A0A068BFY4_HUMAN Loading...

Truncated breast and ovarian cancer susceptibility protein 2

AlphaFold DB , UniProt , Accession A0A068BFY4, Species HUMAN (Homo sapiens, Human), Gene BRCA2, Length 215 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	L	65.8	Low	79.9	Confident	90 Å²	90	77.1 Å²	77.1	47%	0.471	39%	0.39	S	S	.	.				0	-62.2	0	-72.9	172.5	0	0	0	111	T3 Y4 V6 I11 P77	L1-T3 VanDerWaalsContact C-N 3.25Å; L1-T3 PolarHBondContact O-N 3.24Å; L1-Y4 PolarHBondContact O-N 2.93Å; L1-V6 HydrophobicContact CD2-CG2 4.24Å; L1-I11 HydrophobicContact CB-CD1 4.45Å; L1-I11 HydrophobicContact CD1-CD1 4.32Å; L1-P77 HydrophobicContact CD2-CB 4.28Å; L1-P77 HydrophobicContact CD2-CG 3.36Å
2	Y	77.3	Confident	80.6	Confident	140 Å²	140	84 Å²	84	55%	0.549	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-60.2	-31.2	179.3	-57.4	-59.4	0	0	0	114.6	Y4 G5 V6 K8 I11	Y2-Y4 PolarHBondContact O-N 3.36Å; Y2-Y4 VanDerWaalsContact O-N 3.16Å; Y2-G5 PolarHBondContact O-N 3.48Å; Y2-V6 WeakPolarHBondContact CD1-O 3.34Å; Y2-K8 HydrophobicContact CD1-CG 4.32Å; Y2-K8 HydrophobicContact CE1-CB 4.39Å; Y2-K8 HydrophobicContact CE1-CG 3.44Å; Y2-K8 VanDerWaalsContact CE1-CG 3.44Å; Y2-I11 HydrophobicContact CD1-CD1 4.42Å; Y2-I11 HydrophobicContact CE1-CD1 3.54Å
3	T	80.8	Confident	81.4	Confident	125 Å²	125	79.2 Å²	79.2	77%	0.767	39%	0.392	S	S	*	.	G	3₁₀ helix	trans	-59	-23.2	173.2	53.4	0	0	0	0	113.9	L1	L1-T3 VanDerWaalsContact C-N 3.25Å; L1-T3 PolarHBondContact O-N 3.24Å
4	Y	78.3	Confident	82	Confident	112 Å²	112	78.6 Å²	78.6	44%	0.439	39%	0.391	S	S	.	.	G	3₁₀ helix	trans	-98	-0.4	177.3	-62.6	-72.5	0	0	0	112.5	L1 Y2 P77 K78 A81	L1-Y4 PolarHBondContact O-N 2.93Å; Y2-Y4 PolarHBondContact O-N 3.36Å; Y2-Y4 VanDerWaalsContact O-N 3.16Å; Y4-P77 HydrophobicContact CD2-CB 3.83Å; Y4-P77 HydrophobicContact CG-CB 3.89Å; Y4-K78 HydrophobicContact CD1-CG 3.95Å; Y4-K78 HydrophobicContact CE1-CD 4.29Å; Y4-K78 HydrophobicContact CE1-CG 3.47Å; Y4-K78 VanDerWaalsContact CE1-CG 3.47Å; Y4-K78 WeakPolarHBondContact OH-CE 3.41Å; Y4-A81 WeakPolarHBondContact O-CB 3.31Å
5	G	78.8	Confident	82.5	Confident	38 Å²	38	73.7 Å²	73.7	39%	0.392	37%	0.368	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.3	13.1	180	0	0	0	0	0	115.4	Y2 S7	Y2-G5 PolarHBondContact O-N 3.48Å; G5-S7 PolarHBondContact O-N 3.16Å
6	V	81.4	Confident	82.9	Confident	2 Å²	2	75.9 Å²	75.9	1%	0.012	37%	0.374	C	S	.	.			trans	-67	120.3	174.6	-176.6	0	0	0	0	109.8	L1 Y2 C10 I11 E73 P77 A81	L1-V6 HydrophobicContact CD2-CG2 4.24Å; Y2-V6 WeakPolarHBondContact CD1-O 3.34Å; V6-C10 HydrophobicContact CG1-CB 4.3Å; V6-I11 HydrophobicContact CG1-CD1 4.21Å; V6-I11 HydrophobicContact CG1-CG1 3.84Å; V6-E73 WeakPolarHBondContact CG2-O 3.45Å; V6-P77 HydrophobicContact CG2-CB 3.86Å; V6-P77 HydrophobicContact CG2-CG 4.32Å; V6-A81 HydrophobicContact CG2-CB 3.73Å
7	S	81.4	Confident	83.3	Confident	39 Å²	39	74.5 Å²	74.5	27%	0.273	37%	0.369	S	S	.	.			trans	-63.5	144.8	-179.2	175.3	0	0	0	0	112.5	G5 H9 C10 I11	G5-S7 PolarHBondContact O-N 3.16Å; S7-H9 PolarHBondContact O-N 2.64Å; S7-H9 PolarHBondContact OG-N 2.96Å; S7-C10 WeakPolarHBondContact O-CB 3.12Å; S7-C10 PolarHBondContact O-N 3.01Å; S7-I11 PolarHBondContact O-N 2.8Å
8	K	83.4	Confident	83.5	Confident	140 Å²	140	70.3 Å²	70.3	61%	0.609	35%	0.348	S	S	*	.	H	α-helix	trans	-59.9	-32.5	172.6	-72.9	-179.1	180	177	0	112.2	Y2	Y2-K8 HydrophobicContact CD1-CG 4.32Å; Y2-K8 HydrophobicContact CE1-CB 4.39Å; Y2-K8 HydrophobicContact CE1-CG 3.44Å; Y2-K8 VanDerWaalsContact CE1-CG 3.44Å
9	H	82.3	Confident	83.7	Confident	99 Å²	99	70 Å²	70	46%	0.458	35%	0.345	S	S	.	.	H	α-helix	trans	-67.4	-43	177.2	-64.9	-86	0	0	0	110.5	S7 I11 K12 I13 F21	S7-H9 PolarHBondContact O-N 2.64Å; S7-H9 PolarHBondContact OG-N 2.96Å; H9-I11 VanDerWaalsContact C-N 3.35Å; H9-I11 PolarHBondContact O-N 3.34Å; H9-K12 PolarHBondContact O-N 2.8Å; H9-I13 WeakPolarHBondContact O-CG1 3.24Å; H9-F21 HydrophobicContact CB-CE2 4.33Å
10	C	83.7	Confident	83.8	Confident	1 Å²	1	71 Å²	71	1%	0.007	36%	0.36	C	S	.	.	H	α-helix	trans	-57.3	-43.7	178.3	-178	0	0	0	0	112.8	V6 S7 K12 I13 A70 L85	V6-C10 HydrophobicContact CG1-CB 4.3Å; S7-C10 WeakPolarHBondContact O-CB 3.12Å; S7-C10 PolarHBondContact O-N 3.01Å; C10-K12 PolarHBondContact O-N 2.92Å; C10-I13 WeakPolarHBondContact O-CB 3.08Å; C10-I13 PolarHBondContact O-N 2.91Å; C10-I13 VanDerWaalsContact O-N 3.13Å; C10-A70 WeakPolarHBondContact SG-CA 3.46Å; C10-A70 PolarHBondContact SG-O 3.29Å; C10-L85 HydrophobicContact CB-CD2 3.91Å
11	I	86.1	Confident	83.9	Confident	62 Å²	62	68.9 Å²	68.9	32%	0.318	35%	0.348	S	S	.	.	H	α-helix	trans	-65.1	-28	-177.4	-63.7	167.4	0	0	0	112.2	L1 Y2 V6 S7 H9 I13	L1-I11 HydrophobicContact CB-CD1 4.45Å; L1-I11 HydrophobicContact CD1-CD1 4.32Å; Y2-I11 HydrophobicContact CD1-CD1 4.42Å; Y2-I11 HydrophobicContact CE1-CD1 3.54Å; V6-I11 HydrophobicContact CG1-CD1 4.21Å; V6-I11 HydrophobicContact CG1-CG1 3.84Å; S7-I11 PolarHBondContact O-N 2.8Å; H9-I11 VanDerWaalsContact C-N 3.35Å; H9-I11 PolarHBondContact O-N 3.34Å; I11-I13 VanDerWaalsContact C-N 3.27Å
12	K	88.4	Confident	84.9	Confident	160 Å²	160	69 Å²	69	70%	0.696	35%	0.346	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.5	-8.7	-180	-66.7	-179.1	179.4	-176.7	0	112.8	H9 C10 N17	H9-K12 PolarHBondContact O-N 2.8Å; C10-K12 PolarHBondContact O-N 2.92Å; K12-N17 PolarHBondContact O-ND2 3.22Å
13	I	90.5	Very high	85.3	Confident	21 Å²	21	62.5 Å²	62.5	11%	0.108	32%	0.321	C	S	.	.			trans	-74.8	131.5	-179.4	-61.9	171.5	0	0	0	109.5	H9 C10 I11 N17 A18 F21 I66 A70 L85	H9-I13 WeakPolarHBondContact O-CG1 3.24Å; C10-I13 WeakPolarHBondContact O-CB 3.08Å; C10-I13 PolarHBondContact O-N 2.91Å; C10-I13 VanDerWaalsContact O-N 3.13Å; I11-I13 VanDerWaalsContact C-N 3.27Å; I13-N17 VanDerWaalsContact CA-OD1 3.31Å; I13-N17 WeakPolarHBondContact CA-OD1 3.09Å; I13-A18 HydrophobicContact CG2-CB 3.86Å; I13-F21 HydrophobicContact CD1-CD2 3.55Å; I13-F21 HydrophobicContact CD1-CE2 3.6Å; I13-F21 HydrophobicContact CD1-CG 4.08Å; I13-F21 HydrophobicContact CD1-CZ 4.17Å; I13-F21 HydrophobicContact CG1-CD2 3.85Å; I13-F21 HydrophobicContact CG1-CE2 4.18Å; I13-I66 HydrophobicContact CD1-CG2 3.94Å; I13-I66 HydrophobicContact CG2-CG2 3.98Å; I13-A70 HydrophobicContact CB-CB 3.84Å; I13-A70 HydrophobicContact CD1-CB 3.8Å; I13-A70 HydrophobicContact CG1-CB 4.4Å; I13-A70 HydrophobicContact CG2-CB 3.84Å; I13-L85 HydrophobicContact CD1-CD2 3.62Å
14	N	90.3	Very high	85.5	Confident	71 Å²	71	59.8 Å²	59.8	38%	0.38	30%	0.299	S	S	.	.			trans	-131.4	176.9	173.1	64	46.9	0	0	0	109.3	K16 N17 A18	N14-K16 PolarHBondContact O-N 3.38Å; N14-K16 VanDerWaalsContact O-N 3.17Å; N14-K16 WeakPolarHBondContact OD1-CA 3.39Å; N14-K16 WeakPolarHBondContact OD1-CB 3.43Å; N14-K16 PolarHBondContact OD1-N 3.44Å; N14-N17 PolarHBondContact N-OD1 3.07Å; N14-N17 PolarHBondContact ND2-ND2 3.09Å; N14-N17 PolarHBondContact O-OD1 3.45Å; N14-N17 PolarHBondContact OD1-N 3.09Å; N14-N17 PolarHBondContact OD1-OD1 2.76Å; N14-A18 VanDerWaalsContact O-CB 3.27Å; N14-A18 WeakPolarHBondContact O-CB 3.21Å; N14-A18 PolarHBondContact O-N 3.46Å; N14-A18 VanDerWaalsContact O-N 3.14Å
15	S	89.2	Confident	85.5	Confident	5 Å²	5	54.5 Å²	54.5	4%	0.035	28%	0.278	C	S	.	.	T	Hydrogen-bonded Turn	trans	-59.1	-26.1	-179.1	55	0	0	0	0	114.3	R63 S129 V185	S15-R63 VanDerWaalsContact O-CZ 3.28Å; S15-R63 PolarHBondContact O-NE 2.63Å; S15-R63 PolarHBondContact O-NH2 3.26Å; S15-S129 WeakPolarHBondContact CB-O 3.39Å; S15-S129 PolarHBondContact OG-O 3.36Å; S15-V185 VanDerWaalsContact OG-CG1 3.31Å; S15-V185 WeakPolarHBondContact OG-CG1 3.22Å
16	K	88.6	Confident	85.7	Confident	109 Å²	109	57.2 Å²	57.2	47%	0.474	28%	0.281	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	-47.3	-178.3	-72.9	-179.4	135.5	141.9	0	112.4	N14 A18 D130	N14-K16 PolarHBondContact O-N 3.38Å; N14-K16 VanDerWaalsContact O-N 3.17Å; N14-K16 WeakPolarHBondContact OD1-CA 3.39Å; N14-K16 WeakPolarHBondContact OD1-CB 3.43Å; N14-K16 PolarHBondContact OD1-N 3.44Å; K16-A18 VanDerWaalsContact C-N 3.33Å; K16-D130 WeakPolarHBondContact CE-OD1 3.5Å; K16-D130 WeakPolarHBondContact CE-OD2 3.44Å; K16-D130 IonicContact NZ-OD1 2.79Å; K16-D130 PolarHBondContact NZ-OD1 3.42Å; K16-D130 IonicContact NZ-OD2 3.38Å; K16-D130 PolarHBondContact NZ-OD2 3.01Å
17	N	89.7	Confident	85.7	Confident	52 Å²	52	62.1 Å²	62.1	28%	0.278	31%	0.307	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.2	-6.6	-174.3	70.4	11.2	0	0	0	113.7	K12 I13 N14 E19 S20 F21	K12-N17 PolarHBondContact O-ND2 3.22Å; I13-N17 VanDerWaalsContact CA-OD1 3.31Å; I13-N17 WeakPolarHBondContact CA-OD1 3.09Å; N14-N17 PolarHBondContact N-OD1 3.07Å; N14-N17 PolarHBondContact ND2-ND2 3.09Å; N14-N17 PolarHBondContact O-OD1 3.45Å; N14-N17 PolarHBondContact OD1-N 3.09Å; N14-N17 PolarHBondContact OD1-OD1 2.76Å; N17-E19 PolarHBondContact O-N 3.48Å; N17-S20 PolarHBondContact O-N 2.89Å; N17-S20 PolarHBondContact O-OG 3.38Å; N17-F21 PolarHBondContact O-N 3.44Å
18	A	87.9	Confident	85.7	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	31%	0.307	C	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-26.7	176.4	0	0	0	0	0	112.9	I13 N14 K16 F21 R63 I66 W67	I13-A18 HydrophobicContact CG2-CB 3.86Å; N14-A18 VanDerWaalsContact O-CB 3.27Å; N14-A18 WeakPolarHBondContact O-CB 3.21Å; N14-A18 PolarHBondContact O-N 3.46Å; N14-A18 VanDerWaalsContact O-N 3.14Å; K16-A18 VanDerWaalsContact C-N 3.33Å; A18-F21 WeakPolarHBondContact O-CB 3.26Å; A18-R63 HydrophobicContact CB-CG 4.25Å; A18-R63 VanDerWaalsContact CB-O 3.28Å; A18-R63 WeakPolarHBondContact CB-O 3.38Å; A18-I66 HydrophobicContact CB-CB 4.14Å; A18-I66 HydrophobicContact CB-CG2 3.91Å; A18-W67 HydrophobicContact CB-CB 3.83Å
19	E	86.1	Confident	85.6	Confident	64 Å²	64	59.3 Å²	59.3	30%	0.299	29%	0.289	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.8	-41	174.9	168.8	156.6	-135.4	0	0	112.7	N17 F21 E59 R63	N17-E19 PolarHBondContact O-N 3.48Å; E19-F21 VanDerWaalsContact C-N 3.28Å; E19-F21 PolarHBondContact O-N 3.02Å; E19-E59 HydrophobicContact CG-CB 4.09Å; E19-E59 WeakPolarHBondContact CG-O 3.33Å; E19-R63 HydrophobicContact CB-CB 3.97Å; E19-R63 HydrophobicContact CB-CG 3.94Å
20	S	85.7	Confident	85.2	Confident	90 Å²	90	56 Å²	56	63%	0.629	28%	0.282	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.1	8.3	179	57	0	0	0	0	113.3	N17 Q22	N17-S20 PolarHBondContact O-N 2.89Å; N17-S20 PolarHBondContact O-OG 3.38Å; S20-Q22 PolarHBondContact O-N 3.23Å
21	F	86.4	Confident	84.5	Confident	27 Å²	27	62.1 Å²	62.1	12%	0.118	31%	0.308	C	S	.	.			trans	-68.7	132.8	179.2	-178.4	-95.4	0	0	0	110.9	H9 I13 N17 A18 E19 F23 I66 L85	H9-F21 HydrophobicContact CB-CE2 4.33Å; I13-F21 HydrophobicContact CD1-CD2 3.55Å; I13-F21 HydrophobicContact CD1-CE2 3.6Å; I13-F21 HydrophobicContact CD1-CG 4.08Å; I13-F21 HydrophobicContact CD1-CZ 4.17Å; I13-F21 HydrophobicContact CG1-CD2 3.85Å; I13-F21 HydrophobicContact CG1-CE2 4.18Å; N17-F21 PolarHBondContact O-N 3.44Å; A18-F21 WeakPolarHBondContact O-CB 3.26Å; E19-F21 VanDerWaalsContact C-N 3.28Å; E19-F21 PolarHBondContact O-N 3.02Å; F21-F23 HydrophobicContact CD1-CD2 4.33Å; F21-F23 HydrophobicContact CD1-CE2 4.08Å; F21-F23 HydrophobicContact CD1-CZ 4.19Å; F21-F23 AromaticContact CE1-CD1 3.71Å; F21-F23 HydrophobicContact CE1-CD1 3.71Å; F21-F23 AromaticContact CE1-CD2 3.97Å; F21-F23 HydrophobicContact CE1-CD2 3.97Å; F21-F23 AromaticContact CE1-CE1 3.59Å; F21-F23 HydrophobicContact CE1-CE1 3.59Å; F21-F23 AromaticContact CE1-CE2 3.85Å; F21-F23 HydrophobicContact CE1-CE2 3.85Å; F21-F23 AromaticContact CE1-CG 3.9Å; F21-F23 HydrophobicContact CE1-CG 3.9Å; F21-F23 AromaticContact CE1-CZ 3.64Å; F21-F23 HydrophobicContact CE1-CZ 3.64Å; F21-F23 HydrophobicContact CZ-CD1 4.33Å; F21-F23 HydrophobicContact CZ-CE1 4.34Å; F21-I66 HydrophobicContact CB-CG2 3.91Å; F21-I66 HydrophobicContact CD1-CD1 3.96Å; F21-I66 HydrophobicContact CD1-CG1 4.48Å; F21-I66 HydrophobicContact CD1-CG2 4.03Å; F21-I66 HydrophobicContact CE1-CD1 4.48Å; F21-I66 HydrophobicContact CG-CG2 3.98Å; F21-L85 HydrophobicContact CZ-CD2 4.26Å
22	Q	86.6	Confident	83.5	Confident	91 Å²	91	67 Å²	67	43%	0.425	33%	0.329	S	S	.	.			trans	-126.7	133.2	179.1	-67.1	177.6	-10.8	0	0	110	S20 K55 A56	S20-Q22 PolarHBondContact O-N 3.23Å; Q22-K55 HydrophobicContact CB-CB 4.19Å; Q22-K55 HydrophobicContact CB-CD 4.19Å; Q22-A56 WeakPolarHBondContact CA-O 3.44Å
23	F	85.2	Confident	82.1	Confident	5 Å²	5	60.8 Å²	60.8	2%	0.022	31%	0.306	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.2	132.7	173.3	-67	-85.7	0	0	0	109.9	F21 Y28 K55 A56 I66 L85 P87 V90	F21-F23 HydrophobicContact CD1-CD2 4.33Å; F21-F23 HydrophobicContact CD1-CE2 4.08Å; F21-F23 HydrophobicContact CD1-CZ 4.19Å; F21-F23 AromaticContact CE1-CD1 3.71Å; F21-F23 HydrophobicContact CE1-CD1 3.71Å; F21-F23 AromaticContact CE1-CD2 3.97Å; F21-F23 HydrophobicContact CE1-CD2 3.97Å; F21-F23 AromaticContact CE1-CE1 3.59Å; F21-F23 HydrophobicContact CE1-CE1 3.59Å; F21-F23 AromaticContact CE1-CE2 3.85Å; F21-F23 HydrophobicContact CE1-CE2 3.85Å; F21-F23 AromaticContact CE1-CG 3.9Å; F21-F23 HydrophobicContact CE1-CG 3.9Å; F21-F23 AromaticContact CE1-CZ 3.64Å; F21-F23 HydrophobicContact CE1-CZ 3.64Å; F21-F23 HydrophobicContact CZ-CD1 4.33Å; F21-F23 HydrophobicContact CZ-CE1 4.34Å; F23-Y28 HydrophobicContact CB-CE2 4.47Å; F23-Y28 HydrophobicContact CD1-CD2 4.3Å; F23-Y28 AromaticContact CD1-CE2 3.65Å; F23-Y28 HydrophobicContact CD1-CE2 3.65Å; F23-Y28 AromaticContact CD1-CZ 3.77Å; F23-Y28 HydrophobicContact CE1-CE2 4.45Å; F23-K55 CarbonylContact O-C 3.34Å; F23-K55 WeakPolarHBondContact O-CA 3.39Å; F23-A56 PolarHBondContact N-O 3.38Å; F23-A56 PolarHBondContact O-N 3.06Å; F23-I66 HydrophobicContact CE2-CD1 3.66Å; F23-I66 HydrophobicContact CZ-CD1 3.56Å; F23-L85 HydrophobicContact CE1-CD1 4.32Å; F23-L85 HydrophobicContact CE1-CG 4.15Å; F23-L85 HydrophobicContact CZ-CD1 4.08Å; F23-L85 HydrophobicContact CZ-CG 4.41Å; F23-P87 HydrophobicContact CB-CG 4.06Å; F23-P87 HydrophobicContact CD1-CG 3.73Å; F23-P87 HydrophobicContact CD2-CG 4.28Å; F23-P87 HydrophobicContact CE1-CG 4.22Å; F23-P87 HydrophobicContact CG-CG 3.76Å; F23-V90 HydrophobicContact CE2-CG2 4.05Å; F23-V90 HydrophobicContact CZ-CG2 3.73Å
24	H	84.8	Confident	80.7	Confident	68 Å²	68	61.8 Å²	61.8	32%	0.315	31%	0.312	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.8	113	162.4	-63.7	-18.6	0	0	0	107.8	E26 D27 Y28 K55	H24-E26 PolarHBondContact O-N 2.93Å; H24-D27 IonicContact CD2-OD2 2.75Å; H24-D27 PolarHBondContact O-N 3.47Å; H24-D27 VanDerWaalsContact O-N 3.11Å; H24-Y28 WeakPolarHBondContact O-CD2 3.47Å; H24-K55 WeakPolarHBondContact CE1-CE 3.34Å; H24-K55 WeakPolarHBondContact ND1-CG 3.5Å
25	T	79.9	Confident	79.1	Confident	0 Å²	0	68.5 Å²	68.5	0%	0	33%	0.332	C	S	.	.	H	α-helix	trans	-62.7	-29.2	-174.9	49.2	0	0	0	0	112.9	D27 Y28 F29 L34 I40 L48 P50 G54	T25-D27 VanDerWaalsContact C-N 3.25Å; T25-D27 PolarHBondContact O-N 2.9Å; T25-Y28 PolarHBondContact O-N 3.43Å; T25-F29 WeakPolarHBondContact O-CD2 3.36Å; T25-F29 PolarHBondContact O-N 2.9Å; T25-L34 WeakPolarHBondContact OG1-CD2 3.43Å; T25-I40 HydrophobicContact CG2-CD1 4.45Å; T25-L48 HydrophobicContact CG2-CD2 4.2Å; T25-P50 HydrophobicContact CG2-CB 3.88Å; T25-P50 HydrophobicContact CG2-CG 4.37Å; T25-G54 PolarHBondContact N-O 3.35Å; T25-G54 PolarHBondContact OG1-O 3.12Å
