A0A5K4F4U0_SCHMA Loading...

J domain-containing protein

AlphaFold DB (A0A5K4F853), UniProt , Accession A0A5K4F4U0, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 270 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	36.1	Very low	73.2	Confident	237 Å²	237	91.5 Å²	91.5	100%	1.167	47%	0.474	S	S	*	.				0	133.1	0	-61.1	169.3	-173.6	0	0	106.8	Q3	M1-Q3 PolarHBondContact O-N 2.88Å
2	E	42.6	Very low	74.6	Confident	187 Å²	187	86.5 Å²	86.5	87%	0.874	45%	0.448	S	S	*	.			trans	-66.1	126.1	175.5	-64.5	-163.1	134.9	0	0	109.5	T4	E2-T4 PolarHBondContact O-N 3.19Å; E2-T4 VanDerWaalsContact O-N 3.13Å
3	Q	50.4	Low	75.7	Confident	180 Å²	180	92.3 Å²	92.3	84%	0.841	47%	0.467	S	S	*	.			trans	-71.7	110.1	172.7	-77.3	174.3	-22	0	0	108.4	M1 C5	M1-Q3 PolarHBondContact O-N 2.88Å; Q3-C5 VanDerWaalsContact C-N 3.32Å; Q3-C5 PolarHBondContact O-N 3.15Å
4	T	62.9	Low	76.5	Confident	65 Å²	65	95.1 Å²	95.1	40%	0.399	48%	0.475	S	S	.	.			trans	-64.4	87.4	-179	36.5	0	0	0	0	110.3	E2 Y6 I9 Y67	E2-T4 PolarHBondContact O-N 3.19Å; E2-T4 VanDerWaalsContact O-N 3.13Å; T4-Y6 PolarHBondContact O-N 3.37Å; T4-I9 HydrophobicContact CG2-CD1 4.27Å; T4-Y67 PolarHBondContact O-OH 2.98Å
5	C	80.8	Confident	77.2	Confident	41 Å²	41	96.9 Å²	96.9	28%	0.277	49%	0.493	S	S	.	.			trans	-60.8	101	170.9	-69.1	0	0	0	0	109.2	Q3 Y7 K8 I9 Y67	Q3-C5 VanDerWaalsContact C-N 3.32Å; Q3-C5 PolarHBondContact O-N 3.15Å; C5-Y7 PolarHBondContact O-N 2.85Å; C5-Y7 VanDerWaalsContact O-N 3.14Å; C5-K8 HydrophobicContact CB-CB 3.85Å; C5-K8 HydrophobicContact CB-CD 3.78Å; C5-K8 HydrophobicContact CB-CG 3.58Å; C5-K8 WeakPolarHBondContact O-CA 3.41Å; C5-K8 WeakPolarHBondContact O-CB 3.4Å; C5-K8 PolarHBondContact O-N 2.92Å; C5-I9 PolarHBondContact O-N 3.02Å; C5-Y67 VanDerWaalsContact CA-OH 3.27Å; C5-Y67 WeakPolarHBondContact CA-OH 3.49Å
6	Y	87.5	Confident	77.8	Confident	19 Å²	19	91 Å²	91	8%	0.075	46%	0.464	C	S	.	.	H	α-helix	trans	-55.7	-34.3	178.2	-65.3	-42.1	0	0	0	112	T4 K8 I9 L10 E53 A54 V57 Y67	T4-Y6 PolarHBondContact O-N 3.37Å; Y6-K8 PolarHBondContact O-N 2.79Å; Y6-I9 HydrophobicContact CD1-CD1 4.06Å; Y6-I9 PolarHBondContact O-N 2.89Å; Y6-L10 PolarHBondContact O-N 3.45Å; Y6-E53 HydrophobicContact CE1-CG 3.72Å; Y6-E53 WeakPolarHBondContact CE1-OE1 3.26Å; Y6-E53 PolarHBondContact OH-OE1 2.8Å; Y6-A54 HydrophobicContact CD1-CB 3.68Å; Y6-A54 HydrophobicContact CG-CB 3.99Å; Y6-V57 HydrophobicContact CD2-CB 3.93Å; Y6-V57 HydrophobicContact CD2-CG1 3.83Å; Y6-V57 HydrophobicContact CD2-CG2 4.41Å; Y6-V57 HydrophobicContact CE2-CB 3.82Å; Y6-V57 HydrophobicContact CE2-CG1 3.75Å; Y6-V57 HydrophobicContact CE2-CG2 3.81Å; Y6-Y67 HydrophobicContact CD2-CD1 4.28Å; Y6-Y67 AromaticContact CD2-CD2 3.66Å; Y6-Y67 HydrophobicContact CD2-CD2 3.66Å; Y6-Y67 AromaticContact CD2-CE1 3.9Å; Y6-Y67 HydrophobicContact CD2-CE1 3.9Å; Y6-Y67 AromaticContact CD2-CE2 3.22Å; Y6-Y67 HydrophobicContact CD2-CE2 3.22Å; Y6-Y67 HydrophobicContact CD2-CG 4.15Å; Y6-Y67 AromaticContact CD2-CZ 3.34Å; Y6-Y67 AromaticContact CE2-CD2 3.57Å; Y6-Y67 HydrophobicContact CE2-CD2 3.57Å; Y6-Y67 AromaticContact CE2-CE2 3.27Å; Y6-Y67 HydrophobicContact CE2-CE2 3.27Å; Y6-Y67 HydrophobicContact CE2-CG 4.42Å; Y6-Y67 AromaticContact CE2-CZ 3.91Å; Y6-Y67 HydrophobicContact CG-CE2 4.2Å; Y6-Y67 AromaticContact CG-CZ 3.98Å; Y6-Y67 PolarHBondContact N-OH 3.48Å
7	Y	89.2	Confident	78.6	Confident	8 Å²	8	88.7 Å²	88.7	3%	0.031	46%	0.458	C	S	.	.	H	α-helix	trans	-59.5	-38.5	170	-59.6	-73.9	0	0	0	113.9	C5 G11 I12 K14 L58 R64 Y67 D68	C5-Y7 PolarHBondContact O-N 2.85Å; C5-Y7 VanDerWaalsContact O-N 3.14Å; Y7-G11 PolarHBondContact O-N 2.94Å; Y7-G11 VanDerWaalsContact O-N 3.1Å; Y7-I12 HydrophobicContact CD1-CD1 4.11Å; Y7-I12 HydrophobicContact CD1-CG1 4.09Å; Y7-I12 PolarHBondContact O-N 2.82Å; Y7-K14 HydrophobicContact CD1-CG 4.45Å; Y7-K14 HydrophobicContact CD2-CD 4.49Å; Y7-K14 HydrophobicContact CD2-CG 3.83Å; Y7-K14 HydrophobicContact CE1-CB 4.48Å; Y7-K14 HydrophobicContact CE2-CD 4.47Å; Y7-K14 HydrophobicContact CE2-CG 4.01Å; Y7-K14 HydrophobicContact CG-CG 4.04Å; Y7-L58 HydrophobicContact CD1-CD1 3.81Å; Y7-L58 HydrophobicContact CD1-CD2 4.45Å; Y7-L58 HydrophobicContact CE1-CD1 3.92Å; Y7-L58 HydrophobicContact CE1-CD2 3.83Å; Y7-L58 HydrophobicContact CE2-CD2 3.95Å; Y7-L58 HydrophobicContact CG-CD1 4.19Å; Y7-R64 PolarHBondContact OH-NE 3.25Å; Y7-Y67 HydrophobicContact CD2-CE1 4.16Å; Y7-Y67 HydrophobicContact CE2-CD1 4.21Å; Y7-Y67 AromaticContact CE2-CE1 3.9Å; Y7-Y67 HydrophobicContact CE2-CE1 3.9Å; Y7-D68 VanDerWaalsContact CE2-OD1 3.22Å; Y7-D68 WeakPolarHBondContact CE2-OD1 3.34Å; Y7-D68 PolarHBondContact OH-OD1 3.1Å; Y7-D68 PolarHBondContact OH-OD2 3.48Å
8	K	88.5	Confident	79.2	Confident	167 Å²	167	86.9 Å²	86.9	73%	0.726	45%	0.454	S	S	*	.	H	α-helix	trans	-70	-42.6	173.5	-69.4	-177	-175.5	174.7	0	111	C5 Y6 L10 G11	C5-K8 HydrophobicContact CB-CB 3.85Å; C5-K8 HydrophobicContact CB-CD 3.78Å; C5-K8 HydrophobicContact CB-CG 3.58Å; C5-K8 WeakPolarHBondContact O-CA 3.41Å; C5-K8 WeakPolarHBondContact O-CB 3.4Å; C5-K8 PolarHBondContact O-N 2.92Å; Y6-K8 PolarHBondContact O-N 2.79Å; K8-L10 VanDerWaalsContact C-N 3.33Å; K8-L10 PolarHBondContact O-N 2.68Å; K8-G11 PolarHBondContact O-N 2.68Å
9	I	88.2	Confident	79.7	Confident	45 Å²	45	86.9 Å²	86.9	23%	0.231	46%	0.455	C	S	.	.	H	α-helix	trans	-60.3	-42.5	-179.9	-68.4	164.3	0	0	0	111	T4 C5 Y6 G11 L28 L50 I51 A54	T4-I9 HydrophobicContact CG2-CD1 4.27Å; C5-I9 PolarHBondContact O-N 3.02Å; Y6-I9 HydrophobicContact CD1-CD1 4.06Å; Y6-I9 PolarHBondContact O-N 2.89Å; I9-G11 VanDerWaalsContact C-N 3.33Å; I9-L28 WeakPolarHBondContact O-CD1 3.38Å; I9-L50 HydrophobicContact CD1-CB 4.49Å; I9-L50 HydrophobicContact CG2-CB 4.31Å; I9-I51 HydrophobicContact CG2-CG1 4.06Å; I9-A54 HydrophobicContact CB-CB 4.17Å; I9-A54 HydrophobicContact CG2-CB 3.94Å
10	L	89.6	Confident	80.3	Confident	0 Å²	0	87.8 Å²	87.8	0%	0	46%	0.457	C	S	.	.	H	α-helix	trans	-80.2	-10.1	174.4	-66.1	-177.7	0	0	0	114.1	Y6 K8 I12 I21 A24 L28 I51 A54 L58	Y6-L10 PolarHBondContact O-N 3.45Å; K8-L10 VanDerWaalsContact C-N 3.33Å; K8-L10 PolarHBondContact O-N 2.68Å; L10-I12 HydrophobicContact CB-CD1 3.9Å; L10-I12 HydrophobicContact CB-CG1 3.89Å; L10-I12 HydrophobicContact CB-CG2 4.35Å; L10-I12 HydrophobicContact CD1-CD1 3.99Å; L10-I21 HydrophobicContact CD1-CG2 4.12Å; L10-A24 HydrophobicContact CB-CB 4.19Å; L10-L28 HydrophobicContact CB-CD1 4.48Å; L10-L28 HydrophobicContact CD2-CD1 4.13Å; L10-L28 WeakPolarHBondContact O-CD1 3.31Å; L10-I51 HydrophobicContact CD2-CG2 4.14Å; L10-A54 HydrophobicContact CD1-CB 4.16Å; L10-A54 HydrophobicContact CD2-CB 4.18Å; L10-A54 HydrophobicContact CG-CB 3.77Å; L10-L58 HydrophobicContact CD1-CD1 4.17Å
11	G	89.2	Confident	80.8	Confident	57 Å²	57	83.6 Å²	83.6	59%	0.588	44%	0.435	S	S	*	.	T	Hydrogen-bonded Turn	trans	67.7	36.9	-177.8	0	0	0	0	0	113.8	Y7 K8 I9	Y7-G11 PolarHBondContact O-N 2.94Å; Y7-G11 VanDerWaalsContact O-N 3.1Å; K8-G11 PolarHBondContact O-N 2.68Å; I9-G11 VanDerWaalsContact C-N 3.33Å
12	I	90.7	Very high	83.4	Confident	32 Å²	32	75.6 Å²	75.6	16%	0.164	39%	0.394	C	S	.	.			trans	-123.3	161.9	-173.9	59.8	176.2	0	0	0	112.2	Y7 L10 A16 I21 A24 L58	Y7-I12 HydrophobicContact CD1-CD1 4.11Å; Y7-I12 HydrophobicContact CD1-CG1 4.09Å; Y7-I12 PolarHBondContact O-N 2.82Å; L10-I12 HydrophobicContact CB-CD1 3.9Å; L10-I12 HydrophobicContact CB-CG1 3.89Å; L10-I12 HydrophobicContact CB-CG2 4.35Å; L10-I12 HydrophobicContact CD1-CD1 3.99Å; I12-A16 HydrophobicContact CB-CB 4.11Å; I12-A16 HydrophobicContact CD1-CB 4.13Å; I12-A16 HydrophobicContact CG1-CB 4.46Å; I12-I21 HydrophobicContact CD1-CB 4.48Å; I12-I21 HydrophobicContact CD1-CD1 4.47Å; I12-I21 HydrophobicContact CD1-CG1 3.48Å; I12-I21 VanDerWaalsContact CD1-CG1 3.48Å; I12-A24 HydrophobicContact CG2-CB 3.55Å; I12-L58 HydrophobicContact CD1-CD1 4.25Å
13	K	89	Confident	85.6	Confident	162 Å²	162	73.7 Å²	73.7	70%	0.704	38%	0.382	S	S	*	.			trans	-78.8	153.8	174.6	-64.3	178.8	-178.6	175.4	0	110.7	T15 A16	K13-T15 PolarHBondContact O-N 2.91Å; K13-T15 VanDerWaalsContact O-N 3.13Å; K13-A16 WeakPolarHBondContact O-CB 3.46Å; K13-A16 PolarHBondContact O-N 2.82Å
14	K	85.7	Confident	87.6	Confident	131 Å²	131	65.4 Å²	65.4	57%	0.57	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-23.8	172.9	-67.6	-164	175	-168	0	113.4	Y7 A16 R64	Y7-K14 HydrophobicContact CD1-CG 4.45Å; Y7-K14 HydrophobicContact CD2-CD 4.49Å; Y7-K14 HydrophobicContact CD2-CG 3.83Å; Y7-K14 HydrophobicContact CE1-CB 4.48Å; Y7-K14 HydrophobicContact CE2-CD 4.47Å; Y7-K14 HydrophobicContact CE2-CG 4.01Å; Y7-K14 HydrophobicContact CG-CG 4.04Å; K14-A16 VanDerWaalsContact C-N 3.3Å; K14-A16 PolarHBondContact O-N 2.79Å; K14-R64 PolarHBondContact O-NH2 3.02Å
15	T	86.9	Confident	89	Confident	123 Å²	123	62.3 Å²	62.3	76%	0.755	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.6	2.2	176.8	56.6	0	0	0	0	114.1	K13	K13-T15 PolarHBondContact O-N 2.91Å; K13-T15 VanDerWaalsContact O-N 3.13Å
16	A	87.7	Confident	89.3	Confident	2 Å²	2	62.7 Å²	62.7	2%	0.017	32%	0.321	C	S	.	.			trans	-64.5	146.1	-171.2	0	0	0	0	0	113.5	I12 K13 K14 E20 I21 R64	I12-A16 HydrophobicContact CB-CB 4.11Å; I12-A16 HydrophobicContact CD1-CB 4.13Å; I12-A16 HydrophobicContact CG1-CB 4.46Å; K13-A16 WeakPolarHBondContact O-CB 3.46Å; K13-A16 PolarHBondContact O-N 2.82Å; K14-A16 VanDerWaalsContact C-N 3.3Å; K14-A16 PolarHBondContact O-N 2.79Å; A16-E20 WeakPolarHBondContact CA-OE2 3.24Å; A16-E20 HydrophobicContact CB-CB 4.13Å; A16-E20 WeakPolarHBondContact CB-OE2 3.48Å; A16-I21 HydrophobicContact CB-CG1 4.47Å; A16-R64 PolarHBondContact O-NH1 2.86Å; A16-R64 PolarHBondContact O-NH2 2.79Å
17	S	90.4	Very high	89.4	Confident	52 Å²	52	69.2 Å²	69.2	36%	0.364	35%	0.346	S	S	.	.			trans	-74.6	164.8	175.5	76.5	0	0	0	0	112.1	D19 E20 I21	S17-D19 PolarHBondContact O-N 3.28Å; S17-D19 PolarHBondContact OG-N 2.8Å; S17-E20 PolarHBondContact N-OE2 2.78Å; S17-E20 PolarHBondContact O-N 2.79Å; S17-E20 WeakPolarHBondContact OG-CG 3.26Å; S17-E20 PolarHBondContact OG-N 3.35Å; S17-E20 VanDerWaalsContact OG-N 3.08Å; S17-I21 WeakPolarHBondContact O-CD1 3.39Å; S17-I21 WeakPolarHBondContact O-CG1 3.47Å; S17-I21 PolarHBondContact O-N 3.41Å
18	S	89.8	Confident	89.5	Confident	57 Å²	57	69.8 Å²	69.8	40%	0.399	35%	0.349	S	S	.	.	H	α-helix	trans	-54.9	-33.6	171.4	42.3	0	0	0	0	112.7	K22	S18-K22 VanDerWaalsContact O-CG 3.29Å; S18-K22 WeakPolarHBondContact O-CG 3.27Å; S18-K22 PolarHBondContact O-N 2.81Å
19	D	89	Confident	89.6	Confident	87 Å²	87	61.9 Å²	61.9	47%	0.465	32%	0.315	S	S	.	.	H	α-helix	trans	-88.3	-26.4	-174.7	-52.8	-56.8	0	0	0	112.2	S17 K22 K23	S17-D19 PolarHBondContact O-N 3.28Å; S17-D19 PolarHBondContact OG-N 2.8Å; D19-K22 WeakPolarHBondContact OD1-CD 3.25Å; D19-K22 IonicContact OD1-NZ 3.82Å; D19-K22 PolarHBondContact OD1-NZ 2.8Å; D19-K23 VanDerWaalsContact O-CB 3.26Å; D19-K23 WeakPolarHBondContact O-CB 3.18Å; D19-K23 PolarHBondContact O-N 2.89Å
20	E	91.2	Very high	89.6	Confident	104 Å²	104	62.4 Å²	62.4	49%	0.486	32%	0.318	S	S	.	.	H	α-helix	trans	-64.2	-42.9	162.3	-73.8	179	170.9	0	0	111.3	A16 S17 K23 A24	A16-E20 WeakPolarHBondContact CA-OE2 3.24Å; A16-E20 HydrophobicContact CB-CB 4.13Å; A16-E20 WeakPolarHBondContact CB-OE2 3.48Å; S17-E20 PolarHBondContact N-OE2 2.78Å; S17-E20 PolarHBondContact O-N 2.79Å; S17-E20 WeakPolarHBondContact OG-CG 3.26Å; S17-E20 PolarHBondContact OG-N 3.35Å; S17-E20 VanDerWaalsContact OG-N 3.08Å; E20-K23 PolarHBondContact O-N 2.78Å; E20-A24 VanDerWaalsContact O-CB 3.27Å; E20-A24 WeakPolarHBondContact O-CB 3.18Å; E20-A24 PolarHBondContact O-N 2.82Å
21	I	91.2	Very high	89.6	Confident	0 Å²	0	67.9 Å²	67.9	0%	0	34%	0.342	C	S	.	.	H	α-helix	trans	-59.4	-48	174.3	-72.4	158.5	0	0	0	110.8	L10 I12 A16 S17 A24 Y25 Y55 L58 R64	L10-I21 HydrophobicContact CD1-CG2 4.12Å; I12-I21 HydrophobicContact CD1-CB 4.48Å; I12-I21 HydrophobicContact CD1-CD1 4.47Å; I12-I21 HydrophobicContact CD1-CG1 3.48Å; I12-I21 VanDerWaalsContact CD1-CG1 3.48Å; A16-I21 HydrophobicContact CB-CG1 4.47Å; S17-I21 WeakPolarHBondContact O-CD1 3.39Å; S17-I21 WeakPolarHBondContact O-CG1 3.47Å; S17-I21 PolarHBondContact O-N 3.41Å; I21-A24 PolarHBondContact O-N 3.2Å; I21-Y25 WeakPolarHBondContact O-CB 3.4Å; I21-Y25 PolarHBondContact O-N 2.81Å; I21-Y55 HydrophobicContact CG2-CD2 3.81Å; I21-Y55 HydrophobicContact CG2-CE2 4.14Å; I21-L58 HydrophobicContact CD1-CB 4.04Å; I21-L58 HydrophobicContact CG1-CB 4.48Å; I21-L58 HydrophobicContact CG2-CB 4.23Å; I21-R64 VanDerWaalsContact CD1-NH1 3.3Å
22	K	90.2	Very high	89.6	Confident	69 Å²	69	68 Å²	68	30%	0.3	32%	0.324	S	S	.	.	H	α-helix	trans	-61	-43	174	-70.8	165.7	-170.8	166.4	0	112.6	S18 D19 R26 Y55	S18-K22 VanDerWaalsContact O-CG 3.29Å; S18-K22 WeakPolarHBondContact O-CG 3.27Å; S18-K22 PolarHBondContact O-N 2.81Å; D19-K22 WeakPolarHBondContact OD1-CD 3.25Å; D19-K22 IonicContact OD1-NZ 3.82Å; D19-K22 PolarHBondContact OD1-NZ 2.8Å; K22-R26 WeakPolarHBondContact O-CG 3.4Å; K22-R26 PolarHBondContact O-N 2.83Å; K22-Y55 HydrophobicContact CB-CE2 4.41Å; K22-Y55 HydrophobicContact CG-CE2 3.79Å
23	K	90.1	Very high	89.4	Confident	147 Å²	147	68.2 Å²	68.2	64%	0.639	33%	0.325	S	S	*	.	H	α-helix	trans	-65.9	-40.5	178.7	-170.6	175.9	-177.9	178.7	0	111.5	D19 E20 R27	D19-K23 VanDerWaalsContact O-CB 3.26Å; D19-K23 WeakPolarHBondContact O-CB 3.18Å; D19-K23 PolarHBondContact O-N 2.89Å; E20-K23 PolarHBondContact O-N 2.78Å; K23-R27 WeakPolarHBondContact O-CB 3.14Å; K23-R27 PolarHBondContact O-N 2.94Å
