A0A096M960_POEFO Loading...

Zinc finger Ran-binding domain-containing protein 2

May interfere with constitutive 5'-splice site selection.

AlphaFold DB , UniProt , Accession A0A096M960, Species POEFO (Poecilia formosa, Amazon molly), Gene n/a, Length 316 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	41.5	Very low	60.3	Low	245 Å²	245	131.4 Å²	131.4	100%	1.207	73%	0.734	S	S	*	*				0	125.3	0	-71.3	173	168.8	0	0	108.5	G3	M1-G3 PolarHBondContact O-N 2.64Å; M1-G3 VanDerWaalsContact O-N 3.17Å
2	S	46.9	Very low	62.4	Low	113 Å²	113	122.9 Å²	122.9	79%	0.79	69%	0.686	S	S	*	*			trans	-76.8	102.8	179.6	-50.4	0	0	0	0	110.5	K4	S2-K4 PolarHBondContact O-N 2.63Å
3	G	52.6	Low	64.2	Low	78 Å²	78	115.2 Å²	115.2	80%	0.804	64%	0.64	S	S	*	*			trans	-63.5	99.6	171	0	0	0	0	0	110	M1 S5	M1-G3 PolarHBondContact O-N 2.64Å; M1-G3 VanDerWaalsContact O-N 3.17Å; G3-S5 PolarHBondContact O-N 3.4Å; G3-S5 VanDerWaalsContact O-N 3.12Å
4	K	61	Low	65.9	Low	190 Å²	190	114 Å²	114	83%	0.826	63%	0.63	S	S	*	*			trans	-59.8	116.7	166.6	-88.3	82.5	173.3	-167.5	0	106.9	S2 F6	S2-K4 PolarHBondContact O-N 2.63Å; K4-F6 PolarHBondContact O-N 2.82Å
5	S	54.3	Low	67.3	Low	93 Å²	93	106.7 Å²	106.7	65%	0.65	59%	0.59	S	S	*	*			trans	-58.3	111.1	171.2	-179.3	0	0	0	0	107.9	G3 R7	G3-S5 PolarHBondContact O-N 3.4Å; G3-S5 VanDerWaalsContact O-N 3.12Å; S5-R7 PolarHBondContact O-N 3.21Å
6	F	61.3	Low	68.3	Low	156 Å²	156	103.8 Å²	103.8	68%	0.684	58%	0.577	S	S	*	*			trans	-71.4	94.8	-175.9	-161.6	-84.3	0	0	0	108	K4 V8	K4-F6 PolarHBondContact O-N 2.82Å; F6-V8 PolarHBondContact O-N 3.09Å; F6-V8 VanDerWaalsContact O-N 3.08Å
7	R	67	Low	69	Low	210 Å²	210	101.2 Å²	101.2	79%	0.792	56%	0.562	S	S	*	*			trans	-62	111.8	173	-61.3	-60.9	-167.4	171.3	4.5	106.8	S5 S9	S5-R7 PolarHBondContact O-N 3.21Å; R7-S9 PolarHBondContact O-N 2.64Å
8	V	69.7	Low	69.5	Low	66 Å²	66	107.4 Å²	107.4	40%	0.4	58%	0.583	S	S	.	*			trans	-62.7	116.4	169.1	-179.7	0	0	0	0	106.3	F6 D12 V23	F6-V8 PolarHBondContact O-N 3.09Å; F6-V8 VanDerWaalsContact O-N 3.08Å; V8-D12 HydrophobicContact CG1-CB 3.66Å; V8-D12 WeakPolarHBondContact CG1-O 3.21Å; V8-V23 HydrophobicContact CG1-CG1 4.15Å; V8-V23 HydrophobicContact CG2-CG1 4.21Å; V8-V23 HydrophobicContact CG2-CG2 4.1Å
9	S	74.3	Confident	70.1	Confident	74 Å²	74	112.8 Å²	112.8	52%	0.517	60%	0.6	S	S	.	*			trans	-70.9	152.8	-178.2	-61.8	0	0	0	0	110.8	R7 G11 D12	R7-S9 PolarHBondContact O-N 2.64Å; S9-G11 PolarHBondContact O-N 2.98Å; S9-D12 WeakPolarHBondContact O-CB 3.06Å; S9-D12 PolarHBondContact O-N 2.91Å
10	D	59.9	Low	70.9	Confident	175 Å²	175	107.9 Å²	107.9	94%	0.936	58%	0.575	S	S	*	*	T	Hydrogen-bonded Turn	trans	-54.5	114.8	178	-86.8	-84.7	0	0	0	112.1
11	G	74.9	Confident	71.4	Confident	45 Å²	45	104.9 Å²	104.9	46%	0.464	57%	0.57	S	S	.	*	T	Hydrogen-bonded Turn	trans	107.5	-23.4	-177.2	0	0	0	0	0	115.3	S9 A26	S9-G11 PolarHBondContact O-N 2.98Å; G11-A26 VanDerWaalsContact O-CA 3.23Å; G11-A26 WeakPolarHBondContact O-CA 3.44Å; G11-A26 VanDerWaalsContact O-CB 3.29Å; G11-A26 WeakPolarHBondContact O-CB 3.49Å
12	D	86	Confident	73.6	Confident	30 Å²	30	95.2 Å²	95.2	16%	0.16	52%	0.523	C	S	.	.			trans	-67.4	140.6	178	-73.1	-10.1	0	0	0	110.9	V8 S9 V23 N24 F25 A26	V8-D12 HydrophobicContact CG1-CB 3.66Å; V8-D12 WeakPolarHBondContact CG1-O 3.21Å; S9-D12 WeakPolarHBondContact O-CB 3.06Å; S9-D12 PolarHBondContact O-N 2.91Å; D12-V23 HydrophobicContact CB-CG1 4.08Å; D12-N24 CarbonylContact C-O 3.6Å; D12-N24 WeakPolarHBondContact CA-O 3.49Å; D12-F25 WeakPolarHBondContact OD1-CA 3.47Å; D12-A26 PolarHBondContact OD1-N 2.61Å
13	W	85.4	Confident	75.5	Confident	23 Å²	23	92.2 Å²	92.2	9%	0.087	50%	0.5	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.1	140.1	-167	66.4	-81.1	0	0	0	112.7	N24 F25 R28 C31 K38	W13-N24 HydrophobicContact CD2-CB 4.07Å; W13-N24 HydrophobicContact CG-CB 4.44Å; W13-N24 HydrophobicContact CH2-CB 4.49Å; W13-N24 HydrophobicContact CZ2-CB 3.83Å; W13-N24 PolarHBondContact N-O 3.18Å; W13-N24 WeakPolarHBondContact O-CB 3.43Å; W13-N24 PolarHBondContact O-N 2.78Å; W13-N24 PolarHBondContact O-ND2 3.3Å; W13-N24 VanDerWaalsContact O-ND2 3.16Å; W13-F25 PolarHBondContact NE1-O 3.3Å; W13-R28 WeakPolarHBondContact CZ2-O 3.31Å; W13-R28 PolarHBondContact NE1-O 2.85Å; W13-C31 HydrophobicContact CH2-CB 3.82Å; W13-C31 HydrophobicContact CZ3-CB 4.37Å; W13-K38 HydrophobicContact CD2-CB 4.04Å; W13-K38 HydrophobicContact CD2-CD 3.96Å; W13-K38 HydrophobicContact CD2-CG 3.77Å; W13-K38 HydrophobicContact CE3-CB 4.09Å; W13-K38 HydrophobicContact CE3-CG 4Å; W13-K38 HydrophobicContact CG-CD 3.93Å; W13-K38 HydrophobicContact CG-CG 4.15Å; W13-K38 HydrophobicContact CH2-CB 3.76Å; W13-K38 HydrophobicContact CZ2-CB 3.71Å; W13-K38 HydrophobicContact CZ2-CG 4.34Å; W13-K38 HydrophobicContact CZ3-CB 3.95Å; W13-K38 HydrophobicContact CZ3-CG 4.37Å
14	I	87.3	Confident	77.1	Confident	98 Å²	98	88.6 Å²	88.6	50%	0.503	46%	0.462	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.7	137.6	-176.7	-52	-179.3	0	0	0	109.2	N22 V23	I14-N22 CarbonylContact C-O 3.6Å; I14-N22 WeakPolarHBondContact CA-O 3.44Å; I14-V23 HydrophobicContact CG1-CG2 4.36Å
15	C	87.9	Confident	78.3	Confident	5 Å²	5	84.9 Å²	84.9	3%	0.034	45%	0.446	C	S	.	.			trans	-55.2	129.4	174.7	175.9	0	0	0	0	110.3	D17 C20 N22 C31 C34	C15-D17 PolarHBondContact O-N 3.27Å; C15-D17 PolarHBondContact SG-OD2 3.14Å; C15-C20 HydrophobicContact CB-CB 3.95Å; C15-N22 PolarHBondContact N-O 3.04Å; C15-C31 HydrophobicContact CB-CB 4.07Å; C15-C34 HydrophobicContact CB-CB 4.48Å; C15-C34 WeakPolarHBondContact CB-SG 3.49Å; C15-C34 WeakPolarHBondContact SG-CB 3.44Å; C15-C34 CovalentContact SG-SG 2.05Å; C15-C34 PolarHBondContact SG-SG 2.77Å
16	P	82.8	Confident	79.7	Confident	59 Å²	59	82.6 Å²	82.6	38%	0.383	43%	0.432	S	S	.	.	S	Bend	trans	-65	-22.3	-177.5	25.9	-34.9	0	0	0	112.9	K18 T39	P16-K18 PolarHBondContact O-N 3.39Å; P16-T39 HydrophobicContact CB-CG2 4.45Å; P16-T39 HydrophobicContact CG-CG2 3.98Å
17	D	80.8	Confident	80.8	Confident	60 Å²	60	85.4 Å²	85.4	32%	0.321	44%	0.439	S	S	.	.			trans	-62.8	109.3	169.8	-66.5	-60.1	0	0	0	110.7	C15 K19 C20 G21 R36	C15-D17 PolarHBondContact O-N 3.27Å; C15-D17 PolarHBondContact SG-OD2 3.14Å; D17-K19 PolarHBondContact O-N 3.24Å; D17-C20 HydrophobicContact CB-CB 3.91Å; D17-C20 WeakPolarHBondContact O-CB 3.39Å; D17-C20 PolarHBondContact O-N 3.19Å; D17-G21 PolarHBondContact O-N 2.83Å; D17-G21 VanDerWaalsContact O-N 3.16Å; D17-R36 WeakPolarHBondContact OD2-CB 3.26Å; D17-R36 WeakPolarHBondContact OD2-CD 3.21Å; D17-R36 WeakPolarHBondContact OD2-CG 2.8Å
18	K	76.8	Confident	81.6	Confident	214 Å²	214	80.8 Å²	80.8	93%	0.93	42%	0.421	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.8	-17.1	173	-60.7	-175.3	-179.2	-178.6	0	113.7	P16	P16-K18 PolarHBondContact O-N 3.39Å
19	K	81.9	Confident	82.3	Confident	209 Å²	209	83.1 Å²	83.1	91%	0.909	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.8	-20.2	173	-63.4	179.7	-179.9	176.9	0	113.6	D17	D17-K19 PolarHBondContact O-N 3.24Å
20	C	86.1	Confident	83	Confident	15 Å²	15	82.3 Å²	82.3	10%	0.101	43%	0.43	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100	-52.5	-176	178.2	0	0	0	0	112	C15 D17 N22 R33 C34	C15-C20 HydrophobicContact CB-CB 3.95Å; D17-C20 HydrophobicContact CB-CB 3.91Å; D17-C20 WeakPolarHBondContact O-CB 3.39Å; D17-C20 PolarHBondContact O-N 3.19Å; C20-N22 PolarHBondContact O-N 3.07Å; C20-N22 WeakPolarHBondContact SG-CB 2.95Å; C20-R33 PolarHBondContact O-NH1 2.94Å; C20-C34 HydrophobicContact CB-CB 3.72Å; C20-C34 VanDerWaalsContact SG-CB 3.51Å
21	G	80.6	Confident	84.4	Confident	45 Å²	45	74.2 Å²	74.2	46%	0.464	39%	0.387	S	S	.	.			trans	57	12.7	178.8	0	0	0	0	0	115.8	D17	D17-G21 PolarHBondContact O-N 2.83Å; D17-G21 VanDerWaalsContact O-N 3.16Å
22	N	87.8	Confident	85.1	Confident	42 Å²	42	76 Å²	76	23%	0.225	39%	0.386	C	S	.	.			trans	-78.1	128.7	-170.6	-169.7	82.5	0	0	0	111.8	I14 C15 C20 N24 R33	I14-N22 CarbonylContact C-O 3.6Å; I14-N22 WeakPolarHBondContact CA-O 3.44Å; C15-N22 PolarHBondContact N-O 3.04Å; C20-N22 PolarHBondContact O-N 3.07Å; C20-N22 WeakPolarHBondContact SG-CB 2.95Å; N22-N24 PolarHBondContact ND2-OD1 2.92Å; N22-N24 PolarHBondContact O-ND2 3.06Å; N22-R33 HydrophobicContact CB-CB 3.84Å
23	V	87.3	Confident	85	Confident	50 Å²	50	83.2 Å²	83.2	30%	0.303	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-72.1	127.5	170.3	-172.9	0	0	0	0	109.4	V8 D12 I14	V8-V23 HydrophobicContact CG1-CG1 4.15Å; V8-V23 HydrophobicContact CG2-CG1 4.21Å; V8-V23 HydrophobicContact CG2-CG2 4.1Å; D12-V23 HydrophobicContact CB-CG1 4.08Å; I14-V23 HydrophobicContact CG1-CG2 4.36Å
24	N	85.5	Confident	85.1	Confident	1 Å²	1	83.9 Å²	83.9	1%	0.005	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	141.8	-179.7	-49.6	-67.8	0	0	0	109.7	D12 W13 N22 C31 N32	D12-N24 CarbonylContact C-O 3.6Å; D12-N24 WeakPolarHBondContact CA-O 3.49Å; W13-N24 HydrophobicContact CD2-CB 4.07Å; W13-N24 HydrophobicContact CG-CB 4.44Å; W13-N24 HydrophobicContact CH2-CB 4.49Å; W13-N24 HydrophobicContact CZ2-CB 3.83Å; W13-N24 PolarHBondContact N-O 3.18Å; W13-N24 WeakPolarHBondContact O-CB 3.43Å; W13-N24 PolarHBondContact O-N 2.78Å; W13-N24 PolarHBondContact O-ND2 3.3Å; W13-N24 VanDerWaalsContact O-ND2 3.16Å; N22-N24 PolarHBondContact ND2-OD1 2.92Å; N22-N24 PolarHBondContact O-ND2 3.06Å; N24-C31 WeakPolarHBondContact ND2-CB 3.45Å; N24-C31 PolarHBondContact ND2-SG 3.41Å; N24-C31 WeakPolarHBondContact OD1-CA 3.23Å; N24-C31 PolarHBondContact OD1-SG 3.43Å; N24-N32 PolarHBondContact OD1-N 3.13Å; N24-N32 VanDerWaalsContact OD1-N 3.13Å
25	F	87.4	Confident	85	Confident	113 Å²	113	81.9 Å²	81.9	50%	0.496	42%	0.422	S	S	.	.			trans	-58.8	142.3	179.4	-67.5	-71.8	0	0	0	112.5	D12 W13 R27 R28	D12-F25 WeakPolarHBondContact OD1-CA 3.47Å; W13-F25 PolarHBondContact NE1-O 3.3Å; F25-R27 HydrophobicContact CB-CG 4.11Å; F25-R27 PolarHBondContact O-N 2.82Å; F25-R28 HydrophobicContact CB-CG 4.4Å; F25-R28 WeakPolarHBondContact O-CB 3.4Å; F25-R28 PolarHBondContact O-N 2.99Å
