G4V864_SCHMA Loading...

Smp_201070

AlphaFold DB , UniProt , Accession G4V864, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 188 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	26.5	Very low	32.5	Very low	241 Å²	241	127.4 Å²	127.4	100%	1.187	63%	0.633	S	S	*	*				0	105.1	0	-147	176.7	-163.5	0	0	106	Q3	M1-Q3 PolarHBondContact O-N 3.42Å
2	F	27.8	Very low	33.6	Very low	212 Å²	212	120.1 Å²	120.1	93%	0.93	60%	0.598	S	S	*	*			trans	-85.2	112.6	-177	-71	-77.9	0	0	0	108.9
3	Q	24.9	Very low	34.2	Very low	189 Å²	189	116.4 Å²	116.4	88%	0.883	59%	0.586	S	S	*	*			trans	-83.9	111.4	172.7	-167.6	171.9	0.7	0	0	107.6	M1 T5	M1-Q3 PolarHBondContact O-N 3.42Å; Q3-T5 PolarHBondContact O-N 3.07Å
4	T	24.8	Very low	34.7	Very low	128 Å²	128	112.8 Å²	112.8	79%	0.785	57%	0.569	S	S	*	*			trans	-77.8	111.9	177.6	50.8	0	0	0	0	109.4
5	T	28.3	Very low	35.4	Very low	81 Å²	81	105.5 Å²	105.5	50%	0.497	53%	0.532	S	S	.	.			trans	-73.9	127.3	172.3	-52.5	0	0	0	0	109.2	Q3 W7 K9 L10	Q3-T5 PolarHBondContact O-N 3.07Å; T5-W7 PolarHBondContact O-N 3.42Å; T5-K9 HydrophobicContact CG2-CB 4.12Å; T5-L10 HydrophobicContact CG2-CD2 4.44Å; T5-L10 HydrophobicContact CG2-CG 4.04Å
6	P	33	Very low	36.1	Very low	71 Å²	71	104.4 Å²	104.4	46%	0.461	53%	0.527	S	S	.	.			trans	-57.2	135.1	176.1	-22	31.4	0	0	0	111.1	S8 K9 L10	P6-S8 PolarHBondContact O-N 2.94Å; P6-S8 VanDerWaalsContact O-N 3.16Å; P6-K9 PolarHBondContact O-N 3.45Å; P6-L10 PolarHBondContact O-N 2.87Å
7	W	33.9	Very low	36.5	Very low	188 Å²	188	104.2 Å²	104.2	71%	0.712	53%	0.528	S	S	*	.	H	α-helix	trans	-52.4	-37.8	-179.3	178.6	-104.9	0	0	0	113.1	T5 K9 L10 L11	T5-W7 PolarHBondContact O-N 3.42Å; W7-K9 VanDerWaalsContact C-N 3.32Å; W7-K9 PolarHBondContact O-N 3.23Å; W7-L10 HydrophobicContact CE3-CD1 4.47Å; W7-L10 WeakPolarHBondContact O-CB 3.44Å; W7-L10 PolarHBondContact O-N 2.93Å; W7-L10 VanDerWaalsContact O-N 3.13Å; W7-L11 HydrophobicContact CZ2-CD1 3.8Å; W7-L11 PolarHBondContact O-N 3.14Å
8	S	39.6	Very low	37	Very low	58 Å²	58	103.6 Å²	103.6	41%	0.406	53%	0.526	S	S	.	.	H	α-helix	trans	-56.4	-43.2	176	51.9	0	0	0	0	112.9	P6 L11 D12	P6-S8 PolarHBondContact O-N 2.94Å; P6-S8 VanDerWaalsContact O-N 3.16Å; S8-L11 PolarHBondContact O-N 3.3Å; S8-D12 PolarHBondContact O-N 3.18Å
9	K	39.8	Very low	37.4	Very low	133 Å²	133	99.6 Å²	99.6	58%	0.578	51%	0.508	S	S	*	.	H	α-helix	trans	-68.1	-36.3	176.9	-74.9	-170	174.6	-175.1	0	112.6	T5 P6 W7 L11 T13	T5-K9 HydrophobicContact CG2-CB 4.12Å; P6-K9 PolarHBondContact O-N 3.45Å; W7-K9 VanDerWaalsContact C-N 3.32Å; W7-K9 PolarHBondContact O-N 3.23Å; K9-L11 VanDerWaalsContact C-N 3.34Å; K9-T13 WeakPolarHBondContact O-CB 3.35Å; K9-T13 PolarHBondContact O-N 3.3Å; K9-T13 PolarHBondContact O-OG1 3.49Å
10	L	39.4	Very low	37.8	Very low	78 Å²	78	99.4 Å²	99.4	41%	0.408	52%	0.516	S	S	.	.	H	α-helix	trans	-65.1	-41.7	174.9	-76.2	166.6	0	0	0	110.9	T5 P6 W7 T13 L14	T5-L10 HydrophobicContact CG2-CD2 4.44Å; T5-L10 HydrophobicContact CG2-CG 4.04Å; P6-L10 PolarHBondContact O-N 2.87Å; W7-L10 HydrophobicContact CE3-CD1 4.47Å; W7-L10 WeakPolarHBondContact O-CB 3.44Å; W7-L10 PolarHBondContact O-N 2.93Å; W7-L10 VanDerWaalsContact O-N 3.13Å; L10-T13 PolarHBondContact O-N 3.1Å; L10-L14 WeakPolarHBondContact O-CG 3.45Å; L10-L14 PolarHBondContact O-N 3.38Å
11	L	40.1	Very low	38	Very low	22 Å²	22	98.8 Å²	98.8	12%	0.115	51%	0.513	C	S	.	.	H	α-helix	trans	-64.3	-49	177.8	-143.8	83.8	0	0	0	111.5	W7 S8 K9 T13 L14 I15 F22	W7-L11 HydrophobicContact CZ2-CD1 3.8Å; W7-L11 PolarHBondContact O-N 3.14Å; S8-L11 PolarHBondContact O-N 3.3Å; K9-L11 VanDerWaalsContact C-N 3.34Å; L11-T13 PolarHBondContact O-N 3.49Å; L11-L14 WeakPolarHBondContact O-CB 3.36Å; L11-L14 PolarHBondContact O-N 3.33Å; L11-L14 VanDerWaalsContact O-N 3.08Å; L11-I15 HydrophobicContact CD2-CD1 4.26Å; L11-I15 HydrophobicContact CG-CD1 4.29Å; L11-I15 WeakPolarHBondContact O-CB 3.23Å; L11-I15 VanDerWaalsContact O-CG1 3.23Å; L11-I15 WeakPolarHBondContact O-CG1 3.41Å; L11-I15 PolarHBondContact O-N 3.39Å; L11-F22 HydrophobicContact CD1-CE2 3.83Å; L11-F22 HydrophobicContact CD2-CE2 3.94Å; L11-F22 HydrophobicContact CD2-CZ 4.15Å; L11-F22 HydrophobicContact CG-CD2 4.44Å; L11-F22 HydrophobicContact CG-CE2 3.65Å; L11-F22 HydrophobicContact CG-CZ 4.31Å
12	D	45.4	Very low	38.8	Very low	40 Å²	40	88.1 Å²	88.1	21%	0.214	46%	0.46	C	S	.	.	H	α-helix	trans	-56.6	-42.1	176.5	-69.4	-19.8	0	0	0	111	S8 I15 I16 H37 C40	S8-D12 PolarHBondContact O-N 3.18Å; D12-I15 PolarHBondContact O-N 2.95Å; D12-I16 WeakPolarHBondContact O-CB 3.13Å; D12-I16 WeakPolarHBondContact O-CD1 3.21Å; D12-I16 WeakPolarHBondContact O-CG1 3.22Å; D12-I16 PolarHBondContact O-N 3.08Å; D12-H37 IonicContact OD1-CE1 3.84Å; D12-H37 IonicContact OD1-CG 3.9Å; D12-H37 IonicContact OD1-ND1 2.91Å; D12-H37 PolarHBondContact OD1-ND1 3.46Å; D12-C40 VanDerWaalsContact CB-SG 3.5Å; D12-C40 PolarHBondContact OD1-SG 3.3Å
13	T	41.7	Very low	39.7	Very low	72 Å²	72	80.3 Å²	80.3	44%	0.442	43%	0.428	S	S	.	.	H	α-helix	trans	-64.8	-40.2	177.1	-55.5	0	0	0	0	112.1	K9 L10 L11 N17	K9-T13 WeakPolarHBondContact O-CB 3.35Å; K9-T13 PolarHBondContact O-N 3.3Å; K9-T13 PolarHBondContact O-OG1 3.49Å; L10-T13 PolarHBondContact O-N 3.1Å; L11-T13 PolarHBondContact O-N 3.49Å; T13-N17 VanDerWaalsContact CG2-ND2 3.26Å; T13-N17 WeakPolarHBondContact CG2-ND2 3.27Å; T13-N17 VanDerWaalsContact O-CB 3.3Å; T13-N17 WeakPolarHBondContact O-CB 3.12Å; T13-N17 PolarHBondContact O-N 3.41Å; T13-N17 PolarHBondContact O-ND2 3.23Å
14	L	41.3	Very low	40.6	Very low	66 Å²	66	75 Å²	75	35%	0.346	42%	0.416	S	S	.	.	H	α-helix	trans	-67.3	-44.8	177.3	-83.7	161.2	0	0	0	111.9	L10 L11 I16 N18 L21	L10-L14 WeakPolarHBondContact O-CG 3.45Å; L10-L14 PolarHBondContact O-N 3.38Å; L11-L14 WeakPolarHBondContact O-CB 3.36Å; L11-L14 PolarHBondContact O-N 3.33Å; L11-L14 VanDerWaalsContact O-N 3.08Å; L14-I16 VanDerWaalsContact C-N 3.33Å; L14-I16 PolarHBondContact O-N 2.91Å; L14-N18 CarbonylContact O-C 2.97Å; L14-N18 WeakPolarHBondContact O-CA 3.26Å; L14-N18 PolarHBondContact O-N 3.34Å; L14-L21 HydrophobicContact CD2-CD2 4.26Å
15	I	44.9	Very low	41.2	Very low	3 Å²	3	74.4 Å²	74.4	2%	0.015	41%	0.408	C	S	.	.	H	α-helix	trans	-59.3	-45.2	178	-69.7	169	0	0	0	110.6	L11 D12 F22 C40 F45	L11-I15 HydrophobicContact CD2-CD1 4.26Å; L11-I15 HydrophobicContact CG-CD1 4.29Å; L11-I15 WeakPolarHBondContact O-CB 3.23Å; L11-I15 VanDerWaalsContact O-CG1 3.23Å; L11-I15 WeakPolarHBondContact O-CG1 3.41Å; L11-I15 PolarHBondContact O-N 3.39Å; D12-I15 PolarHBondContact O-N 2.95Å; I15-F22 HydrophobicContact CD1-CD1 4.37Å; I15-F22 HydrophobicContact CD1-CE1 3.85Å; I15-F22 HydrophobicContact CD1-CE2 4.09Å; I15-F22 HydrophobicContact CD1-CZ 3.7Å; I15-F22 HydrophobicContact CG1-CB 4.46Å; I15-F22 HydrophobicContact CG1-CD1 3.56Å; I15-F22 HydrophobicContact CG1-CD2 3.8Å; I15-F22 HydrophobicContact CG1-CE1 3.56Å; I15-F22 HydrophobicContact CG1-CE2 3.84Å; I15-F22 HydrophobicContact CG1-CG 3.67Å; I15-F22 HydrophobicContact CG1-CZ 3.71Å; I15-C40 HydrophobicContact CG2-CB 4.11Å; I15-F45 HydrophobicContact CB-CD2 4.5Å; I15-F45 HydrophobicContact CG2-CB 4.28Å; I15-F45 HydrophobicContact CG2-CD2 3.33Å; I15-F45 HydrophobicContact CG2-CE2 3.78Å; I15-F45 HydrophobicContact CG2-CG 3.98Å
16	I	45.6	Very low	41.7	Very low	88 Å²	88	71.5 Å²	71.5	45%	0.451	39%	0.389	S	S	.	.	H	α-helix	trans	-72.8	-48.1	-177.3	-67.3	166.6	0	0	0	111.5	D12 L14	D12-I16 WeakPolarHBondContact O-CB 3.13Å; D12-I16 WeakPolarHBondContact O-CD1 3.21Å; D12-I16 WeakPolarHBondContact O-CG1 3.22Å; D12-I16 PolarHBondContact O-N 3.08Å; L14-I16 VanDerWaalsContact C-N 3.33Å; L14-I16 PolarHBondContact O-N 2.91Å
17	N	44.2	Very low	41.8	Very low	102 Å²	102	72.1 Å²	72.1	55%	0.545	39%	0.394	S	S	.	.	H	α-helix	trans	-87.5	-29.4	-169.1	-66.3	-38.3	0	0	0	113.6	T13	T13-N17 VanDerWaalsContact CG2-ND2 3.26Å; T13-N17 WeakPolarHBondContact CG2-ND2 3.27Å; T13-N17 VanDerWaalsContact O-CB 3.3Å; T13-N17 WeakPolarHBondContact O-CB 3.12Å; T13-N17 PolarHBondContact O-N 3.41Å; T13-N17 PolarHBondContact O-ND2 3.23Å
18	N	45.4	Very low	42.2	Very low	92 Å²	92	67.7 Å²	67.7	49%	0.492	38%	0.381	S	S	.	.			trans	-144.5	65.9	-178	-75.3	-65	0	0	0	110.7	L14 S20 L21 F22	L14-N18 CarbonylContact O-C 2.97Å; L14-N18 WeakPolarHBondContact O-CA 3.26Å; L14-N18 PolarHBondContact O-N 3.34Å; N18-S20 PolarHBondContact O-N 3.45Å; N18-S20 VanDerWaalsContact O-N 3.14Å; N18-L21 HydrophobicContact CB-CB 3.82Å; N18-L21 HydrophobicContact CB-CD2 4.42Å; N18-L21 WeakPolarHBondContact O-CB 3.38Å; N18-L21 PolarHBondContact O-N 3.31Å; N18-F22 PolarHBondContact O-N 2.86Å