24	A	92	Very high	89.2	Confident	6 Å²	6	62 Å²	62	5%	0.05	30%	0.301	C	S	.	.	H	α-helix	trans	-65	-47.5	175.2	0	0	0	0	0	112	L10 I12 E20 I21 R27 L28	L10-A24 HydrophobicContact CB-CB 4.19Å; I12-A24 HydrophobicContact CG2-CB 3.55Å; E20-A24 VanDerWaalsContact O-CB 3.27Å; E20-A24 WeakPolarHBondContact O-CB 3.18Å; E20-A24 PolarHBondContact O-N 2.82Å; I21-A24 PolarHBondContact O-N 3.2Å; A24-R27 PolarHBondContact O-N 2.8Å; A24-L28 WeakPolarHBondContact O-CB 3.43Å; A24-L28 WeakPolarHBondContact O-CG 3.45Å; A24-L28 PolarHBondContact O-N 2.84Å
25	Y	91.4	Very high	89.1	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-56.5	-55	174.7	173.8	-104.8	0	0	0	111.5	I21 R27 L28 A29 I51 Y55 I102 F103 V106	I21-Y25 WeakPolarHBondContact O-CB 3.4Å; I21-Y25 PolarHBondContact O-N 2.81Å; Y25-R27 VanDerWaalsContact C-N 3.31Å; Y25-R27 PolarHBondContact O-N 2.89Å; Y25-L28 PolarHBondContact O-N 2.84Å; Y25-L28 VanDerWaalsContact O-N 3.11Å; Y25-A29 HydrophobicContact CD2-CB 4.4Å; Y25-A29 HydrophobicContact CE1-CB 4.28Å; Y25-A29 HydrophobicContact CE2-CB 4.02Å; Y25-A29 WeakPolarHBondContact O-CB 3.37Å; Y25-A29 PolarHBondContact O-N 3.33Å; Y25-I51 HydrophobicContact CD2-CG2 3.61Å; Y25-I51 HydrophobicContact CE2-CG2 3.91Å; Y25-Y55 VanDerWaalsContact CB-CD2 3.5Å; Y25-Y55 HydrophobicContact CD1-CD1 4.31Å; Y25-Y55 HydrophobicContact CD1-CD2 4.15Å; Y25-Y55 HydrophobicContact CD1-CE2 4.43Å; Y25-Y55 HydrophobicContact CD1-CG 4.08Å; Y25-Y55 VanDerWaalsContact CD2-CB 3.45Å; Y25-Y55 HydrophobicContact CD2-CD1 4.4Å; Y25-Y55 HydrophobicContact CD2-CD2 4.29Å; Y25-Y55 AromaticContact CD2-CG 3.79Å; Y25-Y55 HydrophobicContact CD2-CG 3.79Å; Y25-Y55 HydrophobicContact CE1-CD1 4.49Å; Y25-Y55 HydrophobicContact CE2-CG 4.38Å; Y25-Y55 HydrophobicContact CG-CD1 4.27Å; Y25-Y55 AromaticContact CG-CD2 3.71Å; Y25-Y55 HydrophobicContact CG-CD2 3.71Å; Y25-Y55 HydrophobicContact CG-CE2 4.4Å; Y25-Y55 AromaticContact CG-CG 3.63Å; Y25-Y55 HydrophobicContact CG-CG 3.63Å; Y25-I102 HydrophobicContact CE1-CG2 4.43Å; Y25-F103 WeakPolarHBondContact OH-CA 3.2Å; Y25-F103 PolarHBondContact OH-N 2.86Å; Y25-V106 HydrophobicContact CD1-CB 4.46Å; Y25-V106 HydrophobicContact CD1-CG1 4.1Å; Y25-V106 HydrophobicContact CD1-CG2 4.25Å; Y25-V106 HydrophobicContact CE1-CB 4.05Å; Y25-V106 HydrophobicContact CE1-CG1 4.12Å; Y25-V106 HydrophobicContact CE1-CG2 3.94Å
26	R	88.1	Confident	89.1	Confident	48 Å²	48	60.8 Å²	60.8	18%	0.181	29%	0.29	C	S	.	.	H	α-helix	trans	-54.5	-44.2	-179.6	-73.5	-176	-67.6	-122.9	-2.7	112.7	K22 L30 V106 F107 L115	K22-R26 WeakPolarHBondContact O-CG 3.4Å; K22-R26 PolarHBondContact O-N 2.83Å; R26-L30 WeakPolarHBondContact O-CB 3.5Å; R26-L30 VanDerWaalsContact O-CG 3.31Å; R26-L30 WeakPolarHBondContact O-CG 3.48Å; R26-L30 PolarHBondContact O-N 2.8Å; R26-L30 VanDerWaalsContact O-N 3.12Å; R26-V106 HydrophobicContact CG-CG1 3.81Å; R26-F107 HydrophobicContact CB-CE2 4.22Å; R26-F107 HydrophobicContact CB-CZ 3.77Å; R26-F107 HydrophobicContact CG-CE1 4.4Å; R26-F107 HydrophobicContact CG-CE2 3.77Å; R26-F107 HydrophobicContact CG-CZ 3.69Å; R26-L115 VanDerWaalsContact CZ-CD1 3.44Å
27	R	89.7	Confident	89	Confident	156 Å²	156	62.3 Å²	62.3	59%	0.589	30%	0.297	S	S	*	.	H	α-helix	trans	-63	-44.5	177.9	-178.1	-176.4	63.4	126.1	1	112.5	K23 A24 Y25 K31	K23-R27 WeakPolarHBondContact O-CB 3.14Å; K23-R27 PolarHBondContact O-N 2.94Å; A24-R27 PolarHBondContact O-N 2.8Å; Y25-R27 VanDerWaalsContact C-N 3.31Å; Y25-R27 PolarHBondContact O-N 2.89Å; R27-K31 PolarHBondContact O-N 2.77Å; R27-K31 VanDerWaalsContact O-N 3.15Å
28	L	91.8	Very high	88.7	Confident	21 Å²	21	64.2 Å²	64.2	11%	0.11	31%	0.309	C	S	.	.	H	α-helix	trans	-78.7	-36.8	-176.5	-71.2	170.1	0	0	0	112.7	I9 L10 A24 Y25 K31 W32 I51	I9-L28 WeakPolarHBondContact O-CD1 3.38Å; L10-L28 HydrophobicContact CB-CD1 4.48Å; L10-L28 HydrophobicContact CD2-CD1 4.13Å; L10-L28 WeakPolarHBondContact O-CD1 3.31Å; A24-L28 WeakPolarHBondContact O-CB 3.43Å; A24-L28 WeakPolarHBondContact O-CG 3.45Å; A24-L28 PolarHBondContact O-N 2.84Å; Y25-L28 PolarHBondContact O-N 2.84Å; Y25-L28 VanDerWaalsContact O-N 3.11Å; L28-K31 PolarHBondContact O-N 3.27Å; L28-W32 PolarHBondContact O-N 3.19Å; L28-I51 HydrophobicContact CB-CD1 3.85Å; L28-I51 HydrophobicContact CB-CG1 4.18Å; L28-I51 HydrophobicContact CB-CG2 3.92Å
29	A	89.8	Confident	88.5	Confident	0 Å²	0	69 Å²	69	0%	0	33%	0.33	C	S	.	.	H	α-helix	trans	-63.1	-41	174.5	0	0	0	0	0	111.4	Y25 H33 F48 F103	Y25-A29 HydrophobicContact CD2-CB 4.4Å; Y25-A29 HydrophobicContact CE1-CB 4.28Å; Y25-A29 HydrophobicContact CE2-CB 4.02Å; Y25-A29 WeakPolarHBondContact O-CB 3.37Å; Y25-A29 PolarHBondContact O-N 3.33Å; A29-H33 WeakPolarHBondContact O-CB 3.43Å; A29-H33 PolarHBondContact O-N 3.35Å; A29-F48 HydrophobicContact CB-CD2 4.39Å; A29-F48 HydrophobicContact CB-CE2 3.78Å; A29-F48 WeakPolarHBondContact O-CE2 3.44Å; A29-F103 HydrophobicContact CB-CD2 3.87Å; A29-F103 HydrophobicContact CB-CE2 4.04Å
30	L	88.1	Confident	88.5	Confident	56 Å²	56	69.8 Å²	69.8	29%	0.293	33%	0.329	S	S	.	.	H	α-helix	trans	-64.9	-41.8	170.9	-73.2	171.3	0	0	0	112.3	R26 K36 F103 F107	R26-L30 WeakPolarHBondContact O-CB 3.5Å; R26-L30 VanDerWaalsContact O-CG 3.31Å; R26-L30 WeakPolarHBondContact O-CG 3.48Å; R26-L30 PolarHBondContact O-N 2.8Å; R26-L30 VanDerWaalsContact O-N 3.12Å; L30-K36 WeakPolarHBondContact O-CD 3.47Å; L30-F103 HydrophobicContact CD2-CE2 4.44Å; L30-F103 HydrophobicContact CD2-CZ 4.24Å; L30-F107 HydrophobicContact CD1-CE1 4.11Å; L30-F107 HydrophobicContact CD1-CZ 4.16Å; L30-F107 HydrophobicContact CD2-CE1 4.16Å; L30-F107 HydrophobicContact CD2-CZ 4.26Å; L30-F107 HydrophobicContact CG-CE1 4.13Å; L30-F107 HydrophobicContact CG-CZ 3.89Å
31	K	88.7	Confident	88.3	Confident	116 Å²	116	70.5 Å²	70.5	50%	0.504	33%	0.331	S	S	.	.	H	α-helix	trans	-62.9	-42.1	179.3	-180	172.2	179	173.3	0	112.6	R27 L28 N37	R27-K31 PolarHBondContact O-N 2.77Å; R27-K31 VanDerWaalsContact O-N 3.15Å; L28-K31 PolarHBondContact O-N 3.27Å; K31-N37 PolarHBondContact O-ND2 3.2Å
32	W	90	Very high	88.2	Confident	59 Å²	59	76.8 Å²	76.8	22%	0.223	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-102.1	17.5	-176.2	-65.8	107.5	0	0	0	113.6	L28 A44 C47 F48 I51	L28-W32 PolarHBondContact O-N 3.19Å; W32-A44 HydrophobicContact CE3-CB 4.36Å; W32-C47 HydrophobicContact CB-CB 4.2Å; W32-C47 HydrophobicContact CD2-CB 3.64Å; W32-C47 HydrophobicContact CE3-CB 3.98Å; W32-C47 HydrophobicContact CG-CB 3.79Å; W32-C47 HydrophobicContact CZ2-CB 4.47Å; W32-F48 HydrophobicContact CB-CB 4.46Å; W32-I51 HydrophobicContact CB-CD1 4.15Å; W32-I51 HydrophobicContact CG-CD1 3.94Å
33	H	86.4	Confident	88.1	Confident	37 Å²	37	77.9 Å²	77.9	17%	0.171	37%	0.366	C	S	.	.			trans	-65	135.7	173.2	-162.1	-101	0	0	0	109.5	A29 D35 K36 N37	A29-H33 WeakPolarHBondContact O-CB 3.43Å; A29-H33 PolarHBondContact O-N 3.35Å; H33-D35 VanDerWaalsContact C-N 3.26Å; H33-D35 WeakPolarHBondContact ND1-CB 3.32Å; H33-D35 PolarHBondContact O-N 3.34Å; H33-K36 PolarHBondContact O-N 3.09Å; H33-N37 PolarHBondContact O-N 2.97Å; H33-N37 PolarHBondContact O-ND2 3.35Å
34	P	84.6	Confident	88	Confident	32 Å²	32	70.9 Å²	70.9	21%	0.208	34%	0.336	C	S	.	.	G	3₁₀ helix	trans	-60.4	-35	-175.5	21.3	-32.8	0	0	0	112.9	K36 N37	P34-K36 PolarHBondContact O-N 3.14Å; P34-N37 CarbonylContact O-C 3.37Å; P34-N37 PolarHBondContact O-N 2.95Å
35	D	84.9	Confident	87.8	Confident	97 Å²	97	74.9 Å²	74.9	52%	0.519	35%	0.353	S	S	.	.	G	3₁₀ helix	trans	-54.8	-33.6	172.6	-174.6	74.9	0	0	0	113.7	H33	H33-D35 VanDerWaalsContact C-N 3.26Å; H33-D35 WeakPolarHBondContact ND1-CB 3.32Å; H33-D35 PolarHBondContact O-N 3.34Å
36	K	85.6	Confident	87.7	Confident	131 Å²	131	80.7 Å²	80.7	57%	0.57	38%	0.379	S	S	*	.	G	3₁₀ helix	trans	-87.7	-7.2	178.4	-63.9	-150.7	-175.4	-57.3	0	114.1	L30 H33 P34 P38	L30-K36 WeakPolarHBondContact O-CD 3.47Å; H33-K36 PolarHBondContact O-N 3.09Å; P34-K36 PolarHBondContact O-N 3.14Å; K36-P38 VanDerWaalsContact C-CD 3.47Å
37	N	85.7	Confident	87.6	Confident	33 Å²	33	80.1 Å²	80.1	18%	0.176	38%	0.382	C	S	.	.			trans	-134.7	53.1	-172.6	-61.3	-92.4	0	0	0	110.9	K31 H33 P34 D39 K40 K41 A44	K31-N37 PolarHBondContact O-ND2 3.2Å; H33-N37 PolarHBondContact O-N 2.97Å; H33-N37 PolarHBondContact O-ND2 3.35Å; P34-N37 CarbonylContact O-C 3.37Å; P34-N37 PolarHBondContact O-N 2.95Å; N37-D39 VanDerWaalsContact C-N 3.28Å; N37-D39 PolarHBondContact O-N 2.86Å; N37-K40 CarbonylContact O-C 3.33Å; N37-K40 PolarHBondContact O-N 2.74Å; N37-K41 PolarHBondContact O-N 2.71Å; N37-K41 VanDerWaalsContact O-N 3.07Å; N37-A44 HydrophobicContact CB-CB 3.7Å
38	P	83.6	Confident	87.6	Confident	93 Å²	93	73 Å²	73	60%	0.604	36%	0.355	S	S	*	.	G	3₁₀ helix	trans	-57.3	-41.1	-174.9	24.3	-34.2	0	0	0	112.2	K36 K40	K36-P38 VanDerWaalsContact C-CD 3.47Å; P38-K40 PolarHBondContact O-N 3.21Å
39	D	86.8	Confident	87.5	Confident	158 Å²	158	76.9 Å²	76.9	85%	0.845	37%	0.371	S	S	*	.	G	3₁₀ helix	trans	-70	-18.3	-179.4	-41	-71.9	0	0	0	113.6	N37	N37-D39 VanDerWaalsContact C-N 3.28Å; N37-D39 PolarHBondContact O-N 2.86Å
40	K	88.5	Confident	87.4	Confident	102 Å²	102	80 Å²	80	44%	0.443	39%	0.387	S	S	.	.	G	3₁₀ helix	trans	-130.2	29.9	-170.7	-84.5	176.9	167	-76.6	0	112.3	N37 P38 E42 E43 A44	N37-K40 CarbonylContact O-C 3.33Å; N37-K40 PolarHBondContact O-N 2.74Å; P38-K40 PolarHBondContact O-N 3.21Å; K40-E42 VanDerWaalsContact C-N 3.28Å; K40-E42 PolarHBondContact O-N 3.11Å; K40-E42 VanDerWaalsContact O-N 3.14Å; K40-E43 HydrophobicContact CB-CB 4.45Å; K40-E43 IonicContact NZ-OE1 3.26Å; K40-E43 PolarHBondContact NZ-OE1 3.45Å; K40-E43 IonicContact NZ-OE2 3.45Å; K40-E43 PolarHBondContact NZ-OE2 3.35Å; K40-E43 PolarHBondContact O-N 2.84Å; K40-A44 PolarHBondContact O-N 3.05Å
41	K	88.1	Confident	87.6	Confident	120 Å²	120	77.5 Å²	77.5	52%	0.522	37%	0.374	S	S	.	.	H	α-helix	trans	-47.6	-45.7	-175.1	-177.5	175	173.2	179	0	113.5	N37 A44 E45	N37-K41 PolarHBondContact O-N 2.71Å; N37-K41 VanDerWaalsContact O-N 3.07Å; K41-A44 PolarHBondContact O-N 2.67Å; K41-E45 WeakPolarHBondContact CE-OE1 3.4Å; K41-E45 HydrophobicContact CG-CG 4.41Å; K41-E45 IonicContact NZ-OE1 3.83Å; K41-E45 WeakPolarHBondContact O-CB 3.41Å; K41-E45 WeakPolarHBondContact O-CG 3.5Å; K41-E45 PolarHBondContact O-N 2.79Å
42	E	88.3	Confident	87.6	Confident	132 Å²	132	72 Å²	72	62%	0.617	35%	0.35	S	S	*	.	H	α-helix	trans	-63.3	-42.6	177.8	-81.7	-163.3	-134	0	0	114.2	K40 K46	K40-E42 VanDerWaalsContact C-N 3.28Å; K40-E42 PolarHBondContact O-N 3.11Å; K40-E42 VanDerWaalsContact O-N 3.14Å; E42-K46 WeakPolarHBondContact O-CB 3.42Å; E42-K46 WeakPolarHBondContact O-CD 3.39Å; E42-K46 WeakPolarHBondContact O-CG 3.5Å; E42-K46 PolarHBondContact O-N 3.05Å; E42-K46 VanDerWaalsContact O-N 3.1Å; E42-K46 IonicContact OE2-NZ 3.02Å; E42-K46 PolarHBondContact OE2-NZ 2.96Å
43	E	88.7	Confident	87.5	Confident	91 Å²	91	70.2 Å²	70.2	43%	0.425	35%	0.345	S	S	.	.	H	α-helix	trans	-66.5	-42.8	176.5	-70.3	175.1	-149.9	0	0	110.1	K40 K46 C47	K40-E43 HydrophobicContact CB-CB 4.45Å; K40-E43 IonicContact NZ-OE1 3.26Å; K40-E43 PolarHBondContact NZ-OE1 3.45Å; K40-E43 IonicContact NZ-OE2 3.45Å; K40-E43 PolarHBondContact NZ-OE2 3.35Å; K40-E43 PolarHBondContact O-N 2.84Å; E43-K46 PolarHBondContact O-N 3.19Å; E43-C47 WeakPolarHBondContact O-CB 3.32Å; E43-C47 PolarHBondContact O-N 2.77Å; E43-C47 PolarHBondContact O-SG 3.37Å
44	A	88.1	Confident	87.7	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	34%	0.336	C	S	.	.	H	α-helix	trans	-60.4	-48.9	177.4	0	0	0	0	0	111.8	W32 N37 K40 K41 K46 C47 F48	W32-A44 HydrophobicContact CE3-CB 4.36Å; N37-A44 HydrophobicContact CB-CB 3.7Å; K40-A44 PolarHBondContact O-N 3.05Å; K41-A44 PolarHBondContact O-N 2.67Å; A44-K46 PolarHBondContact O-N 3.16Å; A44-C47 PolarHBondContact O-N 3.43Å; A44-F48 WeakPolarHBondContact O-CB 3.49Å; A44-F48 PolarHBondContact O-N 2.68Å
45	E	87.9	Confident	88	Confident	90 Å²	90	68.3 Å²	68.3	42%	0.421	33%	0.332	S	S	.	.	H	α-helix	trans	-61.8	-43.2	176.9	-74.4	174.3	175.5	0	0	112.4	K41 F48 K49	K41-E45 WeakPolarHBondContact CE-OE1 3.4Å; K41-E45 HydrophobicContact CG-CG 4.41Å; K41-E45 IonicContact NZ-OE1 3.83Å; K41-E45 WeakPolarHBondContact O-CB 3.41Å; K41-E45 WeakPolarHBondContact O-CG 3.5Å; K41-E45 PolarHBondContact O-N 2.79Å; E45-F48 PolarHBondContact O-N 3.01Å; E45-K49 WeakPolarHBondContact O-CB 3.27Å; E45-K49 PolarHBondContact O-N 3.14Å
46	K	88.1	Confident	88.2	Confident	122 Å²	122	64.8 Å²	64.8	53%	0.53	31%	0.312	S	S	.	.	H	α-helix	trans	-62.3	-47.3	176.3	-70.6	162	-164.4	164.2	0	111.4	E42 E43 A44 L50	E42-K46 WeakPolarHBondContact O-CB 3.42Å; E42-K46 WeakPolarHBondContact O-CD 3.39Å; E42-K46 WeakPolarHBondContact O-CG 3.5Å; E42-K46 PolarHBondContact O-N 3.05Å; E42-K46 VanDerWaalsContact O-N 3.1Å; E42-K46 IonicContact OE2-NZ 3.02Å; E42-K46 PolarHBondContact OE2-NZ 2.96Å; E43-K46 PolarHBondContact O-N 3.19Å; A44-K46 PolarHBondContact O-N 3.16Å; K46-L50 WeakPolarHBondContact O-CG 3.38Å; K46-L50 PolarHBondContact O-N 3.27Å
47	C	87.4	Confident	88.3	Confident	36 Å²	36	59.2 Å²	59.2	24%	0.243	29%	0.289	C	S	.	.	H	α-helix	trans	-64.2	-46.2	175.6	-74.7	0	0	0	0	112.2	W32 E43 A44 K49 L50 I51	W32-C47 HydrophobicContact CB-CB 4.2Å; W32-C47 HydrophobicContact CD2-CB 3.64Å; W32-C47 HydrophobicContact CE3-CB 3.98Å; W32-C47 HydrophobicContact CG-CB 3.79Å; W32-C47 HydrophobicContact CZ2-CB 4.47Å; E43-C47 WeakPolarHBondContact O-CB 3.32Å; E43-C47 PolarHBondContact O-N 2.77Å; E43-C47 PolarHBondContact O-SG 3.37Å; A44-C47 PolarHBondContact O-N 3.43Å; C47-K49 VanDerWaalsContact C-N 3.33Å; C47-K49 PolarHBondContact O-N 3.24Å; C47-L50 PolarHBondContact O-N 2.93Å; C47-I51 HydrophobicContact CB-CD1 4.33Å; C47-I51 WeakPolarHBondContact O-CB 3.29Å; C47-I51 VanDerWaalsContact O-CD1 3.31Å; C47-I51 WeakPolarHBondContact O-CD1 3.45Å; C47-I51 VanDerWaalsContact O-CG1 3.25Å; C47-I51 WeakPolarHBondContact O-CG1 3.37Å; C47-I51 PolarHBondContact O-N 3.32Å