26	E	81.4	Confident	77.8	Confident	95 Å²	95	72.5 Å²	72.5	44%	0.444	36%	0.356	S	S	.	.	H	α-helix	trans	-56.8	-36.5	174.1	-68.3	-171.6	-166.1	0	0	113.2	H24 Y28 G30 K31 L34	H24-E26 PolarHBondContact O-N 2.93Å; E26-Y28 VanDerWaalsContact C-N 3.26Å; E26-Y28 PolarHBondContact O-N 3.44Å; E26-G30 WeakPolarHBondContact O-CA 3.41Å; E26-G30 PolarHBondContact O-N 3.02Å; E26-G30 VanDerWaalsContact O-N 3.16Å; E26-K31 HydrophobicContact CG-CG 4.38Å; E26-K31 VanDerWaalsContact OE2-CE 3.31Å; E26-K31 WeakPolarHBondContact OE2-CE 3.37Å; E26-L34 HydrophobicContact CB-CD1 4.28Å; E26-L34 HydrophobicContact CG-CD1 3.18Å
27	D	82.6	Confident	76.6	Confident	105 Å²	105	70.9 Å²	70.9	56%	0.561	37%	0.37	S	S	*	.	H	α-helix	trans	-71.1	-23	-175.2	-67.3	-16	0	0	0	112.6	H24 T25	H24-D27 IonicContact CD2-OD2 2.75Å; H24-D27 PolarHBondContact O-N 3.47Å; H24-D27 VanDerWaalsContact O-N 3.11Å; T25-D27 VanDerWaalsContact C-N 3.25Å; T25-D27 PolarHBondContact O-N 2.9Å
28	Y	81.3	Confident	75.7	Confident	71 Å²	71	76.4 Å²	76.4	28%	0.278	39%	0.392	S	S	.	.	H	α-helix	trans	-112	-32.7	-173.1	-63.5	-90.3	0	0	0	113.4	F23 H24 T25 E26 L85 P87	F23-Y28 HydrophobicContact CB-CE2 4.47Å; F23-Y28 HydrophobicContact CD1-CD2 4.3Å; F23-Y28 AromaticContact CD1-CE2 3.65Å; F23-Y28 HydrophobicContact CD1-CE2 3.65Å; F23-Y28 AromaticContact CD1-CZ 3.77Å; F23-Y28 HydrophobicContact CE1-CE2 4.45Å; H24-Y28 WeakPolarHBondContact O-CD2 3.47Å; T25-Y28 PolarHBondContact O-N 3.43Å; E26-Y28 VanDerWaalsContact C-N 3.26Å; E26-Y28 PolarHBondContact O-N 3.44Å; Y28-L85 WeakPolarHBondContact CE1-O 3.24Å; Y28-L85 PolarHBondContact OH-O 3.33Å; Y28-P87 HydrophobicContact CD2-CG 4.33Å; Y28-P87 HydrophobicContact CG-CG 4.21Å
29	F	80.2	Confident	75.2	Confident	50 Å²	50	77.1 Å²	77.1	22%	0.219	40%	0.399	C	S	.	.	H	α-helix	trans	-116.8	-10.6	-173.2	-54.7	-73.3	0	0	0	113.3	T25 S33 I40 L42 L48 P87	T25-F29 WeakPolarHBondContact O-CD2 3.36Å; T25-F29 PolarHBondContact O-N 2.9Å; F29-S33 VanDerWaalsContact CB-OG 3.29Å; F29-S33 WeakPolarHBondContact CB-OG 3.46Å; F29-S33 PolarHBondContact O-OG 3.32Å; F29-I40 HydrophobicContact CB-CD1 3.71Å; F29-I40 HydrophobicContact CD1-CD1 4.39Å; F29-I40 HydrophobicContact CD1-CG2 3.76Å; F29-I40 HydrophobicContact CD2-CD1 3.37Å; F29-I40 HydrophobicContact CD2-CG2 4.33Å; F29-I40 HydrophobicContact CE1-CG2 3.82Å; F29-I40 HydrophobicContact CE2-CD1 4.04Å; F29-I40 HydrophobicContact CE2-CG2 4.37Å; F29-I40 HydrophobicContact CG-CD1 3.57Å; F29-I40 HydrophobicContact CG-CG2 4.03Å; F29-I40 HydrophobicContact CZ-CG2 4.14Å; F29-L42 HydrophobicContact CE1-CD2 4Å; F29-L42 HydrophobicContact CZ-CD2 3.59Å; F29-L48 HydrophobicContact CE2-CD2 3.86Å; F29-L48 HydrophobicContact CZ-CD2 4.37Å; F29-P87 HydrophobicContact CE2-CB 4.14Å; F29-P87 HydrophobicContact CE2-CG 3.84Å; F29-P87 HydrophobicContact CZ-CB 4.03Å; F29-P87 HydrophobicContact CZ-CG 4.07Å
30	G	74.9	Confident	75	Confident	30 Å²	30	74.9 Å²	74.9	31%	0.309	39%	0.389	S	S	.	.			trans	79.9	169.5	-175.9	0	0	0	0	0	113.4	E26 E32 S33	E26-G30 WeakPolarHBondContact O-CA 3.41Å; E26-G30 PolarHBondContact O-N 3.02Å; E26-G30 VanDerWaalsContact O-N 3.16Å; G30-E32 VanDerWaalsContact C-N 3.34Å; G30-E32 PolarHBondContact O-N 2.82Å; G30-S33 PolarHBondContact O-OG 2.8Å
31	K	69.4	Low	74.9	Confident	129 Å²	129	76.2 Å²	76.2	56%	0.561	39%	0.385	S	S	*	.	S	Bend	trans	-72.8	-25.1	-173.8	-66.2	-173.6	176.4	-173.7	0	113.8	E26 S33 L34	E26-K31 HydrophobicContact CG-CG 4.38Å; E26-K31 VanDerWaalsContact OE2-CE 3.31Å; E26-K31 WeakPolarHBondContact OE2-CE 3.37Å; K31-S33 PolarHBondContact O-N 2.81Å; K31-L34 PolarHBondContact O-N 2.97Å
32	E	64.6	Low	74.7	Confident	163 Å²	163	75.3 Å²	75.3	76%	0.762	38%	0.382	S	S	*	.	H	α-helix	trans	-67.7	-36.5	-176	-63.7	-175	170.2	0	0	112.5	G30 L34 W35	G30-E32 VanDerWaalsContact C-N 3.34Å; G30-E32 PolarHBondContact O-N 2.82Å; E32-L34 VanDerWaalsContact C-N 3.29Å; E32-L34 PolarHBondContact O-N 2.81Å; E32-W35 PolarHBondContact O-N 2.78Å
33	S	59.4	Low	74	Confident	31 Å²	31	74.5 Å²	74.5	22%	0.217	39%	0.391	C	S	.	.	H	α-helix	trans	-66.9	-26.4	178.2	26.5	0	0	0	0	114	F29 G30 K31 T36	F29-S33 VanDerWaalsContact CB-OG 3.29Å; F29-S33 WeakPolarHBondContact CB-OG 3.46Å; F29-S33 PolarHBondContact O-OG 3.32Å; G30-S33 PolarHBondContact O-OG 2.8Å; K31-S33 PolarHBondContact O-N 2.81Å; S33-T36 PolarHBondContact O-OG1 2.91Å; S33-T36 VanDerWaalsContact O-OG1 3.05Å
34	L	59.9	Low	73.5	Confident	42 Å²	42	78 Å²	78	22%	0.22	41%	0.41	C	S	.	.	H	α-helix	trans	-75.6	-32.2	-180	-83.8	148.7	0	0	0	113.1	T25 E26 K31 E32 T36 P50	T25-L34 WeakPolarHBondContact OG1-CD2 3.43Å; E26-L34 HydrophobicContact CB-CD1 4.28Å; E26-L34 HydrophobicContact CG-CD1 3.18Å; K31-L34 PolarHBondContact O-N 2.97Å; E32-L34 VanDerWaalsContact C-N 3.29Å; E32-L34 PolarHBondContact O-N 2.81Å; L34-T36 VanDerWaalsContact C-N 3.27Å; L34-T36 PolarHBondContact O-N 3.09Å; L34-P50 HydrophobicContact CD2-CB 4.48Å; L34-P50 HydrophobicContact CD2-CG 3.92Å
35	W	58.1	Low	73.3	Confident	212 Å²	212	76.4 Å²	76.4	80%	0.803	41%	0.411	S	S	*	.	H	α-helix	trans	-76.5	-13.7	-174.6	-63.3	-13.5	0	0	0	114	E32 G37	E32-W35 PolarHBondContact O-N 2.78Å; W35-G37 VanDerWaalsContact C-N 3.29Å; W35-G37 PolarHBondContact O-N 2.62Å
36	T	61	Low	73.4	Confident	89 Å²	89	77.8 Å²	77.8	55%	0.546	43%	0.426	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.7	-13.3	-179.4	61.9	0	0	0	0	113.6	S33 L34 K38	S33-T36 PolarHBondContact O-OG1 2.91Å; S33-T36 VanDerWaalsContact O-OG1 3.05Å; L34-T36 VanDerWaalsContact C-N 3.27Å; L34-T36 PolarHBondContact O-N 3.09Å; T36-K38 PolarHBondContact O-N 3.37Å
37	G	64.3	Low	73.4	Confident	74 Å²	74	80 Å²	80	76%	0.763	43%	0.43	S	S	*	.	S	Bend	trans	63.3	-0.6	177	0	0	0	0	0	115.6	W35	W35-G37 VanDerWaalsContact C-N 3.29Å; W35-G37 PolarHBondContact O-N 2.62Å
38	K	70.4	Confident	73.3	Confident	168 Å²	168	76 Å²	76	73%	0.73	41%	0.409	S	S	*	.	S	Bend	trans	-92.3	-5.3	-175.6	-77.3	-176.6	174.8	-179.5	0	113.9	T36 W47	T36-K38 PolarHBondContact O-N 3.37Å; K38-W47 HydrophobicContact CB-CZ3 4.28Å; K38-W47 WeakPolarHBondContact O-CZ3 3.5Å
39	G	76.1	Confident	73.4	Confident	15 Å²	15	78.8 Å²	78.8	16%	0.155	43%	0.427	C	S	.	.			trans	78	176.5	-170.3	0	0	0	0	0	111.9	W47 L48	G39-W47 WeakPolarHBondContact O-CZ3 3.15Å; G39-L48 WeakPolarHBondContact CA-O 3.45Å
40	I	82.4	Confident	73.5	Confident	17 Å²	17	77.9 Å²	77.9	9%	0.087	43%	0.426	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	119.4	-173.4	-56.3	175.5	0	0	0	108.4	T25 F29 L42 L48	T25-I40 HydrophobicContact CG2-CD1 4.45Å; F29-I40 HydrophobicContact CB-CD1 3.71Å; F29-I40 HydrophobicContact CD1-CD1 4.39Å; F29-I40 HydrophobicContact CD1-CG2 3.76Å; F29-I40 HydrophobicContact CD2-CD1 3.37Å; F29-I40 HydrophobicContact CD2-CG2 4.33Å; F29-I40 HydrophobicContact CE1-CG2 3.82Å; F29-I40 HydrophobicContact CE2-CD1 4.04Å; F29-I40 HydrophobicContact CE2-CG2 4.37Å; F29-I40 HydrophobicContact CG-CD1 3.57Å; F29-I40 HydrophobicContact CG-CG2 4.03Å; F29-I40 HydrophobicContact CZ-CG2 4.14Å; I40-L42 HydrophobicContact CG2-CD2 4.42Å; I40-L42 PolarHBondContact O-N 2.8Å; I40-L48 HydrophobicContact CB-CB 4.41Å; I40-L48 PolarHBondContact N-O 3.43Å; I40-L48 PolarHBondContact O-N 3.09Å
41	Q	84.3	Confident	73.8	Confident	118 Å²	118	79.9 Å²	79.9	55%	0.551	44%	0.435	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-75.4	125.9	175.6	-166.8	174.7	29	0	0	110	W47	Q41-W47 HydrophobicContact CB-CD2 4.31Å; Q41-W47 HydrophobicContact CB-CE3 4.41Å; Q41-W47 HydrophobicContact CB-CH2 4.34Å; Q41-W47 HydrophobicContact CB-CZ2 4.23Å; Q41-W47 HydrophobicContact CB-CZ3 4.43Å; Q41-W47 HydrophobicContact CG-CZ2 4.47Å
42	L	82.8	Confident	74.2	Confident	9 Å²	9	82.5 Å²	82.5	5%	0.047	46%	0.455	C	S	.	.			trans	-97.4	166.5	177.4	-59.9	-179.5	0	0	0	110.7	F29 I40 D44 G45 G46 L48 E88 L91	F29-L42 HydrophobicContact CE1-CD2 4Å; F29-L42 HydrophobicContact CZ-CD2 3.59Å; I40-L42 HydrophobicContact CG2-CD2 4.42Å; I40-L42 PolarHBondContact O-N 2.8Å; L42-D44 VanDerWaalsContact C-N 3.3Å; L42-D44 PolarHBondContact O-N 3.38Å; L42-D44 VanDerWaalsContact O-N 3.08Å; L42-G45 WeakPolarHBondContact O-CA 3.34Å; L42-G45 PolarHBondContact O-N 3.06Å; L42-G46 PolarHBondContact N-O 3.45Å; L42-L48 HydrophobicContact CD1-CB 3.78Å; L42-L48 HydrophobicContact CD1-CD1 4.45Å; L42-L48 HydrophobicContact CD1-CD2 4.41Å; L42-L48 HydrophobicContact CD1-CG 4.45Å; L42-L48 HydrophobicContact CD2-CB 4.39Å; L42-L48 HydrophobicContact CG-CB 4Å; L42-E88 HydrophobicContact CD2-CG 3.77Å; L42-L91 HydrophobicContact CB-CD2 3.57Å; L42-L91 HydrophobicContact CD1-CB 3.95Å; L42-L91 HydrophobicContact CD1-CD2 3.5Å; L42-L91 HydrophobicContact CD1-CG 4.26Å; L42-L91 HydrophobicContact CG-CD2 4.14Å
43	A	71.4	Confident	74.9	Confident	74 Å²	74	78.9 Å²	78.9	61%	0.612	44%	0.441	S	S	*	.	T	Hydrogen-bonded Turn	trans	-49.9	-38.1	-168	0	0	0	0	0	116.1	G45 L92	A43-G45 PolarHBondContact O-N 2.85Å; A43-L92 HydrophobicContact CB-CD2 4.39Å
44	D	74.8	Confident	75.7	Confident	79 Å²	79	78 Å²	78	42%	0.422	44%	0.437	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.5	12.2	179.5	-69.6	-23.8	0	0	0	113.6	L42 G46 L92 K95	L42-D44 VanDerWaalsContact C-N 3.3Å; L42-D44 PolarHBondContact O-N 3.38Å; L42-D44 VanDerWaalsContact O-N 3.08Å; D44-G46 VanDerWaalsContact C-N 3.26Å; D44-G46 PolarHBondContact O-N 3.45Å; D44-L92 WeakPolarHBondContact OD1-CD2 3.44Å; D44-L92 VanDerWaalsContact OD2-CD2 3.29Å; D44-L92 WeakPolarHBondContact OD2-CD2 3.02Å; D44-K95 HydrophobicContact CB-CD 4.15Å; D44-K95 WeakPolarHBondContact OD2-CD 3.42Å
45	G	80	Confident	76.7	Confident	34 Å²	34	78.7 Å²	78.7	35%	0.351	44%	0.438	S	S	.	.	S	Bend	trans	82.1	-2.6	-178	0	0	0	0	0	114.6	L42 A43	L42-G45 WeakPolarHBondContact O-CA 3.34Å; L42-G45 PolarHBondContact O-N 3.06Å; A43-G45 PolarHBondContact O-N 2.85Å
46	G	81.2	Confident	77.6	Confident	29 Å²	29	69.1 Å²	69.1	30%	0.299	40%	0.404	S	S	.	.			trans	-69	148.4	173.6	0	0	0	0	0	112.2	L42 D44	L42-G46 PolarHBondContact N-O 3.45Å; D44-G46 VanDerWaalsContact C-N 3.26Å; D44-G46 PolarHBondContact O-N 3.45Å
47	W	82.1	Confident	78.1	Confident	140 Å²	140	66.9 Å²	66.9	53%	0.53	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.2	123.7	178.7	-71.5	77.9	0	0	0	110.6	K38 G39 Q41	K38-W47 HydrophobicContact CB-CZ3 4.28Å; K38-W47 WeakPolarHBondContact O-CZ3 3.5Å; G39-W47 WeakPolarHBondContact O-CZ3 3.15Å; Q41-W47 HydrophobicContact CB-CD2 4.31Å; Q41-W47 HydrophobicContact CB-CE3 4.41Å; Q41-W47 HydrophobicContact CB-CH2 4.34Å; Q41-W47 HydrophobicContact CB-CZ2 4.23Å; Q41-W47 HydrophobicContact CB-CZ3 4.43Å; Q41-W47 HydrophobicContact CG-CZ2 4.47Å
48	L	81.7	Confident	78.2	Confident	23 Å²	23	69.2 Å²	69.2	12%	0.12	39%	0.388	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.8	112.4	168.7	-172.3	68.6	0	0	0	108.7	T25 F29 G39 I40 L42 P50 A56 P87	T25-L48 HydrophobicContact CG2-CD2 4.2Å; F29-L48 HydrophobicContact CE2-CD2 3.86Å; F29-L48 HydrophobicContact CZ-CD2 4.37Å; G39-L48 WeakPolarHBondContact CA-O 3.45Å; I40-L48 HydrophobicContact CB-CB 4.41Å; I40-L48 PolarHBondContact N-O 3.43Å; I40-L48 PolarHBondContact O-N 3.09Å; L42-L48 HydrophobicContact CD1-CB 3.78Å; L42-L48 HydrophobicContact CD1-CD1 4.45Å; L42-L48 HydrophobicContact CD1-CD2 4.41Å; L42-L48 HydrophobicContact CD1-CG 4.45Å; L42-L48 HydrophobicContact CD2-CB 4.39Å; L42-L48 HydrophobicContact CG-CB 4Å; L48-P50 WeakPolarHBondContact O-CD 3.07Å; L48-A56 HydrophobicContact CD1-CB 3.68Å; L48-A56 HydrophobicContact CD2-CB 4.34Å; L48-A56 HydrophobicContact CG-CB 4.13Å; L48-P87 HydrophobicContact CD2-CB 3.92Å; L48-P87 HydrophobicContact CD2-CG 4.47Å
49	I	83.3	Confident	77.8	Confident	129 Å²	129	67.4 Å²	67.4	66%	0.662	38%	0.382	S	S	*	.			trans	-103.8	109.2	176.4	-57.6	173.1	0	0	0	107.1
50	P	80.6	Confident	76.8	Confident	30 Å²	30	71.3 Å²	71.3	20%	0.195	40%	0.396	C	S	.	.			trans	-68.2	149.8	174.5	25.4	-29.2	0	0	0	111.1	T25 L34 L48 K55	T25-P50 HydrophobicContact CG2-CB 3.88Å; T25-P50 HydrophobicContact CG2-CG 4.37Å; L34-P50 HydrophobicContact CD2-CB 4.48Å; L34-P50 HydrophobicContact CD2-CG 3.92Å; L48-P50 WeakPolarHBondContact O-CD 3.07Å; P50-K55 CarbonylContact C-O 3.59Å; P50-K55 WeakPolarHBondContact CA-O 3.32Å
51	S	81.8	Confident	75.6	Confident	72 Å²	72	73.9 Å²	73.9	50%	0.503	41%	0.407	S	S	.	.			trans	-60	165.9	164.2	-70.6	0	0	0	0	111.1	D53 G54 K55	S51-D53 WeakPolarHBondContact CB-OD1 3.44Å; S51-D53 PolarHBondContact O-N 2.96Å; S51-G54 WeakPolarHBondContact O-CA 3.35Å; S51-G54 PolarHBondContact O-N 3.27Å; S51-K55 WeakPolarHBondContact CB-O 3.32Å; S51-K55 PolarHBondContact N-O 2.91Å
52	N	78.6	Confident	75.3	Confident	184 Å²	184	69.8 Å²	69.8	98%	0.984	39%	0.386	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.2	-22.1	179.8	-65.4	-17.9	0	0	0	113.6	G54	N52-G54 VanDerWaalsContact C-N 3.32Å
53	D	79.6	Confident	75.7	Confident	88 Å²	88	70.7 Å²	70.7	47%	0.471	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.1	10.2	175.4	68.9	-22.5	0	0	0	113.6	S51 K55	S51-D53 WeakPolarHBondContact CB-OD1 3.44Å; S51-D53 PolarHBondContact O-N 2.96Å; D53-K55 VanDerWaalsContact C-N 3.32Å; D53-K55 PolarHBondContact O-N 3.16Å; D53-K55 WeakPolarHBondContact OD1-CB 3.4Å; D53-K55 PolarHBondContact OD1-N 3.38Å; D53-K55 WeakPolarHBondContact OD2-CD 3.49Å; D53-K55 WeakPolarHBondContact OD2-CE 3.25Å; D53-K55 WeakPolarHBondContact OD2-CG 3.28Å; D53-K55 IonicContact OD2-NZ 2.63Å; D53-K55 PolarHBondContact OD2-NZ 3.16Å
54	G	75.3	Confident	76.7	Confident	12 Å²	12	68.2 Å²	68.2	12%	0.124	36%	0.364	C	S	.	.	S	Bend	trans	78.1	12.6	178.4	0	0	0	0	0	114.4	T25 S51 N52	T25-G54 PolarHBondContact N-O 3.35Å; T25-G54 PolarHBondContact OG1-O 3.12Å; S51-G54 WeakPolarHBondContact O-CA 3.35Å; S51-G54 PolarHBondContact O-N 3.27Å; N52-G54 VanDerWaalsContact C-N 3.32Å
55	K	80.9	Confident	77.5	Confident	57 Å²	57	64.5 Å²	64.5	25%	0.248	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	154.2	-173.6	-59	-169.4	-161.3	134.1	0	113.9	Q22 F23 H24 P50 S51 D53	Q22-K55 HydrophobicContact CB-CB 4.19Å; Q22-K55 HydrophobicContact CB-CD 4.19Å; F23-K55 CarbonylContact O-C 3.34Å; F23-K55 WeakPolarHBondContact O-CA 3.39Å; H24-K55 WeakPolarHBondContact CE1-CE 3.34Å; H24-K55 WeakPolarHBondContact ND1-CG 3.5Å; P50-K55 CarbonylContact C-O 3.59Å; P50-K55 WeakPolarHBondContact CA-O 3.32Å; S51-K55 WeakPolarHBondContact CB-O 3.32Å; S51-K55 PolarHBondContact N-O 2.91Å; D53-K55 VanDerWaalsContact C-N 3.32Å; D53-K55 PolarHBondContact O-N 3.16Å; D53-K55 WeakPolarHBondContact OD1-CB 3.4Å; D53-K55 PolarHBondContact OD1-N 3.38Å; D53-K55 WeakPolarHBondContact OD2-CD 3.49Å; D53-K55 WeakPolarHBondContact OD2-CE 3.25Å; D53-K55 WeakPolarHBondContact OD2-CG 3.28Å; D53-K55 IonicContact OD2-NZ 2.63Å; D53-K55 PolarHBondContact OD2-NZ 3.16Å
56	A	78.1	Confident	78.1	Confident	10 Å²	10	62.9 Å²	62.9	8%	0.083	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-141.6	139.2	172.8	0	0	0	0	0	112.9	Q22 F23 L48	Q22-A56 WeakPolarHBondContact CA-O 3.44Å; F23-A56 PolarHBondContact N-O 3.38Å; F23-A56 PolarHBondContact O-N 3.06Å; L48-A56 HydrophobicContact CD1-CB 3.68Å; L48-A56 HydrophobicContact CD2-CB 4.34Å; L48-A56 HydrophobicContact CG-CB 4.13Å