26	A	83.9	Confident	84.7	Confident	44 Å²	44	88.9 Å²	88.9	36%	0.364	45%	0.448	S	S	.	.	T	Hydrogen-bonded Turn	trans	-44.2	-42.3	-178.5	0	0	0	0	0	114.3	G11 D12 R28 K38	G11-A26 VanDerWaalsContact O-CA 3.23Å; G11-A26 WeakPolarHBondContact O-CA 3.44Å; G11-A26 VanDerWaalsContact O-CB 3.29Å; G11-A26 WeakPolarHBondContact O-CB 3.49Å; D12-A26 PolarHBondContact OD1-N 2.61Å; A26-R28 VanDerWaalsContact C-N 3.28Å; A26-R28 PolarHBondContact O-N 3.28Å; A26-K38 PolarHBondContact O-NZ 3.41Å
27	R	83.4	Confident	84.6	Confident	216 Å²	216	92.6 Å²	92.6	82%	0.815	46%	0.46	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-7.2	179.8	62.3	177.8	-100.7	95.4	-3.9	116.1	F25	F25-R27 HydrophobicContact CB-CG 4.11Å; F25-R27 PolarHBondContact O-N 2.82Å
28	R	84.3	Confident	84.4	Confident	112 Å²	112	92.8 Å²	92.8	42%	0.423	46%	0.458	S	S	.	.			trans	-96.8	131.2	-177.8	-63.7	-171.6	174.3	-116.3	-4.6	111	W13 F25 A26 S30 N32	W13-R28 WeakPolarHBondContact CZ2-O 3.31Å; W13-R28 PolarHBondContact NE1-O 2.85Å; F25-R28 HydrophobicContact CB-CG 4.4Å; F25-R28 WeakPolarHBondContact O-CB 3.4Å; F25-R28 PolarHBondContact O-N 2.99Å; A26-R28 VanDerWaalsContact C-N 3.28Å; A26-R28 PolarHBondContact O-N 3.28Å; R28-S30 WeakPolarHBondContact CB-O 3.18Å; R28-N32 WeakPolarHBondContact CD-OD1 3.49Å; R28-N32 PolarHBondContact NE-OD1 3.06Å; R28-N32 PolarHBondContact NH1-OD1 3.46Å
29	T	83.8	Confident	83.8	Confident	115 Å²	115	84.8 Å²	84.8	71%	0.706	43%	0.427	S	S	*	.	S	Bend	trans	-85.4	-19.4	173.3	47.3	0	0	0	0	112.8	E37 K38	T29-E37 CarbonylContact O-C 3.5Å; T29-E37 WeakPolarHBondContact O-CA 3.45Å; T29-K38 WeakPolarHBondContact O-CB 3.17Å; T29-K38 PolarHBondContact O-N 3.27Å
30	S	89	Confident	82.7	Confident	57 Å²	57	78.8 Å²	78.8	40%	0.399	41%	0.408	S	S	.	.	B	Isolated β-bridge	trans	-127.6	155.5	175.2	59.1	0	0	0	0	111.8	R28 R36	R28-S30 WeakPolarHBondContact CB-O 3.18Å; S30-R36 WeakPolarHBondContact CA-O 3.21Å
31	C	90.4	Very high	81.1	Confident	6 Å²	6	84.4 Å²	84.4	4%	0.041	43%	0.433	C	S	.	.			trans	-84.4	138	-176.4	169.3	0	0	0	0	112.7	W13 C15 N24 R33 C34 G35 R36	W13-C31 HydrophobicContact CH2-CB 3.82Å; W13-C31 HydrophobicContact CZ3-CB 4.37Å; C15-C31 HydrophobicContact CB-CB 4.07Å; N24-C31 WeakPolarHBondContact ND2-CB 3.45Å; N24-C31 PolarHBondContact ND2-SG 3.41Å; N24-C31 WeakPolarHBondContact OD1-CA 3.23Å; N24-C31 PolarHBondContact OD1-SG 3.43Å; C31-R33 PolarHBondContact O-N 3.4Å; C31-R33 PolarHBondContact SG-N 3.24Å; C31-C34 WeakPolarHBondContact CB-SG 3.46Å; C31-C34 PolarHBondContact SG-N 2.86Å; C31-C34 VanDerWaalsContact SG-N 3.41Å; C31-C34 PolarHBondContact SG-SG 3.28Å; C31-G35 WeakPolarHBondContact O-CA 3.47Å; C31-G35 PolarHBondContact O-N 3.15Å; C31-G35 VanDerWaalsContact O-N 3.07Å; C31-R36 PolarHBondContact N-O 2.88Å
32	N	87.8	Confident	79.7	Confident	81 Å²	81	86.7 Å²	86.7	43%	0.433	45%	0.447	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.2	-17.2	179.3	-61.1	-13.9	0	0	0	115.3	N24 R28	N24-N32 PolarHBondContact OD1-N 3.13Å; N24-N32 VanDerWaalsContact OD1-N 3.13Å; R28-N32 WeakPolarHBondContact CD-OD1 3.49Å; R28-N32 PolarHBondContact NE-OD1 3.06Å; R28-N32 PolarHBondContact NH1-OD1 3.46Å
33	R	85.9	Confident	78	Confident	182 Å²	182	92.6 Å²	92.6	69%	0.687	47%	0.471	S	S	*	.	T	Hydrogen-bonded Turn	trans	-126.7	-35.8	-168.9	-170.7	-176.9	-169.2	-170.3	7.3	114.3	C20 N22 C31	C20-R33 PolarHBondContact O-NH1 2.94Å; N22-R33 HydrophobicContact CB-CB 3.84Å; C31-R33 PolarHBondContact O-N 3.4Å; C31-R33 PolarHBondContact SG-N 3.24Å
34	C	87.2	Confident	76.2	Confident	38 Å²	38	97.2 Å²	97.2	26%	0.257	49%	0.491	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98.6	-11.5	176.1	59.8	0	0	0	0	113	C15 C20 C31 R36	C15-C34 HydrophobicContact CB-CB 4.48Å; C15-C34 WeakPolarHBondContact CB-SG 3.49Å; C15-C34 WeakPolarHBondContact SG-CB 3.44Å; C15-C34 CovalentContact SG-SG 2.05Å; C15-C34 PolarHBondContact SG-SG 2.77Å; C20-C34 HydrophobicContact CB-CB 3.72Å; C20-C34 VanDerWaalsContact SG-CB 3.51Å; C31-C34 WeakPolarHBondContact CB-SG 3.46Å; C31-C34 PolarHBondContact SG-N 2.86Å; C31-C34 VanDerWaalsContact SG-N 3.41Å; C31-C34 PolarHBondContact SG-SG 3.28Å; C34-R36 HydrophobicContact CB-CB 4.24Å; C34-R36 PolarHBondContact O-N 2.05Å; C34-R36 WeakPolarHBondContact SG-CB 3.33Å
35	G	83.9	Confident	74.4	Confident	55 Å²	55	105.2 Å²	105.2	57%	0.567	53%	0.531	S	S	*	.			trans	67.6	-22.9	-171.6	0	0	0	0	0	114.5	C31	C31-G35 WeakPolarHBondContact O-CA 3.47Å; C31-G35 PolarHBondContact O-N 3.15Å; C31-G35 VanDerWaalsContact O-N 3.07Å
36	R	81.4	Confident	72.7	Confident	153 Å²	153	108.6 Å²	108.6	58%	0.577	55%	0.545	S	S	*	.			trans	-49.8	140.1	177.2	-133.6	78	-165.5	155	5.7	111.8	D17 S30 C31 C34	D17-R36 WeakPolarHBondContact OD2-CB 3.26Å; D17-R36 WeakPolarHBondContact OD2-CD 3.21Å; D17-R36 WeakPolarHBondContact OD2-CG 2.8Å; S30-R36 WeakPolarHBondContact CA-O 3.21Å; C31-R36 PolarHBondContact N-O 2.88Å; C34-R36 HydrophobicContact CB-CB 4.24Å; C34-R36 PolarHBondContact O-N 2.05Å; C34-R36 WeakPolarHBondContact SG-CB 3.33Å
37	E	81.8	Confident	71.2	Confident	136 Å²	136	107.3 Å²	107.3	64%	0.636	53%	0.534	S	S	*	.	B	Isolated β-bridge	trans	-67.5	160	174.4	68.9	-162	131	0	0	112.6	T29 T39	T29-E37 CarbonylContact O-C 3.5Å; T29-E37 WeakPolarHBondContact O-CA 3.45Å; E37-T39 PolarHBondContact O-N 3.31Å; E37-T39 VanDerWaalsContact O-N 3.15Å
38	K	77.2	Confident	69.6	Low	65 Å²	65	97.7 Å²	97.7	28%	0.283	50%	0.502	S	S	.	.			trans	-71.6	98.1	169.8	-177.7	175.2	-171.8	158.3	0	108.1	W13 A26 T29 T40	W13-K38 HydrophobicContact CD2-CB 4.04Å; W13-K38 HydrophobicContact CD2-CD 3.96Å; W13-K38 HydrophobicContact CD2-CG 3.77Å; W13-K38 HydrophobicContact CE3-CB 4.09Å; W13-K38 HydrophobicContact CE3-CG 4Å; W13-K38 HydrophobicContact CG-CD 3.93Å; W13-K38 HydrophobicContact CG-CG 4.15Å; W13-K38 HydrophobicContact CH2-CB 3.76Å; W13-K38 HydrophobicContact CZ2-CB 3.71Å; W13-K38 HydrophobicContact CZ2-CG 4.34Å; W13-K38 HydrophobicContact CZ3-CB 3.95Å; W13-K38 HydrophobicContact CZ3-CG 4.37Å; A26-K38 PolarHBondContact O-NZ 3.41Å; T29-K38 WeakPolarHBondContact O-CB 3.17Å; T29-K38 PolarHBondContact O-N 3.27Å; K38-T40 PolarHBondContact O-N 3.27Å
39	T	64.3	Low	68.1	Low	46 Å²	46	92.5 Å²	92.5	28%	0.282	48%	0.484	S	S	.	.			trans	-54.6	117.9	-177.4	44.8	0	0	0	0	111.2	P16 E37 E41 A42	P16-T39 HydrophobicContact CB-CG2 4.45Å; P16-T39 HydrophobicContact CG-CG2 3.98Å; E37-T39 PolarHBondContact O-N 3.31Å; E37-T39 VanDerWaalsContact O-N 3.15Å; T39-E41 WeakPolarHBondContact CB-OE2 3.48Å; T39-E41 PolarHBondContact O-N 3.02Å; T39-A42 PolarHBondContact O-N 3.21Å; T39-A42 VanDerWaalsContact O-N 3.16Å
40	T	57.8	Low	67.1	Low	83 Å²	83	90.9 Å²	90.9	51%	0.509	47%	0.474	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.7	-18.6	-178.5	44.4	0	0	0	0	112.6	K38 A42 K43 M44	K38-T40 PolarHBondContact O-N 3.27Å; T40-A42 PolarHBondContact O-N 3.16Å; T40-A42 VanDerWaalsContact O-N 3.12Å; T40-K43 WeakPolarHBondContact O-CA 3.45Å; T40-K43 WeakPolarHBondContact O-CB 3.44Å; T40-K43 PolarHBondContact O-N 2.81Å; T40-M44 WeakPolarHBondContact O-CG 3.42Å; T40-M44 PolarHBondContact O-N 3.05Å; T40-M44 VanDerWaalsContact O-N 3.15Å
41	E	52.7	Low	65.9	Low	132 Å²	132	92.9 Å²	92.9	62%	0.617	48%	0.477	S	S	*	.	H	α-helix	trans	-43.9	-40	166.3	-56	175.2	113.3	0	0	112.6	T39 K43 M44	T39-E41 WeakPolarHBondContact CB-OE2 3.48Å; T39-E41 PolarHBondContact O-N 3.02Å; E41-K43 VanDerWaalsContact C-N 3.25Å; E41-K43 PolarHBondContact O-N 2.98Å; E41-M44 PolarHBondContact O-N 2.96Å
42	A	52	Low	64.6	Low	93 Å²	93	93 Å²	93	77%	0.769	48%	0.477	S	S	*	.	H	α-helix	trans	-71.9	-12.6	178.9	0	0	0	0	0	114.4	T39 T40	T39-A42 PolarHBondContact O-N 3.21Å; T39-A42 VanDerWaalsContact O-N 3.16Å; T40-A42 PolarHBondContact O-N 3.16Å; T40-A42 VanDerWaalsContact O-N 3.12Å
43	K	52.3	Low	63.1	Low	166 Å²	166	90.5 Å²	90.5	72%	0.722	47%	0.47	S	S	*	.	H	α-helix	trans	-95.3	-28.3	168.6	-75.2	-173.9	168.9	-171.1	0	112.8	T40 E41	T40-K43 WeakPolarHBondContact O-CA 3.45Å; T40-K43 WeakPolarHBondContact O-CB 3.44Å; T40-K43 PolarHBondContact O-N 2.81Å; E41-K43 VanDerWaalsContact C-N 3.25Å; E41-K43 PolarHBondContact O-N 2.98Å
44	M	48.6	Very low	61.7	Low	148 Å²	148	89.3 Å²	89.3	73%	0.729	47%	0.47	S	S	*	.	H	α-helix	trans	-89.6	-3.4	-164.8	-70.4	170.2	170.7	0	0	114.8	T40 E41 K46	T40-M44 WeakPolarHBondContact O-CG 3.42Å; T40-M44 PolarHBondContact O-N 3.05Å; T40-M44 VanDerWaalsContact O-N 3.15Å; E41-M44 PolarHBondContact O-N 2.96Å; M44-K46 VanDerWaalsContact C-N 3.3Å; M44-K46 PolarHBondContact O-N 3.01Å
45	M	46.8	Very low	60.2	Low	169 Å²	169	92.9 Å²	92.9	83%	0.833	49%	0.491	S	S	*	.			trans	-92.7	37.4	169.3	-63.8	-166.4	179.4	0	0	113.3	A47	M45-A47 PolarHBondContact O-N 3.21Å
46	K	52	Low	58.8	Low	184 Å²	184	94.3 Å²	94.3	80%	0.8	49%	0.485	S	S	*	.			trans	-67.2	119.8	168.5	-171	70.1	174.6	-178.1	0	108.4	M44 G48	M44-K46 VanDerWaalsContact C-N 3.3Å; M44-K46 PolarHBondContact O-N 3.01Å; K46-G48 PolarHBondContact O-N 3.16Å
47	A	52.1	Low	57.5	Low	16 Å²	16	87.6 Å²	87.6	13%	0.132	46%	0.462	C	S	.	.			trans	-57.3	130	-177.1	0	0	0	0	0	112	M45 G49 E51 Y93	M45-A47 PolarHBondContact O-N 3.21Å; A47-G49 CarbonylContact C-O 3.58Å; A47-E51 VanDerWaalsContact CB-CD 3.49Å; A47-E51 HydrophobicContact CB-CG 3.62Å; A47-E51 WeakPolarHBondContact CB-OE1 3.29Å; A47-Y93 HydrophobicContact CB-CE1 4.25Å
48	G	49.9	Very low	56.4	Low	14 Å²	14	88 Å²	88	14%	0.144	47%	0.465	C	S	.	.	S	Bend	trans	-72.8	-29.8	-174.3	0	0	0	0	0	113.2	K46 K72 K92	K46-G48 PolarHBondContact O-N 3.16Å; G48-K72 WeakPolarHBondContact O-CD 3.31Å; G48-K72 WeakPolarHBondContact O-CE 3.4Å; G48-K72 PolarHBondContact O-NZ 3.12Å; G48-K92 CarbonylContact C-O 3.58Å; G48-K92 WeakPolarHBondContact CA-O 3.41Å; G48-K92 PolarHBondContact N-O 2.9Å
49	G	52.8	Low	55.6	Low	4 Å²	4	93.5 Å²	93.5	4%	0.041	49%	0.488	C	S	.	.	S	Bend	trans	-82.4	150.5	164.1	0	0	0	0	0	111.4	A47 E51 K92	A47-G49 CarbonylContact C-O 3.58Å; G49-E51 PolarHBondContact O-N 3.39Å; G49-K92 PolarHBondContact N-O 2.88Å
50	T	63.7	Low	55.4	Low	81 Å²	81	92.7 Å²	92.7	50%	0.497	49%	0.485	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.6	108.8	167.4	-51.1	0	0	0	0	107.2	I52 Q70	T50-I52 PolarHBondContact O-N 2.85Å; T50-Q70 PolarHBondContact O-N 2.78Å