48	F	88.8	Confident	88.4	Confident	8 Å²	8	57.7 Å²	57.7	4%	0.035	28%	0.281	C	S	.	.	H	α-helix	trans	-63.8	-36.7	-177	-171.7	-90.2	0	0	0	112.4	A29 W32 A44 E45 S52 P99 M100 F103	A29-F48 HydrophobicContact CB-CD2 4.39Å; A29-F48 HydrophobicContact CB-CE2 3.78Å; A29-F48 WeakPolarHBondContact O-CE2 3.44Å; W32-F48 HydrophobicContact CB-CB 4.46Å; A44-F48 WeakPolarHBondContact O-CB 3.49Å; A44-F48 PolarHBondContact O-N 2.68Å; E45-F48 PolarHBondContact O-N 3.01Å; F48-S52 WeakPolarHBondContact O-CB 3.4Å; F48-S52 PolarHBondContact O-N 3.03Å; F48-S52 PolarHBondContact O-OG 2.84Å; F48-P99 HydrophobicContact CD1-CB 3.58Å; F48-P99 HydrophobicContact CE1-CB 3.49Å; F48-P99 VanDerWaalsContact CE1-CB 3.49Å; F48-P99 WeakPolarHBondContact CE1-O 3.44Å; F48-M100 HydrophobicContact CD1-CE 4.14Å; F48-M100 HydrophobicContact CE1-CE 3.31Å; F48-M100 HydrophobicContact CE2-CE 4.27Å; F48-M100 HydrophobicContact CZ-CE 3.4Å; F48-F103 HydrophobicContact CE2-CD2 4.14Å; F48-F103 HydrophobicContact CZ-CB 3.97Å; F48-F103 AromaticContact CZ-CD2 3.94Å; F48-F103 HydrophobicContact CZ-CD2 3.94Å; F48-F103 HydrophobicContact CZ-CG 4.15Å
49	K	88.9	Confident	88.6	Confident	101 Å²	101	54.9 Å²	54.9	44%	0.439	26%	0.264	S	S	.	.	H	α-helix	trans	-61.2	-52.2	170.4	-176	170.6	179.3	173.5	0	111.3	E45 C47 I51 S52 E53 P99	E45-K49 WeakPolarHBondContact O-CB 3.27Å; E45-K49 PolarHBondContact O-N 3.14Å; C47-K49 VanDerWaalsContact C-N 3.33Å; C47-K49 PolarHBondContact O-N 3.24Å; K49-I51 VanDerWaalsContact C-N 3.31Å; K49-I51 PolarHBondContact O-N 3.28Å; K49-S52 PolarHBondContact O-N 2.99Å; K49-E53 WeakPolarHBondContact O-CB 3.24Å; K49-E53 PolarHBondContact O-N 2.64Å; K49-P99 HydrophobicContact CB-CG 4.41Å; K49-P99 HydrophobicContact CG-CG 4.35Å
50	L	89	Confident	88.6	Confident	65 Å²	65	50.7 Å²	50.7	34%	0.34	24%	0.241	S	C	.	.	H	α-helix	trans	-60.9	-36	178.1	-70.2	169.4	0	0	0	113.2	I9 K46 C47 E53 A54	I9-L50 HydrophobicContact CD1-CB 4.49Å; I9-L50 HydrophobicContact CG2-CB 4.31Å; K46-L50 WeakPolarHBondContact O-CG 3.38Å; K46-L50 PolarHBondContact O-N 3.27Å; C47-L50 PolarHBondContact O-N 2.93Å; L50-E53 PolarHBondContact O-N 2.98Å; L50-A54 WeakPolarHBondContact O-CB 3.3Å; L50-A54 PolarHBondContact O-N 3Å
51	I	90.9	Very high	88.6	Confident	5 Å²	5	50.7 Å²	50.7	3%	0.026	25%	0.251	C	S	.	.	H	α-helix	trans	-68	-40.8	176.8	-73.7	156.9	0	0	0	111.2	I9 L10 Y25 L28 W32 C47 K49 Y55	I9-I51 HydrophobicContact CG2-CG1 4.06Å; L10-I51 HydrophobicContact CD2-CG2 4.14Å; Y25-I51 HydrophobicContact CD2-CG2 3.61Å; Y25-I51 HydrophobicContact CE2-CG2 3.91Å; L28-I51 HydrophobicContact CB-CD1 3.85Å; L28-I51 HydrophobicContact CB-CG1 4.18Å; L28-I51 HydrophobicContact CB-CG2 3.92Å; W32-I51 HydrophobicContact CB-CD1 4.15Å; W32-I51 HydrophobicContact CG-CD1 3.94Å; C47-I51 HydrophobicContact CB-CD1 4.33Å; C47-I51 WeakPolarHBondContact O-CB 3.29Å; C47-I51 VanDerWaalsContact O-CD1 3.31Å; C47-I51 WeakPolarHBondContact O-CD1 3.45Å; C47-I51 VanDerWaalsContact O-CG1 3.25Å; C47-I51 WeakPolarHBondContact O-CG1 3.37Å; C47-I51 PolarHBondContact O-N 3.32Å; K49-I51 VanDerWaalsContact C-N 3.31Å; K49-I51 PolarHBondContact O-N 3.28Å; I51-Y55 WeakPolarHBondContact O-CB 3.42Å; I51-Y55 PolarHBondContact O-N 2.97Å
52	S	90.3	Very high	88.5	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.263	C	S	.	.	H	α-helix	trans	-70.5	-35.6	175.9	-54.6	0	0	0	0	111.6	F48 K49 Y55 E56	F48-S52 WeakPolarHBondContact O-CB 3.4Å; F48-S52 PolarHBondContact O-N 3.03Å; F48-S52 PolarHBondContact O-OG 2.84Å; K49-S52 PolarHBondContact O-N 2.99Å; S52-Y55 PolarHBondContact O-N 2.79Å; S52-E56 PolarHBondContact O-N 3.02Å
53	E	88.1	Confident	88.4	Confident	22 Å²	22	48.7 Å²	48.7	10%	0.103	24%	0.241	C	C	.	.	H	α-helix	trans	-63	-49.3	173.6	-177.5	-175.4	143.5	0	0	112.2	Y6 K49 L50 Y55 E56 V57 F91 F96	Y6-E53 HydrophobicContact CE1-CG 3.72Å; Y6-E53 WeakPolarHBondContact CE1-OE1 3.26Å; Y6-E53 PolarHBondContact OH-OE1 2.8Å; K49-E53 WeakPolarHBondContact O-CB 3.24Å; K49-E53 PolarHBondContact O-N 2.64Å; L50-E53 PolarHBondContact O-N 2.98Å; E53-Y55 PolarHBondContact O-N 3.49Å; E53-E56 PolarHBondContact O-N 3.32Å; E53-V57 PolarHBondContact O-N 3.5Å; E53-V57 VanDerWaalsContact O-N 3.17Å; E53-F91 VanDerWaalsContact CD-CE2 3.45Å; E53-F91 HydrophobicContact CG-CE2 3.72Å; E53-F91 HydrophobicContact CG-CZ 3.72Å; E53-F91 WeakPolarHBondContact OE1-CE2 3.2Å; E53-F96 VanDerWaalsContact CA-CZ 3.45Å; E53-F96 HydrophobicContact CB-CE2 4.02Å; E53-F96 HydrophobicContact CB-CZ 3.88Å; E53-F96 HydrophobicContact CG-CE2 4.21Å
54	A	89.6	Confident	88.3	Confident	0 Å²	0	46.4 Å²	46.4	0%	0	23%	0.228	C	C	.	.	H	α-helix	trans	-60	-34.4	174.3	0	0	0	0	0	112.5	Y6 I9 L10 L50 L58	Y6-A54 HydrophobicContact CD1-CB 3.68Å; Y6-A54 HydrophobicContact CG-CB 3.99Å; I9-A54 HydrophobicContact CB-CB 4.17Å; I9-A54 HydrophobicContact CG2-CB 3.94Å; L10-A54 HydrophobicContact CD1-CB 4.16Å; L10-A54 HydrophobicContact CD2-CB 4.18Å; L10-A54 HydrophobicContact CG-CB 3.77Å; L50-A54 WeakPolarHBondContact O-CB 3.3Å; L50-A54 PolarHBondContact O-N 3Å; A54-L58 VanDerWaalsContact O-CB 3.23Å; A54-L58 WeakPolarHBondContact O-CB 3.17Å; A54-L58 VanDerWaalsContact O-CG 3.24Å; A54-L58 WeakPolarHBondContact O-CG 3.47Å; A54-L58 PolarHBondContact O-N 3.44Å
55	Y	90.8	Very high	88.2	Confident	29 Å²	29	49.8 Å²	49.8	11%	0.114	25%	0.246	C	C	.	.	H	α-helix	trans	-72.6	-47.5	175.7	178.5	-101.4	0	0	0	112.7	I21 K22 Y25 I51 S52 E53 V57 L58 S59 I102 V106	I21-Y55 HydrophobicContact CG2-CD2 3.81Å; I21-Y55 HydrophobicContact CG2-CE2 4.14Å; K22-Y55 HydrophobicContact CB-CE2 4.41Å; K22-Y55 HydrophobicContact CG-CE2 3.79Å; Y25-Y55 VanDerWaalsContact CB-CD2 3.5Å; Y25-Y55 HydrophobicContact CD1-CD1 4.31Å; Y25-Y55 HydrophobicContact CD1-CD2 4.15Å; Y25-Y55 HydrophobicContact CD1-CE2 4.43Å; Y25-Y55 HydrophobicContact CD1-CG 4.08Å; Y25-Y55 VanDerWaalsContact CD2-CB 3.45Å; Y25-Y55 HydrophobicContact CD2-CD1 4.4Å; Y25-Y55 HydrophobicContact CD2-CD2 4.29Å; Y25-Y55 AromaticContact CD2-CG 3.79Å; Y25-Y55 HydrophobicContact CD2-CG 3.79Å; Y25-Y55 HydrophobicContact CE1-CD1 4.49Å; Y25-Y55 HydrophobicContact CE2-CG 4.38Å; Y25-Y55 HydrophobicContact CG-CD1 4.27Å; Y25-Y55 AromaticContact CG-CD2 3.71Å; Y25-Y55 HydrophobicContact CG-CD2 3.71Å; Y25-Y55 HydrophobicContact CG-CE2 4.4Å; Y25-Y55 AromaticContact CG-CG 3.63Å; Y25-Y55 HydrophobicContact CG-CG 3.63Å; I51-Y55 WeakPolarHBondContact O-CB 3.42Å; I51-Y55 PolarHBondContact O-N 2.97Å; S52-Y55 PolarHBondContact O-N 2.79Å; E53-Y55 PolarHBondContact O-N 3.49Å; Y55-V57 VanDerWaalsContact C-N 3.29Å; Y55-V57 PolarHBondContact O-N 2.8Å; Y55-L58 PolarHBondContact O-N 3.41Å; Y55-S59 WeakPolarHBondContact O-CB 3.49Å; Y55-S59 PolarHBondContact O-N 3.28Å; Y55-S59 PolarHBondContact O-OG 2.89Å; Y55-I102 HydrophobicContact CD1-CG2 3.7Å; Y55-I102 HydrophobicContact CE1-CG2 4.09Å; Y55-V106 HydrophobicContact CE1-CG2 3.61Å
56	E	88.2	Confident	87.9	Confident	23 Å²	23	51.3 Å²	51.3	11%	0.107	26%	0.255	C	S	.	.	H	α-helix	trans	-60.6	-39.2	-178.4	-148.5	-152.6	97.5	0	0	111.7	S52 E53 K63 F96 R97 I102	S52-E56 PolarHBondContact O-N 3.02Å; E53-E56 PolarHBondContact O-N 3.32Å; E56-K63 WeakPolarHBondContact O-CD 3.14Å; E56-K63 IonicContact OE1-NZ 2.71Å; E56-K63 PolarHBondContact OE1-NZ 3.01Å; E56-F96 HydrophobicContact CB-CE2 3.87Å; E56-F96 HydrophobicContact CG-CE2 4.47Å; E56-F96 WeakPolarHBondContact OE2-CA 3.39Å; E56-F96 WeakPolarHBondContact OE2-CD2 3.42Å; E56-R97 PolarHBondContact OE2-N 3.28Å; E56-R97 VanDerWaalsContact OE2-N 3.16Å; E56-I102 HydrophobicContact CB-CD1 4.4Å; E56-I102 HydrophobicContact CG-CD1 4.4Å
57	V	88.2	Confident	87.6	Confident	13 Å²	13	48.2 Å²	48.2	8%	0.079	24%	0.24	C	C	.	.	H	α-helix	trans	-75.8	-38.1	178.4	178.5	0	0	0	0	113	Y6 E53 Y55 K63 R64 Y67	Y6-V57 HydrophobicContact CD2-CB 3.93Å; Y6-V57 HydrophobicContact CD2-CG1 3.83Å; Y6-V57 HydrophobicContact CD2-CG2 4.41Å; Y6-V57 HydrophobicContact CE2-CB 3.82Å; Y6-V57 HydrophobicContact CE2-CG1 3.75Å; Y6-V57 HydrophobicContact CE2-CG2 3.81Å; E53-V57 PolarHBondContact O-N 3.5Å; E53-V57 VanDerWaalsContact O-N 3.17Å; Y55-V57 VanDerWaalsContact C-N 3.29Å; Y55-V57 PolarHBondContact O-N 2.8Å; V57-K63 HydrophobicContact CG1-CB 4.26Å; V57-K63 CarbonylContact O-C 3.43Å; V57-K63 VanDerWaalsContact O-CB 3.27Å; V57-K63 WeakPolarHBondContact O-CB 3.08Å; V57-R64 PolarHBondContact O-N 3.43Å; V57-Y67 HydrophobicContact CG1-CD2 4.24Å; V57-Y67 HydrophobicContact CG1-CG 4.09Å
58	L	88.8	Confident	87.4	Confident	2 Å²	2	48.6 Å²	48.6	1%	0.01	24%	0.24	C	C	.	.	H	α-helix	trans	-89	-21.5	-174.8	-65	-179.1	0	0	0	114.5	Y7 L10 I12 I21 A54 Y55 R64 Y67	Y7-L58 HydrophobicContact CD1-CD1 3.81Å; Y7-L58 HydrophobicContact CD1-CD2 4.45Å; Y7-L58 HydrophobicContact CE1-CD1 3.92Å; Y7-L58 HydrophobicContact CE1-CD2 3.83Å; Y7-L58 HydrophobicContact CE2-CD2 3.95Å; Y7-L58 HydrophobicContact CG-CD1 4.19Å; L10-L58 HydrophobicContact CD1-CD1 4.17Å; I12-L58 HydrophobicContact CD1-CD1 4.25Å; I21-L58 HydrophobicContact CD1-CB 4.04Å; I21-L58 HydrophobicContact CG1-CB 4.48Å; I21-L58 HydrophobicContact CG2-CB 4.23Å; A54-L58 VanDerWaalsContact O-CB 3.23Å; A54-L58 WeakPolarHBondContact O-CB 3.17Å; A54-L58 VanDerWaalsContact O-CG 3.24Å; A54-L58 WeakPolarHBondContact O-CG 3.47Å; A54-L58 PolarHBondContact O-N 3.44Å; Y55-L58 PolarHBondContact O-N 3.41Å; L58-R64 HydrophobicContact CD2-CG 3.99Å; L58-Y67 HydrophobicContact CD2-CD1 4.23Å
59	S	87.2	Confident	87	Confident	34 Å²	34	55.7 Å²	55.7	24%	0.238	27%	0.266	C	S	.	.	H	α-helix	trans	-74.6	-38.7	177.6	56.4	0	0	0	0	112.7	Y55 P61	Y55-S59 WeakPolarHBondContact O-CB 3.49Å; Y55-S59 PolarHBondContact O-N 3.28Å; Y55-S59 PolarHBondContact O-OG 2.89Å; S59-P61 WeakPolarHBondContact O-CD 3.43Å
60	D	87.7	Confident	86	Confident	70 Å²	70	57.8 Å²	57.8	37%	0.374	27%	0.272	S	S	.	.	S	Bend	trans	-75.3	116.2	173.1	-91.2	-44.6	0	0	0	110.7	K62 K63 R64	D60-K62 PolarHBondContact O-N 3.05Å; D60-K62 VanDerWaalsContact O-N 3.15Å; D60-K63 HydrophobicContact CB-CB 3.82Å; D60-K63 HydrophobicContact CB-CD 3.81Å; D60-K63 HydrophobicContact CB-CG 3.72Å; D60-K63 PolarHBondContact O-N 2.98Å; D60-K63 VanDerWaalsContact O-N 3.11Å; D60-K63 WeakPolarHBondContact OD2-CD 3.35Å; D60-K63 WeakPolarHBondContact OD2-CE 3.19Å; D60-K63 IonicContact OD2-NZ 2.69Å; D60-K63 PolarHBondContact OD2-NZ 2.71Å; D60-R64 WeakPolarHBondContact O-CB 2.79Å; D60-R64 PolarHBondContact O-N 2.89Å
61	P	87.5	Confident	84.7	Confident	101 Å²	101	57.1 Å²	57.1	66%	0.656	28%	0.281	S	S	*	.	H	α-helix	trans	-62.2	-28.9	-178.1	24.5	-33.8	0	0	0	112.7	S59 D65	S59-P61 WeakPolarHBondContact O-CD 3.43Å; P61-D65 WeakPolarHBondContact O-CB 3.25Å; P61-D65 PolarHBondContact O-N 2.92Å
62	K	86.3	Confident	82.9	Confident	174 Å²	174	66.6 Å²	66.6	76%	0.757	32%	0.316	S	S	*	.	H	α-helix	trans	-68.9	-46.6	174.5	-65.6	-178.9	180	177.8	0	112.1	D60 D65 M66	D60-K62 PolarHBondContact O-N 3.05Å; D60-K62 VanDerWaalsContact O-N 3.15Å; K62-D65 PolarHBondContact O-N 3.32Å; K62-M66 WeakPolarHBondContact O-CG 3.29Å; K62-M66 PolarHBondContact O-N 3.24Å; K62-M66 VanDerWaalsContact O-N 3.07Å
63	K	86.1	Confident	80.6	Confident	36 Å²	36	69.6 Å²	69.6	16%	0.157	33%	0.332	C	S	.	.	H	α-helix	trans	-66.8	-40.7	178.4	-64.8	-177.4	-170.8	152.5	0	110.7	E56 V57 D60 M66 Y67 F94	E56-K63 WeakPolarHBondContact O-CD 3.14Å; E56-K63 IonicContact OE1-NZ 2.71Å; E56-K63 PolarHBondContact OE1-NZ 3.01Å; V57-K63 HydrophobicContact CG1-CB 4.26Å; V57-K63 CarbonylContact O-C 3.43Å; V57-K63 VanDerWaalsContact O-CB 3.27Å; V57-K63 WeakPolarHBondContact O-CB 3.08Å; D60-K63 HydrophobicContact CB-CB 3.82Å; D60-K63 HydrophobicContact CB-CD 3.81Å; D60-K63 HydrophobicContact CB-CG 3.72Å; D60-K63 PolarHBondContact O-N 2.98Å; D60-K63 VanDerWaalsContact O-N 3.11Å; D60-K63 WeakPolarHBondContact OD2-CD 3.35Å; D60-K63 WeakPolarHBondContact OD2-CE 3.19Å; D60-K63 IonicContact OD2-NZ 2.69Å; D60-K63 PolarHBondContact OD2-NZ 2.71Å; K63-M66 PolarHBondContact O-N 2.68Å; K63-Y67 WeakPolarHBondContact O-CB 3.26Å; K63-Y67 PolarHBondContact O-N 2.84Å; K63-F94 HydrophobicContact CD-CD1 3.99Å; K63-F94 HydrophobicContact CD-CE1 4.02Å; K63-F94 HydrophobicContact CG-CD1 4.24Å; K63-F94 HydrophobicContact CG-CE1 3.75Å; K63-F94 HydrophobicContact CG-CZ 4.35Å
64	R	87.4	Confident	78.8	Confident	43 Å²	43	73.9 Å²	73.9	16%	0.162	36%	0.362	C	S	.	.	H	α-helix	trans	-60	-46.9	174.9	-176	173	177.4	-179.6	-0.5	112.5	Y7 K14 A16 I21 V57 L58 D60 Y67 D68	Y7-R64 PolarHBondContact OH-NE 3.25Å; K14-R64 PolarHBondContact O-NH2 3.02Å; A16-R64 PolarHBondContact O-NH1 2.86Å; A16-R64 PolarHBondContact O-NH2 2.79Å; I21-R64 VanDerWaalsContact CD1-NH1 3.3Å; V57-R64 PolarHBondContact O-N 3.43Å; L58-R64 HydrophobicContact CD2-CG 3.99Å; D60-R64 WeakPolarHBondContact O-CB 2.79Å; D60-R64 PolarHBondContact O-N 2.89Å; R64-Y67 PolarHBondContact O-N 3.28Å; R64-D68 IonicContact NE-OD2 3.64Å; R64-D68 WeakPolarHBondContact O-CB 3.47Å; R64-D68 PolarHBondContact O-N 3.41Å