19	P	44.5	Very low	42	Very low	29 Å²	29	70.9 Å²	70.9	19%	0.188	40%	0.398	C	S	.	.	H	α-helix	trans	-53.2	-37.8	-177.5	14.5	-27.9	0	0	0	113.7	F22 L23 F45 I49	P19-F22 WeakPolarHBondContact O-CB 3.3Å; P19-F22 PolarHBondContact O-N 3.04Å; P19-L23 PolarHBondContact O-N 3.17Å; P19-F45 HydrophobicContact CB-CD2 4.07Å; P19-F45 HydrophobicContact CB-CE2 3.85Å; P19-I49 HydrophobicContact CB-CD1 3.28Å; P19-I49 HydrophobicContact CB-CG1 3.86Å; P19-I49 HydrophobicContact CG-CD1 4.33Å; P19-I49 HydrophobicContact CG-CG1 4.44Å
20	S	44.1	Very low	41.7	Very low	94 Å²	94	66.9 Å²	66.9	66%	0.657	39%	0.385	S	S	*	.	H	α-helix	trans	-65.3	-40.1	177.9	-41.9	0	0	0	0	112.3	N18 F22 L23 A24	N18-S20 PolarHBondContact O-N 3.45Å; N18-S20 VanDerWaalsContact O-N 3.14Å; S20-F22 VanDerWaalsContact C-N 3.34Å; S20-L23 PolarHBondContact O-N 3.01Å; S20-A24 WeakPolarHBondContact O-CB 3.45Å; S20-A24 PolarHBondContact O-N 2.93Å
21	L	42.9	Very low	41.6	Very low	87 Å²	87	67.4 Å²	67.4	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-69.7	-36	177.8	-173	70	0	0	0	111.1	L14 N18 N25	L14-L21 HydrophobicContact CD2-CD2 4.26Å; N18-L21 HydrophobicContact CB-CB 3.82Å; N18-L21 HydrophobicContact CB-CD2 4.42Å; N18-L21 WeakPolarHBondContact O-CB 3.38Å; N18-L21 PolarHBondContact O-N 3.31Å; L21-N25 WeakPolarHBondContact CD1-ND2 3.42Å; L21-N25 PolarHBondContact O-N 2.69Å; L21-N25 PolarHBondContact O-ND2 2.96Å
22	F	43.1	Very low	41.5	Very low	18 Å²	18	67.5 Å²	67.5	8%	0.079	39%	0.392	C	S	.	.	H	α-helix	trans	-59.6	-55.2	172.5	177.6	-111.2	0	0	0	110	L11 I15 N18 P19 S20 A24 N25 I26 I32 F45	L11-F22 HydrophobicContact CD1-CE2 3.83Å; L11-F22 HydrophobicContact CD2-CE2 3.94Å; L11-F22 HydrophobicContact CD2-CZ 4.15Å; L11-F22 HydrophobicContact CG-CD2 4.44Å; L11-F22 HydrophobicContact CG-CE2 3.65Å; L11-F22 HydrophobicContact CG-CZ 4.31Å; I15-F22 HydrophobicContact CD1-CD1 4.37Å; I15-F22 HydrophobicContact CD1-CE1 3.85Å; I15-F22 HydrophobicContact CD1-CE2 4.09Å; I15-F22 HydrophobicContact CD1-CZ 3.7Å; I15-F22 HydrophobicContact CG1-CB 4.46Å; I15-F22 HydrophobicContact CG1-CD1 3.56Å; I15-F22 HydrophobicContact CG1-CD2 3.8Å; I15-F22 HydrophobicContact CG1-CE1 3.56Å; I15-F22 HydrophobicContact CG1-CE2 3.84Å; I15-F22 HydrophobicContact CG1-CG 3.67Å; I15-F22 HydrophobicContact CG1-CZ 3.71Å; N18-F22 PolarHBondContact O-N 2.86Å; P19-F22 WeakPolarHBondContact O-CB 3.3Å; P19-F22 PolarHBondContact O-N 3.04Å; S20-F22 VanDerWaalsContact C-N 3.34Å; F22-A24 VanDerWaalsContact C-N 3.32Å; F22-A24 PolarHBondContact O-N 3.37Å; F22-N25 PolarHBondContact O-N 3.43Å; F22-N25 VanDerWaalsContact O-N 3.09Å; F22-I26 HydrophobicContact CD1-CD1 3.7Å; F22-I26 HydrophobicContact CD1-CG1 4.38Å; F22-I26 HydrophobicContact CD2-CG1 4.35Å; F22-I26 HydrophobicContact CE1-CD1 3.39Å; F22-I26 HydrophobicContact CE1-CG1 4.11Å; F22-I26 HydrophobicContact CE2-CD1 4.24Å; F22-I26 HydrophobicContact CE2-CG1 4.04Å; F22-I26 HydrophobicContact CG-CD1 4.27Å; F22-I26 HydrophobicContact CZ-CD1 3.69Å; F22-I26 HydrophobicContact CZ-CG1 3.93Å; F22-I26 VanDerWaalsContact O-CG1 3.31Å; F22-I26 WeakPolarHBondContact O-CG1 3.21Å; F22-I26 PolarHBondContact O-N 3.15Å; F22-I26 VanDerWaalsContact O-N 3.16Å; F22-I32 HydrophobicContact CE1-CD1 3.85Å; F22-I32 HydrophobicContact CZ-CD1 3.57Å; F22-F45 HydrophobicContact CD1-CE2 4.03Å; F22-F45 AromaticContact CD1-CZ 4Å; F22-F45 HydrophobicContact CD1-CZ 4Å; F22-F45 HydrophobicContact CE1-CZ 4.33Å
23	L	46.9	Very low	40.9	Very low	48 Å²	48	68.7 Å²	68.7	25%	0.251	40%	0.401	S	S	.	.	H	α-helix	trans	-57.6	-40.2	179.9	-78	159	0	0	0	113.8	P19 S20 N25 I26 F45 I49 L75	P19-L23 PolarHBondContact O-N 3.17Å; S20-L23 PolarHBondContact O-N 3.01Å; L23-N25 VanDerWaalsContact C-N 3.25Å; L23-N25 PolarHBondContact O-N 3.21Å; L23-I26 HydrophobicContact CD2-CD1 4.37Å; L23-F45 HydrophobicContact CD1-CZ 4.13Å; L23-F45 HydrophobicContact CD2-CZ 4.33Å; L23-F45 HydrophobicContact CG-CZ 4.1Å; L23-I49 HydrophobicContact CD1-CD1 3.74Å; L23-I49 HydrophobicContact CD1-CG2 3.73Å; L23-L75 HydrophobicContact CD2-CD1 4.38Å; L23-L75 HydrophobicContact CD2-CD2 4.34Å
24	A	43.7	Very low	40.5	Very low	78 Å²	78	67.6 Å²	67.6	65%	0.645	39%	0.393	S	S	*	.	H	α-helix	trans	-66.9	-25.5	179.8	0	0	0	0	0	113.7	S20 F22	S20-A24 WeakPolarHBondContact O-CB 3.45Å; S20-A24 PolarHBondContact O-N 2.93Å; F22-A24 VanDerWaalsContact C-N 3.32Å; F22-A24 PolarHBondContact O-N 3.37Å
25	N	37.1	Very low	40.2	Very low	115 Å²	115	69.5 Å²	69.5	62%	0.615	41%	0.411	S	S	*	.	H	α-helix	trans	-106.5	-2.3	-174.4	-69.9	-54.2	0	0	0	113.9	L21 F22 L23 P27	L21-N25 WeakPolarHBondContact CD1-ND2 3.42Å; L21-N25 PolarHBondContact O-N 2.69Å; L21-N25 PolarHBondContact O-ND2 2.96Å; F22-N25 PolarHBondContact O-N 3.43Å; F22-N25 VanDerWaalsContact O-N 3.09Å; L23-N25 VanDerWaalsContact C-N 3.25Å; L23-N25 PolarHBondContact O-N 3.21Å; N25-P27 VanDerWaalsContact O-CD 3.29Å; N25-P27 WeakPolarHBondContact O-CD 3.33Å
26	I	38.9	Very low	39.9	Very low	19 Å²	19	72.6 Å²	72.6	10%	0.097	43%	0.433	C	S	.	.	S	Bend	trans	-70.1	122.7	171.6	-63.4	156.1	0	0	0	107.5	F22 L23 Q28 T30 I32 L84	F22-I26 HydrophobicContact CD1-CD1 3.7Å; F22-I26 HydrophobicContact CD1-CG1 4.38Å; F22-I26 HydrophobicContact CD2-CG1 4.35Å; F22-I26 HydrophobicContact CE1-CD1 3.39Å; F22-I26 HydrophobicContact CE1-CG1 4.11Å; F22-I26 HydrophobicContact CE2-CD1 4.24Å; F22-I26 HydrophobicContact CE2-CG1 4.04Å; F22-I26 HydrophobicContact CG-CD1 4.27Å; F22-I26 HydrophobicContact CZ-CD1 3.69Å; F22-I26 HydrophobicContact CZ-CG1 3.93Å; F22-I26 VanDerWaalsContact O-CG1 3.31Å; F22-I26 WeakPolarHBondContact O-CG1 3.21Å; F22-I26 PolarHBondContact O-N 3.15Å; F22-I26 VanDerWaalsContact O-N 3.16Å; L23-I26 HydrophobicContact CD2-CD1 4.37Å; I26-Q28 PolarHBondContact O-N 3.16Å; I26-T30 VanDerWaalsContact CG2-CB 3.48Å; I26-T30 HydrophobicContact CG2-CG2 4.22Å; I26-I32 HydrophobicContact CD1-CD1 3.81Å; I26-I32 HydrophobicContact CG1-CD1 4.36Å; I26-L84 HydrophobicContact CB-CD1 4.1Å; I26-L84 HydrophobicContact CD1-CD1 4.15Å; I26-L84 HydrophobicContact CG2-CD1 3.48Å; I26-L84 VanDerWaalsContact CG2-CD1 3.48Å
27	P	36.1	Very low	39.6	Very low	85 Å²	85	69.4 Å²	69.4	55%	0.552	42%	0.416	S	S	*	.			trans	-54.4	132.8	170.7	-19.9	28.7	0	0	0	109.3	N25 T29 T30	N25-P27 VanDerWaalsContact O-CD 3.29Å; N25-P27 WeakPolarHBondContact O-CD 3.33Å; P27-T29 PolarHBondContact O-N 3.4Å; P27-T30 WeakPolarHBondContact CB-OG1 3.41Å; P27-T30 VanDerWaalsContact CD-OG1 3.28Å; P27-T30 WeakPolarHBondContact CD-OG1 3.47Å; P27-T30 WeakPolarHBondContact O-CB 3.41Å; P27-T30 PolarHBondContact O-N 2.9Å; P27-T30 PolarHBondContact O-OG1 3.44Å
28	Q	41.4	Very low	39	Very low	94 Å²	94	67.4 Å²	67.4	44%	0.439	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.6	-2.7	-167.2	-68.3	175.1	-40.1	0	0	115.7	I26 L84 Q86	I26-Q28 PolarHBondContact O-N 3.16Å; Q28-L84 VanDerWaalsContact O-O 3.07Å; Q28-Q86 HydrophobicContact CB-CG 3.94Å; Q28-Q86 HydrophobicContact CG-CG 4.44Å
29	T	34.6	Very low	38.7	Very low	125 Å²	125	70.3 Å²	70.3	77%	0.767	42%	0.423	S	S	*	.	T	Hydrogen-bonded Turn	trans	-120.9	17.3	178.2	53.6	0	0	0	0	112.9	P27 T31	P27-T29 PolarHBondContact O-N 3.4Å; T29-T31 PolarHBondContact O-N 3.13Å
30	T	34.4	Very low	38.4	Very low	50 Å²	50	69.6 Å²	69.6	31%	0.307	42%	0.419	S	S	.	.			trans	-86.7	112.9	-177.3	-47.3	0	0	0	0	110.7	I26 P27 I32	I26-T30 VanDerWaalsContact CG2-CB 3.48Å; I26-T30 HydrophobicContact CG2-CG2 4.22Å; P27-T30 WeakPolarHBondContact CB-OG1 3.41Å; P27-T30 VanDerWaalsContact CD-OG1 3.28Å; P27-T30 WeakPolarHBondContact CD-OG1 3.47Å; P27-T30 WeakPolarHBondContact O-CB 3.41Å; P27-T30 PolarHBondContact O-N 2.9Å; P27-T30 PolarHBondContact O-OG1 3.44Å; T30-I32 HydrophobicContact CG2-CG1 4.46Å
31	T	36.8	Very low	38	Very low	88 Å²	88	65.6 Å²	65.6	54%	0.54	39%	0.39	S	S	.	.			trans	-77.8	120.9	166.3	-46.6	0	0	0	0	109.1	T29 P33	T29-T31 PolarHBondContact O-N 3.13Å; T31-P33 WeakPolarHBondContact O-CD 3.45Å
32	I	38.7	Very low	38	Very low	25 Å²	25	65.8 Å²	65.8	13%	0.128	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	111.5	174.9	-60.6	164	0	0	0	108.3	F22 I26 T30 I34 L41	F22-I32 HydrophobicContact CE1-CD1 3.85Å; F22-I32 HydrophobicContact CZ-CD1 3.57Å; I26-I32 HydrophobicContact CD1-CD1 3.81Å; I26-I32 HydrophobicContact CG1-CD1 4.36Å; T30-I32 HydrophobicContact CG2-CG1 4.46Å; I32-I34 PolarHBondContact O-N 3.02Å; I32-L41 HydrophobicContact CG2-CD1 4.39Å
33	P	32.2	Very low	37.7	Very low	64 Å²	64	67.9 Å²	67.9	42%	0.416	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.3	123.8	175.3	24	-29.3	0	0	0	110.2	T31 S35 S36	T31-P33 WeakPolarHBondContact O-CD 3.45Å; P33-S35 PolarHBondContact O-N 3.49Å; P33-S36 PolarHBondContact O-OG 3.4Å
34	I	33.8	Very low	37.2	Very low	50 Å²	50	71.5 Å²	71.5	26%	0.256	43%	0.428	S	S	.	.	G	3₁₀ helix	trans	-64	-33.5	-177.4	-69.3	163.4	0	0	0	111	I32 S36 H37 T38 L41	I32-I34 PolarHBondContact O-N 3.02Å; I34-S36 PolarHBondContact O-N 3.32Å; I34-S36 VanDerWaalsContact O-N 3.15Å; I34-H37 CarbonylContact O-C 3.41Å; I34-H37 PolarHBondContact O-N 3.08Å; I34-T38 HydrophobicContact CG2-CG2 4.36Å; I34-T38 WeakPolarHBondContact O-CA 3.46Å; I34-T38 PolarHBondContact O-N 3.23Å; I34-T38 PolarHBondContact O-OG1 3.3Å; I34-L41 HydrophobicContact CG1-CD1 4.27Å