57	G	70.8	Confident	78.7	Confident	42 Å²	42	63.3 Å²	63.3	43%	0.433	32%	0.32	S	S	.	.			trans	-177.9	166.2	177.5	0	0	0	0	0	111.9
58	K	66.1	Low	79.3	Confident	123 Å²	123	61.3 Å²	61.3	54%	0.535	32%	0.315	S	S	.	.			trans	-148.1	152.8	172.9	-179.7	179	179.7	179.9	0	109	Y62	K58-Y62 HydrophobicContact CB-CD2 3.69Å; K58-Y62 HydrophobicContact CB-CE2 3.54Å; K58-Y62 HydrophobicContact CB-CG 4.43Å; K58-Y62 HydrophobicContact CG-CD2 4.48Å; K58-Y62 HydrophobicContact CG-CE2 4.45Å; K58-Y62 WeakPolarHBondContact O-CB 3.45Å; K58-Y62 WeakPolarHBondContact O-CD2 3.29Å
59	E	63	Low	79.8	Confident	131 Å²	131	60.5 Å²	60.5	61%	0.612	31%	0.311	S	S	*	.	S	Bend	trans	-78.2	-66	-157.9	-56.3	-172.8	160.9	0	0	114	E19	E19-E59 HydrophobicContact CG-CB 4.09Å; E19-E59 WeakPolarHBondContact CG-O 3.33Å
60	E	53	Low	80.3	Confident	96 Å²	96	54.4 Å²	54.4	45%	0.449	28%	0.28	S	S	.	.	H	α-helix	trans	-85	-45	-163.3	-53.5	100.4	165	0	0	115.8	Y62 R63	E60-Y62 PolarHBondContact O-N 3.2Å; E60-R63 PolarHBondContact O-N 3.33Å
61	F	58.9	Low	80.9	Confident	71 Å²	71	55.1 Å²	55.1	31%	0.311	29%	0.289	S	S	.	.	H	α-helix	trans	-72.7	-19.7	-175.1	-68.3	-79.9	0	0	0	113.4	L94 R97 L206	F61-L94 HydrophobicContact CB-CD2 3.6Å; F61-R97 PolarHBondContact O-NH1 3.3Å; F61-R97 VanDerWaalsContact O-NH1 3.11Å; F61-L206 HydrophobicContact CZ-CD1 4.05Å
62	Y	78.3	Confident	81.4	Confident	32 Å²	32	54.5 Å²	54.5	13%	0.125	28%	0.278	C	S	.	.	H	α-helix	trans	-78.7	-34.8	-178.5	-83	-119.9	0	0	0	111.8	K58 E60 W64 I65 I66 V90 L94	K58-Y62 HydrophobicContact CB-CD2 3.69Å; K58-Y62 HydrophobicContact CB-CE2 3.54Å; K58-Y62 HydrophobicContact CB-CG 4.43Å; K58-Y62 HydrophobicContact CG-CD2 4.48Å; K58-Y62 HydrophobicContact CG-CE2 4.45Å; K58-Y62 WeakPolarHBondContact O-CB 3.45Å; K58-Y62 WeakPolarHBondContact O-CD2 3.29Å; E60-Y62 PolarHBondContact O-N 3.2Å; Y62-W64 PolarHBondContact O-N 2.94Å; Y62-I65 PolarHBondContact O-N 2.66Å; Y62-I66 HydrophobicContact CD1-CD1 4.49Å; Y62-I66 HydrophobicContact CD1-CG1 4.32Å; Y62-I66 WeakPolarHBondContact O-CB 3.37Å; Y62-I66 VanDerWaalsContact O-CG1 3.27Å; Y62-I66 WeakPolarHBondContact O-CG1 3.5Å; Y62-I66 PolarHBondContact O-N 3.41Å; Y62-V90 HydrophobicContact CD1-CG1 3.7Å; Y62-V90 HydrophobicContact CE1-CG1 3.47Å; Y62-V90 VanDerWaalsContact CE1-CG1 3.47Å; Y62-V90 HydrophobicContact CG-CG1 4.4Å; Y62-L94 HydrophobicContact CD2-CD1 3.89Å; Y62-L94 HydrophobicContact CD2-CD2 4.13Å; Y62-L94 HydrophobicContact CE1-CD1 4.28Å; Y62-L94 HydrophobicContact CE2-CD1 3.17Å; Y62-L94 HydrophobicContact CE2-CD2 4.16Å; Y62-L94 HydrophobicContact CE2-CG 4.28Å; Y62-L94 VanDerWaalsContact CZ-CD1 3.41Å; Y62-L94 WeakPolarHBondContact OH-CD1 3.49Å
63	R	90	Very high	82.1	Confident	28 Å²	28	46 Å²	46	11%	0.106	23%	0.232	C	C	.	.	H	α-helix	trans	-46.8	-55.7	-171	-173.9	179.3	172.1	-163.1	-11.6	112.8	S15 A18 E19 E60 W67 E158	S15-R63 VanDerWaalsContact O-CZ 3.28Å; S15-R63 PolarHBondContact O-NE 2.63Å; S15-R63 PolarHBondContact O-NH2 3.26Å; A18-R63 HydrophobicContact CB-CG 4.25Å; A18-R63 VanDerWaalsContact CB-O 3.28Å; A18-R63 WeakPolarHBondContact CB-O 3.38Å; E19-R63 HydrophobicContact CB-CB 3.97Å; E19-R63 HydrophobicContact CB-CG 3.94Å; E60-R63 PolarHBondContact O-N 3.33Å; R63-W67 VanDerWaalsContact O-CB 3.31Å; R63-W67 WeakPolarHBondContact O-CB 3.45Å; R63-W67 PolarHBondContact O-N 3.43Å; R63-E158 IonicContact CZ-OE2 3.15Å; R63-E158 IonicContact NH1-OE1 3.05Å; R63-E158 PolarHBondContact NH1-OE1 2.69Å; R63-E158 IonicContact NH1-OE2 3.97Å; R63-E158 PolarHBondContact NH1-OE2 3.05Å; R63-E158 IonicContact NH2-OE2 3.32Å; R63-E158 PolarHBondContact NH2-OE2 3.31Å
64	W	91.6	Very high	82.6	Confident	23 Å²	23	43.7 Å²	43.7	9%	0.087	22%	0.223	C	C	.	.	H	α-helix	trans	-70.9	-35.3	-177.3	-50.7	124.9	0	0	0	113.7	Y62 W67 K68 T160 G162 W163 A165	Y62-W64 PolarHBondContact O-N 2.94Å; W64-W67 AromaticContact CE3-CE3 3.87Å; W64-W67 HydrophobicContact CE3-CE3 3.87Å; W64-W67 HydrophobicContact CE3-CZ3 4.26Å; W64-W67 AromaticContact CZ3-CE3 3.9Å; W64-W67 HydrophobicContact CZ3-CE3 3.9Å; W64-W67 AromaticContact CZ3-CZ3 3.98Å; W64-W67 HydrophobicContact CZ3-CZ3 3.98Å; W64-K68 WeakPolarHBondContact O-CB 3.38Å; W64-K68 PolarHBondContact O-N 3.05Å; W64-T160 HydrophobicContact CE3-CG2 4.1Å; W64-T160 HydrophobicContact CH2-CG2 4.2Å; W64-T160 HydrophobicContact CZ3-CG2 3.83Å; W64-G162 WeakPolarHBondContact CB-O 3.15Å; W64-W163 PolarHBondContact NE1-O 3.48Å; W64-W163 VanDerWaalsContact NE1-O 3.11Å; W64-A165 HydrophobicContact CH2-CB 3.95Å; W64-A165 HydrophobicContact CZ2-CB 3.54Å
65	I	92.9	Very high	83.4	Confident	0 Å²	0	46.1 Å²	46.1	0%	0	24%	0.242	C	C	.	.	H	α-helix	trans	-68	-48.5	179.6	-67.4	170	0	0	0	109.2	Y62 K68 L69 V90 Q93 L94	Y62-I65 PolarHBondContact O-N 2.66Å; I65-K68 PolarHBondContact O-N 2.91Å; I65-L69 HydrophobicContact CG2-CD1 3.72Å; I65-L69 HydrophobicContact CG2-CG 4.4Å; I65-L69 WeakPolarHBondContact O-CB 3.22Å; I65-L69 VanDerWaalsContact O-CG 3.23Å; I65-L69 WeakPolarHBondContact O-CG 3.37Å; I65-L69 PolarHBondContact O-N 2.76Å; I65-V90 HydrophobicContact CG2-CB 4.44Å; I65-V90 HydrophobicContact CG2-CG1 4.27Å; I65-V90 HydrophobicContact CG2-CG2 4.17Å; I65-Q93 HydrophobicContact CD1-CB 3.82Å; I65-Q93 HydrophobicContact CG1-CB 4.25Å; I65-Q93 HydrophobicContact CG2-CB 4.01Å; I65-L94 HydrophobicContact CD1-CD2 3.71Å; I65-L94 HydrophobicContact CD1-CG 3.91Å
66	I	92.3	Very high	84	Confident	0 Å²	0	49.3 Å²	49.3	0%	0	26%	0.256	C	S	.	.	H	α-helix	trans	-61.8	-50.8	178.1	-65.3	-65	0	0	0	110.5	I13 A18 F21 F23 Y62 K68 L69 A70 L85 V90	I13-I66 HydrophobicContact CD1-CG2 3.94Å; I13-I66 HydrophobicContact CG2-CG2 3.98Å; A18-I66 HydrophobicContact CB-CB 4.14Å; A18-I66 HydrophobicContact CB-CG2 3.91Å; F21-I66 HydrophobicContact CB-CG2 3.91Å; F21-I66 HydrophobicContact CD1-CD1 3.96Å; F21-I66 HydrophobicContact CD1-CG1 4.48Å; F21-I66 HydrophobicContact CD1-CG2 4.03Å; F21-I66 HydrophobicContact CE1-CD1 4.48Å; F21-I66 HydrophobicContact CG-CG2 3.98Å; F23-I66 HydrophobicContact CE2-CD1 3.66Å; F23-I66 HydrophobicContact CZ-CD1 3.56Å; Y62-I66 HydrophobicContact CD1-CD1 4.49Å; Y62-I66 HydrophobicContact CD1-CG1 4.32Å; Y62-I66 WeakPolarHBondContact O-CB 3.37Å; Y62-I66 VanDerWaalsContact O-CG1 3.27Å; Y62-I66 WeakPolarHBondContact O-CG1 3.5Å; Y62-I66 PolarHBondContact O-N 3.41Å; I66-K68 VanDerWaalsContact C-N 3.31Å; I66-K68 PolarHBondContact O-N 3.49Å; I66-L69 PolarHBondContact O-N 3.47Å; I66-A70 VanDerWaalsContact O-CB 3.26Å; I66-A70 WeakPolarHBondContact O-CB 3.38Å; I66-A70 PolarHBondContact O-N 3.25Å; I66-L85 HydrophobicContact CD1-CD1 3.77Å; I66-L85 HydrophobicContact CG2-CD1 4.18Å; I66-V90 HydrophobicContact CD1-CG1 4.37Å; I66-V90 HydrophobicContact CD1-CG2 3.55Å
67	W	93.9	Very high	84.6	Confident	39 Å²	39	50 Å²	50	15%	0.148	26%	0.259	C	S	.	.	H	α-helix	trans	-59.9	-43.5	-179.7	-177	31.5	0	0	0	111.6	A18 R63 W64 A71 T160 V185	A18-W67 HydrophobicContact CB-CB 3.83Å; R63-W67 VanDerWaalsContact O-CB 3.31Å; R63-W67 WeakPolarHBondContact O-CB 3.45Å; R63-W67 PolarHBondContact O-N 3.43Å; W64-W67 AromaticContact CE3-CE3 3.87Å; W64-W67 HydrophobicContact CE3-CE3 3.87Å; W64-W67 HydrophobicContact CE3-CZ3 4.26Å; W64-W67 AromaticContact CZ3-CE3 3.9Å; W64-W67 HydrophobicContact CZ3-CE3 3.9Å; W64-W67 AromaticContact CZ3-CZ3 3.98Å; W64-W67 HydrophobicContact CZ3-CZ3 3.98Å; W67-A71 WeakPolarHBondContact O-CB 3.41Å; W67-A71 PolarHBondContact O-N 2.99Å; W67-T160 HydrophobicContact CZ3-CG2 4.32Å; W67-V185 HydrophobicContact CH2-CG1 4.25Å; W67-V185 HydrophobicContact CZ2-CG1 4.09Å
68	K	94.6	Very high	85.6	Confident	97 Å²	97	55.5 Å²	55.5	42%	0.422	27%	0.271	S	S	.	.	H	α-helix	trans	-60.2	-52.2	175.6	178.5	-174.3	67	179.3	0	111.9	W64 I65 I66 A70 A71 M72 Q93	W64-K68 WeakPolarHBondContact O-CB 3.38Å; W64-K68 PolarHBondContact O-N 3.05Å; I65-K68 PolarHBondContact O-N 2.91Å; I66-K68 VanDerWaalsContact C-N 3.31Å; I66-K68 PolarHBondContact O-N 3.49Å; K68-A70 VanDerWaalsContact C-N 3.34Å; K68-A70 PolarHBondContact O-N 3.47Å; K68-A71 PolarHBondContact O-N 3.35Å; K68-M72 HydrophobicContact CG-SD 4.13Å; K68-M72 VanDerWaalsContact O-CG 3.29Å; K68-M72 WeakPolarHBondContact O-CG 3.26Å; K68-M72 PolarHBondContact O-N 2.79Å; K68-Q93 VanDerWaalsContact CE-OE1 3.23Å
69	L	93.2	Very high	86.8	Confident	6 Å²	6	55.4 Å²	55.4	3%	0.031	27%	0.273	C	S	.	.	H	α-helix	trans	-63	-43.3	-177.1	-71.4	171.4	0	0	0	111.2	I65 I66 A71 M72 E73 C84 L85 R89 V90	I65-L69 HydrophobicContact CG2-CD1 3.72Å; I65-L69 HydrophobicContact CG2-CG 4.4Å; I65-L69 WeakPolarHBondContact O-CB 3.22Å; I65-L69 VanDerWaalsContact O-CG 3.23Å; I65-L69 WeakPolarHBondContact O-CG 3.37Å; I65-L69 PolarHBondContact O-N 2.76Å; I66-L69 PolarHBondContact O-N 3.47Å; L69-A71 PolarHBondContact O-N 3.21Å; L69-M72 PolarHBondContact O-N 3.48Å; L69-E73 PolarHBondContact O-N 2.81Å; L69-E73 VanDerWaalsContact O-N 3.13Å; L69-C84 HydrophobicContact CB-CB 4.36Å; L69-C84 WeakPolarHBondContact CD1-O 3.18Å; L69-C84 HydrophobicContact CD2-CB 3.75Å; L69-L85 HydrophobicContact CB-CB 4.36Å; L69-L85 HydrophobicContact CB-CD1 4.1Å; L69-R89 HydrophobicContact CD1-CB 4.45Å; L69-V90 HydrophobicContact CD1-CG2 3.82Å
70	A	92.8	Very high	88.1	Confident	2 Å²	2	52.4 Å²	52.4	2%	0.017	26%	0.258	C	S	.	.	H	α-helix	trans	-62.2	-43.9	176.5	0	0	0	0	0	112.1	C10 I13 I66 K68 M72 E73 C74 L85	C10-A70 WeakPolarHBondContact SG-CA 3.46Å; C10-A70 PolarHBondContact SG-O 3.29Å; I13-A70 HydrophobicContact CB-CB 3.84Å; I13-A70 HydrophobicContact CD1-CB 3.8Å; I13-A70 HydrophobicContact CG1-CB 4.4Å; I13-A70 HydrophobicContact CG2-CB 3.84Å; I66-A70 VanDerWaalsContact O-CB 3.26Å; I66-A70 WeakPolarHBondContact O-CB 3.38Å; I66-A70 PolarHBondContact O-N 3.25Å; K68-A70 VanDerWaalsContact C-N 3.34Å; K68-A70 PolarHBondContact O-N 3.47Å; A70-M72 VanDerWaalsContact C-N 3.34Å; A70-M72 PolarHBondContact O-N 2.96Å; A70-E73 PolarHBondContact O-N 3.21Å; A70-C74 PolarHBondContact O-N 2.86Å; A70-C74 PolarHBondContact O-SG 3.17Å; A70-L85 HydrophobicContact CB-CD2 4.4Å
71	A	92.8	Very high	89.7	Confident	45 Å²	45	48.4 Å²	48.4	37%	0.372	24%	0.241	S	C	.	.	H	α-helix	trans	-63.1	-39.2	176.2	0	0	0	0	0	112	W67 K68 L69 C74 A75	W67-A71 WeakPolarHBondContact O-CB 3.41Å; W67-A71 PolarHBondContact O-N 2.99Å; K68-A71 PolarHBondContact O-N 3.35Å; L69-A71 PolarHBondContact O-N 3.21Å; A71-C74 PolarHBondContact O-N 3.31Å; A71-A75 WeakPolarHBondContact O-CB 3.16Å; A71-A75 PolarHBondContact O-N 2.98Å
72	M	93.2	Very high	90.7	Very high	58 Å²	58	50.8 Å²	50.8	29%	0.286	26%	0.257	S	S	.	.	H	α-helix	trans	-61.3	-45.7	176.6	-74.1	176.4	69.1	0	0	112.1	K68 L69 A70 C74 F76 F80	K68-M72 HydrophobicContact CG-SD 4.13Å; K68-M72 VanDerWaalsContact O-CG 3.29Å; K68-M72 WeakPolarHBondContact O-CG 3.26Å; K68-M72 PolarHBondContact O-N 2.79Å; L69-M72 PolarHBondContact O-N 3.48Å; A70-M72 VanDerWaalsContact C-N 3.34Å; A70-M72 PolarHBondContact O-N 2.96Å; M72-C74 VanDerWaalsContact C-N 3.34Å; M72-C74 PolarHBondContact O-N 2.9Å; M72-F76 PolarHBondContact O-N 2.81Å; M72-F80 HydrophobicContact CB-CD2 4.12Å; M72-F80 HydrophobicContact CB-CG 4.46Å; M72-F80 HydrophobicContact CE-CD1 4.06Å; M72-F80 HydrophobicContact CE-CD2 4.04Å; M72-F80 HydrophobicContact CE-CE1 3.84Å; M72-F80 HydrophobicContact CE-CE2 3.85Å; M72-F80 HydrophobicContact CE-CG 4.18Å; M72-F80 HydrophobicContact CE-CZ 3.75Å
73	E	92.6	Very high	91	Very high	5 Å²	5	57.1 Å²	57.1	2%	0.023	28%	0.281	C	S	.	.	H	α-helix	trans	-65.5	-38	177.6	-64.1	-155.2	-176.6	0	0	112.5	V6 L69 A70 P77 F80 N82 R83 C84 L85	V6-E73 WeakPolarHBondContact CG2-O 3.45Å; L69-E73 PolarHBondContact O-N 2.81Å; L69-E73 VanDerWaalsContact O-N 3.13Å; A70-E73 PolarHBondContact O-N 3.21Å; E73-P77 VanDerWaalsContact O-CA 3.27Å; E73-P77 WeakPolarHBondContact O-CA 3.35Å; E73-P77 WeakPolarHBondContact O-CG 3.36Å; E73-F80 HydrophobicContact CG-CB 4.45Å; E73-F80 WeakPolarHBondContact CG-O 3.41Å; E73-N82 VanDerWaalsContact CD-N 3.35Å; E73-N82 PolarHBondContact OE1-N 2.88Å; E73-N82 PolarHBondContact OE2-N 2.82Å; E73-R83 PolarHBondContact OE1-N 2.81Å; E73-C84 HydrophobicContact CG-CB 3.66Å; E73-C84 WeakPolarHBondContact OE1-CA 3.29Å; E73-C84 WeakPolarHBondContact OE1-CB 3.22Å; E73-C84 PolarHBondContact OE1-N 2.61Å; E73-L85 PolarHBondContact OE1-N 2.93Å
74	C	90.7	Very high	90.9	Very high	41 Å²	41	56.5 Å²	56.5	28%	0.277	28%	0.28	S	S	.	.	H	α-helix	trans	-73.2	-39.8	179.7	-65.4	0	0	0	0	112.3	A70 A71 M72	A70-C74 PolarHBondContact O-N 2.86Å; A70-C74 PolarHBondContact O-SG 3.17Å; A71-C74 PolarHBondContact O-N 3.31Å; M72-C74 VanDerWaalsContact C-N 3.34Å; M72-C74 PolarHBondContact O-N 2.9Å
75	A	91.9	Very high	90.7	Very high	62 Å²	62	55.7 Å²	55.7	51%	0.512	28%	0.278	S	S	.	.	H	α-helix	trans	-79.2	-37.6	-176.4	0	0	0	0	0	112.9	A71 P77	A71-A75 WeakPolarHBondContact O-CB 3.16Å; A71-A75 PolarHBondContact O-N 2.98Å; A75-P77 VanDerWaalsContact C-CD 3.46Å
76	F	93.4	Very high	90.5	Very high	125 Å²	125	56.8 Å²	56.8	55%	0.548	29%	0.286	S	S	.	.			trans	-128.9	68	178.7	-47.1	-84.4	0	0	0	111.9	M72 K78 E79 F80	M72-F76 PolarHBondContact O-N 2.81Å; F76-K78 PolarHBondContact O-N 3.5Å; F76-E79 PolarHBondContact O-N 2.77Å; F76-E79 VanDerWaalsContact O-N 3.16Å; F76-F80 HydrophobicContact CB-CD2 3.78Å; F76-F80 HydrophobicContact CB-CE2 4.03Å; F76-F80 HydrophobicContact CD2-CD2 4.38Å; F76-F80 HydrophobicContact CD2-CE2 4.23Å; F76-F80 HydrophobicContact CG-CD2 4.5Å; F76-F80 HydrophobicContact CG-CE2 4.4Å; F76-F80 PolarHBondContact O-N 2.94Å; F76-F80 VanDerWaalsContact O-N 3.14Å
77	P	91.6	Very high	90.2	Very high	23 Å²	23	57.2 Å²	57.2	15%	0.149	29%	0.288	C	S	.	.	H	α-helix	trans	-60	-32.5	-174.3	-22.2	31.7	0	0	0	113.9	L1 Y4 V6 E73 A75 E79 A81	L1-P77 HydrophobicContact CD2-CB 4.28Å; L1-P77 HydrophobicContact CD2-CG 3.36Å; Y4-P77 HydrophobicContact CD2-CB 3.83Å; Y4-P77 HydrophobicContact CG-CB 3.89Å; V6-P77 HydrophobicContact CG2-CB 3.86Å; V6-P77 HydrophobicContact CG2-CG 4.32Å; E73-P77 VanDerWaalsContact O-CA 3.27Å; E73-P77 WeakPolarHBondContact O-CA 3.35Å; E73-P77 WeakPolarHBondContact O-CG 3.36Å; A75-P77 VanDerWaalsContact C-CD 3.46Å; P77-E79 VanDerWaalsContact C-N 3.27Å; P77-E79 PolarHBondContact O-N 3.16Å; P77-A81 HydrophobicContact CB-CB 4.38Å; P77-A81 WeakPolarHBondContact O-CB 3.36Å; P77-A81 PolarHBondContact O-N 2.82Å; P77-A81 VanDerWaalsContact O-N 3.14Å
78	K	90.6	Very high	89.9	Confident	158 Å²	158	59.5 Å²	59.5	69%	0.687	30%	0.301	S	S	*	.	H	α-helix	trans	-64	-32.6	-178.9	-72	-177.5	176.7	-176.5	0	113.2	Y4 F76	Y4-K78 HydrophobicContact CD1-CG 3.95Å; Y4-K78 HydrophobicContact CE1-CD 4.29Å; Y4-K78 HydrophobicContact CE1-CG 3.47Å; Y4-K78 VanDerWaalsContact CE1-CG 3.47Å; Y4-K78 WeakPolarHBondContact OH-CE 3.41Å; F76-K78 PolarHBondContact O-N 3.5Å
79	E	90.9	Very high	89.7	Confident	122 Å²	122	61 Å²	61	57%	0.57	30%	0.304	S	S	*	.	H	α-helix	trans	-94.6	-39.4	-174.8	-62.9	-61.6	155.1	0	0	111.8	F76 P77 R83	F76-E79 PolarHBondContact O-N 2.77Å; F76-E79 VanDerWaalsContact O-N 3.16Å; P77-E79 VanDerWaalsContact C-N 3.27Å; P77-E79 PolarHBondContact O-N 3.16Å; E79-R83 PolarHBondContact O-NH1 3.43Å
