A0A077ZCN2_TRITR Loading...

Mediator of RNA polymerase II transcription subun it 13

AlphaFold DB , UniProt , Accession A0A077ZCN2, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 297 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	57	Low	80.4	Confident	207 Å²	207	75.2 Å²	75.2	100%	1.02	38%	0.375	S	S	*	.				0	-37.7	0	-117	-167.2	-80.7	0	0	113.4	S4	M1-S4 PolarHBondContact O-OG 3.08Å
2	I	64.1	Low	81	Confident	107 Å²	107	69.3 Å²	69.3	55%	0.549	35%	0.345	S	S	.	.			trans	-79	-48	175.8	-63.3	170.6	0	0	0	111.7	S4 R5 L6	I2-S4 PolarHBondContact O-N 3.34Å; I2-R5 WeakPolarHBondContact O-CA 3.49Å; I2-R5 WeakPolarHBondContact O-CB 3.46Å; I2-R5 PolarHBondContact O-N 2.91Å; I2-L6 HydrophobicContact CG2-CG 4.45Å; I2-L6 PolarHBondContact O-N 3.21Å; I2-L6 VanDerWaalsContact O-N 3.11Å
3	E	66.3	Low	81.6	Confident	168 Å²	168	63.9 Å²	63.9	79%	0.785	32%	0.319	S	S	*	.	H	α-helix	trans	-56.2	-38.7	178.8	-66.3	174.9	176.8	0	0	112.4	R5 L7	E3-R5 VanDerWaalsContact C-N 3.29Å; E3-R5 PolarHBondContact O-N 3.43Å; E3-L7 PolarHBondContact O-N 2.96Å
4	S	80.8	Confident	81.6	Confident	58 Å²	58	61.5 Å²	61.5	41%	0.406	31%	0.307	S	S	.	.	H	α-helix	trans	-66.3	-28.1	175.6	57.6	0	0	0	0	113.3	M1 I2 Q8	M1-S4 PolarHBondContact O-OG 3.08Å; I2-S4 PolarHBondContact O-N 3.34Å; S4-Q8 WeakPolarHBondContact O-CB 3.47Å; S4-Q8 WeakPolarHBondContact O-CG 3.43Å; S4-Q8 PolarHBondContact O-N 2.93Å; S4-Q8 PolarHBondContact O-NE2 2.87Å
5	R	90.5	Very high	81.6	Confident	39 Å²	39	66.9 Å²	66.9	15%	0.147	33%	0.33	C	S	.	.	H	α-helix	trans	-79.8	-42.9	178.9	-173.5	172.6	64.4	-125.1	-5.4	111.4	I2 E3 L7 Q8 I9 F28 D38	I2-R5 WeakPolarHBondContact O-CA 3.49Å; I2-R5 WeakPolarHBondContact O-CB 3.46Å; I2-R5 PolarHBondContact O-N 2.91Å; E3-R5 VanDerWaalsContact C-N 3.29Å; E3-R5 PolarHBondContact O-N 3.43Å; R5-L7 VanDerWaalsContact C-N 3.33Å; R5-L7 PolarHBondContact O-N 3.44Å; R5-Q8 PolarHBondContact O-N 3.22Å; R5-Q8 VanDerWaalsContact O-N 3.15Å; R5-I9 HydrophobicContact CG-CD1 4.1Å; R5-I9 HydrophobicContact CG-CG1 4.47Å; R5-I9 WeakPolarHBondContact O-CG1 3.48Å; R5-I9 PolarHBondContact O-N 3.16Å; R5-F28 HydrophobicContact CG-CB 4.4Å; R5-F28 HydrophobicContact CG-CD1 3.96Å; R5-F28 HydrophobicContact CG-CD2 4.06Å; R5-F28 HydrophobicContact CG-CE1 4.22Å; R5-F28 HydrophobicContact CG-CE2 4.33Å; R5-F28 HydrophobicContact CG-CG 3.88Å; R5-F28 HydrophobicContact CG-CZ 4.4Å; R5-D38 IonicContact CZ-OD1 3.69Å; R5-D38 IonicContact CZ-OD2 3.32Å; R5-D38 VanDerWaalsContact CZ-OD2 3.32Å; R5-D38 IonicContact NE-OD1 3.63Å; R5-D38 IonicContact NE-OD2 2.66Å; R5-D38 PolarHBondContact NE-OD2 3.19Å; R5-D38 IonicContact NH2-OD1 3.18Å; R5-D38 PolarHBondContact NH2-OD1 3.2Å; R5-D38 IonicContact NH2-OD2 2.62Å; R5-D38 PolarHBondContact NH2-OD2 2.84Å
6	L	90.6	Very high	81.8	Confident	35 Å²	35	70.9 Å²	70.9	18%	0.183	35%	0.345	C	S	.	.	H	α-helix	trans	-56.3	-48.6	175.8	-62.5	-174.5	0	0	0	111.4	I2 Q8 I9 L10 D38 A41 L42	I2-L6 HydrophobicContact CG2-CG 4.45Å; I2-L6 PolarHBondContact O-N 3.21Å; I2-L6 VanDerWaalsContact O-N 3.11Å; L6-Q8 VanDerWaalsContact C-N 3.32Å; L6-Q8 PolarHBondContact O-N 3.37Å; L6-I9 PolarHBondContact O-N 2.92Å; L6-L10 PolarHBondContact O-N 3Å; L6-D38 HydrophobicContact CD2-CB 3.4Å; L6-D38 VanDerWaalsContact CD2-CB 3.4Å; L6-A41 HydrophobicContact CD1-CB 4.17Å; L6-A41 HydrophobicContact CD2-CB 4.31Å; L6-L42 HydrophobicContact CB-CD2 4.04Å; L6-L42 HydrophobicContact CD2-CG 4.35Å
7	L	84.9	Confident	81.9	Confident	84 Å²	84	69 Å²	69	44%	0.44	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-39.2	178.1	-175.1	65.3	0	0	0	111.8	E3 R5 L10 F11	E3-L7 PolarHBondContact O-N 2.96Å; R5-L7 VanDerWaalsContact C-N 3.33Å; R5-L7 PolarHBondContact O-N 3.44Å; L7-L10 WeakPolarHBondContact O-CB 3.24Å; L7-L10 PolarHBondContact O-N 3.27Å; L7-F11 HydrophobicContact CD1-CE2 3.89Å; L7-F11 HydrophobicContact CD1-CZ 3.93Å; L7-F11 HydrophobicContact CD2-CE2 3.8Å; L7-F11 HydrophobicContact CD2-CZ 4.27Å; L7-F11 HydrophobicContact CG-CD2 4.02Å; L7-F11 HydrophobicContact CG-CE2 3.45Å; L7-F11 VanDerWaalsContact CG-CE2 3.45Å; L7-F11 HydrophobicContact CG-CZ 3.99Å; L7-F11 WeakPolarHBondContact O-CD2 3.44Å; L7-F11 WeakPolarHBondContact O-CG 3.23Å; L7-F11 PolarHBondContact O-N 2.97Å
8	Q	88.5	Confident	82.3	Confident	82 Å²	82	68.4 Å²	68.4	38%	0.383	35%	0.352	S	S	.	.	H	α-helix	trans	-67	-42.2	175.9	-77.5	177	79.6	0	0	112.7	S4 R5 L6 L10 F11 I12 F28	S4-Q8 WeakPolarHBondContact O-CB 3.47Å; S4-Q8 WeakPolarHBondContact O-CG 3.43Å; S4-Q8 PolarHBondContact O-N 2.93Å; S4-Q8 PolarHBondContact O-NE2 2.87Å; R5-Q8 PolarHBondContact O-N 3.22Å; R5-Q8 VanDerWaalsContact O-N 3.15Å; L6-Q8 VanDerWaalsContact C-N 3.32Å; L6-Q8 PolarHBondContact O-N 3.37Å; Q8-L10 VanDerWaalsContact C-N 3.29Å; Q8-L10 PolarHBondContact O-N 3.48Å; Q8-F11 PolarHBondContact O-N 3.01Å; Q8-I12 WeakPolarHBondContact O-CD1 3.28Å; Q8-I12 WeakPolarHBondContact O-CG1 3.1Å; Q8-I12 PolarHBondContact O-N 3.38Å; Q8-F28 HydrophobicContact CB-CE1 3.77Å; Q8-F28 HydrophobicContact CB-CZ 3.66Å; Q8-F28 HydrophobicContact CG-CE1 4.49Å
9	I	91.1	Very high	82.9	Confident	0 Å²	0	65.6 Å²	65.6	0%	0	34%	0.338	C	S	.	.	H	α-helix	trans	-56.9	-47.9	173.5	-70.2	166.8	0	0	0	109.5	R5 L6 F11 I12 L13 L24 F28 I35 D38 I39 L42	R5-I9 HydrophobicContact CG-CD1 4.1Å; R5-I9 HydrophobicContact CG-CG1 4.47Å; R5-I9 WeakPolarHBondContact O-CG1 3.48Å; R5-I9 PolarHBondContact O-N 3.16Å; L6-I9 PolarHBondContact O-N 2.92Å; I9-F11 PolarHBondContact O-N 3.01Å; I9-I12 WeakPolarHBondContact O-CB 3.4Å; I9-I12 PolarHBondContact O-N 2.66Å; I9-L13 HydrophobicContact CG2-CD1 3.9Å; I9-L13 HydrophobicContact CG2-CG 4.26Å; I9-L13 VanDerWaalsContact O-CG 3.31Å; I9-L13 WeakPolarHBondContact O-CG 3.12Å; I9-L13 PolarHBondContact O-N 3.43Å; I9-L24 HydrophobicContact CG1-CD1 4.5Å; I9-L24 HydrophobicContact CG2-CD1 4.18Å; I9-F28 HydrophobicContact CD1-CE2 4.29Å; I9-F28 HydrophobicContact CG1-CD2 4.21Å; I9-F28 HydrophobicContact CG1-CE2 3.46Å; I9-F28 VanDerWaalsContact CG1-CE2 3.46Å; I9-F28 HydrophobicContact CG1-CZ 4.05Å; I9-I35 HydrophobicContact CD1-CD1 4.24Å; I9-D38 HydrophobicContact CD1-CB 3.71Å; I9-I39 HydrophobicContact CG2-CD1 3.77Å; I9-L42 HydrophobicContact CB-CD1 4.31Å; I9-L42 HydrophobicContact CG2-CD1 3.85Å
10	L	87.2	Confident	83.5	Confident	7 Å²	7	64.8 Å²	64.8	4%	0.037	34%	0.337	C	S	.	.	H	α-helix	trans	-55.6	-50.3	177.6	179.8	61.8	0	0	0	112.1	L6 L7 Q8 I12 L13 M14 I47 I61 L67	L6-L10 PolarHBondContact O-N 3Å; L7-L10 WeakPolarHBondContact O-CB 3.24Å; L7-L10 PolarHBondContact O-N 3.27Å; Q8-L10 VanDerWaalsContact C-N 3.29Å; Q8-L10 PolarHBondContact O-N 3.48Å; L10-I12 VanDerWaalsContact C-N 3.31Å; L10-I12 PolarHBondContact O-N 3.37Å; L10-L13 PolarHBondContact O-N 3.21Å; L10-M14 HydrophobicContact CD1-CG 4.28Å; L10-M14 HydrophobicContact CD1-SD 4.13Å; L10-M14 HydrophobicContact CG-SD 4.06Å; L10-M14 WeakPolarHBondContact O-CG 3.2Å; L10-M14 PolarHBondContact O-N 3.27Å; L10-I47 HydrophobicContact CD1-CG2 3.78Å; L10-I47 HydrophobicContact CD2-CD1 4.11Å; L10-I61 HydrophobicContact CD1-CD1 3.43Å; L10-I61 VanDerWaalsContact CD1-CD1 3.43Å; L10-L67 HydrophobicContact CD2-CD1 4.19Å
11	F	83	Confident	84	Confident	40 Å²	40	61.9 Å²	61.9	18%	0.175	32%	0.322	C	S	.	.	H	α-helix	trans	-57.9	-43	177.4	-72.6	-50.1	0	0	0	112.5	L7 Q8 I9 L13 M14 E15 K101 L105	L7-F11 HydrophobicContact CD1-CE2 3.89Å; L7-F11 HydrophobicContact CD1-CZ 3.93Å; L7-F11 HydrophobicContact CD2-CE2 3.8Å; L7-F11 HydrophobicContact CD2-CZ 4.27Å; L7-F11 HydrophobicContact CG-CD2 4.02Å; L7-F11 HydrophobicContact CG-CE2 3.45Å; L7-F11 VanDerWaalsContact CG-CE2 3.45Å; L7-F11 HydrophobicContact CG-CZ 3.99Å; L7-F11 WeakPolarHBondContact O-CD2 3.44Å; L7-F11 WeakPolarHBondContact O-CG 3.23Å; L7-F11 PolarHBondContact O-N 2.97Å; Q8-F11 PolarHBondContact O-N 3.01Å; I9-F11 PolarHBondContact O-N 3.01Å; F11-L13 VanDerWaalsContact C-N 3.35Å; F11-L13 PolarHBondContact O-N 3.31Å; F11-M14 PolarHBondContact O-N 3.3Å; F11-E15 WeakPolarHBondContact O-CB 3.5Å; F11-E15 PolarHBondContact O-N 2.66Å; F11-K101 HydrophobicContact CZ-CB 4.4Å; F11-L105 HydrophobicContact CD1-CD1 3.97Å; F11-L105 HydrophobicContact CE1-CB 3.92Å; F11-L105 HydrophobicContact CE1-CD1 3.59Å; F11-L105 HydrophobicContact CE1-CD2 4.06Å; F11-L105 HydrophobicContact CE1-CG 4.05Å
12	I	88.5	Confident	85.7	Confident	4 Å²	4	55.9 Å²	55.9	2%	0.021	30%	0.299	C	S	.	.	H	α-helix	trans	-62.2	-43.9	179.3	-67.8	165.2	0	0	0	111.1	Q8 I9 L10 E15 K16 V19 L24 R27 F28	Q8-I12 WeakPolarHBondContact O-CD1 3.28Å; Q8-I12 WeakPolarHBondContact O-CG1 3.1Å; Q8-I12 PolarHBondContact O-N 3.38Å; I9-I12 WeakPolarHBondContact O-CB 3.4Å; I9-I12 PolarHBondContact O-N 2.66Å; L10-I12 VanDerWaalsContact C-N 3.31Å; L10-I12 PolarHBondContact O-N 3.37Å; I12-E15 PolarHBondContact O-N 2.93Å; I12-K16 HydrophobicContact CG2-CD 4.27Å; I12-K16 WeakPolarHBondContact O-CB 3.23Å; I12-K16 PolarHBondContact O-N 3.18Å; I12-V19 HydrophobicContact CG2-CB 4.46Å; I12-V19 HydrophobicContact CG2-CG2 3.62Å; I12-L24 HydrophobicContact CD1-CD2 3.95Å; I12-L24 HydrophobicContact CG2-CD2 4.01Å; I12-R27 VanDerWaalsContact CD1-CZ 3.46Å; I12-F28 HydrophobicContact CD1-CE2 3.98Å; I12-F28 HydrophobicContact CD1-CZ 3.61Å
13	L	88.6	Confident	87.2	Confident	0 Å²	0	54.6 Å²	54.6	0%	0	29%	0.293	C	S	.	.	H	α-helix	trans	-68	-37.1	178.9	-64.5	178.1	0	0	0	111.6	I9 L10 F11 G17 V19 V49 I59 I61	I9-L13 HydrophobicContact CG2-CD1 3.9Å; I9-L13 HydrophobicContact CG2-CG 4.26Å; I9-L13 VanDerWaalsContact O-CG 3.31Å; I9-L13 WeakPolarHBondContact O-CG 3.12Å; I9-L13 PolarHBondContact O-N 3.43Å; L10-L13 PolarHBondContact O-N 3.21Å; F11-L13 VanDerWaalsContact C-N 3.35Å; F11-L13 PolarHBondContact O-N 3.31Å; L13-G17 CarbonylContact O-C 3.55Å; L13-G17 WeakPolarHBondContact O-CA 3.49Å; L13-G17 PolarHBondContact O-N 3Å; L13-V19 HydrophobicContact CD2-CB 4.31Å; L13-V19 HydrophobicContact CD2-CG2 4.45Å; L13-V49 HydrophobicContact CD1-CG1 3.59Å; L13-V49 HydrophobicContact CD1-CG2 4.36Å; L13-I59 HydrophobicContact CD1-CG2 3.71Å; L13-I59 HydrophobicContact CD2-CB 4.3Å; L13-I59 HydrophobicContact CD2-CG2 3.93Å; L13-I59 WeakPolarHBondContact CD2-O 3.47Å; L13-I59 HydrophobicContact CG-CG2 4.46Å; L13-I61 HydrophobicContact CB-CB 4.29Å; L13-I61 HydrophobicContact CB-CG2 4.36Å
14	M	81.3	Confident	88.5	Confident	30 Å²	30	46.7 Å²	46.7	15%	0.148	26%	0.256	C	S	.	.	H	α-helix	trans	-68.3	-33.7	175.9	-71.4	-178.5	67.7	0	0	113	L10 F11 I61 L105	L10-M14 HydrophobicContact CD1-CG 4.28Å; L10-M14 HydrophobicContact CD1-SD 4.13Å; L10-M14 HydrophobicContact CG-SD 4.06Å; L10-M14 WeakPolarHBondContact O-CG 3.2Å; L10-M14 PolarHBondContact O-N 3.27Å; F11-M14 PolarHBondContact O-N 3.3Å; M14-I61 HydrophobicContact CG-CD1 4.23Å; M14-L105 HydrophobicContact CE-CD1 3.86Å; M14-L105 WeakPolarHBondContact CE-O 3.46Å; M14-L105 HydrophobicContact SD-CD1 3.48Å; M14-L105 WeakPolarHBondContact SD-CD1 3.35Å
15	E	82.2	Confident	89.2	Confident	142 Å²	142	44.4 Å²	44.4	66%	0.664	24%	0.24	S	C	*	.	H	α-helix	trans	-79.9	-46.2	179.1	-174.3	-176.5	-173.6	0	0	112.3	F11 I12	F11-E15 WeakPolarHBondContact O-CB 3.5Å; F11-E15 PolarHBondContact O-N 2.66Å; I12-E15 PolarHBondContact O-N 2.93Å
16	K	84.4	Confident	89.4	Confident	131 Å²	131	50 Å²	50	57%	0.57	27%	0.269	S	S	*	.	H	α-helix	trans	-94.2	-12.5	-173.9	-63.9	-169.6	174.3	-169.6	0	114.3	I12 S18 V19	I12-K16 HydrophobicContact CG2-CD 4.27Å; I12-K16 WeakPolarHBondContact O-CB 3.23Å; I12-K16 PolarHBondContact O-N 3.18Å; K16-S18 PolarHBondContact O-N 3.22Å; K16-V19 HydrophobicContact CB-CG2 3.88Å; K16-V19 HydrophobicContact CD-CG2 3.72Å; K16-V19 HydrophobicContact CG-CG2 4.37Å
17	G	83.7	Confident	89.6	Confident	39 Å²	39	55 Å²	55	40%	0.402	29%	0.285	S	S	.	.	S	Bend	trans	75.4	-51	-172	0	0	0	0	0	113.4	L13 F60	L13-G17 CarbonylContact O-C 3.55Å; L13-G17 WeakPolarHBondContact O-CA 3.49Å; L13-G17 PolarHBondContact O-N 3Å; G17-F60 WeakPolarHBondContact O-CA 3.48Å; G17-F60 WeakPolarHBondContact O-CB 3.33Å
18	S	88.6	Confident	90	Very high	59 Å²	59	52.5 Å²	52.5	41%	0.413	27%	0.271	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	140.8	-178.5	-175.5	0	0	0	0	112.2	K16 I59	K16-S18 PolarHBondContact O-N 3.22Å; S18-I59 CarbonylContact C-O 3.44Å; S18-I59 WeakPolarHBondContact CA-O 3.21Å
19	V	93.5	Very high	90.3	Very high	14 Å²	14	57.3 Å²	57.3	9%	0.085	29%	0.293	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.4	147.6	178	-176.4	0	0	0	0	110.4	I12 L13 K16 D23 L24 I59	I12-V19 HydrophobicContact CG2-CB 4.46Å; I12-V19 HydrophobicContact CG2-CG2 3.62Å; L13-V19 HydrophobicContact CD2-CB 4.31Å; L13-V19 HydrophobicContact CD2-CG2 4.45Å; K16-V19 HydrophobicContact CB-CG2 3.88Å; K16-V19 HydrophobicContact CD-CG2 3.72Å; K16-V19 HydrophobicContact CG-CG2 4.37Å; V19-D23 HydrophobicContact CG1-CB 3.75Å; V19-L24 HydrophobicContact CB-CD2 4.45Å; V19-L24 HydrophobicContact CB-CG 4.44Å; V19-L24 HydrophobicContact CG1-CD2 3.93Å; V19-L24 HydrophobicContact CG1-CG 3.87Å; V19-I59 PolarHBondContact N-O 2.89Å; V19-I59 WeakPolarHBondContact O-CA 3.32Å; V19-I59 WeakPolarHBondContact O-CB 3.35Å; V19-I59 PolarHBondContact O-N 3.46Å
20	T	94.5	Very high	90.5	Very high	50 Å²	50	59.1 Å²	59.1	31%	0.307	30%	0.304	S	S	.	.			trans	-80.9	154.7	179.5	78.5	0	0	0	0	112.5	P22 D23 L24	T20-P22 WeakPolarHBondContact OG1-CD 3.42Å; T20-D23 WeakPolarHBondContact CB-OD2 3.45Å; T20-D23 PolarHBondContact N-OD2 3.45Å; T20-D23 PolarHBondContact O-N 2.97Å; T20-D23 PolarHBondContact OG1-N 3.18Å; T20-D23 PolarHBondContact OG1-OD1 2.85Å; T20-D23 PolarHBondContact OG1-OD2 3.03Å; T20-L24 PolarHBondContact O-N 3.33Å
21	A	94.2	Very high	91	Very high	4 Å²	4	61.7 Å²	61.7	3%	0.033	32%	0.323	C	S	.	.	H	α-helix	trans	-61.1	-39.5	175.7	0	0	0	0	0	113.2	L24 A25 I35 Y36 I59	A21-L24 PolarHBondContact O-N 2.93Å; A21-A25 WeakPolarHBondContact O-CB 3.47Å; A21-A25 PolarHBondContact O-N 2.9Å; A21-I35 HydrophobicContact CB-CG2 4.29Å; A21-Y36 HydrophobicContact CB-CE1 4.14Å; A21-Y36 HydrophobicContact CB-CE2 3.91Å; A21-I59 HydrophobicContact CB-CD1 3.79Å
22	P	93.6	Very high	91.5	Very high	81 Å²	81	61.6 Å²	61.6	53%	0.526	33%	0.329	S	S	.	.	H	α-helix	trans	-57.6	-43.5	170.6	-28.4	37.2	0	0	0	114.3	T20 L24 A25 E26	T20-P22 WeakPolarHBondContact OG1-CD 3.42Å; P22-L24 VanDerWaalsContact C-N 3.34Å; P22-L24 PolarHBondContact O-N 3.21Å; P22-A25 WeakPolarHBondContact O-CB 3.5Å; P22-A25 PolarHBondContact O-N 2.87Å; P22-A25 VanDerWaalsContact O-N 3.16Å; P22-E26 PolarHBondContact O-N 2.76Å
23	D	94.2	Very high	91.8	Very high	80 Å²	80	71 Å²	71	43%	0.428	36%	0.364	S	S	.	.	H	α-helix	trans	-64.5	-40.6	-179.3	-56.5	-33.9	0	0	0	111.6	V19 T20 R27	V19-D23 HydrophobicContact CG1-CB 3.75Å; T20-D23 WeakPolarHBondContact CB-OD2 3.45Å; T20-D23 PolarHBondContact N-OD2 3.45Å; T20-D23 PolarHBondContact O-N 2.97Å; T20-D23 PolarHBondContact OG1-N 3.18Å; T20-D23 PolarHBondContact OG1-OD1 2.85Å; T20-D23 PolarHBondContact OG1-OD2 3.03Å; D23-R27 VanDerWaalsContact O-CB 3.28Å; D23-R27 WeakPolarHBondContact O-CB 3.26Å; D23-R27 PolarHBondContact O-N 2.92Å
24	L	95	Very high	92.1	Very high	1 Å²	1	72.9 Å²	72.9	1%	0.005	38%	0.376	C	S	.	.	H	α-helix	trans	-67.6	-39	174.5	-65.4	176	0	0	0	111.2	I9 I12 V19 T20 A21 P22 R27 F28 I35 I59	I9-L24 HydrophobicContact CG1-CD1 4.5Å; I9-L24 HydrophobicContact CG2-CD1 4.18Å; I12-L24 HydrophobicContact CD1-CD2 3.95Å; I12-L24 HydrophobicContact CG2-CD2 4.01Å; V19-L24 HydrophobicContact CB-CD2 4.45Å; V19-L24 HydrophobicContact CB-CG 4.44Å; V19-L24 HydrophobicContact CG1-CD2 3.93Å; V19-L24 HydrophobicContact CG1-CG 3.87Å; T20-L24 PolarHBondContact O-N 3.33Å; A21-L24 PolarHBondContact O-N 2.93Å; P22-L24 VanDerWaalsContact C-N 3.34Å; P22-L24 PolarHBondContact O-N 3.21Å; L24-R27 PolarHBondContact O-N 2.95Å; L24-F28 HydrophobicContact CB-CD2 4.33Å; L24-F28 HydrophobicContact CB-CE2 4.44Å; L24-F28 HydrophobicContact CD2-CE2 4.02Å; L24-F28 WeakPolarHBondContact O-CB 3.44Å; L24-F28 WeakPolarHBondContact O-CD2 3.33Å; L24-F28 PolarHBondContact O-N 3.11Å; L24-I35 HydrophobicContact CB-CD1 3.81Å; L24-I35 HydrophobicContact CB-CG1 4Å; L24-I35 HydrophobicContact CB-CG2 4.02Å; L24-I35 HydrophobicContact CD1-CG2 3.85Å; L24-I59 HydrophobicContact CD1-CD1 3.88Å
25	A	95.2	Very high	92.8	Very high	10 Å²	10	71.4 Å²	71.4	8%	0.083	37%	0.369	C	S	.	.	H	α-helix	trans	-62.5	-46.1	178.9	0	0	0	0	0	111.5	A21 P22 E29 V30 A32 I35	A21-A25 WeakPolarHBondContact O-CB 3.47Å; A21-A25 PolarHBondContact O-N 2.9Å; P22-A25 WeakPolarHBondContact O-CB 3.5Å; P22-A25 PolarHBondContact O-N 2.87Å; P22-A25 VanDerWaalsContact O-N 3.16Å; A25-E29 WeakPolarHBondContact O-CA 3.47Å; A25-E29 PolarHBondContact O-N 3.23Å; A25-V30 CarbonylContact C-O 3.5Å; A25-V30 WeakPolarHBondContact CA-O 3.5Å; A25-V30 VanDerWaalsContact CB-O 3.24Å; A25-V30 WeakPolarHBondContact CB-O 3.36Å; A25-V30 PolarHBondContact O-N 3.39Å; A25-A32 HydrophobicContact CB-CB 4.47Å; A25-I35 HydrophobicContact CB-CG1 3.99Å
26	E	95.2	Very high	93.3	Very high	158 Å²	158	68.8 Å²	68.8	74%	0.738	35%	0.353	S	S	*	.	H	α-helix	trans	-61.3	-49.5	173.6	-176.1	175.5	-165	0	0	110.9	P22 F28 E29	P22-E26 PolarHBondContact O-N 2.76Å; E26-F28 VanDerWaalsContact C-N 3.29Å; E26-F28 PolarHBondContact O-N 2.89Å; E26-E29 PolarHBondContact O-N 3.03Å
27	R	93.7	Very high	93.8	Very high	138 Å²	138	71.3 Å²	71.3	52%	0.521	36%	0.359	S	S	.	.	H	α-helix	trans	-59.5	-36.9	-178.8	-179.1	172.7	-176.6	170.9	0.7	114	I12 D23 L24	I12-R27 VanDerWaalsContact CD1-CZ 3.46Å; D23-R27 VanDerWaalsContact O-CB 3.28Å; D23-R27 WeakPolarHBondContact O-CB 3.26Å; D23-R27 PolarHBondContact O-N 2.92Å; L24-R27 PolarHBondContact O-N 2.95Å
