A0A3B3W3H6_9TELE Loading...

Serine and arginine rich splicing factor 7b

AlphaFold DB , UniProt , Accession A0A3B3W3H6, Species 9TELE (Poecilia latipinna, sailfin molly), Gene n/a, Length 229 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	37.1	Very low	49.7	Very low	231 Å²	231	122 Å²	122	100%	1.138	62%	0.623	S	S	*	*				0	125.8	0	-55	70	169.1	0	0	106.1
2	S	39.8	Very low	52.5	Low	88 Å²	88	116.9 Å²	116.9	62%	0.615	59%	0.593	S	S	*	*			cis	-143.6	153.7	0	-62.8	0	0	0	0	110	F4	S2-F4 PolarHBondContact O-N 3.13Å
3	R	40.2	Very low	55.2	Low	244 Å²	244	107.9 Å²	107.9	92%	0.921	55%	0.547	S	S	*	.			trans	-93.1	31.9	-167	-65.6	-176.7	-179.8	154.6	-0.6	115	G5	R3-G5 VanDerWaalsContact C-N 3.31Å; R3-G5 PolarHBondContact O-N 3.37Å
4	F	43.2	Very low	57.4	Low	146 Å²	146	104.6 Å²	104.6	64%	0.64	53%	0.525	S	S	*	.			trans	-72.2	78.1	-178.5	-58.4	-62.8	0	0	0	112.3	S2	S2-F4 PolarHBondContact O-N 3.13Å
5	G	44.2	Very low	59.3	Low	65 Å²	65	97.6 Å²	97.6	67%	0.67	49%	0.49	S	S	*	.	S	Bend	trans	-171.7	26.4	-175.8	0	0	0	0	0	116.2	R3	R3-G5 VanDerWaalsContact C-N 3.31Å; R3-G5 PolarHBondContact O-N 3.37Å
6	R	49.2	Very low	60.9	Low	221 Å²	221	91.6 Å²	91.6	83%	0.834	46%	0.46	S	S	*	.	S	Bend	trans	-137.3	-31.3	176.5	-74.3	-62.5	-171.5	153.1	2.6	115.4
7	Y	49.8	Very low	62.1	Low	168 Å²	168	91.9 Å²	91.9	66%	0.659	46%	0.464	S	S	*	.			trans	-111.5	63.4	177.2	-61.1	-71.8	0	0	0	110.5	E10	Y7-E10 WeakPolarHBondContact CA-OE1 3.22Å; Y7-E10 HydrophobicContact CD1-CG 3.93Å
8	G	49.2	Very low	62.8	Low	76 Å²	76	87.6 Å²	87.6	78%	0.784	44%	0.442	S	S	*	.	S	Bend	trans	-102.4	4	-171.2	0	0	0	0	0	115.2	E10	G8-E10 PolarHBondContact N-OE1 3.18Å
9	G	55.1	Low	63	Low	16 Å²	16	83.6 Å²	83.6	17%	0.165	43%	0.426	C	S	.	.	S	Bend	trans	-132.2	-17.6	-178.7	0	0	0	0	0	114.6	G84	G9-G84 PolarHBondContact O-N 2.98Å
10	E	61.7	Low	63.2	Low	80 Å²	80	87.6 Å²	87.6	37%	0.374	45%	0.454	S	S	.	.	S	Bend	trans	-97.4	-33.8	-173.7	47	-84	87.4	0	0	113.7	Y7 G8 K12	Y7-E10 WeakPolarHBondContact CA-OE1 3.22Å; Y7-E10 HydrophobicContact CD1-CG 3.93Å; G8-E10 PolarHBondContact N-OE1 3.18Å; E10-K12 PolarHBondContact O-N 2.88Å
11	S	77.3	Confident	63.2	Low	7 Å²	7	86.4 Å²	86.4	5%	0.049	46%	0.464	C	S	.	.	S	Bend	trans	-73.4	14.5	175.4	-40.6	0	0	0	0	114.4	F54 S57	S11-F54 WeakPolarHBondContact CB-O 3.24Å; S11-F54 PolarHBondContact O-N 3Å; S11-S57 PolarHBondContact OG-N 2.69Å
12	K	83.8	Confident	64.5	Low	61 Å²	61	76 Å²	76	27%	0.265	41%	0.414	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.4	130.4	-178.1	-170.3	179.5	173.8	-94.8	0	110.6	E10 F51 V52 S82	E10-K12 PolarHBondContact O-N 2.88Å; K12-F51 VanDerWaalsContact NZ-CG 3.28Å; K12-V52 CarbonylContact C-O 3.51Å; K12-V52 WeakPolarHBondContact CA-O 3.41Å; K12-S82 PolarHBondContact NZ-OG 3.2Å; K12-S82 VanDerWaalsContact NZ-OG 3.13Å; K12-S82 WeakPolarHBondContact O-CA 3.34Å; K12-S82 VanDerWaalsContact O-CB 3.26Å; K12-S82 WeakPolarHBondContact O-CB 3.35Å; K12-S82 PolarHBondContact O-N 2.66Å
13	V	87	Confident	66.2	Low	0 Å²	0	73.3 Å²	73.3	0%	0	40%	0.401	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113.6	137.5	177.9	-178.2	0	0	0	0	109.9	V15 F31 F51 V52 F54 A60 V64 V79	V13-V15 HydrophobicContact CG1-CG2 4.16Å; V13-F31 HydrophobicContact CG1-CE1 4.1Å; V13-F51 WeakPolarHBondContact O-CA 3.41Å; V13-V52 HydrophobicContact CB-CB 4.42Å; V13-V52 PolarHBondContact N-O 3.29Å; V13-V52 PolarHBondContact O-N 3.37Å; V13-F54 HydrophobicContact CG2-CD2 3.95Å; V13-F54 HydrophobicContact CG2-CE2 3.82Å; V13-A60 HydrophobicContact CG2-CB 3.65Å; V13-V64 HydrophobicContact CG1-CG2 3.87Å; V13-V64 HydrophobicContact CG2-CG2 4.08Å; V13-V79 HydrophobicContact CG1-CG1 3.3Å
14	Y	86.4	Confident	68.2	Low	61 Å²	61	66.6 Å²	66.6	24%	0.239	38%	0.378	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	136.1	166.7	169.5	-117.8	0	0	0	109.4	F49 F51 V79 E80 S82	Y14-F49 HydrophobicContact CE2-CB 4.18Å; Y14-F49 AromaticContact CE2-CD1 3.73Å; Y14-F49 HydrophobicContact CE2-CD1 3.73Å; Y14-F49 HydrophobicContact CE2-CG 4.21Å; Y14-F49 AromaticContact CZ-CD1 3.68Å; Y14-F49 WeakPolarHBondContact OH-CD1 3.4Å; Y14-F49 WeakPolarHBondContact OH-CE1 3.49Å; Y14-F51 AromaticContact CD2-CD1 3.95Å; Y14-F51 HydrophobicContact CD2-CD1 3.95Å; Y14-F51 AromaticContact CD2-CE1 3.39Å; Y14-F51 HydrophobicContact CD2-CE1 3.39Å; Y14-F51 AromaticContact CD2-CZ 3.95Å; Y14-F51 HydrophobicContact CD2-CZ 3.95Å; Y14-F51 HydrophobicContact CE2-CE1 4.33Å; Y14-F51 HydrophobicContact CE2-CZ 4.49Å; Y14-F51 HydrophobicContact CG-CD1 4.48Å; Y14-F51 AromaticContact CG-CE1 4Å; Y14-F51 HydrophobicContact CG-CE1 4Å; Y14-V79 WeakPolarHBondContact O-CA 3.4Å; Y14-E80 HydrophobicContact CD1-CB 3.98Å; Y14-E80 PolarHBondContact N-O 2.76Å; Y14-E80 PolarHBondContact O-N 3.11Å; Y14-S82 WeakPolarHBondContact CB-OG 3.16Å; Y14-S82 PolarHBondContact N-OG 3.35Å
15	V	85.6	Confident	70.1	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	37%	0.371	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	109.4	-178.3	-167.5	0	0	0	0	107	V13 L18 L27 F31 F49 A50 V52 V77 V79	V13-V15 HydrophobicContact CG1-CG2 4.16Å; V15-L18 HydrophobicContact CB-CD1 4.13Å; V15-L18 HydrophobicContact CG1-CD1 3.81Å; V15-L18 HydrophobicContact CG1-CD2 3.76Å; V15-L18 HydrophobicContact CG1-CG 3.87Å; V15-L27 HydrophobicContact CG1-CD2 4.06Å; V15-F31 HydrophobicContact CB-CZ 4.35Å; V15-F31 HydrophobicContact CG1-CE2 4.17Å; V15-F31 HydrophobicContact CG1-CZ 3.9Å; V15-F31 HydrophobicContact CG2-CE1 3.95Å; V15-F31 HydrophobicContact CG2-CE2 4.05Å; V15-F31 HydrophobicContact CG2-CZ 3.44Å; V15-F31 VanDerWaalsContact CG2-CZ 3.44Å; V15-F49 CarbonylContact O-C 3.51Å; V15-F49 WeakPolarHBondContact O-CA 3.24Å; V15-A50 HydrophobicContact CB-CB 4.31Å; V15-A50 PolarHBondContact N-O 3.2Å; V15-A50 PolarHBondContact O-N 2.91Å; V15-V52 HydrophobicContact CG2-CG2 4.09Å; V15-V77 HydrophobicContact CG1-CG1 3.36Å; V15-V79 HydrophobicContact CG1-CG2 4.42Å
16	G	84.2	Confident	71.9	Confident	1 Å²	1	62.3 Å²	62.3	1%	0.01	35%	0.352	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	167.3	-176.1	0	0	0	0	0	113.5	L18 G48 R78	G16-L18 PolarHBondContact O-N 3.13Å; G16-G48 CarbonylContact C-O 3.54Å; G16-R78 PolarHBondContact N-O 3.15Å; G16-R78 PolarHBondContact O-N 2.83Å
17	N	81.4	Confident	73.5	Confident	98 Å²	98	52 Å²	52	52%	0.524	31%	0.314	S	S	.	.	S	Bend	trans	56.2	35.9	-172.4	-158.1	50.4	0	0	0	112.9	G19 G48 S75 R76	N17-G19 PolarHBondContact O-N 3.01Å; N17-G48 PolarHBondContact N-O 3.38Å; N17-S75 WeakPolarHBondContact O-CB 3.46Å; N17-R76 WeakPolarHBondContact CB-O 3.48Å; N17-R76 PolarHBondContact ND2-O 2.67Å
18	L	75.3	Confident	75.2	Confident	13 Å²	13	47.5 Å²	47.5	7%	0.068	30%	0.299	C	S	.	.			trans	-71.5	121	170.5	-72.4	167.1	0	0	0	109.2	V15 G16 A22 L27 G48 A50 V77	V15-L18 HydrophobicContact CB-CD1 4.13Å; V15-L18 HydrophobicContact CG1-CD1 3.81Å; V15-L18 HydrophobicContact CG1-CD2 3.76Å; V15-L18 HydrophobicContact CG1-CG 3.87Å; G16-L18 PolarHBondContact O-N 3.13Å; L18-A22 HydrophobicContact CB-CB 4.04Å; L18-A22 HydrophobicContact CD2-CB 3.82Å; L18-A22 HydrophobicContact CG-CB 4.5Å; L18-L27 HydrophobicContact CD1-CD1 4.38Å; L18-L27 HydrophobicContact CD1-CD2 4.16Å; L18-L27 HydrophobicContact CD2-CD2 4.01Å; L18-G48 PolarHBondContact N-O 3.41Å; L18-G48 WeakPolarHBondContact O-CA 3.27Å; L18-A50 HydrophobicContact CD1-CB 3.54Å; L18-V77 HydrophobicContact CD2-CG1 4.04Å; L18-V77 HydrophobicContact CD2-CG2 3.85Å
19	G	67.5	Low	76.9	Confident	13 Å²	13	52.2 Å²	52.2	13%	0.134	29%	0.293	C	S	.	.			trans	-62.3	160.6	176.4	0	0	0	0	0	112.4	N17 G21 A22 S75	N17-G19 PolarHBondContact O-N 3.01Å; G19-G21 PolarHBondContact O-N 2.87Å; G19-A22 WeakPolarHBondContact O-CB 3.36Å; G19-A22 PolarHBondContact O-N 2.89Å; G19-S75 VanDerWaalsContact CA-OG 3.27Å; G19-S75 WeakPolarHBondContact CA-OG 3.35Å
20	T	65.9	Low	78.2	Confident	163 Å²	163	52.3 Å²	52.3	100%	1	29%	0.292	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.6	-18.1	-170	-24.2	0	0	0	0	115.1
21	G	62.5	Low	79.3	Confident	63 Å²	63	48.5 Å²	48.5	65%	0.649	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-96	-5	175.9	0	0	0	0	0	116.2	G19 G23	G19-G21 PolarHBondContact O-N 2.87Å; G21-G23 VanDerWaalsContact C-N 3.33Å; G21-G23 PolarHBondContact O-N 3.13Å
22	A	66.3	Low	79.6	Confident	11 Å²	11	50.1 Å²	50.1	9%	0.091	29%	0.292	C	S	.	.			trans	-78.8	77.4	-173.7	0	0	0	0	0	112.3	L18 G19	L18-A22 HydrophobicContact CB-CB 4.04Å; L18-A22 HydrophobicContact CD2-CB 3.82Å; L18-A22 HydrophobicContact CG-CB 4.5Å; G19-A22 WeakPolarHBondContact O-CB 3.36Å; G19-A22 PolarHBondContact O-N 2.89Å
23	G	73.8	Confident	79.6	Confident	33 Å²	33	56.5 Å²	56.5	34%	0.34	32%	0.316	S	S	.	.			trans	-79.5	175.6	-179	0	0	0	0	0	115.2	G21 A25 E26 L27	G21-G23 VanDerWaalsContact C-N 3.33Å; G21-G23 PolarHBondContact O-N 3.13Å; G23-A25 VanDerWaalsContact C-N 3.31Å; G23-A25 PolarHBondContact O-N 3.33Å; G23-E26 PolarHBondContact O-N 3.48Å; G23-L27 PolarHBondContact O-N 2.86Å
