanDerWaalsContact O-CD2 3.26Å; S30-L44 WeakPolarHBondContact O-CD2 3.4Å
31	C	94.1	Very high	93.2	Very high	26 Å²	26	68.1 Å²	68.1	18%	0.176	37%	0.373	C	S	.	.	T	Hydrogen-bonded Turn	trans	-53	-37.7	176.6	-65.9	0	0	0	0	113.2	R34 C49 N51	C31-R34 PolarHBondContact O-NE 3.16Å; C31-R34 PolarHBondContact O-NH2 2.74Å; C31-C49 WeakPolarHBondContact CA-SG 3.4Å; C31-C49 HydrophobicContact CB-CB 3.68Å; C31-C49 WeakPolarHBondContact CB-SG 3.38Å; C31-C49 WeakPolarHBondContact SG-CA 3.5Å; C31-C49 WeakPolarHBondContact SG-CB 3.42Å; C31-C49 CovalentContact SG-SG 2.04Å; C31-C49 PolarHBondContact SG-SG 3.3Å; C31-N51 VanDerWaalsContact C-ND2 3.27Å; C31-N51 PolarHBondContact O-ND2 2.77Å; C31-N51 PolarHBondContact O-OD1 2.67Å
32	F	93.4	Very high	93.4	Very high	89 Å²	89	70.6 Å²	70.6	39%	0.39	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.4	1.7	-175.4	-56.4	-87.6	0	0	0	114.6	Y6 Y7 V9 S30 N51	Y6-F32 VanDerWaalsContact CE2-C 3.44Å; Y6-F32 WeakPolarHBondContact CE2-O 3.34Å; Y7-F32 WeakPolarHBondContact O-CD1 3.12Å; V9-F32 HydrophobicContact CG1-CB 3.8Å; V9-F32 HydrophobicContact CG1-CD1 4.47Å; V9-F32 HydrophobicContact CG1-CG 4.17Å; S30-F32 PolarHBondContact O-N 3.11Å; S30-F32 VanDerWaalsContact O-N 3.15Å; S30-F32 PolarHBondContact OG-N 2.7Å; F32-N51 HydrophobicContact CD1-CB 4.22Å; F32-N51 WeakPolarHBondContact CD1-ND2 3.37Å; F32-N51 HydrophobicContact CE1-CB 3.78Å; F32-N51 HydrophobicContact CZ-CB 4.32Å
33	L	94.4	Very high	94	Very high	107 Å²	107	72.4 Å²	72.4	56%	0.56	38%	0.376	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-155.4	109.5	174.4	176.6	61.3	0	0	0	109.4	G29 S30	G29-L33 WeakPolarHBondContact CA-O 3.36Å; S30-L33 PolarHBondContact N-O 3.17Å; S30-L33 CarbonylContact O-C 3.55Å; S30-L33 PolarHBondContact O-N 2.65Å; S30-L33 VanDerWaalsContact O-O 3.05Å; S30-L33 PolarHBondContact OG-N 3.01Å
34	R	95.6	Very high	94.4	Very high	9 Å²	9	68.6 Å²	68.6	3%	0.034	36%	0.355	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.4	143.7	-174.7	-53.1	-176.7	-167	171.9	10.8	111.3	C3 W4 Y6 F17 C28 S30 C31 L44 N51 Y52	C3-R34 HydrophobicContact CB-CB 4.2Å; W4-R34 PolarHBondContact O-NH1 3.46Å; Y6-R34 VanDerWaalsContact CB-NH2 3.3Å; Y6-R34 HydrophobicContact CD1-CB 4.31Å; Y6-R34 VanDerWaalsContact CD1-CD 3.48Å; Y6-R34 HydrophobicContact CD1-CG 3.81Å; Y6-R34 HydrophobicContact CE1-CB 3.6Å; Y6-R34 HydrophobicContact CE1-CG 3.53Å; Y6-R34 PolarHBondContact OH-N 3.24Å; Y6-R34 VanDerWaalsContact OH-N 3.13Å; F17-R34 HydrophobicContact CZ-CB 4.18Å; F17-R34 WeakPolarHBondContact CZ-O 3.38Å; C28-R34 WeakPolarHBondContact O-CA 3.35Å; S30-R34 VanDerWaalsContact O-CG 3.32Å; S30-R34 WeakPolarHBondContact O-CG 3.15Å; C31-R34 PolarHBondContact O-NE 3.16Å; C31-R34 PolarHBondContact O-NH2 2.74Å; R34-L44 HydrophobicContact CG-CD2 3.8Å; R34-N51 PolarHBondContact NH2-OD1 3.4Å; R34-Y52 VanDerWaalsContact CZ-OH 3.31Å; R34-Y52 VanDerWaalsContact NH1-CE1 3.34Å; R34-Y52 PolarHBondContact NH1-OH 2.99Å; R34-Y52 PolarHBondContact NH2-OH 3.39Å; R34-Y52 VanDerWaalsContact NH2-OH 3.12Å
35	F	94.9	Very high	94.5	Very high	102 Å²	102	71.8 Å²	71.8	45%	0.447	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-152.6	158.6	177.1	55.7	-88.3	0	0	0	110.5	C28 G29 C37	C28-F35 HydrophobicContact CB-CD2 4.29Å; C28-F35 HydrophobicContact CB-CE2 3.95Å; C28-F35 HydrophobicContact CB-CZ 4.3Å; C28-F35 PolarHBondContact N-O 2.89Å; C28-F35 PolarHBondContact O-N 2.74Å; G29-F35 VanDerWaalsContact CA-CE1 3.47Å; F35-C37 HydrophobicContact CD2-CB 4.22Å; F35-C37 HydrophobicContact CE2-CB 4.02Å
36	C	96.2	Very high	94.5	Very high	36 Å²	36	66.2 Å²	66.2	24%	0.243	35%	0.351	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.9	134.4	174.7	-59.4	0	0	0	0	110.8	C19 H24 F26	C19-C36 WeakPolarHBondContact CA-SG 3.17Å; C19-C36 HydrophobicContact CB-CB 3.73Å; C19-C36 WeakPolarHBondContact CB-SG 3.1Å; C19-C36 WeakPolarHBondContact SG-CA 3.33Å; C19-C36 WeakPolarHBondContact SG-CB 3.38Å; C19-C36 CovalentContact SG-SG 2.04Å; C19-C36 PolarHBondContact SG-SG 2.83Å; H24-C36 HydrophobicContact CB-CB 3.9Å; F26-C36 CarbonylContact O-C 3.4Å; F26-C36 VanDerWaalsContact O-CA 3.32Å; F26-C36 WeakPolarHBondContact O-CA 3.37Å
37	C	95	Very high	94.3	Very high	17 Å²	17	73.1 Å²	73.1	12%	0.115	38%	0.381	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.7	165	175.6	90.5	0	0	0	0	114.1	H24 R25 F26 C28 F35	H24-C37 CarbonylContact C-O 3.42Å; H24-C37 WeakPolarHBondContact CA-O 3.31Å; R25-C37 PolarHBondContact N-O 2.93Å; F26-C37 PolarHBondContact N-O 2.84Å; F26-C37 VanDerWaalsContact N-O 3.1Å; F26-C37 PolarHBondContact O-N 3.39Å; C28-C37 HydrophobicContact CB-CB 3.67Å; C28-C37 WeakPolarHBondContact CB-SG 3.44Å; C28-C37 WeakPolarHBondContact SG-CB 3.44Å; C28-C37 CovalentContact SG-SG 2.03Å; C28-C37 PolarHBondContact SG-SG 3.38Å; F35-C37 HydrophobicContact CD2-CB 4.22Å; F35-C37 HydrophobicContact CE2-CB 4.02Å
38	A	94.9	Very high	94.2	Very high	66 Å²	66	77.5 Å²	77.5	55%	0.545	41%	0.411	S	S	.	.	S	Bend	trans	-78.1	-28.7	-178.7	0	0	0	0	0	114	D23 F26 R40	D23-A38 WeakPolarHBondContact O-CA 3.44Å; D23-A38 WeakPolarHBondContact O-CB 3.25Å; F26-A38 WeakPolarHBondContact CD2-O 3.42Å; F26-A38 WeakPolarHBondContact CE2-O 3.2Å; A38-R40 PolarHBondContact O-N 2.95Å
39	D	94	Very high	94	Very high	67 Å²	67	78 Å²	78	36%	0.358	41%	0.414	S	S	.	.			trans	-90.7	110.2	-166.6	-175.2	-10.1	0	0	0	111.4	G41 K42	D39-G41 PolarHBondContact O-N 2.91Å; D39-G41 WeakPolarHBondContact OD1-CA 3.37Å; D39-G41 PolarHBondContact OD1-N 3.26Å; D39-K42 HydrophobicContact CB-CB 4.22Å; D39-K42 HydrophobicContact CB-CD 4.12Å; D39-K42 HydrophobicContact CB-CG 4.18Å; D39-K42 PolarHBondContact O-N 2.88Å; D39-K42 WeakPolarHBondContact OD2-CD 3.38Å; D39-K42 WeakPolarHBondContact OD2-CE 3.34Å; D39-K42 WeakPolarHBondContact OD2-CG 3.33Å; D39-K42 IonicContact OD2-NZ 2.71Å; D39-K42 PolarHBondContact OD2-NZ 3.23Å
40	R	91.3	Very high	93.8	Very high	194 Å²	194	82.5 Å²	82.5	73%	0.732	43%	0.43	S	S	*	.	G	3₁₀ helix	trans	-60.3	-28.4	177.4	-171.1	174.4	175.4	-177.4	-1.6	112.7	F26 A38 K42 R43	F26-R40 HydrophobicContact CD1-CB 4.42Å; F26-R40 HydrophobicContact CD1-CG 4.24Å; F26-R40 HydrophobicContact CD2-CB 4.14Å; F26-R40 HydrophobicContact CE1-CB 4.04Å; F26-R40 HydrophobicContact CE1-CG 3.78Å; F26-R40 HydrophobicContact CE2-CB 3.72Å; F26-R40 HydrophobicContact CE2-CG 4.39Å; F26-R40 HydrophobicContact CG-CB 4.48Å; F26-R40 HydrophobicContact CZ-CB 3.67Å; F26-R40 HydrophobicContact CZ-CG 3.87Å; A38-R40 PolarHBondContact O-N 2.95Å; R40-K42 PolarHBondContact O-N 3.47Å; R40-R43 VanDerWaalsContact O-CB 3.32Å; R40-R43 WeakPolarHBondContact O-CB 3.46Å; R40-R43 PolarHBondContact O-N 3.46Å
41	G	92.1	Very high	93.5	Very high	73 Å²	73	80.5 Å²	80.5	75%	0.753	42%	0.415	S	S	*	.	G	3₁₀ helix	trans	-72.7	-14.6	176.6	0	0	0	0	0	113.9	D39	D39-G41 PolarHBondContact O-N 2.91Å; D39-G41 WeakPolarHBondContact OD1-CA 3.37Å; D39-G41 PolarHBondContact OD1-N 3.26Å
42	K	92.7	Very high	93	Very high	139 Å²	139	82.3 Å²	82.3	60%	0.604	42%	0.418	S	S	*	.	G	3₁₀ helix	trans	-103.7	11.3	176.1	-64.5	179.5	-178	114.6	0	113.1	C28 D39 R40 L44	C28-K42 WeakPolarHBondContact CA-O 3.02Å; C28-K42 VanDerWaalsContact CB-O 3.28Å; C28-K42 WeakPolarHBondContact CB-O 3.45Å; D39-K42 HydrophobicContact CB-CB 4.22Å; D39-K42 HydrophobicContact CB-CD 4.12Å; D39-K42 HydrophobicContact CB-CG 4.18Å; D39-K42 PolarHBondContact O-N 2.88Å; D39-K42 WeakPolarHBondContact OD2-CD 3.38Å; D39-K42 WeakPolarHBondContact OD2-CE 3.34Å; D39-K42 WeakPolarHBondContact OD2-CG 3.33Å; D39-K42 IonicContact OD2-NZ 2.71Å; D39-K42 PolarHBondContact OD2-NZ 3.23Å; R40-K42 PolarHBondContact O-N 3.47Å; K42-L44 PolarHBondContact O-N 2.83Å
43	R	95.3	Very high	92.1	Very high	129 Å²	129	84.2 Å²	84.2	49%	0.487	43%	0.432	S	S	.	.	B	Isolated β-bridge	trans	-63.3	126.3	175.1	176.6	-179.1	163.4	136.2	-5.8	110.3	D1 F26 C27 R40	D1-R43 IonicContact OD1-CZ 3.73Å; D1-R43 IonicContact OD1-NH1 2.69Å; D1-R43 PolarHBondContact OD1-NH1 2.92Å; D1-R43 IonicContact OD2-CZ 3.31Å; D1-R43 VanDerWaalsContact OD2-CZ 3.31Å; D1-R43 IonicContact OD2-NE 3.58Å; D1-R43 IonicContact OD2-NH1 3.88Å; D1-R43 PolarHBondContact OD2-NH1 3.41Å; F26-R43 HydrophobicContact CB-CB 4.35Å; C27-R43 CarbonylContact O-C 3.41Å; C27-R43 VanDerWaalsContact O-CA 3.28Å; C27-R43 WeakPolarHBondContact O-CA 3.34Å; R40-R43 VanDerWaalsContact O-CB 3.32Å; R40-R43 WeakPolarHBondContact O-CB 3.46Å; R40-R43 PolarHBondContact O-N 3.46Å
44	L	95.4	Very high	90.7	Very high	24 Å²	24	81.1 Å²	81.1	13%	0.126	42%	0.418	C	S	.	.			trans	-73.1	130	176.5	177.3	63.7	0	0	0	111.1	C27 S30 R34 K42 Q46	C27-L44 PolarHBondContact O-N 3Å; S30-L44 VanDerWaalsContact O-CD2 3.26Å; S30-L44 WeakPolarHBondContact O-CD2 3.4Å; R34-L44 HydrophobicContact CG-CD2 3.8Å; K42-L44 PolarHBondContact O-N 2.83Å; L44-Q46 HydrophobicContact CB-CG 4.41Å; L44-Q46 HydrophobicContact CD2-CG 3.97Å; L44-Q46 HydrophobicContact CG-CG 4Å; L44-Q46 PolarHBondContact O-N 3.4Å
45	E	94.6	Very high	88.9	Confident	154 Å²	154	82.9 Å²	82.9	72%	0.72	43%	0.431	S	S	*	.			trans	-78	70	171.8	-63.1	-153.7	152.7	0	0	111.4	K47 S48	E45-K47 PolarHBondContact O-N 3.5Å; E45-S48 PolarHBondContact O-N 3.24Å; E45-S48 PolarHBondContact O-OG 2.92Å; E45-S48 VanDerWaalsContact O-OG 3.05Å
46	Q	93.4	Very high	87.1	Confident	21 Å²	21	84.4 Å²	84.4	10%	0.098	44%	0.439	C	S	.	.	G	3₁₀ helix	trans	-49.9	-27.6	-175.3	-67.4	-175.2	94.2	0	0	114.8	T2 W4 L44 S48 C49 Y52	T2-Q46 PolarHBondContact O-NE2 2.91Å; W4-Q46 HydrophobicContact CD2-CB 4.48Å; W4-Q46 HydrophobicContact CE3-CB 3.92Å; W4-Q46 HydrophobicContact CZ3-CB 4.17Å; L44-Q46 HydrophobicContact CB-CG 4.41Å; L44-Q46 HydrophobicContact CD2-CG 3.97Å; L44-Q46 HydrophobicContact CG-CG 4Å; L44-Q46 PolarHBondContact O-N 3.4Å; Q46-S48 PolarHBondContact O-N 3.35Å; Q46-C49 WeakPolarHBondContact O-CB 3.34Å; Q46-C49 PolarHBondContact O-N 3.42Å; Q46-C49 VanDerWaalsContact O-N 3.11Å; Q46-Y52 WeakPolarHBondContact CB-OH 3.49Å; Q46-Y52 PolarHBondContact O-OH 3.42Å
47	K	92.3	Very high	85.4	Confident	190 Å²	190	92 Å²	92	83%	0.826	46%	0.463	S	S	*	.	G	3₁₀ helix	trans	-63.5	-19.3	174.9	-69.9	-173.3	175.2	-173.4	0	114.8	W4 E45	W4-K47 HydrophobicContact CH2-CG 3.94Å; W4-K47 HydrophobicContact CZ3-CG 4.19Å; E45-K47 PolarHBondContact O-N 3.5Å
48	S	93.1	Very high	83.5	Confident	91 Å²	91	94 Å²	94	64%	0.636	47%	0.474	S	S	*	.	G	3₁₀ helix	trans	-89.2	-5.6	175.3	75.9	0	0	0	0	113.3	E45 Q46	E45-S48 PolarHBondContact O-N 3.24Å; E45-S48 PolarHBondContact O-OG 2.92Å; E45-S48 VanDerWaalsContact O-OG 3.05Å; Q46-S48 PolarHBondContact O-N 3.35Å
49	C	92.4	Very high	81.5	Confident	12 Å²	12	95.8 Å²	95.8	8%	0.081	47%	0.469	C	S	.	.			trans	-82.9	148.8	178.6	-59.2	0	0	0	0	111.1	C31 Q46 Y52	C31-C49 WeakPolarHBondContact CA-SG 3.4Å; C31-C49 HydrophobicContact CB-CB 3.68Å; C31-C49 WeakPolarHBondContact CB-SG 3.38Å; C31-C49 WeakPolarHBondContact SG-CA 3.5Å; C31-C49 WeakPolarHBondContact SG-CB 3.42Å; C31-C49 CovalentContact SG-SG 2.04Å; C31-C49 PolarHBondContact SG-SG 3.3Å; Q46-C49 WeakPolarHBondContact O-CB 3.34Å; Q46-C49 PolarHBondContact O-N 3.42Å; Q46-C49 VanDerWaalsContact O-N 3.11Å; C49-Y52 HydrophobicContact CB-CE2 3.68Å; C49-Y52 WeakPolarHBondContact O-CD2 3.32Å; C49-Y52 WeakPolarHBondContact O-CE2 3.28Å
50	N	89.7	Confident	79.5	Confident	133 Å²	133	98.5 Å²	98.5	71%	0.711	49%	0.488	S	S	*	.			trans	-120.6	-6.8	179.2	62.4	-9.9	0	0	0	113.6	Y52	N50-Y52 PolarHBondContact O-N 3.46Å