51	E	63	Low	55.3	Low	99 Å²	99	100.3 Å²	100.3	46%	0.463	50%	0.504	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.4	135.1	172.3	-61.8	-173.8	138.9	0	0	108.1	A47 G49 G53	A47-E51 VanDerWaalsContact CB-CD 3.49Å; A47-E51 HydrophobicContact CB-CG 3.62Å; A47-E51 WeakPolarHBondContact CB-OE1 3.29Å; G49-E51 PolarHBondContact O-N 3.39Å; E51-G53 PolarHBondContact O-N 3.16Å
52	I	63.4	Low	55.9	Low	7 Å²	7	97 Å²	97	4%	0.036	51%	0.505	C	S	.	.			trans	-75	77	174.1	-62.4	178.1	0	0	0	106	T50 L56 F64 A66 D68 V77	T50-I52 PolarHBondContact O-N 2.85Å; I52-L56 HydrophobicContact CG2-CB 3.95Å; I52-L56 HydrophobicContact CG2-CD2 4.07Å; I52-L56 HydrophobicContact CG2-CG 3.99Å; I52-F64 HydrophobicContact CG2-CB 4.12Å; I52-A66 WeakPolarHBondContact O-CA 3.15Å; I52-D68 WeakPolarHBondContact CB-O 3.2Å; I52-D68 PolarHBondContact N-O 3.07Å; I52-V77 HydrophobicContact CD1-CB 4.16Å; I52-V77 HydrophobicContact CD1-CG1 3.41Å; I52-V77 VanDerWaalsContact CD1-CG1 3.41Å; I52-V77 HydrophobicContact CD1-CG2 3.71Å
53	G	56.7	Low	56.5	Low	29 Å²	29	99 Å²	99	30%	0.299	50%	0.502	S	S	.	.			trans	-55.5	158.2	-174.1	0	0	0	0	0	111	E51 T55 L56 A57	E51-G53 PolarHBondContact O-N 3.16Å; G53-T55 PolarHBondContact O-N 2.9Å; G53-L56 PolarHBondContact O-N 3.2Å; G53-A57 PolarHBondContact O-N 2.8Å
54	K	57.2	Low	57	Low	157 Å²	157	94.7 Å²	94.7	68%	0.683	48%	0.484	S	S	*	.	H	α-helix	trans	-46.3	-38.2	-173	-63.9	172.4	-177	176	0	113	L56 A57 E58 A66	K54-L56 PolarHBondContact O-N 3.46Å; K54-A57 PolarHBondContact O-N 3.07Å; K54-E58 WeakPolarHBondContact O-CB 3.43Å; K54-E58 WeakPolarHBondContact O-CG 3.46Å; K54-E58 PolarHBondContact O-N 2.99Å; K54-A66 HydrophobicContact CG-CB 3.81Å
55	T	55.4	Low	57.8	Low	113 Å²	113	90.8 Å²	90.8	69%	0.693	47%	0.471	S	S	*	.	H	α-helix	trans	-53.3	-41.7	173.2	51.5	0	0	0	0	115	G53 K59	G53-T55 PolarHBondContact O-N 2.9Å; T55-K59 WeakPolarHBondContact O-CB 3.23Å; T55-K59 PolarHBondContact O-N 2.92Å; T55-K59 VanDerWaalsContact O-N 3.11Å
56	L	54.9	Low	58.7	Low	85 Å²	85	84.3 Å²	84.3	45%	0.445	44%	0.444	S	S	.	.	H	α-helix	trans	-86	-28.9	178.8	-170.2	57.6	0	0	0	112.2	I52 G53 K54 S60	I52-L56 HydrophobicContact CG2-CB 3.95Å; I52-L56 HydrophobicContact CG2-CD2 4.07Å; I52-L56 HydrophobicContact CG2-CG 3.99Å; G53-L56 PolarHBondContact O-N 3.2Å; K54-L56 PolarHBondContact O-N 3.46Å; L56-S60 VanDerWaalsContact O-CB 3.32Å; L56-S60 WeakPolarHBondContact O-CB 3.43Å; L56-S60 PolarHBondContact O-N 2.96Å; L56-S60 PolarHBondContact O-OG 3.01Å
57	A	53.8	Low	59.9	Low	12 Å²	12	80.6 Å²	80.6	10%	0.099	43%	0.433	C	S	.	.	H	α-helix	trans	-65.2	-40.1	169.5	0	0	0	0	0	112.1	G53 K54 S60 G62 F64 A66	G53-A57 PolarHBondContact O-N 2.8Å; K54-A57 PolarHBondContact O-N 3.07Å; A57-S60 WeakPolarHBondContact CA-OG 3.35Å; A57-S60 PolarHBondContact O-OG 3.25Å; A57-S60 VanDerWaalsContact O-OG 3.09Å; A57-G62 PolarHBondContact O-N 2.89Å; A57-G62 VanDerWaalsContact O-N 3.09Å; A57-F64 WeakPolarHBondContact CB-O 3.49Å; A57-A66 HydrophobicContact CB-CB 4.28Å
58	E	56.9	Low	61.5	Low	146 Å²	146	80.8 Å²	80.8	68%	0.682	43%	0.432	S	S	*	.	H	α-helix	trans	-69.9	-45.5	173.8	-72.2	173.9	115.1	0	0	111.5	K54 S60 R61	K54-E58 WeakPolarHBondContact O-CB 3.43Å; K54-E58 WeakPolarHBondContact O-CG 3.46Å; K54-E58 PolarHBondContact O-N 2.99Å; E58-S60 PolarHBondContact O-N 3.17Å; E58-R61 PolarHBondContact O-N 3.08Å
59	K	62.2	Low	63.2	Low	180 Å²	180	80.2 Å²	80.2	78%	0.783	43%	0.426	S	S	*	.	H	α-helix	trans	-61.8	-28.5	177	-168.6	171	-176.4	177.7	0	113	T55 R61	T55-K59 WeakPolarHBondContact O-CB 3.23Å; T55-K59 PolarHBondContact O-N 2.92Å; T55-K59 VanDerWaalsContact O-N 3.11Å; K59-R61 VanDerWaalsContact C-N 3.31Å
60	S	59.1	Low	64.7	Low	29 Å²	29	83.4 Å²	83.4	20%	0.203	44%	0.439	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.3	13.6	174.6	58.3	0	0	0	0	114.4	L56 A57 E58 G62 L63	L56-S60 VanDerWaalsContact O-CB 3.32Å; L56-S60 WeakPolarHBondContact O-CB 3.43Å; L56-S60 PolarHBondContact O-N 2.96Å; L56-S60 PolarHBondContact O-OG 3.01Å; A57-S60 WeakPolarHBondContact CA-OG 3.35Å; A57-S60 PolarHBondContact O-OG 3.25Å; A57-S60 VanDerWaalsContact O-OG 3.09Å; E58-S60 PolarHBondContact O-N 3.17Å; S60-G62 PolarHBondContact O-N 2.9Å; S60-G62 VanDerWaalsContact O-N 3.15Å; S60-L63 WeakPolarHBondContact O-CB 3.45Å; S60-L63 PolarHBondContact O-N 3.2Å; S60-L63 VanDerWaalsContact O-N 3.13Å
61	R	56.2	Low	65.8	Low	242 Å²	242	79.7 Å²	79.7	91%	0.913	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	53.5	32.4	177.9	-67.2	179.8	133.4	94.4	-3.2	113.9	E58 K59	E58-R61 PolarHBondContact O-N 3.08Å; K59-R61 VanDerWaalsContact C-N 3.31Å
62	G	64.8	Low	66.6	Low	62 Å²	62	80.8 Å²	80.8	64%	0.639	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	14.5	178.6	0	0	0	0	0	115.5	A57 S60 F64	A57-G62 PolarHBondContact O-N 2.89Å; A57-G62 VanDerWaalsContact O-N 3.09Å; S60-G62 PolarHBondContact O-N 2.9Å; S60-G62 VanDerWaalsContact O-N 3.15Å; G62-F64 PolarHBondContact O-N 3.12Å
63	L	64.1	Low	67.5	Low	136 Å²	136	85 Å²	85	71%	0.712	45%	0.446	S	S	*	.	S	Bend	trans	-68.9	-22.6	173.8	-170.9	61.5	0	0	0	113.1	S60	S60-L63 WeakPolarHBondContact O-CB 3.45Å; S60-L63 PolarHBondContact O-N 3.2Å; S60-L63 VanDerWaalsContact O-N 3.13Å
64	F	63.1	Low	68.8	Low	75 Å²	75	86.5 Å²	86.5	33%	0.329	45%	0.451	S	S	.	.	S	Bend	trans	-124.8	143.4	176.7	-57.8	-66.3	0	0	0	111	I52 A57 G62 V77	I52-F64 HydrophobicContact CG2-CB 4.12Å; A57-F64 WeakPolarHBondContact CB-O 3.49Å; G62-F64 PolarHBondContact O-N 3.12Å; F64-V77 HydrophobicContact CD1-CG1 3.79Å; F64-V77 HydrophobicContact CE1-CB 4.22Å; F64-V77 HydrophobicContact CE1-CG1 3.96Å; F64-V77 HydrophobicContact CE1-CG2 4.16Å; F64-V77 HydrophobicContact CZ-CG2 4.44Å
65	S	66.4	Low	70	Confident	66 Å²	66	80.9 Å²	80.9	46%	0.462	44%	0.438	S	S	.	.			trans	-79.2	145.5	173.5	-171.7	0	0	0	0	110.5	N67 D68	S65-N67 PolarHBondContact O-N 3.21Å; S65-D68 WeakPolarHBondContact CB-OD2 3.35Å; S65-D68 PolarHBondContact N-OD2 2.94Å; S65-D68 WeakPolarHBondContact O-CB 2.99Å; S65-D68 PolarHBondContact O-N 3.31Å
66	A	65.8	Low	71.6	Confident	33 Å²	33	77.6 Å²	77.6	27%	0.273	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-64.8	-4.1	179.5	0	0	0	0	0	114.8	I52 K54 A57	I52-A66 WeakPolarHBondContact O-CA 3.15Å; K54-A66 HydrophobicContact CG-CB 3.81Å; A57-A66 HydrophobicContact CB-CB 4.28Å
67	N	76.4	Confident	73.1	Confident	107 Å²	107	75.7 Å²	75.7	57%	0.572	41%	0.408	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.6	-5.5	174.7	-66.6	27.3	0	0	0	112.8	S65 A80	S65-N67 PolarHBondContact O-N 3.21Å; N67-A80 HydrophobicContact CB-CB 3.57Å; N67-A80 VanDerWaalsContact O-CA 3.31Å; N67-A80 WeakPolarHBondContact O-CA 3.06Å; N67-A80 WeakPolarHBondContact O-CB 3.08Å
68	D	86.3	Confident	74.6	Confident	19 Å²	19	75.4 Å²	75.4	10%	0.102	41%	0.405	C	S	.	.			trans	-73.4	149.7	175.7	-64	-30.9	0	0	0	109.9	I52 S65 V77 W79 A80	I52-D68 WeakPolarHBondContact CB-O 3.2Å; I52-D68 PolarHBondContact N-O 3.07Å; S65-D68 WeakPolarHBondContact CB-OD2 3.35Å; S65-D68 PolarHBondContact N-OD2 2.94Å; S65-D68 WeakPolarHBondContact O-CB 2.99Å; S65-D68 PolarHBondContact O-N 3.31Å; D68-V77 HydrophobicContact CB-CG1 4.32Å; D68-W79 VanDerWaalsContact OD1-CA 3.28Å; D68-W79 WeakPolarHBondContact OD1-CA 3.37Å; D68-A80 PolarHBondContact OD1-N 2.68Å
69	W	84.4	Confident	76.1	Confident	3 Å²	3	75.2 Å²	75.2	1%	0.011	40%	0.398	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.8	145.6	-167.4	66.6	-86.1	0	0	0	112.1	C71 N78 R82 C85 K92	W69-C71 HydrophobicContact CZ3-CB 4.3Å; W69-N78 HydrophobicContact CD2-CB 4.19Å; W69-N78 HydrophobicContact CZ2-CB 4.23Å; W69-N78 WeakPolarHBondContact CZ2-ND2 3.42Å; W69-N78 PolarHBondContact N-O 3.21Å; W69-N78 PolarHBondContact NE1-ND2 2.83Å; W69-N78 PolarHBondContact O-N 3.04Å; W69-R82 PolarHBondContact NE1-O 3.15Å; W69-C85 HydrophobicContact CH2-CB 4.02Å; W69-K92 HydrophobicContact CD2-CB 4.09Å; W69-K92 HydrophobicContact CD2-CD 4.02Å; W69-K92 HydrophobicContact CD2-CG 3.66Å; W69-K92 HydrophobicContact CE3-CB 4.28Å; W69-K92 HydrophobicContact CE3-CG 4.04Å; W69-K92 HydrophobicContact CG-CD 3.87Å; W69-K92 HydrophobicContact CG-CG 3.96Å; W69-K92 HydrophobicContact CH2-CB 3.76Å; W69-K92 HydrophobicContact CH2-CG 4.4Å; W69-K92 HydrophobicContact CZ2-CB 3.53Å; W69-K92 HydrophobicContact CZ2-CG 4.06Å; W69-K92 HydrophobicContact CZ3-CB 4.14Å; W69-K92 HydrophobicContact CZ3-CG 4.4Å
70	Q	85.4	Confident	77.1	Confident	71 Å²	71	68.6 Å²	68.6	33%	0.332	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	131.1	-179.2	-156.8	174.1	14	0	0	110.8	T50 K72 G75	T50-Q70 PolarHBondContact O-N 2.78Å; Q70-K72 PolarHBondContact O-N 2.74Å; Q70-G75 WeakPolarHBondContact CG-O 3.35Å; Q70-G75 PolarHBondContact NE2-O 2.74Å
71	C	85.9	Confident	78.3	Confident	2 Å²	2	76.3 Å²	76.3	1%	0.014	40%	0.401	C	S	.	.			trans	-66.3	119.5	172.1	170.4	0	0	0	0	109.8	W69 T73 C74 G75 N76 C85 C88	W69-C71 HydrophobicContact CZ3-CB 4.3Å; C71-T73 PolarHBondContact O-N 2.68Å; C71-T73 PolarHBondContact SG-N 3.37Å; C71-T73 PolarHBondContact SG-OG1 2.82Å; C71-C74 PolarHBondContact O-N 3.42Å; C71-G75 WeakPolarHBondContact O-CA 3.43Å; C71-G75 PolarHBondContact O-N 2.78Å; C71-N76 PolarHBondContact N-O 3.2Å; C71-C85 HydrophobicContact CB-CB 3.89Å; C71-C85 WeakPolarHBondContact CB-SG 2.98Å; C71-C88 WeakPolarHBondContact CB-SG 3.46Å; C71-C88 WeakPolarHBondContact SG-CB 3.19Å; C71-C88 CovalentContact SG-SG 2.05Å; C71-C88 PolarHBondContact SG-SG 3.21Å
72	K	80.8	Confident	79.6	Confident	123 Å²	123	68.3 Å²	68.3	54%	0.535	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-23.4	-179.8	-76.6	-175.2	175.2	162.9	0	114.2	G48 Q70	G48-K72 WeakPolarHBondContact O-CD 3.31Å; G48-K72 WeakPolarHBondContact O-CE 3.4Å; G48-K72 PolarHBondContact O-NZ 3.12Å; Q70-K72 PolarHBondContact O-N 2.74Å
73	T	81	Confident	80.6	Confident	96 Å²	96	68.9 Å²	68.9	59%	0.589	37%	0.365	S	S	*	.	T	Hydrogen-bonded Turn	trans	-93.4	-13.6	-178.2	54	0	0	0	0	114.2	C71 T90	C71-T73 PolarHBondContact O-N 2.68Å; C71-T73 PolarHBondContact SG-N 3.37Å; C71-T73 PolarHBondContact SG-OG1 2.82Å; T73-T90 HydrophobicContact CG2-CG2 4.27Å; T73-T90 PolarHBondContact OG1-OG1 3.35Å
74	C	84.8	Confident	81.7	Confident	60 Å²	60	66.8 Å²	66.8	41%	0.405	35%	0.351	S	S	.	.	T	Hydrogen-bonded Turn	trans	-140.8	4.1	177.7	79	0	0	0	0	116.2	C71 N76 C88	C71-C74 PolarHBondContact O-N 3.42Å; C74-N76 PolarHBondContact O-N 2.83Å; C74-N76 VanDerWaalsContact SG-CB 3.56Å; C74-C88 HydrophobicContact CB-CB 3.97Å; C74-C88 VanDerWaalsContact SG-CB 3.56Å