24	K	82.3	Confident	79.5	Confident	103 Å²	103	59.6 Å²	59.6	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-53.7	-42.7	-176.8	-180	177.7	172.7	-76.9	0	113.2	E26 L27 E28 V40 I42	K24-E26 VanDerWaalsContact C-N 3.26Å; K24-E26 PolarHBondContact O-N 2.86Å; K24-L27 PolarHBondContact O-N 2.8Å; K24-E28 VanDerWaalsContact CE-OE1 3.31Å; K24-E28 WeakPolarHBondContact CE-OE1 3.25Å; K24-E28 HydrophobicContact CG-CG 4.33Å; K24-E28 WeakPolarHBondContact CG-OE2 3.2Å; K24-E28 IonicContact NZ-OE1 3.66Å; K24-E28 PolarHBondContact NZ-OE1 2.96Å; K24-E28 IonicContact NZ-OE2 2.92Å; K24-E28 PolarHBondContact NZ-OE2 2.8Å; K24-E28 WeakPolarHBondContact O-CB 3.35Å; K24-E28 WeakPolarHBondContact O-CG 3.49Å; K24-E28 PolarHBondContact O-N 3.47Å; K24-V40 HydrophobicContact CG-CB 4.42Å; K24-V40 HydrophobicContact CG-CG1 4.18Å; K24-I42 HydrophobicContact CB-CD1 3.88Å
25	A	83.7	Confident	79.3	Confident	58 Å²	58	57.2 Å²	57.2	48%	0.479	32%	0.322	S	S	.	.	H	α-helix	trans	-62.7	-31	179.1	0	0	0	0	0	113.2	G23 R29	G23-A25 VanDerWaalsContact C-N 3.31Å; G23-A25 PolarHBondContact O-N 3.33Å; A25-R29 WeakPolarHBondContact O-CG 3.45Å; A25-R29 PolarHBondContact O-N 3.35Å
26	E	82.3	Confident	79.2	Confident	62 Å²	62	60.8 Å²	60.8	29%	0.29	35%	0.345	S	S	.	.	H	α-helix	trans	-77.2	-39	178.1	-167.3	61.3	-169.8	0	0	111.5	G23 K24 E28 R29 A30 I72	G23-E26 PolarHBondContact O-N 3.48Å; K24-E26 VanDerWaalsContact C-N 3.26Å; K24-E26 PolarHBondContact O-N 2.86Å; E26-E28 VanDerWaalsContact C-N 3.34Å; E26-R29 PolarHBondContact O-N 2.98Å; E26-R29 IonicContact OE2-CZ 3.46Å; E26-R29 IonicContact OE2-NE 3.45Å; E26-R29 PolarHBondContact OE2-NE 3.32Å; E26-R29 VanDerWaalsContact OE2-NE 3.13Å; E26-R29 IonicContact OE2-NH2 3.72Å; E26-R29 PolarHBondContact OE2-NH2 2.85Å; E26-A30 VanDerWaalsContact O-CB 3.24Å; E26-A30 WeakPolarHBondContact O-CB 3.38Å; E26-A30 PolarHBondContact O-N 2.98Å; E26-I72 HydrophobicContact CG-CG2 3.85Å
27	L	83.2	Confident	79.2	Confident	4 Å²	4	63 Å²	63	2%	0.021	36%	0.357	C	S	.	.	H	α-helix	trans	-61.3	-42.8	169.7	-65.3	169.7	0	0	0	111.2	V15 L18 G23 K24 R29 A30 F31 V40 I42 A50	V15-L27 HydrophobicContact CG1-CD2 4.06Å; L18-L27 HydrophobicContact CD1-CD1 4.38Å; L18-L27 HydrophobicContact CD1-CD2 4.16Å; L18-L27 HydrophobicContact CD2-CD2 4.01Å; G23-L27 PolarHBondContact O-N 2.86Å; K24-L27 PolarHBondContact O-N 2.8Å; L27-R29 PolarHBondContact O-N 3.02Å; L27-A30 PolarHBondContact O-N 3.46Å; L27-F31 HydrophobicContact CB-CD2 4.45Å; L27-F31 HydrophobicContact CD2-CD2 4.1Å; L27-F31 HydrophobicContact CD2-CE2 3.69Å; L27-F31 WeakPolarHBondContact O-CB 3.49Å; L27-F31 WeakPolarHBondContact O-CD2 3.38Å; L27-F31 PolarHBondContact O-N 3.03Å; L27-V40 HydrophobicContact CB-CG1 4.1Å; L27-V40 HydrophobicContact CD1-CG1 3.95Å; L27-I42 HydrophobicContact CD1-CD1 3.9Å; L27-I42 HydrophobicContact CD1-CG1 3.9Å; L27-A50 HydrophobicContact CD1-CB 3.56Å
28	E	85.4	Confident	79.4	Confident	75 Å²	75	64.8 Å²	64.8	35%	0.35	36%	0.356	S	S	.	.	H	α-helix	trans	-65.2	-38.5	178.3	-74.8	177.4	137.2	0	0	112.7	K24 E26 G32 L37 V40	K24-E28 VanDerWaalsContact CE-OE1 3.31Å; K24-E28 WeakPolarHBondContact CE-OE1 3.25Å; K24-E28 HydrophobicContact CG-CG 4.33Å; K24-E28 WeakPolarHBondContact CG-OE2 3.2Å; K24-E28 IonicContact NZ-OE1 3.66Å; K24-E28 PolarHBondContact NZ-OE1 2.96Å; K24-E28 IonicContact NZ-OE2 2.92Å; K24-E28 PolarHBondContact NZ-OE2 2.8Å; K24-E28 WeakPolarHBondContact O-CB 3.35Å; K24-E28 WeakPolarHBondContact O-CG 3.49Å; K24-E28 PolarHBondContact O-N 3.47Å; E26-E28 VanDerWaalsContact C-N 3.34Å; E28-G32 VanDerWaalsContact O-CA 3.32Å; E28-G32 WeakPolarHBondContact O-CA 3.41Å; E28-G32 PolarHBondContact O-N 2.91Å; E28-L37 HydrophobicContact CB-CD1 4.21Å; E28-L37 HydrophobicContact CG-CD1 4.04Å; E28-V40 HydrophobicContact CG-CG2 3.97Å
29	R	84.4	Confident	79.8	Confident	175 Å²	175	67.7 Å²	67.7	66%	0.66	37%	0.374	S	S	*	.	H	α-helix	trans	-68.3	-46.3	172.4	-74	-171.7	-67.5	-135.4	6.3	112.9	A25 E26 L27	A25-R29 WeakPolarHBondContact O-CG 3.45Å; A25-R29 PolarHBondContact O-N 3.35Å; E26-R29 PolarHBondContact O-N 2.98Å; E26-R29 IonicContact OE2-CZ 3.46Å; E26-R29 IonicContact OE2-NE 3.45Å; E26-R29 PolarHBondContact OE2-NE 3.32Å; E26-R29 VanDerWaalsContact OE2-NE 3.13Å; E26-R29 IonicContact OE2-NH2 3.72Å; E26-R29 PolarHBondContact OE2-NH2 2.85Å; L27-R29 PolarHBondContact O-N 3.02Å
30	A	83.4	Confident	80.6	Confident	17 Å²	17	67.9 Å²	67.9	14%	0.14	37%	0.373	C	S	.	.	H	α-helix	trans	-73.2	-42.9	-173.2	0	0	0	0	0	113	E26 L27 Y34 I72	E26-A30 VanDerWaalsContact O-CB 3.24Å; E26-A30 WeakPolarHBondContact O-CB 3.38Å; E26-A30 PolarHBondContact O-N 2.98Å; L27-A30 PolarHBondContact O-N 3.46Å; A30-Y34 WeakPolarHBondContact O-CD2 3.38Å; A30-Y34 WeakPolarHBondContact O-CE2 3.35Å; A30-I72 HydrophobicContact CB-CD1 4.4Å
31	F	83.6	Confident	81.6	Confident	0 Å²	0	67 Å²	67	0%	0	35%	0.352	C	S	.	.	H	α-helix	trans	-85.6	-28.6	-179.7	-70.5	-99.7	0	0	0	111.9	V13 V15 L27 Y33 Y34 G35 L37 V52 F54 A63 L67 V79	V13-F31 HydrophobicContact CG1-CE1 4.1Å; V15-F31 HydrophobicContact CB-CZ 4.35Å; V15-F31 HydrophobicContact CG1-CE2 4.17Å; V15-F31 HydrophobicContact CG1-CZ 3.9Å; V15-F31 HydrophobicContact CG2-CE1 3.95Å; V15-F31 HydrophobicContact CG2-CE2 4.05Å; V15-F31 HydrophobicContact CG2-CZ 3.44Å; V15-F31 VanDerWaalsContact CG2-CZ 3.44Å; L27-F31 HydrophobicContact CB-CD2 4.45Å; L27-F31 HydrophobicContact CD2-CD2 4.1Å; L27-F31 HydrophobicContact CD2-CE2 3.69Å; L27-F31 WeakPolarHBondContact O-CB 3.49Å; L27-F31 WeakPolarHBondContact O-CD2 3.38Å; L27-F31 PolarHBondContact O-N 3.03Å; F31-Y33 PolarHBondContact O-N 3.49Å; F31-Y34 PolarHBondContact O-N 3.01Å; F31-G35 PolarHBondContact O-N 3.19Å; F31-L37 HydrophobicContact CB-CD1 4.3Å; F31-L37 HydrophobicContact CB-CD2 3.76Å; F31-V52 HydrophobicContact CB-CG1 4.48Å; F31-V52 HydrophobicContact CD1-CG2 4.39Å; F31-V52 HydrophobicContact CD2-CG2 4.46Å; F31-V52 HydrophobicContact CG-CG2 4.3Å; F31-F54 HydrophobicContact CB-CZ 3.88Å; F31-F54 AromaticContact CD1-CE2 3.95Å; F31-F54 HydrophobicContact CD1-CE2 3.95Å; F31-F54 AromaticContact CD1-CZ 3.85Å; F31-F54 HydrophobicContact CD1-CZ 3.85Å; F31-F54 HydrophobicContact CG-CZ 4.38Å; F31-A63 HydrophobicContact CD1-CB 4.06Å; F31-A63 HydrophobicContact CE1-CB 4.45Å; F31-L67 HydrophobicContact CD1-CD1 3.59Å; F31-L67 HydrophobicContact CD2-CD1 3.89Å; F31-L67 HydrophobicContact CE1-CD1 3.5Å; F31-L67 HydrophobicContact CE2-CD1 3.8Å; F31-L67 HydrophobicContact CG-CD1 3.78Å; F31-L67 HydrophobicContact CZ-CB 4.46Å; F31-L67 HydrophobicContact CZ-CD1 3.6Å; F31-V79 HydrophobicContact CE1-CG1 3.95Å; F31-V79 HydrophobicContact CZ-CG1 4.14Å; F31-V79 HydrophobicContact CZ-CG2 4.2Å
32	G	83.9	Confident	82.6	Confident	41 Å²	41	66.7 Å²	66.7	42%	0.423	33%	0.334	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.2	-12.3	176.7	0	0	0	0	0	114.8	E28 Y34	E28-G32 VanDerWaalsContact O-CA 3.32Å; E28-G32 WeakPolarHBondContact O-CA 3.41Å; E28-G32 PolarHBondContact O-N 2.91Å; G32-Y34 VanDerWaalsContact C-N 3.31Å
33	Y	84.6	Confident	83	Confident	196 Å²	196	66.7 Å²	66.7	77%	0.769	33%	0.334	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.2	-28.1	168.3	179.8	-96.5	0	0	0	112.8	F31	F31-Y33 PolarHBondContact O-N 3.49Å
34	Y	83.8	Confident	82.8	Confident	64 Å²	64	76.1 Å²	76.1	25%	0.251	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	-30	-174.9	-63.8	-96.5	0	0	0	112.7	A30 F31 G32 A63 G66 L67	A30-Y34 WeakPolarHBondContact O-CD2 3.38Å; A30-Y34 WeakPolarHBondContact O-CE2 3.35Å; F31-Y34 PolarHBondContact O-N 3.01Å; G32-Y34 VanDerWaalsContact C-N 3.31Å; Y34-A63 HydrophobicContact CD1-CB 4.28Å; Y34-A63 HydrophobicContact CD2-CB 4.23Å; Y34-A63 HydrophobicContact CG-CB 3.87Å; Y34-G66 PolarHBondContact OH-O 3.45Å; Y34-L67 HydrophobicContact CD2-CD1 4.06Å; Y34-L67 HydrophobicContact CD2-CG 4.45Å; Y34-L67 HydrophobicContact CE2-CD1 3.71Å; Y34-L67 HydrophobicContact CE2-CD2 3.77Å; Y34-L67 HydrophobicContact CE2-CG 3.67Å
35	G	82.7	Confident	81.5	Confident	12 Å²	12	78.2 Å²	78.2	12%	0.124	38%	0.376	C	S	.	.	S	Bend	trans	178.3	169.8	177.7	0	0	0	0	0	114.1	F31 L37	F31-G35 PolarHBondContact O-N 3.19Å; G35-L37 PolarHBondContact O-N 2.9Å
36	P	84.1	Confident	80.6	Confident	74 Å²	74	79.1 Å²	79.1	48%	0.481	38%	0.377	S	S	.	.			trans	-63.6	127.3	178.9	25.5	-33.9	0	0	0	112.2	E55	P36-E55 HydrophobicContact CG-CB 4.02Å; P36-E55 PolarHBondContact O-N 3.24Å; P36-E55 VanDerWaalsContact O-N 3.15Å
37	L	84.5	Confident	79.8	Confident	47 Å²	47	81.1 Å²	81.1	25%	0.246	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.9	120.5	-178.6	-53.3	177.7	0	0	0	110	E28 F31 G35 V40 V52 F54	E28-L37 HydrophobicContact CB-CD1 4.21Å; E28-L37 HydrophobicContact CG-CD1 4.04Å; F31-L37 HydrophobicContact CB-CD1 4.3Å; F31-L37 HydrophobicContact CB-CD2 3.76Å; G35-L37 PolarHBondContact O-N 2.9Å; L37-V40 HydrophobicContact CB-CG2 4.47Å; L37-V40 HydrophobicContact CD1-CG2 4.19Å; L37-V52 HydrophobicContact CD2-CG1 3.69Å; L37-F54 HydrophobicContact CD2-CD1 3.82Å; L37-F54 HydrophobicContact CD2-CE1 3.46Å; L37-F54 VanDerWaalsContact CD2-CE1 3.46Å; L37-F54 HydrophobicContact CD2-CE2 4.32Å; L37-F54 HydrophobicContact CD2-CG 4.4Å; L37-F54 HydrophobicContact CD2-CZ 3.76Å