51	N	88.6	Confident	77.3	Confident	12 Å²	12	94.6 Å²	94.6	6%	0.064	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	-77.9	40.9	-178.1	67.5	-36.2	0	0	0	113.6	Y6 Y7 C31 F32 R34	Y6-N51 WeakPolarHBondContact CA-O 3.41Å; Y7-N51 PolarHBondContact N-O 2.97Å; Y7-N51 PolarHBondContact O-ND2 3.41Å; C31-N51 VanDerWaalsContact C-ND2 3.27Å; C31-N51 PolarHBondContact O-ND2 2.77Å; C31-N51 PolarHBondContact O-OD1 2.67Å; F32-N51 HydrophobicContact CD1-CB 4.22Å; F32-N51 WeakPolarHBondContact CD1-ND2 3.37Å; F32-N51 HydrophobicContact CE1-CB 3.78Å; F32-N51 HydrophobicContact CZ-CB 4.32Å; R34-N51 PolarHBondContact NH2-OD1 3.4Å
52	Y	82.8	Confident	75.1	Confident	64 Å²	64	96.1 Å²	96.1	25%	0.251	49%	0.487	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.5	-38.7	-179.6	-68.8	-62.4	0	0	0	112.9	W4 G5 R34 Q46 C49 N50	W4-Y52 HydrophobicContact CB-CE1 3.79Å; W4-Y52 HydrophobicContact CE3-CE1 4.17Å; W4-Y52 HydrophobicContact CE3-CE2 4.4Å; W4-Y52 AromaticContact CE3-CZ 3.79Å; G5-Y52 WeakPolarHBondContact O-CD1 3.47Å; G5-Y52 WeakPolarHBondContact O-CE1 3.07Å; R34-Y52 VanDerWaalsContact CZ-OH 3.31Å; R34-Y52 VanDerWaalsContact NH1-CE1 3.34Å; R34-Y52 PolarHBondContact NH1-OH 2.99Å; R34-Y52 PolarHBondContact NH2-OH 3.39Å; R34-Y52 VanDerWaalsContact NH2-OH 3.12Å; Q46-Y52 WeakPolarHBondContact CB-OH 3.49Å; Q46-Y52 PolarHBondContact O-OH 3.42Å; C49-Y52 HydrophobicContact CB-CE2 3.68Å; C49-Y52 WeakPolarHBondContact O-CD2 3.32Å; C49-Y52 WeakPolarHBondContact O-CE2 3.28Å; N50-Y52 PolarHBondContact O-N 3.46Å
53	N	75.2	Confident	72.8	Confident	129 Å²	129	95.3 Å²	95.3	69%	0.69	50%	0.496	S	S	*	.	S	Bend	trans	-77.4	148.3	172.1	-66.1	-26.2	0	0	0	109.4	Y7	Y7-N53 WeakPolarHBondContact CD2-O 3.4Å
54	T	64.5	Low	70.2	Confident	42 Å²	42	94.8 Å²	94.8	26%	0.258	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-52	126.4	156	30.7	0	0	0	0	107.9	Y7 V58	Y7-T54 HydrophobicContact CE1-CG2 3.98Å; Y7-T54 HydrophobicContact CE2-CG2 4.22Å; Y7-T54 WeakPolarHBondContact OH-CG2 3.48Å; T54-V58 HydrophobicContact CG2-CB 4.29Å; T54-V58 HydrophobicContact CG2-CG1 3.97Å
55	P	58.8	Low	67.9	Low	46 Å²	46	99.2 Å²	99.2	30%	0.299	54%	0.538	S	S	.	.	P	Polyproline II helix	trans	-63.3	143.9	169.5	29.3	-33.9	0	0	0	108.2	W57 V58	P55-W57 HydrophobicContact CG-CD2 4.32Å; P55-W57 HydrophobicContact CG-CZ2 3.89Å; P55-W57 PolarHBondContact O-N 3.32Å; P55-V58 HydrophobicContact CG-CG2 3.98Å; P55-V58 PolarHBondContact O-N 2.99Å
56	E	56.9	Low	65.2	Low	133 Å²	133	96.7 Å²	96.7	62%	0.621	53%	0.533	S	S	*	.	G	3₁₀ helix	trans	-55.3	-25.8	-169.6	-67.8	-66.8	132.7	0	0	113.6	V58 K59	E56-V58 PolarHBondContact O-N 3.45Å; E56-K59 WeakPolarHBondContact O-CA 3.44Å; E56-K59 WeakPolarHBondContact O-CB 3.4Å; E56-K59 PolarHBondContact O-N 2.93Å; E56-K59 WeakPolarHBondContact OE1-CE 3.26Å; E56-K59 IonicContact OE1-NZ 2.78Å; E56-K59 PolarHBondContact OE1-NZ 3.38Å; E56-K59 IonicContact OE2-NZ 3.12Å
57	W	60.4	Low	63	Low	197 Å²	197	101 Å²	101	75%	0.746	56%	0.563	S	S	*	*	G	3₁₀ helix	trans	-67.2	-16.4	175.3	64.6	-100.1	0	0	0	114.8	P55	P55-W57 HydrophobicContact CG-CD2 4.32Å; P55-W57 HydrophobicContact CG-CZ2 3.89Å; P55-W57 PolarHBondContact O-N 3.32Å
58	V	55.4	Low	61	Low	57 Å²	57	97.4 Å²	97.4	35%	0.345	57%	0.568	S	S	.	*	G	3₁₀ helix	trans	-88.7	-21	170.6	-179.8	0	0	0	0	111.4	T54 P55 E56 V60	T54-V58 HydrophobicContact CG2-CB 4.29Å; T54-V58 HydrophobicContact CG2-CG1 3.97Å; P55-V58 HydrophobicContact CG-CG2 3.98Å; P55-V58 PolarHBondContact O-N 2.99Å; E56-V58 PolarHBondContact O-N 3.45Å; V58-V60 VanDerWaalsContact C-N 3.29Å; V58-V60 PolarHBondContact O-N 3.39Å
59	K	52.5	Low	59	Low	104 Å²	104	95.5 Å²	95.5	45%	0.452	56%	0.563	S	S	.	*	S	Bend	trans	-75.7	88.2	167.5	-64.8	-177.3	-170.8	166.7	0	108.4	E56 P61	E56-K59 WeakPolarHBondContact O-CA 3.44Å; E56-K59 WeakPolarHBondContact O-CB 3.4Å; E56-K59 PolarHBondContact O-N 2.93Å; E56-K59 WeakPolarHBondContact OE1-CE 3.26Å; E56-K59 IonicContact OE1-NZ 2.78Å; E56-K59 PolarHBondContact OE1-NZ 3.38Å; E56-K59 IonicContact OE2-NZ 3.12Å; K59-P61 VanDerWaalsContact O-N 3.17Å
60	V	52	Low	57	Low	124 Å²	124	102.4 Å²	102.4	75%	0.752	60%	0.599	S	S	*	*			trans	-45.4	125.1	156.7	-173.1	0	0	0	0	106.6	V58 S62	V58-V60 VanDerWaalsContact C-N 3.29Å; V58-V60 PolarHBondContact O-N 3.39Å; V60-S62 PolarHBondContact O-N 2.98Å; V60-S62 VanDerWaalsContact O-N 3.1Å
61	P	45.1	Very low	55.5	Low	113 Å²	113	103.7 Å²	103.7	73%	0.734	61%	0.605	S	S	*	*			trans	-56.5	124.1	-176.1	21.8	-32.9	0	0	0	108.6	K59	K59-P61 VanDerWaalsContact O-N 3.17Å
62	S	46.3	Very low	54.1	Low	104 Å²	104	111.1 Å²	111.1	73%	0.727	63%	0.633	S	S	*	*			trans	-47.2	128.8	179.1	-52.3	0	0	0	0	108.8	V60 T64	V60-S62 PolarHBondContact O-N 2.98Å; V60-S62 VanDerWaalsContact O-N 3.1Å; S62-T64 PolarHBondContact O-N 2.99Å
63	P	44.3	Very low	52.7	Low	122 Å²	122	112.9 Å²	112.9	79%	0.792	65%	0.646	S	S	*	*			trans	-59	106.3	-176.4	22.4	-32.3	0	0	0	108.9
64	T	40.5	Very low	52.1	Low	118 Å²	118	110.4 Å²	110.4	72%	0.724	64%	0.637	S	S	*	*			trans	-58.5	129.6	172.1	-61	0	0	0	0	106	S62 T66	S62-T64 PolarHBondContact O-N 2.99Å; T64-T66 PolarHBondContact O-N 3.12Å
65	P	46.6	Very low	52	Low	117 Å²	117	115.6 Å²	115.6	76%	0.76	66%	0.659	S	S	*	*			trans	-53.9	114.9	-167.5	19.6	-33.2	0	0	0	110.4	P67	P65-P67 WeakPolarHBondContact O-CD 3.41Å
66	T	39.3	Very low	52	Low	102 Å²	102	119.8 Å²	119.8	63%	0.626	68%	0.678	S	S	*	*			trans	-56.5	118.7	-168.7	-43.8	0	0	0	0	110.1	T64 A68	T64-T66 PolarHBondContact O-N 3.12Å; T66-A68 PolarHBondContact O-N 3Å
67	P	45.8	Very low	52	Low	112 Å²	112	116.5 Å²	116.5	73%	0.727	67%	0.665	S	S	*	*			trans	-59.7	121.9	165.6	-17.8	31.5	0	0	0	107.3	P65 G69	P65-P67 WeakPolarHBondContact O-CD 3.41Å; P67-G69 PolarHBondContact O-N 3.46Å
68	A	50.1	Low	52.2	Low	113 Å²	113	113.4 Å²	113.4	93%	0.934	66%	0.658	S	S	*	*	S	Bend	trans	-56.1	109.5	-170.9	0	0	0	0	0	111.2	T66	T66-A68 PolarHBondContact O-N 3Å
69	G	52.5	Low	53	Low	52 Å²	52	114.9 Å²	114.9	54%	0.536	67%	0.668	S	S	.	*			trans	166.3	55.7	-164.2	0	0	0	0	0	112.7	P67 I71	P67-G69 PolarHBondContact O-N 3.46Å; G69-I71 PolarHBondContact O-N 2.93Å
70	D	48.8	Very low	54	Low	156 Å²	156	113.7 Å²	113.7	83%	0.834	67%	0.666	S	S	*	*			trans	-66.2	83	166.3	-68	-42.3	0	0	0	109.1	Y72	D70-Y72 VanDerWaalsContact C-N 3.3Å; D70-Y72 PolarHBondContact O-N 3.18Å
71	I	58.9	Low	55.4	Low	161 Å²	161	110.3 Å²	110.3	83%	0.826	65%	0.646	S	S	*	*			trans	-70.3	95.3	168.4	-62.3	175	0	0	0	106.3	G69 D73	G69-I71 PolarHBondContact O-N 2.93Å; I71-D73 PolarHBondContact O-N 2.71Å
72	Y	58.7	Low	57.2	Low	168 Å²	168	108.3 Å²	108.3	66%	0.659	63%	0.632	S	S	*	*			trans	-52.7	110.3	170.4	174	-92.9	0	0	0	109.5	D70 P74	D70-Y72 VanDerWaalsContact C-N 3.3Å; D70-Y72 PolarHBondContact O-N 3.18Å; Y72-P74 HydrophobicContact CD1-CB 4.38Å; Y72-P74 HydrophobicContact CE1-CB 3.9Å; Y72-P74 WeakPolarHBondContact O-CD 3.32Å
73	D	54.9	Low	59.3	Low	100 Å²	100	107.7 Å²	107.7	54%	0.535	62%	0.623	S	S	.	*			trans	-85.7	108.5	175.1	-174.2	-16.4	0	0	0	109.1	I71 E75	I71-D73 PolarHBondContact O-N 2.71Å; D73-E75 VanDerWaalsContact C-N 3.28Å; D73-E75 PolarHBondContact O-N 2.66Å; D73-E75 PolarHBondContact OD1-N 2.91Å; D73-E75 VanDerWaalsContact OD1-N 3.08Å
74	P	61.6	Low	61.5	Low	77 Å²	77	110.1 Å²	110.1	50%	0.5	62%	0.618	S	S	.	*	H	α-helix	trans	-74	-16.4	-174.4	32.4	-36.7	0	0	0	113.4	Y72 Q78	Y72-P74 HydrophobicContact CD1-CB 4.38Å; Y72-P74 HydrophobicContact CE1-CB 3.9Å; Y72-P74 WeakPolarHBondContact O-CD 3.32Å; P74-Q78 PolarHBondContact O-N 3.34Å
75	E	62.1	Low	63.9	Low	152 Å²	152	109.9 Å²	109.9	71%	0.71	61%	0.611	S	S	*	*	H	α-helix	trans	-77.3	-34.6	-171.6	-60.7	-160.8	159.3	0	0	112.1	D73 Q78	D73-E75 VanDerWaalsContact C-N 3.28Å; D73-E75 PolarHBondContact O-N 2.66Å; D73-E75 PolarHBondContact OD1-N 2.91Å; D73-E75 VanDerWaalsContact OD1-N 3.08Å; E75-Q78 PolarHBondContact O-N 2.91Å
76	L	58.7	Low	66.2	Low	134 Å²	134	107.6 Å²	107.6	70%	0.702	60%	0.595	S	S	*	*	H	α-helix	trans	-67.7	-42.1	-178	-170.8	62	0	0	0	112.3	T79	L76-T79 PolarHBondContact O-OG1 3.32Å
77	D	57.9	Low	68.9	Low	63 Å²	63	106.5 Å²	106.5	34%	0.337	59%	0.591	S	S	.	*	H	α-helix	trans	-82.3	-13.6	-179.2	-161.9	41	0	0	0	113.7	T79 N80 T81	D77-T79 PolarHBondContact O-N 2.91Å; D77-N80 PolarHBondContact O-N 3Å; D77-T81 WeakPolarHBondContact O-CB 3.34Å; D77-T81 WeakPolarHBondContact O-CG2 3.04Å; D77-T81 PolarHBondContact O-N 3.39Å; D77-T81 PolarHBondContact O-OG1 3.28Å; D77-T81 VanDerWaalsContact OD2-CG2 3.25Å; D77-T81 WeakPolarHBondContact OD2-CG2 3.47Å
78	Q	64.9	Low	71.3	Confident	132 Å²	132	103.1 Å²	103.1	62%	0.617	58%	0.576	S	S	*	*	H	α-helix	trans	-57.7	-31.9	174.5	-170.4	176.1	81.6	0	0	111.9	P74 E75 T81 T82	P74-Q78 PolarHBondContact O-N 3.34Å; E75-Q78 PolarHBondContact O-N 2.91Å; Q78-T81 WeakPolarHBondContact CA-OG1 3.44Å; Q78-T81 PolarHBondContact O-OG1 2.91Å; Q78-T82 WeakPolarHBondContact O-CB 3.35Å; Q78-T82 PolarHBondContact O-N 3.39Å; Q78-T82 VanDerWaalsContact O-N 3.16Å; Q78-T82 PolarHBondContact O-OG1 3.18Å
79	T	70.7	Confident	73.5	Confident	88 Å²	88	101.6 Å²	101.6	54%	0.54	56%	0.555	S	S	.	*	H	α-helix	trans	-69.8	-52.7	176.9	61.6	0	0	0	0	112.3	L76 D77 T82 V83	L76-T79 PolarHBondContact O-OG1 3.32Å; D77-T79 PolarHBondContact O-N 2.91Å; T79-T82 PolarHBondContact O-N 2.88Å; T79-V83 WeakPolarHBondContact O-CG2 3.2Å; T79-V83 PolarHBondContact O-N 3.16Å
80	N	74.8	Confident	75.6	Confident	79 Å²	79	103.8 Å²	103.8	42%	0.422	55%	0.554	S	S	.	*	H	α-helix	trans	-63	-49.8	-179.2	-63.5	-49.2	0	0	0	111.4	D77 T82 V83 Y84	D77-N80 PolarHBondContact O-N 3Å; N80-T82 VanDerWaalsContact C-N 3.33Å; N80-T82 PolarHBondContact O-N 2.95Å; N80-V83 PolarHBondContact O-N 3.29Å; N80-V83 VanDerWaalsContact O-N 3.12Å; N80-Y84 HydrophobicContact CB-CE2 4.29Å; N80-Y84 WeakPolarHBondContact O-CD2 3.38Å; N80-Y84 PolarHBondContact O-N 3.29Å
81	T	80.8	Confident	77.9	Confident	54 Å²	54	99 Å²	99	33%	0.331	54%	0.536	S	S	.	.	H	α-helix	trans	-58.2	-43.5	177.6	51.8	0	0	0	0	111.8	D77 Q78 V83 Y84 I85	D77-T81 WeakPolarHBondContact O-CB 3.34Å; D77-T81 WeakPolarHBondContact O-CG2 3.04Å; D77-T81 PolarHBondContact O-N 3.39Å; D77-T81 PolarHBondContact O-OG1 3.28Å; D77-T81 VanDerWaalsContact OD2-CG2 3.25Å; D77-T81 WeakPolarHBondContact OD2-CG2 3.47Å; Q78-T81 WeakPolarHBondContact CA-OG1 3.44Å; Q78-T81 PolarHBondContact O-OG1 2.91Å; T81-V83 PolarHBondContact O-N 2.72Å; T81-Y84 PolarHBondContact O-N 3.46Å; T81-I85 WeakPolarHBondContact O-CB 3.49Å; T81-I85 WeakPolarHBondContact O-CD1 3.46Å; T81-I85 WeakPolarHBondContact O-CG1 3.44Å; T81-I85 PolarHBondContact O-N 3.41Å
82	T	83.8	Confident	79.7	Confident	71 Å²	71	96.3 Å²	96.3	44%	0.436	52%	0.522	S	S	.	.	H	α-helix	trans	-61.9	-41.2	175	-61.1	0	0	0	0	112	Q78 T79 N80 T86	Q78-T82 WeakPolarHBondContact O-CB 3.35Å; Q78-T82 PolarHBondContact O-N 3.39Å; Q78-T82 VanDerWaalsContact O-N 3.16Å; Q78-T82 PolarHBondContact O-OG1 3.18Å; T79-T82 PolarHBondContact O-N 2.88Å; N80-T82 VanDerWaalsContact C-N 3.33Å; N80-T82 PolarHBondContact O-N 2.95Å; T82-T86 HydrophobicContact CG2-CG2 4.25Å; T82-T86 WeakPolarHBondContact O-CB 3.43Å; T82-T86 WeakPolarHBondContact O-CG2 3.03Å; T82-T86 PolarHBondContact O-N 3.08Å; T82-T86 PolarHBondContact O-OG1 2.95Å
83	V	90.6	Very high	81.5	Confident	90 Å²	90	93.3 Å²	93.3	55%	0.545	52%	0.517	S	S	.	.	H	α-helix	trans	-63.9	-44.6	176	169.8	0	0	0	0	111.4	T79 N80 T81 T86 C87	T79-V83 WeakPolarHBondContact O-CG2 3.2Å; T79-V83 PolarHBondContact O-N 3.16Å; N80-V83 PolarHBondContact O-N 3.29Å; N80-V83 VanDerWaalsContact O-N 3.12Å; T81-V83 PolarHBondContact O-N 2.72Å; V83-T86 PolarHBondContact O-OG1 2.98Å; V83-C87 WeakPolarHBondContact O-CB 3.08Å; V83-C87 PolarHBondContact O-N 2.74Å