65	D	85.1	Confident	76.9	Confident	72 Å²	72	82 Å²	82	39%	0.385	40%	0.399	S	S	.	.	H	α-helix	trans	-62.6	-44.2	175.9	178.9	35.3	0	0	0	111.8	P61 K62 Y67 D68 R69	P61-D65 WeakPolarHBondContact O-CB 3.25Å; P61-D65 PolarHBondContact O-N 2.92Å; K62-D65 PolarHBondContact O-N 3.32Å; D65-Y67 VanDerWaalsContact C-N 3.31Å; D65-Y67 PolarHBondContact O-N 3.35Å; D65-D68 PolarHBondContact O-N 3.39Å; D65-R69 VanDerWaalsContact CG-NE 3.25Å; D65-R69 WeakPolarHBondContact O-CB 3.37Å; D65-R69 WeakPolarHBondContact O-CG 3.04Å; D65-R69 PolarHBondContact O-N 3.45Å; D65-R69 IonicContact OD1-CZ 2.8Å; D65-R69 IonicContact OD1-NE 3.86Å; D65-R69 PolarHBondContact OD1-NE 3.46Å; D65-R69 IonicContact OD1-NH2 3.43Å; D65-R69 PolarHBondContact OD1-NH2 3.36Å; D65-R69 IonicContact OD2-CZ 3.13Å; D65-R69 VanDerWaalsContact OD2-CZ 3.26Å; D65-R69 IonicContact OD2-NE 3.57Å; D65-R69 PolarHBondContact OD2-NE 2.7Å; D65-R69 VanDerWaalsContact OD2-NE 3.13Å; D65-R69 IonicContact OD2-NH2 2.67Å; D65-R69 PolarHBondContact OD2-NH2 2.93Å
66	M	81.5	Confident	74.9	Confident	121 Å²	121	84.6 Å²	84.6	60%	0.596	42%	0.415	S	S	*	.	H	α-helix	trans	-60.3	-39.7	174.1	-68.3	-176.1	83.1	0	0	112.5	K62 K63 R70	K62-M66 WeakPolarHBondContact O-CG 3.29Å; K62-M66 PolarHBondContact O-N 3.24Å; K62-M66 VanDerWaalsContact O-N 3.07Å; K63-M66 PolarHBondContact O-N 2.68Å; M66-R70 VanDerWaalsContact O-CB 3.31Å; M66-R70 WeakPolarHBondContact O-CB 3.33Å; M66-R70 PolarHBondContact O-N 3.18Å
67	Y	81.9	Confident	72.7	Confident	57 Å²	57	87 Å²	87	22%	0.224	45%	0.445	C	S	.	.	H	α-helix	trans	-68.1	-46.3	176	179.8	-99	0	0	0	112.7	T4 C5 Y6 Y7 V57 L58 K63 R64 D65 R69 R70 G71	T4-Y67 PolarHBondContact O-OH 2.98Å; C5-Y67 VanDerWaalsContact CA-OH 3.27Å; C5-Y67 WeakPolarHBondContact CA-OH 3.49Å; Y6-Y67 HydrophobicContact CD2-CD1 4.28Å; Y6-Y67 AromaticContact CD2-CD2 3.66Å; Y6-Y67 HydrophobicContact CD2-CD2 3.66Å; Y6-Y67 AromaticContact CD2-CE1 3.9Å; Y6-Y67 HydrophobicContact CD2-CE1 3.9Å; Y6-Y67 AromaticContact CD2-CE2 3.22Å; Y6-Y67 HydrophobicContact CD2-CE2 3.22Å; Y6-Y67 HydrophobicContact CD2-CG 4.15Å; Y6-Y67 AromaticContact CD2-CZ 3.34Å; Y6-Y67 AromaticContact CE2-CD2 3.57Å; Y6-Y67 HydrophobicContact CE2-CD2 3.57Å; Y6-Y67 AromaticContact CE2-CE2 3.27Å; Y6-Y67 HydrophobicContact CE2-CE2 3.27Å; Y6-Y67 HydrophobicContact CE2-CG 4.42Å; Y6-Y67 AromaticContact CE2-CZ 3.91Å; Y6-Y67 HydrophobicContact CG-CE2 4.2Å; Y6-Y67 AromaticContact CG-CZ 3.98Å; Y6-Y67 PolarHBondContact N-OH 3.48Å; Y7-Y67 HydrophobicContact CD2-CE1 4.16Å; Y7-Y67 HydrophobicContact CE2-CD1 4.21Å; Y7-Y67 AromaticContact CE2-CE1 3.9Å; Y7-Y67 HydrophobicContact CE2-CE1 3.9Å; V57-Y67 HydrophobicContact CG1-CD2 4.24Å; V57-Y67 HydrophobicContact CG1-CG 4.09Å; L58-Y67 HydrophobicContact CD2-CD1 4.23Å; K63-Y67 WeakPolarHBondContact O-CB 3.26Å; K63-Y67 PolarHBondContact O-N 2.84Å; R64-Y67 PolarHBondContact O-N 3.28Å; D65-Y67 VanDerWaalsContact C-N 3.31Å; D65-Y67 PolarHBondContact O-N 3.35Å; Y67-R69 VanDerWaalsContact C-N 3.31Å; Y67-R69 PolarHBondContact O-N 2.86Å; Y67-R70 PolarHBondContact O-N 3.14Å; Y67-G71 PolarHBondContact O-N 3.07Å
68	D	84.2	Confident	70.6	Confident	44 Å²	44	93.5 Å²	93.5	24%	0.235	48%	0.475	C	S	.	.	H	α-helix	trans	-68.7	-28.8	179.5	-76	-29.5	0	0	0	112.4	Y7 R64 D65 R72	Y7-D68 VanDerWaalsContact CE2-OD1 3.22Å; Y7-D68 WeakPolarHBondContact CE2-OD1 3.34Å; Y7-D68 PolarHBondContact OH-OD1 3.1Å; Y7-D68 PolarHBondContact OH-OD2 3.48Å; R64-D68 IonicContact NE-OD2 3.64Å; R64-D68 WeakPolarHBondContact O-CB 3.47Å; R64-D68 PolarHBondContact O-N 3.41Å; D65-D68 PolarHBondContact O-N 3.39Å; D68-R72 WeakPolarHBondContact O-CG 3.41Å
69	R	79.1	Confident	68.3	Low	157 Å²	157	97.1 Å²	97.1	59%	0.592	51%	0.505	S	S	*	.	H	α-helix	trans	-68.9	-55.4	167.3	-70.4	175.3	-164.5	-144.7	10.8	111	D65 Y67 G71 R72	D65-R69 VanDerWaalsContact CG-NE 3.25Å; D65-R69 WeakPolarHBondContact O-CB 3.37Å; D65-R69 WeakPolarHBondContact O-CG 3.04Å; D65-R69 PolarHBondContact O-N 3.45Å; D65-R69 IonicContact OD1-CZ 2.8Å; D65-R69 IonicContact OD1-NE 3.86Å; D65-R69 PolarHBondContact OD1-NE 3.46Å; D65-R69 IonicContact OD1-NH2 3.43Å; D65-R69 PolarHBondContact OD1-NH2 3.36Å; D65-R69 IonicContact OD2-CZ 3.13Å; D65-R69 VanDerWaalsContact OD2-CZ 3.26Å; D65-R69 IonicContact OD2-NE 3.57Å; D65-R69 PolarHBondContact OD2-NE 2.7Å; D65-R69 VanDerWaalsContact OD2-NE 3.13Å; D65-R69 IonicContact OD2-NH2 2.67Å; D65-R69 PolarHBondContact OD2-NH2 2.93Å; Y67-R69 VanDerWaalsContact C-N 3.31Å; Y67-R69 PolarHBondContact O-N 2.86Å; R69-G71 PolarHBondContact O-N 2.77Å; R69-R72 PolarHBondContact O-N 3.37Å
70	R	68.6	Low	65.9	Low	145 Å²	145	104 Å²	104	55%	0.547	53%	0.531	S	S	.	.	H	α-helix	trans	-62.6	-30.8	-177.2	-170	56	166	177	-3.8	112.6	M66 Y67 R72 I76	M66-R70 VanDerWaalsContact O-CB 3.31Å; M66-R70 WeakPolarHBondContact O-CB 3.33Å; M66-R70 PolarHBondContact O-N 3.18Å; Y67-R70 PolarHBondContact O-N 3.14Å; R70-R72 VanDerWaalsContact C-N 3.32Å; R70-R72 PolarHBondContact O-N 2.98Å; R70-I76 PolarHBondContact NH1-O 3.29Å; R70-I76 VanDerWaalsContact NH1-O 3.16Å
71	G	61.3	Low	63.5	Low	52 Å²	52	106.6 Å²	106.6	54%	0.536	55%	0.549	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.8	3.3	175	0	0	0	0	0	115.6	Y67 R69	Y67-G71 PolarHBondContact O-N 3.07Å; R69-G71 PolarHBondContact O-N 2.77Å
72	R	52.5	Low	61.1	Low	203 Å²	203	109.1 Å²	109.1	77%	0.766	55%	0.55	S	S	*	*	T	Hydrogen-bonded Turn	trans	-106.9	-10.3	171.1	-81.7	-158.5	-68	-179.6	-0.1	114.4	D68 R69 R70	D68-R72 WeakPolarHBondContact O-CG 3.41Å; R69-R72 PolarHBondContact O-N 3.37Å; R70-R72 VanDerWaalsContact C-N 3.32Å; R70-R72 PolarHBondContact O-N 2.98Å
73	D	42.3	Very low	58.6	Low	63 Å²	63	109.7 Å²	109.7	34%	0.337	56%	0.556	S	S	.	*			trans	-129.7	99.2	-169.9	-141	-52.8	0	0	0	114.1	H75 I76	D73-H75 WeakPolarHBondContact OD1-CA 3.47Å; D73-H75 PolarHBondContact OD1-N 3.04Å; D73-I76 HydrophobicContact CB-CB 4.28Å; D73-I76 HydrophobicContact CB-CD1 4.2Å; D73-I76 HydrophobicContact CB-CG1 4.26Å; D73-I76 VanDerWaalsContact CG-CG1 3.48Å; D73-I76 PolarHBondContact OD1-N 3.28Å; D73-I76 VanDerWaalsContact OD2-CD1 3.23Å; D73-I76 WeakPolarHBondContact OD2-CD1 3.42Å; D73-I76 WeakPolarHBondContact OD2-CG1 3.38Å
74	P	50.8	Low	56.2	Low	113 Å²	113	111.8 Å²	111.8	73%	0.734	59%	0.588	S	S	*	*	S	Bend	trans	-79.5	-1.9	168.6	33.9	-34.2	0	0	0	113
75	H	49.3	Very low	54	Low	169 Å²	169	112.3 Å²	112.3	78%	0.782	60%	0.601	S	S	*	*	S	Bend	trans	-120.2	-12.2	-172.4	-73.3	-53.1	0	0	0	115.4	D73 G77	D73-H75 WeakPolarHBondContact OD1-CA 3.47Å; D73-H75 PolarHBondContact OD1-N 3.04Å; H75-G77 PolarHBondContact O-N 2.9Å
76	I	49	Very low	52.2	Low	84 Å²	84	113 Å²	113	43%	0.431	61%	0.605	S	S	.	*			trans	-72.4	80	162.5	-65.2	172.8	0	0	0	109.2	R70 D73 E78	R70-I76 PolarHBondContact NH1-O 3.29Å; R70-I76 VanDerWaalsContact NH1-O 3.16Å; D73-I76 HydrophobicContact CB-CB 4.28Å; D73-I76 HydrophobicContact CB-CD1 4.2Å; D73-I76 HydrophobicContact CB-CG1 4.26Å; D73-I76 VanDerWaalsContact CG-CG1 3.48Å; D73-I76 PolarHBondContact OD1-N 3.28Å; D73-I76 VanDerWaalsContact OD2-CD1 3.23Å; D73-I76 WeakPolarHBondContact OD2-CD1 3.42Å; D73-I76 WeakPolarHBondContact OD2-CG1 3.38Å; I76-E78 HydrophobicContact CG2-CB 3.99Å; I76-E78 HydrophobicContact CG2-CG 3.95Å; I76-E78 PolarHBondContact O-N 3.04Å; I76-E78 VanDerWaalsContact O-N 3.12Å
77	G	41.8	Very low	50.9	Low	73 Å²	73	113.5 Å²	113.5	75%	0.753	62%	0.617	S	S	*	*			trans	-75.7	35.1	168.5	0	0	0	0	0	113.2	H75 A79	H75-G77 PolarHBondContact O-N 2.9Å; G77-A79 VanDerWaalsContact C-N 3.3Å; G77-A79 PolarHBondContact O-N 3.23Å
78	E	44.6	Very low	49.4	Very low	150 Å²	150	117.4 Å²	117.4	70%	0.701	64%	0.635	S	S	*	*			trans	-67	95.4	167.1	-77.8	-168.9	153.1	0	0	108.8	I76 F80	I76-E78 HydrophobicContact CG2-CB 3.99Å; I76-E78 HydrophobicContact CG2-CG 3.95Å; I76-E78 PolarHBondContact O-N 3.04Å; I76-E78 VanDerWaalsContact O-N 3.12Å; E78-F80 PolarHBondContact O-N 2.73Å
79	A	40.2	Very low	47.7	Very low	79 Å²	79	117.2 Å²	117.2	65%	0.653	64%	0.638	S	S	*	*			trans	-71.4	98.2	176.8	0	0	0	0	0	109.2	G77 V81	G77-A79 VanDerWaalsContact C-N 3.3Å; G77-A79 PolarHBondContact O-N 3.23Å; A79-V81 HydrophobicContact CB-CG2 3.73Å; A79-V81 PolarHBondContact O-N 3.46Å
80	F	37.5	Very low	46	Very low	177 Å²	177	116.3 Å²	116.3	78%	0.776	64%	0.642	S	S	*	*			trans	-65.4	76.3	151.9	-95.4	-86	0	0	0	108.4	E78 F82	E78-F80 PolarHBondContact O-N 2.73Å; F80-F82 VanDerWaalsContact C-N 3.34Å; F80-F82 PolarHBondContact O-N 3.15Å
81	V	36.7	Very low	45	Very low	125 Å²	125	111.9 Å²	111.9	76%	0.758	63%	0.627	S	S	*	*			trans	-66.9	97	168.3	-176.4	0	0	0	0	106.5	A79	A79-V81 HydrophobicContact CB-CG2 3.73Å; A79-V81 PolarHBondContact O-N 3.46Å
82	F	36.4	Very low	44.4	Very low	154 Å²	154	113.5 Å²	113.5	68%	0.675	63%	0.626	S	S	*	*			trans	-103.6	122	161	-141	-90.2	0	0	0	108.1	F80	F80-F82 VanDerWaalsContact C-N 3.34Å; F80-F82 PolarHBondContact O-N 3.15Å
83	E	34.1	Very low	44.1	Very low	187 Å²	187	113.1 Å²	113.1	87%	0.874	63%	0.625	S	S	*	*	T	Hydrogen-bonded Turn	trans	-61.9	132.4	-169.9	-160.4	172.1	151.1	0	0	111.2	A85	E83-A85 PolarHBondContact O-N 2.66Å
84	G	36.9	Very low	44.6	Very low	80 Å²	80	113.6 Å²	113.6	83%	0.825	62%	0.624	S	S	*	*	T	Hydrogen-bonded Turn	trans	80.3	2.3	175.8	0	0	0	0	0	117.3	D86	G84-D86 PolarHBondContact O-N 3.12Å
85	A	40.4	Very low	44.8	Very low	54 Å²	54	116.7 Å²	116.7	45%	0.446	63%	0.629	S	S	.	*			trans	-74.9	116.2	-177.7	0	0	0	0	0	113.6	E83	E83-A85 PolarHBondContact O-N 2.66Å
86	D	47.9	Very low	45.3	Very low	86 Å²	86	111 Å²	111	46%	0.46	60%	0.601	S	S	.	*			trans	-61.9	156.4	159.8	60.7	-78.4	0	0	0	111.2	G84 F88 S89	G84-D86 PolarHBondContact O-N 3.12Å; D86-F88 PolarHBondContact O-N 2.88Å; D86-F88 VanDerWaalsContact OD2-CA 3.29Å; D86-F88 WeakPolarHBondContact OD2-CA 3.22Å; D86-F88 WeakPolarHBondContact OD2-CB 3.44Å; D86-F88 PolarHBondContact OD2-N 3.04Å; D86-S89 WeakPolarHBondContact O-CB 3.4Å; D86-S89 PolarHBondContact O-N 3.33Å; D86-S89 VanDerWaalsContact OD1-CB 3.24Å; D86-S89 WeakPolarHBondContact OD1-CB 3.43Å; D86-S89 PolarHBondContact OD2-N 3.11Å
87	P	53.8	Low	46.2	Very low	132 Å²	132	113.4 Å²	113.4	86%	0.857	61%	0.605	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	-15.4	-179.4	-25.6	35.6	0	0	0	115
88	F	49.7	Very low	47.9	Very low	138 Å²	138	114.3 Å²	114.3	61%	0.605	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-29.4	175.9	-130.4	-94.6	0	0	0	111.7	D86 M90 F91 T92	D86-F88 PolarHBondContact O-N 2.88Å; D86-F88 VanDerWaalsContact OD2-CA 3.29Å; D86-F88 WeakPolarHBondContact OD2-CA 3.22Å; D86-F88 WeakPolarHBondContact OD2-CB 3.44Å; D86-F88 PolarHBondContact OD2-N 3.04Å; F88-M90 VanDerWaalsContact C-N 3.28Å; F88-M90 PolarHBondContact O-N 3.48Å; F88-F91 WeakPolarHBondContact O-CA 3.09Å; F88-F91 WeakPolarHBondContact O-CB 3.48Å; F88-F91 PolarHBondContact O-N 3.07Å; F88-T92 PolarHBondContact O-N 3.32Å
89	S	48.3	Very low	49.4	Very low	41 Å²	41	108.3 Å²	108.3	29%	0.287	57%	0.567	S	S	.	*	H	α-helix	trans	-63.8	-26.6	176.6	177.6	0	0	0	0	113.8	D86 F91 T92	D86-S89 WeakPolarHBondContact O-CB 3.4Å; D86-S89 PolarHBondContact O-N 3.33Å; D86-S89 VanDerWaalsContact OD1-CB 3.24Å; D86-S89 WeakPolarHBondContact OD1-CB 3.43Å; D86-S89 PolarHBondContact OD2-N 3.11Å; S89-F91 PolarHBondContact O-N 2.9Å; S89-T92 WeakPolarHBondContact CA-OG1 3.39Å; S89-T92 PolarHBondContact O-N 3.2Å; S89-T92 PolarHBondContact O-OG1 3.03Å
90	M	44.2	Very low	51.2	Low	137 Å²	137	107.2 Å²	107.2	68%	0.675	55%	0.549	S	S	*	.	H	α-helix	trans	-63.7	-27.1	169.7	-165.9	176.2	-173.3	0	0	112.4	F88	F88-M90 VanDerWaalsContact C-N 3.28Å; F88-M90 PolarHBondContact O-N 3.48Å
91	F	47.2	Very low	53.2	Low	52 Å²	52	101.9 Å²	101.9	23%	0.228	53%	0.529	C	S	.	.	H	α-helix	trans	-78.3	-37.5	174.6	-171.9	-94.9	0	0	0	111.9	E53 F88 S89 R93 F94 F96	E53-F91 VanDerWaalsContact CD-CE2 3.45Å; E53-F91 HydrophobicContact CG-CE2 3.72Å; E53-F91 HydrophobicContact CG-CZ 3.72Å; E53-F91 WeakPolarHBondContact OE1-CE2 3.2Å; F88-F91 WeakPolarHBondContact O-CA 3.09Å; F88-F91 WeakPolarHBondContact O-CB 3.48Å; F88-F91 PolarHBondContact O-N 3.07Å; S89-F91 PolarHBondContact O-N 2.9Å; F91-R93 PolarHBondContact O-N 3.33Å; F91-R93 VanDerWaalsContact O-N 3.14Å; F91-F94 PolarHBondContact O-N 3.17Å; F91-F96 HydrophobicContact CE1-CB 3.99Å; F91-F96 HydrophobicContact CE1-CD1 4.49Å; F91-F96 AromaticContact CE1-CD2 3.96Å; F91-F96 HydrophobicContact CE1-CD2 3.96Å; F91-F96 AromaticContact CE1-CG 3.82Å; F91-F96 HydrophobicContact CE1-CG 3.82Å; F91-F96 AromaticContact CZ-CD2 3.75Å; F91-F96 HydrophobicContact CZ-CD2 3.75Å; F91-F96 HydrophobicContact CZ-CE2 4.21Å; F91-F96 HydrophobicContact CZ-CG 4.06Å
92	T	48.7	Very low	55.2	Low	87 Å²	87	96.3 Å²	96.3	53%	0.534	49%	0.494	S	S	.	.	H	α-helix	trans	-68.5	-10.7	-178.8	66.6	0	0	0	0	114.4	F88 S89 F94	F88-T92 PolarHBondContact O-N 3.32Å; S89-T92 WeakPolarHBondContact CA-OG1 3.39Å; S89-T92 PolarHBondContact O-N 3.2Å; S89-T92 PolarHBondContact O-OG1 3.03Å; T92-F94 CarbonylContact C-O 3.55Å; T92-F94 CarbonylContact O-C 3.38Å; T92-F94 PolarHBondContact O-N 3.33Å
93	R	46.9	Very low	57.3	Low	194 Å²	194	90.6 Å²	90.6	73%	0.732	47%	0.469	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.9	-21.9	168.7	-160.6	173.9	-163.5	132.8	7.2	112.7	F91	F91-R93 PolarHBondContact O-N 3.33Å; F91-R93 VanDerWaalsContact O-N 3.14Å
94	F	52.5	Low	59.6	Low	74 Å²	74	86.9 Å²	86.9	33%	0.325	45%	0.447	S	S	.	.	S	Bend	trans	-89.3	125.8	157.3	-62.6	-65.2	0	0	0	108	K63 F91 T92 F96	K63-F94 HydrophobicContact CD-CD1 3.99Å; K63-F94 HydrophobicContact CD-CE1 4.02Å; K63-F94 HydrophobicContact CG-CD1 4.24Å; K63-F94 HydrophobicContact CG-CE1 3.75Å; K63-F94 HydrophobicContact CG-CZ 4.35Å; F91-F94 PolarHBondContact O-N 3.17Å; T92-F94 CarbonylContact C-O 3.55Å; T92-F94 CarbonylContact O-C 3.38Å; T92-F94 PolarHBondContact O-N 3.33Å; F94-F96 PolarHBondContact O-N 3.31Å
95	H	55.5	Low	61.6	Low	178 Å²	178	88.2 Å²	88.2	82%	0.824	43%	0.432	S	S	*	.			trans	-78.9	66.1	-174.2	-153.4	-65	0	0	0	110.1	R97	H95-R97 PolarHBondContact O-N 2.88Å