38	R	85.3	Confident	79.2	Confident	137 Å²	137	81.9 Å²	81.9	52%	0.517	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-86.1	-35.4	-179.2	-178.7	170	164.4	-125.2	-23	112.6	E53	R38-E53 WeakPolarHBondContact CA-O 3.44Å; R38-E53 WeakPolarHBondContact CB-O 3.43Å; R38-E53 IonicContact CZ-OE1 3.09Å; R38-E53 PolarHBondContact N-O 3.4Å; R38-E53 IonicContact NE-OE1 3.88Å; R38-E53 IonicContact NH1-OE1 2.64Å; R38-E53 PolarHBondContact NH1-OE1 3.02Å; R38-E53 IonicContact NH2-OE1 3.35Å; R38-E53 PolarHBondContact NH2-OE1 3.32Å
39	T	82	Confident	79.1	Confident	73 Å²	73	81.4 Å²	81.4	45%	0.448	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-161.2	150.4	165.1	-177.9	0	0	0	0	112	E53	T39-E53 HydrophobicContact CG2-CB 3.61Å; T39-E53 HydrophobicContact CG2-CG 4.39Å; T39-E53 WeakPolarHBondContact CG2-OE2 3.41Å; T39-E53 PolarHBondContact N-O 3.04Å; T39-E53 VanDerWaalsContact N-O 3.11Å; T39-E53 PolarHBondContact O-N 3.26Å
40	V	86.1	Confident	79.1	Confident	18 Å²	18	73 Å²	73	11%	0.109	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.8	120.4	176.5	-179.7	0	0	0	0	108.8	K24 L27 E28 L37 V52	K24-V40 HydrophobicContact CG-CB 4.42Å; K24-V40 HydrophobicContact CG-CG1 4.18Å; L27-V40 HydrophobicContact CB-CG1 4.1Å; L27-V40 HydrophobicContact CD1-CG1 3.95Å; E28-V40 HydrophobicContact CG-CG2 3.97Å; L37-V40 HydrophobicContact CB-CG2 4.47Å; L37-V40 HydrophobicContact CD1-CG2 4.19Å; V40-V52 HydrophobicContact CG1-CG2 4.47Å; V40-V52 HydrophobicContact CG2-CG2 4.46Å
41	W	85.3	Confident	79.3	Confident	145 Å²	145	75.3 Å²	75.3	55%	0.549	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.2	135	179.9	-178.3	93	0	0	0	110.2	A43 A50 F51	W41-A43 HydrophobicContact CH2-CB 3.79Å; W41-A43 HydrophobicContact CZ3-CB 3.58Å; W41-A50 CarbonylContact O-C 3.57Å; W41-A50 VanDerWaalsContact O-CA 3.31Å; W41-A50 WeakPolarHBondContact O-CA 3.45Å; W41-A50 WeakPolarHBondContact O-CB 3.2Å; W41-F51 HydrophobicContact CE3-CB 4.42Å; W41-F51 AromaticContact CE3-CD2 3.58Å; W41-F51 HydrophobicContact CE3-CD2 3.58Å; W41-F51 HydrophobicContact CE3-CE2 4.37Å; W41-F51 HydrophobicContact CE3-CG 4.45Å; W41-F51 AromaticContact CZ3-CD2 3.61Å; W41-F51 HydrophobicContact CZ3-CD2 3.61Å; W41-F51 AromaticContact CZ3-CE2 3.94Å; W41-F51 HydrophobicContact CZ3-CE2 3.94Å; W41-F51 PolarHBondContact N-O 3.5Å; W41-F51 PolarHBondContact O-N 2.86Å
42	I	83.8	Confident	79.5	Confident	55 Å²	55	75.3 Å²	75.3	28%	0.282	38%	0.376	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.5	125.3	-178.2	-58.6	178	0	0	0	109.2	K24 L27 A50	K24-I42 HydrophobicContact CB-CD1 3.88Å; L27-I42 HydrophobicContact CD1-CD1 3.9Å; L27-I42 HydrophobicContact CD1-CG1 3.9Å; I42-A50 HydrophobicContact CG1-CB 4.08Å
43	A	75.9	Confident	79.6	Confident	11 Å²	11	76 Å²	76	9%	0.091	37%	0.368	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.3	125.5	168.6	0	0	0	0	0	108.9	W41 F49	W41-A43 HydrophobicContact CH2-CB 3.79Å; W41-A43 HydrophobicContact CZ3-CB 3.58Å; A43-F49 WeakPolarHBondContact CA-O 3.12Å; A43-F49 HydrophobicContact CB-CB 3.94Å; A43-F49 WeakPolarHBondContact CB-O 3.32Å; A43-F49 PolarHBondContact N-O 2.9Å
44	R	68.9	Low	79.7	Confident	231 Å²	231	66.6 Å²	66.6	87%	0.872	33%	0.332	S	S	*	.			trans	-96.8	-2.8	170.2	-63.9	-176.6	177.8	179.3	-2.1	112.7
45	N	55.4	Low	79.7	Confident	148 Å²	148	69.1 Å²	69.1	79%	0.791	35%	0.346	S	S	*	.	S	Bend	trans	-152.3	114.3	178.2	-169.1	14.5	0	0	0	110.3
46	P	64.3	Low	79.7	Confident	76 Å²	76	70.9 Å²	70.9	49%	0.494	35%	0.352	S	S	.	.	S	Bend	cis	-64.5	162.5	-9.5	-9.8	25.8	0	0	0	111.3	F49	P46-F49 HydrophobicContact CB-CD2 4.36Å; P46-F49 HydrophobicContact CB-CE2 3.88Å; P46-F49 HydrophobicContact CG-CD2 4.45Å; P46-F49 HydrophobicContact CG-CE2 3.97Å
47	P	65.4	Low	79.6	Confident	105 Å²	105	68.3 Å²	68.3	68%	0.682	34%	0.336	S	S	*	.	S	Bend	trans	-68.4	150	178.3	29.4	-35.1	0	0	0	111.8
48	G	71.4	Confident	79.7	Confident	20 Å²	20	73.8 Å²	73.8	21%	0.206	35%	0.353	C	S	.	.	S	Bend	trans	90.3	22.1	170	0	0	0	0	0	116.5	G16 N17 L18	G16-G48 CarbonylContact C-O 3.54Å; N17-G48 PolarHBondContact N-O 3.38Å; L18-G48 PolarHBondContact N-O 3.41Å; L18-G48 WeakPolarHBondContact O-CA 3.27Å
49	F	81.8	Confident	79.7	Confident	64 Å²	64	69.1 Å²	69.1	28%	0.281	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.1	143.7	173.6	-51.7	-64.5	0	0	0	112.7	Y14 V15 A43 P46	Y14-F49 HydrophobicContact CE2-CB 4.18Å; Y14-F49 AromaticContact CE2-CD1 3.73Å; Y14-F49 HydrophobicContact CE2-CD1 3.73Å; Y14-F49 HydrophobicContact CE2-CG 4.21Å; Y14-F49 AromaticContact CZ-CD1 3.68Å; Y14-F49 WeakPolarHBondContact OH-CD1 3.4Å; Y14-F49 WeakPolarHBondContact OH-CE1 3.49Å; V15-F49 CarbonylContact O-C 3.51Å; V15-F49 WeakPolarHBondContact O-CA 3.24Å; A43-F49 WeakPolarHBondContact CA-O 3.12Å; A43-F49 HydrophobicContact CB-CB 3.94Å; A43-F49 WeakPolarHBondContact CB-O 3.32Å; A43-F49 PolarHBondContact N-O 2.9Å; P46-F49 HydrophobicContact CB-CD2 4.36Å; P46-F49 HydrophobicContact CB-CE2 3.88Å; P46-F49 HydrophobicContact CG-CD2 4.45Å; P46-F49 HydrophobicContact CG-CE2 3.97Å
50	A	86.1	Confident	79.8	Confident	0 Å²	0	65.8 Å²	65.8	0%	0	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.8	163.6	169.3	0	0	0	0	0	111.1	V15 L18 L27 W41 I42	V15-A50 HydrophobicContact CB-CB 4.31Å; V15-A50 PolarHBondContact N-O 3.2Å; V15-A50 PolarHBondContact O-N 2.91Å; L18-A50 HydrophobicContact CD1-CB 3.54Å; L27-A50 HydrophobicContact CD1-CB 3.56Å; W41-A50 CarbonylContact O-C 3.57Å; W41-A50 VanDerWaalsContact O-CA 3.31Å; W41-A50 WeakPolarHBondContact O-CA 3.45Å; W41-A50 WeakPolarHBondContact O-CB 3.2Å; I42-A50 HydrophobicContact CG1-CB 4.08Å
51	F	86.8	Confident	79.8	Confident	64 Å²	64	70.3 Å²	70.3	28%	0.281	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.9	130.4	170.4	-69.8	-60.5	0	0	0	109.1	K12 V13 Y14 W41	K12-F51 VanDerWaalsContact NZ-CG 3.28Å; V13-F51 WeakPolarHBondContact O-CA 3.41Å; Y14-F51 AromaticContact CD2-CD1 3.95Å; Y14-F51 HydrophobicContact CD2-CD1 3.95Å; Y14-F51 AromaticContact CD2-CE1 3.39Å; Y14-F51 HydrophobicContact CD2-CE1 3.39Å; Y14-F51 AromaticContact CD2-CZ 3.95Å; Y14-F51 HydrophobicContact CD2-CZ 3.95Å; Y14-F51 HydrophobicContact CE2-CE1 4.33Å; Y14-F51 HydrophobicContact CE2-CZ 4.49Å; Y14-F51 HydrophobicContact CG-CD1 4.48Å; Y14-F51 AromaticContact CG-CE1 4Å; Y14-F51 HydrophobicContact CG-CE1 4Å; W41-F51 HydrophobicContact CE3-CB 4.42Å; W41-F51 AromaticContact CE3-CD2 3.58Å; W41-F51 HydrophobicContact CE3-CD2 3.58Å; W41-F51 HydrophobicContact CE3-CE2 4.37Å; W41-F51 HydrophobicContact CE3-CG 4.45Å; W41-F51 AromaticContact CZ3-CD2 3.61Å; W41-F51 HydrophobicContact CZ3-CD2 3.61Å; W41-F51 AromaticContact CZ3-CE2 3.94Å; W41-F51 HydrophobicContact CZ3-CE2 3.94Å; W41-F51 PolarHBondContact N-O 3.5Å; W41-F51 PolarHBondContact O-N 2.86Å
52	V	87.3	Confident	79.8	Confident	1 Å²	1	67.9 Å²	67.9	1%	0.006	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.3	135.3	174.6	177.4	0	0	0	0	107.6	K12 V13 V15 F31 L37 V40 F54	K12-V52 CarbonylContact C-O 3.51Å; K12-V52 WeakPolarHBondContact CA-O 3.41Å; V13-V52 HydrophobicContact CB-CB 4.42Å; V13-V52 PolarHBondContact N-O 3.29Å; V13-V52 PolarHBondContact O-N 3.37Å; V15-V52 HydrophobicContact CG2-CG2 4.09Å; F31-V52 HydrophobicContact CB-CG1 4.48Å; F31-V52 HydrophobicContact CD1-CG2 4.39Å; F31-V52 HydrophobicContact CD2-CG2 4.46Å; F31-V52 HydrophobicContact CG-CG2 4.3Å; L37-V52 HydrophobicContact CD2-CG1 3.69Å; V40-V52 HydrophobicContact CG1-CG2 4.47Å; V40-V52 HydrophobicContact CG2-CG2 4.46Å; V52-F54 HydrophobicContact CG1-CD2 3.88Å; V52-F54 HydrophobicContact CG1-CE2 3.68Å; V52-F54 HydrophobicContact CG1-CZ 4.3Å
53	E	86.3	Confident	79.9	Confident	54 Å²	54	65.2 Å²	65.2	25%	0.252	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.5	118.3	170.1	-167.9	175.2	158.3	0	0	107.2	R38 T39	R38-E53 WeakPolarHBondContact CA-O 3.44Å; R38-E53 WeakPolarHBondContact CB-O 3.43Å; R38-E53 IonicContact CZ-OE1 3.09Å; R38-E53 PolarHBondContact N-O 3.4Å; R38-E53 IonicContact NE-OE1 3.88Å; R38-E53 IonicContact NH1-OE1 2.64Å; R38-E53 PolarHBondContact NH1-OE1 3.02Å; R38-E53 IonicContact NH2-OE1 3.35Å; R38-E53 PolarHBondContact NH2-OE1 3.32Å; T39-E53 HydrophobicContact CG2-CB 3.61Å; T39-E53 HydrophobicContact CG2-CG 4.39Å; T39-E53 WeakPolarHBondContact CG2-OE2 3.41Å; T39-E53 PolarHBondContact N-O 3.04Å; T39-E53 VanDerWaalsContact N-O 3.11Å; T39-E53 PolarHBondContact O-N 3.26Å
54	F	86.3	Confident	80.4	Confident	0 Å²	0	65.7 Å²	65.7	0%	0	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.1	170.6	175.2	-78.6	-91.5	0	0	0	111.2	S11 V13 F31 L37 V52 D56 D59 A60 A63	S11-F54 WeakPolarHBondContact CB-O 3.24Å; S11-F54 PolarHBondContact O-N 3Å; V13-F54 HydrophobicContact CG2-CD2 3.95Å; V13-F54 HydrophobicContact CG2-CE2 3.82Å; F31-F54 HydrophobicContact CB-CZ 3.88Å; F31-F54 AromaticContact CD1-CE2 3.95Å; F31-F54 HydrophobicContact CD1-CE2 3.95Å; F31-F54 AromaticContact CD1-CZ 3.85Å; F31-F54 HydrophobicContact CD1-CZ 3.85Å; F31-F54 HydrophobicContact CG-CZ 4.38Å; L37-F54 HydrophobicContact CD2-CD1 3.82Å; L37-F54 HydrophobicContact CD2-CE1 3.46Å; L37-F54 VanDerWaalsContact CD2-CE1 3.46Å; L37-F54 HydrophobicContact CD2-CE2 4.32Å; L37-F54 HydrophobicContact CD2-CG 4.4Å; L37-F54 HydrophobicContact CD2-CZ 3.76Å; V52-F54 HydrophobicContact CG1-CD2 3.88Å; V52-F54 HydrophobicContact CG1-CE2 3.68Å; V52-F54 HydrophobicContact CG1-CZ 4.3Å; F54-D56 VanDerWaalsContact CB-O 3.3Å; F54-D56 WeakPolarHBondContact CB-O 3.45Å; F54-D59 HydrophobicContact CD1-CB 3.9Å; F54-D59 HydrophobicContact CE1-CB 4.27Å; F54-A60 HydrophobicContact CB-CB 4.26Å; F54-A60 HydrophobicContact CD2-CB 3.68Å; F54-A60 HydrophobicContact CE2-CB 4.29Å; F54-A60 HydrophobicContact CG-CB 4.14Å; F54-A63 HydrophobicContact CE1-CB 4.5Å; F54-A63 HydrophobicContact CE2-CB 3.97Å; F54-A63 HydrophobicContact CZ-CB 3.58Å