84	Y	89.7	Confident	83.5	Confident	174 Å²	174	93.2 Å²	93.2	68%	0.682	52%	0.515	S	S	*	.	H	α-helix	trans	-66.2	-42.2	176.9	-70.2	-60	0	0	0	112.9	N80 T81 G88	N80-Y84 HydrophobicContact CB-CE2 4.29Å; N80-Y84 WeakPolarHBondContact O-CD2 3.38Å; N80-Y84 PolarHBondContact O-N 3.29Å; T81-Y84 PolarHBondContact O-N 3.46Å; Y84-G88 PolarHBondContact O-N 2.86Å
85	I	91.5	Very high	85.2	Confident	113 Å²	113	91.5 Å²	91.5	58%	0.579	51%	0.507	S	S	*	.	H	α-helix	trans	-63.9	-49	177.6	-69.1	164.1	0	0	0	110.8	T81 G88 V89	T81-I85 WeakPolarHBondContact O-CB 3.49Å; T81-I85 WeakPolarHBondContact O-CD1 3.46Å; T81-I85 WeakPolarHBondContact O-CG1 3.44Å; T81-I85 PolarHBondContact O-N 3.41Å; I85-G88 PolarHBondContact O-N 2.96Å; I85-V89 WeakPolarHBondContact O-CG2 3.39Å; I85-V89 PolarHBondContact O-N 2.82Å
86	T	94.9	Very high	86.9	Confident	69 Å²	69	89.2 Å²	89.2	42%	0.423	50%	0.499	S	S	.	.	H	α-helix	trans	-65.5	-43.1	179.4	51.6	0	0	0	0	112	T82 V83 G88 V89 I90	T82-T86 HydrophobicContact CG2-CG2 4.25Å; T82-T86 WeakPolarHBondContact O-CB 3.43Å; T82-T86 WeakPolarHBondContact O-CG2 3.03Å; T82-T86 PolarHBondContact O-N 3.08Å; T82-T86 PolarHBondContact O-OG1 2.95Å; V83-T86 PolarHBondContact O-OG1 2.98Å; T86-G88 VanDerWaalsContact C-N 3.35Å; T86-G88 PolarHBondContact O-N 3.39Å; T86-V89 PolarHBondContact O-N 3.06Å; T86-I90 WeakPolarHBondContact O-CD1 3.04Å; T86-I90 VanDerWaalsContact O-CG1 3.25Å; T86-I90 WeakPolarHBondContact O-CG1 3.41Å; T86-I90 PolarHBondContact O-N 3.12Å
87	C	94.4	Very high	88.6	Confident	78 Å²	78	84.9 Å²	84.9	53%	0.527	49%	0.486	S	S	.	.	H	α-helix	trans	-60.5	-43.2	174.5	-173.3	0	0	0	0	111.9	V83 I90 A91	V83-C87 WeakPolarHBondContact O-CB 3.08Å; V83-C87 PolarHBondContact O-N 2.74Å; C87-I90 PolarHBondContact O-N 3.34Å; C87-A91 WeakPolarHBondContact O-CB 3.01Å; C87-A91 PolarHBondContact O-N 2.77Å
88	G	96.3	Very high	90.4	Very high	41 Å²	41	86.7 Å²	86.7	42%	0.423	50%	0.495	S	S	.	.	H	α-helix	trans	-63	-43.1	177.5	0	0	0	0	0	113.2	Y84 I85 T86 A91 L92	Y84-G88 PolarHBondContact O-N 2.86Å; I85-G88 PolarHBondContact O-N 2.96Å; T86-G88 VanDerWaalsContact C-N 3.35Å; T86-G88 PolarHBondContact O-N 3.39Å; G88-A91 PolarHBondContact O-N 2.85Å; G88-L92 WeakPolarHBondContact O-CB 3.44Å; G88-L92 PolarHBondContact O-N 2.74Å
89	V	97.2	Very high	91.8	Very high	81 Å²	81	87.8 Å²	87.8	49%	0.491	50%	0.498	S	S	.	.	H	α-helix	trans	-64.1	-43.9	175.4	170.5	0	0	0	0	111.3	I85 T86 L92 I93	I85-V89 WeakPolarHBondContact O-CG2 3.39Å; I85-V89 PolarHBondContact O-N 2.82Å; T86-V89 PolarHBondContact O-N 3.06Å; V89-L92 PolarHBondContact O-N 3.02Å; V89-I93 HydrophobicContact CG1-CD1 3.84Å; V89-I93 WeakPolarHBondContact O-CG1 3.45Å; V89-I93 PolarHBondContact O-N 3.33Å
90	I	96.6	Very high	92.9	Very high	99 Å²	99	86.3 Å²	86.3	51%	0.508	49%	0.494	S	S	.	.	H	α-helix	trans	-62.1	-46	177.3	-68.8	164.4	0	0	0	110.8	T86 C87 L92 I93 I94	T86-I90 WeakPolarHBondContact O-CD1 3.04Å; T86-I90 VanDerWaalsContact O-CG1 3.25Å; T86-I90 WeakPolarHBondContact O-CG1 3.41Å; T86-I90 PolarHBondContact O-N 3.12Å; C87-I90 PolarHBondContact O-N 3.34Å; I90-L92 VanDerWaalsContact C-N 3.33Å; I90-L92 PolarHBondContact O-N 3.22Å; I90-I93 PolarHBondContact O-N 3.15Å; I90-I94 HydrophobicContact CG2-CD1 3.82Å; I90-I94 WeakPolarHBondContact O-CG1 3.32Å; I90-I94 PolarHBondContact O-N 2.86Å
91	A	96.7	Very high	93.7	Very high	55 Å²	55	88.1 Å²	88.1	46%	0.455	50%	0.498	S	S	.	.	H	α-helix	trans	-60.9	-40.4	177.2	0	0	0	0	0	112.4	C87 G88 I94 A95	C87-A91 WeakPolarHBondContact O-CB 3.01Å; C87-A91 PolarHBondContact O-N 2.77Å; G88-A91 PolarHBondContact O-N 2.85Å; A91-I94 PolarHBondContact O-N 2.95Å; A91-A95 WeakPolarHBondContact O-CB 3.32Å; A91-A95 PolarHBondContact O-N 2.97Å
92	L	96.9	Very high	94.2	Very high	104 Å²	104	89 Å²	89	55%	0.545	50%	0.504	S	S	.	.	H	α-helix	trans	-66.6	-40.5	177.1	-178.8	143	0	0	0	112.3	G88 V89 I90 A95 I96	G88-L92 WeakPolarHBondContact O-CB 3.44Å; G88-L92 PolarHBondContact O-N 2.74Å; V89-L92 PolarHBondContact O-N 3.02Å; I90-L92 VanDerWaalsContact C-N 3.33Å; I90-L92 PolarHBondContact O-N 3.22Å; L92-A95 PolarHBondContact O-N 3.1Å; L92-I96 HydrophobicContact CD2-CD1 3.6Å; L92-I96 HydrophobicContact CG-CD1 4.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.04Å; L92-I96 PolarHBondContact O-N 3.04Å
93	I	97.1	Very high	94.3	Very high	106 Å²	106	88.5 Å²	88.5	54%	0.544	51%	0.507	S	S	.	.	H	α-helix	trans	-62.7	-44.8	174.3	-68.9	164.9	0	0	0	110.8	V89 I90 I96 G97	V89-I93 HydrophobicContact CG1-CD1 3.84Å; V89-I93 WeakPolarHBondContact O-CG1 3.45Å; V89-I93 PolarHBondContact O-N 3.33Å; I90-I93 PolarHBondContact O-N 3.15Å; I93-I96 PolarHBondContact O-N 3.26Å; I93-G97 PolarHBondContact O-N 2.93Å
94	I	97.1	Very high	94.3	Very high	98 Å²	98	91.4 Å²	91.4	50%	0.503	51%	0.509	S	S	.	.	H	α-helix	trans	-62.2	-44.7	177.1	-68.3	166.9	0	0	0	110.8	I90 A91 G97 I98	I90-I94 HydrophobicContact CG2-CD1 3.82Å; I90-I94 WeakPolarHBondContact O-CG1 3.32Å; I90-I94 PolarHBondContact O-N 2.86Å; A91-I94 PolarHBondContact O-N 2.95Å; I94-G97 PolarHBondContact O-N 2.96Å; I94-I98 HydrophobicContact CG2-CD1 3.84Å; I94-I98 WeakPolarHBondContact O-CG1 3.28Å; I94-I98 PolarHBondContact O-N 2.69Å
95	A	96.7	Very high	94	Very high	40 Å²	40	86.4 Å²	86.4	33%	0.331	49%	0.494	S	S	.	.	H	α-helix	trans	-59.8	-48	177	0	0	0	0	0	111.9	A91 L92 G97 I98 F99	A91-A95 WeakPolarHBondContact O-CB 3.32Å; A91-A95 PolarHBondContact O-N 2.97Å; L92-A95 PolarHBondContact O-N 3.1Å; A95-G97 VanDerWaalsContact C-N 3.32Å; A95-G97 PolarHBondContact O-N 2.95Å; A95-I98 PolarHBondContact O-N 3.4Å; A95-F99 WeakPolarHBondContact O-CD2 3.32Å; A95-F99 PolarHBondContact O-N 2.83Å
96	I	97.2	Very high	93.3	Very high	105 Å²	105	88.4 Å²	88.4	54%	0.538	50%	0.498	S	S	.	.	H	α-helix	trans	-59.8	-42.6	175.9	-69.6	171.1	0	0	0	110.9	L92 I93 I98 F99 A100	L92-I96 HydrophobicContact CD2-CD1 3.6Å; L92-I96 HydrophobicContact CG-CD1 4.24Å; L92-I96 WeakPolarHBondContact O-CG1 3.04Å; L92-I96 PolarHBondContact O-N 3.04Å; I93-I96 PolarHBondContact O-N 3.26Å; I96-I98 PolarHBondContact O-N 3.42Å; I96-F99 PolarHBondContact O-N 2.96Å; I96-A100 VanDerWaalsContact O-CB 3.26Å; I96-A100 WeakPolarHBondContact O-CB 3.36Å; I96-A100 PolarHBondContact O-N 3.13Å
97	G	95.3	Very high	92.4	Very high	42 Å²	42	89.1 Å²	89.1	43%	0.433	51%	0.512	S	S	.	.	H	α-helix	trans	-59.2	-43.2	175.7	0	0	0	0	0	113.1	I93 I94 A95 K101	I93-G97 PolarHBondContact O-N 2.93Å; I94-G97 PolarHBondContact O-N 2.96Å; A95-G97 VanDerWaalsContact C-N 3.32Å; A95-G97 PolarHBondContact O-N 2.95Å; G97-K101 VanDerWaalsContact O-CB 3.31Å; G97-K101 WeakPolarHBondContact O-CB 2.98Å; G97-K101 PolarHBondContact O-N 2.8Å
98	I	95.8	Very high	91.4	Very high	102 Å²	102	88.6 Å²	88.6	52%	0.523	51%	0.506	S	S	.	.	H	α-helix	trans	-67.1	-46	176.4	-66.3	165.5	0	0	0	111	I94 A95 I96 A100 K101 V102	I94-I98 HydrophobicContact CG2-CD1 3.84Å; I94-I98 WeakPolarHBondContact O-CG1 3.28Å; I94-I98 PolarHBondContact O-N 2.69Å; A95-I98 PolarHBondContact O-N 3.4Å; I96-I98 PolarHBondContact O-N 3.42Å; I98-A100 PolarHBondContact O-N 2.86Å; I98-K101 PolarHBondContact O-N 3.05Å; I98-V102 HydrophobicContact CG2-CG2 4.43Å; I98-V102 WeakPolarHBondContact O-CG2 3.49Å; I98-V102 PolarHBondContact O-N 3.02Å
99	F	94.2	Very high	90.1	Very high	155 Å²	155	93.4 Å²	93.4	68%	0.68	52%	0.515	S	S	*	.	H	α-helix	trans	-62.6	-41.9	177.1	-78.4	-63.4	0	0	0	112.2	A95 I96 V102 A103	A95-F99 WeakPolarHBondContact O-CD2 3.32Å; A95-F99 PolarHBondContact O-N 2.83Å; I96-F99 PolarHBondContact O-N 2.96Å; F99-V102 PolarHBondContact O-N 2.62Å; F99-A103 WeakPolarHBondContact O-CB 3.06Å; F99-A103 PolarHBondContact O-N 2.83Å
100	A	94.3	Very high	88.5	Confident	56 Å²	56	94.7 Å²	94.7	46%	0.463	53%	0.525	S	S	.	.	H	α-helix	trans	-62.7	-43.4	174.3	0	0	0	0	0	111.6	I96 I98 A103 Y104	I96-A100 VanDerWaalsContact O-CB 3.26Å; I96-A100 WeakPolarHBondContact O-CB 3.36Å; I96-A100 PolarHBondContact O-N 3.13Å; I98-A100 PolarHBondContact O-N 2.86Å; A100-A103 PolarHBondContact O-N 3.05Å; A100-Y104 VanDerWaalsContact O-CB 3.24Å; A100-Y104 WeakPolarHBondContact O-CB 3.49Å; A100-Y104 PolarHBondContact O-N 2.04Å
101	K	91.5	Very high	86.8	Confident	117 Å²	117	95.8 Å²	95.8	51%	0.509	54%	0.539	S	S	.	.	H	α-helix	trans	-60.8	-45.3	175.3	-173.8	67.1	172	75.3	0	111.9	G97 I98 Y104 D105	G97-K101 VanDerWaalsContact O-CB 3.31Å; G97-K101 WeakPolarHBondContact O-CB 2.98Å; G97-K101 PolarHBondContact O-N 2.8Å; I98-K101 PolarHBondContact O-N 3.05Å; K101-Y104 PolarHBondContact O-N 3.41Å; K101-D105 IonicContact NZ-OD1 2.66Å; K101-D105 PolarHBondContact NZ-OD1 3.23Å; K101-D105 IonicContact NZ-OD2 3.67Å; K101-D105 PolarHBondContact NZ-OD2 3.12Å; K101-D105 VanDerWaalsContact O-CB 3.31Å; K101-D105 WeakPolarHBondContact O-CB 3.43Å; K101-D105 PolarHBondContact O-N 2.79Å
102	V	90.4	Very high	85.1	Confident	74 Å²	74	101.5 Å²	101.5	45%	0.448	56%	0.556	S	S	.	*	H	α-helix	trans	-69.4	-34.4	179.1	171.3	0	0	0	0	112.3	I98 F99 K106	I98-V102 HydrophobicContact CG2-CG2 4.43Å; I98-V102 WeakPolarHBondContact O-CG2 3.49Å; I98-V102 PolarHBondContact O-N 3.02Å; F99-V102 PolarHBondContact O-N 2.62Å; V102-K106 WeakPolarHBondContact O-CG 3.45Å; V102-K106 PolarHBondContact O-N 2.92Å
103	A	86.7	Confident	83	Confident	59 Å²	59	104.7 Å²	104.7	49%	0.488	57%	0.568	S	S	.	*	H	α-helix	trans	-68.6	-44.6	172.6	0	0	0	0	0	111.3	F99 A100 K106 A107	F99-A103 WeakPolarHBondContact O-CB 3.06Å; F99-A103 PolarHBondContact O-N 2.83Å; A100-A103 PolarHBondContact O-N 3.05Å; A103-K106 PolarHBondContact O-N 2.89Å; A103-A107 WeakPolarHBondContact O-CB 3.43Å; A103-A107 PolarHBondContact O-N 2.97Å
104	Y	89.4	Confident	81.1	Confident	151 Å²	151	107.4 Å²	107.4	59%	0.592	58%	0.581	S	S	*	*	H	α-helix	trans	-63	-46.6	176.7	-169.5	-91.5	0	0	0	111.6	A100 K101 K106 A107 T108	A100-Y104 VanDerWaalsContact O-CB 3.24Å; A100-Y104 WeakPolarHBondContact O-CB 3.49Å; A100-Y104 PolarHBondContact O-N 2.04Å; K101-Y104 PolarHBondContact O-N 3.41Å; Y104-K106 PolarHBondContact O-N 2.66Å; Y104-K106 VanDerWaalsContact O-N 3.16Å; Y104-A107 PolarHBondContact O-N 3.11Å; Y104-A107 VanDerWaalsContact O-N 3.11Å; Y104-T108 HydrophobicContact CD1-CG2 4.03Å; Y104-T108 VanDerWaalsContact CD1-OG1 3.31Å; Y104-T108 WeakPolarHBondContact CD1-OG1 3.24Å; Y104-T108 HydrophobicContact CD2-CG2 4.02Å; Y104-T108 HydrophobicContact CE1-CG2 3.72Å; Y104-T108 VanDerWaalsContact CE1-OG1 3.3Å; Y104-T108 WeakPolarHBondContact CE1-OG1 3.04Å; Y104-T108 HydrophobicContact CE2-CG2 3.7Å; Y104-T108 HydrophobicContact CG-CG2 4.18Å; Y104-T108 WeakPolarHBondContact O-CB 3.44Å; Y104-T108 PolarHBondContact O-N 2.81Å; Y104-T108 PolarHBondContact O-OG1 3.19Å
105	D	84	Confident	79.2	Confident	70 Å²	70	107.6 Å²	107.6	37%	0.374	58%	0.582	S	S	.	*	H	α-helix	trans	-67.3	-10.9	176	-69.8	-5.9	0	0	0	113.6	K101 K109	K101-D105 IonicContact NZ-OD1 2.66Å; K101-D105 PolarHBondContact NZ-OD1 3.23Å; K101-D105 IonicContact NZ-OD2 3.67Å; K101-D105 PolarHBondContact NZ-OD2 3.12Å; K101-D105 VanDerWaalsContact O-CB 3.31Å; K101-D105 WeakPolarHBondContact O-CB 3.43Å; K101-D105 PolarHBondContact O-N 2.79Å; D105-K109 VanDerWaalsContact O-CE 3.27Å; D105-K109 WeakPolarHBondContact O-CE 3.21Å; D105-K109 WeakPolarHBondContact O-CG 3.5Å
106	K	77.8	Confident	77.4	Confident	154 Å²	154	110.2 Å²	110.2	67%	0.67	59%	0.594	S	S	*	*	H	α-helix	trans	-91.9	-39.1	167.8	-80.1	-178.3	176.7	-177.2	0	112.5	V102 A103 Y104	V102-K106 WeakPolarHBondContact O-CG 3.45Å; V102-K106 PolarHBondContact O-N 2.92Å; A103-K106 PolarHBondContact O-N 2.89Å; Y104-K106 PolarHBondContact O-N 2.66Å; Y104-K106 VanDerWaalsContact O-N 3.16Å