28	F	94.4	Very high	94.3	Very high	33 Å²	33	69.9 Å²	69.9	15%	0.145	34%	0.342	C	S	.	.	T	Hydrogen-bonded Turn	trans	-100.2	4.7	-177.5	-65.2	-60.2	0	0	0	113.5	R5 Q8 I9 I12 L24 E26 V30 I35	R5-F28 HydrophobicContact CG-CB 4.4Å; R5-F28 HydrophobicContact CG-CD1 3.96Å; R5-F28 HydrophobicContact CG-CD2 4.06Å; R5-F28 HydrophobicContact CG-CE1 4.22Å; R5-F28 HydrophobicContact CG-CE2 4.33Å; R5-F28 HydrophobicContact CG-CG 3.88Å; R5-F28 HydrophobicContact CG-CZ 4.4Å; Q8-F28 HydrophobicContact CB-CE1 3.77Å; Q8-F28 HydrophobicContact CB-CZ 3.66Å; Q8-F28 HydrophobicContact CG-CE1 4.49Å; I9-F28 HydrophobicContact CD1-CE2 4.29Å; I9-F28 HydrophobicContact CG1-CD2 4.21Å; I9-F28 HydrophobicContact CG1-CE2 3.46Å; I9-F28 VanDerWaalsContact CG1-CE2 3.46Å; I9-F28 HydrophobicContact CG1-CZ 4.05Å; I12-F28 HydrophobicContact CD1-CE2 3.98Å; I12-F28 HydrophobicContact CD1-CZ 3.61Å; L24-F28 HydrophobicContact CB-CD2 4.33Å; L24-F28 HydrophobicContact CB-CE2 4.44Å; L24-F28 HydrophobicContact CD2-CE2 4.02Å; L24-F28 WeakPolarHBondContact O-CB 3.44Å; L24-F28 WeakPolarHBondContact O-CD2 3.33Å; L24-F28 PolarHBondContact O-N 3.11Å; E26-F28 VanDerWaalsContact C-N 3.29Å; E26-F28 PolarHBondContact O-N 2.89Å; F28-V30 VanDerWaalsContact C-N 3.27Å; F28-V30 HydrophobicContact CB-CG2 3.99Å; F28-V30 WeakPolarHBondContact O-CG1 3.33Å; F28-V30 PolarHBondContact O-N 3.38Å; F28-I35 HydrophobicContact CD2-CD1 4.05Å
29	E	94.7	Very high	94.5	Very high	183 Å²	183	67.5 Å²	67.5	86%	0.855	33%	0.325	S	S	*	.	T	Hydrogen-bonded Turn	trans	52.9	43.9	-177.9	-58.3	178.8	178.6	0	0	112.5	A25 E26	A25-E29 WeakPolarHBondContact O-CA 3.47Å; A25-E29 PolarHBondContact O-N 3.23Å; E26-E29 PolarHBondContact O-N 3.03Å
30	V	95.8	Very high	94.5	Very high	38 Å²	38	71.9 Å²	71.9	23%	0.23	35%	0.348	C	S	.	.	S	Bend	trans	-129.1	168.5	179.2	-65.1	0	0	0	0	111.3	A25 F28 T34 I35	A25-V30 CarbonylContact C-O 3.5Å; A25-V30 WeakPolarHBondContact CA-O 3.5Å; A25-V30 VanDerWaalsContact CB-O 3.24Å; A25-V30 WeakPolarHBondContact CB-O 3.36Å; A25-V30 PolarHBondContact O-N 3.39Å; F28-V30 VanDerWaalsContact C-N 3.27Å; F28-V30 HydrophobicContact CB-CG2 3.99Å; F28-V30 WeakPolarHBondContact O-CG1 3.33Å; F28-V30 PolarHBondContact O-N 3.38Å; V30-T34 HydrophobicContact CB-CG2 3.99Å; V30-T34 HydrophobicContact CG1-CG2 4.16Å; V30-T34 HydrophobicContact CG2-CG2 4.18Å; V30-I35 HydrophobicContact CG2-CD1 3.55Å; V30-I35 HydrophobicContact CG2-CG1 3.98Å
31	S	95.9	Very high	94.4	Very high	61 Å²	61	71.6 Å²	71.6	43%	0.427	35%	0.35	S	S	.	.			trans	-71.9	153.2	172.4	77.6	0	0	0	0	112	R33 T34 I35	S31-R33 PolarHBondContact O-N 3.27Å; S31-R33 PolarHBondContact OG-N 2.88Å; S31-T34 WeakPolarHBondContact O-CA 3.18Å; S31-T34 VanDerWaalsContact O-CB 3.23Å; S31-T34 WeakPolarHBondContact O-CB 3.41Å; S31-T34 PolarHBondContact O-N 3.31Å; S31-T34 PolarHBondContact OG-N 2.85Å; S31-T34 VanDerWaalsContact OG-N 3.08Å; S31-T34 PolarHBondContact OG-OG1 3.25Å; S31-I35 PolarHBondContact O-N 3.38Å
32	A	94.6	Very high	94.2	Very high	38 Å²	38	71.8 Å²	71.8	31%	0.314	35%	0.351	S	S	.	.	H	α-helix	trans	-57.2	-31.5	170.4	0	0	0	0	0	112.4	A25 T34 I35 Y36	A25-A32 HydrophobicContact CB-CB 4.47Å; A32-T34 VanDerWaalsContact C-N 3.29Å; A32-T34 PolarHBondContact O-N 3.3Å; A32-I35 PolarHBondContact O-N 2.94Å; A32-Y36 WeakPolarHBondContact O-CD2 3.42Å; A32-Y36 PolarHBondContact O-N 3.47Å
33	R	94.2	Very high	94.1	Very high	200 Å²	200	71 Å²	71	76%	0.755	35%	0.347	S	S	*	.	H	α-helix	trans	-62.3	-36	173.1	-176.3	176.9	-175.5	148.4	1.8	112	S31 R37	S31-R33 PolarHBondContact O-N 3.27Å; S31-R33 PolarHBondContact OG-N 2.88Å; R33-R37 WeakPolarHBondContact O-CG 3.45Å; R33-R37 PolarHBondContact O-N 2.9Å
34	T	94.9	Very high	93.8	Very high	40 Å²	40	71.5 Å²	71.5	25%	0.245	36%	0.363	C	S	.	.	H	α-helix	trans	-65.1	-44.7	174.2	-51.4	0	0	0	0	110.5	V30 S31 A32 Y36 R37 D38	V30-T34 HydrophobicContact CB-CG2 3.99Å; V30-T34 HydrophobicContact CG1-CG2 4.16Å; V30-T34 HydrophobicContact CG2-CG2 4.18Å; S31-T34 WeakPolarHBondContact O-CA 3.18Å; S31-T34 VanDerWaalsContact O-CB 3.23Å; S31-T34 WeakPolarHBondContact O-CB 3.41Å; S31-T34 PolarHBondContact O-N 3.31Å; S31-T34 PolarHBondContact OG-N 2.85Å; S31-T34 VanDerWaalsContact OG-N 3.08Å; S31-T34 PolarHBondContact OG-OG1 3.25Å; A32-T34 VanDerWaalsContact C-N 3.29Å; A32-T34 PolarHBondContact O-N 3.3Å; T34-Y36 PolarHBondContact O-N 3.15Å; T34-R37 WeakPolarHBondContact O-CB 3.46Å; T34-R37 PolarHBondContact O-N 3.42Å; T34-D38 PolarHBondContact O-N 2.9Å
35	I	95.3	Very high	93.4	Very high	0 Å²	0	75.1 Å²	75.1	0%	0	39%	0.393	C	S	.	.	H	α-helix	trans	-59.2	-47.1	177	-60.8	-56.4	0	0	0	111.1	I9 A21 L24 A25 F28 V30 S31 A32 R37 D38 I39 I59	I9-I35 HydrophobicContact CD1-CD1 4.24Å; A21-I35 HydrophobicContact CB-CG2 4.29Å; L24-I35 HydrophobicContact CB-CD1 3.81Å; L24-I35 HydrophobicContact CB-CG1 4Å; L24-I35 HydrophobicContact CB-CG2 4.02Å; L24-I35 HydrophobicContact CD1-CG2 3.85Å; A25-I35 HydrophobicContact CB-CG1 3.99Å; F28-I35 HydrophobicContact CD2-CD1 4.05Å; V30-I35 HydrophobicContact CG2-CD1 3.55Å; V30-I35 HydrophobicContact CG2-CG1 3.98Å; S31-I35 PolarHBondContact O-N 3.38Å; A32-I35 PolarHBondContact O-N 2.94Å; I35-R37 VanDerWaalsContact C-N 3.29Å; I35-R37 PolarHBondContact O-N 3.45Å; I35-D38 WeakPolarHBondContact O-CA 3.38Å; I35-D38 WeakPolarHBondContact O-CB 3.15Å; I35-D38 PolarHBondContact O-N 2.97Å; I35-I39 HydrophobicContact CG2-CG1 4.38Å; I35-I39 WeakPolarHBondContact O-CG1 3.17Å; I35-I39 PolarHBondContact O-N 3.18Å; I35-I59 HydrophobicContact CG2-CD1 3.56Å
36	Y	94.5	Very high	92.9	Very high	87 Å²	87	77.5 Å²	77.5	34%	0.341	42%	0.418	S	S	.	.	H	α-helix	trans	-60.2	-38.5	177.5	-72.5	-61.9	0	0	0	112.8	A21 A32 T34 D38 I39 D40 A51	A21-Y36 HydrophobicContact CB-CE1 4.14Å; A21-Y36 HydrophobicContact CB-CE2 3.91Å; A32-Y36 WeakPolarHBondContact O-CD2 3.42Å; A32-Y36 PolarHBondContact O-N 3.47Å; T34-Y36 PolarHBondContact O-N 3.15Å; Y36-D38 VanDerWaalsContact C-N 3.31Å; Y36-D38 PolarHBondContact O-N 3.31Å; Y36-I39 PolarHBondContact O-N 3Å; Y36-D40 VanDerWaalsContact O-CG 3.29Å; Y36-D40 PolarHBondContact O-N 3.37Å; Y36-A51 HydrophobicContact CE1-CB 4.1Å
37	R	93.6	Very high	92.4	Very high	183 Å²	183	71 Å²	71	69%	0.691	39%	0.389	S	S	*	.	H	α-helix	trans	-64.6	-35.2	173.4	-70.2	-179.5	74.9	-174.5	4.2	112.7	R33 T34 I35 D40 A41	R33-R37 WeakPolarHBondContact O-CG 3.45Å; R33-R37 PolarHBondContact O-N 2.9Å; T34-R37 WeakPolarHBondContact O-CB 3.46Å; T34-R37 PolarHBondContact O-N 3.42Å; I35-R37 VanDerWaalsContact C-N 3.29Å; I35-R37 PolarHBondContact O-N 3.45Å; R37-D40 PolarHBondContact O-N 3.43Å; R37-A41 PolarHBondContact O-N 2.89Å
38	D	94.5	Very high	92.1	Very high	9 Å²	9	65.5 Å²	65.5	5%	0.048	37%	0.371	C	S	.	.	H	α-helix	trans	-67.4	-38.5	174.1	-67.9	-31.7	0	0	0	111.3	R5 L6 I9 T34 I35 Y36 A41 L42	R5-D38 IonicContact CZ-OD1 3.69Å; R5-D38 IonicContact CZ-OD2 3.32Å; R5-D38 VanDerWaalsContact CZ-OD2 3.32Å; R5-D38 IonicContact NE-OD1 3.63Å; R5-D38 IonicContact NE-OD2 2.66Å; R5-D38 PolarHBondContact NE-OD2 3.19Å; R5-D38 IonicContact NH2-OD1 3.18Å; R5-D38 PolarHBondContact NH2-OD1 3.2Å; R5-D38 IonicContact NH2-OD2 2.62Å; R5-D38 PolarHBondContact NH2-OD2 2.84Å; L6-D38 HydrophobicContact CD2-CB 3.4Å; L6-D38 VanDerWaalsContact CD2-CB 3.4Å; I9-D38 HydrophobicContact CD1-CB 3.71Å; T34-D38 PolarHBondContact O-N 2.9Å; I35-D38 WeakPolarHBondContact O-CA 3.38Å; I35-D38 WeakPolarHBondContact O-CB 3.15Å; I35-D38 PolarHBondContact O-N 2.97Å; Y36-D38 VanDerWaalsContact C-N 3.31Å; Y36-D38 PolarHBondContact O-N 3.31Å; D38-A41 WeakPolarHBondContact O-CB 3.38Å; D38-A41 PolarHBondContact O-N 3.24Å; D38-L42 WeakPolarHBondContact O-CG 3.48Å; D38-L42 PolarHBondContact O-N 2.96Å
39	I	93.8	Very high	92	Very high	9 Å²	9	64.3 Å²	64.3	5%	0.046	37%	0.366	C	S	.	.	H	α-helix	trans	-63.5	-43.7	173.8	-58.4	-38.5	0	0	0	110.8	I9 I35 Y36 A41 L42 S43 V49 I59	I9-I39 HydrophobicContact CG2-CD1 3.77Å; I35-I39 HydrophobicContact CG2-CG1 4.38Å; I35-I39 WeakPolarHBondContact O-CG1 3.17Å; I35-I39 PolarHBondContact O-N 3.18Å; Y36-I39 PolarHBondContact O-N 3Å; I39-A41 VanDerWaalsContact C-N 3.28Å; I39-A41 PolarHBondContact O-N 3.12Å; I39-L42 HydrophobicContact CD1-CD1 4.24Å; I39-L42 PolarHBondContact O-N 2.89Å; I39-S43 WeakPolarHBondContact O-CB 3.31Å; I39-S43 PolarHBondContact O-N 3.47Å; I39-V49 HydrophobicContact CD1-CG1 4.2Å; I39-V49 HydrophobicContact CG2-CB 4.17Å; I39-V49 HydrophobicContact CG2-CG1 3.76Å; I39-I59 HydrophobicContact CD1-CD1 4.11Å; I39-I59 HydrophobicContact CD1-CG2 3.64Å; I39-I59 HydrophobicContact CG1-CD1 3.78Å; I39-I59 HydrophobicContact CG1-CG1 4.26Å; I39-I59 HydrophobicContact CG1-CG2 3.92Å
40	D	93.6	Very high	91.8	Very high	107 Å²	107	60.7 Å²	60.7	57%	0.572	35%	0.345	S	S	*	.	H	α-helix	trans	-59.4	-40.6	174.8	-64.9	-27.3	0	0	0	111.2	Y36 R37 S43 A44	Y36-D40 VanDerWaalsContact O-CG 3.29Å; Y36-D40 PolarHBondContact O-N 3.37Å; R37-D40 PolarHBondContact O-N 3.43Å; D40-S43 PolarHBondContact O-N 3.41Å; D40-A44 WeakPolarHBondContact O-CB 3.49Å; D40-A44 PolarHBondContact O-N 2.92Å
41	A	92.6	Very high	91.6	Very high	43 Å²	43	61.2 Å²	61.2	36%	0.355	35%	0.353	S	S	.	.	H	α-helix	trans	-66.2	-41.4	177	0	0	0	0	0	112.7	L6 R37 D38 I39 S43 A44 A45	L6-A41 HydrophobicContact CD1-CB 4.17Å; L6-A41 HydrophobicContact CD2-CB 4.31Å; R37-A41 PolarHBondContact O-N 2.89Å; D38-A41 WeakPolarHBondContact O-CB 3.38Å; D38-A41 PolarHBondContact O-N 3.24Å; I39-A41 VanDerWaalsContact C-N 3.28Å; I39-A41 PolarHBondContact O-N 3.12Å; A41-S43 VanDerWaalsContact C-N 3.35Å; A41-A44 PolarHBondContact O-N 3.15Å; A41-A45 PolarHBondContact O-N 3.02Å; A41-A45 VanDerWaalsContact O-N 3.12Å
42	L	89.8	Confident	91.3	Very high	8 Å²	8	62.1 Å²	62.1	4%	0.042	36%	0.356	C	S	.	.	H	α-helix	trans	-62	-44	173.5	-71.6	169.4	0	0	0	111	L6 I9 D38 I39 A45 I47 V49	L6-L42 HydrophobicContact CB-CD2 4.04Å; L6-L42 HydrophobicContact CD2-CG 4.35Å; I9-L42 HydrophobicContact CB-CD1 4.31Å; I9-L42 HydrophobicContact CG2-CD1 3.85Å; D38-L42 WeakPolarHBondContact O-CG 3.48Å; D38-L42 PolarHBondContact O-N 2.96Å; I39-L42 HydrophobicContact CD1-CD1 4.24Å; I39-L42 PolarHBondContact O-N 2.89Å; L42-A45 WeakPolarHBondContact O-CB 3.22Å; L42-A45 PolarHBondContact O-N 3.4Å; L42-A45 VanDerWaalsContact O-N 3.15Å; L42-I47 HydrophobicContact CB-CB 4.42Å; L42-I47 HydrophobicContact CB-CD1 4.43Å; L42-I47 HydrophobicContact CD2-CD1 3.59Å; L42-I47 WeakPolarHBondContact O-CB 3.4Å; L42-I47 PolarHBondContact O-N 3.24Å; L42-I47 VanDerWaalsContact O-N 3.12Å; L42-V49 HydrophobicContact CB-CG2 4.11Å; L42-V49 HydrophobicContact CD1-CG2 4.29Å
43	S	89.6	Confident	90.9	Very high	65 Å²	65	70.8 Å²	70.8	46%	0.455	38%	0.381	S	S	.	.	H	α-helix	trans	-62.1	-44.3	177.2	-169.3	0	0	0	0	112.1	I39 D40 A41 A45 G46 I47	I39-S43 WeakPolarHBondContact O-CB 3.31Å; I39-S43 PolarHBondContact O-N 3.47Å; D40-S43 PolarHBondContact O-N 3.41Å; A41-S43 VanDerWaalsContact C-N 3.35Å; S43-A45 PolarHBondContact O-N 2.99Å; S43-G46 PolarHBondContact O-N 3.44Å; S43-I47 WeakPolarHBondContact CA-O 3.39Å
44	A	89.3	Confident	90.2	Very high	91 Å²	91	64.1 Å²	64.1	75%	0.752	38%	0.375	S	S	*	.	H	α-helix	trans	-62.5	-25.5	175.5	0	0	0	0	0	113.3	D40 A41 G46	D40-A44 WeakPolarHBondContact O-CB 3.49Å; D40-A44 PolarHBondContact O-N 2.92Å; A41-A44 PolarHBondContact O-N 3.15Å; A44-G46 PolarHBondContact O-N 3.42Å
45	A	85.7	Confident	89.3	Confident	77 Å²	77	72.9 Å²	72.9	64%	0.636	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	7.1	173.5	0	0	0	0	0	113.7	A41 L42 S43	A41-A45 PolarHBondContact O-N 3.02Å; A41-A45 VanDerWaalsContact O-N 3.12Å; L42-A45 WeakPolarHBondContact O-CB 3.22Å; L42-A45 PolarHBondContact O-N 3.4Å; L42-A45 VanDerWaalsContact O-N 3.15Å; S43-A45 PolarHBondContact O-N 2.99Å
46	G	84.3	Confident	88.3	Confident	60 Å²	60	77 Å²	77	62%	0.619	45%	0.452	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.5	12.3	179	0	0	0	0	0	114.5	S43 A44	S43-G46 PolarHBondContact O-N 3.44Å; A44-G46 PolarHBondContact O-N 3.42Å
47	I	85.7	Confident	87.7	Confident	22 Å²	22	73.7 Å²	73.7	11%	0.113	45%	0.445	C	S	.	.			trans	-88.8	121.5	175.7	-54.3	171.8	0	0	0	108.1	L10 L42 S43 V49 I61 Y65	L10-I47 HydrophobicContact CD1-CG2 3.78Å; L10-I47 HydrophobicContact CD2-CD1 4.11Å; L42-I47 HydrophobicContact CB-CB 4.42Å; L42-I47 HydrophobicContact CB-CD1 4.43Å; L42-I47 HydrophobicContact CD2-CD1 3.59Å; L42-I47 WeakPolarHBondContact O-CB 3.4Å; L42-I47 PolarHBondContact O-N 3.24Å; L42-I47 VanDerWaalsContact O-N 3.12Å; S43-I47 WeakPolarHBondContact CA-O 3.39Å; I47-V49 HydrophobicContact CB-CG2 4.3Å; I47-V49 HydrophobicContact CG2-CG2 3.59Å; I47-V49 PolarHBondContact O-N 2.95Å; I47-I61 HydrophobicContact CG2-CD1 3.89Å; I47-Y65 HydrophobicContact CG2-CE1 3.91Å
48	P	87.8	Confident	87.6	Confident	22 Å²	22	65.4 Å²	65.4	14%	0.143	42%	0.416	C	S	.	.			trans	-79.8	70.5	-174.5	34.8	-35.3	0	0	0	110.8	Y50 Q62 Y65	P48-Y50 HydrophobicContact CB-CE2 3.98Å; P48-Y50 WeakPolarHBondContact O-CD2 3.16Å; P48-Y50 WeakPolarHBondContact O-CE2 3.47Å; P48-Q62 HydrophobicContact CB-CB 4.11Å; P48-Q62 HydrophobicContact CG-CB 3.97Å; P48-Q62 PolarHBondContact O-N 3.12Å; P48-Y65 VanDerWaalsContact CD-CZ 3.47Å; P48-Y65 HydrophobicContact CG-CD2 3.17Å; P48-Y65 HydrophobicContact CG-CE2 3.51Å; P48-Y65 HydrophobicContact CG-CG 3.74Å
49	V	91.3	Very high	87.6	Confident	7 Å²	7	65 Å²	65	4%	0.042	41%	0.414	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-94.8	134.7	172.8	-170.6	0	0	0	0	109.1	L13 I39 L42 I47 I59 F60 I61	L13-V49 HydrophobicContact CD1-CG1 3.59Å; L13-V49 HydrophobicContact CD1-CG2 4.36Å; I39-V49 HydrophobicContact CD1-CG1 4.2Å; I39-V49 HydrophobicContact CG2-CB 4.17Å; I39-V49 HydrophobicContact CG2-CG1 3.76Å; L42-V49 HydrophobicContact CB-CG2 4.11Å; L42-V49 HydrophobicContact CD1-CG2 4.29Å; I47-V49 HydrophobicContact CB-CG2 4.3Å; I47-V49 HydrophobicContact CG2-CG2 3.59Å; I47-V49 PolarHBondContact O-N 2.95Å; V49-I59 HydrophobicContact CG1-CG2 3.58Å; V49-F60 WeakPolarHBondContact CA-O 3.14Å; V49-I61 HydrophobicContact CG2-CD1 4.45Å; V49-I61 HydrophobicContact CG2-CG1 4.43Å
50	Y	90.8	Very high	87.5	Confident	107 Å²	107	67.7 Å²	67.7	42%	0.42	43%	0.425	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	153.5	-178.2	-54.7	-81.1	0	0	0	110.2	P48 I59 F60 Q62	P48-Y50 HydrophobicContact CB-CE2 3.98Å; P48-Y50 WeakPolarHBondContact O-CD2 3.16Å; P48-Y50 WeakPolarHBondContact O-CE2 3.47Å; Y50-I59 CarbonylContact O-C 3.57Å; Y50-I59 VanDerWaalsContact O-CA 3.26Å; Y50-I59 WeakPolarHBondContact O-CA 3.16Å; Y50-F60 HydrophobicContact CD2-CD2 4.23Å; Y50-F60 AromaticContact CD2-CE2 3.81Å; Y50-F60 HydrophobicContact CD2-CE2 3.81Å; Y50-F60 HydrophobicContact CG-CE2 4.1Å; Y50-F60 HydrophobicContact CG-CZ 4.36Å; Y50-F60 PolarHBondContact N-O 3.24Å; Y50-F60 PolarHBondContact O-N 2.95Å; Y50-Q62 HydrophobicContact CE2-CB 3.92Å; Y50-Q62 HydrophobicContact CE2-CG 4.33Å
51	A	91.9	Very high	87.2	Confident	49 Å²	49	63.2 Å²	63.2	41%	0.405	40%	0.401	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.2	117	174.1	0	0	0	0	0	109.9	Y36 G58 I59	Y36-A51 HydrophobicContact CE1-CB 4.1Å; A51-G58 WeakPolarHBondContact CA-O 3.48Å; A51-I59 HydrophobicContact CB-CG1 4.12Å
52	V	89.7	Confident	86.8	Confident	81 Å²	81	66 Å²	66	49%	0.491	41%	0.407	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-106	130.8	175.5	172.9	0	0	0	0	109.4	G57 G58 F60	V52-G57 CarbonylContact O-C 3.57Å; V52-G57 VanDerWaalsContact O-CA 3.23Å; V52-G57 WeakPolarHBondContact O-CA 3.34Å; V52-G58 PolarHBondContact N-O 3.31Å; V52-G58 PolarHBondContact O-N 2.82Å; V52-F60 HydrophobicContact CB-CE1 4.1Å; V52-F60 HydrophobicContact CG2-CE1 3.55Å; V52-F60 HydrophobicContact CG2-CZ 3.89Å
53	R	85.8	Confident	85.9	Confident	219 Å²	219	73.9 Å²	73.9	83%	0.826	44%	0.443	S	S	*	.			trans	-90.5	146.5	177.1	-64.4	-176.4	179.9	-178.1	1.2	110.6
54	G	79.3	Confident	84.8	Confident	61 Å²	61	77.7 Å²	77.7	63%	0.629	46%	0.458	S	S	*	.	S	Bend	trans	117	-175.1	172.3	0	0	0	0	0	113.7	G56 G57	G54-G56 PolarHBondContact O-N 3.01Å; G54-G57 WeakPolarHBondContact O-CA 3.39Å; G54-G57 PolarHBondContact O-N 2.96Å
55	K	76.3	Confident	83.7	Confident	223 Å²	223	75.5 Å²	75.5	97%	0.97	43%	0.431	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	119.9	178	-170.4	179.6	-179	-178.4	0	109.2	G57	K55-G57 VanDerWaalsContact C-N 3.28Å
56	G	74.7	Confident	82.4	Confident	86 Å²	86	73.8 Å²	73.8	89%	0.887	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	82.1	3.5	-171.4	0	0	0	0	0	114.3	G54	G54-G56 PolarHBondContact O-N 3.01Å
57	G	81.7	Confident	81.2	Confident	19 Å²	19	72.7 Å²	72.7	20%	0.196	39%	0.392	C	S	.	.			trans	-75.7	167	170.1	0	0	0	0	0	112.3	V52 G54 K55	V52-G57 CarbonylContact O-C 3.57Å; V52-G57 VanDerWaalsContact O-CA 3.23Å; V52-G57 WeakPolarHBondContact O-CA 3.34Å; G54-G57 WeakPolarHBondContact O-CA 3.39Å; G54-G57 PolarHBondContact O-N 2.96Å; K55-G57 VanDerWaalsContact C-N 3.28Å
58	G	91.4	Very high	79.7	Confident	8 Å²	8	76.5 Å²	76.5	8%	0.082	41%	0.413	C	S	.	.	E	Extended strand (participates in β ladder)	trans	177.8	173.6	-177.4	0	0	0	0	0	110.7	A51 V52	A51-G58 WeakPolarHBondContact CA-O 3.48Å; V52-G58 PolarHBondContact N-O 3.31Å; V52-G58 PolarHBondContact O-N 2.82Å
59	I	94.4	Very high	78	Confident	2 Å²	2	81.8 Å²	81.8	1%	0.01	43%	0.434	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.3	126.9	164.7	-60.9	163.4	0	0	0	106.4	L13 S18 V19 A21 L24 I35 I39 V49 Y50 A51	L13-I59 HydrophobicContact CD1-CG2 3.71Å; L13-I59 HydrophobicContact CD2-CB 4.3Å; L13-I59 HydrophobicContact CD2-CG2 3.93Å; L13-I59 WeakPolarHBondContact CD2-O 3.47Å; L13-I59 HydrophobicContact CG-CG2 4.46Å; S18-I59 CarbonylContact C-O 3.44Å; S18-I59 WeakPolarHBondContact CA-O 3.21Å; V19-I59 PolarHBondContact N-O 2.89Å; V19-I59 WeakPolarHBondContact O-CA 3.32Å; V19-I59 WeakPolarHBondContact O-CB 3.35Å; V19-I59 PolarHBondContact O-N 3.46Å; A21-I59 HydrophobicContact CB-CD1 3.79Å; L24-I59 HydrophobicContact CD1-CD1 3.88Å; I35-I59 HydrophobicContact CG2-CD1 3.56Å; I39-I59 HydrophobicContact CD1-CD1 4.11Å; I39-I59 HydrophobicContact CD1-CG2 3.64Å; I39-I59 HydrophobicContact CG1-CD1 3.78Å; I39-I59 HydrophobicContact CG1-CG1 4.26Å; I39-I59 HydrophobicContact CG1-CG2 3.92Å; V49-I59 HydrophobicContact CG1-CG2 3.58Å; Y50-I59 CarbonylContact O-C 3.57Å; Y50-I59 VanDerWaalsContact O-CA 3.26Å; Y50-I59 WeakPolarHBondContact O-CA 3.16Å; A51-I59 HydrophobicContact CB-CG1 4.12Å
60	F	91.6	Very high	76.3	Confident	64 Å²	64	85.9 Å²	85.9	28%	0.281	47%	0.469	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-142	157.1	179.6	57.9	-87.2	0	0	0	110	G17 V49 Y50 V52	G17-F60 WeakPolarHBondContact O-CA 3.48Å; G17-F60 WeakPolarHBondContact O-CB 3.33Å; V49-F60 WeakPolarHBondContact CA-O 3.14Å; Y50-F60 HydrophobicContact CD2-CD2 4.23Å; Y50-F60 AromaticContact CD2-CE2 3.81Å; Y50-F60 HydrophobicContact CD2-CE2 3.81Å; Y50-F60 HydrophobicContact CG-CE2 4.1Å; Y50-F60 HydrophobicContact CG-CZ 4.36Å; Y50-F60 PolarHBondContact N-O 3.24Å; Y50-F60 PolarHBondContact O-N 2.95Å; V52-F60 HydrophobicContact CB-CE1 4.1Å; V52-F60 HydrophobicContact CG2-CE1 3.55Å; V52-F60 HydrophobicContact CG2-CZ 3.89Å