55	E	84.6	Confident	81.2	Confident	117 Å²	117	64.2 Å²	64.2	55%	0.547	32%	0.319	S	S	.	.	S	Bend	trans	-80.1	-50.3	168.9	-163.4	164.9	179.8	0	0	112.6	P36	P36-E55 HydrophobicContact CG-CB 4.02Å; P36-E55 PolarHBondContact O-N 3.24Å; P36-E55 VanDerWaalsContact O-N 3.15Å
56	D	83.3	Confident	82.6	Confident	48 Å²	48	58.8 Å²	58.8	26%	0.257	30%	0.298	S	S	.	.	S	Bend	trans	-96.6	155	171.5	-155.1	-67.1	0	0	0	111.5	F54 R58	F54-D56 VanDerWaalsContact CB-O 3.3Å; F54-D56 WeakPolarHBondContact CB-O 3.45Å; D56-R58 WeakPolarHBondContact OD1-CB 3.13Å; D56-R58 IonicContact OD1-CZ 2.67Å; D56-R58 PolarHBondContact OD1-N 2.67Å; D56-R58 IonicContact OD1-NE 3.03Å; D56-R58 PolarHBondContact OD1-NE 2.88Å; D56-R58 IonicContact OD1-NH2 2.69Å; D56-R58 IonicContact OD2-CZ 2.69Å; D56-R58 IonicContact OD2-NE 3.25Å; D56-R58 PolarHBondContact OD2-NE 3.4Å; D56-R58 IonicContact OD2-NH2 2.61Å; D56-R58 PolarHBondContact OD2-NH2 3.03Å
57	S	81.4	Confident	83.4	Confident	20 Å²	20	55.2 Å²	55.2	14%	0.14	28%	0.275	C	S	.	.	H	α-helix	trans	-84	-21.2	175.4	57.9	0	0	0	0	112.7	S11 A60 E61	S11-S57 PolarHBondContact OG-N 2.69Å; S57-A60 WeakPolarHBondContact O-CB 3.05Å; S57-A60 PolarHBondContact O-N 2.94Å; S57-E61 PolarHBondContact O-N 2.95Å
58	R	85.1	Confident	84.4	Confident	162 Å²	162	54.5 Å²	54.5	61%	0.611	27%	0.265	S	S	*	.	H	α-helix	trans	-68.5	-47.8	176.2	-70.9	168.4	-76	177.6	-0.3	111.2	D56 A60 E61 D62	D56-R58 WeakPolarHBondContact OD1-CB 3.13Å; D56-R58 IonicContact OD1-CZ 2.67Å; D56-R58 PolarHBondContact OD1-N 2.67Å; D56-R58 IonicContact OD1-NE 3.03Å; D56-R58 PolarHBondContact OD1-NE 2.88Å; D56-R58 IonicContact OD1-NH2 2.69Å; D56-R58 IonicContact OD2-CZ 2.69Å; D56-R58 IonicContact OD2-NE 3.25Å; D56-R58 PolarHBondContact OD2-NE 3.4Å; D56-R58 IonicContact OD2-NH2 2.61Å; D56-R58 PolarHBondContact OD2-NH2 3.03Å; R58-A60 PolarHBondContact O-N 2.8Å; R58-E61 PolarHBondContact O-N 2.88Å; R58-D62 PolarHBondContact O-N 3.01Å
59	D	85.9	Confident	84.7	Confident	40 Å²	40	55.5 Å²	55.5	21%	0.214	28%	0.276	C	S	.	.	H	α-helix	trans	-55.1	-37.1	173.4	-49	4.5	0	0	0	111.2	F54 A63	F54-D59 HydrophobicContact CD1-CB 3.9Å; F54-D59 HydrophobicContact CE1-CB 4.27Å; D59-A63 WeakPolarHBondContact O-CB 3.38Å; D59-A63 PolarHBondContact O-N 3.21Å
60	A	85.3	Confident	84.5	Confident	3 Å²	3	57.2 Å²	57.2	3%	0.025	28%	0.283	C	S	.	.	H	α-helix	trans	-68.6	-41.2	174.9	0	0	0	0	0	113	V13 F54 S57 R58 V64	V13-A60 HydrophobicContact CG2-CB 3.65Å; F54-A60 HydrophobicContact CB-CB 4.26Å; F54-A60 HydrophobicContact CD2-CB 3.68Å; F54-A60 HydrophobicContact CE2-CB 4.29Å; F54-A60 HydrophobicContact CG-CB 4.14Å; S57-A60 WeakPolarHBondContact O-CB 3.05Å; S57-A60 PolarHBondContact O-N 2.94Å; R58-A60 PolarHBondContact O-N 2.8Å; A60-V64 WeakPolarHBondContact O-CB 3.42Å; A60-V64 VanDerWaalsContact O-CG2 3.24Å; A60-V64 WeakPolarHBondContact O-CG2 3.5Å; A60-V64 PolarHBondContact O-N 3.39Å
61	E	84.6	Confident	83.9	Confident	113 Å²	113	61.5 Å²	61.5	53%	0.528	31%	0.309	S	S	.	.	H	α-helix	trans	-66.7	-42.1	174.9	-74.7	178	-151.6	0	0	112.2	S57 R58 V64 R65	S57-E61 PolarHBondContact O-N 2.95Å; R58-E61 PolarHBondContact O-N 2.88Å; E61-V64 WeakPolarHBondContact O-CB 3.07Å; E61-V64 PolarHBondContact O-N 3Å; E61-R65 WeakPolarHBondContact O-CB 3.42Å; E61-R65 WeakPolarHBondContact O-CD 3.31Å; E61-R65 WeakPolarHBondContact O-CG 3.31Å; E61-R65 PolarHBondContact O-N 2.78Å
62	D	85.9	Confident	83	Confident	93 Å²	93	59.1 Å²	59.1	50%	0.497	30%	0.299	S	S	.	.	H	α-helix	trans	-71.3	-36.2	176.7	-78.4	-39.2	0	0	0	112.2	R58 R65 G66	R58-D62 PolarHBondContact O-N 3.01Å; D62-R65 PolarHBondContact O-N 2.91Å; D62-G66 PolarHBondContact O-N 3.4Å
63	A	85.8	Confident	81.7	Confident	0 Å²	0	62.6 Å²	62.6	0%	0	32%	0.322	C	S	.	.	H	α-helix	trans	-63.4	-41.4	170.6	0	0	0	0	0	112.2	F31 Y34 F54 D59 G66 L67	F31-A63 HydrophobicContact CD1-CB 4.06Å; F31-A63 HydrophobicContact CE1-CB 4.45Å; Y34-A63 HydrophobicContact CD1-CB 4.28Å; Y34-A63 HydrophobicContact CD2-CB 4.23Å; Y34-A63 HydrophobicContact CG-CB 3.87Å; F54-A63 HydrophobicContact CE1-CB 4.5Å; F54-A63 HydrophobicContact CE2-CB 3.97Å; F54-A63 HydrophobicContact CZ-CB 3.58Å; D59-A63 WeakPolarHBondContact O-CB 3.38Å; D59-A63 PolarHBondContact O-N 3.21Å; A63-G66 PolarHBondContact O-N 2.81Å; A63-L67 HydrophobicContact CB-CD1 4.42Å; A63-L67 WeakPolarHBondContact O-CB 3.4Å; A63-L67 WeakPolarHBondContact O-CG 3.42Å; A63-L67 PolarHBondContact O-N 3.45Å
64	V	86.8	Confident	80.8	Confident	21 Å²	21	63.4 Å²	63.4	13%	0.127	35%	0.345	C	S	.	.	H	α-helix	trans	-55.9	-54.3	170.7	160.3	0	0	0	0	110.2	V13 A60 E61 G66 L67 D68 V79 P81	V13-V64 HydrophobicContact CG1-CG2 3.87Å; V13-V64 HydrophobicContact CG2-CG2 4.08Å; A60-V64 WeakPolarHBondContact O-CB 3.42Å; A60-V64 VanDerWaalsContact O-CG2 3.24Å; A60-V64 WeakPolarHBondContact O-CG2 3.5Å; A60-V64 PolarHBondContact O-N 3.39Å; E61-V64 WeakPolarHBondContact O-CB 3.07Å; E61-V64 PolarHBondContact O-N 3Å; V64-G66 VanDerWaalsContact C-N 3.29Å; V64-G66 PolarHBondContact O-N 2.61Å; V64-L67 PolarHBondContact O-N 2.92Å; V64-D68 WeakPolarHBondContact O-CB 3.26Å; V64-D68 PolarHBondContact O-N 2.78Å; V64-V79 HydrophobicContact CB-CG1 4.39Å; V64-V79 HydrophobicContact CG2-CG1 3.95Å; V64-P81 HydrophobicContact CG2-CB 4.35Å
65	R	85.9	Confident	80.1	Confident	199 Å²	199	65 Å²	65	75%	0.751	36%	0.356	S	S	*	.	H	α-helix	trans	-65.4	-29.7	-175.8	-69	164.1	63.2	83	7.1	113.4	E61 D62	E61-R65 WeakPolarHBondContact O-CB 3.42Å; E61-R65 WeakPolarHBondContact O-CD 3.31Å; E61-R65 WeakPolarHBondContact O-CG 3.31Å; E61-R65 PolarHBondContact O-N 2.78Å; D62-R65 PolarHBondContact O-N 2.91Å
66	G	83.6	Confident	79.9	Confident	35 Å²	35	68 Å²	68	36%	0.361	36%	0.363	S	S	.	.	H	α-helix	trans	-94.6	-15.5	-178.1	0	0	0	0	0	115.8	Y34 D62 A63 V64	Y34-G66 PolarHBondContact OH-O 3.45Å; D62-G66 PolarHBondContact O-N 3.4Å; A63-G66 PolarHBondContact O-N 2.81Å; V64-G66 VanDerWaalsContact C-N 3.29Å; V64-G66 PolarHBondContact O-N 2.61Å
67	L	82.3	Confident	79.9	Confident	0 Å²	0	65.9 Å²	65.9	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-118.2	-14.8	-177	-60.9	173.3	0	0	0	114.2	F31 Y34 A63 V64 K70 V79	F31-L67 HydrophobicContact CD1-CD1 3.59Å; F31-L67 HydrophobicContact CD2-CD1 3.89Å; F31-L67 HydrophobicContact CE1-CD1 3.5Å; F31-L67 HydrophobicContact CE2-CD1 3.8Å; F31-L67 HydrophobicContact CG-CD1 3.78Å; F31-L67 HydrophobicContact CZ-CB 4.46Å; F31-L67 HydrophobicContact CZ-CD1 3.6Å; Y34-L67 HydrophobicContact CD2-CD1 4.06Å; Y34-L67 HydrophobicContact CD2-CG 4.45Å; Y34-L67 HydrophobicContact CE2-CD1 3.71Å; Y34-L67 HydrophobicContact CE2-CD2 3.77Å; Y34-L67 HydrophobicContact CE2-CG 3.67Å; A63-L67 HydrophobicContact CB-CD1 4.42Å; A63-L67 WeakPolarHBondContact O-CB 3.4Å; A63-L67 WeakPolarHBondContact O-CG 3.42Å; A63-L67 PolarHBondContact O-N 3.45Å; V64-L67 PolarHBondContact O-N 2.92Å; L67-K70 HydrophobicContact CD2-CD 3.55Å; L67-K70 WeakPolarHBondContact O-CB 3.3Å; L67-K70 PolarHBondContact O-N 2.81Å; L67-V79 HydrophobicContact CB-CG2 3.87Å; L67-V79 WeakPolarHBondContact O-CG2 3.45Å
68	D	85.4	Confident	80.1	Confident	91 Å²	91	71.8 Å²	71.8	49%	0.487	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.7	137.3	171.9	-170.9	-127.2	0	0	0	111.6	V64 K70 R78 V79	V64-D68 WeakPolarHBondContact O-CB 3.26Å; V64-D68 PolarHBondContact O-N 2.78Å; D68-K70 PolarHBondContact O-N 2.8Å; D68-K70 VanDerWaalsContact O-N 3.13Å; D68-R78 VanDerWaalsContact OD2-CA 3.25Å; D68-R78 WeakPolarHBondContact OD2-CA 3.38Å; D68-V79 HydrophobicContact CB-CB 4.09Å; D68-V79 PolarHBondContact OD2-N 3.07Å
69	G	78.2	Confident	80.2	Confident	41 Å²	41	64.3 Å²	64.3	42%	0.423	34%	0.343	S	S	.	.	T	Hydrogen-bonded Turn	trans	72	-8.6	-174.4	0	0	0	0	0	115.6	V77	G69-V77 WeakPolarHBondContact CA-O 3.42Å; G69-V77 PolarHBondContact N-O 2.95Å
70	K	78.1	Confident	80.1	Confident	100 Å²	100	66.1 Å²	66.1	44%	0.435	35%	0.35	S	S	.	.			trans	-66	136.1	-177.2	-168.1	174.4	-176.7	176.2	0	111.1	L67 D68 I72 V77	L67-K70 HydrophobicContact CD2-CD 3.55Å; L67-K70 WeakPolarHBondContact O-CB 3.3Å; L67-K70 PolarHBondContact O-N 2.81Å; D68-K70 PolarHBondContact O-N 2.8Å; D68-K70 VanDerWaalsContact O-N 3.13Å; K70-I72 HydrophobicContact CG-CG1 4.38Å; K70-I72 PolarHBondContact O-N 2.99Å; K70-V77 PolarHBondContact O-N 2.89Å
71	V	73.7	Confident	79.8	Confident	90 Å²	90	68.4 Å²	68.4	55%	0.545	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-79.4	113.6	174.9	-178.3	0	0	0	0	109.1	S75 R76	V71-S75 CarbonylContact C-O 3.59Å; V71-S75 WeakPolarHBondContact CA-O 3.41Å; V71-R76 HydrophobicContact CG2-CG 3.83Å