107	A	75.1	Confident	75.4	Confident	85 Å²	85	113.3 Å²	113.3	70%	0.702	61%	0.606	S	S	*	*	H	α-helix	trans	-79.2	-30.5	-179	0	0	0	0	0	113.7	A103 Y104	A103-A107 WeakPolarHBondContact O-CB 3.43Å; A103-A107 PolarHBondContact O-N 2.97Å; Y104-A107 PolarHBondContact O-N 3.11Å; Y104-A107 VanDerWaalsContact O-N 3.11Å
108	T	73.1	Confident	73.6	Confident	67 Å²	67	119.6 Å²	119.6	41%	0.411	62%	0.617	S	S	.	*	S	Bend	trans	-105.5	19.4	-179.2	66.4	0	0	0	0	113.2	Y104	Y104-T108 HydrophobicContact CD1-CG2 4.03Å; Y104-T108 VanDerWaalsContact CD1-OG1 3.31Å; Y104-T108 WeakPolarHBondContact CD1-OG1 3.24Å; Y104-T108 HydrophobicContact CD2-CG2 4.02Å; Y104-T108 HydrophobicContact CE1-CG2 3.72Å; Y104-T108 VanDerWaalsContact CE1-OG1 3.3Å; Y104-T108 WeakPolarHBondContact CE1-OG1 3.04Å; Y104-T108 HydrophobicContact CE2-CG2 3.7Å; Y104-T108 HydrophobicContact CG-CG2 4.18Å; Y104-T108 WeakPolarHBondContact O-CB 3.44Å; Y104-T108 PolarHBondContact O-N 2.81Å; Y104-T108 PolarHBondContact O-OG1 3.19Å
109	K	70.3	Confident	71.8	Confident	142 Å²	142	117.2 Å²	117.2	62%	0.617	61%	0.612	S	S	*	*	S	Bend	trans	-56.1	126.7	156.7	-62.3	-165.8	175.2	-168.2	0	106.6	D105	D105-K109 VanDerWaalsContact O-CE 3.27Å; D105-K109 WeakPolarHBondContact O-CE 3.21Å; D105-K109 WeakPolarHBondContact O-CG 3.5Å
110	P	62.7	Low	70.2	Confident	108 Å²	108	114.1 Å²	114.1	70%	0.701	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-54.9	141.2	168.2	25.4	-33.1	0	0	0	107.3	Q112	P110-Q112 PolarHBondContact O-N 2.84Å
111	P	60.4	Low	68.5	Low	121 Å²	121	113.6 Å²	113.6	79%	0.786	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-52.4	122	173.9	23.7	-32.9	0	0	0	106.9	E113	P111-E113 PolarHBondContact O-N 3.49Å; P111-E113 VanDerWaalsContact O-N 3.1Å
112	Q	60.3	Low	66.9	Low	176 Å²	176	112.6 Å²	112.6	82%	0.822	60%	0.598	S	S	*	*	P	Polyproline II helix	trans	-51.2	125.1	-177.6	177.9	-179	5.2	0	0	107.4	P110 M114	P110-Q112 PolarHBondContact O-N 2.84Å; Q112-M114 PolarHBondContact O-N 3.24Å
113	E	53.4	Low	65.4	Low	170 Å²	170	113.4 Å²	113.4	79%	0.794	60%	0.599	S	S	*	*			trans	-62.5	93.9	177.7	-71	-170	142.5	0	0	108.4	P111 N115	P111-E113 PolarHBondContact O-N 3.49Å; P111-E113 VanDerWaalsContact O-N 3.1Å; E113-N115 PolarHBondContact O-N 3.03Å
114	M	58.5	Low	64	Low	164 Å²	164	116.3 Å²	116.3	81%	0.808	61%	0.606	S	S	*	*			trans	-68.7	68.2	165.3	-83.9	-177.8	52.7	0	0	107.5	Q112 V116	Q112-M114 PolarHBondContact O-N 3.24Å; M114-V116 PolarHBondContact O-N 2.03Å
115	N	56.7	Low	62.5	Low	101 Å²	101	119.3 Å²	119.3	54%	0.54	62%	0.616	S	S	.	*			trans	8.6	78.9	179	-64.8	-99.4	0	0	0	112.1	E113 H117 R118 A119	E113-N115 PolarHBondContact O-N 3.03Å; N115-H117 PolarHBondContact O-N 3.1Å; N115-H117 VanDerWaalsContact O-N 3.14Å; N115-R118 HydrophobicContact CB-CB 3.54Å; N115-R118 WeakPolarHBondContact O-CA 3.2Å; N115-R118 WeakPolarHBondContact O-CB 3.11Å; N115-R118 PolarHBondContact O-N 2.89Å; N115-A119 PolarHBondContact O-N 2.04Å
116	V	58.6	Low	61	Low	96 Å²	96	123.8 Å²	123.8	58%	0.582	64%	0.635	S	S	*	*	H	α-helix	trans	-61.6	-30.1	-175.2	-171.7	0	0	0	0	109.8	M114 R118 A119 L120	M114-V116 PolarHBondContact O-N 2.03Å; V116-R118 PolarHBondContact O-N 3.38Å; V116-A119 PolarHBondContact O-N 3.24Å; V116-L120 HydrophobicContact CG1-CD1 3.88Å; V116-L120 WeakPolarHBondContact O-CB 3.46Å; V116-L120 WeakPolarHBondContact O-CD1 3.16Å; V116-L120 PolarHBondContact O-N 3.39Å
117	H	55.1	Low	59.5	Low	170 Å²	170	124.1 Å²	124.1	79%	0.787	64%	0.639	S	S	*	*	H	α-helix	trans	-63.2	-28.8	167.8	-64.6	-72.9	0	0	0	115.2	N115 A121	N115-H117 PolarHBondContact O-N 3.1Å; N115-H117 VanDerWaalsContact O-N 3.14Å; H117-A121 WeakPolarHBondContact O-CB 3.42Å; H117-A121 PolarHBondContact O-N 3.32Å
118	R	58.3	Low	57.9	Low	174 Å²	174	123 Å²	123	66%	0.657	64%	0.636	S	S	*	*	H	α-helix	trans	-79.5	-41.4	174.1	-161.2	179.9	-157	109.7	2.1	111.2	N115 V116 A121 D122	N115-R118 HydrophobicContact CB-CB 3.54Å; N115-R118 WeakPolarHBondContact O-CA 3.2Å; N115-R118 WeakPolarHBondContact O-CB 3.11Å; N115-R118 PolarHBondContact O-N 2.89Å; V116-R118 PolarHBondContact O-N 3.38Å; R118-A121 PolarHBondContact O-N 2.82Å; R118-A121 VanDerWaalsContact O-N 3.17Å; R118-D122 PolarHBondContact O-N 3.5Å
119	A	57.1	Low	56.4	Low	52 Å²	52	126.2 Å²	126.2	43%	0.43	66%	0.658	S	S	.	*	H	α-helix	trans	-60.8	-46.1	172.3	0	0	0	0	0	111.6	N115 V116 D122 I123	N115-A119 PolarHBondContact O-N 2.04Å; V116-A119 PolarHBondContact O-N 3.24Å; A119-D122 PolarHBondContact O-N 2.94Å; A119-I123 WeakPolarHBondContact O-CG1 3.47Å; A119-I123 PolarHBondContact O-N 2.76Å; A119-I123 VanDerWaalsContact O-N 3.12Å
120	L	59.7	Low	54.9	Low	90 Å²	90	125.6 Å²	125.6	47%	0.471	67%	0.666	S	S	.	*	H	α-helix	trans	-65.8	-34.9	171.8	-94.8	82.5	0	0	0	112.6	V116 D122 I123 L124	V116-L120 HydrophobicContact CG1-CD1 3.88Å; V116-L120 WeakPolarHBondContact O-CB 3.46Å; V116-L120 WeakPolarHBondContact O-CD1 3.16Å; V116-L120 PolarHBondContact O-N 3.39Å; L120-D122 VanDerWaalsContact C-N 3.33Å; L120-D122 PolarHBondContact O-N 2.84Å; L120-I123 PolarHBondContact O-N 2.8Å; L120-L124 VanDerWaalsContact O-CB 3.25Å; L120-L124 WeakPolarHBondContact O-CB 3.49Å; L120-L124 WeakPolarHBondContact O-CG 3.37Å; L120-L124 PolarHBondContact O-N 2.99Å
121	A	60.4	Low	53.3	Low	45 Å²	45	126.3 Å²	126.3	37%	0.372	67%	0.673	S	S	.	*	H	α-helix	trans	-64.4	-35.8	177.4	0	0	0	0	0	112.7	H117 R118 R125	H117-A121 WeakPolarHBondContact O-CB 3.42Å; H117-A121 PolarHBondContact O-N 3.32Å; R118-A121 PolarHBondContact O-N 2.82Å; R118-A121 VanDerWaalsContact O-N 3.17Å; A121-R125 WeakPolarHBondContact O-CB 3.31Å; A121-R125 PolarHBondContact O-N 2.03Å
122	D	57.8	Low	52.2	Low	95 Å²	95	124.9 Å²	124.9	51%	0.508	67%	0.671	S	S	.	*	H	α-helix	trans	-72.8	-40.4	174.3	-73.8	-28.2	0	0	0	111.7	R118 A119 L120 R125 Q126	R118-D122 PolarHBondContact O-N 3.5Å; A119-D122 PolarHBondContact O-N 2.94Å; L120-D122 VanDerWaalsContact C-N 3.33Å; L120-D122 PolarHBondContact O-N 2.84Å; D122-R125 WeakPolarHBondContact O-CB 3.3Å; D122-R125 PolarHBondContact O-N 2.87Å; D122-Q126 WeakPolarHBondContact O-CG 3.18Å; D122-Q126 PolarHBondContact O-N 3.24Å
123	I	58.9	Low	51	Low	92 Å²	92	122 Å²	122	47%	0.472	67%	0.67	S	S	.	*	H	α-helix	trans	-62.9	-45.1	174.5	-66.4	164.3	0	0	0	111.2	A119 L120 R125 Q126	A119-I123 WeakPolarHBondContact O-CG1 3.47Å; A119-I123 PolarHBondContact O-N 2.76Å; A119-I123 VanDerWaalsContact O-N 3.12Å; L120-I123 PolarHBondContact O-N 2.8Å; I123-R125 VanDerWaalsContact C-N 3.27Å; I123-R125 PolarHBondContact O-N 2.87Å; I123-Q126 PolarHBondContact O-N 2.89Å; I123-Q126 VanDerWaalsContact O-N 3.07Å
124	L	56.1	Low	50	Low	119 Å²	119	122.9 Å²	122.9	62%	0.623	67%	0.674	S	S	*	*	H	α-helix	trans	-68.5	-25.8	177	-69.7	168.6	0	0	0	112.2	L120 Q126	L120-L124 VanDerWaalsContact O-CB 3.25Å; L120-L124 WeakPolarHBondContact O-CB 3.49Å; L120-L124 WeakPolarHBondContact O-CG 3.37Å; L120-L124 PolarHBondContact O-N 2.99Å; L124-Q126 VanDerWaalsContact C-N 3.27Å; L124-Q126 PolarHBondContact O-N 2.94Å
125	R	58	Low	48.8	Very low	214 Å²	214	122.7 Å²	122.7	81%	0.808	67%	0.67	S	S	*	*	H	α-helix	trans	-71.4	-17.8	170.1	-111.6	-174.9	161.7	82.8	3.7	114	A121 D122 I123	A121-R125 WeakPolarHBondContact O-CB 3.31Å; A121-R125 PolarHBondContact O-N 2.03Å; D122-R125 WeakPolarHBondContact O-CB 3.3Å; D122-R125 PolarHBondContact O-N 2.87Å; I123-R125 VanDerWaalsContact C-N 3.27Å; I123-R125 PolarHBondContact O-N 2.87Å
126	Q	53.2	Low	47.6	Very low	165 Å²	165	125 Å²	125	77%	0.771	68%	0.677	S	S	*	*	H	α-helix	trans	-92.1	-11.6	177.7	-69.5	177.3	0.3	0	0	113.3	D122 I123 L124 G128	D122-Q126 WeakPolarHBondContact O-CG 3.18Å; D122-Q126 PolarHBondContact O-N 3.24Å; I123-Q126 PolarHBondContact O-N 2.89Å; I123-Q126 VanDerWaalsContact O-N 3.07Å; L124-Q126 VanDerWaalsContact C-N 3.27Å; L124-Q126 PolarHBondContact O-N 2.94Å; Q126-G128 PolarHBondContact O-N 2.85Å
127	Q	46.7	Very low	46.4	Very low	160 Å²	160	127.9 Å²	127.9	75%	0.748	68%	0.684	S	S	*	*			trans	-99.8	67.2	-178.1	-66.1	-165.2	1.3	0	0	113.6
128	G	39.9	Very low	45.3	Very low	62 Å²	62	126.9 Å²	126.9	64%	0.639	68%	0.679	S	S	*	*			trans	159	142.5	155.2	0	0	0	0	0	115.6	Q126	Q126-G128 PolarHBondContact O-N 2.85Å
129	P	42.8	Very low	44.1	Very low	135 Å²	135	123.9 Å²	123.9	88%	0.877	68%	0.677	S	S	*	*	S	Bend	cis	-102.5	153.5	-3.8	37.3	-29.1	0	0	0	114.2
130	V	37.4	Very low	42.8	Very low	129 Å²	129	129.3 Å²	129.3	78%	0.782	70%	0.695	S	S	*	*			trans	-50.9	140.5	-176	177.5	0	0	0	0	116.6	A132	V130-A132 HydrophobicContact CG1-CB 3.74Å
131	S	29.7	Very low	41.4	Very low	123 Å²	123	129.6 Å²	129.6	86%	0.86	71%	0.71	S	S	*	*			trans	-126.9	131.4	132.7	62.7	0	0	0	0	108.6
132	A	38.2	Very low	40.1	Very low	90 Å²	90	132 Å²	132	74%	0.744	73%	0.73	S	S	*	*			trans	-117.6	114.2	-166.4	0	0	0	0	0	114.1	V130	V130-A132 HydrophobicContact CG1-CB 3.74Å
133	S	33.6	Very low	39.1	Very low	115 Å²	115	135.8 Å²	135.8	80%	0.804	75%	0.749	S	S	*	*			trans	-168.7	149.1	155	55.3	0	0	0	0	108.1
134	Q	33.8	Very low	38	Very low	189 Å²	189	138.8 Å²	138.8	88%	0.883	77%	0.766	S	S	*	*			cis	-138.4	160.7	-2.4	-163	156.3	-60.2	0	0	111
135	F	32.1	Very low	36.7	Very low	161 Å²	161	136.7 Å²	136.7	71%	0.706	77%	0.773	S	S	*	*			trans	-68.7	150.1	174.6	-165.6	-111.1	0	0	0	111.6
136	E	32.3	Very low	35.3	Very low	149 Å²	149	131.8 Å²	131.8	70%	0.696	77%	0.771	S	S	*	*			trans	24.7	135.9	162.9	-64.3	-179.2	175.4	0	0	121
137	H	33.5	Very low	35.1	Very low	157 Å²	157	128.7 Å²	128.7	73%	0.727	77%	0.766	S	S	*	*				-178.3	-177.8	95.6	-162.5	54.4	0	0	0	111.5
138	E	32.8	Very low	34.3	Very low	148 Å²	148	129.7 Å²	129.7	69%	0.692	77%	0.767	S	S	*	*			trans	-96.3	-179.9	-169.2	-54.7	179.6	133.3	0	0	114.5
139	N	31.3	Very low	33.6	Very low	112 Å²	112	132.7 Å²	132.7	60%	0.599	77%	0.769	S	S	*	*			trans	90.1	114.4	154.2	-69.6	-62.1	0	0	0	122.4
140	M	29.9	Very low	33	Very low	165 Å²	165	135 Å²	135	81%	0.813	77%	0.768	S	S	*	*				70.8	145.1	127.2	-56	-61.1	172.3	0	0	122.9
141	A	31.9	Very low	32.9	Very low	96 Å²	96	135.1 Å²	135.1	79%	0.793	77%	0.769	S	S	*	*			trans	60.9	125	166.4	0	0	0	0	0	117.3
142	A	32.3	Very low	33.6	Very low	96 Å²	96	134.6 Å²	134.6	79%	0.793	76%	0.763	S	S	*	*			cis	94.6	152.6	33.2	0	0	0	0	0	114.9
143	I	36.3	Very low	33.3	Very low	174 Å²	174	135.4 Å²	135.4	89%	0.892	76%	0.758	S	S	*	*			trans	93.2	138.8	173.8	-57.5	174.8	0	0	0	116.6
144	D	35.8	Very low	33.2	Very low	156 Å²	156	140.8 Å²	140.8	83%	0.834	76%	0.761	S	S	*	*			trans	-72.4	162.7	-177.1	-179.6	24.3	0	0	0	113.6
145	G	29.7	Very low	33	Very low	74 Å²	74	136.5 Å²	136.5	76%	0.763	75%	0.752	S	S	*	*			trans	177.1	104.7	-179.3	0	0	0	0	0	115.7
146	S	28.7	Very low	33.2	Very low	112 Å²	112	133.5 Å²	133.5	78%	0.783	75%	0.751	S	S	*	*			trans	-134.2	173.2	170.3	-144	0	0	0	0	108.4
147	P	47.8	Very low	33.1	Very low	100 Å²	100	135.2 Å²	135.2	65%	0.649	76%	0.756	S	S	*	*			cis	-132.4	-159.6	-8.6	27.2	-1.7	0	0	0	112.5
148	K	31.1	Very low	33.1	Very low	180 Å²	180	133.7 Å²	133.7	78%	0.783	75%	0.753	S	S	*	*			trans	79.7	155.7	156.8	-65.9	-178.1	165.1	-141.1	0	118.2
149	D	25.3	Very low	33.2	Very low	126 Å²	126	134.5 Å²	134.5	67%	0.674	76%	0.757	S	S	*	*			cis	-147.5	-162.9	-6.1	-134.6	-55	0	0	0	111
150	E	30	Very low	33.2	Very low	183 Å²	183	139.5 Å²	139.5	86%	0.855	77%	0.769	S	S	*	*			trans	91.8	102.4	160.3	-53.5	-159.1	156.4	0	0	119.5
151	T	35.3	Very low	33.5	Very low	132 Å²	132	136.9 Å²	136.9	81%	0.81	76%	0.762	S	S	*	*			trans	-117.7	166.7	144.9	70.8	0	0	0	0	106.5