61	I	87.4	Confident	75.1	Confident	14 Å²	14	85.4 Å²	85.4	7%	0.072	48%	0.477	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.3	148.4	170.6	-160.3	158.8	0	0	0	108.7	L10 L13 M14 I47 V49 E63 Y65	L10-I61 HydrophobicContact CD1-CD1 3.43Å; L10-I61 VanDerWaalsContact CD1-CD1 3.43Å; L13-I61 HydrophobicContact CB-CB 4.29Å; L13-I61 HydrophobicContact CB-CG2 4.36Å; M14-I61 HydrophobicContact CG-CD1 4.23Å; I47-I61 HydrophobicContact CG2-CD1 3.89Å; V49-I61 HydrophobicContact CG2-CD1 4.45Å; V49-I61 HydrophobicContact CG2-CG1 4.43Å; I61-E63 PolarHBondContact O-N 3.35Å; I61-Y65 HydrophobicContact CD1-CD1 3.19Å; I61-Y65 HydrophobicContact CD1-CE1 3.62Å; I61-Y65 HydrophobicContact CD1-CG 4.01Å; I61-Y65 HydrophobicContact CG1-CD1 3.67Å; I61-Y65 HydrophobicContact CG1-CE1 4.4Å; I61-Y65 HydrophobicContact CG1-CG 3.96Å
62	Q	83.5	Confident	74.5	Confident	100 Å²	100	87 Å²	87	47%	0.467	47%	0.474	S	S	.	.	P	Polyproline II helix	trans	-47.9	132.8	178.2	-161.2	176.8	-25.4	0	0	110.9	P48 Y50 N64 Y65	P48-Q62 HydrophobicContact CB-CB 4.11Å; P48-Q62 HydrophobicContact CG-CB 3.97Å; P48-Q62 PolarHBondContact O-N 3.12Å; Y50-Q62 HydrophobicContact CE2-CB 3.92Å; Y50-Q62 HydrophobicContact CE2-CG 4.33Å; Q62-N64 PolarHBondContact O-N 3.28Å; Q62-Y65 WeakPolarHBondContact O-CB 3.43Å; Q62-Y65 PolarHBondContact O-N 3.35Å
63	E	71.4	Confident	74.1	Confident	175 Å²	175	84.9 Å²	84.9	82%	0.818	46%	0.464	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.6	135.5	172.8	-72.9	-177	174.9	0	0	109.5	I61 Y65	I61-E63 PolarHBondContact O-N 3.35Å; E63-Y65 PolarHBondContact O-N 3.46Å
64	N	66	Low	73.8	Confident	144 Å²	144	77.2 Å²	77.2	77%	0.77	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	65.8	11	-172.2	-51.5	-40.3	0	0	0	116.1	Q62 V66	Q62-N64 PolarHBondContact O-N 3.28Å; N64-V66 VanDerWaalsContact C-N 3.34Å; N64-V66 PolarHBondContact O-N 3.33Å
65	Y	67.4	Low	74.1	Confident	46 Å²	46	79.9 Å²	79.9	18%	0.18	44%	0.435	C	S	.	.			trans	-64.3	102.5	161.6	-172.3	-100.4	0	0	0	108.7	I47 P48 I61 Q62 E63 L67	I47-Y65 HydrophobicContact CG2-CE1 3.91Å; P48-Y65 VanDerWaalsContact CD-CZ 3.47Å; P48-Y65 HydrophobicContact CG-CD2 3.17Å; P48-Y65 HydrophobicContact CG-CE2 3.51Å; P48-Y65 HydrophobicContact CG-CG 3.74Å; I61-Y65 HydrophobicContact CD1-CD1 3.19Å; I61-Y65 HydrophobicContact CD1-CE1 3.62Å; I61-Y65 HydrophobicContact CD1-CG 4.01Å; I61-Y65 HydrophobicContact CG1-CD1 3.67Å; I61-Y65 HydrophobicContact CG1-CE1 4.4Å; I61-Y65 HydrophobicContact CG1-CG 3.96Å; Q62-Y65 WeakPolarHBondContact O-CB 3.43Å; Q62-Y65 PolarHBondContact O-N 3.35Å; E63-Y65 PolarHBondContact O-N 3.46Å; Y65-L67 HydrophobicContact CE1-CD1 4.16Å
66	V	58.7	Low	74.5	Confident	40 Å²	40	73.3 Å²	73.3	24%	0.242	41%	0.408	C	S	.	.			trans	-84.6	154	154.2	-171.2	0	0	0	0	105	N64 N68 K107	N64-V66 VanDerWaalsContact C-N 3.34Å; N64-V66 PolarHBondContact O-N 3.33Å; V66-N68 HydrophobicContact CB-CB 4.08Å; V66-N68 WeakPolarHBondContact O-CB 3.19Å; V66-N68 PolarHBondContact O-N 2.82Å; V66-K107 HydrophobicContact CG2-CD 4.11Å
67	L	58.9	Low	75	Confident	37 Å²	37	69.5 Å²	69.5	19%	0.194	37%	0.367	C	S	.	.			trans	-64.4	75.5	159.4	-154.3	88.2	0	0	0	106.8	L10 Y65 K69 L105	L10-L67 HydrophobicContact CD2-CD1 4.19Å; Y65-L67 HydrophobicContact CE1-CD1 4.16Å; L67-K69 PolarHBondContact O-N 3.25Å; L67-L105 HydrophobicContact CD2-CD2 4.14Å; L67-L105 HydrophobicContact CD2-CG 4.4Å
68	N	54.3	Low	75.1	Confident	103 Å²	103	72.9 Å²	72.9	55%	0.551	38%	0.378	S	S	*	.			trans	-91.5	105.5	-158	-173.7	-3.5	0	0	0	107.7	V66 A70	V66-N68 HydrophobicContact CB-CB 4.08Å; V66-N68 WeakPolarHBondContact O-CB 3.19Å; V66-N68 PolarHBondContact O-N 2.82Å; N68-A70 PolarHBondContact O-N 3.22Å
69	K	51.7	Low	74.8	Confident	132 Å²	132	78.7 Å²	78.7	57%	0.574	40%	0.403	S	S	*	.	S	Bend	trans	54.6	-7	165.7	-65.4	-176.5	-178.7	-167.7	0	119	L67 V71 D74	L67-K69 PolarHBondContact O-N 3.25Å; K69-V71 PolarHBondContact O-N 2.82Å; K69-D74 VanDerWaalsContact CE-OD2 3.23Å; K69-D74 WeakPolarHBondContact CE-OD2 3.46Å; K69-D74 IonicContact NZ-OD2 2.68Å
70	A	54.7	Low	74.4	Confident	94 Å²	94	81 Å²	81	78%	0.777	41%	0.414	S	S	*	.	S	Bend	trans	-70.7	-17.4	-175	0	0	0	0	0	113.1	N68	N68-A70 PolarHBondContact O-N 3.22Å
71	V	67.4	Low	73.9	Confident	97 Å²	97	78.1 Å²	78.1	59%	0.588	40%	0.402	S	S	*	.	S	Bend	trans	-128.3	-41.5	-178.6	-170.3	0	0	0	0	112.4	K69	K69-V71 PolarHBondContact O-N 2.82Å
72	F	77.9	Confident	73.6	Confident	81 Å²	81	79.7 Å²	79.7	36%	0.355	41%	0.41	S	S	.	.			trans	-134.3	136	-178.6	-58.7	-65.8	0	0	0	111.9	E76 Q77 I80 F106	F72-E76 VanDerWaalsContact CA-OE2 3.23Å; F72-E76 WeakPolarHBondContact CA-OE2 3.37Å; F72-E76 HydrophobicContact CB-CB 4.02Å; F72-E76 HydrophobicContact CD1-CB 4.32Å; F72-Q77 HydrophobicContact CB-CG 3.96Å; F72-Q77 PolarHBondContact O-NE2 3.49Å; F72-I80 HydrophobicContact CD1-CD1 3.98Å; F72-I80 HydrophobicContact CD2-CD1 4.23Å; F72-I80 HydrophobicContact CE1-CD1 4.08Å; F72-I80 HydrophobicContact CE2-CD1 4.32Å; F72-I80 HydrophobicContact CG-CD1 4.06Å; F72-I80 HydrophobicContact CZ-CD1 4.25Å; F72-F106 HydrophobicContact CD2-CE1 4.5Å; F72-F106 HydrophobicContact CD2-CZ 4.48Å
73	S	81.3	Confident	73.5	Confident	38 Å²	38	77.4 Å²	77.4	27%	0.266	41%	0.408	S	S	.	.			trans	-65.5	165.9	171.1	93	0	0	0	0	111.6	E75 E76 Q77	S73-E75 WeakPolarHBondContact CB-OE2 3.19Å; S73-E75 PolarHBondContact O-N 3.11Å; S73-E75 PolarHBondContact OG-N 3.38Å; S73-E75 PolarHBondContact OG-OE2 2.64Å; S73-E76 PolarHBondContact N-OE2 2.79Å; S73-E76 PolarHBondContact O-N 3.42Å; S73-E76 PolarHBondContact OG-N 3.43Å; S73-E76 VanDerWaalsContact OG-N 3.15Å; S73-Q77 VanDerWaalsContact O-CG 3.27Å; S73-Q77 WeakPolarHBondContact O-CG 3.35Å; S73-Q77 PolarHBondContact O-N 2.83Å
74	D	80.5	Confident	73.9	Confident	58 Å²	58	70.6 Å²	70.6	31%	0.31	38%	0.377	S	S	.	.	H	α-helix	trans	-59.1	-38.5	175.9	-80	-59.1	0	0	0	111.9	K69 Q78 K108	K69-D74 VanDerWaalsContact CE-OD2 3.23Å; K69-D74 WeakPolarHBondContact CE-OD2 3.46Å; K69-D74 IonicContact NZ-OD2 2.68Å; D74-Q78 WeakPolarHBondContact O-CG 3.44Å; D74-Q78 PolarHBondContact O-N 3.45Å; D74-K108 WeakPolarHBondContact OD1-CE 3.24Å; D74-K108 IonicContact OD1-NZ 2.6Å; D74-K108 PolarHBondContact OD1-NZ 3.47Å
75	E	84.6	Confident	74.3	Confident	116 Å²	116	65.4 Å²	65.4	54%	0.542	35%	0.348	S	S	.	.	H	α-helix	trans	-66.9	-43.8	175.5	-58.7	76.3	-164	0	0	111.6	S73 Q77 Q78 Q79	S73-E75 WeakPolarHBondContact CB-OE2 3.19Å; S73-E75 PolarHBondContact O-N 3.11Å; S73-E75 PolarHBondContact OG-N 3.38Å; S73-E75 PolarHBondContact OG-OE2 2.64Å; E75-Q77 VanDerWaalsContact C-N 3.35Å; E75-Q77 PolarHBondContact O-N 3.29Å; E75-Q78 PolarHBondContact O-N 3.35Å; E75-Q79 VanDerWaalsContact O-CG 3.32Å; E75-Q79 WeakPolarHBondContact O-CG 3.32Å; E75-Q79 PolarHBondContact O-N 2.92Å
76	E	85.2	Confident	74.5	Confident	86 Å²	86	64.7 Å²	64.7	40%	0.402	35%	0.348	S	S	.	.	H	α-helix	trans	-64.1	-40.2	178.9	-70.7	175.4	141.9	0	0	111.5	F72 S73 Q78 Q79 I80	F72-E76 VanDerWaalsContact CA-OE2 3.23Å; F72-E76 WeakPolarHBondContact CA-OE2 3.37Å; F72-E76 HydrophobicContact CB-CB 4.02Å; F72-E76 HydrophobicContact CD1-CB 4.32Å; S73-E76 PolarHBondContact N-OE2 2.79Å; S73-E76 PolarHBondContact O-N 3.42Å; S73-E76 PolarHBondContact OG-N 3.43Å; S73-E76 VanDerWaalsContact OG-N 3.15Å; E76-Q78 PolarHBondContact O-N 3.3Å; E76-Q79 PolarHBondContact O-N 2.9Å; E76-I80 WeakPolarHBondContact O-CB 3.41Å; E76-I80 WeakPolarHBondContact O-CD1 3.48Å; E76-I80 VanDerWaalsContact O-CG1 3.22Å; E76-I80 WeakPolarHBondContact O-CG1 3.39Å; E76-I80 PolarHBondContact O-N 3.49Å
77	Q	84.3	Confident	75	Confident	6 Å²	6	67.8 Å²	67.8	3%	0.028	36%	0.362	C	S	.	.	H	α-helix	trans	-59.6	-45.5	174.3	-68.6	172.9	18.8	0	0	111.7	F72 S73 E75 I80 L81 F106 K108	F72-Q77 HydrophobicContact CB-CG 3.96Å; F72-Q77 PolarHBondContact O-NE2 3.49Å; S73-Q77 VanDerWaalsContact O-CG 3.27Å; S73-Q77 WeakPolarHBondContact O-CG 3.35Å; S73-Q77 PolarHBondContact O-N 2.83Å; E75-Q77 VanDerWaalsContact C-N 3.35Å; E75-Q77 PolarHBondContact O-N 3.29Å; Q77-I80 PolarHBondContact O-N 3.09Å; Q77-L81 WeakPolarHBondContact O-CG 3.34Å; Q77-L81 PolarHBondContact O-N 3.45Å; Q77-F106 HydrophobicContact CB-CB 4.33Å; Q77-F106 HydrophobicContact CB-CD1 4.25Å; Q77-F106 HydrophobicContact CB-CD2 3.81Å; Q77-F106 HydrophobicContact CB-CE2 4.12Å; Q77-F106 HydrophobicContact CB-CG 3.88Å; Q77-F106 HydrophobicContact CB-CZ 4.47Å; Q77-F106 HydrophobicContact CG-CB 4.42Å; Q77-F106 HydrophobicContact CG-CD1 3.62Å; Q77-F106 HydrophobicContact CG-CD2 4.07Å; Q77-F106 HydrophobicContact CG-CE1 3.78Å; Q77-F106 HydrophobicContact CG-CE2 4.2Å; Q77-F106 HydrophobicContact CG-CG 3.78Å; Q77-F106 HydrophobicContact CG-CZ 4.06Å; Q77-K108 HydrophobicContact CB-CD 4.28Å
78	Q	84.3	Confident	75.2	Confident	90 Å²	90	68 Å²	68	42%	0.421	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-43.9	175.9	-73.8	178.8	-15.7	0	0	111.6	D74 E75 E76 I80 L81 I82 K108	D74-Q78 WeakPolarHBondContact O-CG 3.44Å; D74-Q78 PolarHBondContact O-N 3.45Å; E75-Q78 PolarHBondContact O-N 3.35Å; E76-Q78 PolarHBondContact O-N 3.3Å; Q78-I80 VanDerWaalsContact C-N 3.34Å; Q78-I80 PolarHBondContact O-N 2.75Å; Q78-L81 PolarHBondContact O-N 2.86Å; Q78-I82 WeakPolarHBondContact O-CB 3.2Å; Q78-I82 VanDerWaalsContact O-CG1 3.24Å; Q78-I82 WeakPolarHBondContact O-CG1 3.49Å; Q78-I82 PolarHBondContact O-N 3.13Å; Q78-K108 HydrophobicContact CG-CD 3.98Å
79	Q	85.6	Confident	75.4	Confident	130 Å²	130	65.6 Å²	65.6	61%	0.607	35%	0.351	S	S	*	.	H	α-helix	trans	-61.5	-41.4	177.5	-73.4	177.5	-1.3	0	0	112.2	E75 E76 A83	E75-Q79 VanDerWaalsContact O-CG 3.32Å; E75-Q79 WeakPolarHBondContact O-CG 3.32Å; E75-Q79 PolarHBondContact O-N 2.92Å; E76-Q79 PolarHBondContact O-N 2.9Å; Q79-A83 VanDerWaalsContact O-CB 3.25Å; Q79-A83 WeakPolarHBondContact O-CB 3.44Å; Q79-A83 PolarHBondContact O-N 3.39Å
80	I	85	Confident	75.6	Confident	50 Å²	50	61.1 Å²	61.1	26%	0.256	33%	0.334	S	S	.	.	H	α-helix	trans	-61.8	-48.5	175.9	-70.4	163.2	0	0	0	110.3	F72 E76 Q77 Q78 A83 L84 L102 F106	F72-I80 HydrophobicContact CD1-CD1 3.98Å; F72-I80 HydrophobicContact CD2-CD1 4.23Å; F72-I80 HydrophobicContact CE1-CD1 4.08Å; F72-I80 HydrophobicContact CE2-CD1 4.32Å; F72-I80 HydrophobicContact CG-CD1 4.06Å; F72-I80 HydrophobicContact CZ-CD1 4.25Å; E76-I80 WeakPolarHBondContact O-CB 3.41Å; E76-I80 WeakPolarHBondContact O-CD1 3.48Å; E76-I80 VanDerWaalsContact O-CG1 3.22Å; E76-I80 WeakPolarHBondContact O-CG1 3.39Å; E76-I80 PolarHBondContact O-N 3.49Å; Q77-I80 PolarHBondContact O-N 3.09Å; Q78-I80 VanDerWaalsContact C-N 3.34Å; Q78-I80 PolarHBondContact O-N 2.75Å; I80-A83 PolarHBondContact O-N 3.1Å; I80-L84 HydrophobicContact CG2-CD1 3.86Å; I80-L84 HydrophobicContact CG2-CG 4.49Å; I80-L84 WeakPolarHBondContact O-CB 3.32Å; I80-L84 VanDerWaalsContact O-CG 3.3Å; I80-L84 WeakPolarHBondContact O-CG 3.49Å; I80-L84 PolarHBondContact O-N 2.96Å; I80-L102 HydrophobicContact CG2-CD1 4.41Å; I80-F106 HydrophobicContact CB-CE2 4.41Å; I80-F106 HydrophobicContact CD1-CZ 4.4Å; I80-F106 HydrophobicContact CG2-CE2 4.17Å
81	L	82.1	Confident	75.5	Confident	3 Å²	3	57.6 Å²	57.6	2%	0.016	31%	0.305	C	S	.	.	H	α-helix	trans	-61.2	-47.1	179.7	-71.4	176.3	0	0	0	111.7	Q77 Q78 A83 L84 Q85 L102 F106 K108 T110	Q77-L81 WeakPolarHBondContact O-CG 3.34Å; Q77-L81 PolarHBondContact O-N 3.45Å; Q78-L81 PolarHBondContact O-N 2.86Å; L81-A83 PolarHBondContact O-N 3.24Å; L81-L84 PolarHBondContact O-N 3.48Å; L81-Q85 WeakPolarHBondContact O-CG 3.48Å; L81-Q85 PolarHBondContact O-N 3.07Å; L81-L102 HydrophobicContact CD2-CB 3.84Å; L81-F106 HydrophobicContact CD1-CD2 4Å; L81-F106 HydrophobicContact CD2-CD2 4.05Å; L81-F106 HydrophobicContact CD2-CE2 4.43Å; L81-F106 HydrophobicContact CG-CD2 3.87Å; L81-F106 HydrophobicContact CG-CE2 4.33Å; L81-K108 HydrophobicContact CD1-CB 3.99Å; L81-T110 HydrophobicContact CB-CG2 4.09Å; L81-T110 HydrophobicContact CD1-CG2 4.11Å; L81-T110 HydrophobicContact CD2-CG2 4.32Å; L81-T110 HydrophobicContact CG-CG2 4.4Å
82	I	81.3	Confident	74.7	Confident	47 Å²	47	55.2 Å²	55.2	24%	0.241	30%	0.3	C	S	.	.	H	α-helix	trans	-60.2	-45.7	176.6	-68.9	166.1	0	0	0	110.4	Q78 L84 Q85 N86	Q78-I82 WeakPolarHBondContact O-CB 3.2Å; Q78-I82 VanDerWaalsContact O-CG1 3.24Å; Q78-I82 WeakPolarHBondContact O-CG1 3.49Å; Q78-I82 PolarHBondContact O-N 3.13Å; I82-L84 VanDerWaalsContact C-N 3.32Å; I82-L84 PolarHBondContact O-N 3.47Å; I82-Q85 PolarHBondContact O-N 3.37Å; I82-N86 WeakPolarHBondContact CG2-ND2 3.46Å; I82-N86 WeakPolarHBondContact O-CB 3.49Å; I82-N86 PolarHBondContact O-N 3.33Å; I82-N86 VanDerWaalsContact O-N 3.11Å; I82-N86 PolarHBondContact O-ND2 2.93Å
83	A	81.5	Confident	73.4	Confident	53 Å²	53	56.2 Å²	56.2	44%	0.438	32%	0.317	S	S	.	.	H	α-helix	trans	-61	-42.5	179.3	0	0	0	0	0	111.7	Q79 I80 L81 N86 L87	Q79-A83 VanDerWaalsContact O-CB 3.25Å; Q79-A83 WeakPolarHBondContact O-CB 3.44Å; Q79-A83 PolarHBondContact O-N 3.39Å; I80-A83 PolarHBondContact O-N 3.1Å; L81-A83 PolarHBondContact O-N 3.24Å; A83-N86 PolarHBondContact O-N 2.96Å; A83-L87 WeakPolarHBondContact O-CG 3.4Å; A83-L87 PolarHBondContact O-N 3.04Å; A83-L87 VanDerWaalsContact O-N 3.12Å
84	L	79.3	Confident	72	Confident	31 Å²	31	59.9 Å²	59.9	16%	0.162	33%	0.333	C	S	.	.	H	α-helix	trans	-67.7	-46.7	179.3	-72.4	170.2	0	0	0	112.5	I80 L81 I82 N86 L87 N88 L98 V99 L102	I80-L84 HydrophobicContact CG2-CD1 3.86Å; I80-L84 HydrophobicContact CG2-CG 4.49Å; I80-L84 WeakPolarHBondContact O-CB 3.32Å; I80-L84 VanDerWaalsContact O-CG 3.3Å; I80-L84 WeakPolarHBondContact O-CG 3.49Å; I80-L84 PolarHBondContact O-N 2.96Å; L81-L84 PolarHBondContact O-N 3.48Å; I82-L84 VanDerWaalsContact C-N 3.32Å; I82-L84 PolarHBondContact O-N 3.47Å; L84-N86 PolarHBondContact O-N 2.96Å; L84-L87 HydrophobicContact CD2-CD1 4.39Å; L84-L87 WeakPolarHBondContact O-CB 3.4Å; L84-L87 PolarHBondContact O-N 3.23Å; L84-N88 PolarHBondContact O-N 2.84Å; L84-N88 PolarHBondContact O-OD1 3.02Å; L84-L98 HydrophobicContact CD1-CG 4.43Å; L84-L98 HydrophobicContact CD2-CD2 3.9Å; L84-V99 HydrophobicContact CB-CG2 3.72Å; L84-L102 HydrophobicContact CD1-CD1 3.2Å
85	Q	74.9	Confident	70.9	Confident	35 Å²	35	58 Å²	58	16%	0.164	32%	0.324	C	S	.	.	H	α-helix	trans	-55	-42.8	175.8	-74.1	179.9	-62.7	0	0	111.9	L81 I82 L87 N88 V99 T110	L81-Q85 WeakPolarHBondContact O-CG 3.48Å; L81-Q85 PolarHBondContact O-N 3.07Å; I82-Q85 PolarHBondContact O-N 3.37Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 3.42Å; Q85-N88 VanDerWaalsContact O-CB 3.23Å; Q85-N88 WeakPolarHBondContact O-CB 3.34Å; Q85-N88 PolarHBondContact O-N 2.79Å; Q85-N88 VanDerWaalsContact O-N 3.17Å; Q85-V99 HydrophobicContact CG-CG1 3.74Å; Q85-V99 HydrophobicContact CG-CG2 3.96Å; Q85-T110 VanDerWaalsContact CD-CB 3.47Å; Q85-T110 HydrophobicContact CG-CG2 4.43Å; Q85-T110 PolarHBondContact NE2-OG1 3.28Å
86	N	71.3	Confident	70.1	Confident	31 Å²	31	55.6 Å²	55.6	17%	0.166	32%	0.321	C	S	.	.	H	α-helix	trans	-71.9	-22.3	178.7	-72.9	-60.7	0	0	0	113.5	I82 A83 L84 N88 L114	I82-N86 WeakPolarHBondContact CG2-ND2 3.46Å; I82-N86 WeakPolarHBondContact O-CB 3.49Å; I82-N86 PolarHBondContact O-N 3.33Å; I82-N86 VanDerWaalsContact O-N 3.11Å; I82-N86 PolarHBondContact O-ND2 2.93Å; A83-N86 PolarHBondContact O-N 2.96Å; L84-N86 PolarHBondContact O-N 2.96Å; N86-N88 VanDerWaalsContact C-N 3.34Å; N86-L114 WeakPolarHBondContact OD1-CD2 3.48Å
87	L	69.6	Low	69.5	Low	105 Å²	105	54.1 Å²	54.1	55%	0.55	32%	0.32	S	S	.	.	H	α-helix	trans	-72.5	-27.5	171.2	-73.1	170.6	0	0	0	112.2	A83 L84 Q85 L89 T90	A83-L87 WeakPolarHBondContact O-CG 3.4Å; A83-L87 PolarHBondContact O-N 3.04Å; A83-L87 VanDerWaalsContact O-N 3.12Å; L84-L87 HydrophobicContact CD2-CD1 4.39Å; L84-L87 WeakPolarHBondContact O-CB 3.4Å; L84-L87 PolarHBondContact O-N 3.23Å; Q85-L87 VanDerWaalsContact C-N 3.3Å; Q85-L87 PolarHBondContact O-N 3.42Å; L87-L89 PolarHBondContact O-N 3.14Å; L87-T90 PolarHBondContact O-N 2.99Å; L87-T90 PolarHBondContact O-OG1 2.97Å
88	N	62.8	Low	69.2	Low	41 Å²	41	57.6 Å²	57.6	22%	0.219	34%	0.338	C	S	.	.	H	α-helix	trans	-54.3	-28.8	179.2	-63.6	14.4	0	0	0	112.8	L84 Q85 N86 T90 A91 G92 S95 S96	L84-N88 PolarHBondContact O-N 2.84Å; L84-N88 PolarHBondContact O-OD1 3.02Å; Q85-N88 VanDerWaalsContact O-CB 3.23Å; Q85-N88 WeakPolarHBondContact O-CB 3.34Å; Q85-N88 PolarHBondContact O-N 2.79Å; Q85-N88 VanDerWaalsContact O-N 3.17Å; N86-N88 VanDerWaalsContact C-N 3.34Å; N88-T90 PolarHBondContact O-N 3.48Å; N88-A91 PolarHBondContact O-N 3.39Å; N88-G92 PolarHBondContact O-N 3.18Å; N88-S95 WeakPolarHBondContact CA-OG 3.38Å; N88-S95 WeakPolarHBondContact CB-OG 3.14Å; N88-S95 PolarHBondContact ND2-OG 2.87Å; N88-S95 WeakPolarHBondContact OD1-CB 3.45Å; N88-S95 PolarHBondContact OD1-OG 2.85Å; N88-S96 PolarHBondContact ND2-N 3.06Å
89	L	57.2	Low	68.9	Low	54 Å²	54	54 Å²	54	28%	0.283	32%	0.322	S	S	.	.	H	α-helix	trans	-73.5	-7.5	-171.9	-59.1	164	0	0	0	113.9	L87 I116	L87-L89 PolarHBondContact O-N 3.14Å; L89-I116 VanDerWaalsContact CB-O 3.25Å; L89-I116 WeakPolarHBondContact CB-O 3.26Å; L89-I116 HydrophobicContact CD1-CB 3.64Å; L89-I116 HydrophobicContact CD1-CG1 4.09Å; L89-I116 VanDerWaalsContact CD1-N 3.34Å; L89-I116 WeakPolarHBondContact CD1-O 3.43Å
90	T	56.9	Low	68.6	Low	37 Å²	37	50.7 Å²	50.7	23%	0.227	31%	0.314	C	S	.	.	H	α-helix	trans	-119.2	-10.6	177.3	60	0	0	0	0	114.3	L87 N88 F118 F129 W170	L87-T90 PolarHBondContact O-N 2.99Å; L87-T90 PolarHBondContact O-OG1 2.97Å; N88-T90 PolarHBondContact O-N 3.48Å; T90-F118 HydrophobicContact CG2-CD2 3.77Å; T90-F118 HydrophobicContact CG2-CE2 4.14Å; T90-F129 HydrophobicContact CG2-CZ 4.39Å; T90-F129 VanDerWaalsContact O-CD1 3.24Å; T90-F129 WeakPolarHBondContact O-CD1 3.35Å; T90-F129 WeakPolarHBondContact O-CE1 3.48Å; T90-W170 HydrophobicContact CG2-CH2 4.09Å; T90-W170 HydrophobicContact CG2-CZ2 3.62Å
91	A	52.6	Low	68.3	Low	21 Å²	21	53.4 Å²	53.4	17%	0.174	32%	0.324	C	S	.	.	H	α-helix	trans	-130.9	6	-165.9	0	0	0	0	0	115.5	N88	N88-A91 PolarHBondContact O-N 3.39Å
92	G	51.2	Low	68.3	Low	46 Å²	46	54.7 Å²	54.7	47%	0.474	33%	0.33	S	S	.	.	G	3₁₀ helix	trans	59.2	-164.5	-179.6	0	0	0	0	0	113.5	N88 L94 S95	N88-G92 PolarHBondContact O-N 3.18Å; G92-L94 PolarHBondContact O-N 2.88Å; G92-S95 PolarHBondContact O-OG 3.22Å