80	F	90.2	Very high	89.5	Confident	68 Å²	68	60.7 Å²	60.7	30%	0.298	30%	0.302	S	S	.	.	H	α-helix	trans	-117.6	-13	-163.4	-62.4	-51.1	0	0	0	115.6	M72 E73 F76 N82 R83	M72-F80 HydrophobicContact CB-CD2 4.12Å; M72-F80 HydrophobicContact CB-CG 4.46Å; M72-F80 HydrophobicContact CE-CD1 4.06Å; M72-F80 HydrophobicContact CE-CD2 4.04Å; M72-F80 HydrophobicContact CE-CE1 3.84Å; M72-F80 HydrophobicContact CE-CE2 3.85Å; M72-F80 HydrophobicContact CE-CG 4.18Å; M72-F80 HydrophobicContact CE-CZ 3.75Å; E73-F80 HydrophobicContact CG-CB 4.45Å; E73-F80 WeakPolarHBondContact CG-O 3.41Å; F76-F80 HydrophobicContact CB-CD2 3.78Å; F76-F80 HydrophobicContact CB-CE2 4.03Å; F76-F80 HydrophobicContact CD2-CD2 4.38Å; F76-F80 HydrophobicContact CD2-CE2 4.23Å; F76-F80 HydrophobicContact CG-CD2 4.5Å; F76-F80 HydrophobicContact CG-CE2 4.4Å; F76-F80 PolarHBondContact O-N 2.94Å; F76-F80 VanDerWaalsContact O-N 3.14Å; F80-N82 PolarHBondContact O-N 2.76Å; F80-R83 PolarHBondContact O-N 3.29Å
81	A	86.7	Confident	89.3	Confident	12 Å²	12	62.7 Å²	62.7	10%	0.099	31%	0.312	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.4	132.9	-174.3	0	0	0	0	0	111.8	Y4 V6 P77 R83	Y4-A81 WeakPolarHBondContact O-CB 3.31Å; V6-A81 HydrophobicContact CG2-CB 3.73Å; P77-A81 HydrophobicContact CB-CB 4.38Å; P77-A81 WeakPolarHBondContact O-CB 3.36Å; P77-A81 PolarHBondContact O-N 2.82Å; P77-A81 VanDerWaalsContact O-N 3.14Å; A81-R83 WeakPolarHBondContact O-CG 3.41Å; A81-R83 PolarHBondContact O-N 2.7Å
82	N	81.1	Confident	89.1	Confident	120 Å²	120	63.3 Å²	63.3	64%	0.642	31%	0.309	S	S	*	.	T	Hydrogen-bonded Turn	trans	59	21	-178.8	-158.6	38.2	0	0	0	114.9	E73 F80	E73-N82 VanDerWaalsContact CD-N 3.35Å; E73-N82 PolarHBondContact OE1-N 2.88Å; E73-N82 PolarHBondContact OE2-N 2.82Å; F80-N82 PolarHBondContact O-N 2.76Å
83	R	85	Confident	89.1	Confident	166 Å²	166	62.3 Å²	62.3	63%	0.626	30%	0.303	S	S	*	.	T	Hydrogen-bonded Turn	trans	-125	-16.9	-179.9	-61.2	175.5	81.8	-167.7	8.7	113.1	E73 E79 F80 A81 R89	E73-R83 PolarHBondContact OE1-N 2.81Å; E79-R83 PolarHBondContact O-NH1 3.43Å; F80-R83 PolarHBondContact O-N 3.29Å; A81-R83 WeakPolarHBondContact O-CG 3.41Å; A81-R83 PolarHBondContact O-N 2.7Å; R83-R89 PolarHBondContact O-NE 2.91Å
84	C	86.3	Confident	88.9	Confident	14 Å²	14	63.5 Å²	63.5	10%	0.095	31%	0.31	C	S	.	.	S	Bend	trans	-102.9	-57.3	-172	-84	0	0	0	0	111.2	L69 E73 S86 R89	L69-C84 HydrophobicContact CB-CB 4.36Å; L69-C84 WeakPolarHBondContact CD1-O 3.18Å; L69-C84 HydrophobicContact CD2-CB 3.75Å; E73-C84 HydrophobicContact CG-CB 3.66Å; E73-C84 WeakPolarHBondContact OE1-CA 3.29Å; E73-C84 WeakPolarHBondContact OE1-CB 3.22Å; E73-C84 PolarHBondContact OE1-N 2.61Å; C84-S86 VanDerWaalsContact C-N 3.35Å; C84-S86 PolarHBondContact O-N 3.01Å; C84-R89 WeakPolarHBondContact O-CB 3.42Å; C84-R89 WeakPolarHBondContact O-CG 3.47Å
85	L	88.8	Confident	88.9	Confident	7 Å²	7	65.8 Å²	65.8	4%	0.037	32%	0.315	C	S	.	.	S	Bend	trans	-83.5	76.6	-175.4	-172.1	68	0	0	0	110.7	C10 I13 F21 F23 Y28 I66 L69 A70 E73	C10-L85 HydrophobicContact CB-CD2 3.91Å; I13-L85 HydrophobicContact CD1-CD2 3.62Å; F21-L85 HydrophobicContact CZ-CD2 4.26Å; F23-L85 HydrophobicContact CE1-CD1 4.32Å; F23-L85 HydrophobicContact CE1-CG 4.15Å; F23-L85 HydrophobicContact CZ-CD1 4.08Å; F23-L85 HydrophobicContact CZ-CG 4.41Å; Y28-L85 WeakPolarHBondContact CE1-O 3.24Å; Y28-L85 PolarHBondContact OH-O 3.33Å; I66-L85 HydrophobicContact CD1-CD1 3.77Å; I66-L85 HydrophobicContact CG2-CD1 4.18Å; L69-L85 HydrophobicContact CB-CB 4.36Å; L69-L85 HydrophobicContact CB-CD1 4.1Å; A70-L85 HydrophobicContact CB-CD2 4.4Å; E73-L85 PolarHBondContact OE1-N 2.93Å
86	S	88.1	Confident	88.9	Confident	23 Å²	23	69.2 Å²	69.2	16%	0.161	32%	0.316	C	S	.	.	S	Bend	trans	-129.1	154.1	172.3	74	0	0	0	0	111.7	C84 E88 R89 V90	C84-S86 VanDerWaalsContact C-N 3.35Å; C84-S86 PolarHBondContact O-N 3.01Å; S86-E88 PolarHBondContact O-N 2.78Å; S86-R89 PolarHBondContact O-N 2.99Å; S86-R89 VanDerWaalsContact O-N 3.13Å; S86-R89 WeakPolarHBondContact OG-CG 3.5Å; S86-R89 PolarHBondContact OG-N 3.32Å; S86-V90 WeakPolarHBondContact O-CG2 3.45Å; S86-V90 PolarHBondContact O-N 3.2Å
87	P	86.5	Confident	88.9	Confident	8 Å²	8	64.4 Å²	64.4	5%	0.052	29%	0.294	C	S	.	.	H	α-helix	trans	-55.2	-39.4	177.7	-25.8	34	0	0	0	112.9	F23 Y28 F29 L48 V90 L91	F23-P87 HydrophobicContact CB-CG 4.06Å; F23-P87 HydrophobicContact CD1-CG 3.73Å; F23-P87 HydrophobicContact CD2-CG 4.28Å; F23-P87 HydrophobicContact CE1-CG 4.22Å; F23-P87 HydrophobicContact CG-CG 3.76Å; Y28-P87 HydrophobicContact CD2-CG 4.33Å; Y28-P87 HydrophobicContact CG-CG 4.21Å; F29-P87 HydrophobicContact CE2-CB 4.14Å; F29-P87 HydrophobicContact CE2-CG 3.84Å; F29-P87 HydrophobicContact CZ-CB 4.03Å; F29-P87 HydrophobicContact CZ-CG 4.07Å; L48-P87 HydrophobicContact CD2-CB 3.92Å; L48-P87 HydrophobicContact CD2-CG 4.47Å; P87-V90 PolarHBondContact O-N 2.85Å; P87-L91 PolarHBondContact O-N 2.63Å
88	E	87.1	Confident	88.9	Confident	87 Å²	87	69.5 Å²	69.5	41%	0.407	31%	0.311	S	S	.	.	H	α-helix	trans	-60.3	-49.8	175.8	-67.7	174.7	179.4	0	0	112	L42 S86 V90 L91 L92	L42-E88 HydrophobicContact CD2-CG 3.77Å; S86-E88 PolarHBondContact O-N 2.78Å; E88-V90 VanDerWaalsContact C-N 3.27Å; E88-V90 PolarHBondContact O-N 3.38Å; E88-L91 PolarHBondContact O-N 2.83Å; E88-L92 WeakPolarHBondContact O-CB 3.26Å; E88-L92 VanDerWaalsContact O-CG 3.26Å; E88-L92 WeakPolarHBondContact O-CG 3.35Å; E88-L92 PolarHBondContact O-N 3.46Å
89	R	89.9	Confident	89	Confident	129 Å²	129	63.7 Å²	63.7	49%	0.487	29%	0.288	S	S	.	.	H	α-helix	trans	-64	-34.6	179.8	-73.4	-67.4	-169.3	-164.6	-3.2	112.4	L69 R83 C84 S86 Q93	L69-R89 HydrophobicContact CD1-CB 4.45Å; R83-R89 PolarHBondContact O-NE 2.91Å; C84-R89 WeakPolarHBondContact O-CB 3.42Å; C84-R89 WeakPolarHBondContact O-CG 3.47Å; S86-R89 PolarHBondContact O-N 2.99Å; S86-R89 VanDerWaalsContact O-N 3.13Å; S86-R89 WeakPolarHBondContact OG-CG 3.5Å; S86-R89 PolarHBondContact OG-N 3.32Å; R89-Q93 WeakPolarHBondContact O-CG 3.41Å; R89-Q93 PolarHBondContact O-N 3.27Å
90	V	89.5	Confident	89.1	Confident	0 Å²	0	58.5 Å²	58.5	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-67.7	-48.2	175.1	174.8	0	0	0	0	110.2	F23 Y62 I65 I66 L69 S86 P87 E88 L92 Q93 L94	F23-V90 HydrophobicContact CE2-CG2 4.05Å; F23-V90 HydrophobicContact CZ-CG2 3.73Å; Y62-V90 HydrophobicContact CD1-CG1 3.7Å; Y62-V90 HydrophobicContact CE1-CG1 3.47Å; Y62-V90 VanDerWaalsContact CE1-CG1 3.47Å; Y62-V90 HydrophobicContact CG-CG1 4.4Å; I65-V90 HydrophobicContact CG2-CB 4.44Å; I65-V90 HydrophobicContact CG2-CG1 4.27Å; I65-V90 HydrophobicContact CG2-CG2 4.17Å; I66-V90 HydrophobicContact CD1-CG1 4.37Å; I66-V90 HydrophobicContact CD1-CG2 3.55Å; L69-V90 HydrophobicContact CD1-CG2 3.82Å; S86-V90 WeakPolarHBondContact O-CG2 3.45Å; S86-V90 PolarHBondContact O-N 3.2Å; P87-V90 PolarHBondContact O-N 2.85Å; E88-V90 VanDerWaalsContact C-N 3.27Å; E88-V90 PolarHBondContact O-N 3.38Å; V90-L92 PolarHBondContact O-N 3.06Å; V90-Q93 PolarHBondContact O-N 3.07Å; V90-Q93 VanDerWaalsContact O-N 3.17Å; V90-L94 HydrophobicContact CG1-CD1 3.95Å; V90-L94 HydrophobicContact CG1-CG 4.47Å; V90-L94 WeakPolarHBondContact O-CG 3.34Å; V90-L94 PolarHBondContact O-N 3.37Å
91	L	87.6	Confident	89.2	Confident	44 Å²	44	56 Å²	56	23%	0.23	25%	0.254	C	S	.	.	H	α-helix	trans	-60.7	-46.3	177.9	-173.9	70.7	0	0	0	112.1	L42 P87 E88 Q93 L94 K95	L42-L91 HydrophobicContact CB-CD2 3.57Å; L42-L91 HydrophobicContact CD1-CB 3.95Å; L42-L91 HydrophobicContact CD1-CD2 3.5Å; L42-L91 HydrophobicContact CD1-CG 4.26Å; L42-L91 HydrophobicContact CG-CD2 4.14Å; P87-L91 PolarHBondContact O-N 2.63Å; E88-L91 PolarHBondContact O-N 2.83Å; L91-Q93 PolarHBondContact O-N 3.46Å; L91-L94 WeakPolarHBondContact O-CB 3.46Å; L91-L94 PolarHBondContact O-N 3.17Å; L91-L94 VanDerWaalsContact O-N 3.08Å; L91-K95 PolarHBondContact O-N 3.14Å
92	L	90.3	Very high	89.4	Confident	57 Å²	57	59.7 Å²	59.7	30%	0.298	27%	0.271	S	S	.	.	H	α-helix	trans	-54.9	-40.2	176.3	-73.2	174.1	0	0	0	111.5	A43 D44 E88 V90 Y96	A43-L92 HydrophobicContact CB-CD2 4.39Å; D44-L92 WeakPolarHBondContact OD1-CD2 3.44Å; D44-L92 VanDerWaalsContact OD2-CD2 3.29Å; D44-L92 WeakPolarHBondContact OD2-CD2 3.02Å; E88-L92 WeakPolarHBondContact O-CB 3.26Å; E88-L92 VanDerWaalsContact O-CG 3.26Å; E88-L92 WeakPolarHBondContact O-CG 3.35Å; E88-L92 PolarHBondContact O-N 3.46Å; V90-L92 PolarHBondContact O-N 3.06Å; L92-Y96 WeakPolarHBondContact O-CB 3.23Å; L92-Y96 PolarHBondContact O-N 3.07Å
93	Q	91.7	Very high	90	Very high	37 Å²	37	58.8 Å²	58.8	17%	0.173	27%	0.266	C	S	.	.	H	α-helix	trans	-75.2	-32.1	178.3	-76.4	-174.3	58.9	0	0	113.6	I65 K68 R89 V90 L91 Y96 R97	I65-Q93 HydrophobicContact CD1-CB 3.82Å; I65-Q93 HydrophobicContact CG1-CB 4.25Å; I65-Q93 HydrophobicContact CG2-CB 4.01Å; K68-Q93 VanDerWaalsContact CE-OE1 3.23Å; R89-Q93 WeakPolarHBondContact O-CG 3.41Å; R89-Q93 PolarHBondContact O-N 3.27Å; V90-Q93 PolarHBondContact O-N 3.07Å; V90-Q93 VanDerWaalsContact O-N 3.17Å; L91-Q93 PolarHBondContact O-N 3.46Å; Q93-Y96 PolarHBondContact O-N 3.37Å; Q93-R97 WeakPolarHBondContact O-CG 2.98Å; Q93-R97 PolarHBondContact O-N 2.81Å
94	L	89.4	Confident	90.6	Very high	31 Å²	31	58.3 Å²	58.3	16%	0.162	26%	0.264	C	S	.	.	H	α-helix	trans	-65.3	-44	172	-69.9	164.3	0	0	0	110.7	F61 Y62 I65 V90 L91 R97 Y98	F61-L94 HydrophobicContact CB-CD2 3.6Å; Y62-L94 HydrophobicContact CD2-CD1 3.89Å; Y62-L94 HydrophobicContact CD2-CD2 4.13Å; Y62-L94 HydrophobicContact CE1-CD1 4.28Å; Y62-L94 HydrophobicContact CE2-CD1 3.17Å; Y62-L94 HydrophobicContact CE2-CD2 4.16Å; Y62-L94 HydrophobicContact CE2-CG 4.28Å; Y62-L94 VanDerWaalsContact CZ-CD1 3.41Å; Y62-L94 WeakPolarHBondContact OH-CD1 3.49Å; I65-L94 HydrophobicContact CD1-CD2 3.71Å; I65-L94 HydrophobicContact CD1-CG 3.91Å; V90-L94 HydrophobicContact CG1-CD1 3.95Å; V90-L94 HydrophobicContact CG1-CG 4.47Å; V90-L94 WeakPolarHBondContact O-CG 3.34Å; V90-L94 PolarHBondContact O-N 3.37Å; L91-L94 WeakPolarHBondContact O-CB 3.46Å; L91-L94 PolarHBondContact O-N 3.17Å; L91-L94 VanDerWaalsContact O-N 3.08Å; L94-R97 PolarHBondContact O-N 2.64Å; L94-Y98 PolarHBondContact O-N 3.16Å
95	K	90.6	Very high	90.9	Very high	89 Å²	89	61.8 Å²	61.8	39%	0.387	29%	0.289	S	S	.	.	H	α-helix	trans	-58.1	-48.8	171.2	179.9	175.5	173.2	37.4	0	110.9	D44 L91 R97 Y98 D99	D44-K95 HydrophobicContact CB-CD 4.15Å; D44-K95 WeakPolarHBondContact OD2-CD 3.42Å; L91-K95 PolarHBondContact O-N 3.14Å; K95-R97 VanDerWaalsContact C-N 3.25Å; K95-R97 PolarHBondContact O-N 3.36Å; K95-Y98 WeakPolarHBondContact O-CA 3.44Å; K95-Y98 WeakPolarHBondContact O-CB 3.27Å; K95-Y98 PolarHBondContact O-N 2.96Å; K95-D99 WeakPolarHBondContact CE-OD2 2.87Å; K95-D99 VanDerWaalsContact NZ-CG 3.32Å; K95-D99 IonicContact NZ-OD1 4Å; K95-D99 PolarHBondContact NZ-OD1 3.39Å; K95-D99 IonicContact NZ-OD2 2.77Å; K95-D99 PolarHBondContact NZ-OD2 3.13Å; K95-D99 VanDerWaalsContact O-CG 3.3Å; K95-D99 PolarHBondContact O-N 3.15Å
96	Y	92.6	Very high	91.2	Very high	134 Å²	134	69.3 Å²	69.3	53%	0.525	32%	0.316	S	S	.	.	H	α-helix	trans	-55.7	-40.7	176.9	170.7	-94.2	0	0	0	112.7	L92 Q93 T100 W163	L92-Y96 WeakPolarHBondContact O-CB 3.23Å; L92-Y96 PolarHBondContact O-N 3.07Å; Q93-Y96 PolarHBondContact O-N 3.37Å; Y96-T100 VanDerWaalsContact O-CB 3.26Å; Y96-T100 WeakPolarHBondContact O-CB 3.27Å; Y96-T100 PolarHBondContact O-N 3.49Å; Y96-T100 PolarHBondContact O-OG1 3.06Å; Y96-W163 HydrophobicContact CE1-CH2 4.46Å; Y96-W163 HydrophobicContact CE1-CZ2 4.28Å
97	R	92.6	Very high	91.5	Very high	24 Å²	24	72.2 Å²	72.2	9%	0.091	32%	0.324	C	S	.	.	H	α-helix	trans	-63.9	-45.5	175.4	-76	-163.3	171.9	164.9	-0.3	111.7	F61 Q93 L94 K95 T100 E101 G162 W163	F61-R97 PolarHBondContact O-NH1 3.3Å; F61-R97 VanDerWaalsContact O-NH1 3.11Å; Q93-R97 WeakPolarHBondContact O-CG 2.98Å; Q93-R97 PolarHBondContact O-N 2.81Å; L94-R97 PolarHBondContact O-N 2.64Å; K95-R97 VanDerWaalsContact C-N 3.25Å; K95-R97 PolarHBondContact O-N 3.36Å; R97-T100 PolarHBondContact O-N 2.85Å; R97-E101 VanDerWaalsContact O-CB 3.23Å; R97-E101 WeakPolarHBondContact O-CB 3.02Å; R97-E101 PolarHBondContact O-N 3.14Å; R97-G162 PolarHBondContact NH2-O 2.84Å; R97-W163 HydrophobicContact CB-CE3 4.49Å; R97-W163 HydrophobicContact CB-CH2 4.03Å; R97-W163 HydrophobicContact CB-CZ3 3.66Å; R97-W163 HydrophobicContact CG-CE3 4.07Å; R97-W163 HydrophobicContact CG-CH2 3.7Å; R97-W163 HydrophobicContact CG-CZ2 4.39Å; R97-W163 HydrophobicContact CG-CZ3 3.51Å
98	Y	90.9	Very high	91.9	Very high	129 Å²	129	72.4 Å²	72.4	51%	0.506	33%	0.326	S	S	.	.	H	α-helix	trans	-57.2	-54	174.9	-177.7	-88.3	0	0	0	111.4	L94 K95 T100 E101 I102 D103	L94-Y98 PolarHBondContact O-N 3.16Å; K95-Y98 WeakPolarHBondContact O-CA 3.44Å; K95-Y98 WeakPolarHBondContact O-CB 3.27Å; K95-Y98 PolarHBondContact O-N 2.96Å; Y98-T100 PolarHBondContact O-N 3.36Å; Y98-E101 PolarHBondContact O-N 3.47Å; Y98-I102 HydrophobicContact CD2-CB 4.17Å; Y98-I102 HydrophobicContact CD2-CG1 3.75Å; Y98-I102 HydrophobicContact CE1-CB 4.44Å; Y98-I102 HydrophobicContact CE1-CG2 4.49Å; Y98-I102 HydrophobicContact CE2-CB 4.05Å; Y98-I102 HydrophobicContact CE2-CG1 3.89Å; Y98-I102 HydrophobicContact CE2-CG2 4.01Å; Y98-I102 HydrophobicContact CG-CB 4.44Å; Y98-I102 HydrophobicContact CG-CG1 4.31Å; Y98-I102 WeakPolarHBondContact O-CA 3.31Å; Y98-I102 VanDerWaalsContact O-CB 3.27Å; Y98-I102 WeakPolarHBondContact O-CB 3.33Å; Y98-I102 PolarHBondContact O-N 3.31Å; Y98-D103 WeakPolarHBondContact CE1-OD1 3.4Å; Y98-D103 PolarHBondContact O-N 2.92Å
99	D	93.9	Very high	92.4	Very high	37 Å²	37	70.3 Å²	70.3	20%	0.198	32%	0.323	C	S	.	.	I	π-helix	trans	-60.2	-34.4	-179	-63	2.1	0	0	0	111.7	K95 D103 R104	K95-D99 WeakPolarHBondContact CE-OD2 2.87Å; K95-D99 VanDerWaalsContact NZ-CG 3.32Å; K95-D99 IonicContact NZ-OD1 4Å; K95-D99 PolarHBondContact NZ-OD1 3.39Å; K95-D99 IonicContact NZ-OD2 2.77Å; K95-D99 PolarHBondContact NZ-OD2 3.13Å; K95-D99 VanDerWaalsContact O-CG 3.3Å; K95-D99 PolarHBondContact O-N 3.15Å; D99-D103 WeakPolarHBondContact O-CB 3.5Å; D99-R104 WeakPolarHBondContact O-CB 3.31Å; D99-R104 VanDerWaalsContact O-CG 3.25Å; D99-R104 WeakPolarHBondContact O-CG 3.29Å; D99-R104 PolarHBondContact O-N 2.8Å
100	T	93.1	Very high	92.6	Very high	12 Å²	12	64.4 Å²	64.4	7%	0.074	30%	0.301	C	S	.	.	I	π-helix	trans	-78.1	-47.8	-179.1	-61.3	0	0	0	0	112	Y96 R97 Y98 R104 S105 R106 W163	Y96-T100 VanDerWaalsContact O-CB 3.26Å; Y96-T100 WeakPolarHBondContact O-CB 3.27Å; Y96-T100 PolarHBondContact O-N 3.49Å; Y96-T100 PolarHBondContact O-OG1 3.06Å; R97-T100 PolarHBondContact O-N 2.85Å; Y98-T100 PolarHBondContact O-N 3.36Å; T100-R104 CarbonylContact O-C 3.54Å; T100-R104 WeakPolarHBondContact O-CB 3.41Å; T100-S105 PolarHBondContact O-N 3.04Å; T100-R106 HydrophobicContact CG2-CB 3.84Å; T100-R106 WeakPolarHBondContact O-CB 3.31Å; T100-R106 PolarHBondContact O-N 2.92Å; T100-W163 HydrophobicContact CG2-CH2 3.81Å; T100-W163 HydrophobicContact CG2-CZ2 4.2Å