35	S	34.1	Very low	36.9	Very low	105 Å²	105	68.4 Å²	68.4	73%	0.734	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-62.6	-23.9	-173.9	57.9	0	0	0	0	114.4	P33 T38	P33-S35 PolarHBondContact O-N 3.49Å; S35-T38 PolarHBondContact O-OG1 3.16Å
36	S	38.7	Very low	36.9	Very low	68 Å²	68	64.7 Å²	64.7	48%	0.476	38%	0.381	S	S	.	.	G	3₁₀ helix	trans	-87.5	-10.9	175.6	56.2	0	0	0	0	113.9	P33 I34	P33-S36 PolarHBondContact O-OG 3.4Å; I34-S36 PolarHBondContact O-N 3.32Å; I34-S36 VanDerWaalsContact O-N 3.15Å
37	H	39.7	Very low	36.6	Very low	21 Å²	21	69 Å²	69	10%	0.097	40%	0.404	C	S	.	.	T	Hydrogen-bonded Turn	trans	-136.8	20.9	-173	-58.2	-70.7	0	0	0	113.1	D12 I34 N39 C40 L41	D12-H37 IonicContact OD1-CE1 3.84Å; D12-H37 IonicContact OD1-CG 3.9Å; D12-H37 IonicContact OD1-ND1 2.91Å; D12-H37 PolarHBondContact OD1-ND1 3.46Å; I34-H37 CarbonylContact O-C 3.41Å; I34-H37 PolarHBondContact O-N 3.08Å; H37-N39 PolarHBondContact O-N 2.62Å; H37-C40 PolarHBondContact O-N 3.23Å; H37-L41 HydrophobicContact CB-CD1 3.99Å; H37-L41 HydrophobicContact CB-CG 4.23Å; H37-L41 PolarHBondContact O-N 3.02Å
38	T	31.8	Very low	36.7	Very low	60 Å²	60	69.1 Å²	69.1	37%	0.368	41%	0.407	S	S	.	.	H	α-helix	trans	-51.8	-38	-172.1	-31	0	0	0	0	112	I34 S35 C40 T42	I34-T38 HydrophobicContact CG2-CG2 4.36Å; I34-T38 WeakPolarHBondContact O-CA 3.46Å; I34-T38 PolarHBondContact O-N 3.23Å; I34-T38 PolarHBondContact O-OG1 3.3Å; S35-T38 PolarHBondContact O-OG1 3.16Å; T38-C40 PolarHBondContact O-N 3Å; T38-T42 HydrophobicContact CG2-CG2 3.84Å; T38-T42 VanDerWaalsContact O-CB 3.3Å; T38-T42 WeakPolarHBondContact O-CB 3.46Å; T38-T42 WeakPolarHBondContact O-CG2 3.49Å; T38-T42 PolarHBondContact O-N 3.04Å; T38-T42 PolarHBondContact O-OG1 3.27Å
39	N	38.8	Very low	36.5	Very low	153 Å²	153	66.9 Å²	66.9	82%	0.818	40%	0.398	S	S	*	.	H	α-helix	trans	-69.6	-31	-179.4	-69.7	-11.4	0	0	0	113.5	H37	H37-N39 PolarHBondContact O-N 2.62Å
40	C	37.8	Very low	36.5	Very low	14 Å²	14	62.2 Å²	62.2	10%	0.095	37%	0.368	C	S	.	.	H	α-helix	trans	-86	-34.8	-178.1	-60.5	0	0	0	0	111.5	D12 I15 H37 T38 F45	D12-C40 VanDerWaalsContact CB-SG 3.5Å; D12-C40 PolarHBondContact OD1-SG 3.3Å; I15-C40 HydrophobicContact CG2-CB 4.11Å; H37-C40 PolarHBondContact O-N 3.23Å; T38-C40 PolarHBondContact O-N 3Å; C40-F45 WeakPolarHBondContact O-CB 3.49Å
41	L	36.9	Very low	36.4	Very low	11 Å²	11	63 Å²	63	6%	0.058	37%	0.374	C	S	.	.	I	π-helix	trans	-87.2	-21	-174.1	-66.8	174.6	0	0	0	114.2	I32 I34 H37 F45 V46	I32-L41 HydrophobicContact CG2-CD1 4.39Å; I34-L41 HydrophobicContact CG1-CD1 4.27Å; H37-L41 HydrophobicContact CB-CD1 3.99Å; H37-L41 HydrophobicContact CB-CG 4.23Å; H37-L41 PolarHBondContact O-N 3.02Å; L41-F45 HydrophobicContact CD2-CB 4.28Å; L41-F45 HydrophobicContact CD2-CD1 3.6Å; L41-F45 HydrophobicContact CD2-CE1 4.04Å; L41-F45 HydrophobicContact CD2-CG 3.96Å; L41-V46 WeakPolarHBondContact O-CG2 3.12Å
42	T	41.5	Very low	36	Very low	90 Å²	90	63.7 Å²	63.7	55%	0.552	37%	0.374	S	S	*	.	I	π-helix	trans	-83.7	-14.8	-165.3	46.3	0	0	0	0	117.3	T38	T38-T42 HydrophobicContact CG2-CG2 3.84Å; T38-T42 VanDerWaalsContact O-CB 3.3Å; T38-T42 WeakPolarHBondContact O-CB 3.46Å; T38-T42 WeakPolarHBondContact O-CG2 3.49Å; T38-T42 PolarHBondContact O-N 3.04Å; T38-T42 PolarHBondContact O-OG1 3.27Å
43	S	37.3	Very low	35.4	Very low	63 Å²	63	66 Å²	66	44%	0.441	39%	0.392	S	S	.	.	I	π-helix	trans	-143	-47.2	179	73.2	0	0	0	0	114.8	N47	S43-N47 VanDerWaalsContact O-CB 3.22Å; S43-N47 WeakPolarHBondContact O-CB 3.47Å; S43-N47 VanDerWaalsContact O-CG 3.27Å; S43-N47 PolarHBondContact O-N 3.37Å; S43-N47 PolarHBondContact O-ND2 2.98Å
44	Q	37.6	Very low	35.2	Very low	124 Å²	124	69.1 Å²	69.1	58%	0.579	40%	0.396	S	S	*	.	I	π-helix	trans	-79	-49.8	-178.1	-69.6	-176.6	-3.7	0	0	110.6	V46 N47 S48	Q44-V46 PolarHBondContact O-N 3.14Å; Q44-N47 PolarHBondContact O-N 3.04Å; Q44-S48 WeakPolarHBondContact O-CB 3.23Å; Q44-S48 PolarHBondContact O-N 2.95Å; Q44-S48 PolarHBondContact O-OG 3.08Å
45	F	36.9	Very low	34.8	Very low	12 Å²	12	70 Å²	70	5%	0.053	40%	0.401	C	S	.	.	I	π-helix	trans	-62.2	-46.1	-176.4	-168.1	-98.7	0	0	0	113	I15 P19 F22 L23 C40 L41 I49	I15-F45 HydrophobicContact CB-CD2 4.5Å; I15-F45 HydrophobicContact CG2-CB 4.28Å; I15-F45 HydrophobicContact CG2-CD2 3.33Å; I15-F45 HydrophobicContact CG2-CE2 3.78Å; I15-F45 HydrophobicContact CG2-CG 3.98Å; P19-F45 HydrophobicContact CB-CD2 4.07Å; P19-F45 HydrophobicContact CB-CE2 3.85Å; F22-F45 HydrophobicContact CD1-CE2 4.03Å; F22-F45 AromaticContact CD1-CZ 4Å; F22-F45 HydrophobicContact CD1-CZ 4Å; F22-F45 HydrophobicContact CE1-CZ 4.33Å; L23-F45 HydrophobicContact CD1-CZ 4.13Å; L23-F45 HydrophobicContact CD2-CZ 4.33Å; L23-F45 HydrophobicContact CG-CZ 4.1Å; C40-F45 WeakPolarHBondContact O-CB 3.49Å; L41-F45 HydrophobicContact CD2-CB 4.28Å; L41-F45 HydrophobicContact CD2-CD1 3.6Å; L41-F45 HydrophobicContact CD2-CE1 4.04Å; L41-F45 HydrophobicContact CD2-CG 3.96Å; F45-I49 HydrophobicContact CD1-CD1 4.07Å; F45-I49 HydrophobicContact CD2-CD1 3.4Å; F45-I49 HydrophobicContact CE1-CD1 3.82Å; F45-I49 HydrophobicContact CE2-CD1 3.14Å; F45-I49 HydrophobicContact CG-CD1 3.89Å; F45-I49 HydrophobicContact CZ-CD1 3.37Å; F45-I49 PolarHBondContact O-N 2.88Å
46	V	37.1	Very low	34.4	Very low	37 Å²	37	71.2 Å²	71.2	22%	0.224	40%	0.399	C	S	.	.	H	α-helix	trans	-63.3	-50.5	177.3	172.5	0	0	0	0	110.5	L41 Q44 S48 L50 L55	L41-V46 WeakPolarHBondContact O-CG2 3.12Å; Q44-V46 PolarHBondContact O-N 3.14Å; V46-S48 PolarHBondContact O-N 3.47Å; V46-L50 HydrophobicContact CG1-CD1 4.33Å; V46-L50 CarbonylContact O-C 3.45Å; V46-L50 WeakPolarHBondContact O-CA 3.34Å; V46-L50 VanDerWaalsContact O-CB 3.26Å; V46-L50 WeakPolarHBondContact O-CB 3.22Å; V46-L50 PolarHBondContact O-N 3.47Å; V46-L55 HydrophobicContact CG1-CD1 4.09Å
47	N	33.6	Very low	33.6	Very low	109 Å²	109	74 Å²	74	58%	0.583	41%	0.409	S	S	*	.	H	α-helix	trans	-71.5	-26.9	-177.7	-68.1	-28.3	0	0	0	114.1	S43 Q44	S43-N47 VanDerWaalsContact O-CB 3.22Å; S43-N47 WeakPolarHBondContact O-CB 3.47Å; S43-N47 VanDerWaalsContact O-CG 3.27Å; S43-N47 PolarHBondContact O-N 3.37Å; S43-N47 PolarHBondContact O-ND2 2.98Å; Q44-N47 PolarHBondContact O-N 3.04Å
48	S	37	Very low	32.8	Very low	88 Å²	88	78 Å²	78	62%	0.615	43%	0.434	S	S	*	.	H	α-helix	trans	-81	-25.1	-176.6	-51.3	0	0	0	0	113	Q44 V46	Q44-S48 WeakPolarHBondContact O-CB 3.23Å; Q44-S48 PolarHBondContact O-N 2.95Å; Q44-S48 PolarHBondContact O-OG 3.08Å; V46-S48 PolarHBondContact O-N 3.47Å
49	I	37.6	Very low	32.4	Very low	48 Å²	48	79.9 Å²	79.9	25%	0.246	45%	0.447	C	S	.	.	H	α-helix	trans	-120.4	-31.8	-172.9	-51.6	166.5	0	0	0	112	P19 L23 F45 P51	P19-I49 HydrophobicContact CB-CD1 3.28Å; P19-I49 HydrophobicContact CB-CG1 3.86Å; P19-I49 HydrophobicContact CG-CD1 4.33Å; P19-I49 HydrophobicContact CG-CG1 4.44Å; L23-I49 HydrophobicContact CD1-CD1 3.74Å; L23-I49 HydrophobicContact CD1-CG2 3.73Å; F45-I49 HydrophobicContact CD1-CD1 4.07Å; F45-I49 HydrophobicContact CD2-CD1 3.4Å; F45-I49 HydrophobicContact CE1-CD1 3.82Å; F45-I49 HydrophobicContact CE2-CD1 3.14Å; F45-I49 HydrophobicContact CG-CD1 3.89Å; F45-I49 HydrophobicContact CZ-CD1 3.37Å; F45-I49 PolarHBondContact O-N 2.88Å; I49-P51 WeakPolarHBondContact O-CD 3.48Å
50	L	34	Very low	31.8	Very low	26 Å²	26	82.5 Å²	82.5	14%	0.136	45%	0.447	C	S	.	.			trans	-104	93.2	174.9	-64.1	158.6	0	0	0	106.9	V46 L52 L55 L75	V46-L50 HydrophobicContact CG1-CD1 4.33Å; V46-L50 CarbonylContact O-C 3.45Å; V46-L50 WeakPolarHBondContact O-CA 3.34Å; V46-L50 VanDerWaalsContact O-CB 3.26Å; V46-L50 WeakPolarHBondContact O-CB 3.22Å; V46-L50 PolarHBondContact O-N 3.47Å; L50-L52 PolarHBondContact O-N 3.33Å; L50-L52 VanDerWaalsContact O-N 3.07Å; L50-L55 HydrophobicContact CB-CD1 4.43Å; L50-L55 HydrophobicContact CD1-CD1 4.34Å; L50-L75 HydrophobicContact CD2-CD1 4.11Å
51	P	32.9	Very low	31.2	Very low	67 Å²	67	87.1 Å²	87.1	44%	0.435	48%	0.477	S	S	.	.			trans	-46.3	126.6	155	-20.9	29.8	0	0	0	106.6	I49 S53 Y54	I49-P51 WeakPolarHBondContact O-CD 3.48Å; P51-S53 WeakPolarHBondContact CB-OG 3.41Å; P51-S53 PolarHBondContact O-N 3.25Å; P51-Y54 HydrophobicContact CB-CD2 4.16Å; P51-Y54 HydrophobicContact CG-CD2 4Å; P51-Y54 HydrophobicContact CG-CE2 4.23Å; P51-Y54 WeakPolarHBondContact O-CB 3.23Å; P51-Y54 PolarHBondContact O-N 3.42Å
52	L	27.2	Very low	30.5	Very low	102 Å²	102	90.5 Å²	90.5	53%	0.534	50%	0.501	S	S	.	.	T	Hydrogen-bonded Turn	trans	-51.7	-21	-176.6	-146.4	83.1	0	0	0	112.4	L50 Y54 L55 L56	L50-L52 PolarHBondContact O-N 3.33Å; L50-L52 VanDerWaalsContact O-N 3.07Å; L52-Y54 VanDerWaalsContact C-N 3.27Å; L52-Y54 PolarHBondContact O-N 3.13Å; L52-L55 PolarHBondContact O-N 3.33Å; L52-L56 HydrophobicContact CD2-CD1 4.21Å; L52-L56 HydrophobicContact CG-CD1 4.35Å; L52-L56 PolarHBondContact O-N 3.06Å