93	S	50.7	Low	68.3	Low	102 Å²	102	53.3 Å²	53.3	71%	0.713	33%	0.325	S	S	*	.	G	3₁₀ helix	trans	-53.7	-13.7	-159	66.9	0	0	0	0	119.1	S95 S96	S93-S95 PolarHBondContact O-N 2.92Å; S93-S95 VanDerWaalsContact O-N 3.07Å; S93-S96 PolarHBondContact O-OG 2.96Å; S93-S96 VanDerWaalsContact O-OG 3.1Å
94	L	50.6	Low	68.2	Low	116 Å²	116	54.4 Å²	54.4	61%	0.607	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-56.9	-29.1	-178.6	-83	150.9	0	0	0	113.2	G92 S97	G92-L94 PolarHBondContact O-N 2.88Å; L94-S97 PolarHBondContact O-OG 3.31Å; L94-S97 VanDerWaalsContact O-OG 3.13Å
95	S	58.9	Low	68.2	Low	17 Å²	17	53.5 Å²	53.5	12%	0.119	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-96.3	-29	-159.3	64.5	0	0	0	0	111.8	N88 G92 S93 S97 L98 V99	N88-S95 WeakPolarHBondContact CA-OG 3.38Å; N88-S95 WeakPolarHBondContact CB-OG 3.14Å; N88-S95 PolarHBondContact ND2-OG 2.87Å; N88-S95 WeakPolarHBondContact OD1-CB 3.45Å; N88-S95 PolarHBondContact OD1-OG 2.85Å; G92-S95 PolarHBondContact O-OG 3.22Å; S93-S95 PolarHBondContact O-N 2.92Å; S93-S95 VanDerWaalsContact O-N 3.07Å; S95-S97 VanDerWaalsContact C-N 3.33Å; S95-S97 PolarHBondContact O-N 3.31Å; S95-L98 PolarHBondContact O-N 2.94Å; S95-V99 VanDerWaalsContact O-CG2 3.32Å; S95-V99 WeakPolarHBondContact O-CG2 3.41Å; S95-V99 PolarHBondContact O-N 2.85Å
96	S	66.7	Low	68.5	Low	67 Å²	67	52.3 Å²	52.3	47%	0.469	32%	0.316	S	S	.	.	H	α-helix	trans	-62	-38.4	171.8	63.6	0	0	0	0	112.6	N88 S93 L98 S100	N88-S96 PolarHBondContact ND2-N 3.06Å; S93-S96 PolarHBondContact O-OG 2.96Å; S93-S96 VanDerWaalsContact O-OG 3.1Å; S96-L98 VanDerWaalsContact C-N 3.33Å; S96-L98 PolarHBondContact O-N 3.19Å; S96-S100 WeakPolarHBondContact O-CB 3.41Å; S96-S100 PolarHBondContact O-N 3.28Å; S96-S100 PolarHBondContact O-OG 2.93Å
97	S	73.4	Confident	68.8	Low	54 Å²	54	56.5 Å²	56.5	38%	0.378	33%	0.332	S	S	.	.	H	α-helix	trans	-69.9	-29.2	178.4	80.7	0	0	0	0	113.5	L94 S95 S100 K101	L94-S97 PolarHBondContact O-OG 3.31Å; L94-S97 VanDerWaalsContact O-OG 3.13Å; S95-S97 VanDerWaalsContact C-N 3.33Å; S95-S97 PolarHBondContact O-N 3.31Å; S97-S100 PolarHBondContact O-OG 3.04Å; S97-K101 WeakPolarHBondContact O-CB 3.39Å; S97-K101 VanDerWaalsContact O-CD 3.32Å; S97-K101 WeakPolarHBondContact O-CD 3.41Å; S97-K101 WeakPolarHBondContact O-CG 3.26Å; S97-K101 PolarHBondContact O-N 3.01Å
98	L	76.7	Confident	69.1	Low	80 Å²	80	53.7 Å²	53.7	42%	0.419	32%	0.316	S	S	.	.	H	α-helix	trans	-81.7	-42.7	178.8	-178.9	60.2	0	0	0	110.6	L84 S95 S96 S100 K101 L102	L84-L98 HydrophobicContact CD1-CG 4.43Å; L84-L98 HydrophobicContact CD2-CD2 3.9Å; S95-L98 PolarHBondContact O-N 2.94Å; S96-L98 VanDerWaalsContact C-N 3.33Å; S96-L98 PolarHBondContact O-N 3.19Å; L98-S100 VanDerWaalsContact C-N 3.34Å; L98-K101 PolarHBondContact O-N 3.48Å; L98-L102 HydrophobicContact CD1-CD1 3.97Å; L98-L102 HydrophobicContact CD1-CG 4.28Å; L98-L102 HydrophobicContact CG-CD1 4.06Å; L98-L102 WeakPolarHBondContact O-CB 3.49Å; L98-L102 PolarHBondContact O-N 3.25Å
99	V	79.4	Confident	69.6	Low	13 Å²	13	60.8 Å²	60.8	8%	0.079	35%	0.348	C	S	.	.	H	α-helix	trans	-55.4	-52.8	171.6	171.5	0	0	0	0	109	L84 Q85 S95 K101 L102 S103 T110	L84-V99 HydrophobicContact CB-CG2 3.72Å; Q85-V99 HydrophobicContact CG-CG1 3.74Å; Q85-V99 HydrophobicContact CG-CG2 3.96Å; S95-V99 VanDerWaalsContact O-CG2 3.32Å; S95-V99 WeakPolarHBondContact O-CG2 3.41Å; S95-V99 PolarHBondContact O-N 2.85Å; V99-K101 PolarHBondContact O-N 3.43Å; V99-L102 PolarHBondContact O-N 3.3Å; V99-L102 VanDerWaalsContact O-N 3.14Å; V99-S103 WeakPolarHBondContact O-CB 3.42Å; V99-S103 PolarHBondContact O-N 2.99Å; V99-S103 PolarHBondContact O-OG 3.35Å; V99-T110 HydrophobicContact CG1-CG2 4.1Å
100	S	79	Confident	70.1	Confident	62 Å²	62	60.3 Å²	60.3	43%	0.434	35%	0.347	S	S	.	.	H	α-helix	trans	-57.8	-45.8	-179.5	65.4	0	0	0	0	112.8	S96 S97 L98 L102 S103 T104	S96-S100 WeakPolarHBondContact O-CB 3.41Å; S96-S100 PolarHBondContact O-N 3.28Å; S96-S100 PolarHBondContact O-OG 2.93Å; S97-S100 PolarHBondContact O-OG 3.04Å; L98-S100 VanDerWaalsContact C-N 3.34Å; S100-L102 PolarHBondContact O-N 2.96Å; S100-S103 PolarHBondContact O-N 3.25Å; S100-T104 PolarHBondContact O-N 3.46Å; S100-T104 PolarHBondContact O-OG1 2.94Å
101	K	79.1	Confident	70.7	Confident	107 Å²	107	64.1 Å²	64.1	47%	0.465	37%	0.365	S	S	.	.	H	α-helix	trans	-58.9	-43.8	176.4	-75.5	169.6	-174	172.6	0	112.8	F11 S97 L98 V99 L105	F11-K101 HydrophobicContact CZ-CB 4.4Å; S97-K101 WeakPolarHBondContact O-CB 3.39Å; S97-K101 VanDerWaalsContact O-CD 3.32Å; S97-K101 WeakPolarHBondContact O-CD 3.41Å; S97-K101 WeakPolarHBondContact O-CG 3.26Å; S97-K101 PolarHBondContact O-N 3.01Å; L98-K101 PolarHBondContact O-N 3.48Å; V99-K101 PolarHBondContact O-N 3.43Å; K101-L105 WeakPolarHBondContact O-CB 3.19Å; K101-L105 PolarHBondContact O-N 2.82Å
102	L	80.8	Confident	71.5	Confident	30 Å²	30	69.1 Å²	69.1	16%	0.157	39%	0.389	C	S	.	.	H	α-helix	trans	-76.3	-34.3	-179.1	-73.1	171.6	0	0	0	112.5	I80 L81 L84 L98 V99 S100 T104 L105 F106	I80-L102 HydrophobicContact CG2-CD1 4.41Å; L81-L102 HydrophobicContact CD2-CB 3.84Å; L84-L102 HydrophobicContact CD1-CD1 3.2Å; L98-L102 HydrophobicContact CD1-CD1 3.97Å; L98-L102 HydrophobicContact CD1-CG 4.28Å; L98-L102 HydrophobicContact CG-CD1 4.06Å; L98-L102 WeakPolarHBondContact O-CB 3.49Å; L98-L102 PolarHBondContact O-N 3.25Å; V99-L102 PolarHBondContact O-N 3.3Å; V99-L102 VanDerWaalsContact O-N 3.14Å; S100-L102 PolarHBondContact O-N 2.96Å; L102-T104 VanDerWaalsContact C-N 3.31Å; L102-T104 PolarHBondContact O-N 3.46Å; L102-L105 HydrophobicContact CD2-CD2 3.78Å; L102-L105 WeakPolarHBondContact O-CB 3.25Å; L102-L105 PolarHBondContact O-N 3Å; L102-F106 HydrophobicContact CB-CD2 4.49Å; L102-F106 HydrophobicContact CB-CE2 4.27Å; L102-F106 HydrophobicContact CD2-CE2 4.4Å; L102-F106 HydrophobicContact CD2-CZ 4.26Å; L102-F106 WeakPolarHBondContact O-CB 3.17Å; L102-F106 WeakPolarHBondContact O-CD2 3.13Å; L102-F106 WeakPolarHBondContact O-CG 3.5Å; L102-F106 PolarHBondContact O-N 3.44Å
103	S	81.2	Confident	72.5	Confident	18 Å²	18	75.1 Å²	75.1	13%	0.126	40%	0.398	C	S	.	.	H	α-helix	trans	-60.1	-44.3	171.7	-56.4	0	0	0	0	110.5	V99 S100 K107 K108 T110	V99-S103 WeakPolarHBondContact O-CB 3.42Å; V99-S103 PolarHBondContact O-N 2.99Å; V99-S103 PolarHBondContact O-OG 3.35Å; S100-S103 PolarHBondContact O-N 3.25Å; S103-K107 WeakPolarHBondContact O-CA 3.21Å; S103-K107 PolarHBondContact O-N 3.18Å; S103-K108 WeakPolarHBondContact CB-O 3.43Å; S103-K108 PolarHBondContact O-N 2.9Å; S103-K108 VanDerWaalsContact O-N 3.1Å; S103-T110 VanDerWaalsContact OG-CG2 3.29Å; S103-T110 WeakPolarHBondContact OG-CG2 3.4Å
104	T	80.2	Confident	73.4	Confident	76 Å²	76	73.2 Å²	73.2	47%	0.466	38%	0.379	S	S	.	.	H	α-helix	trans	-63.1	-42.4	173	-57.1	0	0	0	0	111.7	S100 L102 K107	S100-T104 PolarHBondContact O-N 3.46Å; S100-T104 PolarHBondContact O-OG1 2.94Å; L102-T104 VanDerWaalsContact C-N 3.31Å; L102-T104 PolarHBondContact O-N 3.46Å; T104-K107 PolarHBondContact O-N 3.33Å
105	L	78.6	Confident	74.3	Confident	12 Å²	12	75.2 Å²	75.2	6%	0.063	39%	0.385	C	S	.	.	H	α-helix	trans	-61.1	-46	178.5	-168.7	67.9	0	0	0	112.4	F11 M14 L67 K101 L102 K107	F11-L105 HydrophobicContact CD1-CD1 3.97Å; F11-L105 HydrophobicContact CE1-CB 3.92Å; F11-L105 HydrophobicContact CE1-CD1 3.59Å; F11-L105 HydrophobicContact CE1-CD2 4.06Å; F11-L105 HydrophobicContact CE1-CG 4.05Å; M14-L105 HydrophobicContact CE-CD1 3.86Å; M14-L105 WeakPolarHBondContact CE-O 3.46Å; M14-L105 HydrophobicContact SD-CD1 3.48Å; M14-L105 WeakPolarHBondContact SD-CD1 3.35Å; L67-L105 HydrophobicContact CD2-CD2 4.14Å; L67-L105 HydrophobicContact CD2-CG 4.4Å; K101-L105 WeakPolarHBondContact O-CB 3.19Å; K101-L105 PolarHBondContact O-N 2.82Å; L102-L105 HydrophobicContact CD2-CD2 3.78Å; L102-L105 WeakPolarHBondContact O-CB 3.25Å; L102-L105 PolarHBondContact O-N 3Å; L105-K107 VanDerWaalsContact C-N 3.26Å
106	F	81.5	Confident	74.8	Confident	10 Å²	10	77 Å²	77	4%	0.044	39%	0.393	C	S	.	.	H	α-helix	trans	-81.9	-7.9	-180	-60.3	-32.4	0	0	0	112.5	F72 Q77 I80 L81 L102 K108	F72-F106 HydrophobicContact CD2-CE1 4.5Å; F72-F106 HydrophobicContact CD2-CZ 4.48Å; Q77-F106 HydrophobicContact CB-CB 4.33Å; Q77-F106 HydrophobicContact CB-CD1 4.25Å; Q77-F106 HydrophobicContact CB-CD2 3.81Å; Q77-F106 HydrophobicContact CB-CE2 4.12Å; Q77-F106 HydrophobicContact CB-CG 3.88Å; Q77-F106 HydrophobicContact CB-CZ 4.47Å; Q77-F106 HydrophobicContact CG-CB 4.42Å; Q77-F106 HydrophobicContact CG-CD1 3.62Å; Q77-F106 HydrophobicContact CG-CD2 4.07Å; Q77-F106 HydrophobicContact CG-CE1 3.78Å; Q77-F106 HydrophobicContact CG-CE2 4.2Å; Q77-F106 HydrophobicContact CG-CG 3.78Å; Q77-F106 HydrophobicContact CG-CZ 4.06Å; I80-F106 HydrophobicContact CB-CE2 4.41Å; I80-F106 HydrophobicContact CD1-CZ 4.4Å; I80-F106 HydrophobicContact CG2-CE2 4.17Å; L81-F106 HydrophobicContact CD1-CD2 4Å; L81-F106 HydrophobicContact CD2-CD2 4.05Å; L81-F106 HydrophobicContact CD2-CE2 4.43Å; L81-F106 HydrophobicContact CG-CD2 3.87Å; L81-F106 HydrophobicContact CG-CE2 4.33Å; L102-F106 HydrophobicContact CB-CD2 4.49Å; L102-F106 HydrophobicContact CB-CE2 4.27Å; L102-F106 HydrophobicContact CD2-CE2 4.4Å; L102-F106 HydrophobicContact CD2-CZ 4.26Å; L102-F106 WeakPolarHBondContact O-CB 3.17Å; L102-F106 WeakPolarHBondContact O-CD2 3.13Å; L102-F106 WeakPolarHBondContact O-CG 3.5Å; L102-F106 PolarHBondContact O-N 3.44Å; F106-K108 HydrophobicContact CB-CB 4.37Å; F106-K108 HydrophobicContact CB-CG 4.34Å; F106-K108 PolarHBondContact O-N 3.09Å
107	K	77.8	Confident	75	Confident	119 Å²	119	79.2 Å²	79.2	52%	0.517	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	48	39	-171.4	-58.7	-174.8	-176.6	178.4	0	111.9	V66 S103 T104 L105	V66-K107 HydrophobicContact CG2-CD 4.11Å; S103-K107 WeakPolarHBondContact O-CA 3.21Å; S103-K107 PolarHBondContact O-N 3.18Å; T104-K107 PolarHBondContact O-N 3.33Å; L105-K107 VanDerWaalsContact C-N 3.26Å
108	K	76.5	Confident	74.8	Confident	46 Å²	46	79 Å²	79	20%	0.2	39%	0.392	C	S	.	.			trans	-116.3	131.1	179.3	-73.3	-176.2	-166.5	-76.2	0	109	D74 Q77 Q78 L81 S103 F106	D74-K108 WeakPolarHBondContact OD1-CE 3.24Å; D74-K108 IonicContact OD1-NZ 2.6Å; D74-K108 PolarHBondContact OD1-NZ 3.47Å; Q77-K108 HydrophobicContact CB-CD 4.28Å; Q78-K108 HydrophobicContact CG-CD 3.98Å; L81-K108 HydrophobicContact CD1-CB 3.99Å; S103-K108 WeakPolarHBondContact CB-O 3.43Å; S103-K108 PolarHBondContact O-N 2.9Å; S103-K108 VanDerWaalsContact O-N 3.1Å; F106-K108 HydrophobicContact CB-CB 4.37Å; F106-K108 HydrophobicContact CB-CG 4.34Å; F106-K108 PolarHBondContact O-N 3.09Å
109	E	72.7	Confident	74.3	Confident	190 Å²	190	76.9 Å²	76.9	89%	0.888	38%	0.384	S	S	*	.			trans	-69.2	135.8	160.1	-67.4	-172.8	174.1	0	0	108.4
110	T	68.3	Low	73.7	Confident	44 Å²	44	77.5 Å²	77.5	27%	0.27	39%	0.387	S	S	.	.			trans	-76.6	126.8	175.9	50.4	0	0	0	0	109.3	L81 Q85 V99 S103 D112	L81-T110 HydrophobicContact CB-CG2 4.09Å; L81-T110 HydrophobicContact CD1-CG2 4.11Å; L81-T110 HydrophobicContact CD2-CG2 4.32Å; L81-T110 HydrophobicContact CG-CG2 4.4Å; Q85-T110 VanDerWaalsContact CD-CB 3.47Å; Q85-T110 HydrophobicContact CG-CG2 4.43Å; Q85-T110 PolarHBondContact NE2-OG1 3.28Å; V99-T110 HydrophobicContact CG1-CG2 4.1Å; S103-T110 VanDerWaalsContact OG-CG2 3.29Å; S103-T110 WeakPolarHBondContact OG-CG2 3.4Å; T110-D112 PolarHBondContact O-N 2.95Å; T110-D112 VanDerWaalsContact O-N 3.08Å
111	L	68.8	Low	72.7	Confident	117 Å²	117	87.3 Å²	87.3	61%	0.613	41%	0.414	S	S	*	.			trans	-69	104.8	168	-78.4	157.1	0	0	0	108.6	W113	L111-W113 VanDerWaalsContact C-N 3.28Å; L111-W113 VanDerWaalsContact O-CD1 3.32Å; L111-W113 PolarHBondContact O-N 3.4Å; L111-W113 VanDerWaalsContact O-N 3.1Å
112	D	69	Low	72.1	Confident	126 Å²	126	86.6 Å²	86.6	67%	0.674	42%	0.419	S	S	*	.			trans	-84.4	71.4	175.8	-166.1	9.9	0	0	0	110.4	T110	T110-D112 PolarHBondContact O-N 2.95Å; T110-D112 VanDerWaalsContact O-N 3.08Å
113	W	73	Confident	71.5	Confident	172 Å²	172	86.7 Å²	86.7	65%	0.652	43%	0.427	S	S	*	.			trans	-105.1	-13.4	-175.8	72.2	-88	0	0	0	113.4	L111	L111-W113 VanDerWaalsContact C-N 3.28Å; L111-W113 VanDerWaalsContact O-CD1 3.32Å; L111-W113 PolarHBondContact O-N 3.4Å; L111-W113 VanDerWaalsContact O-N 3.1Å
114	L	68.9	Low	70.9	Confident	61 Å²	61	91.2 Å²	91.2	32%	0.319	45%	0.449	S	S	.	.			trans	-131.6	115.1	-174.4	-179.5	61.1	0	0	0	110.1	N86 I116	N86-L114 WeakPolarHBondContact OD1-CD2 3.48Å; L114-I116 HydrophobicContact CD1-CD1 4.49Å; L114-I116 HydrophobicContact CD1-CG1 3.98Å; L114-I116 HydrophobicContact CD2-CD1 4.08Å; L114-I116 HydrophobicContact CD2-CG1 4.34Å; L114-I116 HydrophobicContact CG-CD1 4.23Å; L114-I116 HydrophobicContact CG-CG1 3.93Å
115	E	70.3	Confident	70.7	Confident	158 Å²	158	91.9 Å²	91.9	74%	0.738	44%	0.443	S	S	*	.			trans	-113.8	129.7	169.5	-168.6	-179.3	130.2	0	0	108.5
116	I	69.8	Low	70.7	Confident	56 Å²	56	94.9 Å²	94.9	29%	0.287	46%	0.459	S	S	.	.			trans	-124.9	98.9	178.6	-45.4	173.2	0	0	0	109.3	L89 L114 F118	L89-I116 VanDerWaalsContact CB-O 3.25Å; L89-I116 WeakPolarHBondContact CB-O 3.26Å; L89-I116 HydrophobicContact CD1-CB 3.64Å; L89-I116 HydrophobicContact CD1-CG1 4.09Å; L89-I116 VanDerWaalsContact CD1-N 3.34Å; L89-I116 WeakPolarHBondContact CD1-O 3.43Å; L114-I116 HydrophobicContact CD1-CD1 4.49Å; L114-I116 HydrophobicContact CD1-CG1 3.98Å; L114-I116 HydrophobicContact CD2-CD1 4.08Å; L114-I116 HydrophobicContact CD2-CG1 4.34Å; L114-I116 HydrophobicContact CG-CD1 4.23Å; L114-I116 HydrophobicContact CG-CG1 3.93Å; I116-F118 HydrophobicContact CB-CE2 4.3Å; I116-F118 HydrophobicContact CB-CZ 4.34Å; I116-F118 HydrophobicContact CG2-CD1 4.08Å; I116-F118 HydrophobicContact CG2-CD2 4.13Å; I116-F118 HydrophobicContact CG2-CE1 3.48Å; I116-F118 VanDerWaalsContact CG2-CE1 3.48Å; I116-F118 HydrophobicContact CG2-CE2 3.55Å; I116-F118 HydrophobicContact CG2-CG 4.39Å; I116-F118 HydrophobicContact CG2-CZ 3.21Å
117	D	70.7	Confident	70.8	Confident	113 Å²	113	101.2 Å²	101.2	60%	0.604	49%	0.489	S	S	*	.			trans	-89.7	116.3	173.9	-171.1	5.2	0	0	0	111.4	S119	D117-S119 WeakPolarHBondContact OD1-CA 3.38Å; D117-S119 WeakPolarHBondContact OD1-CB 3.23Å; D117-S119 PolarHBondContact OD1-N 2.95Å; D117-S119 PolarHBondContact OD1-OG 3.43Å; D117-S119 PolarHBondContact OD2-OG 3.42Å
118	F	68	Low	71.3	Confident	49 Å²	49	97 Å²	97	22%	0.215	47%	0.472	C	S	.	.			trans	-101.3	0	173.7	-61.8	-60.6	0	0	0	113.7	T90 I116 F165 W170	T90-F118 HydrophobicContact CG2-CD2 3.77Å; T90-F118 HydrophobicContact CG2-CE2 4.14Å; I116-F118 HydrophobicContact CB-CE2 4.3Å; I116-F118 HydrophobicContact CB-CZ 4.34Å; I116-F118 HydrophobicContact CG2-CD1 4.08Å; I116-F118 HydrophobicContact CG2-CD2 4.13Å; I116-F118 HydrophobicContact CG2-CE1 3.48Å; I116-F118 VanDerWaalsContact CG2-CE1 3.48Å; I116-F118 HydrophobicContact CG2-CE2 3.55Å; I116-F118 HydrophobicContact CG2-CG 4.39Å; I116-F118 HydrophobicContact CG2-CZ 3.21Å; F118-F165 HydrophobicContact CD1-CD2 4.09Å; F118-F165 HydrophobicContact CD1-CE1 4.09Å; F118-F165 AromaticContact CD1-CE2 3.42Å; F118-F165 HydrophobicContact CD1-CE2 3.42Å; F118-F165 VanDerWaalsContact CD1-CE2 3.42Å; F118-F165 AromaticContact CD1-CZ 3.4Å; F118-F165 HydrophobicContact CD1-CZ 3.4Å; F118-F165 AromaticContact CE1-CD1 3.95Å; F118-F165 HydrophobicContact CE1-CD1 3.95Å; F118-F165 HydrophobicContact CE1-CD2 4.12Å; F118-F165 AromaticContact CE1-CE1 3.49Å; F118-F165 HydrophobicContact CE1-CE1 3.49Å; F118-F165 VanDerWaalsContact CE1-CE1 3.49Å; F118-F165 AromaticContact CE1-CE2 3.67Å; F118-F165 HydrophobicContact CE1-CE2 3.67Å; F118-F165 HydrophobicContact CE1-CG 4.23Å; F118-F165 AromaticContact CE1-CZ 3.31Å; F118-F165 HydrophobicContact CE1-CZ 3.31Å; F118-F165 HydrophobicContact CG-CE2 4.3Å; F118-F165 HydrophobicContact CZ-CD1 4.46Å; F118-F165 HydrophobicContact CZ-CE1 4.37Å; F118-F165 HydrophobicContact CZ-CZ 4.46Å; F118-W170 HydrophobicContact CD2-CZ2 4.06Å; F118-W170 HydrophobicContact CE2-CZ2 4.36Å; F118-W170 HydrophobicContact CG-CZ2 4.34Å; F118-W170 AromaticContact CG-NE1 3.98Å
119	S	66.7	Low	71.9	Confident	35 Å²	35	95.7 Å²	95.7	25%	0.245	47%	0.466	C	S	.	.			trans	-63.2	157.2	-179.6	75.2	0	0	0	0	111.2	D117 R125	D117-S119 WeakPolarHBondContact OD1-CA 3.38Å; D117-S119 WeakPolarHBondContact OD1-CB 3.23Å; D117-S119 PolarHBondContact OD1-N 2.95Å; D117-S119 PolarHBondContact OD1-OG 3.43Å; D117-S119 PolarHBondContact OD2-OG 3.42Å; S119-R125 VanDerWaalsContact C-NH2 3.27Å; S119-R125 PolarHBondContact O-NH2 3.29Å
120	D	67.5	Low	72.6	Confident	27 Å²	27	89.4 Å²	89.4	14%	0.144	44%	0.439	C	S	.	.			trans	-83.6	152.9	149.5	17.3	34.3	0	0	0	109.1	T122 G123 L124 R125	D120-T122 WeakPolarHBondContact CB-OG1 2.81Å; D120-T122 PolarHBondContact O-N 2.87Å; D120-T122 PolarHBondContact OD1-OG1 3.21Å; D120-T122 PolarHBondContact OD2-OG1 3.24Å; D120-G123 PolarHBondContact O-N 2.8Å; D120-G123 PolarHBondContact OD1-N 3.19Å; D120-L124 PolarHBondContact OD1-N 2.86Å; D120-R125 VanDerWaalsContact N-CZ 3.33Å; D120-R125 VanDerWaalsContact OD1-CB 3.3Å; D120-R125 WeakPolarHBondContact OD1-CB 3.08Å; D120-R125 IonicContact OD1-CZ 3.28Å; D120-R125 PolarHBondContact OD1-N 3.24Å; D120-R125 IonicContact OD1-NE 2.69Å; D120-R125 WeakPolarHBondContact OD2-CD 3.13Å; D120-R125 WeakPolarHBondContact OD2-CG 3.3Å; D120-R125 IonicContact OD2-CZ 3.46Å; D120-R125 IonicContact OD2-NE 3.51Å; D120-R125 PolarHBondContact OD2-NE 3.03Å; D120-R125 IonicContact OD2-NH1 2.63Å; D120-R125 PolarHBondContact OD2-NH1 3Å
121	W	58.3	Low	73.8	Confident	268 Å²	268	90.1 Å²	90.1	100%	1.015	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-45.1	-14.6	159.3	-61.7	105.3	0	0	0	114.5
122	T	65.1	Low	75	Confident	92 Å²	92	84.6 Å²	84.6	56%	0.564	41%	0.41	S	S	*	.	T	Hydrogen-bonded Turn	trans	-98.8	-12.3	178.2	64.3	0	0	0	0	114.7	D120 L124	D120-T122 WeakPolarHBondContact CB-OG1 2.81Å; D120-T122 PolarHBondContact O-N 2.87Å; D120-T122 PolarHBondContact OD1-OG1 3.21Å; D120-T122 PolarHBondContact OD2-OG1 3.24Å; T122-L124 PolarHBondContact O-N 3.41Å
123	G	67.9	Low	76.1	Confident	31 Å²	31	82 Å²	82	32%	0.32	39%	0.391	S	S	.	.	S	Bend	trans	69.7	-17.3	-178	0	0	0	0	0	116.3	D120 R125 N126	D120-G123 PolarHBondContact O-N 2.8Å; D120-G123 PolarHBondContact OD1-N 3.19Å; G123-R125 PolarHBondContact O-N 3.17Å; G123-R125 VanDerWaalsContact O-N 3.09Å; G123-N126 WeakPolarHBondContact O-CB 3.49Å; G123-N126 PolarHBondContact O-N 2.62Å