152	P	44.3	Very low	34.1	Very low	112 Å²	112	138.1 Å²	138.1	73%	0.727	76%	0.762	S	S	*	*				-166.7	-175.7	75.7	47.4	-25.5	0	0	0	119.3
153	V	31.6	Very low	34.1	Very low	107 Å²	107	139 Å²	139	65%	0.648	76%	0.757	S	S	*	*			trans	80.7	121	151.4	173.8	0	0	0	0	122.2
154	R	31.3	Very low	34.1	Very low	228 Å²	228	138.2 Å²	138.2	86%	0.86	75%	0.75	S	S	*	*			trans	64.5	159	156.8	-78.1	170.7	165.6	91.4	-2.2	117.1
155	S	29	Very low	33.8	Very low	98 Å²	98	137.3 Å²	137.3	69%	0.685	75%	0.75	S	S	*	*			cis	-167.9	169.2	-8.4	-112.5	0	0	0	0	109.2
156	S	36.5	Very low	33.9	Very low	99 Å²	99	141.9 Å²	141.9	69%	0.692	75%	0.749	S	S	*	*			cis	178.3	154.8	-31.8	54.6	0	0	0	0	111.8
157	K	30.7	Very low	34.1	Very low	185 Å²	185	142.9 Å²	142.9	80%	0.804	75%	0.75	S	S	*	*			trans	84.3	87.9	149	-155.2	175.2	-172.8	-178.4	0	121.3
158	N	34.4	Very low	33.3	Very low	124 Å²	124	144 Å²	144	66%	0.663	76%	0.76	S	S	*	*				61.4	131.9	118.6	-66.8	17	0	0	0	125.4
159	H	34.9	Very low	33.4	Very low	166 Å²	166	142.2 Å²	142.2	77%	0.769	76%	0.759	S	S	*	*			trans	78.1	123.7	139	-60.7	-5.5	0	0	0	121.1
160	Y	29.6	Very low	33.7	Very low	217 Å²	217	145.1 Å²	145.1	85%	0.851	77%	0.769	S	S	*	*				-158.9	161.4	95.5	-145.4	-108.9	0	0	0	112.3
161	T	37.3	Very low	33.6	Very low	110 Å²	110	139.8 Å²	139.8	68%	0.675	76%	0.762	S	S	*	*			trans	-134.9	158.5	170.1	56.3	0	0	0	0	109.6
162	P	44.5	Very low	33.5	Very low	122 Å²	122	139.5 Å²	139.5	79%	0.792	77%	0.766	S	S	*	*				-144.7	-178.4	121.4	34.7	-17.6	0	0	0	113.9
163	V	32.1	Very low	32.8	Very low	114 Å²	114	138.4 Å²	138.4	69%	0.691	76%	0.761	S	S	*	*			trans	-148.5	149.4	-158.1	160.2	0	0	0	0	112.6
164	H	35.7	Very low	32.5	Very low	158 Å²	158	143.2 Å²	143.2	73%	0.731	77%	0.767	S	S	*	*			trans	69.1	134.9	162.2	-73.9	-31.1	0	0	0	122.5
165	T	30.9	Very low	32.6	Very low	137 Å²	137	139.4 Å²	139.4	84%	0.84	76%	0.759	S	S	*	*				-169.6	133.6	108.9	25.5	0	0	0	0	106.8
166	K	31.5	Very low	32.7	Very low	170 Å²	170	145 Å²	145	74%	0.739	77%	0.767	S	S	*	*			cis	85.8	88.7	49.2	-78.5	-161.6	174.7	-175	0	116.1
167	T	32.9	Very low	32.6	Very low	133 Å²	133	143.4 Å²	143.4	82%	0.816	77%	0.765	S	S	*	*			trans	49.4	130.4	134.5	55.2	0	0	0	0	122.3
168	S	29.9	Very low	32.6	Very low	122 Å²	122	142.9 Å²	142.9	85%	0.853	76%	0.763	S	S	*	*			trans	-150.1	170	150.6	-165.6	0	0	0	0	111.3
169	N	33.9	Very low	32.5	Very low	143 Å²	143	142.2 Å²	142.2	77%	0.765	76%	0.76	S	S	*	*			trans	-123.6	169.2	-161.8	-76.6	-23.2	0	0	0	115.3
170	H	31.6	Very low	32.5	Very low	188 Å²	188	141.4 Å²	141.4	87%	0.87	77%	0.767	S	S	*	*			trans	62	109.9	150	-90.2	-77.3	0	0	0	121.2
171	G	28.1	Very low	32.7	Very low	70 Å²	70	138.1 Å²	138.1	72%	0.722	76%	0.763	S	S	*	*				86.3	113	100.3	0	0	0	0	0	120.5
172	S	31.9	Very low	32.6	Very low	127 Å²	127	143.7 Å²	143.7	89%	0.888	77%	0.772	S	S	*	*			trans	-178.2	-179.1	146.4	45.3	0	0	0	0	110.9
173	S	29.6	Very low	32.6	Very low	88 Å²	88	143.3 Å²	143.3	62%	0.615	77%	0.769	S	S	*	*				-168.2	140.7	-80.6	-162	0	0	0	0	110
174	W	26.1	Very low	32.6	Very low	209 Å²	209	142 Å²	142	79%	0.792	78%	0.778	S	S	*	*			trans	67.6	107.9	160.7	-54.2	135.1	0	0	0	122.5
175	H	33.4	Very low	32.5	Very low	147 Å²	147	137.9 Å²	137.9	68%	0.681	78%	0.779	S	S	*	*				81.8	139.5	111.7	-78.5	-29.1	0	0	0	127.7
176	Y	31.5	Very low	33.3	Very low	216 Å²	216	137 Å²	137	85%	0.847	78%	0.775	S	S	*	*			trans	97.2	136.2	134.9	-106.1	-78.7	0	0	0	124.1
177	G	33.7	Very low	33.3	Very low	65 Å²	65	135.9 Å²	135.9	67%	0.67	78%	0.778	S	S	*	*			trans	111.4	116.1	168.3	0	0	0	0	0	114.7
178	K	31.3	Very low	33.4	Very low	174 Å²	174	136.7 Å²	136.7	76%	0.757	77%	0.774	S	S	*	*				64.4	135.9	55.7	-80.6	-170.2	143.6	-74	0	114.5
179	D	32.1	Very low	33.8	Very low	111 Å²	111	140 Å²	140	59%	0.594	78%	0.776	S	S	*	*			cis	-156.3	156	-1.2	-86.2	-53.1	0	0	0	110.1
180	T	35.3	Very low	33.7	Very low	148 Å²	148	139.8 Å²	139.8	91%	0.908	78%	0.775	S	S	*	*			trans	-172.1	176.9	145.1	11.2	0	0	0	0	113.8
181	L	32.9	Very low	34.1	Very low	149 Å²	149	141 Å²	141	78%	0.78	78%	0.778	S	S	*	*			trans	-127.1	140.2	-151.9	-98.7	65.9	0	0	0	117
182	R	36.8	Very low	34.3	Very low	227 Å²	227	145.8 Å²	145.8	86%	0.857	79%	0.785	S	S	*	*			trans	54.3	173.5	141.3	-82.9	-174.5	97.8	171.5	5	120.1
183	P	43.7	Very low	34.3	Very low	114 Å²	114	145.3 Å²	145.3	74%	0.74	78%	0.781	S	S	*	*			cis	-130.1	157.8	-34.6	33.7	-18	0	0	0	113.8
184	G	32.3	Very low	34.6	Very low	85 Å²	85	147 Å²	147	88%	0.876	79%	0.793	S	S	*	*			trans	175.9	125.3	164.4	0	0	0	0	0	114
185	G	33.2	Very low	34.9	Very low	73 Å²	73	140.3 Å²	140.3	75%	0.753	79%	0.79	S	S	*	*			trans	-132.4	-172.7	165.9	0	0	0	0	0	109.5
186	P	47	Very low	34.8	Very low	117 Å²	117	143.3 Å²	143.3	76%	0.76	80%	0.801	S	S	*	*			cis	-133.9	167.6	17	42.9	-27.7	0	0	0	116.9
187	D	31.9	Very low	35	Very low	148 Å²	148	138.8 Å²	138.8	79%	0.791	80%	0.796	S	S	*	*			trans	86.4	145.9	136.5	-104.4	-42	0	0	0	125.8
188	M	34.8	Very low	35	Very low	149 Å²	149	141.8 Å²	141.8	73%	0.734	80%	0.801	S	S	*	*			trans	51.9	95.8	157.2	-57.8	-174.5	87.7	0	0	121.2
189	H	38.4	Very low	35.2	Very low	193 Å²	193	140.6 Å²	140.6	89%	0.894	80%	0.802	S	S	*	*			trans	-138	144.9	135.7	-87.3	-57.2	0	0	0	111.9
190	N	33.1	Very low	35	Very low	138 Å²	138	138.8 Å²	138.8	74%	0.738	81%	0.81	S	S	*	*			trans	-79.8	141	-172.3	-54.2	-68.9	0	0	0	112.5
191	F	39.1	Very low	34.9	Very low	214 Å²	214	142.8 Å²	142.8	94%	0.939	81%	0.808	S	S	*	*			trans	-134.2	134.4	145.6	-86.1	-74.1	0	0	0	111.3
192	I	32.6	Very low	34.6	Very low	169 Å²	169	141.1 Å²	141.1	87%	0.867	81%	0.809	S	S	*	*			trans	-84.3	130.5	-179.6	-63.2	163.7	0	0	0	108.4
193	S	31.3	Very low	34.3	Very low	117 Å²	117	139.8 Å²	139.8	82%	0.818	81%	0.812	S	S	*	*			trans	-148.1	148.1	157.6	-165.1	0	0	0	0	110.1
194	S	35.9	Very low	33.9	Very low	124 Å²	124	142.7 Å²	142.7	87%	0.867	82%	0.82	S	S	*	*			trans	-84.7	123.1	-163.7	39.5	0	0	0	0	113.6
195	G	32.2	Very low	33.7	Very low	69 Å²	69	148.3 Å²	148.3	71%	0.711	82%	0.821	S	S	*	*			trans	-106	119.6	171.5	0	0	0	0	0	112.1
196	F	31.8	Very low	33.4	Very low	209 Å²	209	148.5 Å²	148.5	92%	0.917	82%	0.823	S	S	*	*			trans	-71.4	129.2	173	-134.3	-104	0	0	0	109.9
197	V	35.9	Very low	32.5	Very low	122 Å²	122	148.5 Å²	148.5	74%	0.739	82%	0.816	S	S	*	*			trans	-110.3	98.7	179.6	-178.4	0	0	0	0	111	L199	V197-L199 PolarHBondContact O-N 3.3Å
198	T	34.1	Very low	32.6	Very low	128 Å²	128	150.6 Å²	150.6	79%	0.785	82%	0.821	S	S	*	*			trans	-72.2	109.4	168.5	-59.8	0	0	0	0	109.7	G200	T198-G200 VanDerWaalsContact C-N 3.26Å; T198-G200 PolarHBondContact O-N 3.14Å
199	L	33.8	Very low	32.3	Very low	149 Å²	149	150.2 Å²	150.2	78%	0.78	82%	0.817	S	S	*	*			trans	-79.6	69.6	-178.3	-119.7	158.1	0	0	0	111.9	V197 R201	V197-L199 PolarHBondContact O-N 3.3Å; L199-R201 PolarHBondContact O-N 2.87Å
200	G	29.8	Very low	32.1	Very low	73 Å²	73	150.7 Å²	150.7	75%	0.753	82%	0.82	S	S	*	*			trans	-71.8	121.2	162.8	0	0	0	0	0	110	T198	T198-G200 VanDerWaalsContact C-N 3.26Å; T198-G200 PolarHBondContact O-N 3.14Å
201	R	31.6	Very low	31.8	Very low	231 Å²	231	151.1 Å²	151.1	87%	0.872	82%	0.817	S	S	*	*			trans	-132.3	130.5	170.8	-152	169.3	-169.3	161.7	3.9	110.5	L199	L199-R201 PolarHBondContact O-N 2.87Å
202	S	27.8	Very low	31.4	Very low	114 Å²	114	152.3 Å²	152.3	80%	0.797	82%	0.817	S	S	*	*			trans	-80.5	158.9	-167.4	39.2	0	0	0	0	113.8
203	H	30.2	Very low	31.4	Very low	199 Å²	199	150.6 Å²	150.6	92%	0.921	81%	0.806	S	S	*	*			trans	-58.3	142.7	169.7	-75.9	-105	0	0	0	111.6
204	L	34.4	Very low	31.3	Very low	175 Å²	175	152.3 Å²	152.3	92%	0.916	80%	0.8	S	S	*	*			trans	-130.5	135.9	161.9	-117.5	164	0	0	0	109.2
205	K	28	Very low	31.1	Very low	203 Å²	203	152.2 Å²	152.2	88%	0.883	80%	0.8	S	S	*	*			trans	-92.4	104.8	-166.5	-178.6	-179.6	177.7	-178.7	0	110.4
206	G	28.6	Very low	30.9	Very low	78 Å²	78	156 Å²	156	80%	0.804	80%	0.798	S	S	*	*			trans	-105	134.5	171.2	0	0	0	0	0	111.1
207	N	27.7	Very low	31	Very low	116 Å²	116	154.2 Å²	154.2	62%	0.62	80%	0.798	S	S	*	*			trans	-116	115.8	-168.9	-177.1	66.3	0	0	0	112.2
208	H	33.1	Very low	30.5	Very low	192 Å²	192	153.8 Å²	153.8	89%	0.889	79%	0.791	S	S	*	*			trans	-141.9	132.8	161.9	-82.2	-67.7	0	0	0	111.1
209	H	29.1	Very low	30.2	Very low	142 Å²	142	155.9 Å²	155.9	66%	0.657	80%	0.797	S	S	*	*			trans	-78.2	145.7	174	-65.3	-123	0	0	0	110
210	H	35	Very low	29.9	Very low	203 Å²	203	154.8 Å²	154.8	94%	0.94	80%	0.796	S	S	*	*			trans	-144.3	148.4	132.4	-93.5	-66.8	0	0	0	108.9
211	E	25.7	Very low	30	Very low	147 Å²	147	155.4 Å²	155.4	69%	0.687	79%	0.794	S	S	*	*			trans	-125.2	127	-157.4	176.9	-177.3	147.7	0	0	109.6
212	Y	31.7	Very low	30.1	Very low	239 Å²	239	152.2 Å²	152.2	94%	0.937	79%	0.794	S	S	*	*			trans	-153.9	102.8	166	-107.8	-75.7	0	0	0	111.1
213	Q	30.8	Very low	30.3	Very low	133 Å²	133	152.8 Å²	152.8	62%	0.621	79%	0.792	S	S	*	*			trans	-68.5	162.1	153.5	-77.4	164.5	-77.8	0	0	109.4
214	H	30.7	Very low	30.8	Very low	152 Å²	152	148.1 Å²	148.1	70%	0.704	78%	0.78	S	S	*	*			cis	-147.7	161.4	-2.1	-113.9	-47.9	0	0	0	106.8
215	S	30.1	Very low	30.4	Very low	123 Å²	123	149.2 Å²	149.2	86%	0.86	78%	0.777	S	S	*	*				-178.4	164.9	96.5	45.1	0	0	0	0	110.9
216	H	29.1	Very low	30.4	Very low	147 Å²	147	146.2 Å²	146.2	68%	0.681	77%	0.77	S	S	*	*			trans	-135.3	137.2	-160.3	-177.5	-84	0	0	0	110.8	D218	H216-D218 IonicContact CE1-OD2 3.52Å; H216-D218 PolarHBondContact CE1-OD2 3.13Å; H216-D218 IonicContact ND1-OD2 3.86Å
217	L	33.7	Very low	30.4	Very low	173 Å²	173	148.9 Å²	148.9	91%	0.906	77%	0.766	S	S	*	*			trans	-159.6	110.7	169.4	-117.1	155.1	0	0	0	110.7
218	D	26.1	Very low	30.8	Very low	112 Å²	112	152.8 Å²	152.8	60%	0.599	77%	0.772	S	S	*	*			trans	-75.9	155.2	170.7	-61.6	-67	0	0	0	111.4	H216	H216-D218 IonicContact CE1-OD2 3.52Å; H216-D218 PolarHBondContact CE1-OD2 3.13Å; H216-D218 IonicContact ND1-OD2 3.86Å
219	L	26.6	Very low	31.2	Very low	172 Å²	172	149.5 Å²	149.5	90%	0.901	77%	0.768	S	S	*	*				-159.9	139.2	104.1	-164.8	56.9	0	0	0	111.6
220	T	28.8	Very low	31.6	Very low	126 Å²	126	150 Å²	150	77%	0.773	77%	0.77	S	S	*	*			trans	-106.2	125.5	-176.4	-51.8	0	0	0	0	112.3
221	A	31.7	Very low	31.5	Very low	86 Å²	86	152 Å²	152	71%	0.711	77%	0.77	S	S	*	*			trans	-162	131.2	165.4	0	0	0	0	0	109.4
222	L	32.1	Very low	31.8	Very low	165 Å²	165	152 Å²	152	86%	0.864	77%	0.773	S	S	*	*			cis	-142.2	158.4	-7.6	-85.6	143.4	0	0	0	108
223	T	33.2	Very low	31.9	Very low	125 Å²	125	146.9 Å²	146.9	77%	0.767	76%	0.762	S	S	*	*			trans	-122.2	157.8	163.6	73.9	0	0	0	0	108.2
224	P	40.8	Very low	31.8	Very low	101 Å²	101	148.1 Å²	148.1	66%	0.656	77%	0.772	S	S	*	*				-154.8	148.3	83.6	38	-18.8	0	0	0	117.4
225	K	26.7	Very low	32.2	Very low	199 Å²	199	148.6 Å²	148.6	87%	0.865	78%	0.778	S	S	*	*			trans	65.5	163.9	142.6	-70.5	172	-173.2	177.8	0	116.7
226	L	27.5	Very low	32.4	Very low	139 Å²	139	149.9 Å²	149.9	73%	0.728	78%	0.775	S	S	*	*			cis	-169.1	130.5	-22.3	173.1	70.4	0	0	0	102.5
227	D	27.9	Very low	32.5	Very low	135 Å²	135	148.7 Å²	148.7	72%	0.722	78%	0.778	S	S	*	*				-167	170.3	70.4	-136.9	-29.7	0	0	0	113.5
228	R	36.9	Very low	32.4	Very low	198 Å²	198	146 Å²	146	75%	0.747	77%	0.774	S	S	*	*			trans	-132.1	153.2	162.4	-89.5	-173.7	174.6	179.2	-0.1	108.3
229	P	41.9	Very low	32.7	Very low	123 Å²	123	144.1 Å²	144.1	80%	0.799	77%	0.774	S	S	*	*				-137.1	144.2	111.5	35.1	-25.5	0	0	0	113.7
230	Q	36.1	Very low	33.1	Very low	152 Å²	152	142 Å²	142	71%	0.71	77%	0.768	S	S	*	*			trans	-80.8	147.7	157.1	-67	176.9	-59.5	0	0	109