53	S	26.1	Very low	29.8	Very low	73 Å²	73	93.5 Å²	93.5	51%	0.51	52%	0.52	S	S	.	.	H	α-helix	trans	-58.2	-29.8	170.4	53.5	0	0	0	0	114.5	P51 L55 N57	P51-S53 WeakPolarHBondContact CB-OG 3.41Å; P51-S53 PolarHBondContact O-N 3.25Å; S53-L55 VanDerWaalsContact C-N 3.31Å; S53-N57 PolarHBondContact O-N 2.9Å
54	Y	28.8	Very low	29.2	Very low	130 Å²	130	95.2 Å²	95.2	51%	0.51	53%	0.528	S	S	.	.	H	α-helix	trans	-72.5	-23.5	172.7	-83.6	-91.9	0	0	0	112.9	P51 L52	P51-Y54 HydrophobicContact CB-CD2 4.16Å; P51-Y54 HydrophobicContact CG-CD2 4Å; P51-Y54 HydrophobicContact CG-CE2 4.23Å; P51-Y54 WeakPolarHBondContact O-CB 3.23Å; P51-Y54 PolarHBondContact O-N 3.42Å; L52-Y54 VanDerWaalsContact C-N 3.27Å; L52-Y54 PolarHBondContact O-N 3.13Å
55	L	26.4	Very low	28.5	Very low	69 Å²	69	95.8 Å²	95.8	36%	0.361	54%	0.535	S	S	.	.	H	α-helix	trans	-91.5	-27.2	-179.2	-78.6	167.9	0	0	0	113.7	V46 L50 L52 S53 P77	V46-L55 HydrophobicContact CG1-CD1 4.09Å; L50-L55 HydrophobicContact CB-CD1 4.43Å; L50-L55 HydrophobicContact CD1-CD1 4.34Å; L52-L55 PolarHBondContact O-N 3.33Å; S53-L55 VanDerWaalsContact C-N 3.31Å; L55-P77 HydrophobicContact CD2-CG 4.1Å
56	L	24.4	Very low	27.9	Very low	131 Å²	131	102.6 Å²	102.6	69%	0.686	57%	0.567	S	S	*	*	H	α-helix	trans	-130.9	-4.7	-164.7	-76.1	166.8	0	0	0	116.9	L52	L52-L56 HydrophobicContact CD2-CD1 4.21Å; L52-L56 HydrophobicContact CG-CD1 4.35Å; L52-L56 PolarHBondContact O-N 3.06Å
57	N	22.6	Very low	27.2	Very low	127 Å²	127	105.5 Å²	105.5	68%	0.679	58%	0.58	S	S	*	*			trans	-129.8	46.9	-169	-108.3	13.2	0	0	0	115.7	S53 P59	S53-N57 PolarHBondContact O-N 2.9Å; N57-P59 VanDerWaalsContact O-CD 3.25Å; N57-P59 WeakPolarHBondContact O-CD 3.48Å
58	V	23.3	Very low	26.8	Very low	104 Å²	104	107.3 Å²	107.3	63%	0.63	59%	0.59	S	S	*	*			trans	-108.7	80.1	154.4	-167.5	0	0	0	0	108.7	Y60	V58-Y60 PolarHBondContact O-N 2.96Å; V58-Y60 VanDerWaalsContact O-N 3.15Å
59	P	23.4	Very low	26.2	Very low	99 Å²	99	106.8 Å²	106.8	64%	0.643	58%	0.58	S	S	*	*			trans	-61.8	116.7	160.3	26.6	-29.5	0	0	0	107	N57 P61	N57-P59 VanDerWaalsContact O-CD 3.25Å; N57-P59 WeakPolarHBondContact O-CD 3.48Å; P59-P61 WeakPolarHBondContact O-CD 3.41Å
60	Y	26.3	Very low	25.8	Very low	208 Å²	208	110 Å²	110	82%	0.816	60%	0.602	S	S	*	*			trans	-63.5	114.9	167	-88.6	-100.7	0	0	0	108.7	V58	V58-Y60 PolarHBondContact O-N 2.96Å; V58-Y60 VanDerWaalsContact O-N 3.15Å
61	P	24.3	Very low	25.7	Very low	112 Å²	112	113.5 Å²	113.5	73%	0.727	62%	0.62	S	S	*	*			trans	-150.3	103.7	131.3	35.6	-16.8	0	0	0	112.8	P59	P59-P61 WeakPolarHBondContact O-CD 3.41Å
62	S	23	Very low	25.8	Very low	81 Å²	81	113.9 Å²	113.9	57%	0.566	62%	0.623	S	S	*	*			trans	176	139.7	136.9	57.8	0	0	0	0	109.4	T64	S62-T64 PolarHBondContact O-N 3.35Å; S62-T64 PolarHBondContact OG-O 3.16Å
63	T	25.4	Very low	26.1	Very low	153 Å²	153	110.8 Å²	110.8	94%	0.939	61%	0.608	S	S	*	*	S	Bend	trans	-68.3	13.6	-176.2	40.5	0	0	0	0	115.1
64	T	24.7	Very low	26.5	Very low	100 Å²	100	108.8 Å²	108.8	61%	0.613	60%	0.596	S	S	*	*			trans	-150.5	149.7	176.8	31.9	0	0	0	0	106	S62	S62-T64 PolarHBondContact O-N 3.35Å; S62-T64 PolarHBondContact OG-O 3.16Å
65	N	23.4	Very low	26.6	Very low	136 Å²	136	104.8 Å²	104.8	73%	0.727	58%	0.583	S	S	*	*			trans	107.2	72.1	178.3	-50.6	-28.2	0	0	0	114.6	I67	N65-I67 PolarHBondContact O-N 2.99Å
66	E	23.7	Very low	26.8	Very low	155 Å²	155	106.2 Å²	106.2	72%	0.724	59%	0.587	S	S	*	*				5.3	105.7	125	-62.9	175.3	174.2	0	0	115.1	N68	E66-N68 PolarHBondContact O-N 3.3Å
67	I	23	Very low	27.1	Very low	97 Å²	97	104.3 Å²	104.3	50%	0.497	58%	0.582	S	S	.	*			trans	-73.6	94.9	167.4	-57.9	175.1	0	0	0	106.8	N65 N69	N65-I67 PolarHBondContact O-N 2.99Å; I67-N69 HydrophobicContact CG2-CB 3.89Å; I67-N69 PolarHBondContact O-N 3.04Å
68	N	24.7	Very low	27.3	Very low	148 Å²	148	102.3 Å²	102.3	79%	0.791	57%	0.571	S	S	*	*			trans	-77.7	54.8	174	-144.2	4.1	0	0	0	110.2	E66 T70	E66-N68 PolarHBondContact O-N 3.3Å; N68-T70 PolarHBondContact O-N 3.42Å
69	N	25	Very low	27.6	Very low	76 Å²	76	105.9 Å²	105.9	41%	0.406	59%	0.587	S	S	.	*			trans	-86.4	103.9	170.9	-101.9	-33.6	0	0	0	107.7	I67 L71	I67-N69 HydrophobicContact CG2-CB 3.89Å; I67-N69 PolarHBondContact O-N 3.04Å; N69-L71 PolarHBondContact O-N 2.55Å
70	T	30.3	Very low	27.8	Very low	115 Å²	115	109.3 Å²	109.3	71%	0.706	59%	0.594	S	S	*	*			trans	-72	15	175.3	45.3	0	0	0	0	113.7	N68 P72	N68-T70 PolarHBondContact O-N 3.42Å; T70-P72 WeakPolarHBondContact O-CD 3.37Å
71	L	30.3	Very low	27.9	Very low	100 Å²	100	99.5 Å²	99.5	52%	0.524	56%	0.556	S	S	.	*			trans	-79.2	116.4	161.6	-87.5	110.2	0	0	0	108.2	N69 T73	N69-L71 PolarHBondContact O-N 2.55Å; L71-T73 PolarHBondContact O-N 2.8Å
72	P	35.5	Very low	28.4	Very low	75 Å²	75	95.6 Å²	95.6	49%	0.487	53%	0.529	S	S	.	.	S	Bend	trans	-67.9	1.1	-173.9	25.1	-33	0	0	0	114.6	T70 H87	T70-P72 WeakPolarHBondContact O-CD 3.37Å; P72-H87 PolarHBondContact O-N 3.37Å
73	T	34.5	Very low	28.8	Very low	38 Å²	38	95.4 Å²	95.4	23%	0.233	52%	0.519	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	115	-174.9	-10.2	0	0	0	0	110.5	L71 L84 L85	L71-T73 PolarHBondContact O-N 2.8Å; T73-L84 HydrophobicContact CG2-CB 3.75Å; T73-L84 HydrophobicContact CG2-CD2 3.6Å; T73-L84 HydrophobicContact CG2-CG 4.3Å; T73-L85 WeakPolarHBondContact CA-O 3.45Å; T73-L85 WeakPolarHBondContact CG2-O 3.26Å
74	A	33	Very low	29.2	Very low	31 Å²	31	88.9 Å²	88.9	26%	0.256	48%	0.479	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	129.8	167.7	0	0	0	0	0	108.5	F76 L85	A74-F76 HydrophobicContact CB-CD2 4.28Å; A74-F76 HydrophobicContact CB-CE2 3.65Å; A74-F76 HydrophobicContact CB-CZ 4.24Å; A74-L85 PolarHBondContact N-O 2.9Å; A74-L85 PolarHBondContact O-N 2.9Å
75	L	31.6	Very low	29.5	Very low	45 Å²	45	87.7 Å²	87.7	24%	0.236	47%	0.468	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.5	108.9	177.2	-71.5	156.7	0	0	0	108.3	L23 L50 P77 I82 L84	L23-L75 HydrophobicContact CD2-CD1 4.38Å; L23-L75 HydrophobicContact CD2-CD2 4.34Å; L50-L75 HydrophobicContact CD2-CD1 4.11Å; L75-P77 WeakPolarHBondContact O-CD 3.38Å; L75-I82 HydrophobicContact CB-CG2 3.93Å; L75-I82 HydrophobicContact CD2-CG2 3.5Å; L75-I82 VanDerWaalsContact CD2-CG2 3.5Å; L75-I82 HydrophobicContact CG-CG2 4.34Å; L75-L84 HydrophobicContact CD2-CD2 3.32Å; L75-L84 HydrophobicContact CD2-CG 3.98Å; L75-L84 HydrophobicContact CG-CD2 4.05Å
76	F	31.1	Very low	29.9	Very low	99 Å²	99	85.8 Å²	85.8	43%	0.434	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	116.9	175.9	-72.9	-87	0	0	0	110.2	A74 L78 I82 E83 L85	A74-F76 HydrophobicContact CB-CD2 4.28Å; A74-F76 HydrophobicContact CB-CE2 3.65Å; A74-F76 HydrophobicContact CB-CZ 4.24Å; F76-L78 PolarHBondContact O-N 3.39Å; F76-I82 WeakPolarHBondContact O-CA 3.31Å; F76-E83 PolarHBondContact N-O 3.46Å; F76-E83 PolarHBondContact O-N 3.21Å; F76-L85 HydrophobicContact CD2-CB 4.36Å; F76-L85 HydrophobicContact CD2-CD1 3.71Å; F76-L85 HydrophobicContact CD2-CG 4.08Å; F76-L85 HydrophobicContact CE2-CB 4.29Å; F76-L85 HydrophobicContact CE2-CD1 3.73Å; F76-L85 HydrophobicContact CE2-CG 4.33Å
77	P	30.6	Very low	30.3	Very low	91 Å²	91	83 Å²	83	59%	0.591	44%	0.441	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-69.8	119.9	171.4	27.9	-31.4	0	0	0	109.4	L55 L75	L55-P77 HydrophobicContact CD2-CG 4.1Å; L75-P77 WeakPolarHBondContact O-CD 3.38Å
78	L	27.3	Very low	30.4	Very low	86 Å²	86	85 Å²	85	45%	0.45	45%	0.45	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.7	157	169.9	-64.9	174.6	0	0	0	109.4	F76 Q80 G81 E83	F76-L78 PolarHBondContact O-N 3.39Å; L78-Q80 PolarHBondContact O-N 3.3Å; L78-G81 WeakPolarHBondContact CA-O 3.45Å; L78-G81 PolarHBondContact N-O 2.91Å; L78-G81 PolarHBondContact O-N 3.03Å; L78-G81 VanDerWaalsContact O-N 3.14Å; L78-E83 HydrophobicContact CD1-CB 3.84Å; L78-E83 HydrophobicContact CG-CB 4.44Å
79	N	28.8	Very low	30.4	Very low	178 Å²	178	81.9 Å²	81.9	95%	0.952	45%	0.453	S	S	*	.	T	Hydrogen-bonded Turn	trans	-54.5	-14.6	178.6	-77.9	-18	0	0	0	114.6
80	Q	27.1	Very low	30.3	Very low	172 Å²	172	85.1 Å²	85.1	80%	0.804	47%	0.468	S	S	*	.	T	Hydrogen-bonded Turn	trans	-133	6.6	179.9	-61.6	-173.8	-9.5	0	0	114.3	L78	L78-Q80 PolarHBondContact O-N 3.3Å
81	G	28.7	Very low	30	Very low	2 Å²	2	84.5 Å²	84.5	2%	0.021	46%	0.464	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-176.5	179.9	-169.4	0	0	0	0	0	114.5	L78	L78-G81 WeakPolarHBondContact CA-O 3.45Å; L78-G81 PolarHBondContact N-O 2.91Å; L78-G81 PolarHBondContact O-N 3.03Å; L78-G81 VanDerWaalsContact O-N 3.14Å
82	I	35.3	Very low	29.7	Very low	30 Å²	30	85.3 Å²	85.3	15%	0.154	47%	0.469	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116	127.9	163.4	-55.8	170.7	0	0	0	107.3	L75 F76	L75-I82 HydrophobicContact CB-CG2 3.93Å; L75-I82 HydrophobicContact CD2-CG2 3.5Å; L75-I82 VanDerWaalsContact CD2-CG2 3.5Å; L75-I82 HydrophobicContact CG-CG2 4.34Å; F76-I82 WeakPolarHBondContact O-CA 3.31Å