72	I	67.4	Low	78.9	Confident	13 Å²	13	63.9 Å²	63.9	7%	0.067	35%	0.345	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-121.4	129.9	174	-52.1	-174.9	0	0	0	107.6	E26 A30 K70 G74 S75 V77	E26-I72 HydrophobicContact CG-CG2 3.85Å; A30-I72 HydrophobicContact CB-CD1 4.4Å; K70-I72 HydrophobicContact CG-CG1 4.38Å; K70-I72 PolarHBondContact O-N 2.99Å; I72-G74 PolarHBondContact O-N 3.39Å; I72-G74 VanDerWaalsContact O-N 3.13Å; I72-S75 PolarHBondContact N-O 3.13Å; I72-S75 PolarHBondContact O-N 2.69Å; I72-S75 VanDerWaalsContact O-O 3.13Å; I72-V77 HydrophobicContact CB-CG2 3.7Å; I72-V77 HydrophobicContact CD1-CG2 3.98Å; I72-V77 HydrophobicContact CG1-CG2 3.8Å
73	C	59.5	Low	77.6	Confident	74 Å²	74	66.3 Å²	66.3	50%	0.5	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	48.9	38.3	-176.5	-56.7	0	0	0	0	113.9	S75	C73-S75 VanDerWaalsContact C-N 3.3Å; C73-S75 PolarHBondContact O-N 3.24Å
74	G	67.9	Low	76	Confident	71 Å²	71	67.8 Å²	67.8	73%	0.732	37%	0.373	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.6	-2.4	179.6	0	0	0	0	0	116	I72	I72-G74 PolarHBondContact O-N 3.39Å; I72-G74 VanDerWaalsContact O-N 3.13Å
75	S	72.4	Confident	74.1	Confident	33 Å²	33	74 Å²	74	23%	0.231	40%	0.403	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.8	138.5	177.2	-59.2	0	0	0	0	111.1	N17 G19 V71 I72 C73 V77	N17-S75 WeakPolarHBondContact O-CB 3.46Å; G19-S75 VanDerWaalsContact CA-OG 3.27Å; G19-S75 WeakPolarHBondContact CA-OG 3.35Å; V71-S75 CarbonylContact C-O 3.59Å; V71-S75 WeakPolarHBondContact CA-O 3.41Å; I72-S75 PolarHBondContact N-O 3.13Å; I72-S75 PolarHBondContact O-N 2.69Å; I72-S75 VanDerWaalsContact O-O 3.13Å; C73-S75 VanDerWaalsContact C-N 3.3Å; C73-S75 PolarHBondContact O-N 3.24Å; S75-V77 PolarHBondContact O-N 2.79Å
76	R	78.8	Confident	72.4	Confident	182 Å²	182	69.4 Å²	69.4	69%	0.687	40%	0.399	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-71.5	107.5	170.3	-76.2	-175.8	-178.9	173.4	0.8	109.3	N17 V71	N17-R76 WeakPolarHBondContact CB-O 3.48Å; N17-R76 PolarHBondContact ND2-O 2.67Å; V71-R76 HydrophobicContact CG2-CG 3.83Å
77	V	84.5	Confident	70.8	Confident	2 Å²	2	79.2 Å²	79.2	1%	0.012	43%	0.425	C	S	.	.			trans	-73.6	136.4	177.6	-177	0	0	0	0	109.3	V15 L18 G69 K70 I72 S75 V79	V15-V77 HydrophobicContact CG1-CG1 3.36Å; L18-V77 HydrophobicContact CD2-CG1 4.04Å; L18-V77 HydrophobicContact CD2-CG2 3.85Å; G69-V77 WeakPolarHBondContact CA-O 3.42Å; G69-V77 PolarHBondContact N-O 2.95Å; K70-V77 PolarHBondContact O-N 2.89Å; I72-V77 HydrophobicContact CB-CG2 3.7Å; I72-V77 HydrophobicContact CD1-CG2 3.98Å; I72-V77 HydrophobicContact CG1-CG2 3.8Å; S75-V77 PolarHBondContact O-N 2.79Å; V77-V79 HydrophobicContact CG1-CG2 3.76Å
78	R	84.4	Confident	69.2	Low	144 Å²	144	88 Å²	88	54%	0.543	46%	0.458	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.7	127.4	167.4	173.7	172.9	165.6	167.3	-3.3	108.6	G16 D68 E80	G16-R78 PolarHBondContact N-O 3.15Å; G16-R78 PolarHBondContact O-N 2.83Å; D68-R78 VanDerWaalsContact OD2-CA 3.25Å; D68-R78 WeakPolarHBondContact OD2-CA 3.38Å; R78-E80 IonicContact CZ-OE2 2.67Å; R78-E80 VanDerWaalsContact CZ-OE2 3.25Å; R78-E80 IonicContact NE-OE2 3.13Å; R78-E80 PolarHBondContact NE-OE2 2.79Å; R78-E80 IonicContact NH2-OE2 3.32Å; R78-E80 PolarHBondContact NH2-OE2 2.89Å
79	V	87.6	Confident	67.4	Low	5 Å²	5	86.3 Å²	86.3	3%	0.03	45%	0.453	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	120.5	-178.4	-168.3	0	0	0	0	108.7	V13 Y14 V15 F31 V64 L67 D68 V77	V13-V79 HydrophobicContact CG1-CG1 3.3Å; Y14-V79 WeakPolarHBondContact O-CA 3.4Å; V15-V79 HydrophobicContact CG1-CG2 4.42Å; F31-V79 HydrophobicContact CE1-CG1 3.95Å; F31-V79 HydrophobicContact CZ-CG1 4.14Å; F31-V79 HydrophobicContact CZ-CG2 4.2Å; V64-V79 HydrophobicContact CB-CG1 4.39Å; V64-V79 HydrophobicContact CG2-CG1 3.95Å; L67-V79 HydrophobicContact CB-CG2 3.87Å; L67-V79 WeakPolarHBondContact O-CG2 3.45Å; D68-V79 HydrophobicContact CB-CB 4.09Å; D68-V79 PolarHBondContact OD2-N 3.07Å; V77-V79 HydrophobicContact CG1-CG2 3.76Å
80	E	84.5	Confident	66.2	Low	78 Å²	78	96.2 Å²	96.2	36%	0.364	48%	0.478	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.2	138	-173	-161	171.9	139	0	0	109.1	Y14 R78 S82	Y14-E80 HydrophobicContact CD1-CB 3.98Å; Y14-E80 PolarHBondContact N-O 2.76Å; Y14-E80 PolarHBondContact O-N 3.11Å; R78-E80 IonicContact CZ-OE2 2.67Å; R78-E80 VanDerWaalsContact CZ-OE2 3.25Å; R78-E80 IonicContact NE-OE2 3.13Å; R78-E80 PolarHBondContact NE-OE2 2.79Å; R78-E80 IonicContact NH2-OE2 3.32Å; R78-E80 PolarHBondContact NH2-OE2 2.89Å; E80-S82 PolarHBondContact O-N 2.86Å; E80-S82 VanDerWaalsContact O-N 3.07Å
81	P	79.6	Confident	65	Low	52 Å²	52	101.8 Å²	101.8	34%	0.338	50%	0.498	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.2	119.6	172.6	27.4	-31.1	0	0	0	107	V64 N83	V64-P81 HydrophobicContact CG2-CB 4.35Å; P81-N83 PolarHBondContact O-N 2.79Å
82	S	65.4	Low	63.9	Low	17 Å²	17	103.3 Å²	103.3	12%	0.119	50%	0.499	C	S	.	.			trans	-68.1	88.6	169.2	-72.5	0	0	0	0	106.4	K12 Y14 E80 G84	K12-S82 PolarHBondContact NZ-OG 3.2Å; K12-S82 VanDerWaalsContact NZ-OG 3.13Å; K12-S82 WeakPolarHBondContact O-CA 3.34Å; K12-S82 VanDerWaalsContact O-CB 3.26Å; K12-S82 WeakPolarHBondContact O-CB 3.35Å; K12-S82 PolarHBondContact O-N 2.66Å; Y14-S82 WeakPolarHBondContact CB-OG 3.16Å; Y14-S82 PolarHBondContact N-OG 3.35Å; E80-S82 PolarHBondContact O-N 2.86Å; E80-S82 VanDerWaalsContact O-N 3.07Å; S82-G84 PolarHBondContact O-N 2.94Å
83	N	58.4	Low	63.3	Low	145 Å²	145	113.2 Å²	113.2	78%	0.775	54%	0.535	S	S	*	.			trans	-59.6	83.7	164.3	-87.3	-70.8	0	0	0	107.6	P81 M85	P81-N83 PolarHBondContact O-N 2.79Å; N83-M85 VanDerWaalsContact C-N 3.27Å; N83-M85 PolarHBondContact O-N 2.64Å
84	G	50.6	Low	63.3	Low	30 Å²	30	114.3 Å²	114.3	31%	0.309	54%	0.541	S	S	.	.			trans	-73.6	85.8	-168.6	0	0	0	0	0	108.5	G9 S82 P86	G9-G84 PolarHBondContact O-N 2.98Å; S82-G84 PolarHBondContact O-N 2.94Å; G84-P86 WeakPolarHBondContact O-CA 3.12Å
85	M	48.4	Very low	62.7	Low	152 Å²	152	115.2 Å²	115.2	75%	0.749	54%	0.535	S	S	*	.			trans	-25.9	100.8	173.1	175.4	67	128.7	0	0	108.4	N83 R87	N83-M85 VanDerWaalsContact C-N 3.27Å; N83-M85 PolarHBondContact O-N 2.64Å; M85-R87 WeakPolarHBondContact O-CA 3.45Å; M85-R87 PolarHBondContact O-N 2.83Å
86	P	49.9	Very low	62	Low	102 Å²	102	119.6 Å²	119.6	66%	0.662	56%	0.562	S	S	*	*			trans	-56.2	115.1	-152.5	18.1	-32.5	0	0	0	106.9	G84 R88	G84-P86 WeakPolarHBondContact O-CA 3.12Å; P86-R88 VanDerWaalsContact C-N 3.28Å; P86-R88 WeakPolarHBondContact O-CA 3.45Å; P86-R88 PolarHBondContact O-N 3.33Å
87	R	50.3	Low	61	Low	242 Å²	242	120 Å²	120	91%	0.913	56%	0.564	S	S	*	*			trans	-48.9	95	-158.6	-82.3	-164.7	-176.9	-161.6	4.8	109	M85 S89	M85-R87 WeakPolarHBondContact O-CA 3.45Å; M85-R87 PolarHBondContact O-N 2.83Å; R87-S89 PolarHBondContact O-N 3.43Å
88	R	47.9	Very low	59.9	Low	184 Å²	184	129.7 Å²	129.7	69%	0.694	60%	0.6	S	S	*	*			trans	-57.2	108.9	-174.5	-87.4	-164.3	-179.3	-169.5	4.2	105.1	P86 R90	P86-R88 VanDerWaalsContact C-N 3.28Å; P86-R88 WeakPolarHBondContact O-CA 3.45Å; P86-R88 PolarHBondContact O-N 3.33Å; R88-R90 PolarHBondContact O-N 2.64Å
89	S	48	Very low	58.8	Low	55 Å²	55	128.2 Å²	128.2	39%	0.385	61%	0.609	S	S	.	*			trans	-58.4	144.2	-174.3	60.4	0	0	0	0	106.2	R87 Y91 E92	R87-S89 PolarHBondContact O-N 3.43Å; S89-Y91 PolarHBondContact O-N 2.78Å; S89-E92 VanDerWaalsContact CB-OE2 3.28Å; S89-E92 WeakPolarHBondContact CB-OE2 3.32Å; S89-E92 PolarHBondContact N-OE2 2.77Å; S89-E92 PolarHBondContact O-N 3.42Å; S89-E92 VanDerWaalsContact OG-CG 3.32Å; S89-E92 WeakPolarHBondContact OG-CG 3.28Å; S89-E92 PolarHBondContact OG-N 2.65Å; S89-E92 VanDerWaalsContact OG-N 3.09Å; S89-E92 PolarHBondContact OG-OE2 3.09Å
90	R	53	Low	57.1	Low	249 Å²	249	131.1 Å²	131.1	94%	0.94	62%	0.621	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.7	1.7	178.7	-164.2	168.9	-78.8	-156.2	-3.7	112.5	R88	R88-R90 PolarHBondContact O-N 2.64Å
91	Y	52.5	Low	56	Low	218 Å²	218	131.9 Å²	131.9	86%	0.855	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-117.1	-1.2	176.2	-75.7	-88.8	0	0	0	114.4	S89 R93	S89-Y91 PolarHBondContact O-N 2.78Å; Y91-R93 PolarHBondContact O-N 2.88Å
92	E	51.8	Low	55.3	Low	121 Å²	121	134 Å²	134	57%	0.565	64%	0.642	S	S	*	*			trans	-71.5	85.1	165.9	-95.9	157.6	109	0	0	109.2	S89	S89-E92 VanDerWaalsContact CB-OE2 3.28Å; S89-E92 WeakPolarHBondContact CB-OE2 3.32Å; S89-E92 PolarHBondContact N-OE2 2.77Å; S89-E92 PolarHBondContact O-N 3.42Å; S89-E92 VanDerWaalsContact OG-CG 3.32Å; S89-E92 WeakPolarHBondContact OG-CG 3.28Å; S89-E92 PolarHBondContact OG-N 2.65Å; S89-E92 VanDerWaalsContact OG-N 3.09Å; S89-E92 PolarHBondContact OG-OE2 3.09Å
93	R	54.8	Low	55.1	Low	221 Å²	221	138.7 Å²	138.7	83%	0.834	67%	0.666	S	S	*	*			trans	-28.9	129.2	162.9	-177	-178.1	-174.8	177.4	1.3	109.8	Y91	Y91-R93 PolarHBondContact O-N 2.88Å
94	P	58.3	Low	55.8	Low	97 Å²	97	133.8 Å²	133.8	63%	0.63	64%	0.64	S	S	*	*	P	Polyproline II helix	trans	-52.4	147.6	177.9	23.5	-34.2	0	0	0	109.7
95	P	55.9	Low	56.9	Low	91 Å²	91	138.2 Å²	138.2	59%	0.591	65%	0.65	S	S	*	*	P	Polyproline II helix	trans	-49.4	138.5	-175.4	21.7	-34	0	0	0	109.3	R97	P95-R97 PolarHBondContact O-N 2.79Å
96	P	56.6	Low	58.1	Low	125 Å²	125	131 Å²	131	81%	0.812	62%	0.615	S	S	*	*	P	Polyproline II helix	trans	-51.3	117.7	-177.4	22.2	-32.7	0	0	0	107.6	R98	P96-R98 PolarHBondContact O-N 2.82Å