101	E	92.8	Very high	92.9	Very high	16 Å²	16	65.9 Å²	65.9	8%	0.075	31%	0.307	C	S	.	.	I	π-helix	trans	-86.4	-38.2	-170.9	-179.5	162.8	-156.3	0	0	112.9	R97 Y98 S105 K111 W163 Y164	R97-E101 VanDerWaalsContact O-CB 3.23Å; R97-E101 WeakPolarHBondContact O-CB 3.02Å; R97-E101 PolarHBondContact O-N 3.14Å; Y98-E101 PolarHBondContact O-N 3.47Å; E101-S105 VanDerWaalsContact O-CA 3.29Å; E101-S105 WeakPolarHBondContact O-CA 3.15Å; E101-K111 WeakPolarHBondContact OE1-CD 2.95Å; E101-K111 WeakPolarHBondContact OE1-CE 3.17Å; E101-K111 IonicContact OE1-NZ 3.5Å; E101-K111 PolarHBondContact OE1-NZ 3.27Å; E101-W163 HydrophobicContact CB-CZ3 4Å; E101-Y164 WeakPolarHBondContact OE1-CE2 3.22Å; E101-Y164 PolarHBondContact OE1-OH 2.92Å; E101-Y164 PolarHBondContact OE2-OH 3.5Å
102	I	90.4	Very high	93.3	Very high	89 Å²	89	67.6 Å²	67.6	46%	0.456	31%	0.313	S	S	.	.	I	π-helix	trans	-92.7	-61.7	-177.2	-51.6	-57.6	0	0	0	109.8	Y98 R104 S105	Y98-I102 HydrophobicContact CD2-CB 4.17Å; Y98-I102 HydrophobicContact CD2-CG1 3.75Å; Y98-I102 HydrophobicContact CE1-CB 4.44Å; Y98-I102 HydrophobicContact CE1-CG2 4.49Å; Y98-I102 HydrophobicContact CE2-CB 4.05Å; Y98-I102 HydrophobicContact CE2-CG1 3.89Å; Y98-I102 HydrophobicContact CE2-CG2 4.01Å; Y98-I102 HydrophobicContact CG-CB 4.44Å; Y98-I102 HydrophobicContact CG-CG1 4.31Å; Y98-I102 WeakPolarHBondContact O-CA 3.31Å; Y98-I102 VanDerWaalsContact O-CB 3.27Å; Y98-I102 WeakPolarHBondContact O-CB 3.33Å; Y98-I102 PolarHBondContact O-N 3.31Å; I102-R104 PolarHBondContact O-N 3.35Å; I102-S105 PolarHBondContact O-N 3.27Å
103	D	94.2	Very high	93.5	Very high	102 Å²	102	65.4 Å²	65.4	55%	0.545	30%	0.302	S	S	.	.	I	π-helix	trans	-69.6	-38.6	-173.2	-62.6	-20	0	0	0	112.5	Y98 D99	Y98-D103 WeakPolarHBondContact CE1-OD1 3.4Å; Y98-D103 PolarHBondContact O-N 2.92Å; D99-D103 WeakPolarHBondContact O-CB 3.5Å
104	R	95.8	Very high	93.6	Very high	156 Å²	156	63.8 Å²	63.8	59%	0.589	29%	0.294	S	S	*	.	S	Bend	trans	-98	-1.9	-179.2	-63.8	172.4	-176.7	-172.9	0.9	113.4	D99 T100 I102 R106	D99-R104 WeakPolarHBondContact O-CB 3.31Å; D99-R104 VanDerWaalsContact O-CG 3.25Å; D99-R104 WeakPolarHBondContact O-CG 3.29Å; D99-R104 PolarHBondContact O-N 2.8Å; T100-R104 CarbonylContact O-C 3.54Å; T100-R104 WeakPolarHBondContact O-CB 3.41Å; I102-R104 PolarHBondContact O-N 3.35Å; R104-R106 HydrophobicContact CB-CG 4.16Å; R104-R106 PolarHBondContact O-N 3.48Å
105	S	94	Very high	93.9	Very high	87 Å²	87	64.1 Å²	64.1	61%	0.608	30%	0.295	S	S	*	.			trans	51	30.8	-179.2	-55.9	0	0	0	0	114.2	T100 E101 I102 R107	T100-S105 PolarHBondContact O-N 3.04Å; E101-S105 VanDerWaalsContact O-CA 3.29Å; E101-S105 WeakPolarHBondContact O-CA 3.15Å; I102-S105 PolarHBondContact O-N 3.27Å; S105-R107 PolarHBondContact O-N 3Å
106	R	95.5	Very high	94	Very high	164 Å²	164	64.5 Å²	64.5	62%	0.619	29%	0.294	S	S	*	.			trans	-89.9	100.8	179.4	-67.1	-174.2	177.4	-174.1	-1.3	110	T100 R104	T100-R106 HydrophobicContact CG2-CB 3.84Å; T100-R106 WeakPolarHBondContact O-CB 3.31Å; T100-R106 PolarHBondContact O-N 2.92Å; R104-R106 HydrophobicContact CB-CG 4.16Å; R104-R106 PolarHBondContact O-N 3.48Å
107	R	94.3	Very high	94.1	Very high	84 Å²	84	63.1 Å²	63.1	32%	0.317	30%	0.295	S	S	.	.			trans	-83.6	142.7	-179.4	-64.9	173.3	-74.9	164.5	-0.6	112.2	S105 K111 K112 E115 D117	S105-R107 PolarHBondContact O-N 3Å; R107-K111 HydrophobicContact CB-CB 4.37Å; R107-K111 HydrophobicContact CB-CD 4.34Å; R107-K111 HydrophobicContact CB-CG 4.24Å; R107-K111 HydrophobicContact CG-CD 4.12Å; R107-K111 HydrophobicContact CG-CG 4.32Å; R107-K112 HydrophobicContact CB-CG 3.75Å; R107-K112 WeakPolarHBondContact O-CE 3.35Å; R107-E115 WeakPolarHBondContact CD-OE2 3.12Å; R107-E115 IonicContact CZ-OE2 2.63Å; R107-E115 IonicContact NE-OE2 2.75Å; R107-E115 IonicContact NH1-OE2 2.63Å; R107-E115 PolarHBondContact NH1-OE2 2.94Å; R107-D117 IonicContact CZ-OD2 3.73Å; R107-D117 IonicContact NH1-OD2 3.91Å; R107-D117 PolarHBondContact NH1-OD2 3.11Å; R107-D117 IonicContact NH2-OD2 2.76Å; R107-D117 PolarHBondContact NH2-OD2 3.11Å
108	S	95.1	Very high	94.2	Very high	13 Å²	13	64.5 Å²	64.5	9%	0.091	31%	0.305	C	S	.	.			trans	-68.6	170.5	175.5	88.9	0	0	0	0	111.6	K111 K112 D161 Y164	S108-K111 PolarHBondContact O-N 3.01Å; S108-K111 PolarHBondContact OG-N 3.36Å; S108-K112 WeakPolarHBondContact O-CG 3.29Å; S108-K112 PolarHBondContact O-N 3.15Å; S108-D161 WeakPolarHBondContact CB-OD2 3.37Å; S108-D161 PolarHBondContact OG-OD2 3.36Å; S108-Y164 WeakPolarHBondContact OG-CD2 3.06Å
109	A	95.7	Very high	94.3	Very high	43 Å²	43	61.9 Å²	61.9	36%	0.355	30%	0.302	S	S	.	.	H	α-helix	trans	-63.9	-49.8	-177.9	0	0	0	0	0	111.4	K111 K112 I113 L124 D161	A109-K111 VanDerWaalsContact C-N 3.32Å; A109-K111 PolarHBondContact O-N 3.44Å; A109-K112 PolarHBondContact O-N 2.55Å; A109-I113 WeakPolarHBondContact O-CD1 3.43Å; A109-I113 VanDerWaalsContact O-CG1 3.26Å; A109-I113 WeakPolarHBondContact O-CG1 3.39Å; A109-I113 PolarHBondContact O-N 2.63Å; A109-I113 VanDerWaalsContact O-N 3.09Å; A109-L124 HydrophobicContact CB-CD2 4.19Å; A109-D161 PolarHBondContact N-OD2 3.13Å; A109-D161 VanDerWaalsContact N-OD2 3.09Å
110	I	95.3	Very high	94.2	Very high	5 Å²	5	60.3 Å²	60.3	3%	0.026	30%	0.295	C	S	.	.	H	α-helix	trans	-60.9	-43.4	178.1	-72.8	175.5	0	0	0	110.5	K112 I113 M114 L126 D161 Y164 V166	I110-K112 PolarHBondContact O-N 2.75Å; I110-I113 PolarHBondContact O-N 2.61Å; I110-M114 HydrophobicContact CG2-CG 4.08Å; I110-M114 HydrophobicContact CG2-SD 3.34Å; I110-M114 WeakPolarHBondContact CG2-SD 3.23Å; I110-M114 WeakPolarHBondContact O-CB 3.03Å; I110-M114 VanDerWaalsContact O-CG 3.28Å; I110-M114 WeakPolarHBondContact O-CG 2.87Å; I110-M114 PolarHBondContact O-N 3.32Å; I110-L126 HydrophobicContact CD1-CD2 4.05Å; I110-L126 HydrophobicContact CG1-CD2 4.17Å; I110-D161 HydrophobicContact CD1-CB 3.87Å; I110-D161 HydrophobicContact CG1-CB 3.96Å; I110-D161 PolarHBondContact N-OD2 3.25Å; I110-Y164 WeakPolarHBondContact CD1-O 3.42Å; I110-V166 HydrophobicContact CD1-CB 4.41Å; I110-V166 HydrophobicContact CD1-CG1 3.94Å; I110-V166 HydrophobicContact CG1-CG1 4.32Å; I110-V166 HydrophobicContact CG2-CB 4.3Å
111	K	95.1	Very high	94.3	Very high	30 Å²	30	61.8 Å²	61.8	13%	0.13	31%	0.308	C	S	.	.	H	α-helix	trans	-59.6	-47.6	179.3	-175	160.8	-175.8	165.5	0	112.7	E101 R107 S108 A109 I113 M114 E115 Y164 P205	E101-K111 WeakPolarHBondContact OE1-CD 2.95Å; E101-K111 WeakPolarHBondContact OE1-CE 3.17Å; E101-K111 IonicContact OE1-NZ 3.5Å; E101-K111 PolarHBondContact OE1-NZ 3.27Å; R107-K111 HydrophobicContact CB-CB 4.37Å; R107-K111 HydrophobicContact CB-CD 4.34Å; R107-K111 HydrophobicContact CB-CG 4.24Å; R107-K111 HydrophobicContact CG-CD 4.12Å; R107-K111 HydrophobicContact CG-CG 4.32Å; S108-K111 PolarHBondContact O-N 3.01Å; S108-K111 PolarHBondContact OG-N 3.36Å; A109-K111 VanDerWaalsContact C-N 3.32Å; A109-K111 PolarHBondContact O-N 3.44Å; K111-I113 VanDerWaalsContact C-N 3.3Å; K111-I113 PolarHBondContact O-N 2.79Å; K111-M114 PolarHBondContact O-N 3.17Å; K111-E115 WeakPolarHBondContact CE-OE1 3.41Å; K111-E115 HydrophobicContact CG-CG 4.31Å; K111-E115 WeakPolarHBondContact CG-OE1 3.34Å; K111-E115 WeakPolarHBondContact O-CB 3.49Å; K111-E115 VanDerWaalsContact O-CG 3.32Å; K111-E115 WeakPolarHBondContact O-CG 3.17Å; K111-E115 PolarHBondContact O-N 2.92Å; K111-Y164 HydrophobicContact CB-CD2 3.98Å; K111-Y164 HydrophobicContact CB-CE2 3.97Å; K111-Y164 HydrophobicContact CD-CD2 4.47Å; K111-Y164 HydrophobicContact CD-CE2 3.65Å; K111-Y164 HydrophobicContact CG-CE2 4.34Å; K111-Y164 PolarHBondContact NZ-OH 3.24Å; K111-P205 HydrophobicContact CB-CG 3.92Å; K111-P205 HydrophobicContact CG-CG 4.03Å
112	K	95.9	Very high	94.3	Very high	80 Å²	80	66 Å²	66	35%	0.348	33%	0.326	S	S	.	.	H	α-helix	trans	-60.6	-39.6	176.5	-71.9	179.4	177.9	-179.2	0	112.7	R107 S108 A109 I110 R116 D117 D118	R107-K112 HydrophobicContact CB-CG 3.75Å; R107-K112 WeakPolarHBondContact O-CE 3.35Å; S108-K112 WeakPolarHBondContact O-CG 3.29Å; S108-K112 PolarHBondContact O-N 3.15Å; A109-K112 PolarHBondContact O-N 2.55Å; I110-K112 PolarHBondContact O-N 2.75Å; K112-R116 PolarHBondContact O-N 3.05Å; K112-D117 PolarHBondContact O-N 3.21Å; K112-D118 HydrophobicContact CB-CB 3.83Å; K112-D118 PolarHBondContact O-N 3.05Å; K112-D118 VanDerWaalsContact O-N 3.09Å
113	I	95.3	Very high	94.6	Very high	11 Å²	11	65.8 Å²	65.8	6%	0.056	33%	0.329	C	S	.	.	H	α-helix	trans	-67.5	-45	-180	-70.1	163.7	0	0	0	111.1	A109 I110 K111 R116 D118 A120 L124 L196	A109-I113 WeakPolarHBondContact O-CD1 3.43Å; A109-I113 VanDerWaalsContact O-CG1 3.26Å; A109-I113 WeakPolarHBondContact O-CG1 3.39Å; A109-I113 PolarHBondContact O-N 2.63Å; A109-I113 VanDerWaalsContact O-N 3.09Å; I110-I113 PolarHBondContact O-N 2.61Å; K111-I113 VanDerWaalsContact C-N 3.3Å; K111-I113 PolarHBondContact O-N 2.79Å; I113-R116 PolarHBondContact O-N 3.38Å; I113-R116 VanDerWaalsContact O-N 3.16Å; I113-D118 WeakPolarHBondContact CA-O 3.37Å; I113-A120 HydrophobicContact CG2-CB 3.9Å; I113-L124 HydrophobicContact CD1-CD1 3.54Å; I113-L124 HydrophobicContact CD1-CD2 3.89Å; I113-L124 HydrophobicContact CD1-CG 4.37Å; I113-L196 HydrophobicContact CG2-CD2 3.96Å
114	M	94.1	Very high	94.7	Very high	3 Å²	3	61.9 Å²	61.9	2%	0.015	31%	0.308	C	S	.	.	H	α-helix	trans	-72.2	-33.9	-178.5	-65.9	178.4	73.5	0	0	112.9	I110 K111 R116 C203 P205 A208 L212	I110-M114 HydrophobicContact CG2-CG 4.08Å; I110-M114 HydrophobicContact CG2-SD 3.34Å; I110-M114 WeakPolarHBondContact CG2-SD 3.23Å; I110-M114 WeakPolarHBondContact O-CB 3.03Å; I110-M114 VanDerWaalsContact O-CG 3.28Å; I110-M114 WeakPolarHBondContact O-CG 2.87Å; I110-M114 PolarHBondContact O-N 3.32Å; K111-M114 PolarHBondContact O-N 3.17Å; M114-R116 PolarHBondContact O-N 3.21Å; M114-C203 CarbonylContact C-O 3.51Å; M114-C203 PolarHBondContact O-N 3.24Å; M114-C203 VanDerWaalsContact O-N 3.16Å; M114-P205 HydrophobicContact CB-CG 4.39Å; M114-P205 HydrophobicContact CE-CB 4.17Å; M114-P205 HydrophobicContact SD-CB 3.7Å; M114-P205 HydrophobicContact SD-CG 3.82Å; M114-A208 HydrophobicContact CE-CB 3.16Å; M114-L212 HydrophobicContact CE-CD2 3.71Å; M114-L212 HydrophobicContact CG-CD2 4.36Å
115	E	94.6	Very high	94.8	Very high	39 Å²	39	58.7 Å²	58.7	18%	0.182	31%	0.306	C	S	.	.	T	Hydrogen-bonded Turn	trans	-75.9	1.6	172	-68.6	175.9	174.2	0	0	112.8	R107 K111 D117 A202	R107-E115 WeakPolarHBondContact CD-OE2 3.12Å; R107-E115 IonicContact CZ-OE2 2.63Å; R107-E115 IonicContact NE-OE2 2.75Å; R107-E115 IonicContact NH1-OE2 2.63Å; R107-E115 PolarHBondContact NH1-OE2 2.94Å; K111-E115 WeakPolarHBondContact CE-OE1 3.41Å; K111-E115 HydrophobicContact CG-CG 4.31Å; K111-E115 WeakPolarHBondContact CG-OE1 3.34Å; K111-E115 WeakPolarHBondContact O-CB 3.49Å; K111-E115 VanDerWaalsContact O-CG 3.32Å; K111-E115 WeakPolarHBondContact O-CG 3.17Å; K111-E115 PolarHBondContact O-N 2.92Å; E115-D117 PolarHBondContact O-N 3.38Å; E115-A202 WeakPolarHBondContact O-CB 3.46Å
116	R	92.9	Very high	94.9	Very high	96 Å²	96	54.7 Å²	54.7	36%	0.362	28%	0.278	S	S	.	.	T	Hydrogen-bonded Turn	trans	63.4	19.2	179.3	-53	-63.7	-173.3	168	-5	115	K112 I113 M114 S199 P200 A202	K112-R116 PolarHBondContact O-N 3.05Å; I113-R116 PolarHBondContact O-N 3.38Å; I113-R116 VanDerWaalsContact O-N 3.16Å; M114-R116 PolarHBondContact O-N 3.21Å; R116-S199 PolarHBondContact NH2-O 2.91Å; R116-P200 PolarHBondContact NE-O 3.08Å; R116-A202 HydrophobicContact CB-CB 4.23Å; R116-A202 HydrophobicContact CG-CB 3.89Å
117	D	94.3	Very high	95	Very high	105 Å²	105	48 Å²	48	56%	0.561	26%	0.255	S	S	*	.	S	Bend	trans	-90.2	-12	176.8	-88.3	6.6	0	0	0	113.3	R107 K112 E115	R107-D117 IonicContact CZ-OD2 3.73Å; R107-D117 IonicContact NH1-OD2 3.91Å; R107-D117 PolarHBondContact NH1-OD2 3.11Å; R107-D117 IonicContact NH2-OD2 2.76Å; R107-D117 PolarHBondContact NH2-OD2 3.11Å; K112-D117 PolarHBondContact O-N 3.21Å; E115-D117 PolarHBondContact O-N 3.38Å
118	D	94.6	Very high	95.1	Very high	54 Å²	54	44 Å²	44	29%	0.289	24%	0.24	S	C	.	.	S	Bend	trans	-143.4	161.3	170.4	-153	-14.5	0	0	0	111.2	K112 I113 K122	K112-D118 HydrophobicContact CB-CB 3.83Å; K112-D118 PolarHBondContact O-N 3.05Å; K112-D118 VanDerWaalsContact O-N 3.09Å; I113-D118 WeakPolarHBondContact CA-O 3.37Å; D118-K122 WeakPolarHBondContact OD1-CD 3.48Å; D118-K122 WeakPolarHBondContact OD1-CE 3.44Å; D118-K122 IonicContact OD1-NZ 2.64Å; D118-K122 PolarHBondContact OD1-NZ 3.21Å; D118-K122 IonicContact OD2-NZ 2.96Å; D118-K122 PolarHBondContact OD2-NZ 3.05Å
119	T	92.9	Very high	95.1	Very high	73 Å²	73	43.4 Å²	43.4	45%	0.448	24%	0.236	S	C	.	.			trans	-91.6	139.5	-179.6	-176	0	0	0	0	112.3	A121 K122	T119-A121 HydrophobicContact CG2-CB 4.33Å; T119-A121 PolarHBondContact O-N 2.84Å; T119-A121 PolarHBondContact OG1-N 3.07Å; T119-K122 HydrophobicContact CG2-CD 4.19Å; T119-K122 HydrophobicContact CG2-CG 3.87Å
120	A	92.9	Very high	95	Very high	5 Å²	5	42.3 Å²	42.3	4%	0.041	22%	0.224	C	C	.	.	T	Hydrogen-bonded Turn	trans	-65.1	-20.3	170.5	0	0	0	0	0	113.2	I113 K122 A194 L196 L214	I113-A120 HydrophobicContact CG2-CB 3.9Å; A120-K122 PolarHBondContact O-N 2.88Å; A120-K122 VanDerWaalsContact O-N 3.16Å; A120-A194 CarbonylContact C-O 3.54Å; A120-A194 WeakPolarHBondContact CB-O 3.36Å; A120-L196 HydrophobicContact CB-CB 4.26Å; A120-L214 HydrophobicContact CB-CD1 3.7Å
121	A	94.2	Very high	94.8	Very high	42 Å²	42	44.4 Å²	44.4	35%	0.347	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-69.4	-14.3	-173.8	0	0	0	0	0	113.9	T119 G193 A194	T119-A121 HydrophobicContact CG2-CB 4.33Å; T119-A121 PolarHBondContact O-N 2.84Å; T119-A121 PolarHBondContact OG1-N 3.07Å; A121-G193 WeakPolarHBondContact O-CA 3.31Å; A121-G193 PolarHBondContact O-N 2.91Å; A121-A194 VanDerWaalsContact CA-O 3.24Å; A121-A194 WeakPolarHBondContact CA-O 3.49Å; A121-A194 PolarHBondContact N-O 3.25Å; A121-A194 VanDerWaalsContact N-O 3.07Å
122	K	94.4	Very high	94.4	Very high	104 Å²	104	46.8 Å²	46.8	45%	0.452	25%	0.248	S	C	.	.	S	Bend	trans	-65.3	168.2	176.2	-74.8	174.6	-179.8	177.4	0	111.5	D118 T119 A120 L124	D118-K122 WeakPolarHBondContact OD1-CD 3.48Å; D118-K122 WeakPolarHBondContact OD1-CE 3.44Å; D118-K122 IonicContact OD1-NZ 2.64Å; D118-K122 PolarHBondContact OD1-NZ 3.21Å; D118-K122 IonicContact OD2-NZ 2.96Å; D118-K122 PolarHBondContact OD2-NZ 3.05Å; T119-K122 HydrophobicContact CG2-CD 4.19Å; T119-K122 HydrophobicContact CG2-CG 3.87Å; A120-K122 PolarHBondContact O-N 2.88Å; A120-K122 VanDerWaalsContact O-N 3.16Å; K122-L124 PolarHBondContact O-N 2.95Å
123	T	96.2	Very high	93.7	Very high	86 Å²	86	44.9 Å²	44.9	53%	0.528	25%	0.245	S	C	.	.			trans	-68.9	123.3	169.9	-50.8	0	0	0	0	109.8	I190 L191 H192	T123-I190 HydrophobicContact CG2-CG2 3.73Å; T123-L191 CarbonylContact C-O 3.58Å; T123-L191 VanDerWaalsContact CA-O 3.31Å; T123-L191 WeakPolarHBondContact CA-O 3.41Å; T123-H192 PolarHBondContact OG1-CD2 2.77Å; T123-H192 VanDerWaalsContact OG1-CD2 3.24Å
124	L	96.4	Very high	92.2	Very high	19 Å²	19	48.3 Å²	48.3	10%	0.099	26%	0.263	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.6	146.6	176.7	-54.4	167.4	0	0	0	109.8	A109 I113 K122 L126 I190 L191	A109-L124 HydrophobicContact CB-CD2 4.19Å; I113-L124 HydrophobicContact CD1-CD1 3.54Å; I113-L124 HydrophobicContact CD1-CD2 3.89Å; I113-L124 HydrophobicContact CD1-CG 4.37Å; K122-L124 PolarHBondContact O-N 2.95Å; L124-L126 HydrophobicContact CB-CG 4.3Å; L124-I190 WeakPolarHBondContact O-CA 3.43Å; L124-L191 HydrophobicContact CB-CD1 3.68Å; L124-L191 HydrophobicContact CB-CD2 4.28Å; L124-L191 HydrophobicContact CB-CG 3.76Å; L124-L191 HydrophobicContact CD1-CD1 3.66Å; L124-L191 HydrophobicContact CG-CD1 4.13Å; L124-L191 PolarHBondContact N-O 2.81Å; L124-L191 PolarHBondContact O-N 3.16Å