83	E	30.3	Very low	29.1	Very low	76 Å²	76	87.6 Å²	87.6	36%	0.355	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	128.2	173	-168.8	171.3	-169.5	0	0	109.7	F76 L78 L85	F76-E83 PolarHBondContact N-O 3.46Å; F76-E83 PolarHBondContact O-N 3.21Å; L78-E83 HydrophobicContact CD1-CB 3.84Å; L78-E83 HydrophobicContact CG-CB 4.44Å; E83-L85 HydrophobicContact CG-CD2 4.01Å; E83-L85 HydrophobicContact CG-CG 4.32Å
84	L	34	Very low	28.5	Very low	17 Å²	17	92 Å²	92	9%	0.089	51%	0.508	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.3	106.5	175.5	-77.1	159.8	0	0	0	107.5	I26 Q28 T73 L75	I26-L84 HydrophobicContact CB-CD1 4.1Å; I26-L84 HydrophobicContact CD1-CD1 4.15Å; I26-L84 HydrophobicContact CG2-CD1 3.48Å; I26-L84 VanDerWaalsContact CG2-CD1 3.48Å; Q28-L84 VanDerWaalsContact O-O 3.07Å; T73-L84 HydrophobicContact CG2-CB 3.75Å; T73-L84 HydrophobicContact CG2-CD2 3.6Å; T73-L84 HydrophobicContact CG2-CG 4.3Å; L75-L84 HydrophobicContact CD2-CD2 3.32Å; L75-L84 HydrophobicContact CD2-CG 3.98Å; L75-L84 HydrophobicContact CG-CD2 4.05Å
85	L	30.8	Very low	28.1	Very low	74 Å²	74	98.9 Å²	98.9	39%	0.387	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.8	127.1	175.9	-66.2	179.9	0	0	0	110.2	T73 A74 F76 E83 H87	T73-L85 WeakPolarHBondContact CA-O 3.45Å; T73-L85 WeakPolarHBondContact CG2-O 3.26Å; A74-L85 PolarHBondContact N-O 2.9Å; A74-L85 PolarHBondContact O-N 2.9Å; F76-L85 HydrophobicContact CD2-CB 4.36Å; F76-L85 HydrophobicContact CD2-CD1 3.71Å; F76-L85 HydrophobicContact CD2-CG 4.08Å; F76-L85 HydrophobicContact CE2-CB 4.29Å; F76-L85 HydrophobicContact CE2-CD1 3.73Å; F76-L85 HydrophobicContact CE2-CG 4.33Å; E83-L85 HydrophobicContact CG-CD2 4.01Å; E83-L85 HydrophobicContact CG-CG 4.32Å; L85-H87 PolarHBondContact O-N 2.86Å
86	Q	33.1	Very low	27.6	Very low	96 Å²	96	100.1 Å²	100.1	45%	0.449	56%	0.558	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-59	118.7	168.4	-80.2	180	-11.1	0	0	109.2	Q28 M88	Q28-Q86 HydrophobicContact CB-CG 3.94Å; Q28-Q86 HydrophobicContact CG-CG 4.44Å; Q86-M88 PolarHBondContact O-N 3.35Å
87	H	30.7	Very low	27.3	Very low	96 Å²	96	104.6 Å²	104.6	44%	0.444	58%	0.581	S	S	.	*			trans	-74.8	75.8	163.9	-105	-127.9	0	0	0	108.4	P72 L85 G89	P72-H87 PolarHBondContact O-N 3.37Å; L85-H87 PolarHBondContact O-N 2.86Å; H87-G89 PolarHBondContact O-N 2.78Å
88	M	24.8	Very low	26.8	Very low	140 Å²	140	105.6 Å²	105.6	69%	0.69	59%	0.59	S	S	*	*			trans	-65.8	119.3	158.8	-75.8	-104.4	-75.3	0	0	106.1	Q86 M90	Q86-M88 PolarHBondContact O-N 3.35Å; M88-M90 VanDerWaalsContact C-N 3.32Å; M88-M90 PolarHBondContact O-N 2.92Å
89	G	26.1	Very low	26.6	Very low	82 Å²	82	109.2 Å²	109.2	85%	0.845	61%	0.609	S	S	*	*			trans	-51.6	91.1	-176.8	0	0	0	0	0	112.1	H87 T91	H87-G89 PolarHBondContact O-N 2.78Å; G89-T91 PolarHBondContact O-N 3.21Å
90	M	22.7	Very low	26.4	Very low	145 Å²	145	108 Å²	108	71%	0.714	60%	0.602	S	S	*	*			trans	-88.4	86.1	176.3	-79.8	-171.4	-82.4	0	0	108	M88 N92	M88-M90 VanDerWaalsContact C-N 3.32Å; M88-M90 PolarHBondContact O-N 2.92Å; M90-N92 PolarHBondContact O-N 2.89Å
91	T	24.8	Very low	26.2	Very low	101 Å²	101	105.4 Å²	105.4	62%	0.62	60%	0.602	S	S	*	*			trans	-73.8	78.7	154	50	0	0	0	0	107.1	G89 T93	G89-T91 PolarHBondContact O-N 3.21Å; T91-T93 PolarHBondContact O-N 3.22Å; T91-T93 VanDerWaalsContact O-N 3.12Å
92	N	22.6	Very low	26	Very low	118 Å²	118	110.5 Å²	110.5	63%	0.631	64%	0.637	S	S	*	*			trans	-79.2	88.3	173.2	-88.4	-30.5	0	0	0	108.6	M90 V94	M90-N92 PolarHBondContact O-N 2.89Å; N92-V94 VanDerWaalsContact C-N 3.29Å; N92-V94 HydrophobicContact CB-CG2 4.17Å; N92-V94 PolarHBondContact O-N 2.86Å
93	T	23.2	Very low	25.4	Very low	123 Å²	123	115.9 Å²	115.9	76%	0.755	67%	0.665	S	S	*	*			trans	-71.1	93.1	157.8	6.2	0	0	0	0	107.2	T91 E95	T91-T93 PolarHBondContact O-N 3.22Å; T91-T93 VanDerWaalsContact O-N 3.12Å; T93-E95 PolarHBondContact O-N 3.22Å
94	V	23	Very low	25	Very low	131 Å²	131	118 Å²	118	79%	0.794	69%	0.688	S	S	*	*			trans	-76.5	74.1	175.6	-170.2	0	0	0	0	108.3	N92	N92-V94 VanDerWaalsContact C-N 3.29Å; N92-V94 HydrophobicContact CB-CG2 4.17Å; N92-V94 PolarHBondContact O-N 2.86Å
95	E	22.7	Very low	24.4	Very low	175 Å²	175	125.8 Å²	125.8	82%	0.818	72%	0.724	S	S	*	*			trans	-90	122.1	157.9	-78.1	-170.6	157.5	0	0	107.7	T93 Q97	T93-E95 PolarHBondContact O-N 3.22Å; E95-Q97 PolarHBondContact O-N 2.93Å; E95-Q97 VanDerWaalsContact O-N 3.12Å
96	G	22.6	Very low	24.1	Very low	71 Å²	71	127.5 Å²	127.5	73%	0.732	74%	0.742	S	S	*	*			trans	-45.5	118.6	-170.9	0	0	0	0	0	112.5	S98	G96-S98 PolarHBondContact O-N 3.4Å
97	Q	23.3	Very low	23.6	Very low	193 Å²	193	128.8 Å²	128.8	90%	0.902	76%	0.761	S	S	*	*	S	Bend	trans	19.4	84.7	159.4	-73.9	177.9	-47	0	0	115.4	E95	E95-Q97 PolarHBondContact O-N 2.93Å; E95-Q97 VanDerWaalsContact O-N 3.12Å
98	S	21.2	Very low	23.4	Very low	112 Å²	112	129.1 Å²	129.1	78%	0.783	78%	0.775	S	S	*	*	S	Bend	trans	-165.8	103.5	152.8	-79	0	0	0	0	111.6	G96	G96-S98 PolarHBondContact O-N 3.4Å
99	N	23.3	Very low	23.3	Very low	161 Å²	161	129 Å²	129	86%	0.861	78%	0.776	S	S	*	*			trans	50.7	74.3	156.8	-65.3	-9.4	0	0	0	119.6	S101	N99-S101 PolarHBondContact O-N 3.07Å
100	I	23.8	Very low	23.2	Very low	154 Å²	154	130.5 Å²	130.5	79%	0.79	77%	0.773	S	S	*	*			trans	-74.6	117.4	157.8	-61.3	168.7	0	0	0	108.2
101	S	23.5	Very low	23.4	Very low	117 Å²	117	127.8 Å²	127.8	82%	0.818	76%	0.758	S	S	*	*			trans	-114.7	3.2	-176	48.7	0	0	0	0	115.7	N99	N99-S101 PolarHBondContact O-N 3.07Å
102	S	23.8	Very low	23.3	Very low	108 Å²	108	128.7 Å²	128.7	76%	0.755	77%	0.769	S	S	*	*			trans	-163.3	143.2	162.6	50.8	0	0	0	0	114
103	I	23.1	Very low	23.5	Very low	144 Å²	144	126.7 Å²	126.7	74%	0.738	75%	0.753	S	S	*	*			trans	-107.4	134.6	177.4	-63.5	166.6	0	0	0	106.6
104	S	21.4	Very low	23.5	Very low	119 Å²	119	126.4 Å²	126.4	83%	0.832	75%	0.751	S	S	*	*			trans	-110.9	138.5	173.8	56.5	0	0	0	0	111
105	H	22.5	Very low	23.6	Very low	181 Å²	181	122.8 Å²	122.8	84%	0.838	73%	0.729	S	S	*	*			trans	-96.1	143	-176.2	-64	-81.8	0	0	0	110.9
106	S	23.5	Very low	23.7	Very low	110 Å²	110	118.2 Å²	118.2	77%	0.769	72%	0.716	S	S	*	*			trans	-127.2	126.3	154.9	81.5	0	0	0	0	109.4	S108	S106-S108 PolarHBondContact O-N 2.88Å
107	S	23.5	Very low	24	Very low	123 Å²	123	122 Å²	122	86%	0.86	72%	0.719	S	S	*	*			trans	-84.4	95.7	-174.2	51.4	0	0	0	0	110.8
108	S	25.8	Very low	24.6	Very low	103 Å²	103	119 Å²	119	72%	0.72	72%	0.716	S	S	*	*			trans	-111.5	102.1	169.6	42.6	0	0	0	0	109.6	S106 S110	S106-S108 PolarHBondContact O-N 2.88Å; S108-S110 PolarHBondContact O-N 3.05Å
109	I	23.3	Very low	24.9	Very low	139 Å²	139	119 Å²	119	71%	0.713	72%	0.716	S	S	*	*			trans	-73.7	113.8	178.7	-62.8	169.9	0	0	0	108.3	Q111	I109-Q111 HydrophobicContact CG2-CG 3.95Å; I109-Q111 PolarHBondContact O-N 2.86Å
110	S	24.5	Very low	25.4	Very low	112 Å²	112	113 Å²	113	78%	0.783	69%	0.687	S	S	*	*			trans	-65.8	124.2	166.7	-75.6	0	0	0	0	109.8	S108	S108-S110 PolarHBondContact O-N 3.05Å
111	Q	25.4	Very low	25.6	Very low	88 Å²	88	108.3 Å²	108.3	41%	0.411	67%	0.668	S	S	.	*			trans	-120.4	136.3	177.1	-64.5	-175.4	21.6	0	0	110.4	I109 Y113 S125	I109-Q111 HydrophobicContact CG2-CG 3.95Å; I109-Q111 PolarHBondContact O-N 2.86Å; Q111-Y113 HydrophobicContact CB-CE2 4.47Å; Q111-Y113 WeakPolarHBondContact O-CE2 3.34Å; Q111-S125 PolarHBondContact OE1-OG 3.44Å
112	S	23.7	Very low	26.1	Very low	120 Å²	120	104.7 Å²	104.7	84%	0.839	64%	0.639	S	S	*	*			trans	-97.8	131.5	-176.9	-51.5	0	0	0	0	110.6
113	Y	26.4	Very low	26.5	Very low	76 Å²	76	104.2 Å²	104.2	30%	0.298	63%	0.627	S	S	.	*			trans	-108.6	131.8	-179.7	-61.7	-90.9	0	0	0	110.1	Q111	Q111-Y113 HydrophobicContact CB-CE2 4.47Å; Q111-Y113 WeakPolarHBondContact O-CE2 3.34Å
114	V	24	Very low	27	Very low	117 Å²	117	97.6 Å²	97.6	71%	0.709	59%	0.593	S	S	*	*			trans	-101	112.6	177.3	-179.7	0	0	0	0	108.6
115	V	25	Very low	27.6	Very low	55 Å²	55	93.6 Å²	93.6	33%	0.333	57%	0.565	S	S	.	*			trans	-91.2	117.8	170.9	-179	0	0	0	0	107.6	F140	V115-F140 HydrophobicContact CG1-CD1 4.45Å; V115-F140 HydrophobicContact CG1-CE1 4.34Å; V115-F140 HydrophobicContact CG1-CE2 4.47Å; V115-F140 HydrophobicContact CG1-CZ 4.36Å; V115-F140 HydrophobicContact CG2-CE2 4.37Å
116	S	24	Very low	27.9	Very low	79 Å²	79	88.2 Å²	88.2	55%	0.552	54%	0.543	S	S	*	.			trans	-107	134.5	172.5	-63.9	0	0	0	0	110.1
117	L	29.9	Very low	28.5	Very low	151 Å²	151	84.7 Å²	84.7	79%	0.791	52%	0.52	S	S	*	.	S	Bend	trans	-54.5	-177.8	-179.8	-66.3	86.9	0	0	0	113.7	S119	L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 3.32Å
118	P	34.9	Very low	29.1	Very low	131 Å²	131	85 Å²	85	85%	0.851	52%	0.523	S	S	*	.	S	Bend		-90.2	12.1	-63.9	9.9	10.6	0	0	0	111.3
119	S	28.1	Very low	29.8	Very low	110 Å²	110	81.6 Å²	81.6	77%	0.769	50%	0.496	S	S	*	.	S	Bend	trans	-118.1	68.5	166.5	46.7	0	0	0	0	106.7	L117 S121	L117-S119 VanDerWaalsContact C-N 3.28Å; L117-S119 PolarHBondContact O-N 3.32Å; S119-S121 PolarHBondContact O-N 3.35Å; S119-S121 VanDerWaalsContact O-N 3.1Å