75	G	82.6	Confident	83	Confident	39 Å²	39	63.3 Å²	63.3	40%	0.402	34%	0.336	S	S	.	.			trans	69.3	-5.5	179.5	0	0	0	0	0	115.9	Q70 C71	Q70-G75 WeakPolarHBondContact CG-O 3.35Å; Q70-G75 PolarHBondContact NE2-O 2.74Å; C71-G75 WeakPolarHBondContact O-CA 3.43Å; C71-G75 PolarHBondContact O-N 2.78Å
76	N	87.8	Confident	84	Confident	43 Å²	43	64.7 Å²	64.7	23%	0.23	34%	0.339	C	S	.	.			trans	-69.4	135	-177.5	178.3	57.6	0	0	0	112.8	C71 C74 M87	C71-N76 PolarHBondContact N-O 3.2Å; C74-N76 PolarHBondContact O-N 2.83Å; C74-N76 VanDerWaalsContact SG-CB 3.56Å; N76-M87 HydrophobicContact CB-CB 4.22Å; N76-M87 HydrophobicContact CB-CG 4.24Å; N76-M87 HydrophobicContact CB-SD 3.59Å; N76-M87 VanDerWaalsContact CB-SD 3.59Å
77	V	86.5	Confident	85	Confident	45 Å²	45	69.3 Å²	69.3	27%	0.273	36%	0.356	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.4	138.6	173.5	-177.7	0	0	0	0	110.5	I52 F64 D68	I52-V77 HydrophobicContact CD1-CB 4.16Å; I52-V77 HydrophobicContact CD1-CG1 3.41Å; I52-V77 VanDerWaalsContact CD1-CG1 3.41Å; I52-V77 HydrophobicContact CD1-CG2 3.71Å; F64-V77 HydrophobicContact CD1-CG1 3.79Å; F64-V77 HydrophobicContact CE1-CB 4.22Å; F64-V77 HydrophobicContact CE1-CG1 3.96Å; F64-V77 HydrophobicContact CE1-CG2 4.16Å; F64-V77 HydrophobicContact CZ-CG2 4.44Å; D68-V77 HydrophobicContact CB-CG1 4.32Å
78	N	86.4	Confident	85.4	Confident	7 Å²	7	66 Å²	66	4%	0.037	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.4	142	-174	-165.7	38.8	0	0	0	111.8	W69 R82 E84 C85	W69-N78 HydrophobicContact CD2-CB 4.19Å; W69-N78 HydrophobicContact CZ2-CB 4.23Å; W69-N78 WeakPolarHBondContact CZ2-ND2 3.42Å; W69-N78 PolarHBondContact N-O 3.21Å; W69-N78 PolarHBondContact NE1-ND2 2.83Å; W69-N78 PolarHBondContact O-N 3.04Å; N78-R82 WeakPolarHBondContact ND2-CB 3.49Å; N78-R82 WeakPolarHBondContact OD1-CD 3.41Å; N78-E84 PolarHBondContact ND2-O 2.86Å; N78-C85 WeakPolarHBondContact ND2-CA 3.04Å
79	W	87.4	Confident	85.3	Confident	142 Å²	142	70.1 Å²	70.1	54%	0.538	36%	0.363	S	S	.	.			trans	-63.3	140.3	-174.6	-61.4	-43.9	0	0	0	112.8	D68 R81 R82	D68-W79 VanDerWaalsContact OD1-CA 3.28Å; D68-W79 WeakPolarHBondContact OD1-CA 3.37Å; W79-R81 HydrophobicContact CB-CG 4.2Å; W79-R81 PolarHBondContact O-N 3.3Å; W79-R82 PolarHBondContact O-N 2.91Å
80	A	83.1	Confident	85.2	Confident	40 Å²	40	72 Å²	72	33%	0.331	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-41.5	-36.9	178.3	0	0	0	0	0	115.3	N67 D68 R82	N67-A80 HydrophobicContact CB-CB 3.57Å; N67-A80 VanDerWaalsContact O-CA 3.31Å; N67-A80 WeakPolarHBondContact O-CA 3.06Å; N67-A80 WeakPolarHBondContact O-CB 3.08Å; D68-A80 PolarHBondContact OD1-N 2.68Å; A80-R82 VanDerWaalsContact C-N 3.33Å; A80-R82 PolarHBondContact O-N 3.12Å
81	R	84.6	Confident	85.1	Confident	192 Å²	192	71.9 Å²	71.9	73%	0.725	38%	0.38	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.8	-7	-177.2	70.8	179	-178.3	87.5	-5.7	115.8	W79	W79-R81 HydrophobicContact CB-CG 4.2Å; W79-R81 PolarHBondContact O-N 3.3Å
82	R	84.8	Confident	84.5	Confident	73 Å²	73	72.6 Å²	72.6	28%	0.275	38%	0.383	S	S	.	.			trans	-101.5	128.6	-176.8	-74.9	171.9	171.3	-110.8	19.6	110.7	W69 N78 W79 A80 E84 N86	W69-R82 PolarHBondContact NE1-O 3.15Å; N78-R82 WeakPolarHBondContact ND2-CB 3.49Å; N78-R82 WeakPolarHBondContact OD1-CD 3.41Å; W79-R82 PolarHBondContact O-N 2.91Å; A80-R82 VanDerWaalsContact C-N 3.33Å; A80-R82 PolarHBondContact O-N 3.12Å; R82-E84 VanDerWaalsContact C-N 3.35Å; R82-N86 PolarHBondContact NH1-OD1 3.42Å; R82-N86 PolarHBondContact NH2-OD1 3.31Å
83	S	84.4	Confident	83.8	Confident	74 Å²	74	73.2 Å²	73.2	52%	0.517	38%	0.383	S	S	.	.	S	Bend	trans	-72.1	-25.3	172.7	45.5	0	0	0	0	113.5	P91 K92	S83-P91 CarbonylContact O-C 3.19Å; S83-P91 WeakPolarHBondContact O-CA 3.42Å; S83-K92 WeakPolarHBondContact O-CB 3.33Å; S83-K92 PolarHBondContact O-N 2.85Å
84	E	88.5	Confident	82.8	Confident	92 Å²	92	71.3 Å²	71.3	43%	0.43	38%	0.377	S	S	.	.	B	Isolated β-bridge	trans	-131.1	151.4	-174.6	-68.4	145	-117.1	0	0	110.2	N78 R82	N78-E84 PolarHBondContact ND2-O 2.86Å; R82-E84 VanDerWaalsContact C-N 3.35Å
85	C	90.4	Very high	81.1	Confident	2 Å²	2	76 Å²	76	1%	0.014	39%	0.39	C	S	.	.			trans	-71.7	141.4	179.2	-170.7	0	0	0	0	113	W69 C71 N78 M87 C88 N89 T90	W69-C85 HydrophobicContact CH2-CB 4.02Å; C71-C85 HydrophobicContact CB-CB 3.89Å; C71-C85 WeakPolarHBondContact CB-SG 2.98Å; N78-C85 WeakPolarHBondContact ND2-CA 3.04Å; C85-M87 PolarHBondContact O-N 3.25Å; C85-M87 PolarHBondContact SG-N 3.03Å; C85-M87 VanDerWaalsContact SG-N 3.4Å; C85-C88 HydrophobicContact CB-CB 4.33Å; C85-C88 WeakPolarHBondContact CB-SG 3.44Å; C85-N89 WeakPolarHBondContact O-CA 3.35Å; C85-N89 PolarHBondContact O-N 3.04Å; C85-T90 PolarHBondContact N-O 3.18Å; C85-T90 VanDerWaalsContact N-O 3.15Å
86	N	87	Confident	79.6	Confident	96 Å²	96	79.7 Å²	79.7	51%	0.513	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-69.3	-3.9	173.4	-163.8	75.9	0	0	0	115.3	R82	R82-N86 PolarHBondContact NH1-OD1 3.42Å; R82-N86 PolarHBondContact NH2-OD1 3.31Å
87	M	85.6	Confident	77.9	Confident	130 Å²	130	83.7 Å²	83.7	64%	0.64	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125.4	-50.8	177.8	-73.5	-178.6	65	0	0	112.9	N76 C85	N76-M87 HydrophobicContact CB-CB 4.22Å; N76-M87 HydrophobicContact CB-CG 4.24Å; N76-M87 HydrophobicContact CB-SD 3.59Å; N76-M87 VanDerWaalsContact CB-SD 3.59Å; C85-M87 PolarHBondContact O-N 3.25Å; C85-M87 PolarHBondContact SG-N 3.03Å; C85-M87 VanDerWaalsContact SG-N 3.4Å
88	C	86.1	Confident	76.2	Confident	36 Å²	36	89.4 Å²	89.4	24%	0.243	44%	0.442	C	S	.	.	T	Hydrogen-bonded Turn	trans	-87.8	-8.7	-176.9	64.7	0	0	0	0	113.7	C71 C74 C85 T90	C71-C88 WeakPolarHBondContact CB-SG 3.46Å; C71-C88 WeakPolarHBondContact SG-CB 3.19Å; C71-C88 CovalentContact SG-SG 2.05Å; C71-C88 PolarHBondContact SG-SG 3.21Å; C74-C88 HydrophobicContact CB-CB 3.97Å; C74-C88 VanDerWaalsContact SG-CB 3.56Å; C85-C88 HydrophobicContact CB-CB 4.33Å; C85-C88 WeakPolarHBondContact CB-SG 3.44Å; C88-T90 PolarHBondContact O-N 2.87Å; C88-T90 PolarHBondContact O-OG1 3.14Å; C88-T90 VanDerWaalsContact SG-CB 3.5Å; C88-T90 PolarHBondContact SG-OG1 2.73Å; C88-T90 VanDerWaalsContact SG-OG1 3.34Å
89	N	83.9	Confident	74.3	Confident	107 Å²	107	97.1 Å²	97.1	57%	0.572	47%	0.47	S	S	*	.			trans	48.5	-4	-164.8	-90.4	90.7	0	0	0	116.9	C85	C85-N89 WeakPolarHBondContact O-CA 3.35Å; C85-N89 PolarHBondContact O-N 3.04Å
90	T	83.1	Confident	72.4	Confident	43 Å²	43	95.4 Å²	95.4	26%	0.264	48%	0.475	S	S	.	.			trans	-56	135.9	177.5	-47	0	0	0	0	110.5	T73 C85 C88	T73-T90 HydrophobicContact CG2-CG2 4.27Å; T73-T90 PolarHBondContact OG1-OG1 3.35Å; C85-T90 PolarHBondContact N-O 3.18Å; C85-T90 VanDerWaalsContact N-O 3.15Å; C88-T90 PolarHBondContact O-N 2.87Å; C88-T90 PolarHBondContact O-OG1 3.14Å; C88-T90 VanDerWaalsContact SG-CB 3.5Å; C88-T90 PolarHBondContact SG-OG1 2.73Å; C88-T90 VanDerWaalsContact SG-OG1 3.34Å
91	P	82.6	Confident	70.9	Confident	68 Å²	68	94.4 Å²	94.4	44%	0.442	47%	0.469	S	S	.	.	B	Isolated β-bridge	trans	-66.6	142.7	179.2	26	-34.8	0	0	0	112	S83 Y93 A94	S83-P91 CarbonylContact O-C 3.19Å; S83-P91 WeakPolarHBondContact O-CA 3.42Å; P91-Y93 PolarHBondContact O-N 3.28Å; P91-Y93 VanDerWaalsContact O-N 3.14Å; P91-A94 HydrophobicContact CG-CB 4.46Å; P91-A94 PolarHBondContact O-N 2.75Å
92	K	73.1	Confident	69.1	Low	17 Å²	17	97.1 Å²	97.1	7%	0.074	48%	0.481	C	S	.	.	T	Hydrogen-bonded Turn	trans	-54.5	-28.9	171.2	-173.1	-179.9	178.9	-159	0	112.1	G48 G49 W69 S83	G48-K92 CarbonylContact C-O 3.58Å; G48-K92 WeakPolarHBondContact CA-O 3.41Å; G48-K92 PolarHBondContact N-O 2.9Å; G49-K92 PolarHBondContact N-O 2.88Å; W69-K92 HydrophobicContact CD2-CB 4.09Å; W69-K92 HydrophobicContact CD2-CD 4.02Å; W69-K92 HydrophobicContact CD2-CG 3.66Å; W69-K92 HydrophobicContact CE3-CB 4.28Å; W69-K92 HydrophobicContact CE3-CG 4.04Å; W69-K92 HydrophobicContact CG-CD 3.87Å; W69-K92 HydrophobicContact CG-CG 3.96Å; W69-K92 HydrophobicContact CH2-CB 3.76Å; W69-K92 HydrophobicContact CH2-CG 4.4Å; W69-K92 HydrophobicContact CZ2-CB 3.53Å; W69-K92 HydrophobicContact CZ2-CG 4.06Å; W69-K92 HydrophobicContact CZ3-CB 4.14Å; W69-K92 HydrophobicContact CZ3-CG 4.4Å; S83-K92 WeakPolarHBondContact O-CB 3.33Å; S83-K92 PolarHBondContact O-N 2.85Å
93	Y	66.8	Low	67.4	Low	136 Å²	136	97.7 Å²	97.7	53%	0.533	51%	0.509	S	S	.	.	T	Hydrogen-bonded Turn	trans	-124.1	63.2	179.5	-52.5	-86.6	0	0	0	109.5	A47 P91 K95	A47-Y93 HydrophobicContact CB-CE1 4.25Å; P91-Y93 PolarHBondContact O-N 3.28Å; P91-Y93 VanDerWaalsContact O-N 3.14Å; Y93-K95 PolarHBondContact O-N 2.76Å
94	A	59.4	Low	66	Low	55 Å²	55	95.4 Å²	95.4	46%	0.455	50%	0.498	S	S	.	.			trans	-53.8	125.5	154.7	0	0	0	0	0	107.7	P91 L96	P91-A94 HydrophobicContact CG-CB 4.46Å; P91-A94 PolarHBondContact O-N 2.75Å; A94-L96 VanDerWaalsContact C-N 3.32Å; A94-L96 PolarHBondContact O-N 3.5Å
95	K	48.8	Very low	64.6	Low	159 Å²	159	93.3 Å²	93.3	69%	0.691	50%	0.501	S	S	*	.			trans	-62.7	95.5	175.6	179.7	-159.6	170.8	-147.7	0	107.2	Y93 E97	Y93-K95 PolarHBondContact O-N 2.76Å; K95-E97 WeakPolarHBondContact CE-OE1 3.12Å; K95-E97 IonicContact NZ-OE1 2.68Å; K95-E97 PolarHBondContact NZ-OE1 3.15Å; K95-E97 IonicContact NZ-OE2 2.74Å; K95-E97 PolarHBondContact NZ-OE2 2.74Å; K95-E97 PolarHBondContact O-N 2.97Å
96	L	51.9	Low	62.1	Low	117 Å²	117	100.8 Å²	100.8	61%	0.613	53%	0.534	S	S	*	.			trans	-78.9	76.8	-179.9	-147.4	173.1	0	0	0	107.7	A94 E98	A94-L96 VanDerWaalsContact C-N 3.32Å; A94-L96 PolarHBondContact O-N 3.5Å; L96-E98 PolarHBondContact O-N 3.04Å
97	E	51.5	Low	60.6	Low	127 Å²	127	101.6 Å²	101.6	59%	0.593	54%	0.538	S	S	*	.			trans	-43	127.9	164.6	-157.3	102.6	-117.1	0	0	108.3	K95 R99	K95-E97 WeakPolarHBondContact CE-OE1 3.12Å; K95-E97 IonicContact NZ-OE1 2.68Å; K95-E97 PolarHBondContact NZ-OE1 3.15Å; K95-E97 IonicContact NZ-OE2 2.74Å; K95-E97 PolarHBondContact NZ-OE2 2.74Å; K95-E97 PolarHBondContact O-N 2.97Å; E97-R99 PolarHBondContact O-N 3.05Å
98	E	52	Low	59	Low	165 Å²	165	103.1 Å²	103.1	77%	0.771	54%	0.543	S	S	*	.			trans	-66.8	124.6	-158.7	-159	162.2	133.5	0	0	110.7	L96 T100	L96-E98 PolarHBondContact O-N 3.04Å; E98-T100 HydrophobicContact CB-CG2 4.1Å; E98-T100 HydrophobicContact CG-CG2 4.14Å; E98-T100 PolarHBondContact O-N 3.29Å; E98-T100 PolarHBondContact O-OG1 2.95Å