125	V	97.2	Very high	90.4	Very high	90 Å²	90	49.8 Å²	49.8	55%	0.545	27%	0.274	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-114.1	109.1	170.2	-176	0	0	0	0	107.4	K188 I189 I190	V125-K188 HydrophobicContact CG1-CB 4.45Å; V125-I189 WeakPolarHBondContact CA-O 3.46Å; V125-I190 HydrophobicContact CG2-CG1 4.24Å
126	L	97.1	Very high	88.1	Confident	3 Å²	3	51.4 Å²	51.4	2%	0.016	29%	0.294	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.8	153.5	-178.2	-59.9	178.8	0	0	0	110.2	I110 L124 L159 T160 D161 K188 I189 L191 L214	I110-L126 HydrophobicContact CD1-CD2 4.05Å; I110-L126 HydrophobicContact CG1-CD2 4.17Å; L124-L126 HydrophobicContact CB-CG 4.3Å; L126-L159 HydrophobicContact CB-CB 4.13Å; L126-L159 HydrophobicContact CB-CD1 4.42Å; L126-L159 HydrophobicContact CD1-CB 3.99Å; L126-L159 HydrophobicContact CD1-CD1 3.91Å; L126-T160 WeakPolarHBondContact CA-O 3.48Å; L126-D161 HydrophobicContact CD2-CB 3.66Å; L126-K188 CarbonylContact O-C 3.57Å; L126-K188 WeakPolarHBondContact O-CA 3.15Å; L126-I189 PolarHBondContact N-O 2.86Å; L126-I189 PolarHBondContact O-N 2.78Å; L126-L191 HydrophobicContact CB-CD2 3.94Å; L126-L191 HydrophobicContact CD1-CD1 4.06Å; L126-L191 HydrophobicContact CD1-CD2 3.77Å; L126-L191 HydrophobicContact CG-CD2 3.8Å; L126-L214 HydrophobicContact CD1-CD2 3.87Å
127	C	97.2	Very high	85.8	Confident	22 Å²	22	53 Å²	53	15%	0.149	31%	0.31	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.1	137	175.8	-173.6	0	0	0	0	109.7	S129 L159 T160 Q187 K188	C127-S129 PolarHBondContact O-N 2.98Å; C127-L159 CarbonylContact O-C 3.55Å; C127-L159 WeakPolarHBondContact O-CA 3.04Å; C127-T160 HydrophobicContact CB-CG2 3.9Å; C127-T160 PolarHBondContact N-O 3.16Å; C127-T160 PolarHBondContact O-N 3.31Å; C127-Q187 CarbonylContact C-O 3.06Å; C127-Q187 WeakPolarHBondContact CA-O 3.38Å; C127-K188 HydrophobicContact CB-CG 4.4Å
128	V	96.3	Very high	83.5	Confident	1 Å²	1	55.1 Å²	55.1	1%	0.006	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.1	111.4	173	-175.6	0	0	0	0	108.8	I157 L159 L183 V185 G186 Q187	V128-I157 HydrophobicContact CG2-CD1 4.36Å; V128-L159 HydrophobicContact CB-CD2 4.39Å; V128-L159 HydrophobicContact CG2-CD2 3.88Å; V128-L183 HydrophobicContact CG2-CD1 3.8Å; V128-L183 HydrophobicContact CG2-CG 4.25Å; V128-V185 HydrophobicContact CG1-CG2 4.37Å; V128-V185 WeakPolarHBondContact O-CA 3.41Å; V128-G186 PolarHBondContact O-N 3.04Å; V128-Q187 PolarHBondContact N-O 3.04Å
129	S	94.7	Very high	81	Confident	0 Å²	0	57.8 Å²	57.8	0%	0	34%	0.342	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.4	-32.5	176.5	54.8	0	0	0	0	112.2	S15 C127 E158 V185	S15-S129 WeakPolarHBondContact CB-O 3.39Å; S15-S129 PolarHBondContact OG-O 3.36Å; C127-S129 PolarHBondContact O-N 2.98Å; S129-E158 WeakPolarHBondContact CB-OE2 3.49Å; S129-E158 PolarHBondContact N-O 2.88Å; S129-E158 WeakPolarHBondContact OG-CB 3.42Å; S129-E158 VanDerWaalsContact OG-CD 3.22Å; S129-E158 WeakPolarHBondContact OG-CG 3.33Å; S129-E158 PolarHBondContact OG-O 2.89Å; S129-E158 PolarHBondContact OG-OE2 3.16Å; S129-V185 WeakPolarHBondContact O-CG1 3.45Å
130	D	93.6	Very high	78.8	Confident	20 Å²	20	63.5 Å²	63.5	11%	0.107	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-153.8	160.7	179.5	-165.9	29.9	0	0	0	113.5	K16 I157 E158	K16-D130 WeakPolarHBondContact CE-OD1 3.5Å; K16-D130 WeakPolarHBondContact CE-OD2 3.44Å; K16-D130 IonicContact NZ-OD1 2.79Å; K16-D130 PolarHBondContact NZ-OD1 3.42Å; K16-D130 IonicContact NZ-OD2 3.38Å; K16-D130 PolarHBondContact NZ-OD2 3.01Å; D130-I157 CarbonylContact O-C 3.57Å; D130-I157 WeakPolarHBondContact O-CA 3.27Å; D130-I157 WeakPolarHBondContact O-CB 3.44Å; D130-E158 HydrophobicContact CB-CB 3.71Å; D130-E158 PolarHBondContact N-O 3.17Å; D130-E158 PolarHBondContact O-N 3.14Å
131	I	91.4	Very high	76	Confident	49 Å²	49	69.3 Å²	69.3	25%	0.251	40%	0.399	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.8	105	171.8	-59.6	164.8	0	0	0	106.7	L134 I157 L178 V185	I131-L134 HydrophobicContact CG2-CD1 3.21Å; I131-I157 HydrophobicContact CG1-CG2 4.32Å; I131-I157 HydrophobicContact CG2-CG2 4.43Å; I131-L178 HydrophobicContact CD1-CD1 3.79Å; I131-L178 HydrophobicContact CG1-CD1 4.14Å; I131-L178 HydrophobicContact CG2-CD1 4.49Å; I131-L178 HydrophobicContact CG2-CD2 4.26Å; I131-V185 HydrophobicContact CD1-CG2 4.04Å; I131-V185 HydrophobicContact CG1-CG2 4.03Å
132	I	87.1	Confident	73.7	Confident	80 Å²	80	72.2 Å²	72.2	41%	0.41	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.3	-51.8	-168.7	-61.7	169.7	0	0	0	110.8	I156 E158 K167	I132-I156 HydrophobicContact CD1-CG2 4.22Å; I132-I156 PolarHBondContact N-O 2.87Å; I132-E158 HydrophobicContact CD1-CB 4.18Å; I132-K167 HydrophobicContact CD1-CD 4.27Å; I132-K167 HydrophobicContact CD1-CG 3.94Å
133	S	79.7	Confident	71.1	Confident	40 Å²	40	72.8 Å²	72.8	28%	0.28	43%	0.434	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.4	117.3	-178.4	59.2	0	0	0	0	111.4	A155 I156	S133-A155 VanDerWaalsContact O-CA 3.31Å; S133-A155 WeakPolarHBondContact O-CA 3.47Å; S133-A155 WeakPolarHBondContact O-CB 3.4Å; S133-I156 PolarHBondContact N-O 2.95Å; S133-I156 VanDerWaalsContact N-O 3.15Å; S133-I156 PolarHBondContact O-N 3.18Å; S133-I156 WeakPolarHBondContact OG-CB 3.28Å; S133-I156 PolarHBondContact OG-N 2.95Å; S133-I156 VanDerWaalsContact OG-N 3.16Å
134	L	64.3	Low	68.4	Low	83 Å²	83	75.8 Å²	75.8	44%	0.435	45%	0.446	S	S	.	.			trans	-104	115.7	154.7	-97.1	88.4	0	0	0	106.8	I131 A136 L178 K179	I131-L134 HydrophobicContact CG2-CD1 3.21Å; L134-A136 PolarHBondContact O-N 3.05Å; L134-L178 HydrophobicContact CD1-CD2 3.81Å; L134-L178 HydrophobicContact CD1-CG 4.31Å; L134-L178 HydrophobicContact CG-CD2 4.38Å; L134-K179 HydrophobicContact CD2-CG 4.36Å
135	S	55.9	Low	65.8	Low	35 Å²	35	83.9 Å²	83.9	25%	0.245	48%	0.481	C	S	.	.			trans	-70.5	83.6	164.7	49.9	0	0	0	0	109	N137 K153	S135-N137 PolarHBondContact O-N 3.48Å; S135-N137 VanDerWaalsContact O-N 3.15Å; S135-K153 PolarHBondContact O-NZ 3.2Å; S135-K153 WeakPolarHBondContact OG-CB 3.44Å; S135-K153 VanDerWaalsContact OG-CG 3.26Å; S135-K153 WeakPolarHBondContact OG-CG 3.26Å
136	A	46.7	Very low	63.1	Low	72 Å²	72	85.6 Å²	85.6	60%	0.595	49%	0.492	S	S	*	.			trans	-56.8	116.9	169.3	0	0	0	0	0	108.5	L134 I138	L134-A136 PolarHBondContact O-N 3.05Å; A136-I138 HydrophobicContact CB-CG1 4.46Å
137	N	44.8	Very low	60.3	Low	131 Å²	131	91.3 Å²	91.3	70%	0.701	53%	0.532	S	S	*	.			trans	-83.4	104.2	151.2	-89.5	-17.9	0	0	0	105.1	S135 K153	S135-N137 PolarHBondContact O-N 3.48Å; S135-N137 VanDerWaalsContact O-N 3.15Å; N137-K153 WeakPolarHBondContact ND2-CE 3.38Å; N137-K153 WeakPolarHBondContact OD1-CE 3.31Å; N137-K153 PolarHBondContact OD1-NZ 3.13Å
138	I	46.7	Very low	57.6	Low	148 Å²	148	96.1 Å²	96.1	76%	0.759	57%	0.566	S	S	*	*			trans	-119.1	124.7	157.9	-64.1	177.7	0	0	0	106.8	A136	A136-I138 HydrophobicContact CB-CG1 4.46Å
139	S	41.6	Very low	54.8	Low	110 Å²	110	99.9 Å²	99.9	77%	0.769	60%	0.597	S	S	*	*			trans	68.8	108.1	172.9	55.4	0	0	0	0	119.9
140	E	46.3	Very low	52.1	Low	193 Å²	193	107.8 Å²	107.8	90%	0.902	64%	0.639	S	S	*	*			trans	-51.5	128.8	139.4	-59.7	178	133.7	0	0	109.7
141	T	35.3	Very low	49.8	Very low	127 Å²	127	113 Å²	113	78%	0.779	67%	0.672	S	S	*	*			trans	-165.3	100.2	140	-67.5	0	0	0	0	108.2
142	S	45.7	Very low	48.1	Very low	104 Å²	104	118.5 Å²	118.5	73%	0.727	70%	0.697	S	S	*	*			trans	38.9	113.5	150.4	56.6	0	0	0	0	121.3
143	S	38.8	Very low	46.9	Very low	115 Å²	115	118.1 Å²	118.1	80%	0.804	69%	0.692	S	S	*	*				171.6	116.7	104	58.7	0	0	0	0	113.5
144	N	39.5	Very low	46.4	Very low	149 Å²	149	118.5 Å²	118.5	80%	0.797	69%	0.693	S	S	*	*			trans	27.9	125.3	150.7	-69.2	-18.1	0	0	0	123.9
145	K	42.7	Very low	47.5	Very low	189 Å²	189	114.5 Å²	114.5	82%	0.822	67%	0.672	S	S	*	*			trans	59.6	130.4	142.4	-68	-175.4	-179	-179.6	0	116.7
146	T	39.1	Very low	49.2	Very low	127 Å²	127	114.4 Å²	114.4	78%	0.779	67%	0.668	S	S	*	*			cis	-174	121.7	18.7	23.2	0	0	0	0	107
147	S	39	Very low	51.5	Low	122 Å²	122	111 Å²	111	85%	0.853	64%	0.64	S	S	*	*			trans	176.4	126.4	140.5	51.1	0	0	0	0	109.3	A149	S147-A149 PolarHBondContact O-N 3.26Å
148	S	41.3	Very low	53.9	Low	124 Å²	124	106.3 Å²	106.3	87%	0.867	61%	0.614	S	S	*	*			trans	-69.8	112.1	178.9	48.7	0	0	0	0	111.6
149	A	36.3	Very low	56.2	Low	80 Å²	80	99.5 Å²	99.5	66%	0.661	58%	0.579	S	S	*	*			trans	-151.9	107.5	146	0	0	0	0	0	106.3	S147 T151	S147-A149 PolarHBondContact O-N 3.26Å; A149-T151 VanDerWaalsContact C-N 3.29Å; A149-T151 PolarHBondContact O-N 3.29Å; A149-T151 PolarHBondContact O-OG1 3.49Å
150	D	38.9	Very low	58.8	Low	165 Å²	165	94.5 Å²	94.5	88%	0.882	54%	0.544	S	S	*	.			trans	-51.7	96.7	169.5	-87.5	-32	0	0	0	108.3	Q152	D150-Q152 PolarHBondContact O-N 2.73Å
151	T	45.3	Very low	61.1	Low	130 Å²	130	86.9 Å²	86.9	80%	0.798	51%	0.509	S	S	*	.			trans	-75.5	81.1	171.3	6	0	0	0	0	105.4	A149 K153	A149-T151 VanDerWaalsContact C-N 3.29Å; A149-T151 PolarHBondContact O-N 3.29Å; A149-T151 PolarHBondContact O-OG1 3.49Å; T151-K153 PolarHBondContact O-N 3.42Å
152	Q	54.9	Low	63.9	Low	164 Å²	164	82.3 Å²	82.3	77%	0.766	49%	0.487	S	S	*	.			trans	-47.9	115.2	168.9	-89	-172.4	-11.8	0	0	107	D150 V154	D150-Q152 PolarHBondContact O-N 2.73Å; Q152-V154 VanDerWaalsContact C-N 3.26Å; Q152-V154 PolarHBondContact O-N 2.79Å
153	K	62.2	Low	66.1	Low	73 Å²	73	80 Å²	80	32%	0.317	46%	0.463	S	S	.	.			trans	-68.3	87.9	178.9	-83.2	179.9	176.2	-98.6	0	108.9	S135 N137 T151 L175	S135-K153 PolarHBondContact O-NZ 3.2Å; S135-K153 WeakPolarHBondContact OG-CB 3.44Å; S135-K153 VanDerWaalsContact OG-CG 3.26Å; S135-K153 WeakPolarHBondContact OG-CG 3.26Å; N137-K153 WeakPolarHBondContact ND2-CE 3.38Å; N137-K153 WeakPolarHBondContact OD1-CE 3.31Å; N137-K153 PolarHBondContact OD1-NZ 3.13Å; T151-K153 PolarHBondContact O-N 3.42Å; K153-L175 WeakPolarHBondContact O-CD2 3.5Å
154	V	70.1	Confident	68.7	Low	47 Å²	47	75.4 Å²	75.4	29%	0.285	43%	0.428	S	S	.	.			trans	-80.5	126.8	173.6	-179.8	0	0	0	0	108.2	Q152 I156 Q169	Q152-V154 VanDerWaalsContact C-N 3.26Å; Q152-V154 PolarHBondContact O-N 2.79Å; V154-I156 HydrophobicContact CG1-CG1 4.17Å; V154-Q169 HydrophobicContact CG1-CB 4.19Å; V154-Q169 HydrophobicContact CG1-CG 3.56Å; V154-Q169 VanDerWaalsContact CG2-NE2 3.34Å
155	A	85.8	Confident	71.3	Confident	0 Å²	0	69.4 Å²	69.4	0%	0	40%	0.399	C	S	.	.			trans	-98.6	135	166.5	0	0	0	0	0	109.2	S133 L170 L175 L178	S133-A155 VanDerWaalsContact O-CA 3.31Å; S133-A155 WeakPolarHBondContact O-CA 3.47Å; S133-A155 WeakPolarHBondContact O-CB 3.4Å; A155-L170 HydrophobicContact CB-CB 4.49Å; A155-L170 HydrophobicContact CB-CD1 4.4Å; A155-L170 PolarHBondContact O-N 3.08Å; A155-L175 HydrophobicContact CB-CD1 3.41Å; A155-L175 VanDerWaalsContact CB-CD1 3.41Å; A155-L175 HydrophobicContact CB-CG 4.41Å; A155-L178 HydrophobicContact CB-CD2 4.34Å
156	I	92.3	Very high	73.7	Confident	33 Å²	33	61 Å²	61	17%	0.169	36%	0.364	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.6	179.1	-55.5	172.4	0	0	0	108	I132 S133 V154 K167 A168 M213	I132-I156 HydrophobicContact CD1-CG2 4.22Å; I132-I156 PolarHBondContact N-O 2.87Å; S133-I156 PolarHBondContact N-O 2.95Å; S133-I156 VanDerWaalsContact N-O 3.15Å; S133-I156 PolarHBondContact O-N 3.18Å; S133-I156 WeakPolarHBondContact OG-CB 3.28Å; S133-I156 PolarHBondContact OG-N 2.95Å; S133-I156 VanDerWaalsContact OG-N 3.16Å; V154-I156 HydrophobicContact CG1-CG1 4.17Å; I156-K167 HydrophobicContact CG2-CB 3.99Å; I156-K167 HydrophobicContact CG2-CG 4.38Å; I156-A168 WeakPolarHBondContact CA-O 3.44Å; I156-M213 HydrophobicContact CD1-CE 3.83Å; I156-M213 HydrophobicContact CD1-SD 4.02Å; I156-M213 HydrophobicContact CG1-SD 4.44Å
157	I	94.7	Very high	76.4	Confident	0 Å²	0	57.9 Å²	57.9	0%	0	34%	0.339	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	162.3	171.6	64.4	169.3	0	0	0	109.6	V128 D130 I131 L159 K167 A168 L170 L178 L183	V128-I157 HydrophobicContact CG2-CD1 4.36Å; D130-I157 CarbonylContact O-C 3.57Å; D130-I157 WeakPolarHBondContact O-CA 3.27Å; D130-I157 WeakPolarHBondContact O-CB 3.44Å; I131-I157 HydrophobicContact CG1-CG2 4.32Å; I131-I157 HydrophobicContact CG2-CG2 4.43Å; I157-L159 HydrophobicContact CD1-CD2 3.61Å; I157-L159 HydrophobicContact CD1-CG 4.13Å; I157-L159 HydrophobicContact CG1-CD2 4.23Å; I157-L159 HydrophobicContact CG1-CG 4.3Å; I157-K167 CarbonylContact O-C 3.57Å; I157-K167 WeakPolarHBondContact O-CA 3.27Å; I157-A168 HydrophobicContact CG1-CB 4.09Å; I157-A168 PolarHBondContact N-O 2.86Å; I157-A168 PolarHBondContact O-N 3.31Å; I157-L170 HydrophobicContact CD1-CD1 4.28Å; I157-L170 HydrophobicContact CD1-CD2 3.7Å; I157-L170 HydrophobicContact CD1-CG 4.28Å; I157-L170 HydrophobicContact CG1-CD1 4.42Å; I157-L170 HydrophobicContact CG1-CD2 3.97Å; I157-L170 HydrophobicContact CG1-CG 4.18Å; I157-L170 HydrophobicContact CG2-CD1 3.84Å; I157-L170 HydrophobicContact CG2-CG 4.35Å; I157-L178 HydrophobicContact CG2-CD2 4.05Å; I157-L183 HydrophobicContact CD1-CD2 4.18Å
158	E	95.2	Very high	79	Confident	33 Å²	33	52.3 Å²	52.3	15%	0.154	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103	129.3	171.7	-165.7	-169.3	-130.8	0	0	108.6	R63 S129 D130 I132 A165	R63-E158 IonicContact CZ-OE2 3.15Å; R63-E158 IonicContact NH1-OE1 3.05Å; R63-E158 PolarHBondContact NH1-OE1 2.69Å; R63-E158 IonicContact NH1-OE2 3.97Å; R63-E158 PolarHBondContact NH1-OE2 3.05Å; R63-E158 IonicContact NH2-OE2 3.32Å; R63-E158 PolarHBondContact NH2-OE2 3.31Å; S129-E158 WeakPolarHBondContact CB-OE2 3.49Å; S129-E158 PolarHBondContact N-O 2.88Å; S129-E158 WeakPolarHBondContact OG-CB 3.42Å; S129-E158 VanDerWaalsContact OG-CD 3.22Å; S129-E158 WeakPolarHBondContact OG-CG 3.33Å; S129-E158 PolarHBondContact OG-O 2.89Å; S129-E158 PolarHBondContact OG-OE2 3.16Å; D130-E158 HydrophobicContact CB-CB 3.71Å; D130-E158 PolarHBondContact N-O 3.17Å; D130-E158 PolarHBondContact O-N 3.14Å; I132-E158 HydrophobicContact CD1-CB 4.18Å; E158-A165 HydrophobicContact CG-CB 3.8Å
159	L	96	Very high	81.4	Confident	5 Å²	5	48.5 Å²	48.5	3%	0.026	27%	0.269	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.9	139	178.6	-64.5	-177.6	0	0	0	109.9	L126 C127 V128 I157 A165 V166 A168 I189 L214	L126-L159 HydrophobicContact CB-CB 4.13Å; L126-L159 HydrophobicContact CB-CD1 4.42Å; L126-L159 HydrophobicContact CD1-CB 3.99Å; L126-L159 HydrophobicContact CD1-CD1 3.91Å; C127-L159 CarbonylContact O-C 3.55Å; C127-L159 WeakPolarHBondContact O-CA 3.04Å; V128-L159 HydrophobicContact CB-CD2 4.39Å; V128-L159 HydrophobicContact CG2-CD2 3.88Å; I157-L159 HydrophobicContact CD1-CD2 3.61Å; I157-L159 HydrophobicContact CD1-CG 4.13Å; I157-L159 HydrophobicContact CG1-CD2 4.23Å; I157-L159 HydrophobicContact CG1-CG 4.3Å; L159-A165 CarbonylContact O-C 3.44Å; L159-A165 WeakPolarHBondContact O-CA 3.45Å; L159-V166 HydrophobicContact CB-CG1 4.47Å; L159-V166 PolarHBondContact N-O 2.91Å; L159-V166 PolarHBondContact O-N 3.3Å; L159-A168 HydrophobicContact CD1-CB 3.51Å; L159-A168 HydrophobicContact CG-CB 3.84Å; L159-I189 HydrophobicContact CD1-CD1 3.99Å; L159-I189 HydrophobicContact CD2-CD1 3.78Å; L159-I189 HydrophobicContact CD2-CG1 4.42Å; L159-L214 HydrophobicContact CD1-CD2 4.38Å