124	L	70.1	Confident	77.1	Confident	114 Å²	114	79.8 Å²	79.8	60%	0.597	39%	0.388	S	S	*	.	H	α-helix	trans	-56.5	-28.2	-177.6	-70.5	168.5	0	0	0	113.4	D120 T122 N126 L128	D120-L124 PolarHBondContact OD1-N 2.86Å; T122-L124 PolarHBondContact O-N 3.41Å; L124-N126 VanDerWaalsContact C-N 3.3Å; L124-N126 PolarHBondContact O-N 2.84Å; L124-L128 PolarHBondContact O-N 2.71Å
125	R	75.8	Confident	78.5	Confident	89 Å²	89	76.9 Å²	76.9	34%	0.336	37%	0.373	S	S	.	.	H	α-helix	trans	-67.6	-28.6	176.1	-80.4	-173.2	-57.8	-115.3	23	113.6	S119 D120 G123 F129	S119-R125 VanDerWaalsContact C-NH2 3.27Å; S119-R125 PolarHBondContact O-NH2 3.29Å; D120-R125 VanDerWaalsContact N-CZ 3.33Å; D120-R125 VanDerWaalsContact OD1-CB 3.3Å; D120-R125 WeakPolarHBondContact OD1-CB 3.08Å; D120-R125 IonicContact OD1-CZ 3.28Å; D120-R125 PolarHBondContact OD1-N 3.24Å; D120-R125 IonicContact OD1-NE 2.69Å; D120-R125 WeakPolarHBondContact OD2-CD 3.13Å; D120-R125 WeakPolarHBondContact OD2-CG 3.3Å; D120-R125 IonicContact OD2-CZ 3.46Å; D120-R125 IonicContact OD2-NE 3.51Å; D120-R125 PolarHBondContact OD2-NE 3.03Å; D120-R125 IonicContact OD2-NH1 2.63Å; D120-R125 PolarHBondContact OD2-NH1 3Å; G123-R125 PolarHBondContact O-N 3.17Å; G123-R125 VanDerWaalsContact O-N 3.09Å; R125-F129 VanDerWaalsContact O-CB 3.26Å; R125-F129 WeakPolarHBondContact O-CB 3.33Å; R125-F129 PolarHBondContact O-N 3.1Å
126	N	78.5	Confident	79.7	Confident	76 Å²	76	70.8 Å²	70.8	41%	0.406	35%	0.345	S	S	.	.	H	α-helix	trans	-70.5	-44.8	-177.3	-66.5	-12	0	0	0	110.8	G123 L124 L128 F129 D130	G123-N126 WeakPolarHBondContact O-CB 3.49Å; G123-N126 PolarHBondContact O-N 2.62Å; L124-N126 VanDerWaalsContact C-N 3.3Å; L124-N126 PolarHBondContact O-N 2.84Å; N126-L128 PolarHBondContact O-N 3.04Å; N126-F129 WeakPolarHBondContact O-CB 3.29Å; N126-F129 PolarHBondContact O-N 2.9Å; N126-D130 PolarHBondContact O-N 3.21Å
127	E	82.7	Confident	80.9	Confident	143 Å²	143	76 Å²	76	67%	0.668	37%	0.365	S	S	*	.	H	α-helix	trans	-60.6	-46.6	176.3	-66.1	179.8	173.9	0	0	111.7	F129 D130 Q131	E127-F129 VanDerWaalsContact C-N 3.31Å; E127-F129 PolarHBondContact O-N 2.86Å; E127-D130 PolarHBondContact O-N 3.42Å; E127-Q131 WeakPolarHBondContact O-CB 3.44Å; E127-Q131 PolarHBondContact O-N 2.86Å
128	L	89.5	Confident	82.1	Confident	29 Å²	29	73 Å²	73	15%	0.152	35%	0.354	C	S	.	.	H	α-helix	trans	-63.1	-38.9	176.2	178.9	59	0	0	0	111.7	L124 N126 Q131 L132 M187 M190 V193	L124-L128 PolarHBondContact O-N 2.71Å; N126-L128 PolarHBondContact O-N 3.04Å; L128-Q131 PolarHBondContact O-N 2.93Å; L128-L132 HydrophobicContact CD1-CD1 4.21Å; L128-L132 HydrophobicContact CD1-CG 4.09Å; L128-L132 HydrophobicContact CG-CD1 4.19Å; L128-L132 HydrophobicContact CG-CG 4.47Å; L128-L132 WeakPolarHBondContact O-CB 3.43Å; L128-L132 VanDerWaalsContact O-CG 3.25Å; L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 3.37Å; L128-M187 HydrophobicContact CB-CE 4.43Å; L128-M187 HydrophobicContact CD2-CB 4.38Å; L128-M187 HydrophobicContact CD2-CE 4.22Å; L128-M187 HydrophobicContact CG-CE 4Å; L128-M190 HydrophobicContact CD2-CB 4.43Å; L128-V193 HydrophobicContact CD1-CB 3.86Å; L128-V193 HydrophobicContact CD1-CG1 4.25Å; L128-V193 HydrophobicContact CD1-CG2 3.47Å; L128-V193 VanDerWaalsContact CD1-CG2 3.47Å
129	F	89.4	Confident	83.5	Confident	20 Å²	20	76.6 Å²	76.6	9%	0.088	37%	0.366	C	S	.	.	H	α-helix	trans	-60.7	-48.8	176.2	-176.1	-84.7	0	0	0	111.1	T90 R125 N126 E127 Q131 L132 R133 L163 W170 M187	T90-F129 HydrophobicContact CG2-CZ 4.39Å; T90-F129 VanDerWaalsContact O-CD1 3.24Å; T90-F129 WeakPolarHBondContact O-CD1 3.35Å; T90-F129 WeakPolarHBondContact O-CE1 3.48Å; R125-F129 VanDerWaalsContact O-CB 3.26Å; R125-F129 WeakPolarHBondContact O-CB 3.33Å; R125-F129 PolarHBondContact O-N 3.1Å; N126-F129 WeakPolarHBondContact O-CB 3.29Å; N126-F129 PolarHBondContact O-N 2.9Å; E127-F129 VanDerWaalsContact C-N 3.31Å; E127-F129 PolarHBondContact O-N 2.86Å; F129-Q131 PolarHBondContact O-N 3.1Å; F129-L132 PolarHBondContact O-N 2.88Å; F129-R133 WeakPolarHBondContact O-CB 3.37Å; F129-R133 PolarHBondContact O-N 2.88Å; F129-L163 HydrophobicContact CD2-CD1 3.77Å; F129-L163 HydrophobicContact CE1-CD1 4.33Å; F129-L163 HydrophobicContact CE2-CB 4.38Å; F129-L163 HydrophobicContact CE2-CD1 3.57Å; F129-L163 HydrophobicContact CG-CD1 4.24Å; F129-L163 HydrophobicContact CZ-CD1 3.88Å; F129-W170 HydrophobicContact CD2-CD2 4.22Å; F129-W170 HydrophobicContact CD2-CE3 4.47Å; F129-W170 AromaticContact CE2-CD2 3.97Å; F129-W170 HydrophobicContact CE2-CD2 3.97Å; F129-W170 AromaticContact CE2-CE2 3.89Å; F129-W170 AromaticContact CE2-CE3 3.89Å; F129-W170 HydrophobicContact CE2-CE3 3.89Å; F129-W170 AromaticContact CE2-CH2 3.7Å; F129-W170 HydrophobicContact CE2-CH2 3.7Å; F129-W170 AromaticContact CE2-CZ2 3.78Å; F129-W170 HydrophobicContact CE2-CZ2 3.78Å; F129-W170 AromaticContact CE2-CZ3 3.75Å; F129-W170 HydrophobicContact CE2-CZ3 3.75Å; F129-W170 HydrophobicContact CZ-CH2 4.24Å; F129-W170 HydrophobicContact CZ-CZ2 4.48Å; F129-M187 HydrophobicContact CB-CE 3.95Å; F129-M187 HydrophobicContact CD2-CE 4.25Å; F129-M187 HydrophobicContact CD2-SD 4.46Å
130	D	86.9	Confident	85	Confident	57 Å²	57	76.5 Å²	76.5	31%	0.305	36%	0.363	S	S	.	.	H	α-helix	trans	-63.3	-40.7	178.2	-86.1	-39.3	0	0	0	112.5	N126 E127 L132 R133 Q134	N126-D130 PolarHBondContact O-N 3.21Å; E127-D130 PolarHBondContact O-N 3.42Å; D130-L132 PolarHBondContact O-N 2.76Å; D130-R133 WeakPolarHBondContact O-CB 3.36Å; D130-R133 PolarHBondContact O-N 3.28Å; D130-R133 IonicContact OD1-CZ 3.98Å; D130-R133 VanDerWaalsContact OD1-CZ 3.29Å; D130-R133 IonicContact OD1-NE 3.81Å; D130-R133 PolarHBondContact OD1-NE 2.6Å; D130-R133 VanDerWaalsContact OD1-NE 3.09Å; D130-R133 IonicContact OD1-NH2 3.3Å; D130-R133 PolarHBondContact OD1-NH2 2.92Å; D130-Q134 WeakPolarHBondContact O-CB 3.37Å; D130-Q134 PolarHBondContact O-N 2.63Å
131	Q	92	Very high	86.5	Confident	60 Å²	60	75.2 Å²	75.2	28%	0.28	36%	0.356	S	S	.	.	H	α-helix	trans	-62	-44.2	175.5	-167.1	-175.4	19.2	0	0	111.8	E127 L128 F129 Q134 A135 V193 I195	E127-Q131 WeakPolarHBondContact O-CB 3.44Å; E127-Q131 PolarHBondContact O-N 2.86Å; L128-Q131 PolarHBondContact O-N 2.93Å; F129-Q131 PolarHBondContact O-N 3.1Å; Q131-Q134 PolarHBondContact O-N 2.87Å; Q131-A135 PolarHBondContact O-N 2.93Å; Q131-V193 PolarHBondContact NE2-O 3.26Å; Q131-I195 HydrophobicContact CG-CD1 3.97Å; Q131-I195 HydrophobicContact CG-CG1 4.1Å; Q131-I195 WeakPolarHBondContact O-CD1 3.44Å
132	L	94.7	Very high	88.4	Confident	0 Å²	0	62.5 Å²	62.5	0%	0	31%	0.307	C	S	.	.	H	α-helix	trans	-67.5	-39.7	175.9	-68.5	177.8	0	0	0	111.7	L128 F129 D130 Q134 A135 I136 I142 L163 L172 M187 M190 V193	L128-L132 HydrophobicContact CD1-CD1 4.21Å; L128-L132 HydrophobicContact CD1-CG 4.09Å; L128-L132 HydrophobicContact CG-CD1 4.19Å; L128-L132 HydrophobicContact CG-CG 4.47Å; L128-L132 WeakPolarHBondContact O-CB 3.43Å; L128-L132 VanDerWaalsContact O-CG 3.25Å; L128-L132 WeakPolarHBondContact O-CG 3.38Å; L128-L132 PolarHBondContact O-N 3.37Å; F129-L132 PolarHBondContact O-N 2.88Å; D130-L132 PolarHBondContact O-N 2.76Å; L132-Q134 VanDerWaalsContact C-N 3.34Å; L132-A135 PolarHBondContact O-N 3.45Å; L132-I136 VanDerWaalsContact O-CG1 3.26Å; L132-I136 WeakPolarHBondContact O-CG1 3.14Å; L132-I136 PolarHBondContact O-N 2.7Å; L132-I142 HydrophobicContact CD2-CD1 3.47Å; L132-I142 VanDerWaalsContact CD2-CD1 3.47Å; L132-L163 HydrophobicContact CB-CD1 4.17Å; L132-L163 HydrophobicContact CB-CD2 4.15Å; L132-L163 HydrophobicContact CD1-CD2 3.92Å; L132-L172 HydrophobicContact CD2-CD2 4.17Å; L132-M187 HydrophobicContact CD1-CE 3.93Å; L132-M187 HydrophobicContact CD1-CG 3.82Å; L132-M187 HydrophobicContact CD1-SD 3.92Å; L132-M190 HydrophobicContact CD1-SD 3.99Å; L132-M190 HydrophobicContact CD2-SD 4.48Å; L132-V193 HydrophobicContact CD2-CG1 3.98Å
133	R	93	Very high	90	Very high	73 Å²	73	61.6 Å²	61.6	28%	0.275	30%	0.297	S	S	.	.	H	α-helix	trans	-58.8	-46.8	174.2	178.7	178	68.4	128.8	-4	110.8	F129 D130 A135 I136 F137	F129-R133 WeakPolarHBondContact O-CB 3.37Å; F129-R133 PolarHBondContact O-N 2.88Å; D130-R133 WeakPolarHBondContact O-CB 3.36Å; D130-R133 PolarHBondContact O-N 3.28Å; D130-R133 IonicContact OD1-CZ 3.98Å; D130-R133 VanDerWaalsContact OD1-CZ 3.29Å; D130-R133 IonicContact OD1-NE 3.81Å; D130-R133 PolarHBondContact OD1-NE 2.6Å; D130-R133 VanDerWaalsContact OD1-NE 3.09Å; D130-R133 IonicContact OD1-NH2 3.3Å; D130-R133 PolarHBondContact OD1-NH2 2.92Å; R133-A135 PolarHBondContact O-N 2.8Å; R133-I136 PolarHBondContact O-N 3.21Å; R133-F137 HydrophobicContact CG-CE1 4.47Å; R133-F137 HydrophobicContact CG-CE2 4.45Å; R133-F137 HydrophobicContact CG-CZ 4.38Å; R133-F137 PolarHBondContact O-N 3.21Å
134	Q	94	Very high	91.4	Very high	125 Å²	125	60.1 Å²	60.1	58%	0.584	28%	0.282	S	S	*	.	H	α-helix	trans	-57.9	-47.4	175.2	-178.2	-177.2	-3	0	0	111	D130 Q131 L132 I136 F137 S138 I195	D130-Q134 WeakPolarHBondContact O-CB 3.37Å; D130-Q134 PolarHBondContact O-N 2.63Å; Q131-Q134 PolarHBondContact O-N 2.87Å; L132-Q134 VanDerWaalsContact C-N 3.34Å; Q134-I136 VanDerWaalsContact C-N 3.35Å; Q134-I136 PolarHBondContact O-N 2.93Å; Q134-F137 PolarHBondContact O-N 3.13Å; Q134-S138 WeakPolarHBondContact O-CB 3.26Å; Q134-S138 PolarHBondContact O-N 3.21Å; Q134-S138 PolarHBondContact O-OG 3.21Å; Q134-I195 HydrophobicContact CB-CD1 4.2Å; Q134-I195 HydrophobicContact CG-CD1 4.06Å
135	A	96.8	Very high	92.7	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	27%	0.268	C	S	.	.	H	α-helix	trans	-62.7	-38.2	179.3	0	0	0	0	0	113.2	Q131 L132 R133 S138 R139 N140 I142 P160 I195	Q131-A135 PolarHBondContact O-N 2.93Å; L132-A135 PolarHBondContact O-N 3.45Å; R133-A135 PolarHBondContact O-N 2.8Å; A135-S138 WeakPolarHBondContact CA-OG 3.12Å; A135-S138 PolarHBondContact O-OG 3.23Å; A135-R139 WeakPolarHBondContact O-CA 3.26Å; A135-R139 PolarHBondContact O-N 2.93Å; A135-N140 PolarHBondContact O-N 2.71Å; A135-I142 HydrophobicContact CB-CG2 3.43Å; A135-I142 VanDerWaalsContact CB-CG2 3.43Å; A135-P160 HydrophobicContact CB-CG 3.76Å; A135-I195 HydrophobicContact CB-CD1 4.01Å; A135-I195 HydrophobicContact CB-CG1 4.06Å; A135-I195 HydrophobicContact CB-CG2 4.35Å
136	I	96.6	Very high	93.7	Very high	30 Å²	30	54.3 Å²	54.3	15%	0.154	26%	0.256	C	S	.	.	H	α-helix	trans	-64.5	-48.1	175	-66.8	165.4	0	0	0	110.5	L132 R133 Q134 R139 P160 L163 L172	L132-I136 VanDerWaalsContact O-CG1 3.26Å; L132-I136 WeakPolarHBondContact O-CG1 3.14Å; L132-I136 PolarHBondContact O-N 2.7Å; R133-I136 PolarHBondContact O-N 3.21Å; Q134-I136 VanDerWaalsContact C-N 3.35Å; Q134-I136 PolarHBondContact O-N 2.93Å; I136-R139 PolarHBondContact O-N 2.85Å; I136-P160 HydrophobicContact CG1-CB 3.75Å; I136-P160 HydrophobicContact CG1-CG 4.29Å; I136-L163 HydrophobicContact CD1-CD1 4.27Å; I136-L163 HydrophobicContact CD1-CG 3.77Å; I136-L172 HydrophobicContact CD1-CD1 4.06Å
137	F	94.6	Very high	94.5	Very high	164 Å²	164	53.1 Å²	53.1	72%	0.719	25%	0.25	S	C	*	.	H	α-helix	trans	-70.3	-36.9	-175.6	-78.7	16.1	0	0	0	112.3	R133 Q134 R139	R133-F137 HydrophobicContact CG-CE1 4.47Å; R133-F137 HydrophobicContact CG-CE2 4.45Å; R133-F137 HydrophobicContact CG-CZ 4.38Å; R133-F137 PolarHBondContact O-N 3.21Å; Q134-F137 PolarHBondContact O-N 3.13Å; F137-R139 VanDerWaalsContact C-N 3.28Å
138	S	96.4	Very high	94.8	Very high	51 Å²	51	47.7 Å²	47.7	36%	0.357	23%	0.227	S	C	.	.	H	α-helix	trans	-79.1	-8.4	175.1	57.5	0	0	0	0	113.8	Q134 A135 N140	Q134-S138 WeakPolarHBondContact O-CB 3.26Å; Q134-S138 PolarHBondContact O-N 3.21Å; Q134-S138 PolarHBondContact O-OG 3.21Å; A135-S138 WeakPolarHBondContact CA-OG 3.12Å; A135-S138 PolarHBondContact O-OG 3.23Å; S138-N140 VanDerWaalsContact C-N 3.26Å; S138-N140 WeakPolarHBondContact CB-OD1 3.46Å; S138-N140 PolarHBondContact O-N 3.37Å; S138-N140 PolarHBondContact O-OD1 2.79Å; S138-N140 PolarHBondContact OG-OD1 3.41Å; S138-N140 VanDerWaalsContact OG-OD1 3.11Å
139	R	97.3	Very high	94.5	Very high	125 Å²	125	52.1 Å²	52.1	47%	0.472	26%	0.256	S	S	.	.	T	Hydrogen-bonded Turn	trans	54.2	41	-175.9	-62.7	179.5	169.4	-94.6	2.6	112.8	A135 I136 F137 S199 F200 R202	A135-R139 WeakPolarHBondContact O-CA 3.26Å; A135-R139 PolarHBondContact O-N 2.93Å; I136-R139 PolarHBondContact O-N 2.85Å; F137-R139 VanDerWaalsContact C-N 3.28Å; R139-S199 CarbonylContact O-C 3.59Å; R139-S199 WeakPolarHBondContact O-CA 3.49Å; R139-S199 WeakPolarHBondContact O-CB 3.42Å; R139-F200 HydrophobicContact CB-CE1 4.3Å; R139-F200 HydrophobicContact CB-CE2 4.46Å; R139-F200 HydrophobicContact CB-CZ 4.19Å; R139-F200 WeakPolarHBondContact O-CD1 3.39Å; R139-F200 WeakPolarHBondContact O-CE1 3.31Å; R139-F200 PolarHBondContact O-N 3.49Å; R139-R202 PolarHBondContact NH1-O 2.96Å
140	N	98.3	Very high	94.4	Very high	33 Å²	33	59.4 Å²	59.4	18%	0.176	29%	0.287	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.4	140.2	178.7	-76.9	117.8	0	0	0	112.1	A135 S138 P160 I195 L196 S197 E198 F200	A135-N140 PolarHBondContact O-N 2.71Å; S138-N140 VanDerWaalsContact C-N 3.26Å; S138-N140 WeakPolarHBondContact CB-OD1 3.46Å; S138-N140 PolarHBondContact O-N 3.37Å; S138-N140 PolarHBondContact O-OD1 2.79Å; S138-N140 PolarHBondContact OG-OD1 3.41Å; S138-N140 VanDerWaalsContact OG-OD1 3.11Å; N140-P160 VanDerWaalsContact O-CD 3.26Å; N140-P160 WeakPolarHBondContact O-CD 3.44Å; N140-P160 WeakPolarHBondContact O-CG 3.47Å; N140-I195 HydrophobicContact CB-CG2 3.53Å; N140-L196 WeakPolarHBondContact CB-O 3.49Å; N140-L196 PolarHBondContact ND2-O 3.25Å; N140-S197 PolarHBondContact ND2-O 3.18Å; N140-E198 CarbonylContact C-O 3.59Å; N140-E198 WeakPolarHBondContact CA-O 3.23Å; N140-E198 PolarHBondContact ND2-O 3.36Å; N140-F200 WeakPolarHBondContact O-CE1 3.35Å
141	V	98.5	Very high	94.4	Very high	0 Å²	0	59.3 Å²	59.3	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-63	140.6	172.1	178.3	0	0	0	0	108.6	K157 L158 E159 L196 E198 F200	V141-K157 HydrophobicContact CG1-CB 4.16Å; V141-K157 HydrophobicContact CG1-CG 4.49Å; V141-L158 CarbonylContact C-O 3.59Å; V141-L158 WeakPolarHBondContact CA-O 3.4Å; V141-L158 WeakPolarHBondContact CG1-O 3.48Å; V141-E159 HydrophobicContact CG2-CG 3.93Å; V141-L196 HydrophobicContact CG1-CD1 4.05Å; V141-L196 WeakPolarHBondContact O-CB 3.21Å; V141-L196 PolarHBondContact O-N 2.71Å; V141-E198 HydrophobicContact CB-CB 4.11Å; V141-E198 HydrophobicContact CB-CG 4.34Å; V141-E198 HydrophobicContact CG2-CB 4Å; V141-E198 HydrophobicContact CG2-CG 3.73Å; V141-E198 PolarHBondContact N-O 3.16Å; V141-F200 HydrophobicContact CG2-CD1 4.34Å
142	I	98.5	Very high	94.4	Very high	0 Å²	0	62.3 Å²	62.3	0%	0	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109.9	144.9	171.3	64.7	177.3	0	0	0	110.7	L132 A135 I144 K157 L158 P160 L172 V193 E194 I195	L132-I142 HydrophobicContact CD2-CD1 3.47Å; L132-I142 VanDerWaalsContact CD2-CD1 3.47Å; A135-I142 HydrophobicContact CB-CG2 3.43Å; A135-I142 VanDerWaalsContact CB-CG2 3.43Å; I142-I144 HydrophobicContact CD1-CG2 3.85Å; I142-I144 HydrophobicContact CG1-CG2 4.1Å; I142-K157 WeakPolarHBondContact O-CA 3.32Å; I142-L158 HydrophobicContact CD1-CB 4.33Å; I142-L158 HydrophobicContact CD1-CD1 4.43Å; I142-L158 HydrophobicContact CG1-CB 3.8Å; I142-L158 PolarHBondContact N-O 3.12Å; I142-L158 PolarHBondContact O-N 3.48Å; I142-P160 HydrophobicContact CD1-CB 4.27Å; I142-P160 HydrophobicContact CD1-CG 4.49Å; I142-P160 HydrophobicContact CG1-CG 4.46Å; I142-P160 HydrophobicContact CG2-CG 4.09Å; I142-L172 HydrophobicContact CD1-CD2 3.67Å; I142-V193 HydrophobicContact CB-CG1 4.47Å; I142-V193 HydrophobicContact CD1-CG1 4.35Å; I142-E194 CarbonylContact C-O 3.5Å; I142-E194 WeakPolarHBondContact CA-O 3.45Å; I142-I195 HydrophobicContact CG2-CG1 4.32Å
143	Q	98.3	Very high	94.4	Very high	74 Å²	74	67.8 Å²	67.8	35%	0.346	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.2	133.6	164.5	-177.7	166.1	-93.4	0	0	109.3	R156 V193 E194 L196	Q143-R156 WeakPolarHBondContact CA-O 3.17Å; Q143-V193 WeakPolarHBondContact O-CA 3.43Å; Q143-E194 HydrophobicContact CB-CB 4.48Å; Q143-E194 PolarHBondContact N-O 3.11Å; Q143-E194 PolarHBondContact O-N 3.15Å; Q143-L196 HydrophobicContact CB-CD1 4.2Å; Q143-L196 HydrophobicContact CB-CD2 4.11Å; Q143-L196 HydrophobicContact CB-CG 4.28Å
144	I	97.9	Very high	94.6	Very high	0 Å²	0	66.2 Å²	66.2	0%	0	34%	0.336	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.5	153.5	177.4	69.6	165	0	0	0	111.5	I142 Y146 A155 R156 L158 F185 M190 V193	I142-I144 HydrophobicContact CD1-CG2 3.85Å; I142-I144 HydrophobicContact CG1-CG2 4.1Å; I144-Y146 HydrophobicContact CD1-CD2 3.84Å; I144-Y146 HydrophobicContact CD1-CG 4.17Å; I144-A155 CarbonylContact O-C 3.57Å; I144-A155 WeakPolarHBondContact O-CA 3.22Å; I144-R156 HydrophobicContact CD1-CB 4.42Å; I144-R156 HydrophobicContact CG1-CB 3.8Å; I144-R156 HydrophobicContact CG1-CG 4.39Å; I144-R156 PolarHBondContact N-O 2.98Å; I144-R156 PolarHBondContact O-N 3.23Å; I144-L158 HydrophobicContact CD1-CD1 3.42Å; I144-L158 VanDerWaalsContact CD1-CD1 3.42Å; I144-L158 HydrophobicContact CD1-CG 4.29Å; I144-L158 HydrophobicContact CG1-CD1 3.95Å; I144-L158 HydrophobicContact CG1-CG 4.33Å; I144-F185 HydrophobicContact CD1-CD1 4.37Å; I144-M190 HydrophobicContact CD1-CE 4.22Å; I144-M190 HydrophobicContact CD1-CG 4Å; I144-M190 HydrophobicContact CD1-SD 4.44Å; I144-V193 HydrophobicContact CB-CG2 4.37Å; I144-V193 HydrophobicContact CG2-CB 4.19Å; I144-V193 HydrophobicContact CG2-CG1 4.02Å; I144-V193 HydrophobicContact CG2-CG2 3.67Å
145	N	97.1	Very high	94.7	Very high	57 Å²	57	63.1 Å²	63.1	31%	0.305	33%	0.332	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-98.3	109.7	160.5	-74.4	-24.3	0	0	0	109	F153 R191 N192	N145-F153 HydrophobicContact CB-CD1 4.3Å; N145-R191 HydrophobicContact CB-CB 4.22Å; N145-R191 PolarHBondContact N-O 3.49Å; N145-R191 PolarHBondContact O-N 2.95Å; N145-N192 PolarHBondContact ND2-ND2 3.42Å