99	R	45.5	Very low	57.4	Low	169 Å²	169	110.5 Å²	110.5	64%	0.638	57%	0.566	S	S	*	*			trans	-73.6	70.7	-178.5	-179.5	179.8	157.1	82.8	-9	109.9	E97 G101 G104 G105	E97-R99 PolarHBondContact O-N 3.05Å; R99-G101 VanDerWaalsContact C-N 3.33Å; R99-G104 VanDerWaalsContact NH1-C 3.3Å; R99-G104 PolarHBondContact NH1-O 2.9Å; R99-G104 PolarHBondContact NH2-O 3.24Å; R99-G105 PolarHBondContact NH1-O 3.18Å; R99-G105 VanDerWaalsContact NH1-O 3.12Å
100	T	48.2	Very low	55.9	Low	105 Å²	105	114.1 Å²	114.1	64%	0.644	58%	0.579	S	S	*	*			trans	-82.4	-8.2	-176.2	50.5	0	0	0	0	113.7	E98 Y102	E98-T100 HydrophobicContact CB-CG2 4.1Å; E98-T100 HydrophobicContact CG-CG2 4.14Å; E98-T100 PolarHBondContact O-N 3.29Å; E98-T100 PolarHBondContact O-OG1 2.95Å; T100-Y102 PolarHBondContact O-N 3.34Å
101	G	50	Low	54.3	Low	19 Å²	19	118.9 Å²	118.9	20%	0.196	60%	0.603	C	S	.	*			trans	-61.5	106.8	178.9	0	0	0	0	0	112.9	R99 G103 G104	R99-G101 VanDerWaalsContact C-N 3.33Å; G101-G103 PolarHBondContact O-N 3.27Å; G101-G104 PolarHBondContact O-N 3.01Å
102	Y	48.1	Very low	53	Low	249 Å²	249	119.2 Å²	119.2	98%	0.976	60%	0.604	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.4	117.6	171.8	-142	-96.6	0	0	0	108.8	T100	T100-Y102 PolarHBondContact O-N 3.34Å
103	G	48.7	Very low	52.1	Low	85 Å²	85	127 Å²	127	88%	0.876	64%	0.641	S	S	*	*	T	Hydrogen-bonded Turn	trans	95.7	-6.4	-171.6	0	0	0	0	0	115.6	G101	G101-G103 PolarHBondContact O-N 3.27Å
104	G	54.5	Low	51.2	Low	27 Å²	27	130.3 Å²	130.3	28%	0.278	65%	0.654	S	S	.	*	S	Bend	trans	84.1	27.3	158.4	0	0	0	0	0	117.8	R99 G101	R99-G104 VanDerWaalsContact NH1-C 3.3Å; R99-G104 PolarHBondContact NH1-O 2.9Å; R99-G104 PolarHBondContact NH2-O 3.24Å; G101-G104 PolarHBondContact O-N 3.01Å
105	G	60	Low	51.2	Low	48 Å²	48	135.4 Å²	135.4	50%	0.495	67%	0.671	S	S	.	*			trans	-75.5	-178.3	160.4	0	0	0	0	0	113.5	R99	R99-G105 PolarHBondContact NH1-O 3.18Å; R99-G105 VanDerWaalsContact NH1-O 3.12Å
106	F	37.2	Very low	51.3	Low	159 Å²	159	136.7 Å²	136.7	70%	0.697	68%	0.68	S	S	*	*			trans	-93.7	137	156.3	-178.5	-117.5	0	0	0	107.1	E108	F106-E108 HydrophobicContact CD1-CB 3.86Å; F106-E108 HydrophobicContact CD1-CG 3.98Å; F106-E108 HydrophobicContact CE1-CB 4.28Å; F106-E108 HydrophobicContact CE1-CG 4Å; F106-E108 PolarHBondContact O-N 2.95Å
107	N	55.6	Low	51.3	Low	112 Å²	112	142.1 Å²	142.1	60%	0.599	69%	0.692	S	S	*	*			trans	-85.9	53.9	-163.7	-156.3	97.5	0	0	0	112.7	R109	N107-R109 PolarHBondContact O-N 2.93Å
108	E	51.5	Low	51.4	Low	162 Å²	162	144.1 Å²	144.1	76%	0.757	70%	0.702	S	S	*	*			trans	-81.5	26.8	-163.8	-150.7	159.9	-152.9	0	0	114.3	F106	F106-E108 HydrophobicContact CD1-CB 3.86Å; F106-E108 HydrophobicContact CD1-CG 3.98Å; F106-E108 HydrophobicContact CE1-CB 4.28Å; F106-E108 HydrophobicContact CE1-CG 4Å; F106-E108 PolarHBondContact O-N 2.95Å
109	R	52.5	Low	51	Low	191 Å²	191	146.2 Å²	146.2	72%	0.721	71%	0.712	S	S	*	*			trans	-140.8	72.9	178.9	-158	176.9	-68.2	-162.4	1.6	110.2	N107 N111 V112	N107-R109 PolarHBondContact O-N 2.93Å; R109-N111 PolarHBondContact O-N 2.9Å; R109-V112 HydrophobicContact CB-CG2 4.28Å; R109-V112 VanDerWaalsContact CD-CG2 3.46Å; R109-V112 HydrophobicContact CG-CG2 3.71Å
110	E	52.3	Low	51.3	Low	183 Å²	183	143.4 Å²	143.4	86%	0.855	72%	0.718	S	S	*	*	S	Bend	trans	-61.1	-21.6	-178.1	-167.6	169.8	168.6	0	0	113.3
111	N	50.3	Low	51.1	Low	143 Å²	143	143.8 Å²	143.8	77%	0.765	72%	0.716	S	S	*	*			trans	-122.3	78.8	178.3	-55.1	98.3	0	0	0	111	R109	R109-N111 PolarHBondContact O-N 2.9Å
112	V	54.5	Low	51.6	Low	75 Å²	75	146.3 Å²	146.3	46%	0.455	74%	0.741	S	S	.	*			trans	-95	90.7	153.3	-178.8	0	0	0	0	107	R109 Y114	R109-V112 HydrophobicContact CB-CG2 4.28Å; R109-V112 VanDerWaalsContact CD-CG2 3.46Å; R109-V112 HydrophobicContact CG-CG2 3.71Å; V112-Y114 HydrophobicContact CG1-CD2 4.31Å; V112-Y114 HydrophobicContact CG1-CE2 4.19Å; V112-Y114 WeakPolarHBondContact O-CD2 3.5Å; V112-Y114 PolarHBondContact O-N 2.84Å
113	E	54.9	Low	52.3	Low	181 Å²	181	137.1 Å²	137.1	85%	0.846	71%	0.707	S	S	*	*			trans	-70.5	113.5	165.3	-169.4	161.6	-125.9	0	0	107.3	I115	E113-I115 PolarHBondContact O-N 3.44Å
114	Y	47.9	Very low	53.2	Low	205 Å²	205	138.8 Å²	138.8	80%	0.804	69%	0.688	S	S	*	*			trans	-72.8	102.1	179.8	-76.6	-98.2	0	0	0	108.3	V112 E116	V112-Y114 HydrophobicContact CG1-CD2 4.31Å; V112-Y114 HydrophobicContact CG1-CE2 4.19Å; V112-Y114 WeakPolarHBondContact O-CD2 3.5Å; V112-Y114 PolarHBondContact O-N 2.84Å; Y114-E116 PolarHBondContact O-N 2.93Å
115	I	58.9	Low	54.2	Low	162 Å²	162	141.8 Å²	141.8	83%	0.831	70%	0.698	S	S	*	*			trans	-62.1	105.8	167.7	-58.4	174	0	0	0	106.8	E113 R117	E113-I115 PolarHBondContact O-N 3.44Å; I115-R117 PolarHBondContact O-N 3.42Å
116	E	52.1	Low	54.5	Low	186 Å²	186	148.9 Å²	148.9	87%	0.869	72%	0.718	S	S	*	*			trans	-68.1	93.8	-176.1	-168	163.5	-128.7	0	0	109.4	Y114 E118	Y114-E116 PolarHBondContact O-N 2.93Å; E116-E118 PolarHBondContact O-N 2.96Å
117	R	51.5	Low	55.5	Low	231 Å²	231	149.4 Å²	149.4	87%	0.872	72%	0.72	S	S	*	*			trans	-79.6	112.2	175.5	178.5	177.9	-67.7	-110.2	-3.4	108.2	I115	I115-R117 PolarHBondContact O-N 3.42Å
118	E	52.3	Low	55.8	Low	170 Å²	170	146.8 Å²	146.8	79%	0.794	72%	0.72	S	S	*	*			trans	-50.1	140.3	177.3	-62.5	-177	136.5	0	0	112	E116 S120	E116-E118 PolarHBondContact O-N 2.96Å; E118-S120 PolarHBondContact O-N 2.79Å
119	E	44.2	Very low	56.6	Low	209 Å²	209	147.2 Å²	147.2	98%	0.977	72%	0.715	S	S	*	*	S	Bend	trans	-74.3	26.5	-167.2	-148.5	177	144.4	0	0	113.9
120	S	52.3	Low	56.9	Low	109 Å²	109	143.9 Å²	143.9	76%	0.762	71%	0.705	S	S	*	*			trans	-101.9	12.7	-158.2	-167.2	0	0	0	0	116	E118	E118-S120 PolarHBondContact O-N 2.79Å
121	D	44.8	Very low	57.3	Low	114 Å²	114	140.1 Å²	140.1	61%	0.61	69%	0.686	S	S	*	*			trans	-123.4	96.4	172.1	-166.9	101.1	0	0	0	112	E123	D121-E123 PolarHBondContact O-N 2.93Å; D121-E123 VanDerWaalsContact OD2-CB 3.26Å; D121-E123 WeakPolarHBondContact OD2-CB 3.24Å; D121-E123 PolarHBondContact OD2-N 2.83Å; D121-E123 VanDerWaalsContact OD2-N 3.09Å
122	G	59.2	Low	57.8	Low	71 Å²	71	143.1 Å²	143.1	73%	0.732	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	-77.6	12.7	180	0	0	0	0	0	115.4
123	E	63.4	Low	57.9	Low	56 Å²	56	147 Å²	147	26%	0.262	70%	0.703	S	S	.	*	T	Hydrogen-bonded Turn	trans	-86.6	-7	-176.6	-162.1	151.8	132.3	0	0	113.6	D121 K130 K131 K133	D121-E123 PolarHBondContact O-N 2.93Å; D121-E123 VanDerWaalsContact OD2-CB 3.26Å; D121-E123 WeakPolarHBondContact OD2-CB 3.24Å; D121-E123 PolarHBondContact OD2-N 2.83Å; D121-E123 VanDerWaalsContact OD2-N 3.09Å; E123-K130 HydrophobicContact CG-CG 4.14Å; E123-K130 WeakPolarHBondContact OE1-CE 2.98Å; E123-K130 IonicContact OE1-NZ 2.64Å; E123-K130 PolarHBondContact OE1-NZ 2.83Å; E123-K131 PolarHBondContact O-N 3.23Å; E123-K133 WeakPolarHBondContact OE1-CE 3.36Å; E123-K133 IonicContact OE1-NZ 3.14Å; E123-K133 PolarHBondContact OE1-NZ 3.34Å; E123-K133 VanDerWaalsContact OE1-NZ 3.14Å; E123-K133 WeakPolarHBondContact OE2-CE 3.18Å; E123-K133 IonicContact OE2-NZ 3.27Å; E123-K133 PolarHBondContact OE2-NZ 3.21Å
124	Y	67.7	Low	57.4	Low	121 Å²	121	148.9 Å²	148.9	48%	0.475	70%	0.704	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-112.8	143.9	176.7	-86.6	-111.5	0	0	0	112.6	G128 K130	Y124-G128 VanDerWaalsContact CD1-C 3.46Å; Y124-G128 WeakPolarHBondContact CE1-O 3.2Å; Y124-K130 HydrophobicContact CD2-CB 4.22Å; Y124-K130 HydrophobicContact CD2-CG 4.1Å; Y124-K130 HydrophobicContact CE1-CB 4.07Å; Y124-K130 HydrophobicContact CE2-CB 3.66Å; Y124-K130 HydrophobicContact CE2-CD 3.69Å; Y124-K130 HydrophobicContact CE2-CG 3.57Å
125	D	76.3	Confident	57.2	Low	90 Å²	90	150.9 Å²	150.9	48%	0.481	71%	0.71	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-82.5	158.6	166.8	-106.4	14.2	0	0	0	111.1	F127 G128 R129 K131	D125-F127 PolarHBondContact O-N 2.82Å; D125-G128 PolarHBondContact O-N 3.23Å; D125-R129 PolarHBondContact N-O 2.78Å; D125-K131 VanDerWaalsContact OD1-CE 3.31Å; D125-K131 WeakPolarHBondContact OD1-CE 3.28Å; D125-K131 IonicContact OD1-NZ 2.63Å; D125-K131 PolarHBondContact OD1-NZ 3Å
126	E	65.8	Low	56.2	Low	197 Å²	197	145.7 Å²	145.7	92%	0.921	70%	0.696	S	S	*	*	T	Hydrogen-bonded Turn	trans	-50.9	-23.7	180	-167.3	177.9	179.5	0	0	114.4	G128	E126-G128 VanDerWaalsContact C-N 3.3Å; E126-G128 PolarHBondContact O-N 2.94Å
127	F	57	Low	55.4	Low	169 Å²	169	146.8 Å²	146.8	74%	0.741	70%	0.699	S	S	*	*	T	Hydrogen-bonded Turn	trans	-86.7	21.1	172.8	-84.9	-89.4	0	0	0	114.8	D125 R129	D125-F127 PolarHBondContact O-N 2.82Å; F127-R129 VanDerWaalsContact C-N 3.3Å; F127-R129 PolarHBondContact O-N 3.18Å
128	G	61.8	Low	54.7	Low	57 Å²	57	140.8 Å²	140.8	59%	0.588	69%	0.692	S	S	*	*	T	Hydrogen-bonded Turn	trans	65	28	175	0	0	0	0	0	114.5	Y124 D125 E126	Y124-G128 VanDerWaalsContact CD1-C 3.46Å; Y124-G128 WeakPolarHBondContact CE1-O 3.2Å; D125-G128 PolarHBondContact O-N 3.23Å; E126-G128 VanDerWaalsContact C-N 3.3Å; E126-G128 PolarHBondContact O-N 2.94Å
129	R	68.6	Low	53.7	Low	172 Å²	172	140.6 Å²	140.6	65%	0.649	70%	0.696	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-118.1	130.9	-178.3	-71.6	-179.3	-70	-176.5	-0.5	111.8	D125 F127	D125-R129 PolarHBondContact N-O 2.78Å; F127-R129 VanDerWaalsContact C-N 3.3Å; F127-R129 PolarHBondContact O-N 3.18Å
130	K	60.3	Low	53.1	Low	121 Å²	121	135.3 Å²	135.3	53%	0.526	68%	0.682	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-67.3	130	-179.2	-160.9	162	-173.5	163	0	111.4	E123 Y124 K132	E123-K130 HydrophobicContact CG-CG 4.14Å; E123-K130 WeakPolarHBondContact OE1-CE 2.98Å; E123-K130 IonicContact OE1-NZ 2.64Å; E123-K130 PolarHBondContact OE1-NZ 2.83Å; Y124-K130 HydrophobicContact CD2-CB 4.22Å; Y124-K130 HydrophobicContact CD2-CG 4.1Å; Y124-K130 HydrophobicContact CE1-CB 4.07Å; Y124-K130 HydrophobicContact CE2-CB 3.66Å; Y124-K130 HydrophobicContact CE2-CD 3.69Å; Y124-K130 HydrophobicContact CE2-CG 3.57Å; K130-K132 PolarHBondContact O-N 3.11Å