120	S	32.6	Very low	30.5	Very low	36 Å²	36	78.5 Å²	78.5	25%	0.252	48%	0.481	S	S	.	.			trans	-71.6	101.8	-164.6	47.3	0	0	0	0	111.3	T163	S120-T163 PolarHBondContact O-OG1 3.09Å
121	S	29.8	Very low	31.1	Very low	55 Å²	55	75.2 Å²	75.2	39%	0.385	46%	0.457	S	S	.	.			trans	-81.1	117.4	162	57.9	0	0	0	0	108.8	S119 L123	S119-S121 PolarHBondContact O-N 3.35Å; S119-S121 VanDerWaalsContact O-N 3.1Å; S121-L123 PolarHBondContact O-N 3.03Å
122	L	33.9	Very low	31.7	Very low	41 Å²	41	76.9 Å²	76.9	22%	0.215	47%	0.465	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.4	113.3	170.1	-175.6	65.1	0	0	0	108.4	I124 L134 V161	L122-I124 HydrophobicContact CD2-CD1 3.83Å; L122-I124 HydrophobicContact CD2-CG1 3.86Å; L122-I124 HydrophobicContact CG-CD1 4.29Å; L122-I124 HydrophobicContact CG-CG1 3.77Å; L122-I124 PolarHBondContact O-N 3.29Å; L122-L134 HydrophobicContact CD2-CD2 3.82Å; L122-V161 PolarHBondContact O-N 3.15Å
123	L	30.5	Very low	32.4	Very low	98 Å²	98	74.2 Å²	74.2	51%	0.513	44%	0.44	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.5	104.5	173.4	-77	166	0	0	0	108.6	S121	S121-L123 PolarHBondContact O-N 3.03Å
124	I	35.5	Very low	32.9	Very low	5 Å²	5	71.6 Å²	71.6	3%	0.026	43%	0.431	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.9	118.2	177.1	-60.4	-170	0	0	0	108.3	L122 I129 L134 S159 V161	L122-I124 HydrophobicContact CD2-CD1 3.83Å; L122-I124 HydrophobicContact CD2-CG1 3.86Å; L122-I124 HydrophobicContact CG-CD1 4.29Å; L122-I124 HydrophobicContact CG-CG1 3.77Å; L122-I124 PolarHBondContact O-N 3.29Å; I124-I129 HydrophobicContact CG2-CD1 3.05Å; I124-I129 HydrophobicContact CG2-CG1 3.87Å; I124-L134 HydrophobicContact CD1-CD2 3.88Å; I124-S159 PolarHBondContact N-O 3.31Å; I124-S159 PolarHBondContact O-N 3.46Å; I124-V161 HydrophobicContact CB-CG2 4.37Å; I124-V161 HydrophobicContact CD1-CG2 3.45Å; I124-V161 VanDerWaalsContact CD1-CG2 3.45Å; I124-V161 HydrophobicContact CG1-CG2 3.81Å
125	S	32.6	Very low	33.5	Very low	35 Å²	35	69 Å²	69	25%	0.245	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	150.4	171.8	50.1	0	0	0	0	110.7	Q111 A127	Q111-S125 PolarHBondContact OE1-OG 3.44Å; S125-A127 PolarHBondContact O-N 3.03Å
126	N	28.9	Very low	34.3	Very low	68 Å²	68	72.1 Å²	72.1	36%	0.364	42%	0.424	S	S	.	.	S	Bend	trans	-66	16.5	-177.4	-139.9	23	0	0	0	115.1
127	A	36.3	Very low	34.8	Very low	36 Å²	36	71.3 Å²	71.3	30%	0.298	41%	0.414	S	S	.	.	S	Bend	trans	-78.1	148.4	171.3	0	0	0	0	0	109.1	S125 I129	S125-A127 PolarHBondContact O-N 3.03Å; A127-I129 WeakPolarHBondContact O-CG1 3.47Å; A127-I129 PolarHBondContact O-N 3.16Å
128	S	37	Very low	34.9	Very low	130 Å²	130	64.8 Å²	64.8	91%	0.909	38%	0.381	S	S	*	.			trans	-56.1	105.9	170.4	-56.3	0	0	0	0	109
129	I	38.9	Very low	35.1	Very low	32 Å²	32	66.3 Å²	66.3	16%	0.164	38%	0.376	C	S	.	.			trans	-81.5	129.2	178.8	-57	119.1	0	0	0	107.3	I124 A127 P131 L134	I124-I129 HydrophobicContact CG2-CD1 3.05Å; I124-I129 HydrophobicContact CG2-CG1 3.87Å; A127-I129 WeakPolarHBondContact O-CG1 3.47Å; A127-I129 PolarHBondContact O-N 3.16Å; I129-P131 VanDerWaalsContact O-CD 3.23Å; I129-P131 WeakPolarHBondContact O-CD 3.1Å; I129-L134 HydrophobicContact CB-CD1 4.24Å; I129-L134 HydrophobicContact CG2-CD1 3.63Å; I129-L134 HydrophobicContact CG2-CG 3.95Å
130	N	39.8	Very low	35.2	Very low	73 Å²	73	66.7 Å²	66.7	39%	0.39	36%	0.364	S	S	.	.			trans	-62.9	116.2	165.6	-180	-7.1	0	0	0	107.8	E132 I133	N130-E132 PolarHBondContact ND2-OE2 2.87Å; N130-E132 PolarHBondContact O-N 3.36Å; N130-E132 WeakPolarHBondContact OD1-CB 3.39Å; N130-E132 PolarHBondContact OD1-N 2.78Å; N130-I133 HydrophobicContact CB-CD1 3.98Å; N130-I133 HydrophobicContact CB-CG1 4.12Å; N130-I133 WeakPolarHBondContact O-CB 3.14Å; N130-I133 PolarHBondContact O-N 3.07Å
131	P	35.5	Very low	35.1	Very low	44 Å²	44	66 Å²	66	29%	0.286	36%	0.358	S	S	.	.	H	α-helix	trans	-58.2	-22.6	-178.1	21.8	-32	0	0	0	113.3	I129 I133 L134 L135 L172	I129-P131 VanDerWaalsContact O-CD 3.23Å; I129-P131 WeakPolarHBondContact O-CD 3.1Å; P131-I133 VanDerWaalsContact C-N 3.29Å; P131-I133 PolarHBondContact O-N 2.97Å; P131-L134 WeakPolarHBondContact O-CB 3.3Å; P131-L134 PolarHBondContact O-N 3.23Å; P131-L135 PolarHBondContact O-N 3.37Å; P131-L172 HydrophobicContact CB-CB 4.45Å
132	E	38.6	Very low	35.1	Very low	122 Å²	122	66.5 Å²	66.5	57%	0.57	36%	0.361	S	S	*	.	H	α-helix	trans	-62.8	-34	173.2	-67	177	157	0	0	112.6	N130 L134 L135 Q136	N130-E132 PolarHBondContact ND2-OE2 2.87Å; N130-E132 PolarHBondContact O-N 3.36Å; N130-E132 WeakPolarHBondContact OD1-CB 3.39Å; N130-E132 PolarHBondContact OD1-N 2.78Å; E132-L134 VanDerWaalsContact C-N 3.32Å; E132-L135 WeakPolarHBondContact O-CB 3.42Å; E132-L135 PolarHBondContact O-N 3.48Å; E132-Q136 WeakPolarHBondContact O-CG 3.2Å; E132-Q136 PolarHBondContact O-N 2.83Å
133	I	38.3	Very low	34.8	Very low	64 Å²	64	69.6 Å²	69.6	33%	0.328	38%	0.384	S	S	.	.	H	α-helix	trans	-68.9	-35.5	177.7	-61.3	174.4	0	0	0	110.3	N130 P131 N137	N130-I133 HydrophobicContact CB-CD1 3.98Å; N130-I133 HydrophobicContact CB-CG1 4.12Å; N130-I133 WeakPolarHBondContact O-CB 3.14Å; N130-I133 PolarHBondContact O-N 3.07Å; P131-I133 VanDerWaalsContact C-N 3.29Å; P131-I133 PolarHBondContact O-N 2.97Å; I133-N137 PolarHBondContact O-N 3.07Å; I133-N137 PolarHBondContact O-ND2 2.63Å
134	L	37	Very low	34.7	Very low	21 Å²	21	67.7 Å²	67.7	11%	0.11	38%	0.376	C	S	.	.	H	α-helix	trans	-65.9	-40.7	172.4	-84.9	155	0	0	0	111.2	L122 I124 I129 P131 E132 N137 S138 I182	L122-L134 HydrophobicContact CD2-CD2 3.82Å; I124-L134 HydrophobicContact CD1-CD2 3.88Å; I129-L134 HydrophobicContact CB-CD1 4.24Å; I129-L134 HydrophobicContact CG2-CD1 3.63Å; I129-L134 HydrophobicContact CG2-CG 3.95Å; P131-L134 WeakPolarHBondContact O-CB 3.3Å; P131-L134 PolarHBondContact O-N 3.23Å; E132-L134 VanDerWaalsContact C-N 3.32Å; L134-N137 PolarHBondContact O-N 2.91Å; L134-S138 PolarHBondContact O-N 3.04Å; L134-S138 VanDerWaalsContact O-N 3.08Å; L134-I182 HydrophobicContact CD1-CD1 3.98Å
135	L	35.8	Very low	34.3	Very low	63 Å²	63	73.7 Å²	73.7	33%	0.33	41%	0.408	S	S	.	.	H	α-helix	trans	-61.9	-46.7	173.7	-101.6	132.1	0	0	0	112.5	P131 E132 N137 S138 L172	P131-L135 PolarHBondContact O-N 3.37Å; E132-L135 WeakPolarHBondContact O-CB 3.42Å; E132-L135 PolarHBondContact O-N 3.48Å; L135-N137 PolarHBondContact O-N 3.26Å; L135-S138 WeakPolarHBondContact O-CB 3.36Å; L135-S138 PolarHBondContact O-N 3.29Å; L135-S138 PolarHBondContact O-OG 3.36Å; L135-L172 HydrophobicContact CB-CD1 4.27Å; L135-L172 HydrophobicContact CD1-CB 4.19Å; L135-L172 HydrophobicContact CD1-CD1 3.26Å; L135-L172 HydrophobicContact CD1-CG 4.33Å; L135-L172 HydrophobicContact CD2-CD1 4.48Å; L135-L172 HydrophobicContact CG-CD1 3.37Å
136	Q	42.4	Very low	34.1	Very low	120 Å²	120	80.1 Å²	80.1	56%	0.561	43%	0.427	S	S	*	.	H	α-helix	trans	-65.6	-24.8	-179.6	-72.6	177.9	-1.2	0	0	113.1	E132 H139	E132-Q136 WeakPolarHBondContact O-CG 3.2Å; E132-Q136 PolarHBondContact O-N 2.83Å; Q136-H139 PolarHBondContact O-CD2 3.42Å; Q136-H139 PolarHBondContact O-NE2 3.19Å
137	N	34.4	Very low	34.4	Very low	63 Å²	63	81 Å²	81	34%	0.337	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	-98	5	174.4	-67.6	-74.4	0	0	0	113	I133 L134 L135 H139 F140	I133-N137 PolarHBondContact O-N 3.07Å; I133-N137 PolarHBondContact O-ND2 2.63Å; L134-N137 PolarHBondContact O-N 2.91Å; L135-N137 PolarHBondContact O-N 3.26Å; N137-H139 PolarHBondContact O-N 3.05Å; N137-H139 VanDerWaalsContact O-N 3.15Å; N137-F140 HydrophobicContact CB-CD2 4.44Å; N137-F140 VanDerWaalsContact O-CD2 3.27Å; N137-F140 WeakPolarHBondContact O-CD2 3.29Å; N137-F140 PolarHBondContact O-N 3.04Å
138	S	32.2	Very low	34.3	Very low	13 Å²	13	79.8 Å²	79.8	9%	0.091	42%	0.424	C	S	.	.	G	3₁₀ helix	trans	-67.6	-12.5	179.4	69.3	0	0	0	0	113.6	L134 L135 F140 L141	L134-S138 PolarHBondContact O-N 3.04Å; L134-S138 VanDerWaalsContact O-N 3.08Å; L135-S138 WeakPolarHBondContact O-CB 3.36Å; L135-S138 PolarHBondContact O-N 3.29Å; L135-S138 PolarHBondContact O-OG 3.36Å; S138-F140 PolarHBondContact O-N 3.17Å; S138-L141 WeakPolarHBondContact O-CB 3.28Å; S138-L141 WeakPolarHBondContact O-CG 3.45Å; S138-L141 PolarHBondContact O-N 3.33Å
139	H	38.9	Very low	34.2	Very low	164 Å²	164	78.1 Å²	78.1	76%	0.759	40%	0.404	S	S	*	.	G	3₁₀ helix	trans	-57.3	-19.6	173.1	-49.3	-58.7	0	0	0	113.4	Q136 N137 L141	Q136-H139 PolarHBondContact O-CD2 3.42Å; Q136-H139 PolarHBondContact O-NE2 3.19Å; N137-H139 PolarHBondContact O-N 3.05Å; N137-H139 VanDerWaalsContact O-N 3.15Å; H139-L141 VanDerWaalsContact C-N 3.28Å