146	Y	96.7	Very high	94.7	Very high	24 Å²	24	64.5 Å²	64.5	9%	0.094	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.9	124.5	-173.2	-166.6	-107.3	0	0	0	112.6	I144 S148 F153 T154 F185 K186 R189 M190	I144-Y146 HydrophobicContact CD1-CD2 3.84Å; I144-Y146 HydrophobicContact CD1-CG 4.17Å; Y146-S148 PolarHBondContact O-N 2.96Å; Y146-F153 CarbonylContact O-C 3.51Å; Y146-F153 WeakPolarHBondContact O-CA 3.48Å; Y146-T154 PolarHBondContact N-O 3.45Å; Y146-T154 PolarHBondContact O-N 2.89Å; Y146-T154 PolarHBondContact O-OG1 3.28Å; Y146-F185 AromaticContact CD1-CD1 3.96Å; Y146-F185 HydrophobicContact CD1-CD1 3.96Å; Y146-F185 HydrophobicContact CD1-CE1 4.35Å; Y146-F185 HydrophobicContact CD2-CB 4.37Å; Y146-F185 AromaticContact CD2-CD1 3.83Å; Y146-F185 HydrophobicContact CD2-CD1 3.83Å; Y146-F185 AromaticContact CE1-CD1 3.87Å; Y146-F185 HydrophobicContact CE1-CD1 3.87Å; Y146-F185 HydrophobicContact CE1-CE1 4.5Å; Y146-F185 HydrophobicContact CE2-CB 3.73Å; Y146-F185 AromaticContact CE2-CD1 3.76Å; Y146-F185 HydrophobicContact CE2-CD1 3.76Å; Y146-F185 HydrophobicContact CE2-CG 4.25Å; Y146-F185 AromaticContact CG-CD1 3.92Å; Y146-F185 HydrophobicContact CG-CD1 3.92Å; Y146-F185 HydrophobicContact CG-CE1 4.47Å; Y146-F185 AromaticContact CZ-CD1 3.77Å; Y146-F185 WeakPolarHBondContact OH-CA 3.3Å; Y146-K186 PolarHBondContact OH-N 3.28Å; Y146-R189 HydrophobicContact CD2-CB 4.13Å; Y146-R189 HydrophobicContact CE2-CB 3.56Å; Y146-M190 HydrophobicContact CD2-CG 3.92Å; Y146-M190 HydrophobicContact CE2-CG 4.11Å
147	L	95.8	Very high	94.8	Very high	51 Å²	51	66.8 Å²	66.8	27%	0.267	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.7	111.1	173.9	-175.5	60.9	0	0	0	110.4	G151 F153 R189	L147-G151 VanDerWaalsContact CD1-C 3.48Å; L147-G151 WeakPolarHBondContact CD1-O 3.4Å; L147-F153 HydrophobicContact CB-CD1 4.1Å; L147-F153 HydrophobicContact CB-CE1 3.69Å; L147-F153 HydrophobicContact CB-CZ 4.07Å; L147-F153 HydrophobicContact CD1-CD2 4.21Å; L147-F153 HydrophobicContact CD1-CE1 4.35Å; L147-F153 HydrophobicContact CD1-CE2 4Å; L147-F153 HydrophobicContact CD1-CG 4.47Å; L147-F153 HydrophobicContact CD1-CZ 4.08Å; L147-F153 HydrophobicContact CD2-CZ 4.49Å; L147-F153 HydrophobicContact CG-CZ 4.44Å; L147-R189 HydrophobicContact CB-CB 4.21Å; L147-R189 PolarHBondContact N-O 2.91Å; L147-R189 WeakPolarHBondContact O-CD 3.33Å
148	S	89.8	Confident	95	Very high	29 Å²	29	59 Å²	59	20%	0.203	31%	0.312	C	S	.	.			trans	-73.8	166.4	175.4	68.1	0	0	0	0	112.2	Y146 K150 G151 Q152	Y146-S148 PolarHBondContact O-N 2.96Å; S148-K150 PolarHBondContact O-N 3.46Å; S148-K150 VanDerWaalsContact O-N 3.16Å; S148-K150 PolarHBondContact OG-N 3.32Å; S148-G151 PolarHBondContact O-N 2.89Å; S148-Q152 WeakPolarHBondContact CB-O 3.25Å; S148-Q152 PolarHBondContact N-O 3.3Å; S148-Q152 PolarHBondContact OG-N 2.91Å; S148-Q152 PolarHBondContact OG-O 3.4Å
149	T	82.9	Confident	95.1	Very high	121 Å²	121	56.9 Å²	56.9	74%	0.742	30%	0.297	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.7	-17.1	172.5	48.3	0	0	0	0	113.5	G151	T149-G151 VanDerWaalsContact C-N 3.25Å; T149-G151 PolarHBondContact O-N 2.77Å
150	K	86.1	Confident	95.1	Very high	173 Å²	173	51 Å²	51	75%	0.752	27%	0.274	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.9	4.6	174.3	-61.1	-174	178.1	-174	0	113.2	S148 Q152	S148-K150 PolarHBondContact O-N 3.46Å; S148-K150 VanDerWaalsContact O-N 3.16Å; S148-K150 PolarHBondContact OG-N 3.32Å; K150-Q152 PolarHBondContact O-N 3.03Å
151	G	87.6	Confident	95.1	Very high	55 Å²	55	49.6 Å²	49.6	57%	0.567	27%	0.267	S	S	*	.	S	Bend	trans	76.3	6.4	-178.1	0	0	0	0	0	114.6	L147 S148 T149	L147-G151 VanDerWaalsContact CD1-C 3.48Å; L147-G151 WeakPolarHBondContact CD1-O 3.4Å; S148-G151 PolarHBondContact O-N 2.89Å; T149-G151 VanDerWaalsContact C-N 3.25Å; T149-G151 PolarHBondContact O-N 2.77Å
152	Q	92.1	Very high	95	Very high	123 Å²	123	52.6 Å²	52.6	58%	0.575	28%	0.28	S	S	*	.			trans	-99	134.7	180	-66.3	174.5	-16.4	0	0	110.8	S148 K150	S148-Q152 WeakPolarHBondContact CB-O 3.25Å; S148-Q152 PolarHBondContact N-O 3.3Å; S148-Q152 PolarHBondContact OG-N 2.91Å; S148-Q152 PolarHBondContact OG-O 3.4Å; K150-Q152 PolarHBondContact O-N 3.03Å
153	F	95.3	Very high	94.7	Very high	116 Å²	116	54 Å²	54	51%	0.509	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.6	140.6	167.1	-76.2	-78.2	0	0	0	110.7	N145 Y146 L147 R191	N145-F153 HydrophobicContact CB-CD1 4.3Å; Y146-F153 CarbonylContact O-C 3.51Å; Y146-F153 WeakPolarHBondContact O-CA 3.48Å; L147-F153 HydrophobicContact CB-CD1 4.1Å; L147-F153 HydrophobicContact CB-CE1 3.69Å; L147-F153 HydrophobicContact CB-CZ 4.07Å; L147-F153 HydrophobicContact CD1-CD2 4.21Å; L147-F153 HydrophobicContact CD1-CE1 4.35Å; L147-F153 HydrophobicContact CD1-CE2 4Å; L147-F153 HydrophobicContact CD1-CG 4.47Å; L147-F153 HydrophobicContact CD1-CZ 4.08Å; L147-F153 HydrophobicContact CD2-CZ 4.49Å; L147-F153 HydrophobicContact CG-CZ 4.44Å; F153-R191 HydrophobicContact CE1-CB 4.31Å; F153-R191 HydrophobicContact CE1-CG 3.69Å; F153-R191 HydrophobicContact CZ-CG 4.15Å
154	T	95.5	Very high	94.4	Very high	39 Å²	39	51.3 Å²	51.3	24%	0.239	28%	0.276	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-135	131.8	171.6	52.4	0	0	0	0	109.2	Y146 R156	Y146-T154 PolarHBondContact N-O 3.45Å; Y146-T154 PolarHBondContact O-N 2.89Å; Y146-T154 PolarHBondContact O-OG1 3.28Å; T154-R156 PolarHBondContact OG1-NE 3.47Å; T154-R156 PolarHBondContact OG1-NH2 3.47Å
155	A	97	Very high	93.9	Very high	61 Å²	61	55.1 Å²	55.1	50%	0.504	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67	135.1	170	0	0	0	0	0	109.5	I144	I144-A155 CarbonylContact O-C 3.57Å; I144-A155 WeakPolarHBondContact O-CA 3.22Å
156	R	97.2	Very high	93.3	Very high	28 Å²	28	56.9 Å²	56.9	11%	0.106	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.6	131.6	179.6	-54.9	-71.4	175.4	179.3	-11.6	109.3	Q143 I144 T154 L158	Q143-R156 WeakPolarHBondContact CA-O 3.17Å; I144-R156 HydrophobicContact CD1-CB 4.42Å; I144-R156 HydrophobicContact CG1-CB 3.8Å; I144-R156 HydrophobicContact CG1-CG 4.39Å; I144-R156 PolarHBondContact N-O 2.98Å; I144-R156 PolarHBondContact O-N 3.23Å; T154-R156 PolarHBondContact OG1-NE 3.47Å; T154-R156 PolarHBondContact OG1-NH2 3.47Å; R156-L158 HydrophobicContact CB-CD2 3.87Å; R156-L158 HydrophobicContact CB-CG 4.09Å
157	K	98.3	Very high	92.6	Very high	78 Å²	78	62.5 Å²	62.5	34%	0.339	33%	0.327	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.5	125.6	157.8	-75.6	-169.4	168	-160.4	0	109.1	V141 I142 H177 L196 E198	V141-K157 HydrophobicContact CG1-CB 4.16Å; V141-K157 HydrophobicContact CG1-CG 4.49Å; I142-K157 WeakPolarHBondContact O-CA 3.32Å; K157-H177 HydrophobicContact CB-CB 4.1Å; K157-H177 PolarHBondContact O-N 2.88Å; K157-L196 HydrophobicContact CD-CD1 4.39Å; K157-L196 HydrophobicContact CG-CD1 4.45Å; K157-E198 IonicContact NZ-OE2 2.85Å; K157-E198 PolarHBondContact NZ-OE2 3.23Å
158	L	98.5	Very high	91.9	Very high	0 Å²	0	69.1 Å²	69.1	0%	0	35%	0.353	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-127.6	143.1	-175.6	-56.6	-175.1	0	0	0	110.4	V141 I142 I144 R156 P160 L172 A174 F175 C176 F185	V141-L158 CarbonylContact C-O 3.59Å; V141-L158 WeakPolarHBondContact CA-O 3.4Å; V141-L158 WeakPolarHBondContact CG1-O 3.48Å; I142-L158 HydrophobicContact CD1-CB 4.33Å; I142-L158 HydrophobicContact CD1-CD1 4.43Å; I142-L158 HydrophobicContact CG1-CB 3.8Å; I142-L158 PolarHBondContact N-O 3.12Å; I142-L158 PolarHBondContact O-N 3.48Å; I144-L158 HydrophobicContact CD1-CD1 3.42Å; I144-L158 VanDerWaalsContact CD1-CD1 3.42Å; I144-L158 HydrophobicContact CD1-CG 4.29Å; I144-L158 HydrophobicContact CG1-CD1 3.95Å; I144-L158 HydrophobicContact CG1-CG 4.33Å; R156-L158 HydrophobicContact CB-CD2 3.87Å; R156-L158 HydrophobicContact CB-CG 4.09Å; L158-P160 VanDerWaalsContact O-CD 3.26Å; L158-P160 WeakPolarHBondContact O-CD 3.09Å; L158-L172 HydrophobicContact CD1-CD2 4.17Å; L158-A174 HydrophobicContact CB-CB 4.01Å; L158-A174 HydrophobicContact CD1-CB 4.31Å; L158-F175 WeakPolarHBondContact CA-O 3.49Å; L158-C176 HydrophobicContact CD2-CB 3.75Å; L158-F185 HydrophobicContact CD1-CD1 4.18Å; L158-F185 HydrophobicContact CD1-CD2 3.84Å; L158-F185 HydrophobicContact CD1-CE1 4.19Å; L158-F185 HydrophobicContact CD1-CE2 3.84Å; L158-F185 HydrophobicContact CD1-CG 4.02Å; L158-F185 HydrophobicContact CD1-CZ 4.03Å; L158-F185 HydrophobicContact CD2-CD2 4.44Å; L158-F185 HydrophobicContact CD2-CE1 4.02Å; L158-F185 HydrophobicContact CD2-CE2 3.61Å; L158-F185 HydrophobicContact CD2-CZ 3.36Å; L158-F185 HydrophobicContact CG-CE2 4.39Å; L158-F185 HydrophobicContact CG-CZ 4.37Å
159	E	98.3	Very high	91.8	Very high	8 Å²	8	68.3 Å²	68.3	4%	0.037	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-97.2	102.5	164	-70.5	172.9	-146.8	0	0	108.4	V141 L161 A174 F175 H177 F200 R202	V141-E159 HydrophobicContact CG2-CG 3.93Å; E159-L161 PolarHBondContact O-N 3.36Å; E159-A174 WeakPolarHBondContact O-CA 3.49Å; E159-A174 WeakPolarHBondContact O-CB 3.34Å; E159-F175 HydrophobicContact CB-CB 4.24Å; E159-F175 PolarHBondContact N-O 2.96Å; E159-F175 PolarHBondContact O-N 3.23Å; E159-F175 VanDerWaalsContact O-N 3.1Å; E159-H177 IonicContact OE1-CD2 2.75Å; E159-H177 IonicContact OE1-CE1 3.29Å; E159-H177 IonicContact OE1-NE2 3.09Å; E159-H177 PolarHBondContact OE1-NE2 2.88Å; E159-F200 HydrophobicContact CB-CB 4.31Å; E159-F200 HydrophobicContact CB-CD1 3.73Å; E159-F200 HydrophobicContact CB-CD2 3.97Å; E159-F200 HydrophobicContact CB-CE1 4.04Å; E159-F200 HydrophobicContact CB-CE2 4.29Å; E159-F200 HydrophobicContact CB-CG 3.71Å; E159-F200 HydrophobicContact CB-CZ 4.32Å; E159-F200 HydrophobicContact CG-CB 3.6Å; E159-F200 HydrophobicContact CG-CD1 3.59Å; E159-F200 HydrophobicContact CG-CD2 4.2Å; E159-F200 HydrophobicContact CG-CE1 4.36Å; E159-F200 HydrophobicContact CG-CG 3.51Å; E159-F200 WeakPolarHBondContact OE2-CB 3.32Å; E159-F200 WeakPolarHBondContact OE2-CG 3.25Å; E159-R202 VanDerWaalsContact CD-NE 3.34Å; E159-R202 VanDerWaalsContact CD-NH2 3.29Å; E159-R202 IonicContact OE1-CZ 3.55Å; E159-R202 IonicContact OE1-NE 3.3Å; E159-R202 IonicContact OE1-NH2 3.77Å; E159-R202 PolarHBondContact OE1-NH2 2.92Å; E159-R202 WeakPolarHBondContact OE2-CD 3.49Å; E159-R202 IonicContact OE2-CZ 2.92Å; E159-R202 VanDerWaalsContact OE2-CZ 3.3Å; E159-R202 IonicContact OE2-NE 3.65Å; E159-R202 PolarHBondContact OE2-NE 3.03Å; E159-R202 IonicContact OE2-NH2 2.76Å; E159-R202 PolarHBondContact OE2-NH2 3.23Å
160	P	98.2	Very high	92.1	Very high	0 Å²	0	64.5 Å²	64.5	0%	0	32%	0.32	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.8	120.5	-176.2	31.3	-37.3	0	0	0	110.4	A135 I136 N140 I142 L158 L172 F200	A135-P160 HydrophobicContact CB-CG 3.76Å; I136-P160 HydrophobicContact CG1-CB 3.75Å; I136-P160 HydrophobicContact CG1-CG 4.29Å; N140-P160 VanDerWaalsContact O-CD 3.26Å; N140-P160 WeakPolarHBondContact O-CD 3.44Å; N140-P160 WeakPolarHBondContact O-CG 3.47Å; I142-P160 HydrophobicContact CD1-CB 4.27Å; I142-P160 HydrophobicContact CD1-CG 4.49Å; I142-P160 HydrophobicContact CG1-CG 4.46Å; I142-P160 HydrophobicContact CG2-CG 4.09Å; L158-P160 VanDerWaalsContact O-CD 3.26Å; L158-P160 WeakPolarHBondContact O-CD 3.09Å; P160-L172 HydrophobicContact CB-CD1 3.7Å; P160-L172 HydrophobicContact CB-CD2 3.96Å; P160-L172 HydrophobicContact CB-CG 4.33Å; P160-F200 HydrophobicContact CG-CE1 4.2Å; P160-F200 WeakPolarHBondContact O-CZ 3.44Å
161	L	97.6	Very high	92.4	Very high	5 Å²	5	58.8 Å²	58.8	3%	0.026	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-110	-37	-173.1	-67.2	170	0	0	0	113.5	E159 Y173 Y182 F200 R202 T204	E159-L161 PolarHBondContact O-N 3.36Å; L161-Y173 HydrophobicContact CB-CD1 3.98Å; L161-Y173 WeakPolarHBondContact CB-O 3.37Å; L161-Y173 HydrophobicContact CD1-CD1 4.15Å; L161-Y173 HydrophobicContact CD1-CE1 3.95Å; L161-Y173 PolarHBondContact N-O 2.8Å; L161-Y182 HydrophobicContact CD1-CD1 3.72Å; L161-Y182 HydrophobicContact CD1-CE1 3.5Å; L161-F200 HydrophobicContact CD2-CD2 4.28Å; L161-F200 HydrophobicContact CD2-CE2 3.55Å; L161-F200 HydrophobicContact CD2-CZ 4.27Å; L161-R202 HydrophobicContact CD2-CB 4.08Å; L161-T204 HydrophobicContact CB-CG2 4.08Å; L161-T204 WeakPolarHBondContact CB-OG1 3.35Å; L161-T204 WeakPolarHBondContact O-CG2 3.49Å; L161-T204 PolarHBondContact O-OG1 3.46Å; L161-T204 VanDerWaalsContact O-OG1 3.13Å
162	K	96	Very high	92.8	Very high	63 Å²	63	56.2 Å²	56.2	27%	0.274	27%	0.268	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-160	136.4	-177.7	-170.5	169.6	-86.6	170.8	0	111.4	V164 Y173 T204 P205 K206 I208	K162-V164 HydrophobicContact CB-CG1 4.46Å; K162-V164 HydrophobicContact CD-CG1 3.96Å; K162-V164 HydrophobicContact CG-CG1 3.8Å; K162-Y173 PolarHBondContact N-O 3.08Å; K162-Y173 PolarHBondContact O-N 2.93Å; K162-T204 HydrophobicContact CB-CG2 3.87Å; K162-T204 HydrophobicContact CD-CG2 4.27Å; K162-P205 PolarHBondContact NZ-O 3.18Å; K162-K206 PolarHBondContact NZ-O 3.1Å; K162-I208 HydrophobicContact CD-CD1 4.43Å; K162-I208 HydrophobicContact CD-CG1 3.82Å
163	L	93.6	Very high	93.1	Very high	30 Å²	30	51.9 Å²	51.9	16%	0.157	25%	0.246	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.2	132	163.2	-70	170.7	0	0	0	109	F129 L132 I136 W170 Y171 L172 M187	F129-L163 HydrophobicContact CD2-CD1 3.77Å; F129-L163 HydrophobicContact CE1-CD1 4.33Å; F129-L163 HydrophobicContact CE2-CB 4.38Å; F129-L163 HydrophobicContact CE2-CD1 3.57Å; F129-L163 HydrophobicContact CG-CD1 4.24Å; F129-L163 HydrophobicContact CZ-CD1 3.88Å; L132-L163 HydrophobicContact CB-CD1 4.17Å; L132-L163 HydrophobicContact CB-CD2 4.15Å; L132-L163 HydrophobicContact CD1-CD2 3.92Å; I136-L163 HydrophobicContact CD1-CD1 4.27Å; I136-L163 HydrophobicContact CD1-CG 3.77Å; L163-W170 HydrophobicContact CB-CE3 4.25Å; L163-W170 HydrophobicContact CB-CZ3 4.19Å; L163-Y171 WeakPolarHBondContact CA-O 3.34Å; L163-L172 HydrophobicContact CD2-CB 4.28Å; L163-L172 HydrophobicContact CD2-CD1 3.89Å; L163-L172 HydrophobicContact CG-CD1 4.45Å; L163-M187 HydrophobicContact CD2-CG 4.47Å; L163-M187 HydrophobicContact CD2-SD 3.65Å
164	V	91.6	Very high	93.2	Very high	16 Å²	16	46.3 Å²	46.3	10%	0.097	22%	0.222	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-132.5	142.1	179.8	-58.9	0	0	0	0	110	K162 Y171 L184 I208 F209	K162-V164 HydrophobicContact CB-CG1 4.46Å; K162-V164 HydrophobicContact CD-CG1 3.96Å; K162-V164 HydrophobicContact CG-CG1 3.8Å; V164-Y171 PolarHBondContact N-O 3.07Å; V164-Y171 PolarHBondContact O-N 2.85Å; V164-L184 HydrophobicContact CG2-CD2 3.83Å; V164-I208 HydrophobicContact CG1-CB 4.28Å; V164-I208 HydrophobicContact CG1-CG1 4.02Å; V164-F209 HydrophobicContact CB-CE2 3.72Å; V164-F209 HydrophobicContact CB-CZ 4.18Å; V164-F209 HydrophobicContact CG1-CE2 4.46Å; V164-F209 HydrophobicContact CG2-CE2 3.56Å; V164-F209 HydrophobicContact CG2-CZ 3.48Å; V164-F209 VanDerWaalsContact CG2-CZ 3.48Å
165	F	87	Confident	93.3	Very high	80 Å²	80	45.8 Å²	45.8	35%	0.351	22%	0.216	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-106.9	129.2	176.2	-169.7	-98.1	0	0	0	109.8	F118 K168 A169 W170	F118-F165 HydrophobicContact CD1-CD2 4.09Å; F118-F165 HydrophobicContact CD1-CE1 4.09Å; F118-F165 AromaticContact CD1-CE2 3.42Å; F118-F165 HydrophobicContact CD1-CE2 3.42Å; F118-F165 VanDerWaalsContact CD1-CE2 3.42Å; F118-F165 AromaticContact CD1-CZ 3.4Å; F118-F165 HydrophobicContact CD1-CZ 3.4Å; F118-F165 AromaticContact CE1-CD1 3.95Å; F118-F165 HydrophobicContact CE1-CD1 3.95Å; F118-F165 HydrophobicContact CE1-CD2 4.12Å; F118-F165 AromaticContact CE1-CE1 3.49Å; F118-F165 HydrophobicContact CE1-CE1 3.49Å; F118-F165 VanDerWaalsContact CE1-CE1 3.49Å; F118-F165 AromaticContact CE1-CE2 3.67Å; F118-F165 HydrophobicContact CE1-CE2 3.67Å; F118-F165 HydrophobicContact CE1-CG 4.23Å; F118-F165 AromaticContact CE1-CZ 3.31Å; F118-F165 HydrophobicContact CE1-CZ 3.31Å; F118-F165 HydrophobicContact CG-CE2 4.3Å; F118-F165 HydrophobicContact CZ-CD1 4.46Å; F118-F165 HydrophobicContact CZ-CE1 4.37Å; F118-F165 HydrophobicContact CZ-CZ 4.46Å; F165-K168 VanDerWaalsContact CZ-CA 3.47Å; F165-A169 WeakPolarHBondContact CA-O 3.27Å; F165-W170 HydrophobicContact CB-CD2 4.25Å; F165-W170 HydrophobicContact CB-CE3 3.98Å; F165-W170 HydrophobicContact CB-CH2 4.08Å; F165-W170 HydrophobicContact CB-CZ2 4.33Å; F165-W170 HydrophobicContact CB-CZ3 3.91Å; F165-W170 AromaticContact CD2-CD1 3.86Å; F165-W170 AromaticContact CD2-CD2 3.7Å; F165-W170 HydrophobicContact CD2-CD2 3.7Å; F165-W170 AromaticContact CD2-CE2 3.61Å; F165-W170 HydrophobicContact CD2-CE3 4.3Å; F165-W170 AromaticContact CD2-CG 3.84Å; F165-W170 HydrophobicContact CD2-CG 3.84Å; F165-W170 HydrophobicContact CD2-CZ2 4.11Å; F165-W170 AromaticContact CD2-NE1 3.72Å; F165-W170 HydrophobicContact CE2-CG 4.45Å; F165-W170 HydrophobicContact CG-CD2 4.47Å
166	R	84.7	Confident	93.4	Very high	95 Å²	95	43 Å²	43	36%	0.358	19%	0.193	S	C	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	133.9	175.9	-172.8	172.2	-178.9	-174.9	-0.5	110.9	K168 A169 Y171 F209	R166-K168 PolarHBondContact O-N 3.19Å; R166-A169 PolarHBondContact N-O 3.24Å; R166-A169 PolarHBondContact O-N 3.06Å; R166-Y171 HydrophobicContact CB-CD2 4.48Å; R166-Y171 HydrophobicContact CB-CE2 4.28Å; R166-Y171 WeakPolarHBondContact O-CE2 3.24Å; R166-F209 HydrophobicContact CB-CE1 4.5Å; R166-F209 HydrophobicContact CB-CE2 3.8Å; R166-F209 HydrophobicContact CB-CZ 3.72Å; R166-F209 HydrophobicContact CG-CE2 4.4Å; R166-F209 HydrophobicContact CG-CZ 4.3Å; R166-F209 VanDerWaalsContact NH1-CD1 3.29Å
167	N	81.4	Confident	93.4	Very high	141 Å²	141	44.5 Å²	44.5	75%	0.754	20%	0.201	S	C	*	.	T	Hydrogen-bonded Turn	trans	48.3	60	176.5	-168.2	26.6	0	0	0	113	A169	N167-A169 PolarHBondContact O-N 3.29Å
168	K	81.5	Confident	93.3	Very high	191 Å²	191	45.9 Å²	45.9	83%	0.83	21%	0.211	S	C	*	.	T	Hydrogen-bonded Turn	trans	60.9	23.1	177.8	-51.4	-179.3	-177.7	-178.9	0	114.9	F165 R166	F165-K168 VanDerWaalsContact CZ-CA 3.47Å; R166-K168 PolarHBondContact O-N 3.19Å
169	A	86.4	Confident	93.1	Very high	12 Å²	12	52.4 Å²	52.4	10%	0.099	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-146.5	145.5	179.7	0	0	0	0	0	113.5	F165 R166 N167 Y171	F165-A169 WeakPolarHBondContact CA-O 3.27Å; R166-A169 PolarHBondContact N-O 3.24Å; R166-A169 PolarHBondContact O-N 3.06Å; N167-A169 PolarHBondContact O-N 3.29Å; A169-Y171 HydrophobicContact CB-CE2 3.8Å; A169-Y171 WeakPolarHBondContact O-CD2 3.48Å; A169-Y171 WeakPolarHBondContact O-CE2 3.45Å