97	R	58.2	Low	59	Low	191 Å²	191	135.7 Å²	135.7	72%	0.721	62%	0.621	S	S	*	*	P	Polyproline II helix	trans	-51.2	139.2	-173.5	-71.5	-175.4	177.2	176.3	-1	107.9	P95	P95-R97 PolarHBondContact O-N 2.79Å
98	R	61.9	Low	59.5	Low	204 Å²	204	129.7 Å²	129.7	77%	0.77	60%	0.603	S	S	*	*	P	Polyproline II helix	trans	-47.6	141.7	175.1	-74.8	-174.1	173.1	-169.3	-1.7	108.7	P96 F100	P96-R98 PolarHBondContact O-N 2.82Å; R98-F100 PolarHBondContact O-N 3.38Å
99	P	60.9	Low	60.3	Low	114 Å²	114	122 Å²	122	74%	0.74	58%	0.577	S	S	*	*	P	Polyproline II helix	trans	-47.9	141	168.3	-25.7	35.1	0	0	0	109.6	D101	P99-D101 PolarHBondContact O-N 2.93Å
100	F	51.8	Low	61.3	Low	65 Å²	65	121.7 Å²	121.7	29%	0.285	58%	0.583	S	S	.	*			trans	-59.4	113.7	-179.3	-171.6	-79.9	0	0	0	109.1	R98 D104 G113 H114 Y115	R98-F100 PolarHBondContact O-N 3.38Å; F100-D104 HydrophobicContact CD1-CB 4.31Å; F100-D104 HydrophobicContact CD2-CB 4.38Å; F100-D104 HydrophobicContact CE1-CB 3.71Å; F100-D104 HydrophobicContact CE2-CB 3.78Å; F100-D104 HydrophobicContact CZ-CB 3.41Å; F100-D104 VanDerWaalsContact CZ-CB 3.41Å; F100-D104 VanDerWaalsContact CZ-O 3.26Å; F100-D104 WeakPolarHBondContact CZ-O 3.46Å; F100-G113 VanDerWaalsContact CE1-CA 3.43Å; F100-G113 VanDerWaalsContact CZ-C 3.5Å; F100-H114 VanDerWaalsContact CZ-N 3.29Å; F100-Y115 AromaticContact CD2-CD1 3.96Å; F100-Y115 HydrophobicContact CD2-CD1 3.96Å; F100-Y115 AromaticContact CD2-CD2 3.89Å; F100-Y115 HydrophobicContact CD2-CD2 3.89Å; F100-Y115 AromaticContact CD2-CE1 3.65Å; F100-Y115 HydrophobicContact CD2-CE1 3.65Å; F100-Y115 AromaticContact CD2-CE2 3.61Å; F100-Y115 HydrophobicContact CD2-CE2 3.61Å; F100-Y115 HydrophobicContact CD2-CG 4.05Å; F100-Y115 AromaticContact CD2-CZ 3.46Å; F100-Y115 VanDerWaalsContact CD2-CZ 3.46Å; F100-Y115 AromaticContact CE2-CD1 3.71Å; F100-Y115 HydrophobicContact CE2-CD1 3.71Å; F100-Y115 HydrophobicContact CE2-CD2 4.3Å; F100-Y115 AromaticContact CE2-CE1 3.72Å; F100-Y115 HydrophobicContact CE2-CE1 3.72Å; F100-Y115 HydrophobicContact CE2-CE2 4.35Å; F100-Y115 AromaticContact CE2-CG 3.99Å; F100-Y115 HydrophobicContact CE2-CG 3.99Å
101	D	61.5	Low	61.9	Low	94 Å²	94	115.7 Å²	115.7	50%	0.503	57%	0.565	S	S	.	*			trans	-72.5	134.9	178	-106.2	-59	0	0	0	108.5	P99 D103 D104	P99-D101 PolarHBondContact O-N 2.93Å; D101-D103 PolarHBondContact O-N 2.6Å; D101-D104 WeakPolarHBondContact O-CB 3.5Å; D101-D104 PolarHBondContact O-N 2.91Å
102	P	64.9	Low	62.5	Low	98 Å²	98	110.4 Å²	110.4	64%	0.636	55%	0.547	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.3	-15.6	-174.9	-27.4	36.1	0	0	0	115.5
103	D	60.7	Low	63.3	Low	115 Å²	115	107.4 Å²	107.4	62%	0.615	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.6	-13.3	175.8	-83	-79.5	0	0	0	115.1	D101 K105 K112	D101-D103 PolarHBondContact O-N 2.6Å; D103-K105 PolarHBondContact O-N 3.31Å; D103-K112 WeakPolarHBondContact OD1-CE 3.37Å; D103-K112 IonicContact OD1-NZ 2.6Å; D103-K112 PolarHBondContact OD1-NZ 2.9Å
104	D	73.8	Confident	64.2	Low	42 Å²	42	98.6 Å²	98.6	23%	0.225	52%	0.516	C	S	.	.			trans	-57.3	127.7	175.4	-90.2	-32.3	0	0	0	110.1	F100 D101 K112 Y115	F100-D104 HydrophobicContact CD1-CB 4.31Å; F100-D104 HydrophobicContact CD2-CB 4.38Å; F100-D104 HydrophobicContact CE1-CB 3.71Å; F100-D104 HydrophobicContact CE2-CB 3.78Å; F100-D104 HydrophobicContact CZ-CB 3.41Å; F100-D104 VanDerWaalsContact CZ-CB 3.41Å; F100-D104 VanDerWaalsContact CZ-O 3.26Å; F100-D104 WeakPolarHBondContact CZ-O 3.46Å; D101-D104 WeakPolarHBondContact O-CB 3.5Å; D101-D104 PolarHBondContact O-N 2.91Å; D104-K112 WeakPolarHBondContact O-CA 3.26Å; D104-Y115 HydrophobicContact CB-CE1 4.44Å; D104-Y115 WeakPolarHBondContact OD2-CE1 3.43Å; D104-Y115 PolarHBondContact OD2-OH 3.12Å
105	K	73.9	Confident	64.6	Low	122 Å²	122	96.7 Å²	96.7	53%	0.53	50%	0.497	S	S	.	.	B	Isolated β-bridge	trans	-108.8	139.5	175.6	-76.8	171.4	-73.5	-174.3	0	109.7	D103 Y107 G110 K112	D103-K105 PolarHBondContact O-N 3.31Å; K105-Y107 PolarHBondContact O-N 3.31Å; K105-Y107 VanDerWaalsContact O-N 3.12Å; K105-G110 WeakPolarHBondContact CG-O 3.43Å; K105-K112 HydrophobicContact CD-CG 4.34Å; K105-K112 HydrophobicContact CG-CG 3.54Å
106	C	73.1	Confident	65	Low	1 Å²	1	93.5 Å²	93.5	1%	0.007	48%	0.478	C	S	.	.			trans	-60.9	113.4	172.3	175.9	0	0	0	0	110.2	E108 C109 G110 Q111 H114 A116	C106-E108 PolarHBondContact O-N 3.06Å; C106-C109 VanDerWaalsContact CB-SG 3.52Å; C106-C109 PolarHBondContact O-N 3.44Å; C106-C109 VanDerWaalsContact O-N 3.13Å; C106-G110 WeakPolarHBondContact O-CA 3.44Å; C106-G110 PolarHBondContact O-N 3.16Å; C106-Q111 WeakPolarHBondContact CB-O 3.41Å; C106-Q111 PolarHBondContact N-O 2.78Å; C106-H114 WeakPolarHBondContact CB-O 3.38Å; C106-A116 VanDerWaalsContact SG-CA 3.59Å
107	Y	69.4	Low	65	Low	200 Å²	200	97.5 Å²	97.5	78%	0.784	48%	0.478	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.7	-18.6	-178	-64	-85.9	0	0	0	114.3	K105	K105-Y107 PolarHBondContact O-N 3.31Å; K105-Y107 VanDerWaalsContact O-N 3.12Å
108	E	61.1	Low	65.2	Low	117 Å²	117	93 Å²	93	55%	0.547	47%	0.469	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	-14.7	179.4	-66.5	176.2	-179.7	0	0	114.2	C106 A116	C106-E108 PolarHBondContact O-N 3.06Å; E108-A116 HydrophobicContact CG-CB 3.88Å
109	C	65.3	Low	65.4	Low	22 Å²	22	83.7 Å²	83.7	15%	0.149	44%	0.435	C	S	.	.	T	Hydrogen-bonded Turn	trans	-140.7	-3.7	-176.7	84.2	0	0	0	0	116.1	C106 Q111 H114 C119	C106-C109 VanDerWaalsContact CB-SG 3.52Å; C106-C109 PolarHBondContact O-N 3.44Å; C106-C109 VanDerWaalsContact O-N 3.13Å; C109-Q111 PolarHBondContact O-N 2.86Å; C109-Q111 VanDerWaalsContact O-N 3.16Å; C109-H114 VanDerWaalsContact SG-CE1 3.6Å; C109-H114 PolarHBondContact SG-NE2 3.05Å; C109-H114 VanDerWaalsContact SG-NE2 3.39Å; C109-C119 VanDerWaalsContact SG-SG 3.68Å
110	G	68.4	Low	65.5	Low	48 Å²	48	85.9 Å²	85.9	50%	0.495	44%	0.435	S	S	.	.			trans	74.9	-11.4	178.2	0	0	0	0	0	116	K105 C106	K105-G110 WeakPolarHBondContact CG-O 3.43Å; C106-G110 WeakPolarHBondContact O-CA 3.44Å; C106-G110 PolarHBondContact O-N 3.16Å
111	Q	65.8	Low	65.6	Low	123 Å²	123	90.8 Å²	90.8	58%	0.575	45%	0.452	S	S	*	.			trans	-77.1	140.6	-177.2	-63.3	-177.4	-25.5	0	0	111.9	C106 C109	C106-Q111 WeakPolarHBondContact CB-O 3.41Å; C106-Q111 PolarHBondContact N-O 2.78Å; C109-Q111 PolarHBondContact O-N 2.86Å; C109-Q111 VanDerWaalsContact O-N 3.16Å
112	K	64.9	Low	65.1	Low	107 Å²	107	94.2 Å²	94.2	47%	0.465	46%	0.459	S	S	.	.	B	Isolated β-bridge	trans	-71.4	160.1	172.1	-74.7	-175.7	166.2	-165.4	0	111.9	D103 D104 K105	D103-K112 WeakPolarHBondContact OD1-CE 3.37Å; D103-K112 IonicContact OD1-NZ 2.6Å; D103-K112 PolarHBondContact OD1-NZ 2.9Å; D104-K112 WeakPolarHBondContact O-CA 3.26Å; K105-K112 HydrophobicContact CD-CG 4.34Å; K105-K112 HydrophobicContact CG-CG 3.54Å
113	G	68.9	Low	64.5	Low	58 Å²	58	91.9 Å²	91.9	60%	0.598	45%	0.452	S	S	*	.	S	Bend	trans	88.6	3.8	168.1	0	0	0	0	0	116.6	F100	F100-G113 VanDerWaalsContact CE1-CA 3.43Å; F100-G113 VanDerWaalsContact CZ-C 3.5Å
114	H	72	Confident	63.8	Low	36 Å²	36	96.9 Å²	96.9	17%	0.167	46%	0.463	C	S	.	.	S	Bend	trans	-149.6	150.9	167.9	63.9	-83.3	0	0	0	112.1	F100 C106 C109 D118 C119	F100-H114 VanDerWaalsContact CZ-N 3.29Å; C106-H114 WeakPolarHBondContact CB-O 3.38Å; C109-H114 VanDerWaalsContact SG-CE1 3.6Å; C109-H114 PolarHBondContact SG-NE2 3.05Å; C109-H114 VanDerWaalsContact SG-NE2 3.39Å; H114-D118 HydrophobicContact CB-CB 4.42Å; H114-C119 PolarHBondContact NE2-SG 3.39Å
115	Y	66.5	Low	62.5	Low	58 Å²	58	107 Å²	107	23%	0.227	50%	0.498	C	S	.	.			trans	-78.7	159.1	169.5	-69.8	-52.2	0	0	0	110.6	F100 D104 Y117 D118	F100-Y115 AromaticContact CD2-CD1 3.96Å; F100-Y115 HydrophobicContact CD2-CD1 3.96Å; F100-Y115 AromaticContact CD2-CD2 3.89Å; F100-Y115 HydrophobicContact CD2-CD2 3.89Å; F100-Y115 AromaticContact CD2-CE1 3.65Å; F100-Y115 HydrophobicContact CD2-CE1 3.65Å; F100-Y115 AromaticContact CD2-CE2 3.61Å; F100-Y115 HydrophobicContact CD2-CE2 3.61Å; F100-Y115 HydrophobicContact CD2-CG 4.05Å; F100-Y115 AromaticContact CD2-CZ 3.46Å; F100-Y115 VanDerWaalsContact CD2-CZ 3.46Å; F100-Y115 AromaticContact CE2-CD1 3.71Å; F100-Y115 HydrophobicContact CE2-CD1 3.71Å; F100-Y115 HydrophobicContact CE2-CD2 4.3Å; F100-Y115 AromaticContact CE2-CE1 3.72Å; F100-Y115 HydrophobicContact CE2-CE1 3.72Å; F100-Y115 HydrophobicContact CE2-CE2 4.35Å; F100-Y115 AromaticContact CE2-CG 3.99Å; F100-Y115 HydrophobicContact CE2-CG 3.99Å; D104-Y115 HydrophobicContact CB-CE1 4.44Å; D104-Y115 WeakPolarHBondContact OD2-CE1 3.43Å; D104-Y115 PolarHBondContact OD2-OH 3.12Å; Y115-Y117 PolarHBondContact O-N 3.13Å; Y115-Y117 VanDerWaalsContact O-N 3.16Å; Y115-D118 PolarHBondContact O-N 3.35Å
116	A	64.3	Low	61.3	Low	23 Å²	23	103.8 Å²	103.8	19%	0.19	50%	0.499	C	S	.	.	G	3₁₀ helix	trans	-46.8	-45	176.6	0	0	0	0	0	113.3	C106 E108 D118 C119	C106-A116 VanDerWaalsContact SG-CA 3.59Å; E108-A116 HydrophobicContact CG-CB 3.88Å; A116-D118 PolarHBondContact O-N 2.94Å; A116-D118 VanDerWaalsContact O-N 3.08Å; A116-C119 WeakPolarHBondContact O-CB 3.18Å; A116-C119 PolarHBondContact O-N 3.16Å
117	Y	57.1	Low	59.9	Low	209 Å²	209	112.5 Å²	112.5	82%	0.82	54%	0.539	S	S	*	.	G	3₁₀ helix	trans	-60.4	-22.7	-179.7	-155.3	-90.3	0	0	0	114.6	Y115	Y115-Y117 PolarHBondContact O-N 3.13Å; Y115-Y117 VanDerWaalsContact O-N 3.16Å