140	F	29.9	Very low	34.1	Very low	117 Å²	117	76.9 Å²	76.9	51%	0.513	40%	0.398	S	S	.	.	G	3₁₀ helix	trans	-81.8	-1.9	174	-63	-70	0	0	0	113.8	V115 N137 S138	V115-F140 HydrophobicContact CG1-CD1 4.45Å; V115-F140 HydrophobicContact CG1-CE1 4.34Å; V115-F140 HydrophobicContact CG1-CE2 4.47Å; V115-F140 HydrophobicContact CG1-CZ 4.36Å; V115-F140 HydrophobicContact CG2-CE2 4.37Å; N137-F140 HydrophobicContact CB-CD2 4.44Å; N137-F140 VanDerWaalsContact O-CD2 3.27Å; N137-F140 WeakPolarHBondContact O-CD2 3.29Å; N137-F140 PolarHBondContact O-N 3.04Å; S138-F140 PolarHBondContact O-N 3.17Å
141	L	31.6	Very low	33.7	Very low	23 Å²	23	79.1 Å²	79.1	12%	0.12	41%	0.41	C	S	.	.	S	Bend	trans	-102.1	111	-174.5	-53.1	176.6	0	0	0	109.3	S138 H139 T163 I166	S138-L141 WeakPolarHBondContact O-CB 3.28Å; S138-L141 WeakPolarHBondContact O-CG 3.45Å; S138-L141 PolarHBondContact O-N 3.33Å; H139-L141 VanDerWaalsContact C-N 3.28Å; L141-T163 HydrophobicContact CD2-CG2 3.67Å; L141-I166 CarbonylContact C-O 2.9Å; L141-I166 WeakPolarHBondContact CA-O 3.35Å; L141-I166 WeakPolarHBondContact CB-O 3.46Å
142	S	28.5	Very low	33.7	Very low	65 Å²	65	78.1 Å²	78.1	46%	0.455	40%	0.402	S	S	.	.			trans	-79	139.9	-174	101	0	0	0	0	113.6	T144 I166 G167	S142-T144 PolarHBondContact O-N 3.15Å; S142-I166 CarbonylContact C-O 3.3Å; S142-I166 VanDerWaalsContact C-O 3.3Å; S142-I166 PolarHBondContact N-O 2.83Å; S142-I166 VanDerWaalsContact N-O 3.08Å; S142-I166 CarbonylContact O-C 3.16Å; S142-I166 PolarHBondContact O-N 2.8Å; S142-G167 PolarHBondContact O-N 3.35Å
143	P	29.2	Very low	33.4	Very low	106 Å²	106	76 Å²	76	69%	0.688	40%	0.395	S	S	*	.	S	Bend	trans	-60	92.8	-168.8	27.5	-35.7	0	0	0	114.9
144	T	27.1	Very low	33.5	Very low	58 Å²	58	77.5 Å²	77.5	36%	0.356	41%	0.409	S	S	.	.			trans	-147.5	147.1	155	41.9	0	0	0	0	111.6	S142 R146 L165 I166 G167	S142-T144 PolarHBondContact O-N 3.15Å; T144-R146 VanDerWaalsContact C-N 3.34Å; T144-R146 PolarHBondContact O-N 3.33Å; T144-L165 VanDerWaalsContact OG1-C 3.25Å; T144-L165 WeakPolarHBondContact OG1-CB 3.49Å; T144-L165 PolarHBondContact OG1-O 3.33Å; T144-L165 VanDerWaalsContact OG1-O 3.07Å; T144-I166 CarbonylContact O-C 3.58Å; T144-I166 WeakPolarHBondContact O-CA 3.25Å; T144-G167 PolarHBondContact O-N 3.15Å
145	D	28.2	Very low	33.4	Very low	131 Å²	131	83.6 Å²	83.6	70%	0.701	44%	0.442	S	S	*	.			trans	-71.2	67.5	-167	-65.5	-43.5	0	0	0	115
146	R	27.8	Very low	33.1	Very low	170 Å²	170	83.6 Å²	83.6	64%	0.642	44%	0.444	S	S	*	.			trans	-130.2	131.7	177.8	-63.1	-170.1	178.9	-163.2	1.3	112.6	T144 L148 I166	T144-R146 VanDerWaalsContact C-N 3.34Å; T144-R146 PolarHBondContact O-N 3.33Å; R146-L148 PolarHBondContact O-N 2.9Å; R146-I166 HydrophobicContact CB-CG1 4.3Å; R146-I166 VanDerWaalsContact O-CG2 3.23Å; R146-I166 WeakPolarHBondContact O-CG2 3.47Å
147	T	35.4	Very low	32.6	Very low	86 Å²	86	83.2 Å²	83.2	53%	0.528	45%	0.45	S	S	.	.			trans	-62.9	125	171.2	-48.9	0	0	0	0	109.5	N149 I184	T147-N149 PolarHBondContact O-N 3.18Å; T147-I184 WeakPolarHBondContact CA-O 3.38Å
148	L	33.5	Very low	32.3	Very low	11 Å²	11	87.4 Å²	87.4	6%	0.058	47%	0.466	C	S	.	.			trans	-75.1	119	168	-174.2	68.2	0	0	0	107.5	R146 V150 V161 T163 I166 I184	R146-L148 PolarHBondContact O-N 2.9Å; L148-V150 HydrophobicContact CD2-CG2 3.73Å; L148-V150 HydrophobicContact CG-CG2 3.84Å; L148-V161 HydrophobicContact CD1-CG1 3.37Å; L148-V161 HydrophobicContact CD2-CG1 3.81Å; L148-V161 HydrophobicContact CG-CG1 4.05Å; L148-T163 HydrophobicContact CD1-CG2 4.31Å; L148-I166 VanDerWaalsContact CA-CD1 3.48Å; L148-I166 HydrophobicContact CB-CD1 3.42Å; L148-I166 VanDerWaalsContact CB-CD1 3.42Å; L148-I166 HydrophobicContact CD1-CD1 3.33Å; L148-I166 HydrophobicContact CG-CD1 3.95Å; L148-I184 HydrophobicContact CB-CB 4.07Å; L148-I184 HydrophobicContact CB-CD1 3.62Å; L148-I184 HydrophobicContact CB-CG1 3.83Å; L148-I184 HydrophobicContact CD2-CD1 3.57Å; L148-I184 HydrophobicContact CD2-CG1 4.42Å; L148-I184 HydrophobicContact CG-CD1 4.24Å
149	N	34.8	Very low	32.1	Very low	94 Å²	94	87.2 Å²	87.2	50%	0.503	46%	0.464	S	S	.	.	B	Isolated β-bridge	trans	-108.1	117.1	167.8	-124.4	13.1	0	0	0	107.3	T147	T147-N149 PolarHBondContact O-N 3.18Å
150	V	37.2	Very low	31.8	Very low	6 Å²	6	84.2 Å²	84.2	4%	0.036	46%	0.457	C	S	.	.			trans	-102.8	103.6	175.6	-176.2	0	0	0	0	108.1	L148 L152 V161 I182	L148-V150 HydrophobicContact CD2-CG2 3.73Å; L148-V150 HydrophobicContact CG-CG2 3.84Å; V150-L152 HydrophobicContact CG1-CD2 3.7Å; V150-L152 HydrophobicContact CG1-CG 4.01Å; V150-L152 PolarHBondContact O-N 2.9Å; V150-L152 VanDerWaalsContact O-N 3.13Å; V150-V161 HydrophobicContact CB-CG2 4.41Å; V150-V161 HydrophobicContact CG1-CG2 3.77Å; V150-V161 HydrophobicContact CG2-CG1 4.03Å; V150-V161 HydrophobicContact CG2-CG2 3.74Å; V150-I182 HydrophobicContact CG2-CD1 4.48Å
151	D	31.5	Very low	32	Very low	121 Å²	121	78.9 Å²	78.9	65%	0.647	43%	0.434	S	S	*	.			trans	-76.8	97.4	169.7	-75.8	-26.8	0	0	0	108.7	N153	D151-N153 PolarHBondContact O-N 3.44Å
152	L	35.5	Very low	32	Very low	23 Å²	23	84.3 Å²	84.3	12%	0.12	46%	0.463	C	S	.	.			trans	-76.5	107	172.2	-67.3	-179.2	0	0	0	109.2	V150 P154 S159 N180	V150-L152 HydrophobicContact CG1-CD2 3.7Å; V150-L152 HydrophobicContact CG1-CG 4.01Å; V150-L152 PolarHBondContact O-N 2.9Å; V150-L152 VanDerWaalsContact O-N 3.13Å; L152-P154 WeakPolarHBondContact O-CD 3.46Å; L152-S159 WeakPolarHBondContact CA-OG 3.44Å; L152-N180 HydrophobicContact CB-CB 4.4Å; L152-N180 HydrophobicContact CD1-CB 3.73Å; L152-N180 HydrophobicContact CG-CB 4.42Å
153	N	33.1	Very low	32.3	Very low	76 Å²	76	82 Å²	82	41%	0.406	45%	0.447	S	S	.	.			trans	-74.4	115.7	173.5	178.1	-8.9	0	0	0	109.4	D151 N155 T156 S159	D151-N153 PolarHBondContact O-N 3.44Å; N153-N155 PolarHBondContact O-N 2.77Å; N153-N155 VanDerWaalsContact O-N 3.16Å; N153-N155 PolarHBondContact OD1-N 3.45Å; N153-T156 WeakPolarHBondContact CB-OG1 3.34Å; N153-T156 PolarHBondContact O-N 3.23Å; N153-S159 PolarHBondContact N-OG 3.03Å
154	P	40.4	Very low	32.4	Very low	96 Å²	96	81 Å²	81	62%	0.623	44%	0.442	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.6	-23.2	-175.8	26.1	-34.3	0	0	0	113.3	L152	L152-P154 WeakPolarHBondContact O-CD 3.46Å
155	N	33.3	Very low	32.5	Very low	150 Å²	150	82 Å²	82	80%	0.802	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-1	-177.3	-67.4	-16.3	0	0	0	113.6	N153	N153-N155 PolarHBondContact O-N 2.77Å; N153-N155 VanDerWaalsContact O-N 3.16Å; N153-N155 PolarHBondContact OD1-N 3.45Å
156	T	29.6	Very low	32.8	Very low	62 Å²	62	76.4 Å²	76.4	38%	0.38	42%	0.415	S	S	.	.	S	Bend	trans	-130.9	130.9	178	58	0	0	0	0	110.4	N153 K158	N153-T156 WeakPolarHBondContact CB-OG1 3.34Å; N153-T156 PolarHBondContact O-N 3.23Å; T156-K158 PolarHBondContact O-N 2.89Å; T156-K158 PolarHBondContact OG1-O 2.73Å
157	T	31.8	Very low	33.1	Very low	112 Å²	112	68.4 Å²	68.4	69%	0.687	39%	0.386	S	S	*	.	S	Bend	trans	-68.4	-0.6	-179.7	42.8	0	0	0	0	114.6
158	K	28.4	Very low	33.2	Very low	152 Å²	152	68.3 Å²	68.3	66%	0.661	39%	0.388	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-135.3	122.9	-174.3	-61.4	-179	-178.4	-179.8	0	109.1	T156	T156-K158 PolarHBondContact O-N 2.89Å; T156-K158 PolarHBondContact OG1-O 2.73Å
159	S	28.7	Very low	33.2	Very low	9 Å²	9	68.3 Å²	68.3	6%	0.063	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	128.7	166.7	-62.1	0	0	0	0	108.6	I124 L152 N153	I124-S159 PolarHBondContact N-O 3.31Å; I124-S159 PolarHBondContact O-N 3.46Å; L152-S159 WeakPolarHBondContact CA-OG 3.44Å; N153-S159 PolarHBondContact N-OG 3.03Å
160	T	32.7	Very low	33.2	Very low	100 Å²	100	67.9 Å²	67.9	61%	0.613	39%	0.39	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-90.5	114.6	-178.7	-45.7	0	0	0	0	108.3	N162	T160-N162 PolarHBondContact O-N 2.97Å
161	V	33.9	Very low	33	Very low	5 Å²	5	70.3 Å²	70.3	3%	0.03	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.5	114.3	173.6	-173.2	0	0	0	0	108.4	L122 I124 L148 V150 T163	L122-V161 PolarHBondContact O-N 3.15Å; I124-V161 HydrophobicContact CB-CG2 4.37Å; I124-V161 HydrophobicContact CD1-CG2 3.45Å; I124-V161 VanDerWaalsContact CD1-CG2 3.45Å; I124-V161 HydrophobicContact CG1-CG2 3.81Å; L148-V161 HydrophobicContact CD1-CG1 3.37Å; L148-V161 HydrophobicContact CD2-CG1 3.81Å; L148-V161 HydrophobicContact CG-CG1 4.05Å; V150-V161 HydrophobicContact CB-CG2 4.41Å; V150-V161 HydrophobicContact CG1-CG2 3.77Å; V150-V161 HydrophobicContact CG2-CG1 4.03Å; V150-V161 HydrophobicContact CG2-CG2 3.74Å; V161-T163 HydrophobicContact CB-CG2 4.19Å; V161-T163 HydrophobicContact CG1-CG2 3.43Å; V161-T163 VanDerWaalsContact CG1-CG2 3.43Å; V161-T163 PolarHBondContact O-N 3.04Å
162	N	32.1	Very low	33.1	Very low	137 Å²	137	66.2 Å²	66.2	73%	0.733	39%	0.385	S	S	*	.			trans	-86.8	89	175.8	-151.6	5.5	0	0	0	109.2	T160 S164	T160-N162 PolarHBondContact O-N 2.97Å; N162-S164 VanDerWaalsContact C-N 3.28Å; N162-S164 PolarHBondContact O-N 3.31Å