96	F	59.1	Low	63.2	Low	48 Å²	48	86.2 Å²	86.2	21%	0.211	41%	0.414	C	S	.	.	P	Polyproline II helix	trans	-56.7	117.6	-160.2	-163.1	-91.8	0	0	0	111.4	E53 E56 F91 F94 P99 I102	E53-F96 VanDerWaalsContact CA-CZ 3.45Å; E53-F96 HydrophobicContact CB-CE2 4.02Å; E53-F96 HydrophobicContact CB-CZ 3.88Å; E53-F96 HydrophobicContact CG-CE2 4.21Å; E56-F96 HydrophobicContact CB-CE2 3.87Å; E56-F96 HydrophobicContact CG-CE2 4.47Å; E56-F96 WeakPolarHBondContact OE2-CA 3.39Å; E56-F96 WeakPolarHBondContact OE2-CD2 3.42Å; F91-F96 HydrophobicContact CE1-CB 3.99Å; F91-F96 HydrophobicContact CE1-CD1 4.49Å; F91-F96 AromaticContact CE1-CD2 3.96Å; F91-F96 HydrophobicContact CE1-CD2 3.96Å; F91-F96 AromaticContact CE1-CG 3.82Å; F91-F96 HydrophobicContact CE1-CG 3.82Å; F91-F96 AromaticContact CZ-CD2 3.75Å; F91-F96 HydrophobicContact CZ-CD2 3.75Å; F91-F96 HydrophobicContact CZ-CE2 4.21Å; F91-F96 HydrophobicContact CZ-CG 4.06Å; F94-F96 PolarHBondContact O-N 3.31Å; F96-P99 HydrophobicContact CE1-CG 4.45Å; F96-I102 HydrophobicContact CE1-CD1 4.22Å; F96-I102 HydrophobicContact CZ-CD1 3.93Å
97	R	68	Low	64.6	Low	135 Å²	135	84.2 Å²	84.2	51%	0.509	40%	0.402	S	S	.	.	P	Polyproline II helix	trans	-72.5	151.7	-176.1	-78.5	-171.6	168	-176.9	-3.8	111	E56 H95 I102 E105	E56-R97 PolarHBondContact OE2-N 3.28Å; E56-R97 VanDerWaalsContact OE2-N 3.16Å; H95-R97 PolarHBondContact O-N 2.88Å; R97-I102 HydrophobicContact CB-CD1 3.97Å; R97-I102 HydrophobicContact CB-CG1 3.59Å; R97-E105 IonicContact CZ-OE2 3.27Å; R97-E105 IonicContact NH1-OE1 3.7Å; R97-E105 PolarHBondContact NH1-OE1 3.07Å; R97-E105 IonicContact NH1-OE2 3.83Å; R97-E105 PolarHBondContact NH1-OE2 3.48Å
98	D	76.9	Confident	65.5	Low	93 Å²	93	82.2 Å²	82.2	50%	0.497	40%	0.396	S	S	.	.	P	Polyproline II helix	trans	-53.8	129.9	172.3	-102.8	-46	0	0	0	109.1	M100 D101 I102	D98-M100 PolarHBondContact O-N 2.87Å; D98-D101 HydrophobicContact CB-CB 4.21Å; D98-D101 WeakPolarHBondContact O-CA 3.39Å; D98-D101 PolarHBondContact O-N 2.92Å; D98-I102 PolarHBondContact O-N 3.18Å
99	P	77.3	Confident	66.1	Low	23 Å²	23	78.9 Å²	78.9	15%	0.149	40%	0.401	C	S	.	.	H	α-helix	trans	-54.2	-31.7	-178.6	-31.6	37.7	0	0	0	113.5	F48 K49 F96 F103	F48-P99 HydrophobicContact CD1-CB 3.58Å; F48-P99 HydrophobicContact CE1-CB 3.49Å; F48-P99 VanDerWaalsContact CE1-CB 3.49Å; F48-P99 WeakPolarHBondContact CE1-O 3.44Å; K49-P99 HydrophobicContact CB-CG 4.41Å; K49-P99 HydrophobicContact CG-CG 4.35Å; F96-P99 HydrophobicContact CE1-CG 4.45Å; P99-F103 WeakPolarHBondContact O-CB 3.15Å; P99-F103 PolarHBondContact O-N 2.88Å
100	M	77.6	Confident	66.5	Low	56 Å²	56	79 Å²	79	28%	0.276	40%	0.402	S	S	.	.	H	α-helix	trans	-67.5	-32.7	173.5	-68.1	-78.9	95.9	0	0	113	F48 D98 R104	F48-M100 HydrophobicContact CD1-CE 4.14Å; F48-M100 HydrophobicContact CE1-CE 3.31Å; F48-M100 HydrophobicContact CE2-CE 4.27Å; F48-M100 HydrophobicContact CZ-CE 3.4Å; D98-M100 PolarHBondContact O-N 2.87Å; M100-R104 WeakPolarHBondContact O-CB 3.43Å; M100-R104 VanDerWaalsContact O-CD 3.3Å; M100-R104 WeakPolarHBondContact O-CD 3.37Å; M100-R104 WeakPolarHBondContact O-CG 3.38Å; M100-R104 PolarHBondContact O-N 2.69Å
101	D	79.7	Confident	66.8	Low	66 Å²	66	74.1 Å²	74.1	35%	0.353	39%	0.386	S	S	.	.	H	α-helix	trans	-80.8	-36.2	178	-74.5	-12.1	0	0	0	112	D98 F103 R104 E105	D98-D101 HydrophobicContact CB-CB 4.21Å; D98-D101 WeakPolarHBondContact O-CA 3.39Å; D98-D101 PolarHBondContact O-N 2.92Å; D101-F103 PolarHBondContact O-N 2.85Å; D101-R104 PolarHBondContact O-N 2.97Å; D101-R104 VanDerWaalsContact OD1-CD 3.26Å; D101-R104 WeakPolarHBondContact OD1-CD 3.21Å; D101-R104 IonicContact OD1-CZ 2.68Å; D101-R104 IonicContact OD1-NE 2.66Å; D101-R104 IonicContact OD1-NH1 2.69Å; D101-R104 PolarHBondContact OD1-NH1 2.93Å; D101-E105 VanDerWaalsContact O-CB 3.25Å; D101-E105 WeakPolarHBondContact O-CB 3.27Å; D101-E105 PolarHBondContact O-N 3.12Å
102	I	78.1	Confident	67.2	Low	7 Å²	7	77.5 Å²	77.5	4%	0.036	41%	0.406	C	S	.	.	H	α-helix	trans	-58.6	-42.2	167.3	-60.6	173.3	0	0	0	109.8	Y25 Y55 E56 F96 R97 D98 E105 V106	Y25-I102 HydrophobicContact CE1-CG2 4.43Å; Y55-I102 HydrophobicContact CD1-CG2 3.7Å; Y55-I102 HydrophobicContact CE1-CG2 4.09Å; E56-I102 HydrophobicContact CB-CD1 4.4Å; E56-I102 HydrophobicContact CG-CD1 4.4Å; F96-I102 HydrophobicContact CE1-CD1 4.22Å; F96-I102 HydrophobicContact CZ-CD1 3.93Å; R97-I102 HydrophobicContact CB-CD1 3.97Å; R97-I102 HydrophobicContact CB-CG1 3.59Å; D98-I102 PolarHBondContact O-N 3.18Å; I102-E105 PolarHBondContact O-N 3.16Å; I102-V106 WeakPolarHBondContact O-CB 3.07Å; I102-V106 WeakPolarHBondContact O-CG2 3.2Å; I102-V106 PolarHBondContact O-N 3.09Å
103	F	80.4	Confident	67.5	Low	35 Å²	35	78.4 Å²	78.4	15%	0.154	41%	0.408	C	S	.	.	H	α-helix	trans	-63.8	-48.9	175	-175.7	-91.7	0	0	0	112	Y25 A29 L30 F48 P99 D101 E105 V106 F107	Y25-F103 WeakPolarHBondContact OH-CA 3.2Å; Y25-F103 PolarHBondContact OH-N 2.86Å; A29-F103 HydrophobicContact CB-CD2 3.87Å; A29-F103 HydrophobicContact CB-CE2 4.04Å; L30-F103 HydrophobicContact CD2-CE2 4.44Å; L30-F103 HydrophobicContact CD2-CZ 4.24Å; F48-F103 HydrophobicContact CE2-CD2 4.14Å; F48-F103 HydrophobicContact CZ-CB 3.97Å; F48-F103 AromaticContact CZ-CD2 3.94Å; F48-F103 HydrophobicContact CZ-CD2 3.94Å; F48-F103 HydrophobicContact CZ-CG 4.15Å; P99-F103 WeakPolarHBondContact O-CB 3.15Å; P99-F103 PolarHBondContact O-N 2.88Å; D101-F103 PolarHBondContact O-N 2.85Å; F103-E105 VanDerWaalsContact C-N 3.35Å; F103-E105 PolarHBondContact O-N 2.82Å; F103-V106 PolarHBondContact O-N 3.34Å; F103-F107 HydrophobicContact CD1-CD2 4.25Å; F103-F107 AromaticContact CD2-CD2 3.63Å; F103-F107 HydrophobicContact CD2-CD2 3.63Å; F103-F107 AromaticContact CD2-CE2 3.5Å; F103-F107 HydrophobicContact CD2-CE2 3.5Å; F103-F107 VanDerWaalsContact CD2-CE2 3.5Å; F103-F107 HydrophobicContact CD2-CZ 4.35Å; F103-F107 HydrophobicContact CE1-CB 4.5Å; F103-F107 HydrophobicContact CE1-CD2 4.18Å; F103-F107 HydrophobicContact CE1-CG 4.25Å; F103-F107 AromaticContact CE2-CD2 3.57Å; F103-F107 HydrophobicContact CE2-CD2 3.57Å; F103-F107 HydrophobicContact CE2-CE1 4.31Å; F103-F107 AromaticContact CE2-CE2 3.23Å; F103-F107 HydrophobicContact CE2-CE2 3.23Å; F103-F107 HydrophobicContact CE2-CG 4.24Å; F103-F107 AromaticContact CE2-CZ 3.65Å; F103-F107 HydrophobicContact CE2-CZ 3.65Å; F103-F107 AromaticContact CG-CD2 3.99Å; F103-F107 HydrophobicContact CG-CD2 3.99Å; F103-F107 HydrophobicContact CG-CE2 4.32Å; F103-F107 HydrophobicContact CZ-CD1 4.27Å; F103-F107 AromaticContact CZ-CD2 3.85Å; F103-F107 HydrophobicContact CZ-CD2 3.85Å; F103-F107 HydrophobicContact CZ-CE1 4.28Å; F103-F107 AromaticContact CZ-CE2 3.86Å; F103-F107 HydrophobicContact CZ-CE2 3.86Å; F103-F107 HydrophobicContact CZ-CG 4.05Å; F103-F107 HydrophobicContact CZ-CZ 4.08Å; F103-F107 WeakPolarHBondContact O-CB 3.43Å; F103-F107 WeakPolarHBondContact O-CD2 3.31Å; F103-F107 PolarHBondContact O-N 3.42Å
104	R	81.8	Confident	67.9	Low	109 Å²	109	73.5 Å²	73.5	41%	0.411	40%	0.403	S	S	.	.	H	α-helix	trans	-57.5	-45.4	175.5	-73.8	156.4	176.4	166	-3.7	111.7	M100 D101 V106 F107 A108	M100-R104 WeakPolarHBondContact O-CB 3.43Å; M100-R104 VanDerWaalsContact O-CD 3.3Å; M100-R104 WeakPolarHBondContact O-CD 3.37Å; M100-R104 WeakPolarHBondContact O-CG 3.38Å; M100-R104 PolarHBondContact O-N 2.69Å; D101-R104 PolarHBondContact O-N 2.97Å; D101-R104 VanDerWaalsContact OD1-CD 3.26Å; D101-R104 WeakPolarHBondContact OD1-CD 3.21Å; D101-R104 IonicContact OD1-CZ 2.68Å; D101-R104 IonicContact OD1-NE 2.66Å; D101-R104 IonicContact OD1-NH1 2.69Å; D101-R104 PolarHBondContact OD1-NH1 2.93Å; R104-V106 PolarHBondContact O-N 3.23Å; R104-F107 PolarHBondContact O-N 2.66Å; R104-A108 WeakPolarHBondContact O-CA 3.37Å; R104-A108 WeakPolarHBondContact O-CB 3.42Å; R104-A108 PolarHBondContact O-N 3.49Å
105	E	80.2	Confident	67.9	Low	107 Å²	107	74.4 Å²	74.4	50%	0.5	41%	0.411	S	S	.	.	H	α-helix	trans	-61.7	-44.7	179.2	-173.8	171.6	179.8	0	0	111.6	R97 D101 I102 F103 G109	R97-E105 IonicContact CZ-OE2 3.27Å; R97-E105 IonicContact NH1-OE1 3.7Å; R97-E105 PolarHBondContact NH1-OE1 3.07Å; R97-E105 IonicContact NH1-OE2 3.83Å; R97-E105 PolarHBondContact NH1-OE2 3.48Å; D101-E105 VanDerWaalsContact O-CB 3.25Å; D101-E105 WeakPolarHBondContact O-CB 3.27Å; D101-E105 PolarHBondContact O-N 3.12Å; I102-E105 PolarHBondContact O-N 3.16Å; F103-E105 VanDerWaalsContact C-N 3.35Å; F103-E105 PolarHBondContact O-N 2.82Å; E105-G109 VanDerWaalsContact O-CA 3.26Å; E105-G109 WeakPolarHBondContact O-CA 3.49Å; E105-G109 PolarHBondContact O-N 3.4Å
106	V	74.5	Confident	67.7	Low	13 Å²	13	72.1 Å²	72.1	8%	0.079	40%	0.399	C	S	.	.	H	α-helix	trans	-70.5	-39.3	178.1	172.4	0	0	0	0	112.9	Y25 R26 Y55 I102 F103 R104 S110	Y25-V106 HydrophobicContact CD1-CB 4.46Å; Y25-V106 HydrophobicContact CD1-CG1 4.1Å; Y25-V106 HydrophobicContact CD1-CG2 4.25Å; Y25-V106 HydrophobicContact CE1-CB 4.05Å; Y25-V106 HydrophobicContact CE1-CG1 4.12Å; Y25-V106 HydrophobicContact CE1-CG2 3.94Å; R26-V106 HydrophobicContact CG-CG1 3.81Å; Y55-V106 HydrophobicContact CE1-CG2 3.61Å; I102-V106 WeakPolarHBondContact O-CB 3.07Å; I102-V106 WeakPolarHBondContact O-CG2 3.2Å; I102-V106 PolarHBondContact O-N 3.09Å; F103-V106 PolarHBondContact O-N 3.34Å; R104-V106 PolarHBondContact O-N 3.23Å; V106-S110 PolarHBondContact O-N 3.4Å; V106-S110 PolarHBondContact O-OG 3.13Å
107	F	76.9	Confident	67.2	Low	44 Å²	44	72.9 Å²	72.9	19%	0.193	42%	0.42	C	S	.	.	H	α-helix	trans	-92.9	-19.6	-173.7	-78.9	-100	0	0	0	114.9	R26 L30 F103 R104	R26-F107 HydrophobicContact CB-CE2 4.22Å; R26-F107 HydrophobicContact CB-CZ 3.77Å; R26-F107 HydrophobicContact CG-CE1 4.4Å; R26-F107 HydrophobicContact CG-CE2 3.77Å; R26-F107 HydrophobicContact CG-CZ 3.69Å; L30-F107 HydrophobicContact CD1-CE1 4.11Å; L30-F107 HydrophobicContact CD1-CZ 4.16Å; L30-F107 HydrophobicContact CD2-CE1 4.16Å; L30-F107 HydrophobicContact CD2-CZ 4.26Å; L30-F107 HydrophobicContact CG-CE1 4.13Å; L30-F107 HydrophobicContact CG-CZ 3.89Å; F103-F107 HydrophobicContact CD1-CD2 4.25Å; F103-F107 AromaticContact CD2-CD2 3.63Å; F103-F107 HydrophobicContact CD2-CD2 3.63Å; F103-F107 AromaticContact CD2-CE2 3.5Å; F103-F107 HydrophobicContact CD2-CE2 3.5Å; F103-F107 VanDerWaalsContact CD2-CE2 3.5Å; F103-F107 HydrophobicContact CD2-CZ 4.35Å; F103-F107 HydrophobicContact CE1-CB 4.5Å; F103-F107 HydrophobicContact CE1-CD2 4.18Å; F103-F107 HydrophobicContact CE1-CG 4.25Å; F103-F107 AromaticContact CE2-CD2 3.57Å; F103-F107 HydrophobicContact CE2-CD2 3.57Å; F103-F107 HydrophobicContact CE2-CE1 4.31Å; F103-F107 AromaticContact CE2-CE2 3.23Å; F103-F107 HydrophobicContact CE2-CE2 3.23Å; F103-F107 HydrophobicContact CE2-CG 4.24Å; F103-F107 AromaticContact CE2-CZ 3.65Å; F103-F107 HydrophobicContact CE2-CZ 3.65Å; F103-F107 AromaticContact CG-CD2 3.99Å; F103-F107 HydrophobicContact CG-CD2 3.99Å; F103-F107 HydrophobicContact CG-CE2 4.32Å; F103-F107 HydrophobicContact CZ-CD1 4.27Å; F103-F107 AromaticContact CZ-CD2 3.85Å; F103-F107 HydrophobicContact CZ-CD2 3.85Å; F103-F107 HydrophobicContact CZ-CE1 4.28Å; F103-F107 AromaticContact CZ-CE2 3.86Å; F103-F107 HydrophobicContact CZ-CE2 3.86Å; F103-F107 HydrophobicContact CZ-CG 4.05Å; F103-F107 HydrophobicContact CZ-CZ 4.08Å; F103-F107 WeakPolarHBondContact O-CB 3.43Å; F103-F107 WeakPolarHBondContact O-CD2 3.31Å; F103-F107 PolarHBondContact O-N 3.42Å; R104-F107 PolarHBondContact O-N 2.66Å
108	A	72.6	Confident	66.3	Low	89 Å²	89	71.4 Å²	71.4	74%	0.736	43%	0.43	S	S	*	.	H	α-helix	trans	-100	-27.6	171.3	0	0	0	0	0	112.4	R104	R104-A108 WeakPolarHBondContact O-CA 3.37Å; R104-A108 WeakPolarHBondContact O-CB 3.42Å; R104-A108 PolarHBondContact O-N 3.49Å
109	G	61.3	Low	64.9	Low	69 Å²	69	71.4 Å²	71.4	71%	0.711	44%	0.437	S	S	*	.	S	Bend	trans	-82.5	-7.5	174.6	0	0	0	0	0	114.7	E105	E105-G109 VanDerWaalsContact O-CA 3.26Å; E105-G109 WeakPolarHBondContact O-CA 3.49Å; E105-G109 PolarHBondContact O-N 3.4Å
110	S	57.5	Low	63.6	Low	44 Å²	44	75.5 Å²	75.5	31%	0.308	46%	0.457	S	S	.	.	S	Bend	trans	-132.2	124.7	168.1	68.9	0	0	0	0	110.8	V106 L112	V106-S110 PolarHBondContact O-N 3.4Å; V106-S110 PolarHBondContact O-OG 3.13Å; S110-L112 PolarHBondContact O-N 3.02Å
111	G	51	Low	62.2	Low	34 Å²	34	82 Å²	82	35%	0.351	49%	0.487	S	S	.	.			trans	-54.7	118.7	-172.6	0	0	0	0	0	113.1	D113 S114	G111-D113 WeakPolarHBondContact CA-OD1 3.24Å; G111-D113 PolarHBondContact O-N 2.99Å; G111-S114 PolarHBondContact O-N 3.4Å; G111-S114 VanDerWaalsContact O-N 3.09Å
112	L	55.4	Low	60.4	Low	122 Å²	122	85.2 Å²	85.2	64%	0.639	50%	0.503	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-32.4	177.3	46.4	146.3	0	0	0	111.9	S110 S114 L115 F116	S110-L112 PolarHBondContact O-N 3.02Å; L112-S114 VanDerWaalsContact C-N 3.28Å; L112-S114 PolarHBondContact O-N 3.11Å; L112-L115 PolarHBondContact O-N 3.04Å; L112-F116 PolarHBondContact O-N 2.89Å; L112-F116 VanDerWaalsContact O-N 3.13Å
113	D	54.2	Low	58.7	Low	106 Å²	106	92.7 Å²	92.7	57%	0.567	54%	0.536	S	S	*	.	H	α-helix	trans	-41.6	-49.2	164	44	-84.6	0	0	0	113.5	G111 L115 G117	G111-D113 WeakPolarHBondContact CA-OD1 3.24Å; G111-D113 PolarHBondContact O-N 2.99Å; D113-L115 VanDerWaalsContact C-N 3.27Å; D113-L115 PolarHBondContact O-N 2.91Å; D113-G117 PolarHBondContact O-N 2.98Å
114	S	54.9	Low	56.6	Low	91 Å²	91	99.2 Å²	99.2	64%	0.636	57%	0.567	S	S	*	*	H	α-helix	trans	-79.6	-1.4	-168.1	-64.9	0	0	0	0	114.6	G111 L112	G111-S114 PolarHBondContact O-N 3.4Å; G111-S114 VanDerWaalsContact O-N 3.09Å; L112-S114 VanDerWaalsContact C-N 3.28Å; L112-S114 PolarHBondContact O-N 3.11Å