170	W	89.9	Confident	93	Very high	40 Å²	40	55.7 Å²	55.7	15%	0.152	26%	0.264	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-83.6	140.9	170.1	-72.4	104.3	0	0	0	112.9	T90 F118 F129 L163 F165 M187	T90-W170 HydrophobicContact CG2-CH2 4.09Å; T90-W170 HydrophobicContact CG2-CZ2 3.62Å; F118-W170 HydrophobicContact CD2-CZ2 4.06Å; F118-W170 HydrophobicContact CE2-CZ2 4.36Å; F118-W170 HydrophobicContact CG-CZ2 4.34Å; F118-W170 AromaticContact CG-NE1 3.98Å; F129-W170 HydrophobicContact CD2-CD2 4.22Å; F129-W170 HydrophobicContact CD2-CE3 4.47Å; F129-W170 AromaticContact CE2-CD2 3.97Å; F129-W170 HydrophobicContact CE2-CD2 3.97Å; F129-W170 AromaticContact CE2-CE2 3.89Å; F129-W170 AromaticContact CE2-CE3 3.89Å; F129-W170 HydrophobicContact CE2-CE3 3.89Å; F129-W170 AromaticContact CE2-CH2 3.7Å; F129-W170 HydrophobicContact CE2-CH2 3.7Å; F129-W170 AromaticContact CE2-CZ2 3.78Å; F129-W170 HydrophobicContact CE2-CZ2 3.78Å; F129-W170 AromaticContact CE2-CZ3 3.75Å; F129-W170 HydrophobicContact CE2-CZ3 3.75Å; F129-W170 HydrophobicContact CZ-CH2 4.24Å; F129-W170 HydrophobicContact CZ-CZ2 4.48Å; L163-W170 HydrophobicContact CB-CE3 4.25Å; L163-W170 HydrophobicContact CB-CZ3 4.19Å; F165-W170 HydrophobicContact CB-CD2 4.25Å; F165-W170 HydrophobicContact CB-CE3 3.98Å; F165-W170 HydrophobicContact CB-CH2 4.08Å; F165-W170 HydrophobicContact CB-CZ2 4.33Å; F165-W170 HydrophobicContact CB-CZ3 3.91Å; F165-W170 AromaticContact CD2-CD1 3.86Å; F165-W170 AromaticContact CD2-CD2 3.7Å; F165-W170 HydrophobicContact CD2-CD2 3.7Å; F165-W170 AromaticContact CD2-CE2 3.61Å; F165-W170 HydrophobicContact CD2-CE3 4.3Å; F165-W170 AromaticContact CD2-CG 3.84Å; F165-W170 HydrophobicContact CD2-CG 3.84Å; F165-W170 HydrophobicContact CD2-CZ2 4.11Å; F165-W170 AromaticContact CD2-NE1 3.72Å; F165-W170 HydrophobicContact CE2-CG 4.45Å; F165-W170 HydrophobicContact CG-CD2 4.47Å; W170-M187 HydrophobicContact CB-CB 4.21Å; W170-M187 HydrophobicContact CB-CE 4.46Å; W170-M187 HydrophobicContact CB-CG 4.02Å; W170-M187 HydrophobicContact CB-SD 3.32Å; W170-M187 WeakPolarHBondContact CB-SD 3.43Å; W170-M187 HydrophobicContact CG-SD 4.03Å; W170-M187 PolarHBondContact O-N 2.81Å
171	Y	93.6	Very high	92.9	Very high	54 Å²	54	59.4 Å²	59.4	21%	0.212	28%	0.284	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.5	143.9	173.8	-58.3	-100.2	0	0	0	110.2	L163 V164 R166 A169 L184 F185 K186	L163-Y171 WeakPolarHBondContact CA-O 3.34Å; V164-Y171 PolarHBondContact N-O 3.07Å; V164-Y171 PolarHBondContact O-N 2.85Å; R166-Y171 HydrophobicContact CB-CD2 4.48Å; R166-Y171 HydrophobicContact CB-CE2 4.28Å; R166-Y171 WeakPolarHBondContact O-CE2 3.24Å; A169-Y171 HydrophobicContact CB-CE2 3.8Å; A169-Y171 WeakPolarHBondContact O-CD2 3.48Å; A169-Y171 WeakPolarHBondContact O-CE2 3.45Å; Y171-L184 HydrophobicContact CD1-CB 4.45Å; Y171-F185 CarbonylContact C-O 3.56Å; Y171-F185 WeakPolarHBondContact CA-O 3.45Å; Y171-K186 HydrophobicContact CD1-CB 3.84Å; Y171-K186 HydrophobicContact CD1-CG 4.25Å; Y171-K186 HydrophobicContact CE1-CB 3.64Å; Y171-K186 HydrophobicContact CE1-CD 4.19Å; Y171-K186 HydrophobicContact CE1-CG 3.8Å
172	L	96.1	Very high	92.8	Very high	0 Å²	0	63.4 Å²	63.4	0%	0	30%	0.3	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	122.4	164.2	-178.9	70.8	0	0	0	109	L132 I136 I142 L158 P160 L163 A174 L184 F185 M190	L132-L172 HydrophobicContact CD2-CD2 4.17Å; I136-L172 HydrophobicContact CD1-CD1 4.06Å; I142-L172 HydrophobicContact CD1-CD2 3.67Å; L158-L172 HydrophobicContact CD1-CD2 4.17Å; P160-L172 HydrophobicContact CB-CD1 3.7Å; P160-L172 HydrophobicContact CB-CD2 3.96Å; P160-L172 HydrophobicContact CB-CG 4.33Å; L163-L172 HydrophobicContact CD2-CB 4.28Å; L163-L172 HydrophobicContact CD2-CD1 3.89Å; L163-L172 HydrophobicContact CG-CD1 4.45Å; L172-A174 HydrophobicContact CD2-CB 3.98Å; L172-A174 HydrophobicContact CG-CB 4.05Å; L172-L184 WeakPolarHBondContact O-CA 3.44Å; L172-F185 HydrophobicContact CB-CB 4.46Å; L172-F185 PolarHBondContact N-O 3.19Å; L172-F185 PolarHBondContact O-N 3.49Å; L172-M190 HydrophobicContact CB-CE 3.53Å; L172-M190 HydrophobicContact CD2-CE 3.71Å; L172-M190 HydrophobicContact CG-CE 4.28Å
173	Y	97.5	Very high	92.8	Very high	32 Å²	32	65.7 Å²	65.7	13%	0.125	31%	0.307	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.6	121.8	162.1	-177.4	-104.2	0	0	0	108.7	L161 K162 Y182 L184 P205 I208	L161-Y173 HydrophobicContact CB-CD1 3.98Å; L161-Y173 WeakPolarHBondContact CB-O 3.37Å; L161-Y173 HydrophobicContact CD1-CD1 4.15Å; L161-Y173 HydrophobicContact CD1-CE1 3.95Å; L161-Y173 PolarHBondContact N-O 2.8Å; K162-Y173 PolarHBondContact N-O 3.08Å; K162-Y173 PolarHBondContact O-N 2.93Å; Y173-Y182 AromaticContact CE1-CD1 3.91Å; Y173-Y182 HydrophobicContact CE1-CD1 3.91Å; Y173-Y182 AromaticContact CZ-CD1 3.8Å; Y173-Y182 AromaticContact CZ-CG 3.94Å; Y173-Y182 VanDerWaalsContact OH-CB 3.31Å; Y173-Y182 WeakPolarHBondContact OH-CB 3.46Å; Y173-Y182 WeakPolarHBondContact OH-CD1 3.38Å; Y173-L184 HydrophobicContact CD2-CD2 3.97Å; Y173-L184 HydrophobicContact CD2-CG 4.29Å; Y173-L184 HydrophobicContact CG-CD2 4.44Å; Y173-P205 HydrophobicContact CE1-CG 4.07Å; Y173-I208 HydrophobicContact CD1-CD1 3.39Å; Y173-I208 HydrophobicContact CD1-CG1 4.24Å; Y173-I208 HydrophobicContact CD2-CD1 4.08Å; Y173-I208 HydrophobicContact CD2-CG2 3.56Å; Y173-I208 HydrophobicContact CE1-CD1 3.51Å; Y173-I208 HydrophobicContact CE2-CD1 4.16Å; Y173-I208 HydrophobicContact CE2-CG2 4.02Å; Y173-I208 HydrophobicContact CG-CD1 3.68Å; Y173-I208 HydrophobicContact CG-CG1 4.11Å; Y173-I208 HydrophobicContact CG-CG2 3.94Å
174	A	98	Very high	92.8	Very high	0 Å²	0	67.6 Å²	67.6	0%	0	32%	0.317	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-149.8	152.3	-174.7	0	0	0	0	0	112.2	L158 E159 L172 Y182 R183 F185	L158-A174 HydrophobicContact CB-CB 4.01Å; L158-A174 HydrophobicContact CD1-CB 4.31Å; E159-A174 WeakPolarHBondContact O-CA 3.49Å; E159-A174 WeakPolarHBondContact O-CB 3.34Å; L172-A174 HydrophobicContact CD2-CB 3.98Å; L172-A174 HydrophobicContact CG-CB 4.05Å; A174-Y182 WeakPolarHBondContact O-CA 3.23Å; A174-R183 PolarHBondContact N-O 2.93Å; A174-R183 PolarHBondContact O-N 3.49Å; A174-F185 HydrophobicContact CB-CD2 4.25Å; A174-F185 HydrophobicContact CB-CE2 4.2Å
175	F	97.9	Very high	93	Very high	28 Å²	28	67.2 Å²	67.2	12%	0.123	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-80.8	124.4	166.4	-174.8	-94.8	0	0	0	109.5	L158 E159 H177 A180 Y182	L158-F175 WeakPolarHBondContact CA-O 3.49Å; E159-F175 HydrophobicContact CB-CB 4.24Å; E159-F175 PolarHBondContact N-O 2.96Å; E159-F175 PolarHBondContact O-N 3.23Å; E159-F175 VanDerWaalsContact O-N 3.1Å; F175-H177 AromaticContact CD1-CD2 3.95Å; F175-A180 VanDerWaalsContact CE2-C 3.49Å; F175-A180 VanDerWaalsContact CZ-C 3.4Å; F175-A180 HydrophobicContact CZ-CB 4.5Å; F175-Y182 HydrophobicContact CB-CD1 4.01Å; F175-Y182 HydrophobicContact CB-CE1 4Å; F175-Y182 HydrophobicContact CD2-CD1 4.08Å; F175-Y182 HydrophobicContact CD2-CD2 4.19Å; F175-Y182 AromaticContact CD2-CE1 3.99Å; F175-Y182 HydrophobicContact CD2-CE1 3.99Å; F175-Y182 HydrophobicContact CD2-CE2 4.11Å; F175-Y182 HydrophobicContact CD2-CG 4.18Å; F175-Y182 HydrophobicContact CG-CE1 4.46Å
176	C	97.8	Very high	93.3	Very high	1 Å²	1	66.6 Å²	66.6	1%	0.007	31%	0.311	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-99.3	112.1	-176.4	-179.9	0	0	0	0	110.4	L158 L178 R179 A180 D181 F185	L158-C176 HydrophobicContact CD2-CB 3.75Å; C176-L178 VanDerWaalsContact C-N 3.3Å; C176-L178 PolarHBondContact O-N 2.89Å; C176-R179 HydrophobicContact CB-CB 4.31Å; C176-R179 CarbonylContact O-C 3.53Å; C176-R179 PolarHBondContact O-N 2.94Å; C176-A180 WeakPolarHBondContact O-CA 3.48Å; C176-A180 PolarHBondContact O-N 3.02Å; C176-D181 PolarHBondContact N-O 2.95Å; C176-D181 PolarHBondContact O-N 2.89Å; C176-F185 HydrophobicContact CB-CE2 4.35Å; C176-F185 HydrophobicContact CB-CZ 3.87Å
177	H	97.4	Very high	93.7	Very high	61 Å²	61	62.2 Å²	62.2	28%	0.282	30%	0.295	S	S	.	.	G	3₁₀ helix	trans	-57.1	-43.7	-178.5	-70.6	-166.7	0	0	0	112.1	K157 E159 F175 R179 A180 E198	K157-H177 HydrophobicContact CB-CB 4.1Å; K157-H177 PolarHBondContact O-N 2.88Å; E159-H177 IonicContact OE1-CD2 2.75Å; E159-H177 IonicContact OE1-CE1 3.29Å; E159-H177 IonicContact OE1-NE2 3.09Å; E159-H177 PolarHBondContact OE1-NE2 2.88Å; F175-H177 AromaticContact CD1-CD2 3.95Å; H177-R179 PolarHBondContact O-N 3.37Å; H177-A180 PolarHBondContact O-N 2.84Å; H177-E198 IonicContact CE1-OE1 2.8Å
178	L	95.6	Very high	94.2	Very high	106 Å²	106	58.1 Å²	58.1	56%	0.555	28%	0.28	S	S	*	.	G	3₁₀ helix	trans	-65.8	-21.7	-178.9	-179	56.2	0	0	0	113.6	C176	C176-L178 VanDerWaalsContact C-N 3.3Å; C176-L178 PolarHBondContact O-N 2.89Å
179	R	94.7	Very high	94.7	Very high	138 Å²	138	53.2 Å²	53.2	52%	0.521	26%	0.256	S	S	.	.	G	3₁₀ helix	trans	-110.7	-3.2	178.3	-64.6	-60.3	-170	-166.9	1.6	113.2	C176 H177 D181	C176-R179 HydrophobicContact CB-CB 4.31Å; C176-R179 CarbonylContact O-C 3.53Å; C176-R179 PolarHBondContact O-N 2.94Å; H177-R179 PolarHBondContact O-N 3.37Å; R179-D181 PolarHBondContact O-N 2.83Å
180	A	96.7	Very high	95.1	Very high	76 Å²	76	52.9 Å²	52.9	63%	0.628	25%	0.253	S	S	*	.	T	Hydrogen-bonded Turn	trans	47.4	37.4	-174	0	0	0	0	0	113.4	F175 C176 H177	F175-A180 VanDerWaalsContact CE2-C 3.49Å; F175-A180 VanDerWaalsContact CZ-C 3.4Å; F175-A180 HydrophobicContact CZ-CB 4.5Å; C176-A180 WeakPolarHBondContact O-CA 3.48Å; C176-A180 PolarHBondContact O-N 3.02Å; H177-A180 PolarHBondContact O-N 2.84Å
181	D	96.3	Very high	95.3	Very high	79 Å²	79	56.5 Å²	56.5	42%	0.422	27%	0.266	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-155.1	157.8	-172.7	-168	16.5	0	0	0	112.2	C176 R179	C176-D181 PolarHBondContact N-O 2.95Å; C176-D181 PolarHBondContact O-N 2.89Å; R179-D181 PolarHBondContact O-N 2.83Å
182	Y	95.5	Very high	95.4	Very high	88 Å²	88	59.8 Å²	59.8	35%	0.345	29%	0.288	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.5	133.2	175.7	-61	-84.2	0	0	0	111.3	L161 Y173 A174 F175	L161-Y182 HydrophobicContact CD1-CD1 3.72Å; L161-Y182 HydrophobicContact CD1-CE1 3.5Å; Y173-Y182 AromaticContact CE1-CD1 3.91Å; Y173-Y182 HydrophobicContact CE1-CD1 3.91Å; Y173-Y182 AromaticContact CZ-CD1 3.8Å; Y173-Y182 AromaticContact CZ-CG 3.94Å; Y173-Y182 VanDerWaalsContact OH-CB 3.31Å; Y173-Y182 WeakPolarHBondContact OH-CB 3.46Å; Y173-Y182 WeakPolarHBondContact OH-CD1 3.38Å; A174-Y182 WeakPolarHBondContact O-CA 3.23Å; F175-Y182 HydrophobicContact CB-CD1 4.01Å; F175-Y182 HydrophobicContact CB-CE1 4Å; F175-Y182 HydrophobicContact CD2-CD1 4.08Å; F175-Y182 HydrophobicContact CD2-CD2 4.19Å; F175-Y182 AromaticContact CD2-CE1 3.99Å; F175-Y182 HydrophobicContact CD2-CE1 3.99Å; F175-Y182 HydrophobicContact CD2-CE2 4.11Å; F175-Y182 HydrophobicContact CD2-CG 4.18Å; F175-Y182 HydrophobicContact CG-CE1 4.46Å
183	R	94.7	Very high	95.4	Very high	112 Å²	112	60.8 Å²	60.8	42%	0.423	29%	0.293	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-143.7	158.3	-178.4	-65.5	-173.2	176	-130.5	-4.9	111.9	A174 F185	A174-R183 PolarHBondContact N-O 2.93Å; A174-R183 PolarHBondContact O-N 3.49Å; R183-F185 HydrophobicContact CB-CD2 4.37Å; R183-F185 HydrophobicContact CB-CE2 3.63Å; R183-F185 HydrophobicContact CB-CZ 3.89Å
184	L	95	Very high	95.4	Very high	70 Å²	70	64.2 Å²	64.2	37%	0.366	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-97	130.6	169.4	-71.5	166.5	0	0	0	110.2	V164 Y171 L172 Y173 I208 F209	V164-L184 HydrophobicContact CG2-CD2 3.83Å; Y171-L184 HydrophobicContact CD1-CB 4.45Å; L172-L184 WeakPolarHBondContact O-CA 3.44Å; Y173-L184 HydrophobicContact CD2-CD2 3.97Å; Y173-L184 HydrophobicContact CD2-CG 4.29Å; Y173-L184 HydrophobicContact CG-CD2 4.44Å; L184-I208 HydrophobicContact CD2-CG2 4.01Å; L184-F209 HydrophobicContact CD1-CD1 4.36Å; L184-F209 HydrophobicContact CD1-CE1 3.5Å; L184-F209 VanDerWaalsContact CD1-CE1 3.5Å; L184-F209 HydrophobicContact CD1-CZ 4.18Å; L184-F209 HydrophobicContact CD2-CZ 4.49Å
185	F	95.3	Very high	95.4	Very high	8 Å²	8	66.4 Å²	66.4	4%	0.035	32%	0.322	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-118.8	118	178.5	-63.2	-92.7	0	0	0	109.1	I144 Y146 L158 Y171 L172 A174 C176 R183 M187 M190	I144-F185 HydrophobicContact CD1-CD1 4.37Å; Y146-F185 AromaticContact CD1-CD1 3.96Å; Y146-F185 HydrophobicContact CD1-CD1 3.96Å; Y146-F185 HydrophobicContact CD1-CE1 4.35Å; Y146-F185 HydrophobicContact CD2-CB 4.37Å; Y146-F185 AromaticContact CD2-CD1 3.83Å; Y146-F185 HydrophobicContact CD2-CD1 3.83Å; Y146-F185 AromaticContact CE1-CD1 3.87Å; Y146-F185 HydrophobicContact CE1-CD1 3.87Å; Y146-F185 HydrophobicContact CE1-CE1 4.5Å; Y146-F185 HydrophobicContact CE2-CB 3.73Å; Y146-F185 AromaticContact CE2-CD1 3.76Å; Y146-F185 HydrophobicContact CE2-CD1 3.76Å; Y146-F185 HydrophobicContact CE2-CG 4.25Å; Y146-F185 AromaticContact CG-CD1 3.92Å; Y146-F185 HydrophobicContact CG-CD1 3.92Å; Y146-F185 HydrophobicContact CG-CE1 4.47Å; Y146-F185 AromaticContact CZ-CD1 3.77Å; Y146-F185 WeakPolarHBondContact OH-CA 3.3Å; L158-F185 HydrophobicContact CD1-CD1 4.18Å; L158-F185 HydrophobicContact CD1-CD2 3.84Å; L158-F185 HydrophobicContact CD1-CE1 4.19Å; L158-F185 HydrophobicContact CD1-CE2 3.84Å; L158-F185 HydrophobicContact CD1-CG 4.02Å; L158-F185 HydrophobicContact CD1-CZ 4.03Å; L158-F185 HydrophobicContact CD2-CD2 4.44Å; L158-F185 HydrophobicContact CD2-CE1 4.02Å; L158-F185 HydrophobicContact CD2-CE2 3.61Å; L158-F185 HydrophobicContact CD2-CZ 3.36Å; L158-F185 HydrophobicContact CG-CE2 4.39Å; L158-F185 HydrophobicContact CG-CZ 4.37Å; Y171-F185 CarbonylContact C-O 3.56Å; Y171-F185 WeakPolarHBondContact CA-O 3.45Å; L172-F185 HydrophobicContact CB-CB 4.46Å; L172-F185 PolarHBondContact N-O 3.19Å; L172-F185 PolarHBondContact O-N 3.49Å; A174-F185 HydrophobicContact CB-CD2 4.25Å; A174-F185 HydrophobicContact CB-CE2 4.2Å; C176-F185 HydrophobicContact CB-CE2 4.35Å; C176-F185 HydrophobicContact CB-CZ 3.87Å; R183-F185 HydrophobicContact CB-CD2 4.37Å; R183-F185 HydrophobicContact CB-CE2 3.63Å; R183-F185 HydrophobicContact CB-CZ 3.89Å; F185-M187 PolarHBondContact O-N 2.93Å; F185-M190 HydrophobicContact CB-CE 3.24Å; F185-M190 HydrophobicContact CG-CE 4.2Å
186	K	93.6	Very high	95.4	Very high	66 Å²	66	66.5 Å²	66.5	29%	0.287	32%	0.324	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-67.9	121.9	177.3	-167.6	172.9	-174.6	174.3	0	108.4	Y146 Y171 A188 R189	Y146-K186 PolarHBondContact OH-N 3.28Å; Y171-K186 HydrophobicContact CD1-CB 3.84Å; Y171-K186 HydrophobicContact CD1-CG 4.25Å; Y171-K186 HydrophobicContact CE1-CB 3.64Å; Y171-K186 HydrophobicContact CE1-CD 4.19Å; Y171-K186 HydrophobicContact CE1-CG 3.8Å; K186-A188 HydrophobicContact CG-CB 4.48Å; K186-A188 PolarHBondContact O-N 2.82Å; K186-R189 HydrophobicContact CB-CG 4.32Å; K186-R189 WeakPolarHBondContact O-CB 3.43Å; K186-R189 PolarHBondContact O-N 3.3Å
187	M	93.2	Very high	95.3	Very high	4 Å²	4	72.3 Å²	72.3	2%	0.02	36%	0.364	C	S	.	.	G	3₁₀ helix	trans	-56.1	-40.1	-174.6	-79	178.7	56.1	0	0	112.3	L128 F129 L132 L163 W170 F185 R189 M190	L128-M187 HydrophobicContact CB-CE 4.43Å; L128-M187 HydrophobicContact CD2-CB 4.38Å; L128-M187 HydrophobicContact CD2-CE 4.22Å; L128-M187 HydrophobicContact CG-CE 4Å; F129-M187 HydrophobicContact CB-CE 3.95Å; F129-M187 HydrophobicContact CD2-CE 4.25Å; F129-M187 HydrophobicContact CD2-SD 4.46Å; L132-M187 HydrophobicContact CD1-CE 3.93Å; L132-M187 HydrophobicContact CD1-CG 3.82Å; L132-M187 HydrophobicContact CD1-SD 3.92Å; L163-M187 HydrophobicContact CD2-CG 4.47Å; L163-M187 HydrophobicContact CD2-SD 3.65Å; W170-M187 HydrophobicContact CB-CB 4.21Å; W170-M187 HydrophobicContact CB-CE 4.46Å; W170-M187 HydrophobicContact CB-CG 4.02Å; W170-M187 HydrophobicContact CB-SD 3.32Å; W170-M187 WeakPolarHBondContact CB-SD 3.43Å; W170-M187 HydrophobicContact CG-SD 4.03Å; W170-M187 PolarHBondContact O-N 2.81Å; F185-M187 PolarHBondContact O-N 2.93Å; M187-R189 PolarHBondContact O-N 2.84Å; M187-M190 HydrophobicContact CG-SD 4.48Å; M187-M190 WeakPolarHBondContact O-CB 3.42Å; M187-M190 PolarHBondContact O-N 2.98Å
188	A	90.6	Very high	95.4	Very high	54 Å²	54	73 Å²	73	45%	0.446	37%	0.368	S	S	.	.	G	3₁₀ helix	trans	-58.3	-15	177.6	0	0	0	0	0	114.8	K186 R191	K186-A188 HydrophobicContact CG-CB 4.48Å; K186-A188 PolarHBondContact O-N 2.82Å; A188-R191 PolarHBondContact O-NH1 2.77Å; A188-R191 PolarHBondContact O-NH2 2.9Å
189	R	93.4	Very high	95.4	Very high	89 Å²	89	72.1 Å²	72.1	34%	0.336	37%	0.371	S	S	.	.	G	3₁₀ helix	trans	-100.4	-2.2	178	-65.2	179.7	-178.6	172.2	0.2	113.6	Y146 L147 K186 M187	Y146-R189 HydrophobicContact CD2-CB 4.13Å; Y146-R189 HydrophobicContact CE2-CB 3.56Å; L147-R189 HydrophobicContact CB-CB 4.21Å; L147-R189 PolarHBondContact N-O 2.91Å; L147-R189 WeakPolarHBondContact O-CD 3.33Å; K186-R189 HydrophobicContact CB-CG 4.32Å; K186-R189 WeakPolarHBondContact O-CB 3.43Å; K186-R189 PolarHBondContact O-N 3.3Å; M187-R189 PolarHBondContact O-N 2.84Å
190	M	95.1	Very high	95.6	Very high	5 Å²	5	66.5 Å²	66.5	3%	0.025	35%	0.35	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-86	138.9	176.5	-58.9	-179.3	170.6	0	0	110.3	L128 L132 I144 Y146 L172 F185 M187 V193	L128-M190 HydrophobicContact CD2-CB 4.43Å; L132-M190 HydrophobicContact CD1-SD 3.99Å; L132-M190 HydrophobicContact CD2-SD 4.48Å; I144-M190 HydrophobicContact CD1-CE 4.22Å; I144-M190 HydrophobicContact CD1-CG 4Å; I144-M190 HydrophobicContact CD1-SD 4.44Å; Y146-M190 HydrophobicContact CD2-CG 3.92Å; Y146-M190 HydrophobicContact CE2-CG 4.11Å; L172-M190 HydrophobicContact CB-CE 3.53Å; L172-M190 HydrophobicContact CD2-CE 3.71Å; L172-M190 HydrophobicContact CG-CE 4.28Å; F185-M190 HydrophobicContact CB-CE 3.24Å; F185-M190 HydrophobicContact CG-CE 4.2Å; M187-M190 HydrophobicContact CG-SD 4.48Å; M187-M190 WeakPolarHBondContact O-CB 3.42Å; M187-M190 PolarHBondContact O-N 2.98Å; M190-V193 HydrophobicContact CB-CG2 3.97Å
191	R	94.1	Very high	95.5	Very high	116 Å²	116	66.3 Å²	66.3	44%	0.438	36%	0.355	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-134.1	155	172.6	-61.7	-64.8	-179.5	-86.7	0.8	108.8	N145 F153 A188 V193	N145-R191 HydrophobicContact CB-CB 4.22Å; N145-R191 PolarHBondContact N-O 3.49Å; N145-R191 PolarHBondContact O-N 2.95Å; F153-R191 HydrophobicContact CE1-CB 4.31Å; F153-R191 HydrophobicContact CE1-CG 3.69Å; F153-R191 HydrophobicContact CZ-CG 4.15Å; A188-R191 PolarHBondContact O-NH1 2.77Å; A188-R191 PolarHBondContact O-NH2 2.9Å; R191-V193 VanDerWaalsContact C-N 3.34Å; R191-V193 PolarHBondContact O-N 2.8Å