131	K	59.3	Low	52	Low	103 Å²	103	135.4 Å²	135.4	45%	0.448	68%	0.683	S	S	.	*	P	Polyproline II helix	trans	-65.3	118.8	175.6	-77.6	-171.1	171.4	75.9	0	110.5	E123 D125 K133	E123-K131 PolarHBondContact O-N 3.23Å; D125-K131 VanDerWaalsContact OD1-CE 3.31Å; D125-K131 WeakPolarHBondContact OD1-CE 3.28Å; D125-K131 IonicContact OD1-NZ 2.63Å; D125-K131 PolarHBondContact OD1-NZ 3Å; K131-K133 PolarHBondContact O-N 2.87Å
132	K	62	Low	51.4	Low	207 Å²	207	135.3 Å²	135.3	90%	0.9	69%	0.691	S	S	*	*	P	Polyproline II helix	trans	-70.3	116.8	172.6	-84.8	-174.4	172.3	179.2	0	110.3	K130 Y134	K130-K132 PolarHBondContact O-N 3.11Å; K132-Y134 PolarHBondContact O-N 3.47Å
133	K	56.1	Low	49.9	Very low	156 Å²	156	137.7 Å²	137.7	68%	0.678	70%	0.697	S	S	*	*	P	Polyproline II helix	trans	-70.4	120.1	177.2	-54.8	-175.4	-175.9	-178.4	0	109.3	E123 K131 R135	E123-K133 WeakPolarHBondContact OE1-CE 3.36Å; E123-K133 IonicContact OE1-NZ 3.14Å; E123-K133 PolarHBondContact OE1-NZ 3.34Å; E123-K133 VanDerWaalsContact OE1-NZ 3.14Å; E123-K133 WeakPolarHBondContact OE2-CE 3.18Å; E123-K133 IonicContact OE2-NZ 3.27Å; E123-K133 PolarHBondContact OE2-NZ 3.21Å; K131-K133 PolarHBondContact O-N 2.87Å; K133-R135 PolarHBondContact O-N 2.83Å
134	Y	43.8	Very low	48.5	Very low	220 Å²	220	139.8 Å²	139.8	86%	0.863	72%	0.723	S	S	*	*			trans	-71.6	112.8	-171.4	-177.5	-93.1	0	0	0	111.7	K132 G136	K132-Y134 PolarHBondContact O-N 3.47Å; Y134-G136 PolarHBondContact O-N 2.05Å
135	R	44.6	Very low	46.9	Very low	247 Å²	247	142.9 Å²	142.9	93%	0.932	74%	0.739	S	S	*	*			trans	-80.1	94.2	-178.3	176.1	176.4	161.7	168.4	-6.1	111	K133	K133-R135 PolarHBondContact O-N 2.83Å
136	G	38.2	Very low	44.8	Very low	53 Å²	53	146.1 Å²	146.1	55%	0.546	75%	0.752	S	S	.	*			trans	167	95.1	161.8	0	0	0	0	0	119	Y134	Y134-G136 PolarHBondContact O-N 2.05Å
137	K	35.3	Very low	43.1	Very low	210 Å²	210	142.4 Å²	142.4	91%	0.913	74%	0.743	S	S	*	*				-166	144.2	118.1	-153.3	69.5	172.3	-176.3	0	110.2
138	S	35.4	Very low	42.1	Very low	105 Å²	105	142.5 Å²	142.5	73%	0.734	75%	0.745	S	S	*	*			trans	-97.2	132.9	174.4	52.7	0	0	0	0	111.5
139	N	31.5	Very low	40.8	Very low	165 Å²	165	147.7 Å²	147.7	88%	0.882	75%	0.752	S	S	*	*			trans	-158.2	165.1	133.6	-134.5	16.6	0	0	0	111.7
140	S	31.7	Very low	39.1	Very low	98 Å²	98	148.3 Å²	148.3	69%	0.685	76%	0.759	S	S	*	*			trans	-113.7	172.7	-170	54.9	0	0	0	0	113.9
141	S	30	Very low	37.7	Very low	112 Å²	112	151 Å²	151	78%	0.783	77%	0.773	S	S	*	*			trans	73.3	152.5	179.4	89.2	0	0	0	0	114.7
142	S	30.7	Very low	36.4	Very low	111 Å²	111	152 Å²	152	78%	0.776	79%	0.788	S	S	*	*			cis	-139.8	166.1	8.6	-71	0	0	0	0	112.6
143	S	29.1	Very low	35.7	Very low	122 Å²	122	148 Å²	148	85%	0.853	78%	0.784	S	S	*	*			trans	-60.1	151.6	177.2	-38.4	0	0	0	0	115.4
144	A	33.6	Very low	34.4	Very low	99 Å²	99	146.6 Å²	146.6	82%	0.818	78%	0.777	S	S	*	*				-172.1	164.5	120.8	0	0	0	0	0	113.6
145	K	33.3	Very low	33.7	Very low	186 Å²	186	143.2 Å²	143.2	81%	0.809	77%	0.774	S	S	*	*			trans	-31.3	161.5	167.6	-69.2	178.9	171.8	-171.2	0	116.8
146	E	33.1	Very low	33.1	Very low	159 Å²	159	137.4 Å²	137.4	74%	0.743	76%	0.758	S	S	*	*			cis	-156.7	173.2	41.5	-160.3	144	93	0	0	115.9
147	T	29.5	Very low	32.7	Very low	119 Å²	119	141.6 Å²	141.6	73%	0.73	77%	0.767	S	S	*	*			trans	-61.4	166.9	162.8	44.6	0	0	0	0	111.3
148	E	37.4	Very low	32.8	Very low	170 Å²	170	140.7 Å²	140.7	79%	0.794	77%	0.766	S	S	*	*			cis	-153.5	161.4	27.8	-140.7	-177.9	78.1	0	0	106.5
149	K	33.8	Very low	32.8	Very low	166 Å²	166	144.7 Å²	144.7	72%	0.722	77%	0.774	S	S	*	*				-178.8	152.7	64.7	-166.4	-174.7	173.2	-164.6	0	111.4
150	K	32.5	Very low	32.9	Very low	186 Å²	186	146.5 Å²	146.5	81%	0.809	78%	0.777	S	S	*	*			trans	-65.5	160.7	168.4	-62.3	175.2	170.5	-179.3	0	112.1
151	E	30.4	Very low	33.1	Very low	176 Å²	176	150.9 Å²	150.9	82%	0.822	79%	0.786	S	S	*	*				-150.9	157.8	99.9	-62.8	-148.8	152.9	0	0	110.1
152	V	32.8	Very low	33.3	Very low	126 Å²	126	155 Å²	155	76%	0.764	79%	0.793	S	S	*	*			trans	-155.8	129.4	-170.2	167.3	0	0	0	0	107.5	K154	V152-K154 HydrophobicContact CG1-CB 4.26Å
153	P	46.3	Very low	33.5	Very low	123 Å²	123	159 Å²	159	80%	0.799	80%	0.8	S	S	*	*				-131.4	162.5	85.5	13.8	9.7	0	0	0	113.5
154	K	29	Very low	34.1	Very low	126 Å²	126	162.1 Å²	162.1	55%	0.548	80%	0.801	S	S	.	*			cis	92.9	100	20.6	-167.2	-95.6	-175.5	-173	0	115.4	V152 E156	V152-K154 HydrophobicContact CG1-CB 4.26Å; K154-E156 VanDerWaalsContact CE-CD 3.45Å; K154-E156 WeakPolarHBondContact CE-OE1 3.47Å; K154-E156 IonicContact NZ-OE1 2.61Å; K154-E156 PolarHBondContact NZ-OE1 3.44Å; K154-E156 IonicContact NZ-OE2 2.64Å; K154-E156 PolarHBondContact NZ-OE2 3.29Å
155	D	29.3	Very low	34.2	Very low	149 Å²	149	166.5 Å²	166.5	80%	0.797	80%	0.804	S	S	*	*			trans	-148.4	136.4	146.1	-65.3	-56.7	0	0	0	103.2
156	E	32	Very low	34.9	Very low	124 Å²	124	165.5 Å²	165.5	58%	0.579	81%	0.808	S	S	*	*			cis	69.5	118.1	43.8	-65.7	-175.7	166.2	0	0	112.4	K154	K154-E156 VanDerWaalsContact CE-CD 3.45Å; K154-E156 WeakPolarHBondContact CE-OE1 3.47Å; K154-E156 IonicContact NZ-OE1 2.61Å; K154-E156 PolarHBondContact NZ-OE1 3.44Å; K154-E156 IonicContact NZ-OE2 2.64Å; K154-E156 PolarHBondContact NZ-OE2 3.29Å
157	D	30.4	Very low	35.3	Very low	141 Å²	141	164.7 Å²	164.7	75%	0.754	81%	0.809	S	S	*	*			cis	-120.8	-146.2	-6.8	-69.1	-54.8	0	0	0	109.4
158	E	36.3	Very low	36.2	Very low	191 Å²	191	167 Å²	167	89%	0.893	82%	0.816	S	S	*	*			cis	-157.7	174.4	8	-155.4	163.1	-160.1	0	0	108.4
159	E	35.4	Very low	36.6	Very low	190 Å²	190	161.1 Å²	161.1	89%	0.888	80%	0.802	S	S	*	*			trans	-102.4	142.7	-174.2	-62.4	176.5	149.2	0	0	113.4
160	E	35.3	Very low	37.2	Very low	202 Å²	202	158.6 Å²	158.6	94%	0.944	80%	0.796	S	S	*	*			trans	-158.8	141.2	146.4	-124.6	167.4	-156.4	0	0	111.5
161	E	34.9	Very low	37.9	Very low	190 Å²	190	156 Å²	156	89%	0.888	79%	0.791	S	S	*	*			trans	-97.8	145	179.7	-58.5	175.5	129	0	0	110.6
162	E	34.2	Very low	39.1	Very low	199 Å²	199	151.5 Å²	151.5	93%	0.93	78%	0.778	S	S	*	*			trans	-151.3	156.3	148.3	-125.7	173.3	-149.5	0	0	110.6
163	E	35.4	Very low	40	Very low	196 Å²	196	154.7 Å²	154.7	92%	0.916	78%	0.782	S	S	*	*			trans	-89.6	171.3	-149.3	-60.2	-177.9	119.3	0	0	116.1
164	E	41.5	Very low	40.1	Very low	186 Å²	186	157.2 Å²	157.2	87%	0.869	78%	0.777	S	S	*	*			trans	-76.6	148.9	178.9	-57.3	-176.2	146.5	0	0	113.2
165	E	35.2	Very low	41.4	Very low	191 Å²	191	160.4 Å²	160.4	89%	0.893	79%	0.79	S	S	*	*			trans	-143.2	105.8	153.9	-164.3	164.9	-138.2	0	0	110.8	D167	E165-D167 PolarHBondContact O-N 2.93Å
166	D	48.1	Very low	42.2	Very low	166 Å²	166	161 Å²	161	89%	0.888	79%	0.793	S	S	*	*			trans	-73.7	98.2	169.3	-91.4	-44.6	0	0	0	109.9
167	D	40.7	Very low	42.8	Very low	141 Å²	141	161.3 Å²	161.3	75%	0.754	80%	0.798	S	S	*	*			trans	-101.6	102.2	168.8	-173.3	-129.6	0	0	0	111.5	E165 G169	E165-D167 PolarHBondContact O-N 2.93Å; D167-G169 PolarHBondContact O-N 2.96Å
168	D	49.8	Very low	43.8	Very low	167 Å²	167	161.6 Å²	161.6	89%	0.893	80%	0.8	S	S	*	*			trans	-79.1	66.8	179.5	-146.4	-33.1	0	0	0	110.6	D170	D168-D170 PolarHBondContact O-N 2.99Å
169	G	44.8	Very low	44.3	Very low	47 Å²	47	159.5 Å²	159.5	49%	0.485	80%	0.795	S	S	.	*			trans	-69.1	80.5	-167	0	0	0	0	0	116.1	D167 L171	D167-G169 PolarHBondContact O-N 2.96Å; G169-L171 PolarHBondContact O-N 2.72Å
170	D	46	Very low	45.2	Very low	114 Å²	114	158.6 Å²	158.6	61%	0.61	79%	0.791	S	S	*	*			trans	-21.5	104.4	173.4	177.2	27.5	0	0	0	117	D168 S172	D168-D170 PolarHBondContact O-N 2.99Å; D170-S172 VanDerWaalsContact CG-OG 3.25Å; D170-S172 WeakPolarHBondContact OD1-CB 3.32Å; D170-S172 PolarHBondContact OD1-N 3.09Å; D170-S172 PolarHBondContact OD1-OG 2.97Å; D170-S172 PolarHBondContact OD2-OG 3.09Å; D170-S172 VanDerWaalsContact OD2-OG 3.04Å
171	L	48.1	Very low	45.7	Very low	132 Å²	132	155.8 Å²	155.8	69%	0.691	78%	0.782	S	S	*	*			trans	-88.9	14.9	173.3	-68	-178.7	0	0	0	114.7	G169 K173 Y174	G169-L171 PolarHBondContact O-N 2.72Å; L171-K173 PolarHBondContact O-N 2.92Å; L171-Y174 HydrophobicContact CB-CE1 4.37Å; L171-Y174 WeakPolarHBondContact O-CE1 3.36Å
172	S	55.6	Low	46.7	Very low	80 Å²	80	153.7 Å²	153.7	56%	0.559	78%	0.777	S	S	*	*	G	3₁₀ helix	trans	-73.3	-3.9	179	73.7	0	0	0	0	114.9	D170 Y174	D170-S172 VanDerWaalsContact CG-OG 3.25Å; D170-S172 WeakPolarHBondContact OD1-CB 3.32Å; D170-S172 PolarHBondContact OD1-N 3.09Å; D170-S172 PolarHBondContact OD1-OG 2.97Å; D170-S172 PolarHBondContact OD2-OG 3.09Å; D170-S172 VanDerWaalsContact OD2-OG 3.04Å; S172-Y174 PolarHBondContact O-N 3.44Å
173	K	52.2	Low	47.5	Very low	193 Å²	193	152.3 Å²	152.3	84%	0.839	77%	0.771	S	S	*	*	G	3₁₀ helix	trans	-64.4	-9.6	-170.1	-153	-179.2	-171.6	68.1	0	116.4	L171	L171-K173 PolarHBondContact O-N 2.92Å
174	Y	47.1	Very low	48.1	Very low	177 Å²	177	150.2 Å²	150.2	69%	0.694	77%	0.766	S	S	*	*	G	3₁₀ helix	trans	-117.5	41.9	-178.4	55.4	-90.9	0	0	0	114	L171 S172 L176	L171-Y174 HydrophobicContact CB-CE1 4.37Å; L171-Y174 WeakPolarHBondContact O-CE1 3.36Å; S172-Y174 PolarHBondContact O-N 3.44Å; Y174-L176 PolarHBondContact O-N 3.4Å
175	K	57.6	Low	48.7	Very low	192 Å²	192	144.2 Å²	144.2	84%	0.835	75%	0.754	S	S	*	*			trans	-71.2	99.9	140.3	-76.1	-175.7	175.8	-178.8	0	108.2
176	L	45.5	Very low	49.5	Very low	162 Å²	162	140.6 Å²	140.6	85%	0.848	74%	0.74	S	S	*	*			trans	-97.3	124	157.7	-166.6	165	0	0	0	105.1	Y174	Y174-L176 PolarHBondContact O-N 3.4Å
177	D	44.8	Very low	49.8	Very low	130 Å²	130	139.3 Å²	139.3	70%	0.695	73%	0.733	S	S	*	*			trans	-58.4	144.4	-168.3	-67.6	-107.4	0	0	0	114.2	D179	D177-D179 VanDerWaalsContact C-N 3.32Å; D177-D179 PolarHBondContact O-N 2.98Å
178	D	52.1	Low	50.6	Low	148 Å²	148	136.2 Å²	136.2	79%	0.791	72%	0.723	S	S	*	*			trans	-89.9	66.2	179.7	-162.7	-150.4	0	0	0	108.5	E180	D178-E180 PolarHBondContact O-N 2.71Å
179	D	46.4	Very low	50.9	Low	147 Å²	147	136.1 Å²	136.1	79%	0.786	71%	0.714	S	S	*	*			trans	-77.7	91.9	173.5	-99.6	-68.1	0	0	0	109.3	D177 D181	D177-D179 VanDerWaalsContact C-N 3.32Å; D177-D179 PolarHBondContact O-N 2.98Å; D179-D181 VanDerWaalsContact C-N 3.25Å; D179-D181 PolarHBondContact O-N 3.24Å
180	E	53.6	Low	51	Low	170 Å²	170	142 Å²	142	79%	0.794	72%	0.723	S	S	*	*			trans	-67.4	77.8	168.5	-72	-174.4	112.9	0	0	110.9	D178 D182	D178-E180 PolarHBondContact O-N 2.71Å; E180-D182 VanDerWaalsContact C-N 3.25Å; E180-D182 PolarHBondContact O-N 3Å