163	T	33.5	Very low	33	Very low	17 Å²	17	67.9 Å²	67.9	10%	0.104	40%	0.399	C	S	.	.			trans	-88.7	51.5	-174.6	57.9	0	0	0	0	111.6	S120 L141 L148 V161 L165	S120-T163 PolarHBondContact O-OG1 3.09Å; L141-T163 HydrophobicContact CD2-CG2 3.67Å; L148-T163 HydrophobicContact CD1-CG2 4.31Å; V161-T163 HydrophobicContact CB-CG2 4.19Å; V161-T163 HydrophobicContact CG1-CG2 3.43Å; V161-T163 VanDerWaalsContact CG1-CG2 3.43Å; V161-T163 PolarHBondContact O-N 3.04Å; T163-L165 PolarHBondContact O-N 3.14Å
164	S	31.8	Very low	32.9	Very low	85 Å²	85	68.4 Å²	68.4	59%	0.594	41%	0.405	S	S	*	.	S	Bend	trans	-72.4	-25.5	-171	54.8	0	0	0	0	113.9	N162	N162-S164 VanDerWaalsContact C-N 3.28Å; N162-S164 PolarHBondContact O-N 3.31Å
165	L	30.2	Very low	32.4	Very low	79 Å²	79	67.8 Å²	67.8	41%	0.414	40%	0.4	S	S	.	.	S	Bend	trans	-159.6	66	-168.2	-72.2	173	0	0	0	113.2	T144 T163	T144-L165 VanDerWaalsContact OG1-C 3.25Å; T144-L165 WeakPolarHBondContact OG1-CB 3.49Å; T144-L165 PolarHBondContact OG1-O 3.33Å; T144-L165 VanDerWaalsContact OG1-O 3.07Å; T163-L165 PolarHBondContact O-N 3.14Å
166	I	33	Very low	32.4	Very low	13 Å²	13	64.9 Å²	64.9	7%	0.067	40%	0.396	C	S	.	.			trans	-133.6	127.2	-177.7	-58.3	-177.7	0	0	0	109.9	L141 S142 T144 R146 L148	L141-I166 CarbonylContact C-O 2.9Å; L141-I166 WeakPolarHBondContact CA-O 3.35Å; L141-I166 WeakPolarHBondContact CB-O 3.46Å; S142-I166 CarbonylContact C-O 3.3Å; S142-I166 VanDerWaalsContact C-O 3.3Å; S142-I166 PolarHBondContact N-O 2.83Å; S142-I166 VanDerWaalsContact N-O 3.08Å; S142-I166 CarbonylContact O-C 3.16Å; S142-I166 PolarHBondContact O-N 2.8Å; T144-I166 CarbonylContact O-C 3.58Å; T144-I166 WeakPolarHBondContact O-CA 3.25Å; R146-I166 HydrophobicContact CB-CG1 4.3Å; R146-I166 VanDerWaalsContact O-CG2 3.23Å; R146-I166 WeakPolarHBondContact O-CG2 3.47Å; L148-I166 VanDerWaalsContact CA-CD1 3.48Å; L148-I166 HydrophobicContact CB-CD1 3.42Å; L148-I166 VanDerWaalsContact CB-CD1 3.42Å; L148-I166 HydrophobicContact CD1-CD1 3.33Å; L148-I166 HydrophobicContact CG-CD1 3.95Å
167	G	35.6	Very low	32.6	Very low	3 Å²	3	65.5 Å²	65.5	3%	0.031	40%	0.4	C	S	.	.			trans	-77.1	-177.6	-177.4	0	0	0	0	0	117	S142 T144 P169	S142-G167 PolarHBondContact O-N 3.35Å; T144-G167 PolarHBondContact O-N 3.15Å; G167-P169 WeakPolarHBondContact O-CD 3.03Å; G167-P169 VanDerWaalsContact O-N 3.12Å
168	S	36.6	Very low	32.9	Very low	83 Å²	83	67.7 Å²	67.7	58%	0.58	41%	0.413	S	S	*	.			trans	-62.3	102.4	-179.7	-51.4	0	0	0	0	110.8	T170 N186	S168-T170 PolarHBondContact O-N 3.3Å; S168-N186 PolarHBondContact O-OD1 3.49Å
169	P	34.6	Very low	33.1	Very low	12 Å²	12	64 Å²	64	8%	0.078	40%	0.404	C	S	.	.			trans	-76.8	129.3	-170.5	31.3	-31.8	0	0	0	111.5	G167 I184	G167-P169 WeakPolarHBondContact O-CD 3.03Å; G167-P169 VanDerWaalsContact O-N 3.12Å; P169-I184 HydrophobicContact CB-CG2 3.18Å; P169-I184 HydrophobicContact CG-CG2 4.05Å
170	T	33.7	Very low	33.4	Very low	84 Å²	84	67.4 Å²	67.4	52%	0.515	42%	0.421	S	S	.	.	S	Bend	trans	-82.5	-20.6	176.4	53.4	0	0	0	0	113.2	S168 S187	S168-T170 PolarHBondContact O-N 3.3Å; T170-S187 PolarHBondContact OG1-N 3.21Å; T170-S187 PolarHBondContact OG1-OG 3.12Å
171	S	33.2	Very low	33.2	Very low	58 Å²	58	64.9 Å²	64.9	41%	0.406	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.5	145.9	178.9	66.6	0	0	0	0	112.7	V185	S171-V185 PolarHBondContact OG-O 2.92Å
172	L	34.1	Very low	33.3	Very low	35 Å²	35	65.3 Å²	65.3	18%	0.183	41%	0.406	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.6	127.5	171.7	-93.2	123.6	0	0	0	109.3	P131 L135 I182 I184	P131-L172 HydrophobicContact CB-CB 4.45Å; L135-L172 HydrophobicContact CB-CD1 4.27Å; L135-L172 HydrophobicContact CD1-CB 4.19Å; L135-L172 HydrophobicContact CD1-CD1 3.26Å; L135-L172 HydrophobicContact CD1-CG 4.33Å; L135-L172 HydrophobicContact CD2-CD1 4.48Å; L135-L172 HydrophobicContact CG-CD1 3.37Å; L172-I182 HydrophobicContact CD2-CG2 3.55Å; L172-I184 HydrophobicContact CD2-CD1 4Å; L172-I184 HydrophobicContact CD2-CG1 3.73Å; L172-I184 HydrophobicContact CG-CD1 4.43Å; L172-I184 HydrophobicContact CG-CG1 4.06Å
173	S	32.2	Very low	33.1	Very low	58 Å²	58	60.3 Å²	60.3	41%	0.406	38%	0.382	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.3	129.9	167.6	71.8	0	0	0	0	109.9	S183	S173-S183 PolarHBondContact N-O 3.06Å; S173-S183 PolarHBondContact O-N 3.12Å; S173-S183 VanDerWaalsContact O-N 3.16Å
174	T	31.8	Very low	33.2	Very low	86 Å²	86	59.9 Å²	59.9	53%	0.528	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.5	110.3	174.9	49.7	0	0	0	0	108
175	T	29.4	Very low	33.1	Very low	84 Å²	84	59.2 Å²	59.2	52%	0.515	37%	0.371	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	103	171.8	-40.1	0	0	0	0	107.5	T177 N181	T175-T177 VanDerWaalsContact C-N 3.3Å; T175-T177 PolarHBondContact O-N 2.91Å; T175-N181 PolarHBondContact N-O 2.91Å
176	A	33.3	Very low	33.1	Very low	89 Å²	89	58.3 Å²	58.3	74%	0.736	37%	0.367	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-73.3	83.7	178.2	0	0	0	0	0	110
177	T	34.3	Very low	32.9	Very low	74 Å²	74	61.2 Å²	61.2	45%	0.454	39%	0.388	S	S	.	.	S	Bend	trans	-101.3	166.5	159.2	46.6	0	0	0	0	108.8	T175 T179 N180	T175-T177 VanDerWaalsContact C-N 3.3Å; T175-T177 PolarHBondContact O-N 2.91Å; T177-T179 CarbonylContact C-O 3.43Å; T177-T179 CarbonylContact O-C 2.94Å; T177-T179 PolarHBondContact O-N 2.72Å; T177-T179 PolarHBondContact OG1-O 3.29Å; T177-N180 PolarHBondContact O-N 3.39Å
178	T	38.7	Very low	32.8	Very low	158 Å²	158	70.6 Å²	70.6	97%	0.969	45%	0.445	S	S	*	.	S	Bend	trans	-53.3	-19.9	179.6	44.1	0	0	0	0	113.6
179	T	31.5	Very low	32.6	Very low	76 Å²	76	70 Å²	70	47%	0.466	44%	0.438	S	S	.	.	S	Bend	trans	-94.6	109.6	153.8	37.7	0	0	0	0	109.6	T177 N181	T177-T179 CarbonylContact C-O 3.43Å; T177-T179 CarbonylContact O-C 2.94Å; T177-T179 PolarHBondContact O-N 2.72Å; T177-T179 PolarHBondContact OG1-O 3.29Å; T179-N181 VanDerWaalsContact C-N 3.3Å; T179-N181 PolarHBondContact O-N 2.9Å
180	N	34.2	Very low	32.5	Very low	80 Å²	80	73 Å²	73	43%	0.428	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-69.8	85.4	175.7	-80.4	-32.6	0	0	0	109.7	L152 T177 I182	L152-N180 HydrophobicContact CB-CB 4.4Å; L152-N180 HydrophobicContact CD1-CB 3.73Å; L152-N180 HydrophobicContact CG-CB 4.42Å; T177-N180 PolarHBondContact O-N 3.39Å; N180-I182 PolarHBondContact O-N 3.01Å
181	N	30.4	Very low	32.4	Very low	46 Å²	46	72.4 Å²	72.4	25%	0.246	45%	0.454	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	109.6	174.7	-67.7	0.3	0	0	0	108.3	T175 T179	T175-N181 PolarHBondContact N-O 2.91Å; T179-N181 VanDerWaalsContact C-N 3.3Å; T179-N181 PolarHBondContact O-N 2.9Å
182	I	34.3	Very low	32.3	Very low	15 Å²	15	73.2 Å²	73.2	8%	0.077	46%	0.456	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-77.7	121.6	162.9	-57.5	174.9	0	0	0	105.7	L134 V150 L172 N180 I184	L134-I182 HydrophobicContact CD1-CD1 3.98Å; V150-I182 HydrophobicContact CG2-CD1 4.48Å; L172-I182 HydrophobicContact CD2-CG2 3.55Å; N180-I182 PolarHBondContact O-N 3.01Å; I182-I184 HydrophobicContact CG2-CG1 4.16Å
183	S	29.6	Very low	32.2	Very low	31 Å²	31	75.6 Å²	75.6	22%	0.217	47%	0.474	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	118	171.9	-75.3	0	0	0	0	108.9	S173	S173-S183 PolarHBondContact N-O 3.06Å; S173-S183 PolarHBondContact O-N 3.12Å; S173-S183 VanDerWaalsContact O-N 3.16Å
184	I	34.5	Very low	32.2	Very low	8 Å²	8	76.8 Å²	76.8	4%	0.041	48%	0.478	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.6	110.9	175.6	-59.9	-170.5	0	0	0	107.8	T147 L148 P169 L172 I182	T147-I184 WeakPolarHBondContact CA-O 3.38Å; L148-I184 HydrophobicContact CB-CB 4.07Å; L148-I184 HydrophobicContact CB-CD1 3.62Å; L148-I184 HydrophobicContact CB-CG1 3.83Å; L148-I184 HydrophobicContact CD2-CD1 3.57Å; L148-I184 HydrophobicContact CD2-CG1 4.42Å; L148-I184 HydrophobicContact CG-CD1 4.24Å; P169-I184 HydrophobicContact CB-CG2 3.18Å; P169-I184 HydrophobicContact CG-CG2 4.05Å; L172-I184 HydrophobicContact CD2-CD1 4Å; L172-I184 HydrophobicContact CD2-CG1 3.73Å; L172-I184 HydrophobicContact CG-CD1 4.43Å; L172-I184 HydrophobicContact CG-CG1 4.06Å; I182-I184 HydrophobicContact CG2-CG1 4.16Å
185	V	29.8	Very low	32.3	Very low	72 Å²	72	76.1 Å²	76.1	44%	0.436	48%	0.475	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.1	120	179.8	-174.2	0	0	0	0	108.3	S171	S171-V185 PolarHBondContact OG-O 2.92Å
186	N	29.9	Very low	32.5	Very low	60 Å²	60	75.5 Å²	75.5	32%	0.321	47%	0.471	S	S	.	.			trans	-84.2	114.6	169.8	-142.8	19.2	0	0	0	107.6	S168	S168-N186 PolarHBondContact O-OD1 3.49Å
187	S	29.2	Very low	32.4	Very low	73 Å²	73	74.4 Å²	74.4	51%	0.51	45%	0.449	S	S	.	.			trans	-83.2	118.8	169.7	67.8	0	0	0	0	108.4	T170	T170-S187 PolarHBondContact OG1-N 3.21Å; T170-S187 PolarHBondContact OG1-OG 3.12Å
188	T	32.5	Very low	32.2	Very low	200 Å²	200	74.5 Å²	74.5	100%	1.227	45%	0.449	S	S	*	.			trans	-54.1	0	165	49.2	0	0	0	0	111.7

Retrieved 188 of 188 residues in 237.4 ms (Link to these results)

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