118	D	62.7	Low	58.5	Low	97 Å²	97	115 Å²	115	52%	0.519	55%	0.547	S	S	.	.	G	3₁₀ helix	trans	-103.1	12.3	180	-62.4	-75.3	0	0	0	112.2	H114 Y115 A116 H120	H114-D118 HydrophobicContact CB-CB 4.42Å; Y115-D118 PolarHBondContact O-N 3.35Å; A116-D118 PolarHBondContact O-N 2.94Å; A116-D118 VanDerWaalsContact O-N 3.08Å; D118-H120 PolarHBondContact O-N 3.04Å; D118-H120 VanDerWaalsContact O-N 3.09Å
119	C	66.6	Low	57.4	Low	9 Å²	9	114.1 Å²	114.1	6%	0.061	55%	0.554	C	S	.	*			trans	-68.5	108.3	-172.7	-165.8	0	0	0	0	113.9	C109 H114 A116 R121 Y122 G123	C109-C119 VanDerWaalsContact SG-SG 3.68Å; H114-C119 PolarHBondContact NE2-SG 3.39Å; A116-C119 WeakPolarHBondContact O-CB 3.18Å; A116-C119 PolarHBondContact O-N 3.16Å; C119-R121 PolarHBondContact O-N 3.09Å; C119-Y122 PolarHBondContact O-N 3Å; C119-G123 PolarHBondContact O-N 3.08Å
120	H	63.6	Low	56.2	Low	159 Å²	159	123.9 Å²	123.9	74%	0.736	59%	0.588	S	S	*	*	T	Hydrogen-bonded Turn	trans	-62	-12	176.9	-68.3	-23.8	0	0	0	114.9	D118	D118-H120 PolarHBondContact O-N 3.04Å; D118-H120 VanDerWaalsContact O-N 3.09Å
121	R	52.7	Low	54.8	Low	169 Å²	169	126.2 Å²	126.2	64%	0.638	60%	0.597	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68.8	-35.6	177.5	-154.2	175.2	-159.2	164.7	6.4	112.4	C119	C119-R121 PolarHBondContact O-N 3.09Å
122	Y	50.7	Low	53.5	Low	165 Å²	165	130.9 Å²	130.9	65%	0.647	61%	0.609	S	S	*	*	T	Hydrogen-bonded Turn	trans	-111.5	-16.5	-177.7	-65.3	-74.9	0	0	0	114.4	C119 R124	C119-Y122 PolarHBondContact O-N 3Å; Y122-R124 PolarHBondContact O-N 2.84Å
123	G	52.2	Low	52.2	Low	49 Å²	49	130.5 Å²	130.5	51%	0.505	62%	0.62	S	S	.	*	G	3₁₀ helix	trans	-61.5	2.9	177.8	0	0	0	0	0	117.1	C119 R125 G126	C119-G123 PolarHBondContact O-N 3.08Å; G123-R125 PolarHBondContact O-N 3.28Å; G123-G126 PolarHBondContact O-N 3.29Å
124	R	47.1	Very low	51.1	Low	221 Å²	221	139.8 Å²	139.8	83%	0.834	64%	0.637	S	S	*	*	G	3₁₀ helix	trans	-66.9	4.2	-176.2	-80.2	-64.7	-139.3	-84	2.8	116.2	Y122	Y122-R124 PolarHBondContact O-N 2.84Å
125	R	46.4	Very low	49.4	Very low	253 Å²	253	142.5 Å²	142.5	96%	0.955	66%	0.66	S	S	*	*	G	3₁₀ helix	trans	-116	-2.9	167.3	-67.3	-169.9	-179.3	-166	2	114.7	G123	G123-R125 PolarHBondContact O-N 3.28Å
126	G	48.8	Very low	47.9	Very low	55 Å²	55	151.7 Å²	151.7	57%	0.567	69%	0.694	S	S	*	*	T	Hydrogen-bonded Turn	trans	-90.3	-60.4	-165.8	0	0	0	0	0	116.6	G123	G123-G126 PolarHBondContact O-N 3.29Å
127	H	44	Very low	46.6	Very low	184 Å²	184	156 Å²	156	85%	0.852	72%	0.722	S	S	*	*			trans	-130.9	113.8	-163.7	-75.1	-73.7	0	0	0	114.6	S129	H127-S129 PolarHBondContact O-N 3.02Å
128	R	38.8	Very low	45.6	Very low	252 Å²	252	157.8 Å²	157.8	95%	0.951	73%	0.728	S	S	*	*			trans	-66.7	111.9	162.9	-161.5	174.8	-161.6	173.3	7	108.3	R130	R128-R130 PolarHBondContact O-N 3.2Å; R128-R130 VanDerWaalsContact O-N 3.08Å
129	S	39.6	Very low	44.2	Very low	99 Å²	99	158.3 Å²	158.3	69%	0.692	74%	0.739	S	S	*	*			trans	-56.8	109	-169.4	44.8	0	0	0	0	112.9	H127 S131	H127-S129 PolarHBondContact O-N 3.02Å; S129-S131 PolarHBondContact O-N 3.04Å
130	R	39.8	Very low	42.7	Very low	228 Å²	228	169.6 Å²	169.6	86%	0.86	78%	0.78	S	S	*	*			trans	-82.8	68	171.8	-162.7	171.4	-166.9	161.8	6	110.2	R128 R132	R128-R130 PolarHBondContact O-N 3.2Å; R128-R130 VanDerWaalsContact O-N 3.08Å; R130-R132 PolarHBondContact O-N 3.16Å
131	S	38.4	Very low	41.4	Very low	97 Å²	97	166.9 Å²	166.9	68%	0.678	78%	0.779	S	S	*	*			trans	-59.1	89.6	-177.7	33	0	0	0	0	112.6	S129 S133	S129-S131 PolarHBondContact O-N 3.04Å; S131-S133 VanDerWaalsContact C-N 3.26Å; S131-S133 PolarHBondContact O-N 2.86Å; S131-S133 VanDerWaalsContact O-N 3.16Å
132	R	39.4	Very low	40.6	Very low	221 Å²	221	170.8 Å²	170.8	83%	0.834	79%	0.794	S	S	*	*			trans	-84.2	67.1	166.9	-87.7	-177	161.2	165.6	-5.1	110.6	R130 R134	R130-R132 PolarHBondContact O-N 3.16Å; R132-R134 PolarHBondContact O-N 3.09Å; R132-R134 VanDerWaalsContact O-N 3.09Å
133	S	37.4	Very low	40	Very low	98 Å²	98	168 Å²	168	69%	0.685	80%	0.799	S	S	*	*			trans	-61.4	107.5	167.3	29.9	0	0	0	0	110	S131 S135	S131-S133 VanDerWaalsContact C-N 3.26Å; S131-S133 PolarHBondContact O-N 2.86Å; S131-S133 VanDerWaalsContact O-N 3.16Å; S133-S135 PolarHBondContact O-N 3.08Å
134	R	44.9	Very low	39.3	Very low	254 Å²	254	178 Å²	178	96%	0.958	82%	0.821	S	S	*	*			trans	-74.8	61.8	178.4	-104.1	-177.5	163.5	173.6	-5.8	111.7	R132	R132-R134 PolarHBondContact O-N 3.09Å; R132-R134 VanDerWaalsContact O-N 3.09Å
135	S	37.1	Very low	38.6	Very low	92 Å²	92	170.5 Å²	170.5	64%	0.643	81%	0.813	S	S	*	*			trans	-165.7	95.5	173.9	42.2	0	0	0	0	114.1	S133	S133-S135 PolarHBondContact O-N 3.08Å
136	R	35.3	Very low	38.1	Very low	252 Å²	252	170.4 Å²	170.4	95%	0.951	81%	0.812	S	S	*	*			trans	-177.8	118.9	132	-101	155.8	-177.1	175.5	1.1	111.4
137	S	36.3	Very low	37.3	Very low	112 Å²	112	178.7 Å²	178.7	78%	0.783	83%	0.826	S	S	*	*			trans	-71.4	137.4	162.6	41.8	0	0	0	0	110
138	R	35	Very low	36.7	Very low	248 Å²	248	179.1 Å²	179.1	94%	0.936	82%	0.822	S	S	*	*			trans	-171	127.6	143.2	-105.6	154.6	-172.2	-176.3	1.8	110.8
139	S	35.3	Very low	36.6	Very low	107 Å²	107	171.7 Å²	171.7	75%	0.748	81%	0.809	S	S	*	*			trans	-73	148.9	166.1	45.6	0	0	0	0	110.4
140	R	34.8	Very low	36.2	Very low	247 Å²	247	177.1 Å²	177.1	93%	0.932	81%	0.814	S	S	*	*			trans	-172	137.2	136.4	-102.6	152.9	-172.4	-167.6	0.4	111
141	S	36.5	Very low	35.8	Very low	102 Å²	102	171.3 Å²	171.3	71%	0.713	81%	0.808	S	S	*	*			trans	-80.4	157	169.4	49	0	0	0	0	110.9
142	R	36.1	Very low	35.5	Very low	250 Å²	250	177.9 Å²	177.9	94%	0.943	82%	0.818	S	S	*	*			trans	-174.2	145.5	133.3	-99.4	151.1	-171.4	-157.8	-0.7	111.2
143	S	37.1	Very low	35.1	Very low	107 Å²	107	172.2 Å²	172.2	75%	0.748	81%	0.813	S	S	*	*			trans	-102.6	150.3	-178.6	43.3	0	0	0	0	111.6
144	R	36.6	Very low	34.9	Very low	259 Å²	259	179.3 Å²	179.3	98%	0.977	82%	0.824	S	S	*	*			trans	161.6	142.7	164.5	-87.5	144.4	-169.4	-163.1	1.9	106.5
145	G	33.3	Very low	34.2	Very low	64 Å²	64	172.8 Å²	172.8	66%	0.66	82%	0.817	S	S	*	*			cis	142.5	147	-3.8	0	0	0	0	0	111.4
146	R	34.8	Very low	33.9	Very low	250 Å²	250	179.5 Å²	179.5	94%	0.943	83%	0.829	S	S	*	*			trans	74.3	123.4	-176.1	-48.4	172.6	-178.2	-170.3	-2	112.4
147	R	33	Very low	33.6	Very low	229 Å²	229	172.2 Å²	172.2	86%	0.864	82%	0.817	S	S	*	*			cis	72.7	94.3	36.6	-164.7	-170.6	-76	-154	0.2	113
148	Y	30.8	Very low	33.5	Very low	193 Å²	193	179 Å²	179	76%	0.757	83%	0.825	S	S	*	*			trans	-105.7	132.8	154.3	175	-109.6	0	0	0	108.6	R150	Y148-R150 HydrophobicContact CE1-CB 4.18Å; Y148-R150 HydrophobicContact CE2-CB 4.07Å; Y148-R150 WeakPolarHBondContact OH-CB 3.35Å; Y148-R150 WeakPolarHBondContact OH-CD 3.38Å
149	S	37.6	Very low	33.3	Very low	96 Å²	96	170.8 Å²	170.8	67%	0.671	82%	0.818	S	S	*	*			trans	-145.7	113.5	179.1	51.9	0	0	0	0	108.5
150	R	31.1	Very low	33.1	Very low	214 Å²	214	177.8 Å²	177.8	81%	0.808	83%	0.828	S	S	*	*			trans	-143.9	129.8	174.7	-149.3	168.9	-166.6	163.8	3.5	109.8	Y148	Y148-R150 HydrophobicContact CE1-CB 4.18Å; Y148-R150 HydrophobicContact CE2-CB 4.07Å; Y148-R150 WeakPolarHBondContact OH-CB 3.35Å; Y148-R150 WeakPolarHBondContact OH-CD 3.38Å
151	S	31.5	Very low	33.1	Very low	105 Å²	105	177.4 Å²	177.4	73%	0.734	83%	0.827	S	S	*	*			trans	-117	153.5	-174	50.5	0	0	0	0	110.6
152	R	31.6	Very low	33.1	Very low	235 Å²	235	177.7 Å²	177.7	89%	0.887	83%	0.829	S	S	*	*			trans	177.5	123	138	-97.6	158.2	-177.3	-164.3	-0.9	113.7
153	S	30.4	Very low	33	Very low	103 Å²	103	177.1 Å²	177.1	72%	0.72	83%	0.826	S	S	*	*				54.2	108.4	129.7	-50.8	0	0	0	0	123.5
154	R	33.1	Very low	32.8	Very low	246 Å²	246	176.6 Å²	176.6	93%	0.928	82%	0.823	S	S	*	*				46.1	118.1	126.9	-61.2	176.9	174.3	174.7	-2.8	120.5
155	S	30.3	Very low	32.8	Very low	117 Å²	117	169.3 Å²	169.3	82%	0.818	81%	0.812	S	S	*	*				-179.9	147.4	117.3	43.5	0	0	0	0	116.9
156	R	31.1	Very low	33.4	Very low	233 Å²	233	171.3 Å²	171.3	88%	0.879	81%	0.813	S	S	*	*			trans	46.7	81.4	146.1	-62.7	-179.7	179.4	-176.5	-0.2	123.3
157	S	28.6	Very low	33.3	Very low	100 Å²	100	170.5 Å²	170.5	70%	0.699	81%	0.81	S	S	*	*				34.9	140.9	116.7	67.1	0	0	0	0	125.3
158	R	34.4	Very low	33.1	Very low	253 Å²	253	171 Å²	171	96%	0.955	81%	0.812	S	S	*	*			trans	78.7	137.9	164.3	-50.9	178.2	-177.3	-177.4	0.5	115.1
159	G	31.9	Very low	33.1	Very low	77 Å²	77	165.6 Å²	165.6	79%	0.794	80%	0.803	S	S	*	*			cis	-157.5	-176.4	-5.6	0	0	0	0	0	109.2
160	R	31.2	Very low	32.7	Very low	253 Å²	253	173 Å²	173	96%	0.955	82%	0.816	S	S	*	*			cis	-135.7	176.5	20.7	-66.7	-175.3	173.6	-138.2	-0.8	113.1
161	R	35.1	Very low	32.7	Very low	240 Å²	240	168 Å²	168	91%	0.906	81%	0.813	S	S	*	*			trans	-60.4	164.5	177	-49	171	172.8	-171.3	-4.7	112.4
162	S	34.7	Very low	32.7	Very low	108 Å²	108	168.1 Å²	168.1	76%	0.755	81%	0.814	S	S	*	*			cis	-141.1	-149.2	15.5	-50.9	0	0	0	0	109
163	R	35.5	Very low	32.8	Very low	237 Å²	237	162.5 Å²	162.5	89%	0.894	81%	0.811	S	S	*	*			cis	-171	136.7	-23.2	-127.5	175.6	175.1	-179.6	-1.2	101.9
164	S	32.5	Very low	33.4	Very low	97 Å²	97	163 Å²	163	68%	0.678	81%	0.812	S	S	*	*			cis	-144.5	163.8	-4.2	-78.4	0	0	0	0	106.4
165	S	36.3	Very low	33.4	Very low	106 Å²	106	162.6 Å²	162.6	74%	0.741	81%	0.81	S	S	*	*			cis	81.3	135	31.6	-69.2	0	0	0	0	115.7