160	T	95.7	Very high	84.1	Confident	4 Å²	4	45.4 Å²	45.4	3%	0.025	24%	0.241	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.4	141.9	177.3	-179	0	0	0	0	112.3	W64 W67 L126 C127 G162 Y164	W64-T160 HydrophobicContact CE3-CG2 4.1Å; W64-T160 HydrophobicContact CH2-CG2 4.2Å; W64-T160 HydrophobicContact CZ3-CG2 3.83Å; W67-T160 HydrophobicContact CZ3-CG2 4.32Å; L126-T160 WeakPolarHBondContact CA-O 3.48Å; C127-T160 HydrophobicContact CB-CG2 3.9Å; C127-T160 PolarHBondContact N-O 3.16Å; C127-T160 PolarHBondContact O-N 3.31Å; T160-G162 PolarHBondContact OG1-N 3.02Å; T160-Y164 VanDerWaalsContact CA-O 3.22Å; T160-Y164 WeakPolarHBondContact CA-O 3.15Å; T160-Y164 VanDerWaalsContact CB-O 3.29Å; T160-Y164 WeakPolarHBondContact CB-O 3.36Å; T160-Y164 PolarHBondContact OG1-O 3.01Å
161	D	95.4	Very high	86.5	Confident	34 Å²	34	40.9 Å²	40.9	18%	0.182	22%	0.217	C	C	.	.			trans	-88.8	7.3	167.5	68.6	-6.1	0	0	0	112.4	S108 A109 I110 L126 W163 Y164	S108-D161 WeakPolarHBondContact CB-OD2 3.37Å; S108-D161 PolarHBondContact OG-OD2 3.36Å; A109-D161 PolarHBondContact N-OD2 3.13Å; A109-D161 VanDerWaalsContact N-OD2 3.09Å; I110-D161 HydrophobicContact CD1-CB 3.87Å; I110-D161 HydrophobicContact CG1-CB 3.96Å; I110-D161 PolarHBondContact N-OD2 3.25Å; L126-D161 HydrophobicContact CD2-CB 3.66Å; D161-W163 VanDerWaalsContact C-N 3.35Å; D161-W163 PolarHBondContact OD1-N 3.49Å; D161-Y164 PolarHBondContact N-O 3.38Å; D161-Y164 PolarHBondContact OD1-N 2.89Å
162	G	92.9	Very high	88.6	Confident	31 Å²	31	39.6 Å²	39.6	32%	0.32	21%	0.211	S	C	.	.	S	Bend	trans	88.2	-7.8	-175.6	0	0	0	0	0	114.1	W64 R97 T160	W64-G162 WeakPolarHBondContact CB-O 3.15Å; R97-G162 PolarHBondContact NH2-O 2.84Å; T160-G162 PolarHBondContact OG1-N 3.02Å
163	W	92.6	Very high	90.2	Very high	56 Å²	56	35.8 Å²	35.8	21%	0.212	20%	0.201	C	C	.	.	S	Bend	trans	-111	-49.6	174	-69.9	73.2	0	0	0	111.1	W64 Y96 R97 T100 E101 D161	W64-W163 PolarHBondContact NE1-O 3.48Å; W64-W163 VanDerWaalsContact NE1-O 3.11Å; Y96-W163 HydrophobicContact CE1-CH2 4.46Å; Y96-W163 HydrophobicContact CE1-CZ2 4.28Å; R97-W163 HydrophobicContact CB-CE3 4.49Å; R97-W163 HydrophobicContact CB-CH2 4.03Å; R97-W163 HydrophobicContact CB-CZ3 3.66Å; R97-W163 HydrophobicContact CG-CE3 4.07Å; R97-W163 HydrophobicContact CG-CH2 3.7Å; R97-W163 HydrophobicContact CG-CZ2 4.39Å; R97-W163 HydrophobicContact CG-CZ3 3.51Å; T100-W163 HydrophobicContact CG2-CH2 3.81Å; T100-W163 HydrophobicContact CG2-CZ2 4.2Å; E101-W163 HydrophobicContact CB-CZ3 4Å; D161-W163 VanDerWaalsContact C-N 3.35Å; D161-W163 PolarHBondContact OD1-N 3.49Å
164	Y	93.4	Very high	91.5	Very high	17 Å²	17	36 Å²	36	7%	0.067	21%	0.205	C	C	.	.			trans	-127.5	170.3	179.8	-64.8	-73	0	0	0	110.2	E101 S108 I110 K111 T160 D161 P205 L206	E101-Y164 WeakPolarHBondContact OE1-CE2 3.22Å; E101-Y164 PolarHBondContact OE1-OH 2.92Å; E101-Y164 PolarHBondContact OE2-OH 3.5Å; S108-Y164 WeakPolarHBondContact OG-CD2 3.06Å; I110-Y164 WeakPolarHBondContact CD1-O 3.42Å; K111-Y164 HydrophobicContact CB-CD2 3.98Å; K111-Y164 HydrophobicContact CB-CE2 3.97Å; K111-Y164 HydrophobicContact CD-CD2 4.47Å; K111-Y164 HydrophobicContact CD-CE2 3.65Å; K111-Y164 HydrophobicContact CG-CE2 4.34Å; K111-Y164 PolarHBondContact NZ-OH 3.24Å; T160-Y164 VanDerWaalsContact CA-O 3.22Å; T160-Y164 WeakPolarHBondContact CA-O 3.15Å; T160-Y164 VanDerWaalsContact CB-O 3.29Å; T160-Y164 WeakPolarHBondContact CB-O 3.36Å; T160-Y164 PolarHBondContact OG1-O 3.01Å; D161-Y164 PolarHBondContact N-O 3.38Å; D161-Y164 PolarHBondContact OD1-N 2.89Å; Y164-P205 HydrophobicContact CD1-CB 3.5Å; Y164-P205 HydrophobicContact CD1-CG 4.1Å; Y164-P205 HydrophobicContact CD2-CB 4.27Å; Y164-P205 HydrophobicContact CD2-CG 4.03Å; Y164-P205 HydrophobicContact CE1-CB 4.07Å; Y164-P205 HydrophobicContact CE1-CG 4.42Å; Y164-P205 HydrophobicContact CE2-CG 4.37Å; Y164-P205 HydrophobicContact CG-CB 3.59Å; Y164-P205 HydrophobicContact CG-CG 3.86Å; Y164-L206 HydrophobicContact CD1-CD2 4.26Å; Y164-L206 HydrophobicContact CE1-CD1 4.45Å; Y164-L206 HydrophobicContact CE1-CD2 4.04Å; Y164-L206 HydrophobicContact CE1-CG 3.97Å
165	A	93.5	Very high	92.5	Very high	24 Å²	24	34.4 Å²	34.4	20%	0.198	19%	0.194	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-125.1	152.3	173.8	0	0	0	0	0	110.7	W64 E158 L159	W64-A165 HydrophobicContact CH2-CB 3.95Å; W64-A165 HydrophobicContact CZ2-CB 3.54Å; E158-A165 HydrophobicContact CG-CB 3.8Å; L159-A165 CarbonylContact O-C 3.44Å; L159-A165 WeakPolarHBondContact O-CA 3.45Å
166	V	94	Very high	92.6	Very high	13 Å²	13	36.5 Å²	36.5	8%	0.079	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-137.5	141.6	175.6	68.5	0	0	0	0	108.8	I110 L159 L212 L214	I110-V166 HydrophobicContact CD1-CB 4.41Å; I110-V166 HydrophobicContact CD1-CG1 3.94Å; I110-V166 HydrophobicContact CG1-CG1 4.32Å; I110-V166 HydrophobicContact CG2-CB 4.3Å; L159-V166 HydrophobicContact CB-CG1 4.47Å; L159-V166 PolarHBondContact N-O 2.91Å; L159-V166 PolarHBondContact O-N 3.3Å; V166-L212 HydrophobicContact CG2-CD2 3.98Å; V166-L214 HydrophobicContact CG1-CB 4.34Å
167	K	94.3	Very high	92.6	Very high	60 Å²	60	37.1 Å²	37.1	26%	0.261	22%	0.217	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-70.1	140	171.7	-68	179	-175.1	171.7	0	108.7	I132 I156 I157 E210 M213 L214	I132-K167 HydrophobicContact CD1-CD 4.27Å; I132-K167 HydrophobicContact CD1-CG 3.94Å; I156-K167 HydrophobicContact CG2-CB 3.99Å; I156-K167 HydrophobicContact CG2-CG 4.38Å; I157-K167 CarbonylContact O-C 3.57Å; I157-K167 WeakPolarHBondContact O-CA 3.27Å; K167-E210 IonicContact NZ-OE1 2.76Å; K167-M213 HydrophobicContact CB-CG 4.06Å; K167-M213 CarbonylContact O-C 3.54Å; K167-M213 VanDerWaalsContact O-CA 3.24Å; K167-M213 WeakPolarHBondContact O-CA 3.41Å; K167-L214 PolarHBondContact O-N 3.29Å
168	A	94.1	Very high	92.3	Very high	5 Å²	5	37.7 Å²	37.7	4%	0.041	22%	0.22	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-127.1	130.9	177.4	0	0	0	0	0	110.9	I156 I157 L159 L214	I156-A168 WeakPolarHBondContact CA-O 3.44Å; I157-A168 HydrophobicContact CG1-CB 4.09Å; I157-A168 PolarHBondContact N-O 2.86Å; I157-A168 PolarHBondContact O-N 3.31Å; L159-A168 HydrophobicContact CD1-CB 3.51Å; L159-A168 HydrophobicContact CG-CB 3.84Å; A168-L214 CarbonylContact C-O 3.47Å; A168-L214 WeakPolarHBondContact CA-O 3.46Å; A168-L214 HydrophobicContact CB-CB 4.15Å
169	Q	92.8	Very high	92	Very high	45 Å²	45	41.4 Å²	41.4	21%	0.21	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-85.3	122.1	173.1	161.9	161.8	16.6	0	0	109	V154 L214 K215	V154-Q169 HydrophobicContact CG1-CB 4.19Å; V154-Q169 HydrophobicContact CG1-CG 3.56Å; V154-Q169 VanDerWaalsContact CG2-NE2 3.34Å; Q169-L214 PolarHBondContact N-O 3.49Å; Q169-K215 HydrophobicContact CG-CG 4.34Å
170	L	91.6	Very high	91.7	Very high	15 Å²	15	47 Å²	47	8%	0.079	27%	0.266	C	S	.	.	P	Polyproline II helix	trans	-84.5	142.8	176.7	-61.9	-174.5	0	0	0	112	A155 I157 L174 L178 L183	A155-L170 HydrophobicContact CB-CB 4.49Å; A155-L170 HydrophobicContact CB-CD1 4.4Å; A155-L170 PolarHBondContact O-N 3.08Å; I157-L170 HydrophobicContact CD1-CD1 4.28Å; I157-L170 HydrophobicContact CD1-CD2 3.7Å; I157-L170 HydrophobicContact CD1-CG 4.28Å; I157-L170 HydrophobicContact CG1-CD1 4.42Å; I157-L170 HydrophobicContact CG1-CD2 3.97Å; I157-L170 HydrophobicContact CG1-CG 4.18Å; I157-L170 HydrophobicContact CG2-CD1 3.84Å; I157-L170 HydrophobicContact CG2-CG 4.35Å; L170-L174 HydrophobicContact CB-CB 4.14Å; L170-L174 HydrophobicContact CD1-CB 4.43Å; L170-L174 HydrophobicContact CD2-CB 4.01Å; L170-L174 HydrophobicContact CD2-CD1 4.06Å; L170-L174 HydrophobicContact CG-CB 4.43Å; L170-L178 HydrophobicContact CD1-CB 4.34Å; L170-L178 HydrophobicContact CD1-CD2 3.75Å; L170-L183 HydrophobicContact CD1-CD2 4.4Å
171	D	89.8	Confident	91.4	Very high	70 Å²	70	49.1 Å²	49.1	37%	0.374	29%	0.288	S	S	.	.	P	Polyproline II helix	trans	-76.3	167.4	167.3	71.6	1.6	0	0	0	111.3	P173 L174 L175	D171-P173 WeakPolarHBondContact OD1-CD 3.49Å; D171-L174 PolarHBondContact O-N 3.23Å; D171-L174 WeakPolarHBondContact OD1-CB 3.26Å; D171-L174 WeakPolarHBondContact OD1-CD1 3.35Å; D171-L174 WeakPolarHBondContact OD1-CG 3.08Å; D171-L174 PolarHBondContact OD1-N 3.23Å; D171-L175 WeakPolarHBondContact O-CB 3.46Å; D171-L175 PolarHBondContact O-N 3.25Å
172	P	88.9	Confident	91.2	Very high	103 Å²	103	56.3 Å²	56.3	67%	0.669	31%	0.313	S	S	*	.	H	α-helix	trans	-58.2	-40.4	-178.9	-23	32.7	0	0	0	114.6	L175 A176	P172-L175 PolarHBondContact O-N 3.37Å; P172-A176 PolarHBondContact O-N 3.17Å
173	P	89.3	Confident	91.2	Very high	84 Å²	84	55.5 Å²	55.5	55%	0.545	30%	0.301	S	S	.	.	H	α-helix	trans	-60.4	-48	173.2	-25.6	35.1	0	0	0	113.9	D171 L175 A176 V177	D171-P173 WeakPolarHBondContact OD1-CD 3.49Å; P173-L175 VanDerWaalsContact C-N 3.29Å; P173-L175 PolarHBondContact O-N 2.98Å; P173-A176 WeakPolarHBondContact O-CB 3.32Å; P173-A176 PolarHBondContact O-N 3.19Å; P173-A176 VanDerWaalsContact O-N 3.12Å; P173-V177 WeakPolarHBondContact O-CG2 3.37Å; P173-V177 PolarHBondContact O-N 3.2Å
174	L	89.6	Confident	91.2	Very high	77 Å²	77	55.6 Å²	55.6	40%	0.403	31%	0.308	S	S	.	.	H	α-helix	trans	-66.4	-34.3	178.5	-69.3	171	0	0	0	111.5	L170 D171 A176 V177 L178	L170-L174 HydrophobicContact CB-CB 4.14Å; L170-L174 HydrophobicContact CD1-CB 4.43Å; L170-L174 HydrophobicContact CD2-CB 4.01Å; L170-L174 HydrophobicContact CD2-CD1 4.06Å; L170-L174 HydrophobicContact CG-CB 4.43Å; D171-L174 PolarHBondContact O-N 3.23Å; D171-L174 WeakPolarHBondContact OD1-CB 3.26Å; D171-L174 WeakPolarHBondContact OD1-CD1 3.35Å; D171-L174 WeakPolarHBondContact OD1-CG 3.08Å; D171-L174 PolarHBondContact OD1-N 3.23Å; L174-A176 VanDerWaalsContact C-N 3.32Å; L174-A176 PolarHBondContact O-N 3.3Å; L174-V177 PolarHBondContact O-N 3.21Å; L174-L178 WeakPolarHBondContact O-CB 3.4Å; L174-L178 PolarHBondContact O-N 3.48Å
175	L	89.9	Confident	91.3	Very high	13 Å²	13	57.5 Å²	57.5	7%	0.068	32%	0.321	C	S	.	.	H	α-helix	trans	-61.4	-40	171.3	177.7	54.2	0	0	0	112	K153 A155 D171 P172 P173 L178 K179	K153-L175 WeakPolarHBondContact O-CD2 3.5Å; A155-L175 HydrophobicContact CB-CD1 3.41Å; A155-L175 VanDerWaalsContact CB-CD1 3.41Å; A155-L175 HydrophobicContact CB-CG 4.41Å; D171-L175 WeakPolarHBondContact O-CB 3.46Å; D171-L175 PolarHBondContact O-N 3.25Å; P172-L175 PolarHBondContact O-N 3.37Å; P173-L175 VanDerWaalsContact C-N 3.29Å; P173-L175 PolarHBondContact O-N 2.98Å; L175-L178 HydrophobicContact CD1-CD2 4.48Å; L175-L178 PolarHBondContact O-N 2.79Å; L175-K179 HydrophobicContact CD1-CD 4.35Å; L175-K179 HydrophobicContact CD1-CG 4.22Å; L175-K179 HydrophobicContact CG-CD 4.35Å; L175-K179 WeakPolarHBondContact O-CB 3.36Å; L175-K179 WeakPolarHBondContact O-CG 3.34Å; L175-K179 PolarHBondContact O-N 3.33Å
176	A	88.9	Confident	91.3	Very high	45 Å²	45	58.2 Å²	58.2	37%	0.372	33%	0.331	S	S	.	.	H	α-helix	trans	-64.8	-40.4	174.7	0	0	0	0	0	111.6	P172 P173 L174 L178 K179 N180	P172-A176 PolarHBondContact O-N 3.17Å; P173-A176 WeakPolarHBondContact O-CB 3.32Å; P173-A176 PolarHBondContact O-N 3.19Å; P173-A176 VanDerWaalsContact O-N 3.12Å; L174-A176 VanDerWaalsContact C-N 3.32Å; L174-A176 PolarHBondContact O-N 3.3Å; A176-L178 VanDerWaalsContact C-N 3.34Å; A176-L178 PolarHBondContact O-N 3.4Å; A176-K179 PolarHBondContact O-N 2.82Å; A176-N180 WeakPolarHBondContact O-CB 3.48Å; A176-N180 PolarHBondContact O-N 3.34Å; A176-N180 PolarHBondContact O-ND2 3.11Å
177	V	91.1	Very high	91.4	Very high	46 Å²	46	61.2 Å²	61.2	28%	0.279	34%	0.344	S	S	.	.	H	α-helix	trans	-62.5	-41.2	175.3	178	0	0	0	0	111.3	P173 L174 N180 G181 R182 L183	P173-V177 WeakPolarHBondContact O-CG2 3.37Å; P173-V177 PolarHBondContact O-N 3.2Å; L174-V177 PolarHBondContact O-N 3.21Å; V177-N180 PolarHBondContact O-N 3.27Å; V177-G181 PolarHBondContact O-N 3.24Å; V177-R182 HydrophobicContact CG1-CB 3.63Å; V177-R182 PolarHBondContact O-N 3.46Å; V177-L183 HydrophobicContact CG1-CB 4.06Å; V177-L183 PolarHBondContact O-N 2.98Å
178	L	90.1	Very high	91.5	Very high	11 Å²	11	66.2 Å²	66.2	6%	0.058	37%	0.366	C	S	.	.	H	α-helix	trans	-63.2	-48.1	174.5	-176.7	66.1	0	0	0	111.7	I131 L134 A155 I157 L170 L174 L175 A176 N180 G181 L183	I131-L178 HydrophobicContact CD1-CD1 3.79Å; I131-L178 HydrophobicContact CG1-CD1 4.14Å; I131-L178 HydrophobicContact CG2-CD1 4.49Å; I131-L178 HydrophobicContact CG2-CD2 4.26Å; L134-L178 HydrophobicContact CD1-CD2 3.81Å; L134-L178 HydrophobicContact CD1-CG 4.31Å; L134-L178 HydrophobicContact CG-CD2 4.38Å; A155-L178 HydrophobicContact CB-CD2 4.34Å; I157-L178 HydrophobicContact CG2-CD2 4.05Å; L170-L178 HydrophobicContact CD1-CB 4.34Å; L170-L178 HydrophobicContact CD1-CD2 3.75Å; L174-L178 WeakPolarHBondContact O-CB 3.4Å; L174-L178 PolarHBondContact O-N 3.48Å; L175-L178 HydrophobicContact CD1-CD2 4.48Å; L175-L178 PolarHBondContact O-N 2.79Å; A176-L178 VanDerWaalsContact C-N 3.34Å; A176-L178 PolarHBondContact O-N 3.4Å; L178-N180 VanDerWaalsContact C-N 3.27Å; L178-N180 PolarHBondContact O-N 3.35Å; L178-G181 PolarHBondContact O-N 3.3Å; L178-L183 HydrophobicContact CB-CB 4.42Å; L178-L183 HydrophobicContact CD1-CB 4.16Å; L178-L183 HydrophobicContact CD1-CD2 4.31Å; L178-L183 HydrophobicContact CD1-CG 4.34Å; L178-L183 WeakPolarHBondContact CD1-O 3.49Å
179	K	88.6	Confident	91.5	Very high	112 Å²	112	68.1 Å²	68.1	49%	0.487	38%	0.375	S	S	.	.	H	α-helix	trans	-62.3	-33.8	177.8	-76.9	177.6	178.4	177.9	0	113	L134 L175 A176 G181	L134-K179 HydrophobicContact CD2-CG 4.36Å; L175-K179 HydrophobicContact CD1-CD 4.35Å; L175-K179 HydrophobicContact CD1-CG 4.22Å; L175-K179 HydrophobicContact CG-CD 4.35Å; L175-K179 WeakPolarHBondContact O-CB 3.36Å; L175-K179 WeakPolarHBondContact O-CG 3.34Å; L175-K179 PolarHBondContact O-N 3.33Å; A176-K179 PolarHBondContact O-N 2.82Å; K179-G181 PolarHBondContact O-N 3.47Å
180	N	89.7	Confident	91.7	Very high	123 Å²	123	72.2 Å²	72.2	66%	0.658	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	2.5	175.9	-67.3	-12	0	0	0	113	A176 V177 L178 R182	A176-N180 WeakPolarHBondContact O-CB 3.48Å; A176-N180 PolarHBondContact O-N 3.34Å; A176-N180 PolarHBondContact O-ND2 3.11Å; V177-N180 PolarHBondContact O-N 3.27Å; L178-N180 VanDerWaalsContact C-N 3.27Å; L178-N180 PolarHBondContact O-N 3.35Å; N180-R182 HydrophobicContact CB-CG 4.45Å; N180-R182 PolarHBondContact O-N 3.26Å
181	G	88.4	Confident	91.8	Very high	48 Å²	48	72.8 Å²	72.8	50%	0.495	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	69.8	13.7	179.8	0	0	0	0	0	114.1	V177 L178 K179 T184	V177-G181 PolarHBondContact O-N 3.24Å; L178-G181 PolarHBondContact O-N 3.3Å; K179-G181 PolarHBondContact O-N 3.47Å; G181-T184 WeakPolarHBondContact O-CG2 3.29Å
182	R	91.2	Very high	92	Very high	184 Å²	184	76.5 Å²	76.5	69%	0.694	41%	0.414	S	S	*	.			trans	-83.9	-22.4	179.4	-71.2	-174.1	66.1	-159	-1.8	112.9	V177 N180 Q187	V177-R182 HydrophobicContact CG1-CB 3.63Å; V177-R182 PolarHBondContact O-N 3.46Å; N180-R182 HydrophobicContact CB-CG 4.45Å; N180-R182 PolarHBondContact O-N 3.26Å; R182-Q187 PolarHBondContact O-NE2 2.79Å; R182-Q187 PolarHBondContact O-OE1 2.91Å; R182-Q187 VanDerWaalsContact O-OE1 3.09Å