115	L	52.5	Low	54.7	Low	93 Å²	93	102 Å²	102	49%	0.487	58%	0.579	S	S	.	*	H	α-helix	trans	-130.7	-29.1	177.7	-76.8	172.9	0	0	0	114.6	R26 L112 D113 G117	R26-L115 VanDerWaalsContact CZ-CD1 3.44Å; L112-L115 PolarHBondContact O-N 3.04Å; D113-L115 VanDerWaalsContact C-N 3.27Å; D113-L115 PolarHBondContact O-N 2.91Å; L115-G117 VanDerWaalsContact C-N 3.33Å
116	F	51.2	Low	52.4	Low	131 Å²	131	104.2 Å²	104.2	58%	0.575	59%	0.594	S	S	*	*	H	α-helix	trans	-73	-27	172.7	-96.5	-107.9	0	0	0	112.5	L112 S118 I120	L112-F116 PolarHBondContact O-N 2.89Å; L112-F116 VanDerWaalsContact O-N 3.13Å; F116-S118 VanDerWaalsContact C-N 3.27Å; F116-S118 PolarHBondContact O-N 3.24Å; F116-S118 VanDerWaalsContact O-N 3.16Å; F116-I120 HydrophobicContact CD1-CD1 3.82Å; F116-I120 HydrophobicContact CD1-CG1 4.4Å; F116-I120 HydrophobicContact CE1-CD1 4.46Å; F116-I120 WeakPolarHBondContact O-CD1 3.23Å
117	G	50	Low	50.8	Low	63 Å²	63	109.8 Å²	109.8	65%	0.649	63%	0.628	S	S	*	*	T	Hydrogen-bonded Turn	trans	-72.8	3.2	-177.3	0	0	0	0	0	117.3	D113 L115	D113-G117 PolarHBondContact O-N 2.98Å; L115-G117 VanDerWaalsContact C-N 3.33Å
118	S	48.6	Very low	48.7	Very low	105 Å²	105	116.2 Å²	116.2	73%	0.734	66%	0.659	S	S	*	*	T	Hydrogen-bonded Turn	trans	-149.1	4.8	-171.8	-55	0	0	0	0	117.9	F116	F116-S118 VanDerWaalsContact C-N 3.27Å; F116-S118 PolarHBondContact O-N 3.24Å; F116-S118 VanDerWaalsContact O-N 3.16Å
119	S	47.1	Very low	47.4	Very low	92 Å²	92	119.9 Å²	119.9	64%	0.643	67%	0.665	S	S	*	*			trans	-152.4	25.6	-175.2	-66.4	0	0	0	0	116.8	H121	S119-H121 PolarHBondContact O-N 3.41Å
120	I	51.1	Low	46	Very low	110 Å²	110	123.8 Å²	123.8	56%	0.564	67%	0.67	S	S	*	*	T	Hydrogen-bonded Turn	trans	-71	-12	176.6	-60.2	178.4	0	0	0	112.4	F116 D122	F116-I120 HydrophobicContact CD1-CD1 3.82Å; F116-I120 HydrophobicContact CD1-CG1 4.4Å; F116-I120 HydrophobicContact CE1-CD1 4.46Å; F116-I120 WeakPolarHBondContact O-CD1 3.23Å; I120-D122 PolarHBondContact O-N 3.19Å
121	H	46.4	Very low	45.3	Very low	193 Å²	193	132.9 Å²	132.9	89%	0.894	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-85.8	5.6	-171.7	-140.6	-60.2	0	0	0	116.1	S119	S119-H121 PolarHBondContact O-N 3.41Å
122	D	42.2	Very low	44.9	Very low	132 Å²	132	136.7 Å²	136.7	71%	0.706	71%	0.714	S	S	*	*			trans	-106.2	47.3	174.9	-163.8	26.1	0	0	0	111.5	I120 Q124	I120-D122 PolarHBondContact O-N 3.19Å; D122-Q124 PolarHBondContact O-N 2.78Å
123	F	43.9	Very low	44.2	Very low	165 Å²	165	137.7 Å²	137.7	72%	0.724	72%	0.719	S	S	*	*			trans	-80.1	64	177.8	-133.3	-83.2	0	0	0	109.9	Y125	F123-Y125 HydrophobicContact CD1-CD2 4.03Å; F123-Y125 HydrophobicContact CE1-CD2 4.05Å; F123-Y125 HydrophobicContact CE1-CE2 4.47Å; F123-Y125 PolarHBondContact O-N 3.15Å
124	Q	35.5	Very low	43.3	Very low	172 Å²	172	142.9 Å²	142.9	80%	0.804	73%	0.731	S	S	*	*			trans	-73.7	70.1	-176.5	-161.4	178.9	24.7	0	0	112.2	D122	D122-Q124 PolarHBondContact O-N 2.78Å
125	Y	41.6	Very low	42.7	Very low	167 Å²	167	148.8 Å²	148.8	66%	0.655	75%	0.745	S	S	*	*			trans	-103.4	129	161	-90.4	-85.9	0	0	0	109.2	F123 T127	F123-Y125 HydrophobicContact CD1-CD2 4.03Å; F123-Y125 HydrophobicContact CE1-CD2 4.05Å; F123-Y125 HydrophobicContact CE1-CE2 4.47Å; F123-Y125 PolarHBondContact O-N 3.15Å; Y125-T127 PolarHBondContact O-N 3.21Å
126	D	32.1	Very low	42.2	Very low	154 Å²	154	151.6 Å²	151.6	82%	0.824	76%	0.761	S	S	*	*			trans	-74.6	94.2	-172.7	-131	-58.8	0	0	0	111.1
127	T	42.1	Very low	41.9	Very low	130 Å²	130	149.2 Å²	149.2	80%	0.798	76%	0.76	S	S	*	*			trans	-134.1	115.2	167.2	24.5	0	0	0	0	109.7	Y125	Y125-T127 PolarHBondContact O-N 3.21Å
128	Q	32.5	Very low	41.8	Very low	178 Å²	178	153.1 Å²	153.1	83%	0.832	76%	0.762	S	S	*	*			trans	-66.6	133.7	-176.4	-53.3	174.7	15.6	0	0	111.2
129	L	44.1	Very low	41.7	Very low	167 Å²	167	159 Å²	159	87%	0.874	77%	0.768	S	S	*	*			trans	176.7	155.1	131.6	-96.6	166.6	0	0	0	112.5
130	N	32.3	Very low	41.9	Very low	150 Å²	150	162 Å²	162	80%	0.802	78%	0.777	S	S	*	*			trans	-63.1	132.4	-176.8	-66.4	-73.3	0	0	0	114.2
131	R	42.1	Very low	41.7	Very low	235 Å²	235	160.8 Å²	160.8	89%	0.887	78%	0.783	S	S	*	*			trans	-153.4	77.6	152	-154.4	165.2	-65	-149.2	3.3	115.8
132	T	42.5	Very low	41.6	Very low	114 Å²	114	155.4 Å²	155.4	70%	0.699	78%	0.779	S	S	*	*				39.8	97.8	127.5	-42.3	0	0	0	0	120.2
133	L	40.5	Very low	42	Very low	144 Å²	144	159.9 Å²	159.9	75%	0.754	79%	0.786	S	S	*	*			trans	60.1	131.7	133.9	-66.8	175.3	0	0	0	123
134	R	36.2	Very low	42.5	Very low	215 Å²	215	160.4 Å²	160.4	81%	0.811	79%	0.791	S	S	*	*			trans	72.1	132	153.8	-62.5	168	-173.7	-167.1	2.6	118.3
135	F	42.5	Very low	43.3	Very low	214 Å²	214	158 Å²	158	94%	0.939	79%	0.793	S	S	*	*				-153.6	159.1	111.2	-91	-63.4	0	0	0	111.6
136	N	42.4	Very low	43.5	Very low	153 Å²	153	154 Å²	154	82%	0.818	80%	0.803	S	S	*	*			trans	-97.9	172.5	179.9	-97.2	-17	0	0	0	109.8
137	S	44.2	Very low	44.2	Very low	80 Å²	80	152.2 Å²	152.2	56%	0.559	80%	0.803	S	S	*	*			cis	-178.8	-164	-16	179.7	0	0	0	0	107.1
138	H	47.1	Very low	44.7	Very low	145 Å²	145	150 Å²	150	67%	0.671	79%	0.79	S	S	*	*			trans	76.9	142.6	165.7	-39	-49.8	0	0	0	115
139	R	47.8	Very low	45.6	Very low	228 Å²	228	150.4 Å²	150.4	86%	0.86	79%	0.786	S	S	*	*			cis	-167.7	166.2	1.7	-102.2	159.9	-167.9	172.8	2.6	106
140	N	50.6	Low	45.6	Very low	157 Å²	157	150.6 Å²	150.6	84%	0.84	78%	0.781	S	S	*	*			cis	-171.7	-174.3	-11.2	-174.5	19.9	0	0	0	108.8
141	A	48	Very low	46.2	Very low	83 Å²	83	151.6 Å²	151.6	69%	0.686	78%	0.781	S	S	*	*			trans	90.2	77.5	146.5	0	0	0	0	0	123.6
142	G	43.9	Very low	46.3	Very low	80 Å²	80	144.9 Å²	144.9	83%	0.825	78%	0.776	S	S	*	*			trans	72.8	173	131.5	0	0	0	0	0	121.2
143	R	50.2	Low	46.3	Very low	226 Å²	226	143.1 Å²	143.1	85%	0.853	78%	0.78	S	S	*	*			cis	-168.4	153.1	-20.9	-141.3	-175.6	-164.7	-139.8	5.4	110.3
144	Q	54.9	Low	46.5	Very low	177 Å²	177	144.7 Å²	144.7	83%	0.827	79%	0.789	S	S	*	*			trans	79.7	151.4	172.8	-50.6	149.4	122.1	0	0	115.2
145	S	50.9	Low	46.9	Very low	120 Å²	120	138.8 Å²	138.8	84%	0.839	78%	0.78	S	S	*	*			cis	-170.1	142.2	-18.8	48.3	0	0	0	0	110.8
146	G	46.5	Very low	47.2	Very low	83 Å²	83	133.4 Å²	133.4	86%	0.856	77%	0.769	S	S	*	*			trans	164.7	135.8	169.8	0	0	0	0	0	114.6
147	S	46.3	Very low	47.3	Very low	118 Å²	118	134.7 Å²	134.7	83%	0.825	77%	0.77	S	S	*	*			trans	-133.6	179.3	177.4	-134.9	0	0	0	0	107.9
148	P	53.9	Low	47.2	Very low	83 Å²	83	136 Å²	136	54%	0.539	77%	0.774	S	S	.	*			cis	-140.3	-170	7.5	21.8	6.9	0	0	0	116.5
149	Y	51.5	Low	46.8	Very low	187 Å²	187	136.4 Å²	136.4	73%	0.733	78%	0.777	S	S	*	*			trans	108.4	101.4	152.1	-57.5	-56.7	0	0	0	120.3
150	H	44	Very low	46.3	Very low	170 Å²	170	129.4 Å²	129.4	79%	0.787	76%	0.762	S	S	*	*			trans	53.7	146.2	149.1	-50.2	-71.6	0	0	0	119.7
151	H	43.8	Very low	45.9	Very low	172 Å²	172	131.2 Å²	131.2	80%	0.796	76%	0.759	S	S	*	*			cis	-156.4	136.2	28.6	-170.3	-91.9	0	0	0	113.4
152	A	44.7	Very low	45.5	Very low	94 Å²	94	134.4 Å²	134.4	78%	0.777	77%	0.765	S	S	*	*			trans	28.5	131.2	162.5	0	0	0	0	0	124.1
153	G	41.8	Very low	46	Very low	77 Å²	77	136 Å²	136	79%	0.794	76%	0.761	S	S	*	*			trans	169.2	119.1	159.3	0	0	0	0	0	116
154	L	45.9	Very low	45.5	Very low	177 Å²	177	132.5 Å²	132.5	93%	0.927	76%	0.757	S	S	*	*			trans	-74.7	164.3	179.9	-87.9	72.7	0	0	0	113.6
155	S	44.9	Very low	44.8	Very low	90 Å²	90	131.6 Å²	131.6	63%	0.629	76%	0.756	S	S	*	*			cis	-174.3	154.5	-11.2	171.7	0	0	0	0	111.5
156	S	47.4	Very low	44.2	Very low	101 Å²	101	130.3 Å²	130.3	71%	0.706	75%	0.747	S	S	*	*			trans	59.6	155.1	151	46	0	0	0	0	121.4
157	Q	45	Very low	44.1	Very low	180 Å²	180	133.1 Å²	133.1	84%	0.841	74%	0.743	S	S	*	*			cis	179.8	166	-16.5	174.1	175.5	-32.5	0	0	109.5
158	V	43.1	Very low	44.3	Very low	107 Å²	107	132.8 Å²	132.8	65%	0.648	74%	0.738	S	S	*	*				-163.3	156	-65.3	84.8	0	0	0	0	111.7
159	Q	37.8	Very low	43.6	Very low	155 Å²	155	136 Å²	136	72%	0.724	75%	0.75	S	S	*	*			trans	69.2	160.3	160.6	-70	174.4	-6.2	0	0	119.9
160	S	37.4	Very low	43.2	Very low	80 Å²	80	135 Å²	135	56%	0.559	75%	0.754	S	S	*	*			cis	-174	180	-18	-93.8	0	0	0	0	113.1
161	Y	41.6	Very low	42.8	Very low	195 Å²	195	130.4 Å²	130.4	77%	0.765	75%	0.752	S	S	*	*			trans	105.8	154.2	149.6	-46.5	-63.3	0	0	0	121.1
162	D	39.8	Very low	42.5	Very low	151 Å²	151	125.4 Å²	125.4	81%	0.807	75%	0.747	S	S	*	*			trans	-130.4	-140.2	-158.7	-51	-104.7	0	0	0	111.5
163	P	54.5	Low	42.3	Very low	114 Å²	114	129.9 Å²	129.9	74%	0.74	76%	0.757	S	S	*	*			cis	-139.2	-154.4	-26.2	28.2	-1.4	0	0	0	116.1
164	I	40.1	Very low	42.4	Very low	152 Å²	152	135 Å²	135	78%	0.779	76%	0.758	S	S	*	*			trans	90.5	139.6	152.3	-11.3	-178.3	0	0	0	125
165	I	39.5	Very low	42.2	Very low	157 Å²	157	133.3 Å²	133.3	81%	0.805	75%	0.75	S	S	*	*			trans	107	152.9	154.8	-54.6	-175.2	0	0	0	118.9
166	S	38.8	Very low	42.6	Very low	93 Å²	93	133.2 Å²	133.2	65%	0.65	75%	0.749	S	S	*	*			trans	-111.4	-160.2	-153.9	36.6	0	0	0	0	114.9
167	D	45.1	Very low	42.7	Very low	142 Å²	142	133.5 Å²	133.5	76%	0.759	75%	0.748	S	S	*	*			cis	-162.1	-179.3	33.3	-100.2	-62.3	0	0	0	114.1
168	P	49.7	Very low	42.7	Very low	111 Å²	111	135.2 Å²	135.2	72%	0.721	75%	0.754	S	S	*	*			trans	-114.8	-175.9	-160	44.3	-39.4	0	0	0	119.6
169	L	39.1	Very low	42.5	Very low	152 Å²	152	133.4 Å²	133.4	80%	0.796	76%	0.757	S	S	*	*			trans	99.4	146.3	155.3	-154.9	74.1	0	0	0	119.5
170	M	42.9	Very low	43	Very low	165 Å²	165	129.5 Å²	129.5	81%	0.813	76%	0.758	S	S	*	*			trans	70	155.4	172.2	-129.3	54.7	74.2	0	0	116.1
171	G	35.8	Very low	43.4	Very low	73 Å²	73	131.5 Å²	131.5	75%	0.753	77%	0.772	S	S	*	*			cis	140.5	111.6	-11.5	0	0	0	0	0	112.8
172	G	38.5	Very low	43.2	Very low	68 Å²	68	128.2 Å²	128.2	70%	0.701	77%	0.767	S	S	*	*			trans	136.5	128.6	-175.6	0	0	0	0	0	111.3
173	L	38.7	Very low	43.4	Very low	187 Å²	187	130.6 Å²	130.6	98%	0.979	77%	0.77	S	S	*	*				76	84.2	75.3	-74	171.9	0	0	0	114.2
174	F	45.7	Very low	43.3	Very low	186 Å²	186	131 Å²	131	82%	0.816	77%	0.767	S	S	*	*			trans	-139.8	119.3	151.4	179.5	-110	0	0	0	109.9	S176	F174-S176 WeakPolarHBondContact CZ-OG 3.31Å
175	D	40.5	Very low	43.6	Very low	140 Å²	140	129.4 Å²	129.4	75%	0.749	77%	0.766	S	S	*	*			trans	-106.1	132	173.9	177.2	-76.2	0	0	0	108.3
176	S	53.8	Low	44	Very low	88 Å²	88	126.9 Å²	126.9	62%	0.615	75%	0.753	S	S	*	*			trans	-170.4	153.4	159.9	-86.4	0	0	0	0	113.3	F174	F174-S176 WeakPolarHBondContact CZ-OG 3.31Å
177	P	49.3	Very low	44.1	Very low	107 Å²	107	129.6 Å²	129.6	70%	0.695	76%	0.757	S	S	*	*			trans	-137.7	134.3	-148.2	35.8	-15.3	0	0	0	117.1
178	F	44.7	Very low	44	Very low	217 Å²	217	127.2 Å²	127.2	95%	0.952	76%	0.757	S	S	*	*			trans	-170.2	141.6	148.4	-135.8	-102.3	0	0	0	114.6
179	G	39.1	Very low	43.5	Very low	69 Å²	69	127.2 Å²	127.2	71%	0.711	76%	0.76	S	S	*	*			trans	69.6	137.7	162.1	0	0	0	0	0	117.4
180	G	47.4	Very low	43.7	Very low	73 Å²	73	126.4 Å²	126.4	75%	0.753	76%	0.762	S	S	*	*			cis	84.9	131.4	11.1	0	0	0	0	0	112.5
181	S	47.7	Very low	43.5	Very low	121 Å²	121	126.3 Å²	126.3	85%	0.846	77%	0.765	S	S	*	*			cis	-160.3	153.4	2.1	-61.1	0	0	0	0	110.4
182	L	37.5	Very low	43.8	Very low	126 Å²	126	128.8 Å²	128.8	66%	0.66	77%	0.77	S	S	*	*			trans	-154.5	118.1	163	-92.1	179	0	0	0	110.2
183	F	43.5	Very low	43.7	Very low	201 Å²	201	128.4 Å²	128.4	88%	0.882	77%	0.767	S	S	*	*			trans	-168.7	139.5	135.4	-113.8	-70.9	0	0	0	112.3
184	N	51.8	Low	43.7	Very low	124 Å²	124	129.6 Å²	129.6	66%	0.663	76%	0.764	S	S	*	*			trans	-99.4	145.8	-176.6	-178.2	72.3	0	0	0	111.4
185	P	47.4	Very low	43.1	Very low	117 Å²	117	125.4 Å²	125.4	76%	0.76	76%	0.764	S	S	*	*			trans	-92.1	157.3	167	35.2	-31.6	0	0	0	112.8
186	L	46.4	Very low	43.2	Very low	105 Å²	105	126.5 Å²	126.5	55%	0.55	77%	0.77	S	S	.	*			trans	-148.9	148.5	-162.4	170.9	63.6	0	0	0	111.6
187	M	42.5	Very low	42.6	Very low	149 Å²	149	127.2 Å²	127.2	73%	0.734	77%	0.773	S	S	*	*			trans	70.9	169	164.5	-79.4	-75.2	-176.6	0	0	119.2
188	A	41.4	Very low	41.7	Very low	92 Å²	92	131.8 Å²	131.8	76%	0.76	78%	0.784	S	S	*	*			trans	65.6	99.9	179.8	0	0	0	0	0	115.2
189	S	39.2	Very low	41.3	Very low	111 Å²	111	124.6 Å²	124.6	78%	0.776	77%	0.772	S	S	*	*			cis	85.9	155.6	39.9	-160.4	0	0	0	0	114.7
190	T	44.7	Very low	41	Very low	136 Å²	136	128 Å²	128	83%	0.834	79%	0.785	S	S	*	*			trans	64.8	107	-173.2	66.3	0	0	0	0	116
191	N	38.8	Very low	40.7	Very low	163 Å²	163	129.4 Å²	129.4	87%	0.872	78%	0.783	S	S	*	*			trans	-155.3	92.9	160.7	-169.4	13.3	0	0	0	110.8
192	S	41.3	Very low	40.4	Very low	124 Å²	124	129.6 Å²	129.6	87%	0.867	78%	0.784	S	S	*	*			trans	-164.6	97.3	171.4	57	0	0	0	0	111.3
193	G	36.4	Very low	40.9	Very low	61 Å²	61	129.6 Å²	129.6	63%	0.629	79%	0.79	S	S	*	*			trans	162.1	127.9	169	0	0	0	0	0	115.7
194	F	37.8	Very low	40.7	Very low	212 Å²	212	125 Å²	125	93%	0.93	78%	0.783	S	S	*	*			trans	59.9	100.3	154.7	-59.1	-77.5	0	0	0	119
195	A	34.4	Very low	40.2	Very low	98 Å²	98	125.8 Å²	125.8	81%	0.81	79%	0.792	S	S	*	*			trans	-68.8	141.9	152.5	0	0	0	0	0	110.9
196	N	41.2	Very low	39.8	Very low	162 Å²	162	128.9 Å²	128.9	87%	0.866	79%	0.793	S	S	*	*			trans	-154.4	147.2	144	-126.1	-0.1	0	0	0	109.5
197	P	41.2	Very low	39.4	Very low	104 Å²	104	128.5 Å²	128.5	68%	0.675	80%	0.8	S	S	*	*			trans	-88.4	167.3	-177	37.1	-35.1	0	0	0	112.2
198	Q	30.7	Very low	39.3	Very low	202 Å²	202	126.8 Å²	126.8	94%	0.944	80%	0.802	S	S	*	*			trans	58.7	90.1	170.7	-58	-179.7	3.2	0	0	115.6
199	G	36.4	Very low	39.4	Very low	67 Å²	67	130.8 Å²	130.8	69%	0.691	80%	0.803	S	S	*	*			trans	-171.7	116.9	168.7	0	0	0	0	0	113.2	S201	G199-S201 PolarHBondContact O-N 2.69Å
200	S	34.3	Very low	39.6	Very low	141 Å²	141	129 Å²	129	99%	0.986	80%	0.802	S	S	*	*			trans	-76	98.8	173.2	-60.9	0	0	0	0	110.2
201	S	39.8	Very low	39.1	Very low	102 Å²	102	126.5 Å²	126.5	71%	0.713	80%	0.803	S	S	*	*			trans	-122.6	117.1	178.7	49.1	0	0	0	0	111.7	G199	G199-S201 PolarHBondContact O-N 2.69Å