181	D	45.5	Very low	51.2	Low	144 Å²	144	143.1 Å²	143.1	77%	0.77	73%	0.729	S	S	*	*			trans	-78.2	73.9	171	-162.8	-129.5	0	0	0	110.5	D179 E183	D179-D181 VanDerWaalsContact C-N 3.25Å; D179-D181 PolarHBondContact O-N 3.24Å; D181-E183 PolarHBondContact O-N 2.86Å
182	D	56.7	Low	51.4	Low	145 Å²	145	144.6 Å²	144.6	78%	0.775	74%	0.736	S	S	*	*			trans	-77.3	64.6	178.7	-146.9	-13.4	0	0	0	110.5	E180 D184	E180-D182 VanDerWaalsContact C-N 3.25Å; E180-D182 PolarHBondContact O-N 3Å; D182-D184 PolarHBondContact O-N 2.94Å
183	E	50.1	Low	51.1	Low	171 Å²	171	147.6 Å²	147.6	80%	0.799	75%	0.746	S	S	*	*			trans	-73.8	90.9	178.3	-177.2	150.1	82.1	0	0	111.2	D181 G185	D181-E183 PolarHBondContact O-N 2.86Å; E183-G185 PolarHBondContact O-N 2.82Å
184	D	49.1	Very low	50.6	Low	152 Å²	152	142.9 Å²	142.9	81%	0.813	74%	0.743	S	S	*	*			trans	-51.2	86.4	172.4	-118.3	-36.2	0	0	0	112.2	D182 D186	D182-D184 PolarHBondContact O-N 2.94Å; D184-D186 PolarHBondContact O-N 3.15Å
185	G	54.8	Low	50.3	Low	60 Å²	60	139.2 Å²	139.2	62%	0.619	74%	0.744	S	S	*	*			trans	-69.1	84.5	-177.8	0	0	0	0	0	113.3	E183 L187	E183-G185 PolarHBondContact O-N 2.82Å; G185-L187 PolarHBondContact O-N 3.13Å
186	D	51.7	Low	49.6	Very low	114 Å²	114	137.9 Å²	137.9	61%	0.61	75%	0.746	S	S	*	*			trans	-58.3	99.7	178.9	174.9	26	0	0	0	113.3	D184 S188	D184-D186 PolarHBondContact O-N 3.15Å; D186-S188 WeakPolarHBondContact OD1-CB 3.15Å; D186-S188 PolarHBondContact OD1-N 3.32Å; D186-S188 PolarHBondContact OD1-OG 2.77Å; D186-S188 PolarHBondContact OD2-OG 3.41Å
187	L	52.8	Low	49.6	Very low	139 Å²	139	139 Å²	139	73%	0.728	75%	0.747	S	S	*	*			trans	-93.5	6.6	174.5	-65.3	-177.1	0	0	0	114.1	G185 K189 Y190	G185-L187 PolarHBondContact O-N 3.13Å; L187-K189 PolarHBondContact O-N 3.08Å; L187-Y190 PolarHBondContact O-N 3.03Å
188	S	57.5	Low	49.2	Very low	77 Å²	77	140.9 Å²	140.9	54%	0.538	76%	0.757	S	S	.	*	G	3₁₀ helix	trans	-62	-15	177	71.3	0	0	0	0	113.5	D186 Y190	D186-S188 WeakPolarHBondContact OD1-CB 3.15Å; D186-S188 PolarHBondContact OD1-N 3.32Å; D186-S188 PolarHBondContact OD1-OG 2.77Å; D186-S188 PolarHBondContact OD2-OG 3.41Å; S188-Y190 PolarHBondContact O-N 3.34Å; S188-Y190 VanDerWaalsContact O-N 3.08Å
189	K	56.2	Low	48.4	Very low	165 Å²	165	140.7 Å²	140.7	72%	0.717	75%	0.751	S	S	*	*	G	3₁₀ helix	trans	-64.8	-9.2	179.4	-161.6	159.8	-170.6	165	0	115.4	L187	L187-K189 PolarHBondContact O-N 3.08Å
190	Y	48.4	Very low	48.2	Very low	169 Å²	169	141.3 Å²	141.3	66%	0.663	75%	0.747	S	S	*	*	G	3₁₀ helix	trans	-123.8	36.9	-175.2	-58.7	-71.1	0	0	0	114.2	L187 S188 L192	L187-Y190 PolarHBondContact O-N 3.03Å; S188-Y190 PolarHBondContact O-N 3.34Å; S188-Y190 VanDerWaalsContact O-N 3.08Å; Y190-L192 PolarHBondContact O-N 2.59Å
191	D	50.2	Low	48	Very low	139 Å²	139	138.8 Å²	138.8	74%	0.743	75%	0.745	S	S	*	*			trans	-65.4	75.2	168	-111.8	-44.8	0	0	0	112.1	N193	D191-N193 VanDerWaalsContact C-N 3.26Å; D191-N193 PolarHBondContact O-N 2.92Å
192	L	52.6	Low	47.4	Very low	162 Å²	162	135.8 Å²	135.8	85%	0.848	74%	0.741	S	S	*	*			trans	-91.7	45.9	175.4	-66.7	-176.8	0	0	0	112	Y190	Y190-L192 PolarHBondContact O-N 2.59Å
193	N	48	Very low	46.4	Very low	143 Å²	143	138.4 Å²	138.4	77%	0.765	75%	0.745	S	S	*	*			trans	-110.9	62.7	166.8	-166	69.4	0	0	0	111.4	D191	D191-N193 VanDerWaalsContact C-N 3.26Å; D191-N193 PolarHBondContact O-N 2.92Å
194	A	42.4	Very low	45.7	Very low	94 Å²	94	140.7 Å²	140.7	78%	0.777	75%	0.752	S	S	*	*			trans	-117.7	70.7	171.7	0	0	0	0	0	110.1
195	S	40.6	Very low	45	Very low	101 Å²	101	139.1 Å²	139.1	71%	0.706	75%	0.753	S	S	*	*			trans	-140.8	92.2	163.8	-66.2	0	0	0	0	105.7
196	D	41.8	Very low	43.9	Very low	163 Å²	163	139.3 Å²	139.3	87%	0.872	76%	0.755	S	S	*	*				74.9	60.4	89.3	-159.3	-119.3	0	0	0	110.9
197	E	46	Very low	43.1	Very low	187 Å²	187	139.1 Å²	139.1	87%	0.874	76%	0.763	S	S	*	*			trans	-136.6	83.7	171.8	-79.3	-89.1	105.9	0	0	107.4
198	D	37	Very low	42.2	Very low	168 Å²	168	143.7 Å²	143.7	90%	0.898	77%	0.77	S	S	*	*			trans	-149.8	144.8	160.3	-143.6	-31.6	0	0	0	111.4
199	E	35.1	Very low	41.1	Very low	145 Å²	145	145.8 Å²	145.8	68%	0.678	79%	0.785	S	S	*	*			trans	-108.2	124.3	-156.2	-100	-140.3	142.6	0	0	114.7
200	K	43	Very low	39.9	Very low	159 Å²	159	141.3 Å²	141.3	69%	0.691	79%	0.786	S	S	*	*			trans	74.5	174.7	149	-45.7	-90.8	174.7	-172	0	116.5
201	P	48.8	Very low	39.1	Very low	117 Å²	117	138.4 Å²	138.4	76%	0.76	79%	0.79	S	S	*	*			cis	-128	166.8	-33.8	22.9	-3.3	0	0	0	113.9
202	A	32.2	Very low	38.4	Very low	82 Å²	82	135.6 Å²	135.6	68%	0.678	78%	0.782	S	S	*	*				136.3	152.9	113.5	0	0	0	0	0	117.6
203	K	36.1	Very low	37.4	Very low	199 Å²	199	138.9 Å²	138.9	87%	0.865	78%	0.783	S	S	*	*			trans	72.1	101.4	158.9	-45.8	-159.3	-178.3	-178.4	0	118.5
204	K	35.1	Very low	36.7	Very low	219 Å²	219	137 Å²	137	95%	0.952	78%	0.781	S	S	*	*			trans	-88.9	117.8	161.4	-80.6	-178.1	175.2	175.7	0	111.5
205	S	35.3	Very low	36.4	Very low	119 Å²	119	139.1 Å²	139.1	83%	0.832	78%	0.784	S	S	*	*			trans	-166.3	139.3	158.4	53.3	0	0	0	0	107.8
206	G	31.8	Very low	36	Very low	64 Å²	64	138.4 Å²	138.4	66%	0.66	78%	0.779	S	S	*	*			cis	173.6	159.2	-3.4	0	0	0	0	0	109.6
207	S	34.6	Very low	35.6	Very low	111 Å²	111	140.8 Å²	140.8	78%	0.776	78%	0.776	S	S	*	*			trans	51.6	111.6	165.4	56	0	0	0	0	121.4
208	R	33.6	Very low	35	Very low	234 Å²	234	137 Å²	137	88%	0.883	77%	0.77	S	S	*	*				76	131.7	124.4	-67.3	179.3	165.6	178.6	-5.3	122.4
209	S	33.9	Very low	34.8	Very low	122 Å²	122	133.9 Å²	133.9	85%	0.853	76%	0.762	S	S	*	*			trans	64.7	141.7	135.9	63	0	0	0	0	122.2
210	G	31.1	Very low	34.7	Very low	71 Å²	71	132.3 Å²	132.3	73%	0.732	77%	0.766	S	S	*	*				137.6	68.3	128.3	0	0	0	0	0	120.3
211	S	32.8	Very low	34.3	Very low	108 Å²	108	129.8 Å²	129.8	76%	0.755	77%	0.769	S	S	*	*			trans	32.4	101.9	135.8	-160.3	0	0	0	0	121.5
212	S	34.6	Very low	33.7	Very low	80 Å²	80	131.5 Å²	131.5	56%	0.559	78%	0.778	S	S	*	*				72.1	155.6	129.2	81.5	0	0	0	0	122.4
213	R	32.7	Very low	33.8	Very low	230 Å²	230	132.4 Å²	132.4	87%	0.868	78%	0.779	S	S	*	*			trans	92.2	119.6	157	-60.4	150.8	-157.8	-118.7	-2.9	118.4
214	S	33.1	Very low	33.8	Very low	105 Å²	105	133.7 Å²	133.7	73%	0.734	78%	0.778	S	S	*	*			trans	-53.3	149.3	158	51.5	0	0	0	0	114.4
215	T	34.5	Very low	33.9	Very low	138 Å²	138	128.1 Å²	128.1	85%	0.847	77%	0.767	S	S	*	*				-161.8	164.8	113.7	16.2	0	0	0	0	112.7
216	S	33.1	Very low	34.1	Very low	85 Å²	85	133.1 Å²	133.1	59%	0.594	77%	0.767	S	S	*	*			trans	-78.7	179.2	-167.5	46.8	0	0	0	0	116.7
217	R	33.4	Very low	34.5	Very low	214 Å²	214	135 Å²	135	81%	0.808	77%	0.77	S	S	*	*			trans	74.6	101.6	138.7	71.7	-170.2	161	-172.4	-4	121.9
218	S	32.6	Very low	34.5	Very low	108 Å²	108	141.6 Å²	141.6	76%	0.755	78%	0.778	S	S	*	*				108.9	129.2	114.7	-67	0	0	0	0	122.3
219	S	34.1	Very low	34.8	Very low	102 Å²	102	135.2 Å²	135.2	71%	0.713	77%	0.77	S	S	*	*			trans	73.5	122.8	135.4	59.1	0	0	0	0	123
220	S	33.5	Very low	35	Very low	111 Å²	111	140.1 Å²	140.1	78%	0.776	77%	0.769	S	S	*	*			trans	66.2	146.5	143.1	47.6	0	0	0	0	120.2
221	S	32.9	Very low	35.3	Very low	107 Å²	107	141.4 Å²	141.4	75%	0.748	77%	0.767	S	S	*	*			cis	-173.9	139	-15.8	49.9	0	0	0	0	111.7
222	T	37.2	Very low	35.5	Very low	153 Å²	153	147.4 Å²	147.4	94%	0.939	77%	0.773	S	S	*	*			trans	-144.4	168.7	155.8	32.8	0	0	0	0	109.8
223	S	34.5	Very low	35.4	Very low	101 Å²	101	148 Å²	148	71%	0.706	78%	0.777	S	S	*	*			trans	-142.6	176	-153	64.5	0	0	0	0	115.3
224	R	35.1	Very low	35.6	Very low	226 Å²	226	143.6 Å²	143.6	85%	0.853	78%	0.776	S	S	*	*			trans	94.4	114.8	173.1	-57.4	172.2	-174.7	-155	-1.8	113
225	S	37.6	Very low	35.8	Very low	101 Å²	101	143.4 Å²	143.4	71%	0.706	78%	0.775	S	S	*	*				80	139.3	63.3	-72.2	0	0	0	0	111.9
226	R	39.7	Very low	35.9	Very low	225 Å²	225	142 Å²	142	85%	0.849	77%	0.77	S	S	*	*			cis	-166.6	162.8	0.6	-99.9	164.9	-177	-178.3	-0.3	105.9
227	S	39.3	Very low	36.2	Very low	102 Å²	102	142.4 Å²	142.4	71%	0.713	77%	0.773	S	S	*	*			cis	-169.2	165.6	-13.2	-107.1	0	0	0	0	108.9
228	R	35.3	Very low	36.4	Very low	250 Å²	250	143.4 Å²	143.4	94%	0.943	78%	0.777	S	S	*	*			trans	-96	157.1	160.8	-75	-176	175.8	175.7	-1.6	111.5
229	S	40.3	Very low	36.8	Very low	101 Å²	101	143.8 Å²	143.8	71%	0.706	78%	0.78	S	S	*	*			trans	-145.7	151.4	-175.6	-68.1	0	0	0	0	108.1
230	R	38.5	Very low	36.7	Very low	224 Å²	224	142.7 Å²	142.7	85%	0.845	79%	0.785	S	S	*	*			cis	-156.7	158.4	8.6	-113.5	155.8	-171.2	-162.2	2	110.1
231	S	36.2	Very low	36.9	Very low	98 Å²	98	142.7 Å²	142.7	69%	0.685	79%	0.785	S	S	*	*			trans	43.1	134.5	143.3	-52.7	0	0	0	0	122.1
232	R	36.7	Very low	37	Very low	235 Å²	235	149.1 Å²	149.1	89%	0.887	79%	0.792	S	S	*	*			cis	70.2	141.9	47.9	-62.7	-178.8	-176.6	-162.9	1.4	114.7
233	S	32.8	Very low	36.8	Very low	92 Å²	92	146.3 Å²	146.3	64%	0.643	78%	0.779	S	S	*	*			cis	-178.1	150.2	-14.8	-89.5	0	0	0	0	110.5
234	T	37.6	Very low	36.8	Very low	138 Å²	138	153 Å²	153	85%	0.847	79%	0.789	S	S	*	*			trans	58.5	141.9	153.2	52	0	0	0	0	119.7
235	S	36.8	Very low	36.8	Very low	101 Å²	101	146.9 Å²	146.9	71%	0.706	78%	0.781	S	S	*	*				-173	156.6	68.5	52.5	0	0	0	0	116.2
236	S	36.5	Very low	36.5	Very low	108 Å²	108	151.1 Å²	151.1	76%	0.755	79%	0.789	S	S	*	*			trans	58	147.2	148.1	52.3	0	0	0	0	122.4
237	S	39.2	Very low	36.2	Very low	94 Å²	94	145.4 Å²	145.4	66%	0.657	78%	0.784	S	S	*	*			cis	-173.8	167.5	-16.7	62.3	0	0	0	0	112.3
238	R	38.7	Very low	36	Very low	234 Å²	234	152 Å²	152	88%	0.883	79%	0.793	S	S	*	*			trans	72	148.6	162.7	-67	177.9	172	-144.6	-2.8	117.2
239	S	39.4	Very low	35.9	Very low	117 Å²	117	145.3 Å²	145.3	82%	0.818	79%	0.785	S	S	*	*			cis	-166.4	144.4	-14.4	45	0	0	0	0	111.9
240	G	32.8	Very low	35.6	Very low	79 Å²	79	145.4 Å²	145.4	81%	0.814	79%	0.786	S	S	*	*			trans	-165.5	112	173.9	0	0	0	0	0	114.2
241	S	37.1	Very low	35.5	Very low	110 Å²	110	139.7 Å²	139.7	77%	0.769	78%	0.78	S	S	*	*			trans	-77.6	167.2	174.9	36.6	0	0	0	0	113
242	R	35	Very low	35.5	Very low	242 Å²	242	146.2 Å²	146.2	91%	0.913	79%	0.789	S	S	*	*			cis	-157.4	174.3	16.6	-130	155.7	-158.8	177.5	4.7	109.8
243	S	33.1	Very low	35.6	Very low	95 Å²	95	140.7 Å²	140.7	66%	0.664	79%	0.787	S	S	*	*			trans	-128.1	149.8	179.4	58.1	0	0	0	0	113.5