166	P	46	Very low	33.4	Very low	105 Å²	105	168.8 Å²	168.8	68%	0.682	82%	0.815	S	S	*	*			cis	-146.8	153.1	-12.6	38.8	-18.5	0	0	0	119.3
167	R	32.1	Very low	33.4	Very low	234 Å²	234	162.6 Å²	162.6	88%	0.883	81%	0.808	S	S	*	*			trans	45	126.5	133.3	-55.5	166.8	-175.7	-95.7	0.6	122.2
168	R	30.2	Very low	33.4	Very low	238 Å²	238	170 Å²	170	90%	0.898	82%	0.821	S	S	*	*				-179.7	159.7	114.1	-98.1	-176.5	-177	-136	3.7	109.4
169	S	30.3	Very low	33.5	Very low	81 Å²	81	163.7 Å²	163.7	57%	0.566	82%	0.815	S	S	*	*			cis	179.8	145.6	-41.2	52.8	0	0	0	0	109.1
170	R	28.8	Very low	33.6	Very low	252 Å²	252	163.1 Å²	163.1	95%	0.951	81%	0.81	S	S	*	*			trans	74.9	166.1	170.9	-54.6	176.7	178.6	176.1	-2.1	115.8
171	S	31.5	Very low	33.6	Very low	108 Å²	108	157 Å²	157	76%	0.755	81%	0.806	S	S	*	*			trans	-144.3	161.1	-155	51	0	0	0	0	113.6
172	S	31	Very low	33.8	Very low	107 Å²	107	151.5 Å²	151.5	75%	0.748	80%	0.801	S	S	*	*			trans	78.9	93.8	161.3	-53.3	0	0	0	0	119
173	S	34	Very low	34.1	Very low	117 Å²	117	158 Å²	158	82%	0.818	81%	0.809	S	S	*	*			trans	60.6	132.8	131.6	-59.4	0	0	0	0	120.3
174	P	41.8	Very low	33.9	Very low	114 Å²	114	157.4 Å²	157.4	74%	0.74	81%	0.807	S	S	*	*				-148.1	155.8	75.8	37.5	-19.2	0	0	0	118.9
175	R	34	Very low	33.8	Very low	238 Å²	238	158.6 Å²	158.6	90%	0.898	81%	0.805	S	S	*	*			trans	45.6	114.8	147.1	-60.5	172.8	-172.1	-92	2.7	120.4
176	R	30.2	Very low	33.5	Very low	246 Å²	246	161.6 Å²	161.6	93%	0.928	81%	0.807	S	S	*	*				-161	154.6	99.9	-112.9	-175.7	-179.3	-140.5	0.4	113.9
177	S	31.3	Very low	32.9	Very low	104 Å²	104	162.7 Å²	162.7	73%	0.727	82%	0.818	S	S	*	*			trans	-50	136.8	-175.6	46	0	0	0	0	116.9
178	R	29.3	Very low	32.7	Very low	254 Å²	254	155 Å²	155	96%	0.958	81%	0.81	S	S	*	*			trans	-114.6	117.9	150.8	-79.9	-175.1	173.6	-178.4	-1.8	109.5
179	S	36.1	Very low	33.4	Very low	121 Å²	121	149.7 Å²	149.7	85%	0.846	81%	0.81	S	S	*	*			trans	-115.1	152	157.6	47.4	0	0	0	0	108
180	G	33.4	Very low	33.9	Very low	66 Å²	66	152 Å²	152	68%	0.68	82%	0.823	S	S	*	*			cis	143.3	51.5	0.4	0	0	0	0	0	111.5	P182	G180-P182 WeakPolarHBondContact O-CD 3.33Å
181	S	32.2	Very low	34.1	Very low	123 Å²	123	143.4 Å²	143.4	86%	0.86	81%	0.813	S	S	*	*			trans	-68.5	118.4	-168.5	-46	0	0	0	0	112.8
182	P	39.5	Very low	34.2	Very low	125 Å²	125	148.4 Å²	148.4	81%	0.812	82%	0.815	S	S	*	*			trans	-82.7	167.2	178.3	34.2	-35	0	0	0	112.8	G180	G180-P182 WeakPolarHBondContact O-CD 3.33Å
183	R	40.2	Very low	34.4	Very low	244 Å²	244	148.2 Å²	148.2	92%	0.921	81%	0.814	S	S	*	*			trans	-128.1	132.1	169.6	-72.5	175.6	169.1	-103.3	3.8	110
184	R	31.3	Very low	34.4	Very low	226 Å²	226	152.1 Å²	152.1	85%	0.853	81%	0.81	S	S	*	*			trans	-162.8	123	152.1	-103.1	-175.6	164.2	-108.9	-1.9	107.4
185	L	30.3	Very low	34.3	Very low	121 Å²	121	151.5 Å²	151.5	63%	0.634	81%	0.809	S	S	*	*				86.7	102.5	74.2	-77.3	-169.3	0	0	0	114.7
186	Q	30.7	Very low	34.6	Very low	169 Å²	169	151.3 Å²	151.3	79%	0.79	81%	0.808	S	S	*	*			trans	62.6	149.3	132.6	-77.6	177.6	-47.2	0	0	123.6
187	S	32.1	Very low	34.9	Very low	129 Å²	129	144.6 Å²	144.6	90%	0.902	80%	0.799	S	S	*	*			trans	72.1	145.9	161.4	67	0	0	0	0	118.8
188	G	29.5	Very low	35.5	Very low	71 Å²	71	146.3 Å²	146.3	73%	0.732	81%	0.805	S	S	*	*			trans	128.4	104	176	0	0	0	0	0	112.5
189	S	43.4	Very low	36.2	Very low	127 Å²	127	139.5 Å²	139.5	89%	0.888	80%	0.796	S	S	*	*			trans	-149.8	107.5	168.9	-63.9	0	0	0	0	111
190	P	42.4	Very low	36.1	Very low	131 Å²	131	143 Å²	143	85%	0.851	80%	0.796	S	S	*	*			trans	-134.8	176.5	159.3	38.7	-24.8	0	0	0	112.7
191	G	31.3	Very low	36.1	Very low	71 Å²	71	145 Å²	145	73%	0.732	80%	0.798	S	S	*	*			trans	114	17.7	141	0	0	0	0	0	121.4
192	R	34.9	Very low	36.3	Very low	213 Å²	213	150 Å²	150	80%	0.804	80%	0.798	S	S	*	*			trans	-8.4	117.8	156.5	178.1	-166.9	-174.6	-123.4	16.1	118.9
193	S	34.8	Very low	36.2	Very low	102 Å²	102	149.5 Å²	149.5	71%	0.713	80%	0.798	S	S	*	*			trans	-156.4	133.1	148.5	44	0	0	0	0	108.8
194	R	34.7	Very low	36.1	Very low	199 Å²	199	149.4 Å²	149.4	75%	0.751	80%	0.798	S	S	*	*				54.7	120.3	70.1	-69.7	-178.8	171.5	179.9	-4.9	110.7
195	S	38.3	Very low	36.4	Very low	102 Å²	102	144.3 Å²	144.3	71%	0.713	80%	0.797	S	S	*	*			cis	-156.8	-175.7	15	-39.7	0	0	0	0	109
196	R	40.4	Very low	36.6	Very low	234 Å²	234	142.2 Å²	142.2	88%	0.883	80%	0.804	S	S	*	*			cis	-158.7	-178	3.8	-137.1	156.8	-163.8	177.5	2.8	108.5
197	S	36.6	Very low	37	Very low	104 Å²	104	139.7 Å²	139.7	73%	0.727	81%	0.806	S	S	*	*			trans	-33.5	153.5	168.2	-34.9	0	0	0	0	115.6
198	V	44.6	Very low	37.4	Very low	141 Å²	141	142.7 Å²	142.7	86%	0.855	81%	0.808	S	S	*	*			cis	-126.7	177.5	21.9	-107.2	0	0	0	0	110.7
199	S	43	Very low	37.6	Very low	110 Å²	110	142.9 Å²	142.9	77%	0.769	81%	0.809	S	S	*	*			cis	-149.7	-162.6	21.8	-153.6	0	0	0	0	114.6
200	K	35.4	Very low	37.5	Very low	195 Å²	195	148.6 Å²	148.6	85%	0.848	81%	0.811	S	S	*	*			trans	-140	154.7	173.4	-113.2	167.7	-177.5	171.3	0	105.4
201	C	31.9	Very low	37.1	Very low	108 Å²	108	146.6 Å²	146.6	73%	0.73	80%	0.801	S	S	*	*			cis	-163.8	-171.6	24.2	60.1	0	0	0	0	108.6
202	R	37	Very low	37.6	Very low	228 Å²	228	151.3 Å²	151.3	86%	0.86	80%	0.803	S	S	*	*			cis	-155.6	137.7	-1.2	-143.5	160.7	-172.9	174.2	1	107.5
203	S	38.1	Very low	37.7	Very low	115 Å²	115	146.3 Å²	146.3	80%	0.804	80%	0.801	S	S	*	*			trans	-76.5	146.2	165.7	43.7	0	0	0	0	110.6
204	R	37.2	Very low	37.8	Very low	241 Å²	241	145.4 Å²	145.4	91%	0.909	81%	0.807	S	S	*	*			trans	-140.4	114.7	163.1	-101	-172.9	166.5	176.6	-5.2	110.7
205	S	38	Very low	38.3	Very low	120 Å²	120	141.6 Å²	141.6	84%	0.839	81%	0.811	S	S	*	*			trans	-66.1	157.1	154.8	40.5	0	0	0	0	110
206	G	33.7	Very low	38.7	Very low	77 Å²	77	148.6 Å²	148.6	79%	0.794	82%	0.822	S	S	*	*			trans	-167.1	54.2	-172.5	0	0	0	0	0	113.8	M208	G206-M208 PolarHBondContact O-N 2.98Å
207	S	40.7	Very low	38.8	Very low	116 Å²	116	141.7 Å²	141.7	81%	0.811	82%	0.815	S	S	*	*			trans	-94.4	80.8	-179.2	55.1	0	0	0	0	112.5
208	M	38.5	Very low	39.1	Very low	192 Å²	192	149 Å²	149	95%	0.946	83%	0.827	S	S	*	*			trans	-146.4	143.8	161.2	-62.1	-172.5	-179.4	0	0	107.3	G206	G206-M208 PolarHBondContact O-N 2.98Å
209	G	35.2	Very low	39.2	Very low	74 Å²	74	147.1 Å²	147.1	76%	0.763	82%	0.82	S	S	*	*			cis	117.3	82.3	14.9	0	0	0	0	0	109.3
210	R	40.6	Very low	39.5	Very low	247 Å²	247	153.1 Å²	153.1	93%	0.932	83%	0.825	S	S	*	*			trans	-156.4	99	179	-114	171	-177	-93.8	-1.5	112.2
211	S	34.9	Very low	40	Very low	90 Å²	90	149.3 Å²	149.3	63%	0.629	82%	0.823	S	S	*	*			trans	-76.6	158.3	154	45.3	0	0	0	0	110
212	H	40.3	Very low	40.7	Very low	170 Å²	170	148.7 Å²	148.7	79%	0.787	83%	0.826	S	S	*	*				172.4	141.7	118.6	-93.1	83.8	0	0	0	112.9
213	S	37.7	Very low	41.4	Very low	108 Å²	108	143.3 Å²	143.3	76%	0.755	82%	0.823	S	S	*	*			trans	11.1	127.9	155.1	56.6	0	0	0	0	120.7
214	G	37.1	Very low	42	Very low	82 Å²	82	149.3 Å²	149.3	85%	0.845	83%	0.828	S	S	*	*			trans	-152.6	38.5	171.5	0	0	0	0	0	114.3	R216	G214-R216 PolarHBondContact O-N 2.91Å
215	S	44.4	Very low	43.4	Very low	119 Å²	119	144.6 Å²	144.6	83%	0.832	83%	0.826	S	S	*	*			trans	-70.5	122.7	179.6	40.2	0	0	0	0	112.1
216	R	46.9	Very low	44.3	Very low	249 Å²	249	144.7 Å²	144.7	94%	0.94	82%	0.824	S	S	*	*			trans	-145.2	114.6	162.7	-110.3	178.9	-179.4	-165	-2.7	111.5	G214	G214-R216 PolarHBondContact O-N 2.91Å
217	A	41.9	Very low	45.2	Very low	89 Å²	89	145.9 Å²	145.9	74%	0.736	83%	0.827	S	S	*	*			trans	-70	155	172.9	0	0	0	0	0	111.5
218	R	44	Very low	45.8	Very low	259 Å²	259	148 Å²	148	98%	0.977	83%	0.829	S	S	*	*			trans	-120.3	85.1	159.4	-89.6	-173.9	165	-117.2	0.5	109.3
219	S	46	Very low	46.4	Very low	101 Å²	101	149.9 Å²	149.9	71%	0.706	84%	0.843	S	S	*	*			trans	-93.5	118.7	166.4	40.7	0	0	0	0	110.2
220	R	50.4	Low	46.9	Very low	236 Å²	236	153.7 Å²	153.7	89%	0.891	85%	0.847	S	S	*	*			trans	178.7	116.2	157.2	-99.7	162.1	-177.3	-147.1	-2.6	105.2
221	S	45.5	Very low	47.3	Very low	114 Å²	114	148.7 Å²	148.7	80%	0.797	84%	0.842	S	S	*	*				69.2	134.7	56	-51.4	0	0	0	0	113.1
222	A	46	Very low	48	Very low	96 Å²	96	152 Å²	152	79%	0.793	85%	0.854	S	S	*	*			cis	-170.5	126.4	-18.5	0	0	0	0	0	110.8
223	S	51.8	Low	48.4	Very low	114 Å²	114	150.9 Å²	150.9	80%	0.797	86%	0.858	S	S	*	*			trans	-168.7	119.3	162.3	42.6	0	0	0	0	107.5
224	R	51.2	Low	49.1	Very low	241 Å²	241	153.6 Å²	153.6	91%	0.909	86%	0.864	S	S	*	*				61.3	93.8	54.3	-71.5	-168.1	169.6	-132.4	0.4	114
225	T	65.8	Low	49.9	Very low	142 Å²	142	158.4 Å²	158.4	87%	0.871	87%	0.866	S	S	*	*				-175.6	113.6	120.8	34.2	0	0	0	0	110.2
226	P	57.5	Low	50.3	Low	122 Å²	122	161.2 Å²	161.2	79%	0.792	87%	0.868	S	S	*	*			trans	-104.1	172.4	154.4	38.4	-30.6	0	0	0	111.3
227	A	52.9	Low	50.5	Low	103 Å²	103	154.5 Å²	154.5	85%	0.851	86%	0.863	S	S	*	*			trans	73.7	127	171.8	0	0	0	0	0	117.8
228	D	53	Low	51.2	Low	160 Å²	160	159.9 Å²	159.9	86%	0.856	87%	0.873	S	S	*	*			trans	-111.8	95.3	160.6	177.6	-107	0	0	0	106.5
229	N	50.8	Low	51.9	Low	231 Å²	231	150.9 Å²	150.9	100%	1.235	86%	0.864	S	S	*	*			trans	-179.4	0	162	-118.6	-85.8	0	0	0	108.7

Retrieved 229 of 229 residues in 64.3 ms (Link to these results)

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