202	S	40.9	Very low	39.3	Very low	124 Å²	124	124.4 Å²	124.4	87%	0.867	80%	0.801	S	S	*	*			trans	-91.4	107.6	178.2	52.5	0	0	0	0	111
203	T	49.3	Very low	39	Very low	127 Å²	127	124.2 Å²	124.2	78%	0.779	80%	0.8	S	S	*	*			trans	-96.3	102.1	176.5	43.6	0	0	0	0	111.6	V205	T203-V205 PolarHBondContact O-N 3.45Å
204	S	39.5	Very low	39	Very low	105 Å²	105	127 Å²	127	73%	0.734	81%	0.808	S	S	*	*			trans	-91.1	96.8	173.2	55.8	0	0	0	0	111
205	V	40.4	Very low	39.3	Very low	140 Å²	140	122.4 Å²	122.4	85%	0.848	81%	0.81	S	S	*	*			trans	-82	112.5	170.8	-75.4	0	0	0	0	110.6	T203	T203-V205 PolarHBondContact O-N 3.45Å
206	F	38.5	Very low	40	Very low	181 Å²	181	121.1 Å²	121.1	79%	0.794	81%	0.806	S	S	*	*			trans	-97	119.7	171.4	57.6	-84.1	0	0	0	109.3
207	S	39.1	Very low	40.9	Very low	98 Å²	98	115.6 Å²	115.6	69%	0.685	79%	0.787	S	S	*	*			trans	-112.9	69.9	-179	46.9	0	0	0	0	111.4	F209	S207-F209 VanDerWaalsContact C-N 3.33Å; S207-F209 WeakPolarHBondContact O-CD1 3.25Å; S207-F209 PolarHBondContact O-N 2.8Å
208	S	39.8	Very low	42.1	Very low	112 Å²	112	120.1 Å²	120.1	78%	0.783	80%	0.797	S	S	*	*			trans	-72.4	82.1	174	-58.8	0	0	0	0	111.4	G210	S208-G210 VanDerWaalsContact C-N 3.29Å; S208-G210 PolarHBondContact O-N 3.13Å
209	F	44.8	Very low	44.5	Very low	177 Å²	177	117 Å²	117	78%	0.776	78%	0.776	S	S	*	*			trans	-74	83.3	170.5	62	-86.4	0	0	0	110.4	S207	S207-F209 VanDerWaalsContact C-N 3.33Å; S207-F209 WeakPolarHBondContact O-CD1 3.25Å; S207-F209 PolarHBondContact O-N 2.8Å
210	G	41.5	Very low	46.6	Very low	74 Å²	74	117.3 Å²	117.3	76%	0.763	77%	0.768	S	S	*	*			trans	-74.4	127.5	177.1	0	0	0	0	0	112.5	S208	S208-G210 VanDerWaalsContact C-N 3.29Å; S208-G210 PolarHBondContact O-N 3.13Å
211	G	35.8	Very low	49.1	Very low	83 Å²	83	113.8 Å²	113.8	86%	0.856	74%	0.74	S	S	*	*			trans	69.4	90.5	149.3	0	0	0	0	0	118.4
212	S	41.4	Very low	51.2	Low	119 Å²	119	112.2 Å²	112.2	83%	0.832	73%	0.73	S	S	*	*			trans	-145.2	151.2	134	-165.1	0	0	0	0	110.2	C214	S212-C214 PolarHBondContact O-N 3.02Å
213	S	36	Very low	53.5	Low	120 Å²	120	109.8 Å²	109.8	84%	0.839	71%	0.709	S	S	*	*			trans	-91.8	93	-162.4	56.2	0	0	0	0	113.4
214	C	36.6	Very low	55.2	Low	119 Å²	119	107.3 Å²	107.3	80%	0.804	70%	0.698	S	S	*	*	S	Bend	trans	-144.4	156	158.7	58.3	0	0	0	0	110.4	S212 G216	S212-C214 PolarHBondContact O-N 3.02Å; C214-G216 PolarHBondContact O-N 2.9Å; C214-G216 VanDerWaalsContact O-N 3.11Å
215	A	44.7	Very low	57.6	Low	116 Å²	116	105.7 Å²	105.7	96%	0.959	69%	0.686	S	S	*	*	S	Bend	trans	-73.4	104.8	-169.8	0	0	0	0	0	112.4
216	G	48	Very low	59.9	Low	71 Å²	71	106.2 Å²	106.2	73%	0.732	68%	0.677	S	S	*	*			trans	-155.5	135.8	170.9	0	0	0	0	0	109.7	C214	C214-G216 PolarHBondContact O-N 2.9Å; C214-G216 VanDerWaalsContact O-N 3.11Å
217	G	60.3	Low	62.4	Low	46 Å²	46	105.7 Å²	105.7	47%	0.474	67%	0.671	S	S	.	*			trans	-72.9	159.8	-174.4	0	0	0	0	0	113.6	R219 N241	G217-R219 PolarHBondContact O-N 3.44Å; G217-N241 WeakPolarHBondContact CA-OD1 3.43Å
218	F	66.2	Low	64.7	Low	199 Å²	199	104.3 Å²	104.3	87%	0.873	66%	0.658	S	S	*	*			trans	-61.8	121.5	-178.4	-60.7	-78.3	0	0	0	111.2	N241	F218-N241 PolarHBondContact O-N 3.36Å; F218-N241 VanDerWaalsContact O-N 3.14Å
219	R	81.8	Confident	67	Low	135 Å²	135	106.6 Å²	106.6	51%	0.509	66%	0.662	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-126.3	122.5	175.2	-170.9	177.7	-172	-94.3	-2	110.5	G217 V239 E240	G217-R219 PolarHBondContact O-N 3.44Å; R219-V239 CarbonylContact C-O 3.54Å; R219-V239 VanDerWaalsContact CA-O 3.27Å; R219-V239 WeakPolarHBondContact CA-O 3.23Å; R219-E240 HydrophobicContact CB-CG 4.27Å; R219-E240 VanDerWaalsContact CD-OE2 3.29Å; R219-E240 WeakPolarHBondContact CD-OE2 3.45Å; R219-E240 HydrophobicContact CG-CB 4.16Å; R219-E240 HydrophobicContact CG-CG 3.96Å; R219-E240 IonicContact CZ-OE2 3.83Å; R219-E240 IonicContact NE-OE2 2.71Å; R219-E240 PolarHBondContact NE-OE2 3.16Å; R219-E240 IonicContact NH2-OE2 2.64Å
220	S	80.6	Confident	68.9	Low	75 Å²	75	101.7 Å²	101.7	52%	0.524	66%	0.661	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.6	141	176.4	-177.8	0	0	0	0	109.7	V238 V239	S220-V238 WeakPolarHBondContact O-CA 3.31Å; S220-V239 PolarHBondContact N-O 3.37Å; S220-V239 PolarHBondContact O-N 2.79Å
221	V	86.9	Confident	70.9	Confident	66 Å²	66	103.4 Å²	103.4	40%	0.4	65%	0.648	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-132.6	126.5	177.5	-177.3	0	0	0	0	108.9	T236 K237 V238	V221-T236 HydrophobicContact CG1-CG2 4.39Å; V221-K237 CarbonylContact C-O 3.5Å; V221-K237 WeakPolarHBondContact CA-O 3.34Å; V221-V238 HydrophobicContact CG1-CG2 4.27Å; V221-V238 HydrophobicContact CG2-CG1 4.28Å; V221-V238 HydrophobicContact CG2-CG2 4.24Å
222	S	83.7	Confident	73.3	Confident	70 Å²	70	102.8 Å²	102.8	49%	0.49	62%	0.623	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-124.2	125.7	175.4	-179.2	0	0	0	0	108.9	T236 K237	S222-T236 CarbonylContact O-C 3.54Å; S222-K237 PolarHBondContact N-O 3.37Å; S222-K237 PolarHBondContact O-N 3.26Å
223	T	88.7	Confident	75.6	Confident	72 Å²	72	98.8 Å²	98.8	44%	0.442	59%	0.593	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-119.3	131.5	178.2	-57	0	0	0	0	109.1	R234 V235	T223-R234 HydrophobicContact CG2-CG 3.97Å; T223-R234 VanDerWaalsContact CG2-NE 3.28Å; T223-V235 WeakPolarHBondContact CA-O 3.37Å
224	S	85.7	Confident	78.1	Confident	76 Å²	76	97.2 Å²	97.2	53%	0.531	57%	0.569	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-131.8	121.2	178.5	-177.3	0	0	0	0	109.9	R234 V235	S224-R234 CarbonylContact O-C 3.55Å; S224-R234 WeakPolarHBondContact O-CA 3.36Å; S224-V235 PolarHBondContact N-O 2.81Å; S224-V235 PolarHBondContact O-N 3.14Å
225	S	88.9	Confident	80.7	Confident	71 Å²	71	93.8 Å²	93.8	50%	0.497	54%	0.544	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.6	134	180	-60.4	0	0	0	0	110.8	V233	S225-V233 CarbonylContact C-O 3.57Å; S225-V233 WeakPolarHBondContact CA-O 3.47Å
226	K	89.1	Confident	82.9	Confident	151 Å²	151	89.1 Å²	89.1	66%	0.657	50%	0.504	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-149.4	137.6	-178.8	-172.4	176.8	-178.8	-179.5	0	111	V233	K226-V233 PolarHBondContact N-O 3.45Å; K226-V233 WeakPolarHBondContact O-CA 3.5Å; K226-V233 WeakPolarHBondContact O-CB 3.41Å; K226-V233 PolarHBondContact O-N 3.01Å; K226-V233 VanDerWaalsContact O-O 3.06Å
227	Y	90.8	Very high	84.9	Confident	170 Å²	170	89.4 Å²	89.4	67%	0.667	49%	0.485	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-79.1	133.5	173.1	-67.5	-86.6	0	0	0	111.5	K231 M232	Y227-K231 CarbonylContact C-O 3.58Å; Y227-K231 VanDerWaalsContact CA-O 3.26Å; Y227-K231 WeakPolarHBondContact CA-O 3.45Å; Y227-M232 HydrophobicContact CD1-CB 4.1Å; Y227-M232 HydrophobicContact CE1-CB 3.71Å; Y227-M232 HydrophobicContact CE1-CG 4.16Å
228	V	87.9	Confident	86.3	Confident	68 Å²	68	88.6 Å²	88.6	41%	0.412	47%	0.471	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.8	124.1	177.1	-175.7	0	0	0	0	108.3	G230 K231 V233	V228-G230 PolarHBondContact O-N 2.92Å; V228-G230 VanDerWaalsContact O-N 3.15Å; V228-K231 PolarHBondContact N-O 2.97Å; V228-K231 WeakPolarHBondContact O-CB 3.39Å; V228-K231 PolarHBondContact O-N 3.02Å; V228-V233 HydrophobicContact CB-CG2 3.78Å; V228-V233 HydrophobicContact CG2-CB 4.37Å; V228-V233 HydrophobicContact CG2-CG2 3.72Å
229	N	87.2	Confident	87.2	Confident	161 Å²	161	80.6 Å²	80.6	86%	0.861	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	50.4	37.8	-179.1	-58.9	-13.4	0	0	0	114	K231	N229-K231 VanDerWaalsContact C-N 3.26Å; N229-K231 PolarHBondContact O-N 3.24Å
230	G	85.9	Confident	87.2	Confident	74 Å²	74	78 Å²	78	76%	0.763	43%	0.432	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.7	-11.3	-177.7	0	0	0	0	0	115.4	V228	V228-G230 PolarHBondContact O-N 2.92Å; V228-G230 VanDerWaalsContact O-N 3.15Å
231	K	83.5	Confident	87.2	Confident	110 Å²	110	79.7 Å²	79.7	48%	0.478	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.4	146.9	-179.6	-60.2	-167.7	160.8	-138.1	0	112	Y227 V228 N229 V233 V250 D251	Y227-K231 CarbonylContact C-O 3.58Å; Y227-K231 VanDerWaalsContact CA-O 3.26Å; Y227-K231 WeakPolarHBondContact CA-O 3.45Å; V228-K231 PolarHBondContact N-O 2.97Å; V228-K231 WeakPolarHBondContact O-CB 3.39Å; V228-K231 PolarHBondContact O-N 3.02Å; N229-K231 VanDerWaalsContact C-N 3.26Å; N229-K231 PolarHBondContact O-N 3.24Å; K231-V233 PolarHBondContact O-N 3.25Å; K231-V250 HydrophobicContact CB-CG1 3.83Å; K231-V250 HydrophobicContact CD-CG1 3.76Å; K231-V250 HydrophobicContact CG-CG1 4.43Å; K231-D251 VanDerWaalsContact CA-OD1 3.27Å; K231-D251 WeakPolarHBondContact CA-OD1 3.29Å; K231-D251 WeakPolarHBondContact CB-OD1 3.45Å; K231-D251 WeakPolarHBondContact CB-OD2 3.44Å; K231-D251 WeakPolarHBondContact CD-OD2 3.47Å; K231-D251 WeakPolarHBondContact CE-OD2 3.39Å; K231-D251 VanDerWaalsContact CG-OD2 3.24Å; K231-D251 WeakPolarHBondContact CG-OD2 3.42Å; K231-D251 IonicContact NZ-OD2 3.86Å; K231-D251 PolarHBondContact NZ-OD2 3.28Å
232	M	84.8	Confident	86.7	Confident	70 Å²	70	78.4 Å²	78.4	35%	0.345	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-85.2	108	174.7	-175.7	176.6	66.5	0	0	109.7	Y227 V250 D251	Y227-M232 HydrophobicContact CD1-CB 4.1Å; Y227-M232 HydrophobicContact CE1-CB 3.71Å; Y227-M232 HydrophobicContact CE1-CG 4.16Å; M232-V250 CarbonylContact O-C 3.58Å; M232-V250 WeakPolarHBondContact O-CA 3.35Å; M232-D251 PolarHBondContact N-OD1 3.44Å; M232-D251 PolarHBondContact O-N 3.05Å
233	V	90.2	Very high	86.5	Confident	34 Å²	34	77.3 Å²	77.3	21%	0.206	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.4	128.3	172.9	-170.6	0	0	0	0	108.9	S225 K226 V228 K231 E249 V250	S225-V233 CarbonylContact C-O 3.57Å; S225-V233 WeakPolarHBondContact CA-O 3.47Å; K226-V233 PolarHBondContact N-O 3.45Å; K226-V233 WeakPolarHBondContact O-CA 3.5Å; K226-V233 WeakPolarHBondContact O-CB 3.41Å; K226-V233 PolarHBondContact O-N 3.01Å; K226-V233 VanDerWaalsContact O-O 3.06Å; V228-V233 HydrophobicContact CB-CG2 3.78Å; V228-V233 HydrophobicContact CG2-CB 4.37Å; V228-V233 HydrophobicContact CG2-CG2 3.72Å; K231-V233 PolarHBondContact O-N 3.25Å; V233-E249 CarbonylContact C-O 3.59Å; V233-E249 VanDerWaalsContact CA-O 3.31Å; V233-E249 WeakPolarHBondContact CA-O 3.22Å; V233-V250 HydrophobicContact CG1-CG2 4.29Å; V233-V250 HydrophobicContact CG2-CG2 4.21Å
234	R	89	Confident	86.4	Confident	87 Å²	87	75.6 Å²	75.6	33%	0.328	41%	0.413	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.4	123.9	178.3	169.8	176.2	175.5	-135.2	7.1	109.9	T223 S224 E248 E249	T223-R234 HydrophobicContact CG2-CG 3.97Å; T223-R234 VanDerWaalsContact CG2-NE 3.28Å; S224-R234 CarbonylContact O-C 3.55Å; S224-R234 WeakPolarHBondContact O-CA 3.36Å; R234-E248 WeakPolarHBondContact O-CA 3.48Å; R234-E249 HydrophobicContact CB-CB 4.21Å; R234-E249 WeakPolarHBondContact CD-OE2 3.45Å; R234-E249 IonicContact CZ-OE1 3.35Å; R234-E249 IonicContact CZ-OE2 2.68Å; R234-E249 PolarHBondContact N-O 3.25Å; R234-E249 IonicContact NE-OE2 2.77Å; R234-E249 IonicContact NH1-OE1 3.75Å; R234-E249 PolarHBondContact NH1-OE1 2.81Å; R234-E249 IonicContact NH1-OE2 3.63Å; R234-E249 PolarHBondContact NH1-OE2 3.31Å; R234-E249 PolarHBondContact O-N 3.49Å
235	V	91.3	Very high	86.5	Confident	47 Å²	47	73.5 Å²	73.5	29%	0.285	40%	0.397	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.8	118	179.1	-174.7	0	0	0	0	108.7	T223 S224 I246 T247 E248	T223-V235 WeakPolarHBondContact CA-O 3.37Å; S224-V235 PolarHBondContact N-O 2.81Å; S224-V235 PolarHBondContact O-N 3.14Å; V235-I246 HydrophobicContact CG1-CG2 3.69Å; V235-T247 CarbonylContact C-O 3.58Å; V235-T247 WeakPolarHBondContact CA-O 3.21Å; V235-E248 HydrophobicContact CG1-CG 4.47Å; V235-E248 HydrophobicContact CG2-CG 4.3Å
236	T	91.3	Very high	86.5	Confident	18 Å²	18	71.9 Å²	71.9	11%	0.11	38%	0.382	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	106.6	-179.4	-55.7	0	0	0	0	109	V221 S222 V238 T247	V221-T236 HydrophobicContact CG1-CG2 4.39Å; S222-T236 CarbonylContact O-C 3.54Å; T236-V238 HydrophobicContact CG2-CG2 4.26Å; T236-T247 PolarHBondContact N-O 2.83Å; T236-T247 PolarHBondContact O-N 3.13Å
237	K	90	Very high	86.5	Confident	78 Å²	78	65.7 Å²	65.7	34%	0.339	36%	0.357	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.3	116.7	173.7	169.3	170.1	172.1	150.1	0	109.7	V221 S222 V239 E244 T245	V221-K237 CarbonylContact C-O 3.5Å; V221-K237 WeakPolarHBondContact CA-O 3.34Å; S222-K237 PolarHBondContact N-O 3.37Å; S222-K237 PolarHBondContact O-N 3.26Å; K237-V239 HydrophobicContact CG-CG2 4.3Å; K237-E244 HydrophobicContact CD-CG 4.38Å; K237-E244 WeakPolarHBondContact CD-OE1 3.38Å; K237-E244 WeakPolarHBondContact CE-OE1 3.27Å; K237-E244 VanDerWaalsContact CE-OE2 3.25Å; K237-E244 WeakPolarHBondContact CE-OE2 3.26Å; K237-E244 HydrophobicContact CG-CG 4.26Å; K237-E244 IonicContact NZ-OE1 2.68Å; K237-E244 PolarHBondContact NZ-OE1 2.81Å; K237-E244 IonicContact NZ-OE2 2.68Å; K237-E244 PolarHBondContact NZ-OE2 2.88Å; K237-T245 CarbonylContact C-O 3.49Å; K237-T245 WeakPolarHBondContact CA-O 3.42Å
238	V	88.8	Confident	86.3	Confident	28 Å²	28	60.9 Å²	60.9	17%	0.17	34%	0.341	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	120	172.6	-179.3	0	0	0	0	108	S220 V221 T236 E240 E244 T245	S220-V238 WeakPolarHBondContact O-CA 3.31Å; V221-V238 HydrophobicContact CG1-CG2 4.27Å; V221-V238 HydrophobicContact CG2-CG1 4.28Å; V221-V238 HydrophobicContact CG2-CG2 4.24Å; T236-V238 HydrophobicContact CG2-CG2 4.26Å; V238-E240 HydrophobicContact CG1-CB 4.32Å; V238-E244 CarbonylContact O-C 3.56Å; V238-E244 WeakPolarHBondContact O-CA 3.41Å; V238-T245 PolarHBondContact N-O 2.86Å; V238-T245 PolarHBondContact O-N 2.91Å