231	R	33	Very low	33.4	Very low	245 Å²	245	143.1 Å²	143.1	93%	0.925	77%	0.765	S	S	*	*			trans	-131.6	134.9	153.4	-81.1	-168.2	176.4	178.7	0.6	109.9
232	I	32.8	Very low	33.5	Very low	146 Å²	146	144.4 Å²	144.4	75%	0.749	77%	0.766	S	S	*	*			trans	-106	166.2	167.5	-48.5	172.2	0	0	0	106.3
233	N	33.6	Very low	33.4	Very low	133 Å²	133	147.1 Å²	147.1	71%	0.711	77%	0.766	S	S	*	*			trans	101.6	102.7	166.1	-52.6	-7	0	0	0	115.2
234	N	29.4	Very low	33.4	Very low	158 Å²	158	148.4 Å²	148.4	85%	0.845	77%	0.768	S	S	*	*				177.2	139.6	99.7	-86.9	-21.5	0	0	0	111.2
235	I	38.7	Very low	33.2	Very low	162 Å²	162	150 Å²	150	83%	0.831	78%	0.776	S	S	*	*			trans	-115.6	123	162.9	-64.6	169.9	0	0	0	106.4
236	L	34.9	Very low	33.5	Very low	151 Å²	151	145.3 Å²	145.3	79%	0.791	77%	0.768	S	S	*	*			trans	-169.3	145.3	144	-127.3	68.7	0	0	0	111.1
237	T	31.1	Very low	33.9	Very low	121 Å²	121	146.5 Å²	146.5	74%	0.742	77%	0.774	S	S	*	*			trans	7.4	142.5	147	54.7	0	0	0	0	119.3
238	S	31.8	Very low	34.2	Very low	116 Å²	116	145.1 Å²	145.1	81%	0.811	78%	0.775	S	S	*	*			cis	-160.9	-175	19.5	52.2	0	0	0	0	109.8
239	A	30.6	Very low	34.3	Very low	73 Å²	73	147.6 Å²	147.6	60%	0.603	79%	0.785	S	S	*	*			cis	-159.3	-178.1	14	0	0	0	0	0	111
240	T	35	Very low	34	Very low	127 Å²	127	146.2 Å²	146.2	78%	0.779	78%	0.778	S	S	*	*			trans	58.4	135.2	159.1	52.1	0	0	0	0	118.7
241	E	35.1	Very low	34.4	Very low	151 Å²	151	149 Å²	149	71%	0.706	79%	0.788	S	S	*	*			cis	-149.8	159.4	-8.2	-92.9	-59.5	98.8	0	0	107
242	P	33.6	Very low	34.9	Very low	112 Å²	112	145.4 Å²	145.4	73%	0.727	78%	0.781	S	S	*	*			trans	-82.4	135.4	175.9	33.2	-32.1	0	0	0	112.6
243	Y	31.8	Very low	34.9	Very low	222 Å²	222	145.7 Å²	145.7	87%	0.871	79%	0.785	S	S	*	*			trans	-110.9	126.2	169.6	-96.1	-80.7	0	0	0	111.3
244	D	32.7	Very low	35.5	Very low	152 Å²	152	147.8 Å²	147.8	81%	0.813	80%	0.795	S	S	*	*			trans	-66.6	137.3	179.5	-86	-54.2	0	0	0	113.5	S246	D244-S246 VanDerWaalsContact C-N 3.27Å; D244-S246 PolarHBondContact O-N 2.74Å
245	V	36.4	Very low	35.9	Very low	136 Å²	136	145 Å²	145	82%	0.824	79%	0.787	S	S	*	*			trans	-83.1	74.4	169.2	-172.6	0	0	0	0	109.2	L247	V245-L247 PolarHBondContact O-N 2.71Å
246	S	32.6	Very low	35.9	Very low	100 Å²	100	145.8 Å²	145.8	70%	0.699	79%	0.787	S	S	*	*			trans	-71.4	86.9	176	50	0	0	0	0	111.3	D244 S248	D244-S246 VanDerWaalsContact C-N 3.27Å; D244-S246 PolarHBondContact O-N 2.74Å; S246-S248 PolarHBondContact O-N 2.99Å
247	L	36.8	Very low	35.9	Very low	164 Å²	164	147 Å²	147	86%	0.859	79%	0.794	S	S	*	*			trans	-74.3	63	179.9	-164.2	76.2	0	0	0	112.4	V245	V245-L247 PolarHBondContact O-N 2.71Å
248	S	34	Very low	36.1	Very low	106 Å²	106	149.7 Å²	149.7	74%	0.741	80%	0.798	S	S	*	*			trans	-117.7	73.8	-179.7	-64.9	0	0	0	0	111.3	S246	S246-S248 PolarHBondContact O-N 2.99Å
249	R	38.6	Very low	36.5	Very low	250 Å²	250	150.3 Å²	150.3	94%	0.943	80%	0.799	S	S	*	*			trans	-97	100.4	162.2	-80	-167.4	170.9	-156.4	-2.9	109.8
250	S	36.4	Very low	36.5	Very low	93 Å²	93	151.3 Å²	151.3	65%	0.65	80%	0.802	S	S	*	*			trans	-67.2	149.6	175.9	44.1	0	0	0	0	112.4	Q252	S250-Q252 PolarHBondContact O-N 2.78Å
251	F	43.9	Very low	36.6	Very low	212 Å²	212	155.4 Å²	155.4	93%	0.93	80%	0.804	S	S	*	*			trans	-67.8	111.2	166.5	-67.9	-92.6	0	0	0	109.6
252	Q	43.6	Very low	36.9	Very low	168 Å²	168	157.2 Å²	157.2	79%	0.785	81%	0.813	S	S	*	*			trans	-159.8	70.9	174.2	-122	168.1	57.6	0	0	112.1	S250	S250-Q252 PolarHBondContact O-N 2.78Å
253	N	32.7	Very low	37.1	Very low	153 Å²	153	159.6 Å²	159.6	82%	0.818	82%	0.819	S	S	*	*			trans	-155.9	67.2	164.7	-150.7	-15.1	0	0	0	113.3
254	L	45.9	Very low	37.7	Very low	177 Å²	177	154.3 Å²	154.3	93%	0.927	81%	0.812	S	S	*	*	S	Bend	trans	-151.7	46.9	169.1	-150.7	82	0	0	0	112.3
255	S	37.9	Very low	37.8	Very low	98 Å²	98	155.8 Å²	155.8	69%	0.685	82%	0.818	S	S	*	*			trans	-155.5	63.2	-173.1	60.5	0	0	0	0	113
256	H	38.8	Very low	37.6	Very low	179 Å²	179	157.7 Å²	157.7	83%	0.829	82%	0.815	S	S	*	*			trans	-150.5	65.4	174.6	-121.8	-81	0	0	0	114.2
257	L	35.2	Very low	37.9	Very low	176 Å²	176	158.3 Å²	158.3	92%	0.921	82%	0.817	S	S	*	*			trans	-125.1	140.8	155.2	-75.5	173.6	0	0	0	108.1
258	Q	34	Very low	37.7	Very low	179 Å²	179	157.3 Å²	157.3	84%	0.836	81%	0.813	S	S	*	*			trans	-86.6	151.6	-170.7	-68.4	-173.1	-79.3	0	0	112.8
259	P	40	Very low	38	Very low	128 Å²	128	160.2 Å²	160.2	83%	0.831	82%	0.819	S	S	*	*			trans	-76.4	137	170.8	31.9	-34	0	0	0	111.3
260	S	31.5	Very low	37.7	Very low	94 Å²	94	153.7 Å²	153.7	66%	0.657	81%	0.812	S	S	*	*			trans	-127.1	100.4	179	58.5	0	0	0	0	111.8
261	Y	37.3	Very low	37.7	Very low	213 Å²	213	156.5 Å²	156.5	84%	0.835	82%	0.819	S	S	*	*			trans	39.7	128.6	161.4	64.9	-92.4	0	0	0	121
262	E	40.6	Very low	37.4	Very low	189 Å²	189	154.9 Å²	154.9	88%	0.883	81%	0.812	S	S	*	*			trans	-81.9	153.3	155.9	-62.7	-175.7	133.7	0	0	111
263	L	38.5	Very low	37.2	Very low	163 Å²	163	154.5 Å²	154.5	85%	0.853	82%	0.816	S	S	*	*			trans	-146.7	134.7	148.2	-101.8	173.2	0	0	0	108.7
264	P	43.9	Very low	37.3	Very low	111 Å²	111	154.4 Å²	154.4	72%	0.721	81%	0.812	S	S	*	*			trans	-95.7	154.2	-169.1	36.6	-35	0	0	0	113.6
265	L	35.8	Very low	36.9	Very low	183 Å²	183	152.6 Å²	152.6	96%	0.958	80%	0.803	S	S	*	*			trans	-122.5	157.2	157.3	-74.8	175.1	0	0	0	110.1
266	K	31.7	Very low	36.8	Very low	175 Å²	175	155.5 Å²	155.5	76%	0.761	81%	0.811	S	S	*	*			trans	-120.7	144.7	-152.9	-171.6	-175.9	177	-164.3	0	110.8
267	P	37.9	Very low	36.5	Very low	113 Å²	113	156.4 Å²	156.4	73%	0.734	81%	0.808	S	S	*	*			trans	-79.5	142.7	175.8	32.3	-34.6	0	0	0	111.9
268	D	32.7	Very low	36.3	Very low	144 Å²	144	158.1 Å²	158.1	77%	0.77	80%	0.804	S	S	*	*			trans	-128.8	166.2	168	-82.6	-50.5	0	0	0	110.1
269	L	41	Very low	36.6	Very low	167 Å²	167	154.4 Å²	154.4	87%	0.874	80%	0.796	S	S	*	*			trans	-107	137.2	-153.5	-57.6	111.8	0	0	0	116.6
270	S	32.4	Very low	36.3	Very low	113 Å²	113	157.6 Å²	157.6	79%	0.79	79%	0.791	S	S	*	*			trans	-169	121.9	139.2	54.4	0	0	0	0	106.9
271	D	36.2	Very low	36.3	Very low	151 Å²	151	160.9 Å²	160.9	81%	0.807	79%	0.794	S	S	*	*			cis	75.2	124.5	39.5	-161.7	25	0	0	0	113.4
272	K	38.9	Very low	36.1	Very low	178 Å²	178	158.4 Å²	158.4	77%	0.774	79%	0.789	S	S	*	*			trans	78.2	122	-158.2	-58.3	163.8	-174.5	171	0	114.4
273	D	38.5	Very low	35.6	Very low	161 Å²	161	156.1 Å²	156.1	86%	0.861	78%	0.782	S	S	*	*			cis	-136.8	150.2	23.5	-80.2	-48.5	0	0	0	113.2
274	M	34.7	Very low	35.3	Very low	151 Å²	151	155.3 Å²	155.3	74%	0.744	77%	0.774	S	S	*	*			trans	-138.9	94.2	176	-174.6	-93.9	120.2	0	0	109.5
275	D	37	Very low	35.6	Very low	139 Å²	139	154.5 Å²	154.5	74%	0.743	77%	0.769	S	S	*	*			trans	179.3	106.9	152.1	-104.3	-36.9	0	0	0	110.4
276	D	36.1	Very low	35.3	Very low	158 Å²	158	151.3 Å²	151.3	85%	0.845	75%	0.753	S	S	*	*			trans	-158.2	92.4	139.2	-132.2	-29.2	0	0	0	112.7
277	Y	33.1	Very low	35.3	Very low	198 Å²	198	152.5 Å²	152.5	78%	0.776	76%	0.758	S	S	*	*			trans	53.9	99.4	136	-139.9	-96.9	0	0	0	121.6
278	Y	30	Very low	35	Very low	212 Å²	212	151.8 Å²	151.8	83%	0.831	76%	0.762	S	S	*	*			trans	-123.8	125	154.9	-123	-87.8	0	0	0	108.8	R280	Y278-R280 HydrophobicContact CD1-CB 4.33Å
279	P	41.6	Very low	35	Very low	101 Å²	101	148.8 Å²	148.8	66%	0.656	77%	0.765	S	S	*	*				-141.9	142.2	98.1	31.2	-13.8	0	0	0	113
280	R	32.4	Very low	34.7	Very low	196 Å²	196	153.3 Å²	153.3	74%	0.74	77%	0.77	S	S	*	*				79.4	88.5	56.5	-161.9	-174.4	-163.8	112	0.7	116	Y278	Y278-R280 HydrophobicContact CD1-CB 4.33Å
281	K	32.7	Very low	34.6	Very low	163 Å²	163	151.2 Å²	151.2	71%	0.709	77%	0.767	S	S	*	*			trans	57.8	135.3	151.5	-58.6	-173.1	175.9	-167.8	0	120.1
282	H	33	Very low	34.9	Very low	160 Å²	160	149.8 Å²	149.8	74%	0.741	77%	0.765	S	S	*	*				172.6	178.4	105.3	-92.1	-75.6	0	0	0	112.6
283	L	30.1	Very low	34.7	Very low	142 Å²	142	147.2 Å²	147.2	74%	0.743	77%	0.765	S	S	*	*			trans	-44.1	161	-171.2	-64.1	63.8	0	0	0	115.6
284	H	32.3	Very low	34.5	Very low	145 Å²	145	147.2 Å²	147.2	67%	0.671	76%	0.759	S	S	*	*			cis	-171.2	161.8	46.4	-164.7	-91.4	0	0	0	111.2	D286	H284-D286 IonicContact CE1-OD2 2.67Å; H284-D286 IonicContact ND1-OD2 2.65Å
285	P	48.6	Very low	34.4	Very low	95 Å²	95	148 Å²	148	62%	0.617	76%	0.763	S	S	*	*			trans	-82.8	172.5	169.2	34.6	-39.1	0	0	0	114.6
286	D	30.5	Very low	34.4	Very low	115 Å²	115	148 Å²	148	62%	0.615	77%	0.768	S	S	*	*			trans	151.5	166.5	130.4	-76.6	-31.8	0	0	0	114.8	H284	H284-D286 IonicContact CE1-OD2 2.67Å; H284-D286 IonicContact ND1-OD2 2.65Å
287	F	32.2	Very low	34.5	Very low	200 Å²	200	149.5 Å²	149.5	88%	0.877	77%	0.767	S	S	*	*			trans	66.3	129.7	174.1	-61.5	-85.9	0	0	0	118.1
288	A	30.7	Very low	34.5	Very low	98 Å²	98	147.6 Å²	147.6	81%	0.81	77%	0.769	S	S	*	*			cis	139.3	125.9	-11.1	0	0	0	0	0	108.7
289	G	33	Very low	34.6	Very low	81 Å²	81	145 Å²	145	84%	0.835	77%	0.77	S	S	*	*			trans	-138.6	146.1	178.1	0	0	0	0	0	111.9
290	R	35.8	Very low	34.1	Very low	263 Å²	263	144.5 Å²	144.5	99%	0.992	77%	0.774	S	S	*	*			trans	-76.7	159	-178.7	-56.6	175.1	-179.1	-161.9	-0.8	110.6
291	G	30	Very low	33.9	Very low	69 Å²	69	144.6 Å²	144.6	71%	0.711	78%	0.783	S	S	*	*			cis	-170.5	-168.5	6.5	0	0	0	0	0	112.3
292	P	41.6	Very low	33.9	Very low	120 Å²	120	148.4 Å²	148.4	78%	0.779	79%	0.793	S	S	*	*			trans	-107.3	168.2	-162.6	40	-35.6	0	0	0	115.6
293	T	35.4	Very low	34.3	Very low	125 Å²	125	146.4 Å²	146.4	77%	0.767	79%	0.794	S	S	*	*				-178.1	149.2	124.4	24.4	0	0	0	0	115.8
294	H	34.4	Very low	34.6	Very low	161 Å²	161	150.5 Å²	150.5	75%	0.745	80%	0.8	S	S	*	*			trans	30	120.1	157.5	-62.8	-69.4	0	0	0	125.1
295	M	32.3	Very low	34.6	Very low	168 Å²	168	153.8 Å²	153.8	83%	0.828	81%	0.806	S	S	*	*				22.7	129.6	121.6	-58.9	168.9	67.9	0	0	120.7
296	V	37.4	Very low	33.8	Very low	137 Å²	137	154.1 Å²	154.1	83%	0.83	81%	0.806	S	S	*	*				-165.8	153.6	114.8	136.7	0	0	0	0	110.4
297	K	36.6	Very low	34	Very low	190 Å²	190	157.3 Å²	157.3	83%	0.826	82%	0.817	S	S	*	*			trans	-124.4	120.6	178.7	170.3	-172.2	175.1	-178.5	0	109.9
298	L	33.8	Very low	34	Very low	159 Å²	159	158.7 Å²	158.7	83%	0.832	82%	0.817	S	S	*	*			trans	-144	140.4	167.5	-76.4	178.5	0	0	0	111.8
299	N	31.5	Very low	34.3	Very low	158 Å²	158	158.4 Å²	158.4	85%	0.845	81%	0.814	S	S	*	*			trans	-92.4	147.6	159.8	-74.6	-10.5	0	0	0	108.7
300	A	31.4	Very low	34.2	Very low	89 Å²	89	162.4 Å²	162.4	74%	0.736	81%	0.813	S	S	*	*			trans	-176.6	119.6	137.2	0	0	0	0	0	113.7
301	E	28.8	Very low	34	Very low	199 Å²	199	153.4 Å²	153.4	93%	0.93	79%	0.79	S	S	*	*			trans	55.6	166.5	133.6	-56	-165.3	101.3	0	0	123.8
302	R	33.3	Very low	34.1	Very low	242 Å²	242	157.6 Å²	157.6	91%	0.913	79%	0.791	S	S	*	*			trans	-95.4	160.3	-170.9	-66.4	168.6	162.3	170.1	-7.1	112.6
303	P	40.7	Very low	33.8	Very low	119 Å²	119	158.3 Å²	158.3	77%	0.773	79%	0.789	S	S	*	*				-145.7	151.6	118.9	33.3	-16.4	0	0	0	118.1
304	R	36.6	Very low	33.7	Very low	227 Å²	227	161 Å²	161	86%	0.857	79%	0.792	S	S	*	*			trans	10.8	155	135.5	-69.2	172.8	-179.8	170	1	121
305	R	31.8	Very low	33.5	Very low	214 Å²	214	159.6 Å²	159.6	81%	0.808	80%	0.795	S	S	*	*			cis	173.9	163.1	-10.2	-170.3	-164.2	-171.4	166.3	4	110
306	V	32.3	Very low	33.4	Very low	102 Å²	102	158.4 Å²	158.4	62%	0.618	79%	0.791	S	S	*	*			trans	79.6	126.6	158.3	-159	0	0	0	0	120
307	Q	33.9	Very low	33	Very low	182 Å²	182	157.9 Å²	157.9	85%	0.85	79%	0.788	S	S	*	*				-161.8	165.7	120.4	-149.8	57.9	-2.3	0	0	111.6
308	R	33.4	Very low	33.4	Very low	230 Å²	230	154.8 Å²	154.8	87%	0.868	79%	0.787	S	S	*	*			trans	-130.5	149.7	-167.6	-66.4	173.2	168.8	149.5	-10.8	114.1