244	R	34.4	Very low	35.6	Very low	240 Å²	240	139.6 Å²	139.6	91%	0.906	79%	0.79	S	S	*	*				161.4	154.8	127.9	-86.4	160.9	-170.7	-157.9	-0.4	113.1
245	S	36.3	Very low	35.7	Very low	98 Å²	98	143.6 Å²	143.6	69%	0.685	80%	0.795	S	S	*	*			trans	-75.7	167.3	166.7	48.5	0	0	0	0	112.1
246	H	31.2	Very low	35.5	Very low	190 Å²	190	142.2 Å²	142.2	88%	0.88	80%	0.798	S	S	*	*			trans	-170	173.7	133.5	-104.1	76	0	0	0	110.4
247	S	33.3	Very low	35.6	Very low	106 Å²	106	142.9 Å²	142.9	74%	0.741	80%	0.802	S	S	*	*			trans	-136.1	158.1	-163.6	-49.5	0	0	0	0	114.4
248	R	35	Very low	35.7	Very low	240 Å²	240	143.9 Å²	143.9	91%	0.906	81%	0.809	S	S	*	*			trans	97.7	145.9	159.1	-53.9	-177.1	-179.5	-152.8	-0.8	118.8
249	S	33.8	Very low	36.5	Very low	110 Å²	110	139 Å²	139	77%	0.769	81%	0.808	S	S	*	*			trans	105.7	100.2	148	-54.8	0	0	0	0	121
250	S	33.6	Very low	36.4	Very low	103 Å²	103	141 Å²	141	72%	0.72	80%	0.804	S	S	*	*				65.3	102.1	129.6	61.8	0	0	0	0	124.3
251	S	36.3	Very low	36.6	Very low	104 Å²	104	147.2 Å²	147.2	73%	0.727	81%	0.809	S	S	*	*				96.3	140.9	111.1	79.7	0	0	0	0	123.2
252	R	36.8	Very low	36.6	Very low	235 Å²	235	151.8 Å²	151.8	89%	0.887	81%	0.809	S	S	*	*			trans	69.7	146.6	163	-63.5	-177.2	168.7	-162.9	-3.1	117.8
253	S	37.6	Very low	36.7	Very low	118 Å²	118	144.3 Å²	144.3	83%	0.825	79%	0.794	S	S	*	*			cis	-168.2	140.5	-17.3	-96.3	0	0	0	0	112.6
254	G	33.7	Very low	36.7	Very low	69 Å²	69	151.5 Å²	151.5	71%	0.711	81%	0.807	S	S	*	*			trans	161	118.9	167.6	0	0	0	0	0	110.5
255	K	39.4	Very low	36.8	Very low	222 Å²	222	145.6 Å²	145.6	97%	0.965	80%	0.802	S	S	*	*				57.7	117.8	68.1	-71.1	-169.4	171.9	-173.5	0	112.4
256	G	31.6	Very low	37.6	Very low	73 Å²	73	146.3 Å²	146.3	75%	0.753	80%	0.804	S	S	*	*			cis	-171	-172.5	-2.9	0	0	0	0	0	108.7
257	S	39.3	Very low	37.8	Very low	122 Å²	122	142.4 Å²	142.4	85%	0.853	80%	0.799	S	S	*	*			cis	-160	153.7	-0.1	-70.8	0	0	0	0	109.1
258	S	41.8	Very low	37.7	Very low	115 Å²	115	142.4 Å²	142.4	80%	0.804	80%	0.799	S	S	*	*			trans	-132.3	136.1	172.2	-53.4	0	0	0	0	111.4
259	P	54.9	Low	38.1	Very low	132 Å²	132	136.5 Å²	136.5	86%	0.857	79%	0.794	S	S	*	*			trans	-81.9	145.7	-177.3	32	-34.4	0	0	0	113.3
260	Q	38.1	Very low	38.8	Very low	157 Å²	157	137.8 Å²	137.8	73%	0.734	80%	0.799	S	S	*	*			trans	-80.2	163.5	-179.4	-62.5	176.3	-21.1	0	0	113
261	K	36.4	Very low	39.6	Very low	210 Å²	210	141.3 Å²	141.3	91%	0.913	81%	0.805	S	S	*	*			trans	-117.1	137	154	-76.5	-78.9	-174.4	-75.1	0	108
262	R	37.2	Very low	39.7	Very low	207 Å²	207	147.9 Å²	147.9	78%	0.781	81%	0.814	S	S	*	*			trans	-142.2	118.4	-166.8	-155.4	-179.2	-165	-93.1	7.4	111.8
263	S	36.7	Very low	39.7	Very low	85 Å²	85	140 Å²	140	59%	0.594	81%	0.805	S	S	*	*			trans	44.1	120.4	153.9	64.4	0	0	0	0	120.9
264	R	33.2	Very low	40	Very low	246 Å²	246	142.1 Å²	142.1	93%	0.928	80%	0.802	S	S	*	*				-179.8	157.6	105.6	-94.3	166.1	-178	-169.6	-0.7	112.2
265	S	37.4	Very low	40.3	Very low	115 Å²	115	146.9 Å²	146.9	80%	0.804	80%	0.803	S	S	*	*			trans	-104.8	-167.2	-175.3	-34.8	0	0	0	0	110
266	P	53.1	Low	40	Very low	113 Å²	113	148 Å²	148	73%	0.734	80%	0.801	S	S	*	*			cis	-142.1	-174.6	6	44.7	-25.7	0	0	0	117.5
267	S	34.2	Very low	40.2	Very low	109 Å²	109	148.7 Å²	148.7	76%	0.762	80%	0.795	S	S	*	*			trans	69.4	154.5	157.1	90.3	0	0	0	0	117.8
268	S	32.3	Very low	40	Very low	106 Å²	106	153.8 Å²	153.8	74%	0.741	80%	0.795	S	S	*	*			cis	-138.5	147.8	6.5	-65.2	0	0	0	0	112.5
269	S	42.2	Very low	39.6	Very low	115 Å²	115	152.4 Å²	152.4	80%	0.804	79%	0.786	S	S	*	*			trans	-147.9	129.7	166.3	-64.6	0	0	0	0	110.8
270	P	49.9	Very low	38.8	Very low	137 Å²	137	157.3 Å²	157.3	89%	0.89	79%	0.787	S	S	*	*			trans	-89	108.3	175.2	32.6	-30.6	0	0	0	111.8
271	E	50.5	Low	38.6	Very low	177 Å²	177	155.2 Å²	155.2	83%	0.827	79%	0.789	S	S	*	*			trans	-99.6	122.4	171	-114.7	-74.7	96.3	0	0	110.1
272	R	37.2	Very low	38.6	Very low	243 Å²	243	150.4 Å²	150.4	92%	0.917	78%	0.782	S	S	*	*			trans	-177.5	147.5	159.6	-107.2	171.7	-173.4	-142.1	1.1	109.3
273	G	37.3	Very low	38.8	Very low	69 Å²	69	145.5 Å²	145.5	71%	0.711	78%	0.78	S	S	*	*			cis	142	131	2.9	0	0	0	0	0	110.6
274	Q	43.2	Very low	38.8	Very low	162 Å²	162	145.5 Å²	145.5	76%	0.757	79%	0.793	S	S	*	*			trans	-59.1	165.4	-179.4	-52.6	171.2	-10.6	0	0	111.6
275	K	39.4	Very low	38.9	Very low	170 Å²	170	137.3 Å²	137.3	74%	0.739	79%	0.785	S	S	*	*			cis	-167.8	159.6	21.7	11.3	-145.7	154.8	-155.3	0	111.1
276	R	34.9	Very low	39.1	Very low	244 Å²	244	143.9 Å²	143.9	92%	0.921	79%	0.792	S	S	*	*			trans	43.4	130.5	154.2	-69.8	178.2	165.8	177.6	-4.9	118.3
277	S	36.1	Very low	38.8	Very low	88 Å²	88	148.2 Å²	148.2	62%	0.615	80%	0.8	S	S	*	*				175.9	159.5	72.5	62.2	0	0	0	0	113.5
278	R	33.9	Very low	39.1	Very low	229 Å²	229	154.1 Å²	154.1	86%	0.864	81%	0.805	S	S	*	*			trans	62.5	152.4	157.3	-68.3	167.4	175.7	130	-6.4	118.6
279	S	34.5	Very low	39.8	Very low	86 Å²	86	160.9 Å²	160.9	60%	0.601	81%	0.814	S	S	*	*			cis	-171.5	154.3	-28.3	53.3	0	0	0	0	110.3
280	R	36.8	Very low	39.7	Very low	236 Å²	236	165.8 Å²	165.8	89%	0.891	82%	0.815	S	S	*	*			trans	67.2	160.5	169.1	-58.2	168.4	176.6	170.5	-3.4	115.5
281	S	34.7	Very low	39.1	Very low	112 Å²	112	163.9 Å²	163.9	78%	0.783	81%	0.805	S	S	*	*			cis	-168.8	154.8	-31.3	-90	0	0	0	0	109.7
282	S	36.3	Very low	38.6	Very low	109 Å²	109	167.1 Å²	167.1	76%	0.762	81%	0.81	S	S	*	*			trans	127.4	140.3	147.8	-160.2	0	0	0	0	117.2
283	S	40.7	Very low	38.6	Very low	105 Å²	105	161.2 Å²	161.2	73%	0.734	81%	0.806	S	S	*	*			trans	29	122.5	150.7	57.7	0	0	0	0	120.2
284	G	36.3	Very low	38.6	Very low	85 Å²	85	167 Å²	167	88%	0.876	81%	0.814	S	S	*	*			cis	102.1	90.1	-0.9	0	0	0	0	0	115.2
285	G	36.3	Very low	38.3	Very low	73 Å²	73	164.7 Å²	164.7	75%	0.753	82%	0.816	S	S	*	*			trans	138.6	160	166.6	0	0	0	0	0	114.6
286	R	40.5	Very low	38.5	Very low	253 Å²	253	161.5 Å²	161.5	96%	0.955	82%	0.815	S	S	*	*			cis	-153.7	158.4	-12.6	-109.2	-179.1	-172.4	-157.3	2	109.7
287	K	47.4	Very low	38.7	Very low	204 Å²	204	158.2 Å²	158.2	89%	0.887	81%	0.81	S	S	*	*			trans	-60.6	148	-179.6	-54.3	173.4	-176.9	176	0	112.5
288	R	41.6	Very low	38.9	Very low	234 Å²	234	164.5 Å²	164.5	88%	0.883	82%	0.82	S	S	*	*			trans	-133.8	121.2	147.6	-83.3	-166.8	167.4	175.4	-1.3	112
289	R	47.2	Very low	39.3	Very low	247 Å²	247	165.1 Å²	165.1	93%	0.932	82%	0.822	S	S	*	*			trans	-101.3	142.1	153.3	-74.3	-176.6	172.5	-169.3	-1.9	107.6
290	R	39	Very low	39.6	Very low	219 Å²	219	167.5 Å²	167.5	83%	0.826	84%	0.839	S	S	*	*			trans	-153.6	140.7	155.5	-91.3	-173.4	169.2	165.2	-5.7	105.5
291	S	37.2	Very low	39.6	Very low	96 Å²	96	159.2 Å²	159.2	67%	0.671	83%	0.827	S	S	*	*			cis	154	128.8	-13.6	44	0	0	0	0	103.5
292	R	39.6	Very low	39.8	Very low	246 Å²	246	162.6 Å²	162.6	93%	0.928	83%	0.83	S	S	*	*			trans	-66.9	152.9	179.8	-71.5	171.8	164.3	150.9	-8.9	111.8
293	S	38.4	Very low	39.8	Very low	118 Å²	118	162.5 Å²	162.5	83%	0.825	83%	0.829	S	S	*	*			trans	-141.6	144.6	155.7	-62.7	0	0	0	0	109.3
294	H	36.7	Very low	39.7	Very low	191 Å²	191	163.2 Å²	163.2	88%	0.884	83%	0.834	S	S	*	*			trans	-103.8	145.3	171.1	-75.9	133.8	0	0	0	110.2
295	S	37.4	Very low	39.7	Very low	114 Å²	114	162.5 Å²	162.5	80%	0.797	83%	0.827	S	S	*	*			trans	177.3	135.4	139.8	-84.2	0	0	0	0	107.2
296	S	43.3	Very low	40	Very low	103 Å²	103	165 Å²	165	72%	0.72	83%	0.833	S	S	*	*			cis	112.4	54.7	13.6	78.8	0	0	0	0	115.6
297	E	39.3	Very low	40.1	Very low	175 Å²	175	158 Å²	158	82%	0.818	82%	0.823	S	S	*	*			trans	-128.1	119.8	159.4	-88.2	178.9	82.2	0	0	109.9
298	R	40.5	Very low	40	Very low	219 Å²	219	156.3 Å²	156.3	83%	0.826	82%	0.823	S	S	*	*				62.4	93.6	95.2	-65.7	180	-173.6	-103.1	-1.3	111.6
299	R	42.3	Very low	40.2	Very low	243 Å²	243	151.3 Å²	151.3	92%	0.917	82%	0.823	S	S	*	*				57.7	98.6	92	-78	-173.8	169.3	-111.4	2.6	113.6
300	S	40.3	Very low	39.8	Very low	135 Å²	135	142.6 Å²	142.6	94%	0.944	81%	0.811	S	S	*	*			trans	-152.6	141.9	135.9	-86.2	0	0	0	0	108.6
301	G	36.6	Very low	40	Very low	62 Å²	62	138.3 Å²	138.3	64%	0.639	81%	0.814	S	S	*	*			trans	-165.8	150.6	177.2	0	0	0	0	0	111.9
302	H	39.3	Very low	40.5	Very low	183 Å²	183	138.5 Å²	138.5	85%	0.847	82%	0.816	S	S	*	*			trans	61.4	100.2	153.2	-59.2	115.2	0	0	0	119.3
303	S	35.9	Very low	40.9	Very low	107 Å²	107	131.7 Å²	131.7	75%	0.748	81%	0.806	S	S	*	*				107.6	145.5	116.1	-59.8	0	0	0	0	120.8
304	S	37.9	Very low	41.6	Very low	120 Å²	120	135 Å²	135	84%	0.839	81%	0.806	S	S	*	*			trans	114.4	135.9	141.2	-46.1	0	0	0	0	117.9
305	G	36.7	Very low	42.2	Very low	71 Å²	71	135.3 Å²	135.3	73%	0.732	80%	0.804	S	S	*	*			trans	83	119.9	164.2	0	0	0	0	0	115.8
306	S	42.8	Very low	42.9	Very low	124 Å²	124	142.6 Å²	142.6	87%	0.867	82%	0.821	S	S	*	*			cis	89.5	66.9	6.2	-41.3	0	0	0	0	119
307	S	43.5	Very low	42.9	Very low	107 Å²	107	144.6 Å²	144.6	75%	0.748	83%	0.826	S	S	*	*			trans	-168.6	117.1	154.6	47.1	0	0	0	0	108.8
308	L	44.9	Very low	43.1	Very low	168 Å²	168	142.9 Å²	142.9	88%	0.88	83%	0.827	S	S	*	*				84.4	143.2	75.9	-76.8	175.3	0	0	0	114.7
309	S	46.1	Very low	43.3	Very low	129 Å²	129	138.7 Å²	138.7	90%	0.902	83%	0.827	S	S	*	*			trans	67.1	150.5	-169.7	77.4	0	0	0	0	115.8
310	G	37.3	Very low	43.3	Very low	65 Å²	65	132.6 Å²	132.6	67%	0.67	82%	0.822	S	S	*	*			cis	158.7	126.4	-12	0	0	0	0	0	113.5
311	S	44.8	Very low	43.5	Very low	128 Å²	128	132.4 Å²	132.4	90%	0.895	81%	0.814	S	S	*	*			trans	67.3	162.8	179.5	-46.9	0	0	0	0	114.6
312	S	46.5	Very low	44	Very low	101 Å²	101	137.1 Å²	137.1	71%	0.706	83%	0.826	S	S	*	*			cis	-148.9	163.2	1.3	-158.5	0	0	0	0	112.3
313	S	49.5	Very low	44.3	Very low	102 Å²	102	133.9 Å²	133.9	71%	0.713	82%	0.824	S	S	*	*			trans	25.8	122.2	151.5	-52.7	0	0	0	0	120.8
314	K	51.1	Low	44.9	Very low	189 Å²	189	135.9 Å²	135.9	82%	0.822	83%	0.83	S	S	*	*				85.5	126.7	50.5	-171.5	-173.4	-173.6	176.6	0	113.5
315	K	50.9	Low	45.5	Very low	196 Å²	196	137.3 Å²	137.3	85%	0.852	83%	0.829	S	S	*	*			trans	76.7	150.9	-175.3	-59.3	-178.2	178.9	178.2	0	114.7
316	K	52.3	Low	46.3	Very low	267 Å²	267	143.3 Å²	143.3	100%	1.161	84%	0.838	S	S	*	*			cis	-136.5	0	-2.1	-155	-171.3	175.9	-168.4	0	110.7

Retrieved 316 of 316 residues in 177.2 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).