239	V	85.7	Confident	86.4	Confident	32 Å²	32	59 Å²	59	19%	0.194	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	118.8	168.8	179.5	0	0	0	0	107.7	R219 S220 K237 T243 E244	R219-V239 CarbonylContact C-O 3.54Å; R219-V239 VanDerWaalsContact CA-O 3.27Å; R219-V239 WeakPolarHBondContact CA-O 3.23Å; S220-V239 PolarHBondContact N-O 3.37Å; S220-V239 PolarHBondContact O-N 2.79Å; K237-V239 HydrophobicContact CG-CG2 4.3Å; V239-T243 CarbonylContact C-O 3.54Å; V239-T243 WeakPolarHBondContact CA-O 3.36Å; V239-E244 HydrophobicContact CG2-CB 4.12Å; V239-E244 HydrophobicContact CG2-CG 4.1Å
240	E	81.8	Confident	86.4	Confident	79 Å²	79	52.8 Å²	52.8	37%	0.369	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	126	-176.1	-170	170.4	152.8	0	0	109.9	R219 V238 G242 T243	R219-E240 HydrophobicContact CB-CG 4.27Å; R219-E240 VanDerWaalsContact CD-OE2 3.29Å; R219-E240 WeakPolarHBondContact CD-OE2 3.45Å; R219-E240 HydrophobicContact CG-CB 4.16Å; R219-E240 HydrophobicContact CG-CG 3.96Å; R219-E240 IonicContact CZ-OE2 3.83Å; R219-E240 IonicContact NE-OE2 2.71Å; R219-E240 PolarHBondContact NE-OE2 3.16Å; R219-E240 IonicContact NH2-OE2 2.64Å; V238-E240 HydrophobicContact CG1-CB 4.32Å; E240-G242 PolarHBondContact O-N 3.24Å; E240-G242 VanDerWaalsContact O-N 3.09Å; E240-T243 PolarHBondContact N-O 3.35Å; E240-T243 PolarHBondContact O-N 2.86Å
241	N	79.8	Confident	86.4	Confident	111 Å²	111	52.6 Å²	52.6	59%	0.594	28%	0.277	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.1	34.2	178.1	-57.3	-39.6	0	0	0	114.3	G217 F218	G217-N241 WeakPolarHBondContact CA-OD1 3.43Å; F218-N241 PolarHBondContact O-N 3.36Å; F218-N241 VanDerWaalsContact O-N 3.14Å
242	G	77.3	Confident	86.4	Confident	39 Å²	39	50 Å²	50	40%	0.402	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	81.7	7.7	-177.1	0	0	0	0	0	115.2	E240 C262	E240-G242 PolarHBondContact O-N 3.24Å; E240-G242 VanDerWaalsContact O-N 3.09Å; G242-C262 WeakPolarHBondContact O-CB 3.22Å; G242-C262 PolarHBondContact O-N 2.78Å
243	T	80	Confident	86.4	Confident	48 Å²	48	53.4 Å²	53.4	29%	0.294	30%	0.295	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	126.9	173.7	-58	0	0	0	0	110.6	V239 E240 V259	V239-T243 CarbonylContact C-O 3.54Å; V239-T243 WeakPolarHBondContact CA-O 3.36Å; E240-T243 PolarHBondContact N-O 3.35Å; E240-T243 PolarHBondContact O-N 2.86Å; T243-V259 HydrophobicContact CG2-CG1 3.53Å
244	E	85.5	Confident	86.2	Confident	36 Å²	36	55.9 Å²	55.9	17%	0.168	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.4	115.3	174.8	178.3	169	159.2	0	0	110.7	K237 V238 V239 I246 V259 R260	K237-E244 HydrophobicContact CD-CG 4.38Å; K237-E244 WeakPolarHBondContact CD-OE1 3.38Å; K237-E244 WeakPolarHBondContact CE-OE1 3.27Å; K237-E244 VanDerWaalsContact CE-OE2 3.25Å; K237-E244 WeakPolarHBondContact CE-OE2 3.26Å; K237-E244 HydrophobicContact CG-CG 4.26Å; K237-E244 IonicContact NZ-OE1 2.68Å; K237-E244 PolarHBondContact NZ-OE1 2.81Å; K237-E244 IonicContact NZ-OE2 2.68Å; K237-E244 PolarHBondContact NZ-OE2 2.88Å; V238-E244 CarbonylContact O-C 3.56Å; V238-E244 WeakPolarHBondContact O-CA 3.41Å; V239-E244 HydrophobicContact CG2-CB 4.12Å; V239-E244 HydrophobicContact CG2-CG 4.1Å; E244-I246 HydrophobicContact CG-CG1 4.15Å; E244-V259 CarbonylContact O-C 3.5Å; E244-V259 WeakPolarHBondContact O-CA 3.48Å; E244-R260 PolarHBondContact N-O 2.96Å; E244-R260 PolarHBondContact O-N 3.38Å
245	T	87.7	Confident	86.2	Confident	32 Å²	32	56 Å²	56	20%	0.196	32%	0.321	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.4	120.5	170.8	-62.3	0	0	0	0	108.9	K237 V238 Q257 V259	K237-T245 CarbonylContact C-O 3.49Å; K237-T245 WeakPolarHBondContact CA-O 3.42Å; V238-T245 PolarHBondContact N-O 2.86Å; V238-T245 PolarHBondContact O-N 2.91Å; T245-Q257 HydrophobicContact CG2-CG 4.25Å; T245-V259 HydrophobicContact CG2-CG2 4.16Å
246	I	88.7	Confident	86	Confident	36 Å²	36	56.9 Å²	56.9	19%	0.185	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.8	120.5	171.4	-52.6	173.3	0	0	0	107.8	V235 E244 Q257 T258	V235-I246 HydrophobicContact CG1-CG2 3.69Å; E244-I246 HydrophobicContact CG-CG1 4.15Å; I246-Q257 CarbonylContact O-C 3.59Å; I246-Q257 WeakPolarHBondContact O-CA 3.35Å; I246-T258 PolarHBondContact N-O 3.1Å; I246-T258 PolarHBondContact O-N 2.99Å
247	T	88.8	Confident	85.9	Confident	22 Å²	22	62 Å²	62	14%	0.135	35%	0.347	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.6	127.3	173.1	-54.5	0	0	0	0	109.1	V235 T236 E249 V254	V235-T247 CarbonylContact C-O 3.58Å; V235-T247 WeakPolarHBondContact CA-O 3.21Å; T236-T247 PolarHBondContact N-O 2.83Å; T236-T247 PolarHBondContact O-N 3.13Å; T247-E249 HydrophobicContact CG2-CG 4.43Å; T247-V254 HydrophobicContact CG2-CB 4.41Å; T247-V254 HydrophobicContact CG2-CG1 3.72Å; T247-V254 HydrophobicContact CG2-CG2 3.8Å
248	E	88.2	Confident	85.8	Confident	69 Å²	69	60.1 Å²	60.1	32%	0.322	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106.7	121.4	172.1	-48.9	-176.4	136.9	0	0	108.9	R234 V235 V254 T255 N256	R234-E248 WeakPolarHBondContact O-CA 3.48Å; V235-E248 HydrophobicContact CG1-CG 4.47Å; V235-E248 HydrophobicContact CG2-CG 4.3Å; E248-V254 CarbonylContact O-C 3.57Å; E248-V254 WeakPolarHBondContact O-CA 3.27Å; E248-T255 PolarHBondContact O-N 3.34Å; E248-T255 PolarHBondContact O-OG1 2.88Å; E248-N256 HydrophobicContact CB-CB 3.97Å; E248-N256 HydrophobicContact CG-CB 4.02Å; E248-N256 PolarHBondContact N-O 3.08Å; E248-N256 PolarHBondContact O-N 2.79Å; E248-N256 WeakPolarHBondContact OE2-CB 3.47Å; E248-N256 PolarHBondContact OE2-ND2 3.02Å
249	E	89	Confident	85.8	Confident	29 Å²	29	63.1 Å²	63.1	14%	0.136	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.2	137.7	175.7	-64.5	158	-138.4	0	0	109.2	V233 R234 T247 H253 V254	V233-E249 CarbonylContact C-O 3.59Å; V233-E249 VanDerWaalsContact CA-O 3.31Å; V233-E249 WeakPolarHBondContact CA-O 3.22Å; R234-E249 HydrophobicContact CB-CB 4.21Å; R234-E249 WeakPolarHBondContact CD-OE2 3.45Å; R234-E249 IonicContact CZ-OE1 3.35Å; R234-E249 IonicContact CZ-OE2 2.68Å; R234-E249 PolarHBondContact N-O 3.25Å; R234-E249 IonicContact NE-OE2 2.77Å; R234-E249 IonicContact NH1-OE1 3.75Å; R234-E249 PolarHBondContact NH1-OE1 2.81Å; R234-E249 IonicContact NH1-OE2 3.63Å; R234-E249 PolarHBondContact NH1-OE2 3.31Å; R234-E249 PolarHBondContact O-N 3.49Å; T247-E249 HydrophobicContact CG2-CG 4.43Å; E249-H253 CarbonylContact C-O 3.53Å; E249-H253 VanDerWaalsContact CA-O 3.32Å; E249-H253 WeakPolarHBondContact CA-O 3.15Å; E249-V254 HydrophobicContact CG-CG2 4.13Å
250	V	87.6	Confident	85.8	Confident	30 Å²	30	69.2 Å²	69.2	18%	0.182	38%	0.38	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-125.5	122.2	169.5	-177.3	0	0	0	0	108.5	K231 M232 V233 G252 H253 T255	K231-V250 HydrophobicContact CB-CG1 3.83Å; K231-V250 HydrophobicContact CD-CG1 3.76Å; K231-V250 HydrophobicContact CG-CG1 4.43Å; M232-V250 CarbonylContact O-C 3.58Å; M232-V250 WeakPolarHBondContact O-CA 3.35Å; V233-V250 HydrophobicContact CG1-CG2 4.29Å; V233-V250 HydrophobicContact CG2-CG2 4.21Å; V250-G252 PolarHBondContact O-N 2.8Å; V250-H253 PolarHBondContact N-O 2.82Å; V250-H253 WeakPolarHBondContact O-CB 3.47Å; V250-H253 PolarHBondContact O-N 3Å; V250-T255 HydrophobicContact CB-CG2 3.74Å; V250-T255 HydrophobicContact CG2-CG2 3.6Å
251	D	85.6	Confident	85.8	Confident	70 Å²	70	73.4 Å²	73.4	37%	0.374	40%	0.399	S	S	.	.	T	Hydrogen-bonded Turn	trans	49.9	41	-174.8	-52.4	-39.3	0	0	0	112	K231 M232 H253	K231-D251 VanDerWaalsContact CA-OD1 3.27Å; K231-D251 WeakPolarHBondContact CA-OD1 3.29Å; K231-D251 WeakPolarHBondContact CB-OD1 3.45Å; K231-D251 WeakPolarHBondContact CB-OD2 3.44Å; K231-D251 WeakPolarHBondContact CD-OD2 3.47Å; K231-D251 WeakPolarHBondContact CE-OD2 3.39Å; K231-D251 VanDerWaalsContact CG-OD2 3.24Å; K231-D251 WeakPolarHBondContact CG-OD2 3.42Å; K231-D251 IonicContact NZ-OD2 3.86Å; K231-D251 PolarHBondContact NZ-OD2 3.28Å; M232-D251 PolarHBondContact N-OD1 3.44Å; M232-D251 PolarHBondContact O-N 3.05Å; D251-H253 VanDerWaalsContact C-N 3.28Å; D251-H253 PolarHBondContact O-N 3.5Å; D251-H253 PolarHBondContact O-ND1 2.89Å
252	G	83.4	Confident	85.3	Confident	54 Å²	54	70.3 Å²	70.3	56%	0.557	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	77.3	-0.7	-178.5	0	0	0	0	0	116	V250	V250-G252 PolarHBondContact O-N 2.8Å
253	H	84	Confident	84.5	Confident	142 Å²	142	71.7 Å²	71.7	66%	0.657	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-102.6	127.6	179.2	-64.8	62.9	0	0	0	110.3	E249 V250 D251 T255	E249-H253 CarbonylContact C-O 3.53Å; E249-H253 VanDerWaalsContact CA-O 3.32Å; E249-H253 WeakPolarHBondContact CA-O 3.15Å; V250-H253 PolarHBondContact N-O 2.82Å; V250-H253 WeakPolarHBondContact O-CB 3.47Å; V250-H253 PolarHBondContact O-N 3Å; D251-H253 VanDerWaalsContact C-N 3.28Å; D251-H253 PolarHBondContact O-N 3.5Å; D251-H253 PolarHBondContact O-ND1 2.89Å; H253-T255 PolarHBondContact O-N 2.78Å
254	V	87.7	Confident	83.2	Confident	87 Å²	87	78 Å²	78	53%	0.527	43%	0.432	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.1	118	177.4	-179.5	0	0	0	0	109.9	T247 E248 E249 N256	T247-V254 HydrophobicContact CG2-CB 4.41Å; T247-V254 HydrophobicContact CG2-CG1 3.72Å; T247-V254 HydrophobicContact CG2-CG2 3.8Å; E248-V254 CarbonylContact O-C 3.57Å; E248-V254 WeakPolarHBondContact O-CA 3.27Å; E249-V254 HydrophobicContact CG-CG2 4.13Å; V254-N256 WeakPolarHBondContact CG1-O 3.12Å
255	T	89.2	Confident	81.4	Confident	90 Å²	90	79.2 Å²	79.2	55%	0.552	45%	0.454	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.8	-23.7	177.3	52.1	0	0	0	0	113.2	E248 V250 H253	E248-T255 PolarHBondContact O-N 3.34Å; E248-T255 PolarHBondContact O-OG1 2.88Å; V250-T255 HydrophobicContact CB-CG2 3.74Å; V250-T255 HydrophobicContact CG2-CG2 3.6Å; H253-T255 PolarHBondContact O-N 2.78Å
256	N	87.1	Confident	79.2	Confident	65 Å²	65	82.1 Å²	82.1	35%	0.348	48%	0.481	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-151.5	142.3	-179.9	-171.4	-8.3	0	0	0	109.6	E248 V254 T258	E248-N256 HydrophobicContact CB-CB 3.97Å; E248-N256 HydrophobicContact CG-CB 4.02Å; E248-N256 PolarHBondContact N-O 3.08Å; E248-N256 PolarHBondContact O-N 2.79Å; E248-N256 WeakPolarHBondContact OE2-CB 3.47Å; E248-N256 PolarHBondContact OE2-ND2 3.02Å; V254-N256 WeakPolarHBondContact CG1-O 3.12Å; N256-T258 PolarHBondContact OD1-OG1 3.25Å
257	Q	88.9	Confident	76.8	Confident	125 Å²	125	88.3 Å²	88.3	58%	0.584	51%	0.514	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-138.6	120.5	168.7	-166.8	177	16.9	0	0	108.9	T245 I246	T245-Q257 HydrophobicContact CG2-CG 4.25Å; I246-Q257 CarbonylContact O-C 3.59Å; I246-Q257 WeakPolarHBondContact O-CA 3.35Å
258	T	88.1	Confident	74.4	Confident	39 Å²	39	96.1 Å²	96.1	24%	0.239	55%	0.549	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	118.7	-176.4	-74.3	0	0	0	0	109.1	I246 N256 R260	I246-T258 PolarHBondContact N-O 3.1Å; I246-T258 PolarHBondContact O-N 2.99Å; N256-T258 PolarHBondContact OD1-OG1 3.25Å; T258-R260 HydrophobicContact CG2-CG 4Å; T258-R260 VanDerWaalsContact CG2-NE 3.3Å
259	V	88.1	Confident	72	Confident	91 Å²	91	96.8 Å²	96.8	55%	0.552	57%	0.566	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-107.9	133.7	175.7	-174.1	0	0	0	0	109.5	T243 E244 T245	T243-V259 HydrophobicContact CG2-CG1 3.53Å; E244-V259 CarbonylContact O-C 3.5Å; E244-V259 WeakPolarHBondContact O-CA 3.48Å; T245-V259 HydrophobicContact CG2-CG2 4.16Å
260	R	86.4	Confident	69.6	Low	160 Å²	160	108.1 Å²	108.1	60%	0.604	62%	0.622	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-141.8	149.8	179.9	-59.7	-179.4	-175.5	178.5	2.7	109.1	E244 T258	E244-R260 PolarHBondContact N-O 2.96Å; E244-R260 PolarHBondContact O-N 3.38Å; T258-R260 HydrophobicContact CG2-CG 4Å; T258-R260 VanDerWaalsContact CG2-NE 3.3Å
261	Q	80.7	Confident	68.7	Low	167 Å²	167	112 Å²	112	78%	0.78	64%	0.644	S	S	*	*	E	Extended strand (participates in β ladder)	trans	-81.5	143.1	165.2	-72.6	-173.6	-10.2	0	0	110.2	G263	Q261-G263 PolarHBondContact O-N 3.01Å
262	C	69.3	Low	67.8	Low	46 Å²	46	114.2 Å²	114.2	31%	0.311	66%	0.659	S	S	.	*			trans	-71.1	107.2	171.4	-62.5	0	0	0	0	108.7	G242 N264	G242-C262 WeakPolarHBondContact O-CB 3.22Å; G242-C262 PolarHBondContact O-N 2.78Å; C262-N264 PolarHBondContact O-N 3.13Å
263	G	60.6	Low	66.9	Low	68 Å²	68	117.6 Å²	117.6	70%	0.701	66%	0.664	S	S	*	*			trans	-62.9	128.8	-179.6	0	0	0	0	0	112.5	Q261 G265	Q261-G263 PolarHBondContact O-N 3.01Å; G263-G265 PolarHBondContact O-N 3.02Å
264	N	53.3	Low	65.9	Low	180 Å²	180	116.1 Å²	116.1	96%	0.963	67%	0.665	S	S	*	*			trans	-75.7	85.9	171.7	-69.6	-48.1	0	0	0	109.9	C262	C262-N264 PolarHBondContact O-N 3.13Å
265	G	46.5	Very low	64.5	Low	61 Å²	61	117.9 Å²	117.9	63%	0.629	67%	0.673	S	S	*	*			trans	157.2	113.2	-177.7	0	0	0	0	0	109.8	G263	G263-G265 PolarHBondContact O-N 3.02Å
266	A	41.4	Very low	62.9	Low	93 Å²	93	119.8 Å²	119.8	77%	0.769	68%	0.681	S	S	*	*			cis	64.4	93.2	15	0	0	0	0	0	115.2
267	L	39.7	Very low	61.1	Low	167 Å²	167	123.7 Å²	123.7	87%	0.874	71%	0.705	S	S	*	*			trans	61.5	52.6	144.9	-64	167.2	0	0	0	119.4
268	Q	38.2	Very low	59	Low	185 Å²	185	123.6 Å²	123.6	86%	0.864	71%	0.714	S	S	*	*			trans	-144.9	121.5	147.2	-130.8	88.7	52.6	0	0	106.4
269	A	36.4	Very low	56.6	Low	83 Å²	83	130.7 Å²	130.7	69%	0.686	75%	0.754	S	S	*	*			cis	73.7	73.5	27.8	0	0	0	0	0	114.5
270	M	38.6	Very low	53.7	Low	267 Å²	267	134.3 Å²	134.3	100%	1.315	77%	0.772	S	S	*	*				-164.5	0	120.9	-99.9	169.4	-174	0	0	110.8

Retrieved 270 of 270 residues in 125.4 ms (Link to these results)

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