309	A	35.9	Very low	33.2	Very low	91 Å²	91	159.3 Å²	159.3	75%	0.752	79%	0.793	S	S	*	*			trans	-168.7	143.3	137.8	0	0	0	0	0	107.8
310	M	31.2	Very low	33.3	Very low	166 Å²	166	162.9 Å²	162.9	82%	0.818	80%	0.795	S	S	*	*			cis	71.6	132.9	31.6	-55.9	-63.4	-70.8	0	0	112.9
311	S	31.3	Very low	33.3	Very low	73 Å²	73	161.3 Å²	161.3	51%	0.51	79%	0.787	S	S	.	*			cis	-167.5	149.7	-0.2	-157.4	0	0	0	0	110.7
312	Q	33.3	Very low	33.6	Very low	157 Å²	157	158.5 Å²	158.5	73%	0.734	78%	0.779	S	S	*	*			trans	61.9	166.4	150.3	-69.9	171.4	-81	0	0	119.9
313	D	33.3	Very low	33.7	Very low	135 Å²	135	157.4 Å²	157.4	72%	0.722	78%	0.776	S	S	*	*			cis	-156.9	-177.9	-20.5	-106.9	-22.4	0	0	0	112.1
314	H	34.1	Very low	33.4	Very low	182 Å²	182	155.2 Å²	155.2	84%	0.843	78%	0.775	S	S	*	*			trans	-49.3	158.9	176.4	-101.2	37.3	0	0	0	118.7
315	V	30	Very low	33.4	Very low	132 Å²	132	152.4 Å²	152.4	80%	0.8	78%	0.776	S	S	*	*				-174	131.3	125.1	135	0	0	0	0	117.2
316	L	30.5	Very low	33.5	Very low	142 Å²	142	147.3 Å²	147.3	74%	0.743	77%	0.773	S	S	*	*			trans	29.9	122.5	150.4	-61.7	168.2	0	0	0	126.5
317	T	30.1	Very low	33.9	Very low	126 Å²	126	146.9 Å²	146.9	77%	0.773	78%	0.775	S	S	*	*			trans	35.5	150.2	131	48.4	0	0	0	0	125.5
318	P	45	Very low	34.2	Very low	125 Å²	125	149.3 Å²	149.3	81%	0.812	78%	0.778	S	S	*	*			trans	-91.1	169	-170.4	38.6	-39.1	0	0	0	116.4
319	R	29.5	Very low	34.7	Very low	254 Å²	254	141.3 Å²	141.3	96%	0.958	77%	0.767	S	S	*	*			trans	-123.5	163.8	169.1	-167.2	169.1	175.7	118	4.6	112.3
320	R	33.7	Very low	35	Very low	234 Å²	234	142.2 Å²	142.2	88%	0.883	77%	0.774	S	S	*	*			trans	-127	149.2	-159	172.7	-170.4	-175.2	175.9	4	112.3
321	G	29.9	Very low	35.5	Very low	55 Å²	55	143.4 Å²	143.4	57%	0.567	78%	0.78	S	S	*	*			trans	175.4	115.2	160.8	0	0	0	0	0	109
322	D	35	Very low	36.1	Very low	141 Å²	141	144.5 Å²	144.5	75%	0.754	79%	0.793	S	S	*	*				89.1	143.2	81.6	-63.3	-29.4	0	0	0	110.5
323	Y	36.2	Very low	36.6	Very low	218 Å²	218	141.9 Å²	141.9	86%	0.855	80%	0.799	S	S	*	*			cis	-157	140.3	17.7	32.3	-95.9	0	0	0	112.5
324	G	33.5	Very low	36.9	Very low	73 Å²	73	140.4 Å²	140.4	75%	0.753	81%	0.806	S	S	*	*			trans	62.4	159.3	164.8	0	0	0	0	0	118.1
325	L	37.1	Very low	37.2	Very low	168 Å²	168	135.1 Å²	135.1	88%	0.88	79%	0.793	S	S	*	*			cis	-160.9	167	-10.2	-137	69.4	0	0	0	105.4
326	S	33.3	Very low	37.5	Very low	107 Å²	107	140 Å²	140	75%	0.748	80%	0.799	S	S	*	*			cis	-153.8	-159.2	8.9	-164.3	0	0	0	0	110.5
327	S	42.6	Very low	37.5	Very low	93 Å²	93	136.9 Å²	136.9	65%	0.65	80%	0.801	S	S	*	*			trans	-76.3	127.1	-178.9	164.9	0	0	0	0	115.3
328	Y	40	Very low	37.6	Very low	234 Å²	234	135.8 Å²	135.8	92%	0.918	80%	0.798	S	S	*	*	S	Bend		-176.7	120.1	125.4	-97.8	-67.4	0	0	0	109.4
329	G	42.7	Very low	37	Very low	61 Å²	61	135.1 Å²	135.1	63%	0.629	80%	0.796	S	S	*	*			trans	144.7	-9.4	174	0	0	0	0	0	117.7	M331	G329-M331 PolarHBondContact O-N 2.73Å
330	A	41.7	Very low	37.4	Very low	110 Å²	110	133.5 Å²	133.5	91%	0.909	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.1	26.4	-171.1	0	0	0	0	0	116.6
331	M	43.2	Very low	37.3	Very low	192 Å²	192	130.4 Å²	130.4	95%	0.946	79%	0.791	S	S	*	*	T	Hydrogen-bonded Turn	trans	-129.9	4.2	178.7	-69.8	-171.4	177.8	0	0	114.7	G329	G329-M331 PolarHBondContact O-N 2.73Å
332	A	42.9	Very low	37.5	Very low	95 Å²	95	135.5 Å²	135.5	79%	0.785	81%	0.805	S	S	*	*	S	Bend	trans	-110.1	-19.1	-177.2	0	0	0	0	0	115.4
333	A	43.9	Very low	37.3	Very low	103 Å²	103	134 Å²	134	85%	0.851	81%	0.805	S	S	*	*	S	Bend	trans	-102.5	18.5	-167.8	0	0	0	0	0	115
334	A	39.2	Very low	37.2	Very low	104 Å²	104	130.4 Å²	130.4	86%	0.86	80%	0.801	S	S	*	*			trans	-109.2	22.1	-170.7	0	0	0	0	0	114.5
335	A	40.3	Very low	37.2	Very low	70 Å²	70	135.2 Å²	135.2	58%	0.579	80%	0.804	S	S	*	*	S	Bend	trans	-130.7	141	174.6	0	0	0	0	0	110.7
336	Y	37.7	Very low	37.1	Very low	235 Å²	235	135.7 Å²	135.7	92%	0.922	80%	0.801	S	S	*	*			trans	63.1	69	176	-50.4	-70.4	0	0	0	116.8
337	G	29.9	Very low	37.2	Very low	76 Å²	76	137.1 Å²	137.1	78%	0.784	80%	0.8	S	S	*	*			trans	-83.3	-179	152.1	0	0	0	0	0	112.9
338	S	31.2	Very low	36.8	Very low	103 Å²	103	140.7 Å²	140.7	72%	0.72	81%	0.811	S	S	*	*			trans	92.6	78.8	169.4	-158.5	0	0	0	0	118.6
339	S	33.3	Very low	36.5	Very low	111 Å²	111	135.3 Å²	135.3	78%	0.776	81%	0.807	S	S	*	*			trans	-163.9	98.3	131.1	-79.7	0	0	0	0	107.8
340	R	38.6	Very low	36.2	Very low	221 Å²	221	136.5 Å²	136.5	83%	0.834	81%	0.812	S	S	*	*				57.5	77.9	84.8	-68.2	-172	176.3	168	0.4	113.2
341	N	30.4	Very low	36	Very low	168 Å²	168	138.5 Å²	138.5	90%	0.898	81%	0.807	S	S	*	*			trans	-63.3	139	156.9	-65.5	-51.7	0	0	0	109.4
342	L	33.9	Very low	35.5	Very low	163 Å²	163	141.1 Å²	141.1	85%	0.853	81%	0.806	S	S	*	*			trans	-132.6	147.1	168.4	-99.2	160.1	0	0	0	108.7
343	S	32.4	Very low	35	Very low	109 Å²	109	143.8 Å²	143.8	76%	0.762	81%	0.806	S	S	*	*			trans	-78.7	154.9	-157.7	50.1	0	0	0	0	115.1
344	N	33.8	Very low	34.3	Very low	142 Å²	142	147.2 Å²	147.2	76%	0.759	81%	0.805	S	S	*	*			trans	-62.2	-179.2	154.5	-72.9	-11.9	0	0	0	111.2
345	E	34.1	Very low	33.9	Very low	175 Å²	175	147.7 Å²	147.7	82%	0.818	80%	0.802	S	S	*	*			trans	71.1	76.2	172.9	-55.5	-53.3	104.2	0	0	117.2
346	Q	33.8	Very low	33.5	Very low	177 Å²	177	152.2 Å²	152.2	83%	0.827	81%	0.811	S	S	*	*			trans	-152.2	107.5	137.2	-123.2	178.3	-3.7	0	0	115.5
347	L	35.8	Very low	33.3	Very low	137 Å²	137	147.7 Å²	147.7	72%	0.717	80%	0.802	S	S	*	*			trans	51.5	108.5	142	-62.4	173.3	0	0	0	120.8
348	L	33.8	Very low	34.1	Very low	168 Å²	168	149 Å²	149	88%	0.88	80%	0.797	S	S	*	*				8.6	113.6	121.9	-71.1	149.9	0	0	0	116.5
349	S	34.4	Very low	34.2	Very low	121 Å²	121	152.2 Å²	152.2	85%	0.846	81%	0.806	S	S	*	*			trans	-152.9	113.8	154.7	-75.9	0	0	0	0	110
350	A	36	Very low	34	Very low	87 Å²	87	154.4 Å²	154.4	72%	0.719	81%	0.808	S	S	*	*			trans	-80.1	174.1	162.6	0	0	0	0	0	110
351	D	36.9	Very low	33.9	Very low	151 Å²	151	149.1 Å²	149.1	81%	0.807	81%	0.805	S	S	*	*			trans	59	94.4	171.4	-61.5	-32.9	0	0	0	118
352	R	33.9	Very low	34.6	Very low	247 Å²	247	146.8 Å²	146.8	93%	0.932	80%	0.799	S	S	*	*				-153.6	126.6	113.6	-118.1	173.5	178	82	0.7	115.2
353	L	31.5	Very low	34.5	Very low	151 Å²	151	143.4 Å²	143.4	79%	0.791	79%	0.794	S	S	*	*			trans	-93.1	169.7	165.5	-103.2	146	0	0	0	110.4
354	H	29.8	Very low	34.5	Very low	176 Å²	176	145.7 Å²	145.7	82%	0.815	80%	0.795	S	S	*	*			trans	71.7	109.6	168.9	-72	91.1	0	0	0	119.8
355	S	30.3	Very low	34.6	Very low	114 Å²	114	150.6 Å²	150.6	80%	0.797	80%	0.803	S	S	*	*			trans	171.9	128.3	131.1	-150.6	0	0	0	0	106.1
356	Q	31.8	Very low	34.8	Very low	164 Å²	164	150.8 Å²	150.8	77%	0.766	80%	0.796	S	S	*	*				50.9	126.1	56.5	-68.9	-177.3	-4.8	0	0	112.3
357	D	34	Very low	34.9	Very low	140 Å²	140	146.8 Å²	146.8	75%	0.749	78%	0.78	S	S	*	*			cis	-150.6	172.2	14	-112.6	-9.8	0	0	0	112.9
358	P	46.4	Very low	34.8	Very low	104 Å²	104	146.5 Å²	146.5	68%	0.675	77%	0.773	S	S	*	*			trans	-93.1	154.7	-172.2	36.6	-35.2	0	0	0	114.3
359	L	32.4	Very low	35	Very low	171 Å²	171	147 Å²	147	90%	0.895	77%	0.769	S	S	*	*			trans	-133.5	151	167.1	-78.1	179.1	0	0	0	114.3
360	L	29.6	Very low	35.1	Very low	156 Å²	156	150.7 Å²	150.7	82%	0.817	76%	0.764	S	S	*	*			trans	-76.7	150.8	-158	-68.8	64.6	0	0	0	114.7
361	S	36.1	Very low	35.1	Very low	111 Å²	111	155.3 Å²	155.3	78%	0.776	77%	0.77	S	S	*	*			trans	-74.2	169	153.5	-40.6	0	0	0	0	111
362	P	46	Very low	35	Very low	119 Å²	119	156.6 Å²	156.6	77%	0.773	77%	0.769	S	S	*	*				-149.4	158.7	110	37.7	-23.1	0	0	0	116.4
363	A	32.4	Very low	35.2	Very low	91 Å²	91	149.4 Å²	149.4	75%	0.752	76%	0.763	S	S	*	*			trans	64.7	144.6	151.2	0	0	0	0	0	119.2
364	M	31.7	Very low	35.6	Very low	157 Å²	157	151.1 Å²	151.1	77%	0.773	77%	0.769	S	S	*	*			cis	-162.7	144	-15.2	-116.1	-133.5	-66.5	0	0	109
365	R	35.9	Very low	36	Very low	246 Å²	246	147.7 Å²	147.7	93%	0.928	77%	0.771	S	S	*	*			trans	-168.4	92.9	140.4	-98.3	-68	149.2	69.2	2.5	109.3
366	R	38.8	Very low	36.4	Very low	178 Å²	178	154.2 Å²	154.2	67%	0.672	78%	0.778	S	S	*	*			trans	-73.6	163.2	165.3	-78.8	175.6	83.8	124.6	-13.7	109.6
367	D	35.5	Very low	36.6	Very low	94 Å²	94	151.2 Å²	151.2	50%	0.503	78%	0.781	S	S	.	*			cis	-157.4	152.9	4.2	-122.3	-16.5	0	0	0	110.9
368	K	34.3	Very low	36.7	Very low	131 Å²	131	153.6 Å²	153.6	57%	0.57	79%	0.79	S	S	*	*			trans	45.1	137.2	139.4	-61.6	171.2	-176.4	82.6	0	120
369	F	37	Very low	36.1	Very low	179 Å²	179	153.6 Å²	153.6	79%	0.785	79%	0.793	S	S	*	*				-156.1	128.5	64.2	-116.7	-100.1	0	0	0	114.4
370	R	37.1	Very low	36.3	Very low	197 Å²	197	153.5 Å²	153.5	74%	0.743	79%	0.787	S	S	*	*			trans	51.7	109.6	137.2	-164.7	-172.4	-168.4	-170.3	3.6	116.7
371	E	35.1	Very low	36.8	Very low	184 Å²	184	151.2 Å²	151.2	86%	0.86	79%	0.791	S	S	*	*			cis	48.2	97	29.9	-161.8	-171.5	-170.1	0	0	115.5
372	K	35.5	Very low	36.8	Very low	178 Å²	178	152.6 Å²	152.6	77%	0.774	79%	0.789	S	S	*	*			trans	-168.5	144	139.7	-112.5	172.1	-177.5	-177.4	0	111
373	A	38.1	Very low	36.2	Very low	97 Å²	97	155.2 Å²	155.2	80%	0.802	79%	0.793	S	S	*	*	S	Bend	trans	68.7	122.3	-177.1	0	0	0	0	0	114.1
374	M	39.3	Very low	36.6	Very low	186 Å²	186	158.8 Å²	158.8	92%	0.916	80%	0.799	S	S	*	*			cis	-140	123.1	-0.3	-62.3	-179	-80.4	0	0	110.3
375	A	37.5	Very low	36.9	Very low	104 Å²	104	158.9 Å²	158.9	86%	0.86	80%	0.8	S	S	*	*			trans	-154.4	40.2	-177.4	0	0	0	0	0	115
376	R	39.4	Very low	37.2	Very low	251 Å²	251	153.1 Å²	153.1	95%	0.947	79%	0.794	S	S	*	*			trans	-163.2	114.9	163.9	-140.5	172.9	-177.5	145.6	-0	114
377	A	36.3	Very low	37.3	Very low	101 Å²	101	150.8 Å²	150.8	84%	0.835	80%	0.8	S	S	*	*			trans	-170	61	155.9	0	0	0	0	0	110.9
378	M	36	Very low	37.6	Very low	190 Å²	190	152.3 Å²	152.3	94%	0.936	81%	0.813	S	S	*	*			trans	-119.5	116.1	161.5	-68.4	-163.1	-58.6	0	0	108
379	S	33.9	Very low	38.3	Very low	104 Å²	104	152 Å²	152	73%	0.727	82%	0.824	S	S	*	*			trans	-161.4	114.6	175.3	53.8	0	0	0	0	110.4
380	H	37	Very low	38.2	Very low	170 Å²	170	149.6 Å²	149.6	79%	0.787	82%	0.824	S	S	*	*			trans	30.7	112.2	151.2	-57.8	-89.3	0	0	0	118.7
381	A	38.7	Very low	38.3	Very low	108 Å²	108	147.8 Å²	147.8	89%	0.893	83%	0.826	S	S	*	*			trans	-108.8	106.6	149.6	0	0	0	0	0	107.5
382	D	36.6	Very low	38.1	Very low	139 Å²	139	147 Å²	147	74%	0.743	83%	0.827	S	S	*	*			trans	-78.6	162	179.9	-76.2	-56.3	0	0	0	112.7	L384	D382-L384 PolarHBondContact O-N 2.86Å
383	M	34.1	Very low	38.1	Very low	174 Å²	174	147.2 Å²	147.2	86%	0.857	82%	0.823	S	S	*	*			trans	-64.6	128.5	179.9	-66.9	178.8	-76.1	0	0	112.4
384	L	40.7	Very low	38.1	Very low	166 Å²	166	149.3 Å²	149.3	87%	0.869	82%	0.816	S	S	*	*			trans	-129.7	104.2	158.6	-72.8	177.4	0	0	0	110.2	D382	D382-L384 PolarHBondContact O-N 2.86Å
385	M	38.1	Very low	38.1	Very low	160 Å²	160	150.4 Å²	150.4	79%	0.788	82%	0.816	S	S	*	*			trans	-77.3	129.2	169.6	-73.5	-79.2	102.8	0	0	110.1	T387	M385-T387 PolarHBondContact O-N 2.82Å
386	P	41.5	Very low	38.1	Very low	125 Å²	125	154.2 Å²	154.2	81%	0.812	82%	0.818	S	S	*	*			trans	-68.4	111.8	165.1	-18.5	32.8	0	0	0	110.2
387	T	41.5	Very low	38	Very low	129 Å²	129	149 Å²	149	79%	0.791	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-70.1	142.9	177.9	48.3	0	0	0	0	112.3	M385	M385-T387 PolarHBondContact O-N 2.82Å
388	T	41.3	Very low	38.1	Very low	126 Å²	126	152.9 Å²	152.9	77%	0.773	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-73.1	141.5	172.8	47.6	0	0	0	0	112.3
389	P	49.2	Very low	38.3	Very low	124 Å²	124	152.4 Å²	152.4	81%	0.805	81%	0.81	S	S	*	*	P	Polyproline II helix	trans	-95.4	128.9	157	33.1	-27.9	0	0	0	110.3