183	L	92.8	Very high	92.1	Very high	14 Å²	14	73.6 Å²	73.6	7%	0.073	40%	0.403	C	S	.	.	S	Bend	trans	-105.3	118.9	170.2	-173.1	65.5	0	0	0	108.9	V128 I157 L170 V177 L178 Q187 I189	V128-L183 HydrophobicContact CG2-CD1 3.8Å; V128-L183 HydrophobicContact CG2-CG 4.25Å; I157-L183 HydrophobicContact CD1-CD2 4.18Å; L170-L183 HydrophobicContact CD1-CD2 4.4Å; V177-L183 HydrophobicContact CG1-CB 4.06Å; V177-L183 PolarHBondContact O-N 2.98Å; L178-L183 HydrophobicContact CB-CB 4.42Å; L178-L183 HydrophobicContact CD1-CB 4.16Å; L178-L183 HydrophobicContact CD1-CD2 4.31Å; L178-L183 HydrophobicContact CD1-CG 4.34Å; L178-L183 WeakPolarHBondContact CD1-O 3.49Å; L183-Q187 VanDerWaalsContact CA-OE1 3.25Å; L183-I189 HydrophobicContact CD1-CG2 3.66Å
184	T	93.6	Very high	92.4	Very high	59 Å²	59	69.9 Å²	69.9	36%	0.362	38%	0.38	S	S	.	.			trans	-134.1	158	-177.5	66.9	0	0	0	0	111.4	G181 G186 Q187	G181-T184 WeakPolarHBondContact O-CG2 3.29Å; T184-G186 PolarHBondContact O-N 3.24Å; T184-Q187 WeakPolarHBondContact O-CB 3.39Å; T184-Q187 PolarHBondContact O-N 2.89Å; T184-Q187 WeakPolarHBondContact OG1-CG 3.36Å
185	V	95	Very high	92.6	Very high	57 Å²	57	72.3 Å²	72.3	35%	0.345	39%	0.389	S	S	.	.	T	Hydrogen-bonded Turn	trans	-55.6	138.6	173	176.6	0	0	0	0	110.6	S15 W67 V128 S129 I131 Q187	S15-V185 VanDerWaalsContact OG-CG1 3.31Å; S15-V185 WeakPolarHBondContact OG-CG1 3.22Å; W67-V185 HydrophobicContact CH2-CG1 4.25Å; W67-V185 HydrophobicContact CZ2-CG1 4.09Å; V128-V185 HydrophobicContact CG1-CG2 4.37Å; V128-V185 WeakPolarHBondContact O-CA 3.41Å; S129-V185 WeakPolarHBondContact O-CG1 3.45Å; I131-V185 HydrophobicContact CD1-CG2 4.04Å; I131-V185 HydrophobicContact CG1-CG2 4.03Å; V185-Q187 VanDerWaalsContact C-N 3.35Å
186	G	94.1	Very high	92.7	Very high	38 Å²	38	73.1 Å²	73.1	39%	0.392	39%	0.393	S	S	.	.	T	Hydrogen-bonded Turn	trans	89	-10.1	-177.3	0	0	0	0	0	114.8	V128 T184	V128-G186 PolarHBondContact O-N 3.04Å; T184-G186 PolarHBondContact O-N 3.24Å
187	Q	95.4	Very high	92.8	Very high	76 Å²	76	73.8 Å²	73.8	36%	0.355	39%	0.393	S	S	.	.			trans	-78.3	144	174.9	-71	-178.9	-33.9	0	0	111.7	C127 V128 R182 L183 T184 V185	C127-Q187 CarbonylContact C-O 3.06Å; C127-Q187 WeakPolarHBondContact CA-O 3.38Å; V128-Q187 PolarHBondContact N-O 3.04Å; R182-Q187 PolarHBondContact O-NE2 2.79Å; R182-Q187 PolarHBondContact O-OE1 2.91Å; R182-Q187 VanDerWaalsContact O-OE1 3.09Å; L183-Q187 VanDerWaalsContact CA-OE1 3.25Å; T184-Q187 WeakPolarHBondContact O-CB 3.39Å; T184-Q187 PolarHBondContact O-N 2.89Å; T184-Q187 WeakPolarHBondContact OG1-CG 3.36Å; V185-Q187 VanDerWaalsContact C-N 3.35Å
188	K	96.5	Very high	92.7	Very high	165 Å²	165	73.6 Å²	73.6	72%	0.717	40%	0.4	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-93.4	133	172.3	-60.7	-171.9	179.4	-161.3	0	109.8	V125 L126 C127	V125-K188 HydrophobicContact CG1-CB 4.45Å; L126-K188 CarbonylContact O-C 3.57Å; L126-K188 WeakPolarHBondContact O-CA 3.15Å; C127-K188 HydrophobicContact CB-CG 4.4Å
189	I	95.3	Very high	92.3	Very high	46 Å²	46	74.5 Å²	74.5	24%	0.236	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.5	147.3	175.4	59.3	171	0	0	0	109.7	V125 L126 L159 L183 L191	V125-I189 WeakPolarHBondContact CA-O 3.46Å; L126-I189 PolarHBondContact N-O 2.86Å; L126-I189 PolarHBondContact O-N 2.78Å; L159-I189 HydrophobicContact CD1-CD1 3.99Å; L159-I189 HydrophobicContact CD2-CD1 3.78Å; L159-I189 HydrophobicContact CD2-CG1 4.42Å; L183-I189 HydrophobicContact CD1-CG2 3.66Å; I189-L191 HydrophobicContact CD1-CD2 4.15Å; I189-L191 HydrophobicContact CG1-CD2 4.03Å
190	I	96.4	Very high	92	Very high	131 Å²	131	74 Å²	74	67%	0.672	42%	0.415	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-104.5	124.4	171	-52.3	179.7	0	0	0	106.3	T123 L124 V125	T123-I190 HydrophobicContact CG2-CG2 3.73Å; L124-I190 WeakPolarHBondContact O-CA 3.43Å; V125-I190 HydrophobicContact CG2-CG1 4.24Å
191	L	92.7	Very high	92	Very high	26 Å²	26	73.5 Å²	73.5	14%	0.136	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.1	149.2	177.4	45.3	138	0	0	0	109.6	T123 L124 L126 I189 A194 L214	T123-L191 CarbonylContact C-O 3.58Å; T123-L191 VanDerWaalsContact CA-O 3.31Å; T123-L191 WeakPolarHBondContact CA-O 3.41Å; L124-L191 HydrophobicContact CB-CD1 3.68Å; L124-L191 HydrophobicContact CB-CD2 4.28Å; L124-L191 HydrophobicContact CB-CG 3.76Å; L124-L191 HydrophobicContact CD1-CD1 3.66Å; L124-L191 HydrophobicContact CG-CD1 4.13Å; L124-L191 PolarHBondContact N-O 2.81Å; L124-L191 PolarHBondContact O-N 3.16Å; L126-L191 HydrophobicContact CB-CD2 3.94Å; L126-L191 HydrophobicContact CD1-CD1 4.06Å; L126-L191 HydrophobicContact CD1-CD2 3.77Å; L126-L191 HydrophobicContact CG-CD2 3.8Å; I189-L191 HydrophobicContact CD1-CD2 4.15Å; I189-L191 HydrophobicContact CG1-CD2 4.03Å; L191-A194 HydrophobicContact CD1-CB 3.75Å; L191-L214 HydrophobicContact CD1-CD2 3.69Å
192	H	94.3	Very high	92.1	Very high	148 Å²	148	74.4 Å²	74.4	69%	0.685	42%	0.416	S	S	*	.			trans	-141.7	139.3	178.1	-172.8	-67.6	0	0	0	108.5	T123 A194	T123-H192 PolarHBondContact OG1-CD2 2.77Å; T123-H192 VanDerWaalsContact OG1-CD2 3.24Å; H192-A194 VanDerWaalsContact C-N 3.29Å; H192-A194 PolarHBondContact O-N 3.47Å
193	G	92.6	Very high	92.1	Very high	42 Å²	42	66.7 Å²	66.7	43%	0.433	39%	0.389	S	S	.	.	S	Bend	trans	69.4	28	178.5	0	0	0	0	0	113.3	A121	A121-G193 WeakPolarHBondContact O-CA 3.31Å; A121-G193 PolarHBondContact O-N 2.91Å
194	A	93.9	Very high	92	Very high	7 Å²	7	68.3 Å²	68.3	6%	0.058	40%	0.4	C	S	.	.			trans	-70.7	150.7	176.2	0	0	0	0	0	111	A120 A121 L191 H192 L214 K215	A120-A194 CarbonylContact C-O 3.54Å; A120-A194 WeakPolarHBondContact CB-O 3.36Å; A121-A194 VanDerWaalsContact CA-O 3.24Å; A121-A194 WeakPolarHBondContact CA-O 3.49Å; A121-A194 PolarHBondContact N-O 3.25Å; A121-A194 VanDerWaalsContact N-O 3.07Å; L191-A194 HydrophobicContact CD1-CB 3.75Å; H192-A194 VanDerWaalsContact C-N 3.29Å; H192-A194 PolarHBondContact O-N 3.47Å; A194-L214 HydrophobicContact CB-CD1 3.84Å; A194-L214 HydrophobicContact CB-CD2 4.24Å; A194-L214 HydrophobicContact CB-CG 3.95Å; A194-K215 CarbonylContact C-O 3.58Å; A194-K215 WeakPolarHBondContact CA-O 3.06Å
195	E	93.6	Very high	91.7	Very high	127 Å²	127	66.2 Å²	66.2	59%	0.593	39%	0.388	S	S	*	.			trans	-117.5	137.6	-179.9	-66.5	-177.9	172.3	0	0	110.4	V197 L214 K215	E195-V197 HydrophobicContact CB-CG2 4.4Å; E195-V197 PolarHBondContact O-N 2.72Å; E195-L214 CarbonylContact O-C 3.48Å; E195-L214 WeakPolarHBondContact O-CA 3.17Å; E195-K215 PolarHBondContact N-O 3.44Å; E195-K215 PolarHBondContact O-N 3.36Å
196	L	93.4	Very high	91.3	Very high	30 Å²	30	68.2 Å²	68.2	16%	0.157	40%	0.396	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.8	103.4	173.2	-172.9	63.1	0	0	0	109.1	I113 A120 L212	I113-L196 HydrophobicContact CG2-CD2 3.96Å; A120-L196 HydrophobicContact CB-CB 4.26Å; L196-L212 HydrophobicContact CD1-CD1 4.4Å; L196-L212 HydrophobicContact CD1-CD2 3.69Å; L196-L212 HydrophobicContact CD1-CG 3.89Å; L196-L212 HydrophobicContact CD2-CD1 4.34Å; L196-L212 HydrophobicContact CG-CG 4.41Å
197	V	91.4	Very high	91	Very high	60 Å²	60	73.7 Å²	73.7	36%	0.364	41%	0.411	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.9	148.2	-178.4	-174.1	0	0	0	0	109.7	E195 L212 M213 K215	E195-V197 HydrophobicContact CB-CG2 4.4Å; E195-V197 PolarHBondContact O-N 2.72Å; V197-L212 WeakPolarHBondContact O-CA 3.49Å; V197-M213 PolarHBondContact N-O 3.36Å; V197-M213 PolarHBondContact O-N 3.49Å; V197-M213 VanDerWaalsContact O-O 3.07Å; V197-K215 HydrophobicContact CG2-CB 3.76Å; V197-K215 HydrophobicContact CG2-CD 4.16Å
198	G	87	Confident	90.6	Very high	42 Å²	42	71.7 Å²	71.7	43%	0.433	41%	0.408	S	S	.	.	S	Bend	trans	117	-137.3	178	0	0	0	0	0	112.2	S211	G198-S211 WeakPolarHBondContact CA-O 3.47Å
199	S	83.2	Confident	90.2	Very high	29 Å²	29	66.1 Å²	66.1	20%	0.203	39%	0.388	C	S	.	.			trans	-59.8	129.5	-177.6	-175.7	0	0	0	0	111.6	R116 D201	R116-S199 PolarHBondContact NH2-O 2.91Å; S199-D201 VanDerWaalsContact C-N 3.25Å; S199-D201 PolarHBondContact O-N 3.43Å; S199-D201 PolarHBondContact OG-N 2.75Å
200	P	81.8	Confident	89.8	Confident	102 Å²	102	71.2 Å²	71.2	66%	0.662	41%	0.411	S	S	*	.			trans	-72.2	-20.6	178.2	30.7	-34.9	0	0	0	112.9	R116	R116-P200 PolarHBondContact NE-O 3.08Å
201	D	89.4	Confident	89.4	Confident	113 Å²	113	68.5 Å²	68.5	60%	0.604	40%	0.404	S	S	*	.	S	Bend	trans	-74.3	150.7	-173.8	-59.7	-38.1	0	0	0	112.3	S199	S199-D201 VanDerWaalsContact C-N 3.25Å; S199-D201 PolarHBondContact O-N 3.43Å; S199-D201 PolarHBondContact OG-N 2.75Å
202	A	90.9	Very high	89.3	Confident	67 Å²	67	67.5 Å²	67.5	55%	0.554	40%	0.399	S	S	*	.			trans	-69.7	132.9	170.3	0	0	0	0	0	110	E115 R116	E115-A202 WeakPolarHBondContact O-CB 3.46Å; R116-A202 HydrophobicContact CB-CB 4.23Å; R116-A202 HydrophobicContact CG-CB 3.89Å
203	C	91.4	Very high	89.3	Confident	21 Å²	21	62.1 Å²	62.1	14%	0.142	37%	0.374	C	S	.	.			trans	-139.5	152.2	178.1	59.6	0	0	0	0	110.8	M114	M114-C203 CarbonylContact C-O 3.51Å; M114-C203 PolarHBondContact O-N 3.24Å; M114-C203 VanDerWaalsContact O-N 3.16Å
204	T	89.6	Confident	89.3	Confident	49 Å²	49	60.5 Å²	60.5	30%	0.301	36%	0.355	S	S	.	.			trans	-72.9	145.9	169	71.6	0	0	0	0	109.1	L206 E207 A208	T204-L206 PolarHBondContact O-N 3.45Å; T204-L206 VanDerWaalsContact O-N 3.07Å; T204-E207 PolarHBondContact O-N 3.37Å; T204-E207 WeakPolarHBondContact OG1-CB 3.42Å; T204-E207 VanDerWaalsContact OG1-CD 3.32Å; T204-E207 WeakPolarHBondContact OG1-CG 3.46Å; T204-E207 PolarHBondContact OG1-OE2 2.82Å; T204-A208 PolarHBondContact O-N 3.05Å
205	P	88.8	Confident	89.2	Confident	15 Å²	15	66.6 Å²	66.6	10%	0.097	38%	0.381	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.1	-25.2	-178	-28.7	35.3	0	0	0	115.7	K111 M114 Y164	K111-P205 HydrophobicContact CB-CG 3.92Å; K111-P205 HydrophobicContact CG-CG 4.03Å; M114-P205 HydrophobicContact CB-CG 4.39Å; M114-P205 HydrophobicContact CE-CB 4.17Å; M114-P205 HydrophobicContact SD-CB 3.7Å; M114-P205 HydrophobicContact SD-CG 3.82Å; Y164-P205 HydrophobicContact CD1-CB 3.5Å; Y164-P205 HydrophobicContact CD1-CG 4.1Å; Y164-P205 HydrophobicContact CD2-CB 4.27Å; Y164-P205 HydrophobicContact CD2-CG 4.03Å; Y164-P205 HydrophobicContact CE1-CB 4.07Å; Y164-P205 HydrophobicContact CE1-CG 4.42Å; Y164-P205 HydrophobicContact CE2-CG 4.37Å; Y164-P205 HydrophobicContact CG-CB 3.59Å; Y164-P205 HydrophobicContact CG-CG 3.86Å
206	L	86.1	Confident	88.9	Confident	99 Å²	99	63.6 Å²	63.6	52%	0.518	37%	0.37	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.1	-24.5	179.9	-62.8	177.2	0	0	0	112.7	F61 Y164 T204	F61-L206 HydrophobicContact CZ-CD1 4.05Å; Y164-L206 HydrophobicContact CD1-CD2 4.26Å; Y164-L206 HydrophobicContact CE1-CD1 4.45Å; Y164-L206 HydrophobicContact CE1-CD2 4.04Å; Y164-L206 HydrophobicContact CE1-CG 3.97Å; T204-L206 PolarHBondContact O-N 3.45Å; T204-L206 VanDerWaalsContact O-N 3.07Å
207	E	86.8	Confident	88.7	Confident	152 Å²	152	65.4 Å²	65.4	71%	0.71	38%	0.381	S	S	*	.	S	Bend	trans	-104.9	14.9	-178.7	-61.7	167.2	156	0	0	111.4	T204	T204-E207 PolarHBondContact O-N 3.37Å; T204-E207 WeakPolarHBondContact OG1-CB 3.42Å; T204-E207 VanDerWaalsContact OG1-CD 3.32Å; T204-E207 WeakPolarHBondContact OG1-CG 3.46Å; T204-E207 PolarHBondContact OG1-OE2 2.82Å
208	A	87.5	Confident	88.6	Confident	35 Å²	35	65.7 Å²	65.7	29%	0.289	38%	0.382	S	S	.	.			trans	-66.6	133.7	-172.6	0	0	0	0	0	111.7	M114 T204	M114-A208 HydrophobicContact CE-CB 3.16Å; T204-A208 PolarHBondContact O-N 3.05Å
209	P	89.1	Confident	88.7	Confident	47 Å²	47	67.1 Å²	67.1	31%	0.305	38%	0.379	S	S	.	.			trans	-68.3	147.9	177.5	28.6	-33	0	0	0	110.4	S211 L212	P209-S211 PolarHBondContact O-N 3.01Å; P209-L212 HydrophobicContact CG-CB 3.98Å; P209-L212 WeakPolarHBondContact O-CB 3.49Å; P209-L212 PolarHBondContact O-N 2.91Å
210	E	85.4	Confident	89	Confident	154 Å²	154	69.4 Å²	69.4	72%	0.72	39%	0.39	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.8	-19.5	-178.4	-61	-162.1	136.5	0	0	114.3	K167 L212 M213	K167-E210 IonicContact NZ-OE1 2.76Å; E210-L212 VanDerWaalsContact C-N 3.33Å; E210-M213 WeakPolarHBondContact O-CE 3.15Å
211	S	88.6	Confident	89.5	Confident	73 Å²	73	67.3 Å²	67.3	51%	0.51	37%	0.372	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.8	-16.4	177.2	59.1	0	0	0	0	113.7	G198 P209	G198-S211 WeakPolarHBondContact CA-O 3.47Å; P209-S211 PolarHBondContact O-N 3.01Å
212	L	91.1	Very high	89.5	Confident	6 Å²	6	64 Å²	64	3%	0.031	36%	0.356	C	S	.	.			trans	-81.2	122	-179.2	-179.3	149.6	0	0	0	110.3	M114 V166 L196 V197 P209 E210	M114-L212 HydrophobicContact CE-CD2 3.71Å; M114-L212 HydrophobicContact CG-CD2 4.36Å; V166-L212 HydrophobicContact CG2-CD2 3.98Å; L196-L212 HydrophobicContact CD1-CD1 4.4Å; L196-L212 HydrophobicContact CD1-CD2 3.69Å; L196-L212 HydrophobicContact CD1-CG 3.89Å; L196-L212 HydrophobicContact CD2-CD1 4.34Å; L196-L212 HydrophobicContact CG-CG 4.41Å; V197-L212 WeakPolarHBondContact O-CA 3.49Å; P209-L212 HydrophobicContact CG-CB 3.98Å; P209-L212 WeakPolarHBondContact O-CB 3.49Å; P209-L212 PolarHBondContact O-N 2.91Å; E210-L212 VanDerWaalsContact C-N 3.33Å
213	M	92.8	Very high	89.4	Confident	35 Å²	35	63.8 Å²	63.8	17%	0.172	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-143	148.9	-173.7	-57.2	-172.6	-172.1	0	0	111.3	I156 K167 V197 E210	I156-M213 HydrophobicContact CD1-CE 3.83Å; I156-M213 HydrophobicContact CD1-SD 4.02Å; I156-M213 HydrophobicContact CG1-SD 4.44Å; K167-M213 HydrophobicContact CB-CG 4.06Å; K167-M213 CarbonylContact O-C 3.54Å; K167-M213 VanDerWaalsContact O-CA 3.24Å; K167-M213 WeakPolarHBondContact O-CA 3.41Å; V197-M213 PolarHBondContact N-O 3.36Å; V197-M213 PolarHBondContact O-N 3.49Å; V197-M213 VanDerWaalsContact O-O 3.07Å; E210-M213 WeakPolarHBondContact O-CE 3.15Å
214	L	93.6	Very high	89.2	Confident	7 Å²	7	67.3 Å²	67.3	4%	0.037	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	138.7	167	-163.1	70.3	0	0	0	109.4	A120 L126 L159 V166 K167 A168 Q169 L191 A194 E195	A120-L214 HydrophobicContact CB-CD1 3.7Å; L126-L214 HydrophobicContact CD1-CD2 3.87Å; L159-L214 HydrophobicContact CD1-CD2 4.38Å; V166-L214 HydrophobicContact CG1-CB 4.34Å; K167-L214 PolarHBondContact O-N 3.29Å; A168-L214 CarbonylContact C-O 3.47Å; A168-L214 WeakPolarHBondContact CA-O 3.46Å; A168-L214 HydrophobicContact CB-CB 4.15Å; Q169-L214 PolarHBondContact N-O 3.49Å; L191-L214 HydrophobicContact CD1-CD2 3.69Å; A194-L214 HydrophobicContact CB-CD1 3.84Å; A194-L214 HydrophobicContact CB-CD2 4.24Å; A194-L214 HydrophobicContact CB-CG 3.95Å; E195-L214 CarbonylContact O-C 3.48Å; E195-L214 WeakPolarHBondContact O-CA 3.17Å
215	K	91.1	Very high	89.2	Confident	136 Å²	136	69 Å²	69	59%	0.591	36%	0.362	S	S	*	.			trans	-125.1	0	176.2	-172.8	179.7	176.3	-171.6	0	110.7	Q169 A194 E195 V197	Q169-K215 HydrophobicContact CG-CG 4.34Å; A194-K215 CarbonylContact C-O 3.58Å; A194-K215 WeakPolarHBondContact CA-O 3.06Å; E195-K215 PolarHBondContact N-O 3.44Å; E195-K215 PolarHBondContact O-N 3.36Å; V197-K215 HydrophobicContact CG2-CB 3.76Å; V197-K215 HydrophobicContact CG2-CD 4.16Å

Retrieved 215 of 215 residues in 153.1 ms (Link to these results)

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