390	V	36	Very low	38.4	Very low	129 Å²	129	155.5 Å²	155.5	78%	0.782	81%	0.813	S	S	*	*	P	Polyproline II helix	trans	-96.3	127.4	174.6	171.1	0	0	0	0	109.9
391	M	39	Very low	38.3	Very low	159 Å²	159	153 Å²	153	78%	0.783	81%	0.814	S	S	*	*			trans	26	119.7	155.9	-60.7	-66.9	-69.6	0	0	119.3
392	D	30.8	Very low	38.2	Very low	167 Å²	167	156.6 Å²	156.6	89%	0.893	81%	0.813	S	S	*	*			trans	-137.3	167.5	134.7	-154.3	-4.4	0	0	0	110.7
393	R	34.6	Very low	38.4	Very low	182 Å²	182	156 Å²	156	69%	0.687	82%	0.817	S	S	*	*			trans	-130.8	137	-140.3	-161.4	-178.9	151.4	152	-6.8	114.3
394	H	37.7	Very low	38.2	Very low	142 Å²	142	153.9 Å²	153.9	66%	0.657	82%	0.819	S	S	*	*			trans	75.4	119.9	173	-33.4	99.4	0	0	0	117.8
395	K	39.4	Very low	37.8	Very low	209 Å²	209	150.6 Å²	150.6	91%	0.909	82%	0.815	S	S	*	*				-153.4	152.2	107.9	-105.6	165	-172.5	174.9	0	109.9
396	M	38.5	Very low	37.6	Very low	183 Å²	183	148.7 Å²	148.7	90%	0.901	82%	0.818	S	S	*	*			trans	-96.2	126.3	-174.7	-62.5	169.7	179.1	0	0	110.6
397	T	37.2	Very low	37.1	Very low	142 Å²	142	150 Å²	150	87%	0.871	82%	0.818	S	S	*	*			trans	-143.4	119.8	161.5	6.3	0	0	0	0	109.9
398	K	37.6	Very low	36.7	Very low	182 Å²	182	151.8 Å²	151.8	79%	0.791	82%	0.823	S	S	*	*			trans	-92.6	118.6	-177.1	170	-171.4	175.8	-176.4	0	109.2
399	M	40.2	Very low	36.3	Very low	181 Å²	181	149.9 Å²	149.9	89%	0.892	81%	0.814	S	S	*	*			trans	-131.3	148.9	163.2	-67.6	-152.2	-62.6	0	0	111
400	H	37.5	Very low	35.5	Very low	168 Å²	168	154.9 Å²	154.9	78%	0.778	82%	0.819	S	S	*	*			trans	-100.1	140.3	177.6	-77.7	7.3	0	0	0	110.8
401	S	34.8	Very low	35.4	Very low	118 Å²	118	156.1 Å²	156.1	83%	0.825	82%	0.821	S	S	*	*			trans	-163.9	114.2	147	55	0	0	0	0	109.7
402	Q	36.5	Very low	35.1	Very low	183 Å²	183	154.9 Å²	154.9	86%	0.855	82%	0.823	S	S	*	*	P	Polyproline II helix	trans	-84.2	151.6	163.4	-76.9	-178.4	-23.2	0	0	109.6
403	P	41.1	Very low	35.2	Very low	128 Å²	128	154.6 Å²	154.6	83%	0.831	82%	0.821	S	S	*	*	P	Polyproline II helix	trans	-72.2	136.8	171.7	30.8	-34	0	0	0	110.8
404	S	29.4	Very low	35.1	Very low	128 Å²	128	154 Å²	154	90%	0.895	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-82.2	118	174.4	-55.7	0	0	0	0	111
405	A	32.2	Very low	34.9	Very low	97 Å²	97	153.4 Å²	153.4	80%	0.802	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-99.4	127.6	163.5	0	0	0	0	0	109.1
406	S	33.5	Very low	34.3	Very low	120 Å²	120	149.8 Å²	149.8	84%	0.839	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-87.1	117	177.5	51.3	0	0	0	0	110.9
407	N	31.6	Very low	34.1	Very low	154 Å²	154	148.1 Å²	148.1	82%	0.824	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-82.3	134.1	163.3	-73.6	-23.5	0	0	0	109.5
408	D	32.6	Very low	33.7	Very low	165 Å²	165	150 Å²	150	88%	0.882	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-101.6	148.3	147.5	-99.3	-50.2	0	0	0	108.6
409	S	32.6	Very low	33.4	Very low	86 Å²	86	146.1 Å²	146.1	60%	0.601	81%	0.814	S	S	*	*			trans	-147.3	132.4	-169.1	59.5	0	0	0	0	113.1
410	Y	33.3	Very low	32.9	Very low	230 Å²	230	140.5 Å²	140.5	90%	0.902	80%	0.803	S	S	*	*			trans	-132.3	145.1	163.9	-83.4	-78.5	0	0	0	111.1
411	N	33.3	Very low	32.7	Very low	155 Å²	155	139.2 Å²	139.2	83%	0.829	81%	0.807	S	S	*	*			trans	-94.6	161.2	-158.2	-77	-69.5	0	0	0	114.8
412	T	33.5	Very low	32.5	Very low	133 Å²	133	138.7 Å²	138.7	82%	0.816	80%	0.804	S	S	*	*			trans	-111.3	154.6	167.3	46	0	0	0	0	111.9
413	L	33.1	Very low	32.3	Very low	161 Å²	161	136 Å²	136	84%	0.843	80%	0.8	S	S	*	*			trans	-132.9	118.3	165.7	-78.1	155.7	0	0	0	105.3
414	M	32.3	Very low	31.9	Very low	169 Å²	169	135.1 Å²	135.1	83%	0.833	80%	0.797	S	S	*	*				57	122.3	78.3	-64.4	-68.9	-172.2	0	0	110.8
415	V	31.8	Very low	32.1	Very low	130 Å²	130	138.8 Å²	138.8	79%	0.788	80%	0.796	S	S	*	*			cis	-153.4	159.1	44.8	162.2	0	0	0	0	107.4
416	N	28.6	Very low	32.5	Very low	132 Å²	132	145.5 Å²	145.5	71%	0.706	80%	0.801	S	S	*	*			cis	-152.9	-173.5	32.3	-149.8	-6	0	0	0	114.8
417	H	33.6	Very low	32.9	Very low	149 Å²	149	148.6 Å²	148.6	69%	0.69	80%	0.802	S	S	*	*			trans	-94.2	159.2	171	-63.8	-98.3	0	0	0	114.6
418	H	29.6	Very low	33	Very low	180 Å²	180	145 Å²	145	83%	0.833	79%	0.794	S	S	*	*				177.9	-177.3	98.8	-92.3	-64.5	0	0	0	112.3
419	A	31.3	Very low	33	Very low	101 Å²	101	147.2 Å²	147.2	84%	0.835	80%	0.797	S	S	*	*			trans	-133.7	167.6	-155	0	0	0	0	0	114.8
420	G	29.6	Very low	33	Very low	64 Å²	64	147.2 Å²	147.2	66%	0.66	80%	0.802	S	S	*	*			trans	113.4	106	150.7	0	0	0	0	0	118
421	T	31.6	Very low	33.1	Very low	140 Å²	140	141.5 Å²	141.5	86%	0.859	80%	0.795	S	S	*	*			trans	38.9	117.3	139.9	55.4	0	0	0	0	121.4
422	S	30.5	Very low	33.1	Very low	108 Å²	108	145.6 Å²	145.6	76%	0.755	80%	0.799	S	S	*	*				179.9	143.4	116.1	55.8	0	0	0	0	115.7
423	T	33	Very low	33.3	Very low	126 Å²	126	150.6 Å²	150.6	77%	0.773	80%	0.803	S	S	*	*			trans	45.3	107.5	146.9	56.2	0	0	0	0	123.3
424	S	33.2	Very low	33.7	Very low	110 Å²	110	149.2 Å²	149.2	77%	0.769	80%	0.801	S	S	*	*				62.7	143.7	104.2	-152.6	0	0	0	0	123.5
425	K	33.1	Very low	33.8	Very low	204 Å²	204	149.2 Å²	149.2	89%	0.887	80%	0.799	S	S	*	*			trans	90	156.5	163.9	-69.6	177.7	178.6	175	0	119.7
426	R	40.4	Very low	34.1	Very low	238 Å²	238	149.9 Å²	149.9	90%	0.898	80%	0.803	S	S	*	*			trans	-98.5	146.4	-169.9	-57.3	174	174.1	-163.9	-1.6	112.3
427	Q	41.9	Very low	34.2	Very low	185 Å²	185	148.3 Å²	148.3	86%	0.864	80%	0.798	S	S	*	*			trans	-170.2	129.8	140.8	-98.8	149.8	7.3	0	0	105.4
428	A	33.8	Very low	34.3	Very low	80 Å²	80	147.3 Å²	147.3	66%	0.661	80%	0.798	S	S	*	*			cis	66	103.1	37.4	0	0	0	0	0	113.5
429	F	33.1	Very low	34.5	Very low	211 Å²	211	147.8 Å²	147.8	93%	0.925	80%	0.8	S	S	*	*				-174.2	168.4	113.4	-102.1	-67.8	0	0	0	113.9
430	A	32	Very low	34.7	Very low	86 Å²	86	149.9 Å²	149.9	71%	0.711	80%	0.797	S	S	*	*			trans	-70.5	152.3	-160.1	0	0	0	0	0	118.3
431	S	34.8	Very low	35	Very low	109 Å²	109	156.3 Å²	156.3	76%	0.762	81%	0.81	S	S	*	*				22.5	130	129.7	-172.4	0	0	0	0	120.1
432	R	34.2	Very low	34.8	Very low	241 Å²	241	158.5 Å²	158.5	91%	0.909	80%	0.804	S	S	*	*			trans	-150.4	132.8	140	-107.3	163.7	-165.1	-116.5	-0.5	111.2
433	R	36.9	Very low	34.9	Very low	239 Å²	239	161.1 Å²	161.1	90%	0.902	81%	0.807	S	S	*	*			trans	-89.2	146	159.2	-65.2	179.2	-177.6	163.4	-0.1	108.3
434	T	42.7	Very low	35.2	Very low	132 Å²	132	159.4 Å²	159.4	81%	0.81	80%	0.798	S	S	*	*			trans	-136.1	130.7	159.5	43.3	0	0	0	0	109.9
435	H	34.3	Very low	35.1	Very low	169 Å²	169	157 Å²	157	78%	0.782	79%	0.791	S	S	*	*			trans	-63.1	149.9	168.4	-104.7	-126.3	0	0	0	110.8	V437	H435-V437 HydrophobicContact CB-CG2 4.39Å; H435-V437 VanDerWaalsContact ND1-CG2 3.27Å; H435-V437 WeakPolarHBondContact ND1-CG2 3.27Å
436	T	37.9	Very low	35	Very low	143 Å²	143	156.5 Å²	156.5	88%	0.877	79%	0.792	S	S	*	*			trans	-128.8	146.5	140.7	47.7	0	0	0	0	108
437	V	31.1	Very low	34.6	Very low	99 Å²	99	152.7 Å²	152.7	60%	0.6	78%	0.784	S	S	*	*			trans	-138.1	159.9	-176.7	-161.6	0	0	0	0	107.5	H435	H435-V437 HydrophobicContact CB-CG2 4.39Å; H435-V437 VanDerWaalsContact ND1-CG2 3.27Å; H435-V437 WeakPolarHBondContact ND1-CG2 3.27Å
438	D	35.6	Very low	34.3	Very low	129 Å²	129	153.3 Å²	153.3	69%	0.69	79%	0.786	S	S	*	*			trans	66.7	115.2	168.7	-58.2	-53.9	0	0	0	118.3
439	H	33.8	Very low	34.4	Very low	190 Å²	190	153.7 Å²	153.7	88%	0.88	78%	0.78	S	S	*	*				-147.3	135.4	96.6	-142.2	-74.6	0	0	0	112.1
440	L	35.7	Very low	34.3	Very low	144 Å²	144	153.8 Å²	153.8	75%	0.754	78%	0.776	S	S	*	*			trans	-85.6	155.4	172.9	-81.1	155.6	0	0	0	111.4
441	Q	35.6	Very low	34.5	Very low	199 Å²	199	160.9 Å²	160.9	93%	0.93	79%	0.785	S	S	*	*			trans	-139.4	137.6	159.3	-159.3	166.1	8.6	0	0	109.2
442	Y	26.7	Very low	34.7	Very low	187 Å²	187	162 Å²	162	73%	0.733	79%	0.787	S	S	*	*			trans	-144	142.6	-162.5	160.7	-83.4	0	0	0	110.7	P444	Y442-P444 HydrophobicContact CE1-CB 4.14Å; Y442-P444 HydrophobicContact CE1-CG 4.13Å; Y442-P444 HydrophobicContact CE2-CB 4.09Å; Y442-P444 WeakPolarHBondContact OH-CB 3.4Å
443	I	32.5	Very low	34.6	Very low	163 Å²	163	155.1 Å²	155.1	84%	0.836	78%	0.782	S	S	*	*			trans	-167.9	152.1	154.6	-105.8	151	0	0	0	109.2
444	P	39.9	Very low	34.6	Very low	89 Å²	89	148.9 Å²	148.9	58%	0.578	78%	0.775	S	S	*	*			trans	-134.5	176.5	-137.1	42.7	-28.2	0	0	0	118.1	Y442	Y442-P444 HydrophobicContact CE1-CB 4.14Å; Y442-P444 HydrophobicContact CE1-CG 4.13Å; Y442-P444 HydrophobicContact CE2-CB 4.09Å; Y442-P444 WeakPolarHBondContact OH-CB 3.4Å
445	G	30.6	Very low	34.6	Very low	61 Å²	61	149 Å²	149	63%	0.629	76%	0.764	S	S	*	*			trans	121.1	109.6	132.5	0	0	0	0	0	118.1
446	H	31.2	Very low	35	Very low	193 Å²	193	148.6 Å²	148.6	89%	0.894	77%	0.767	S	S	*	*				177.7	156	103.4	-100.6	-83.2	0	0	0	111.6
447	H	32.7	Very low	35.3	Very low	158 Å²	158	148.6 Å²	148.6	73%	0.731	76%	0.758	S	S	*	*			trans	-120.5	151.6	-176.1	-65.1	-106	0	0	0	112.2
448	H	34.8	Very low	36	Very low	198 Å²	198	150.8 Å²	150.8	92%	0.917	77%	0.771	S	S	*	*			trans	-142.8	153.6	138.6	-83.3	-63	0	0	0	110.2
449	T	35.7	Very low	36.5	Very low	88 Å²	88	150.6 Å²	150.6	54%	0.54	78%	0.775	S	S	.	*			trans	-143.2	-179.8	-166.7	40.9	0	0	0	0	111.4
450	Y	31.6	Very low	37.3	Very low	213 Å²	213	151.9 Å²	151.9	84%	0.835	80%	0.796	S	S	*	*			trans	79.5	148.3	177.4	-42.5	-65.5	0	0	0	114.4
451	R	35.9	Very low	37.3	Very low	235 Å²	235	152.3 Å²	152.3	89%	0.887	80%	0.798	S	S	*	*			cis	-147.4	165.7	8.5	-143.2	169.7	-158.6	168.7	4.2	111.6
452	T	39.1	Very low	37.4	Very low	131 Å²	131	149.8 Å²	149.8	80%	0.804	79%	0.791	S	S	*	*			trans	-104	178.3	180	49.3	0	0	0	0	112.5
453	A	33.4	Very low	38	Very low	98 Å²	98	147.8 Å²	147.8	81%	0.81	79%	0.794	S	S	*	*			trans	75.4	155.8	167	0	0	0	0	0	117.3
454	S	35.4	Very low	38.4	Very low	108 Å²	108	146.9 Å²	146.9	76%	0.755	79%	0.791	S	S	*	*			cis	-172.3	149.1	-26.2	-178	0	0	0	0	109.6
455	K	42.9	Very low	38.3	Very low	134 Å²	134	150.5 Å²	150.5	58%	0.583	81%	0.805	S	S	*	*			trans	58.2	141.3	159	-130	-178.6	-178.7	-164.5	0	119.8	E457	K455-E457 WeakPolarHBondContact CE-OE1 2.76Å; K455-E457 VanDerWaalsContact CE-OE2 3.26Å; K455-E457 WeakPolarHBondContact CE-OE2 3.26Å; K455-E457 VanDerWaalsContact NZ-CD 3.29Å; K455-E457 IonicContact NZ-OE1 3.18Å; K455-E457 PolarHBondContact NZ-OE1 3.18Å; K455-E457 IonicContact NZ-OE2 2.81Å; K455-E457 PolarHBondContact NZ-OE2 2.81Å
456	N	42.5	Very low	38.8	Very low	160 Å²	160	156.5 Å²	156.5	86%	0.856	82%	0.816	S	S	*	*				-167.1	138.2	112.7	-93.9	-16.5	0	0	0	111.5
457	E	44.8	Very low	39.3	Very low	143 Å²	143	153.9 Å²	153.9	67%	0.668	81%	0.811	S	S	*	*			trans	-118.2	128.1	177.3	-64.4	146.1	-158	0	0	107.2	K455	K455-E457 WeakPolarHBondContact CE-OE1 2.76Å; K455-E457 VanDerWaalsContact CE-OE2 3.26Å; K455-E457 WeakPolarHBondContact CE-OE2 3.26Å; K455-E457 VanDerWaalsContact NZ-CD 3.29Å; K455-E457 IonicContact NZ-OE1 3.18Å; K455-E457 PolarHBondContact NZ-OE1 3.18Å; K455-E457 IonicContact NZ-OE2 2.81Å; K455-E457 PolarHBondContact NZ-OE2 2.81Å
458	V	46.3	Very low	39.8	Very low	146 Å²	146	153.5 Å²	153.5	89%	0.885	82%	0.817	S	S	*	*			trans	-145	131.8	161.3	178.7	0	0	0	0	109.4
459	T	45.9	Very low	40.2	Very low	125 Å²	125	149.8 Å²	149.8	77%	0.767	81%	0.809	S	S	*	*			trans	-97.8	153.6	174	49.8	0	0	0	0	111.9
460	V	49.3	Very low	40.6	Very low	217 Å²	217	155.5 Å²	155.5	100%	1.315	83%	0.833	S	S	*	*				-133.3	0	129.7	-176.3	0	0	0	0	107.1

Retrieved 460 of 460 residues in 418.3 ms (Link to these results)

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