192	N	94.4	Very high	95.5	Very high	123 Å²	123	66.5 Å²	66.5	66%	0.658	35%	0.35	S	S	*	.	E	Extended strand (participates in β ladder)	trans	48.3	55.1	174.8	-53.2	-7.2	0	0	0	111.6	N145	N145-N192 PolarHBondContact ND2-ND2 3.42Å
193	V	96.5	Very high	95.4	Very high	20 Å²	20	70 Å²	70	12%	0.121	37%	0.37	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	127.2	178.7	-179.7	0	0	0	0	108.3	L128 Q131 L132 I142 Q143 I144 M190 R191	L128-V193 HydrophobicContact CD1-CB 3.86Å; L128-V193 HydrophobicContact CD1-CG1 4.25Å; L128-V193 HydrophobicContact CD1-CG2 3.47Å; L128-V193 VanDerWaalsContact CD1-CG2 3.47Å; Q131-V193 PolarHBondContact NE2-O 3.26Å; L132-V193 HydrophobicContact CD2-CG1 3.98Å; I142-V193 HydrophobicContact CB-CG1 4.47Å; I142-V193 HydrophobicContact CD1-CG1 4.35Å; Q143-V193 WeakPolarHBondContact O-CA 3.43Å; I144-V193 HydrophobicContact CB-CG2 4.37Å; I144-V193 HydrophobicContact CG2-CB 4.19Å; I144-V193 HydrophobicContact CG2-CG1 4.02Å; I144-V193 HydrophobicContact CG2-CG2 3.67Å; M190-V193 HydrophobicContact CB-CG2 3.97Å; R191-V193 VanDerWaalsContact C-N 3.34Å; R191-V193 PolarHBondContact O-N 2.8Å
194	E	97.5	Very high	95.2	Very high	104 Å²	104	67.2 Å²	67.2	49%	0.486	37%	0.365	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	129.4	-179.2	-175.2	-176.7	-175.3	0	0	108.7	I142 Q143 L196	I142-E194 CarbonylContact C-O 3.5Å; I142-E194 WeakPolarHBondContact CA-O 3.45Å; Q143-E194 HydrophobicContact CB-CB 4.48Å; Q143-E194 PolarHBondContact N-O 3.11Å; Q143-E194 PolarHBondContact O-N 3.15Å; E194-L196 HydrophobicContact CG-CD2 4.22Å
195	I	98.1	Very high	94.9	Very high	46 Å²	46	66.3 Å²	66.3	24%	0.236	36%	0.363	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.7	120.2	174.1	-51.9	-178.8	0	0	0	107.5	Q131 Q134 A135 N140 I142	Q131-I195 HydrophobicContact CG-CD1 3.97Å; Q131-I195 HydrophobicContact CG-CG1 4.1Å; Q131-I195 WeakPolarHBondContact O-CD1 3.44Å; Q134-I195 HydrophobicContact CB-CD1 4.2Å; Q134-I195 HydrophobicContact CG-CD1 4.06Å; A135-I195 HydrophobicContact CB-CD1 4.01Å; A135-I195 HydrophobicContact CB-CG1 4.06Å; A135-I195 HydrophobicContact CB-CG2 4.35Å; N140-I195 HydrophobicContact CB-CG2 3.53Å; I142-I195 HydrophobicContact CG2-CG1 4.32Å
196	L	98	Very high	94.6	Very high	31 Å²	31	75.6 Å²	75.6	16%	0.162	40%	0.404	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88.8	158	178.4	-52.8	-177.5	0	0	0	110.4	N140 V141 Q143 K157 E194 E198	N140-L196 WeakPolarHBondContact CB-O 3.49Å; N140-L196 PolarHBondContact ND2-O 3.25Å; V141-L196 HydrophobicContact CG1-CD1 4.05Å; V141-L196 WeakPolarHBondContact O-CB 3.21Å; V141-L196 PolarHBondContact O-N 2.71Å; Q143-L196 HydrophobicContact CB-CD1 4.2Å; Q143-L196 HydrophobicContact CB-CD2 4.11Å; Q143-L196 HydrophobicContact CB-CG 4.28Å; K157-L196 HydrophobicContact CD-CD1 4.39Å; K157-L196 HydrophobicContact CG-CD1 4.45Å; E194-L196 HydrophobicContact CG-CD2 4.22Å; L196-E198 HydrophobicContact CB-CB 4.44Å; L196-E198 PolarHBondContact O-N 3.35Å
197	S	96.7	Very high	94.3	Very high	123 Å²	123	79.3 Å²	79.3	86%	0.86	42%	0.42	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-70	-18.4	174.2	58.6	0	0	0	0	113.6	N140 S199	N140-S197 PolarHBondContact ND2-O 3.18Å; S197-S199 PolarHBondContact O-N 3.44Å
198	E	97.7	Very high	94.2	Very high	75 Å²	75	80.9 Å²	80.9	35%	0.35	43%	0.428	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-60.9	129	175.9	-172.2	-176.5	161.9	0	0	109.9	N140 V141 K157 H177 L196	N140-E198 CarbonylContact C-O 3.59Å; N140-E198 WeakPolarHBondContact CA-O 3.23Å; N140-E198 PolarHBondContact ND2-O 3.36Å; V141-E198 HydrophobicContact CB-CB 4.11Å; V141-E198 HydrophobicContact CB-CG 4.34Å; V141-E198 HydrophobicContact CG2-CB 4Å; V141-E198 HydrophobicContact CG2-CG 3.73Å; V141-E198 PolarHBondContact N-O 3.16Å; K157-E198 IonicContact NZ-OE2 2.85Å; K157-E198 PolarHBondContact NZ-OE2 3.23Å; H177-E198 IonicContact CE1-OE1 2.8Å; L196-E198 HydrophobicContact CB-CB 4.44Å; L196-E198 PolarHBondContact O-N 3.35Å
199	S	97.3	Very high	93.8	Very high	88 Å²	88	81 Å²	81	62%	0.615	42%	0.418	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-109.6	161.1	179.6	65.2	0	0	0	0	112	R139 S197	R139-S199 CarbonylContact O-C 3.59Å; R139-S199 WeakPolarHBondContact O-CA 3.49Å; R139-S199 WeakPolarHBondContact O-CB 3.42Å; S197-S199 PolarHBondContact O-N 3.44Å
200	F	97.4	Very high	93	Very high	19 Å²	19	80.2 Å²	80.2	8%	0.083	43%	0.427	C	S	.	.			trans	-135.3	149.9	-179.9	67.6	-92.1	0	0	0	113.9	R139 N140 V141 E159 P160 L161 R202	R139-F200 HydrophobicContact CB-CE1 4.3Å; R139-F200 HydrophobicContact CB-CE2 4.46Å; R139-F200 HydrophobicContact CB-CZ 4.19Å; R139-F200 WeakPolarHBondContact O-CD1 3.39Å; R139-F200 WeakPolarHBondContact O-CE1 3.31Å; R139-F200 PolarHBondContact O-N 3.49Å; N140-F200 WeakPolarHBondContact O-CE1 3.35Å; V141-F200 HydrophobicContact CG2-CD1 4.34Å; E159-F200 HydrophobicContact CB-CB 4.31Å; E159-F200 HydrophobicContact CB-CD1 3.73Å; E159-F200 HydrophobicContact CB-CD2 3.97Å; E159-F200 HydrophobicContact CB-CE1 4.04Å; E159-F200 HydrophobicContact CB-CE2 4.29Å; E159-F200 HydrophobicContact CB-CG 3.71Å; E159-F200 HydrophobicContact CB-CZ 4.32Å; E159-F200 HydrophobicContact CG-CB 3.6Å; E159-F200 HydrophobicContact CG-CD1 3.59Å; E159-F200 HydrophobicContact CG-CD2 4.2Å; E159-F200 HydrophobicContact CG-CE1 4.36Å; E159-F200 HydrophobicContact CG-CG 3.51Å; E159-F200 WeakPolarHBondContact OE2-CB 3.32Å; E159-F200 WeakPolarHBondContact OE2-CG 3.25Å; P160-F200 HydrophobicContact CG-CE1 4.2Å; P160-F200 WeakPolarHBondContact O-CZ 3.44Å; L161-F200 HydrophobicContact CD2-CD2 4.28Å; L161-F200 HydrophobicContact CD2-CE2 3.55Å; L161-F200 HydrophobicContact CD2-CZ 4.27Å; F200-R202 HydrophobicContact CD2-CB 4.21Å
201	G	96.1	Very high	91.7	Very high	72 Å²	72	87.6 Å²	87.6	74%	0.742	46%	0.461	S	S	*	.			trans	-105.2	5.3	-178.3	0	0	0	0	0	115.5
202	R	95	Very high	90.4	Very high	84 Å²	84	90 Å²	90	32%	0.317	48%	0.475	S	S	.	.	P	Polyproline II helix	trans	-61.4	143.1	-178.5	-87.1	-178.5	-108.9	-79.5	-11.5	112.3	R139 E159 L161 F200	R139-R202 PolarHBondContact NH1-O 2.96Å; E159-R202 VanDerWaalsContact CD-NE 3.34Å; E159-R202 VanDerWaalsContact CD-NH2 3.29Å; E159-R202 IonicContact OE1-CZ 3.55Å; E159-R202 IonicContact OE1-NE 3.3Å; E159-R202 IonicContact OE1-NH2 3.77Å; E159-R202 PolarHBondContact OE1-NH2 2.92Å; E159-R202 WeakPolarHBondContact OE2-CD 3.49Å; E159-R202 IonicContact OE2-CZ 2.92Å; E159-R202 VanDerWaalsContact OE2-CZ 3.3Å; E159-R202 IonicContact OE2-NE 3.65Å; E159-R202 PolarHBondContact OE2-NE 3.03Å; E159-R202 IonicContact OE2-NH2 2.76Å; E159-R202 PolarHBondContact OE2-NH2 3.23Å; L161-R202 HydrophobicContact CD2-CB 4.08Å; F200-R202 HydrophobicContact CD2-CB 4.21Å
203	E	93	Very high	89.1	Confident	162 Å²	162	89.1 Å²	89.1	76%	0.757	48%	0.476	S	S	*	.	P	Polyproline II helix	trans	-88.1	145.6	173.1	-65.6	-167.6	167.9	0	0	111.3
204	T	91	Very high	87.8	Confident	53 Å²	53	92.9 Å²	92.9	33%	0.325	50%	0.499	S	S	.	.	P	Polyproline II helix	trans	-95.4	126.8	179.9	-57.8	0	0	0	0	109.9	L161 K162	L161-T204 HydrophobicContact CB-CG2 4.08Å; L161-T204 WeakPolarHBondContact CB-OG1 3.35Å; L161-T204 WeakPolarHBondContact O-CG2 3.49Å; L161-T204 PolarHBondContact O-OG1 3.46Å; L161-T204 VanDerWaalsContact O-OG1 3.13Å; K162-T204 HydrophobicContact CB-CG2 3.87Å; K162-T204 HydrophobicContact CD-CG2 4.27Å
205	P	90	Very high	86.5	Confident	51 Å²	51	94 Å²	94	33%	0.331	51%	0.507	S	S	.	.	P	Polyproline II helix	trans	-59.2	144.3	173.8	-21.1	31.3	0	0	0	112.1	K162 Y173 I208	K162-P205 PolarHBondContact NZ-O 3.18Å; Y173-P205 HydrophobicContact CE1-CG 4.07Å; P205-I208 HydrophobicContact CB-CD1 4.09Å; P205-I208 HydrophobicContact CG-CD1 4.23Å
206	K	88.7	Confident	85.4	Confident	202 Å²	202	93.9 Å²	93.9	88%	0.878	51%	0.509	S	S	*	.	S	Bend	trans	-59	-51	179.1	-71.4	-173.4	178.4	-179.1	0	111.5	K162	K162-K206 PolarHBondContact NZ-O 3.1Å
207	K	87.5	Confident	84.4	Confident	144 Å²	144	102.5 Å²	102.5	63%	0.626	55%	0.548	S	S	*	.			trans	-112.6	133.8	175	-71	-174.2	175.4	177.9	0	110.3	E211	K207-E211 IonicContact NZ-OE1 2.69Å; K207-E211 PolarHBondContact NZ-OE1 2.62Å
208	I	89.3	Confident	84.1	Confident	38 Å²	38	102.9 Å²	102.9	20%	0.195	54%	0.535	C	S	.	.	S	Bend	trans	-97.4	-41.1	177.4	-57.7	-53.8	0	0	0	111.4	K162 V164 Y173 L184 P205	K162-I208 HydrophobicContact CD-CD1 4.43Å; K162-I208 HydrophobicContact CD-CG1 3.82Å; V164-I208 HydrophobicContact CG1-CB 4.28Å; V164-I208 HydrophobicContact CG1-CG1 4.02Å; Y173-I208 HydrophobicContact CD1-CD1 3.39Å; Y173-I208 HydrophobicContact CD1-CG1 4.24Å; Y173-I208 HydrophobicContact CD2-CD1 4.08Å; Y173-I208 HydrophobicContact CD2-CG2 3.56Å; Y173-I208 HydrophobicContact CE1-CD1 3.51Å; Y173-I208 HydrophobicContact CE2-CD1 4.16Å; Y173-I208 HydrophobicContact CE2-CG2 4.02Å; Y173-I208 HydrophobicContact CG-CD1 3.68Å; Y173-I208 HydrophobicContact CG-CG1 4.11Å; Y173-I208 HydrophobicContact CG-CG2 3.94Å; L184-I208 HydrophobicContact CD2-CG2 4.01Å; P205-I208 HydrophobicContact CB-CD1 4.09Å; P205-I208 HydrophobicContact CG-CD1 4.23Å
209	F	84.2	Confident	83.9	Confident	56 Å²	56	103.6 Å²	103.6	25%	0.246	54%	0.538	C	S	.	.	S	Bend	trans	-93.3	141.9	177.3	-59.7	-58.5	0	0	0	110.6	V164 R166 L184	V164-F209 HydrophobicContact CB-CE2 3.72Å; V164-F209 HydrophobicContact CB-CZ 4.18Å; V164-F209 HydrophobicContact CG1-CE2 4.46Å; V164-F209 HydrophobicContact CG2-CE2 3.56Å; V164-F209 HydrophobicContact CG2-CZ 3.48Å; V164-F209 VanDerWaalsContact CG2-CZ 3.48Å; R166-F209 HydrophobicContact CB-CE1 4.5Å; R166-F209 HydrophobicContact CB-CE2 3.8Å; R166-F209 HydrophobicContact CB-CZ 3.72Å; R166-F209 HydrophobicContact CG-CE2 4.4Å; R166-F209 HydrophobicContact CG-CZ 4.3Å; R166-F209 VanDerWaalsContact NH1-CD1 3.29Å; L184-F209 HydrophobicContact CD1-CD1 4.36Å; L184-F209 HydrophobicContact CD1-CE1 3.5Å; L184-F209 VanDerWaalsContact CD1-CE1 3.5Å; L184-F209 HydrophobicContact CD1-CZ 4.18Å; L184-F209 HydrophobicContact CD2-CZ 4.49Å
210	S	75.6	Confident	83.8	Confident	73 Å²	73	100.3 Å²	100.3	51%	0.51	51%	0.514	S	S	.	.			trans	-69.1	144.3	162.6	56.1	0	0	0	0	109.8	K212	S210-K212 PolarHBondContact O-N 3.44Å; S210-K212 PolarHBondContact OG-O 3.49Å
211	E	68.1	Low	83.7	Confident	159 Å²	159	105.2 Å²	105.2	74%	0.743	54%	0.537	S	S	*	.	S	Bend	trans	-67.2	-26.2	169.3	-71.3	171	-170	0	0	111.5	K207	K207-E211 IonicContact NZ-OE1 2.69Å; K207-E211 PolarHBondContact NZ-OE1 2.62Å
212	K	66.9	Low	83.8	Confident	167 Å²	167	101.8 Å²	101.8	73%	0.726	50%	0.502	S	S	*	.	S	Bend	trans	-70.8	133.9	173.6	-65.3	-173.1	179.8	-177.7	0	110.1	S210 T214	S210-K212 PolarHBondContact O-N 3.44Å; S210-K212 PolarHBondContact OG-O 3.49Å; K212-T214 PolarHBondContact O-N 2.9Å
213	P	67.8	Low	83.8	Confident	105 Å²	105	98.7 Å²	98.7	68%	0.682	49%	0.492	S	S	*	.			trans	-52	140.3	170.3	-23.3	32.1	0	0	0	110.5	I215	P213-I215 PolarHBondContact O-N 3.45Å; P213-I215 VanDerWaalsContact O-N 3.1Å
214	T	68.3	Low	84	Confident	99 Å²	99	91 Å²	91	61%	0.607	46%	0.456	S	S	*	.			trans	-73.4	104.8	169.2	-51.2	0	0	0	0	106.9	K212 P216	K212-T214 PolarHBondContact O-N 2.9Å; T214-P216 WeakPolarHBondContact O-CD 3.26Å
215	I	69.6	Low	84.3	Confident	127 Å²	127	88.9 Å²	88.9	65%	0.651	44%	0.443	S	S	*	.			trans	-78	117.5	178.6	-62.7	-180	0	0	0	107	P213	P213-I215 PolarHBondContact O-N 3.45Å; P213-I215 VanDerWaalsContact O-N 3.1Å
216	P	75.2	Confident	84.6	Confident	44 Å²	44	86.5 Å²	86.5	29%	0.286	43%	0.428	S	S	.	.			trans	-56.5	140.1	172.9	-21	29.1	0	0	0	110.5	T214 K218 Q219 P256	T214-P216 WeakPolarHBondContact O-CD 3.26Å; P216-K218 PolarHBondContact O-N 2.78Å; P216-Q219 HydrophobicContact CB-CG 4.2Å; P216-Q219 HydrophobicContact CG-CG 4.45Å; P216-Q219 PolarHBondContact O-NE2 3.45Å; P216-P256 HydrophobicContact CB-CB 3.9Å; P216-P256 HydrophobicContact CB-CG 4.27Å; P216-P256 HydrophobicContact CG-CB 3.78Å; P216-P256 HydrophobicContact CG-CG 3.58Å
217	E	78.1	Confident	84.9	Confident	211 Å²	211	80.1 Å²	80.1	99%	0.986	40%	0.403	S	S	*	.	S	Bend	trans	-58	-37	177.9	-69.9	179.8	175.4	0	0	112.1
218	K	89.8	Confident	85.1	Confident	132 Å²	132	77.1 Å²	77.1	57%	0.574	40%	0.399	S	S	*	.	S	Bend	trans	-118.8	125.1	177.4	-159.3	-173.8	-174.7	-159.2	0	110.2	P216 D257	P216-K218 PolarHBondContact O-N 2.78Å; K218-D257 HydrophobicContact CB-CB 4.45Å; K218-D257 HydrophobicContact CD-CB 3.96Å; K218-D257 WeakPolarHBondContact CD-OD2 3.45Å; K218-D257 WeakPolarHBondContact CE-OD2 3.45Å; K218-D257 HydrophobicContact CG-CB 3.97Å; K218-D257 IonicContact NZ-OD2 3.85Å; K218-D257 PolarHBondContact NZ-OD2 3.29Å; K218-D257 PolarHBondContact O-N 3.31Å
219	Q	93.1	Very high	85.3	Confident	90 Å²	90	78.6 Å²	78.6	42%	0.421	42%	0.417	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.7	159.3	179.3	-62.2	-177.2	8.1	0	0	110.8	P216 T254 L255	P216-Q219 HydrophobicContact CB-CG 4.2Å; P216-Q219 HydrophobicContact CG-CG 4.45Å; P216-Q219 PolarHBondContact O-NE2 3.45Å; Q219-T254 HydrophobicContact CB-CG2 3.81Å; Q219-T254 HydrophobicContact CG-CG2 4.39Å; Q219-L255 CarbonylContact C-O 3.52Å; Q219-L255 VanDerWaalsContact CA-O 3.31Å; Q219-L255 WeakPolarHBondContact CA-O 3.41Å
220	V	94.8	Very high	85.7	Confident	18 Å²	18	75.9 Å²	75.9	11%	0.109	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.3	127.9	172	57.9	0	0	0	0	107.9	L222 T254 L255 D257 P277 F280	V220-L222 HydrophobicContact CG1-CD1 4.28Å; V220-L222 HydrophobicContact CG1-CD2 4.09Å; V220-L222 HydrophobicContact CG1-CG 4.07Å; V220-L222 HydrophobicContact CG2-CD2 3.74Å; V220-L222 HydrophobicContact CG2-CG 4.25Å; V220-T254 WeakPolarHBondContact O-CA 3.36Å; V220-L255 PolarHBondContact N-O 3.04Å; V220-L255 PolarHBondContact O-N 3.49Å; V220-D257 HydrophobicContact CB-CB 4.09Å; V220-D257 HydrophobicContact CG1-CB 3.95Å; V220-P277 HydrophobicContact CG2-CG 3.84Å; V220-F280 HydrophobicContact CB-CD2 4.42Å; V220-F280 HydrophobicContact CG1-CD2 3.84Å; V220-F280 HydrophobicContact CG1-CE2 3.8Å; V220-F280 HydrophobicContact CG2-CB 4.5Å; V220-F280 HydrophobicContact CG2-CD2 4.06Å
221	E	96.4	Very high	86.4	Confident	122 Å²	122	73.8 Å²	73.8	57%	0.57	39%	0.393	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-78.8	129.4	165.9	-174.5	175.2	88.2	0	0	108	V252 V253 P277	E221-V252 HydrophobicContact CG-CG1 3.85Å; E221-V253 CarbonylContact C-O 3.52Å; E221-V253 WeakPolarHBondContact CA-O 3.41Å; E221-P277 WeakPolarHBondContact O-CD 3.09Å
222	L	96.6	Very high	87.5	Confident	0 Å²	0	73.8 Å²	73.8	0%	0	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.1	131.2	-175.6	-62.6	171.3	0	0	0	109.5	V220 L224 V252 V253 L255 T261 L265 I274 E276 F280	V220-L222 HydrophobicContact CG1-CD1 4.28Å; V220-L222 HydrophobicContact CG1-CD2 4.09Å; V220-L222 HydrophobicContact CG1-CG 4.07Å; V220-L222 HydrophobicContact CG2-CD2 3.74Å; V220-L222 HydrophobicContact CG2-CG 4.25Å; L222-L224 HydrophobicContact CB-CD2 3.87Å; L222-L224 HydrophobicContact CB-CG 4.14Å; L222-L224 HydrophobicContact CD1-CD2 4.42Å; L222-V252 WeakPolarHBondContact O-CA 3.26Å; L222-V253 HydrophobicContact CB-CG1 4.26Å; L222-V253 PolarHBondContact N-O 3.09Å; L222-V253 PolarHBondContact O-N 3.38Å; L222-L255 HydrophobicContact CD1-CB 4.41Å; L222-L255 HydrophobicContact CD1-CD1 4.06Å; L222-T261 HydrophobicContact CD1-CG2 3.98Å; L222-L265 HydrophobicContact CD1-CD1 3.89Å; L222-I274 HydrophobicContact CD2-CG2 4.39Å; L222-E276 WeakPolarHBondContact CA-O 3.13Å; L222-F280 HydrophobicContact CD1-CE1 4.48Å; L222-F280 HydrophobicContact CD2-CB 3.86Å; L222-F280 HydrophobicContact CD2-CD1 3.74Å; L222-F280 HydrophobicContact CD2-CD2 4.02Å; L222-F280 HydrophobicContact CD2-CE1 4.29Å; L222-F280 HydrophobicContact CD2-CG 3.59Å
223	T	96.8	Very high	88.7	Confident	19 Å²	19	67.8 Å²	67.8	12%	0.117	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-96.8	112.6	165.3	-57.3	0	0	0	0	107.6	I250 V252 L275 E276	T223-I250 HydrophobicContact CG2-CG2 3.97Å; T223-V252 HydrophobicContact CG2-CG2 4.38Å; T223-L275 HydrophobicContact CG2-CB 4.1Å; T223-L275 HydrophobicContact CG2-CD1 4.21Å; T223-L275 PolarHBondContact O-N 2.95Å; T223-E276 PolarHBondContact N-O 2.68Å; T223-E276 VanDerWaalsContact N-O 3.09Å; T223-E276 PolarHBondContact O-N 3.01Å; T223-E276 PolarHBondContact OG1-OE2 2.91Å
224	L	96.7	Very high	89.9	Confident	0 Å²	0	62.8 Å²	62.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-109	135	-175.1	-56.4	-179.7	0	0	0	109.4	L222 F226 F238 I250 A251 V253 L265 L272 I274	L222-L224 HydrophobicContact CB-CD2 3.87Å; L222-L224 HydrophobicContact CB-CG 4.14Å; L222-L224 HydrophobicContact CD1-CD2 4.42Å; L224-F226 HydrophobicContact CB-CD2 4.31Å; L224-F226 HydrophobicContact CB-CE2 3.51Å; L224-F226 HydrophobicContact CB-CZ 3.81Å; L224-F226 HydrophobicContact CD1-CE2 4.2Å; L224-F226 HydrophobicContact CD1-CZ 3.81Å; L224-F226 HydrophobicContact CG-CZ 4.46Å; L224-F238 HydrophobicContact CD1-CE1 4.32Å; L224-F238 HydrophobicContact CD1-CZ 4.08Å; L224-I250 CarbonylContact O-C 3.57Å; L224-I250 VanDerWaalsContact O-CA 3.26Å; L224-I250 WeakPolarHBondContact O-CA 3.34Å; L224-A251 PolarHBondContact N-O 3.19Å; L224-A251 PolarHBondContact O-N 3.47Å; L224-V253 HydrophobicContact CD1-CG1 3.72Å; L224-V253 HydrophobicContact CG-CG1 4.32Å; L224-L265 HydrophobicContact CD1-CD2 3.77Å; L224-L265 HydrophobicContact CD2-CD2 4.1Å; L224-L272 HydrophobicContact CB-CD1 3.76Å; L224-L272 HydrophobicContact CD1-CD1 4.42Å; L224-L272 HydrophobicContact CD2-CD1 4Å; L224-L272 HydrophobicContact CG-CD1 4.27Å; L224-I274 HydrophobicContact CD2-CG1 4.02Å; L224-I274 HydrophobicContact CD2-CG2 4.44Å
225	L	96.4	Very high	90.8	Very high	10 Å²	10	63.7 Å²	63.7	5%	0.052	32%	0.324	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-114	128.3	174	-178.9	70.8	0	0	0	108.7	R248 L249 I250 E273 L275	L225-R248 HydrophobicContact CD1-CB 3.8Å; L225-R248 HydrophobicContact CG-CB 4.46Å; L225-L249 CarbonylContact C-O 3.58Å; L225-L249 WeakPolarHBondContact CA-O 3.35Å; L225-I250 HydrophobicContact CD1-CD1 4.19Å; L225-I250 HydrophobicContact CD1-CG1 3.49Å; L225-I250 VanDerWaalsContact CD1-CG1 3.49Å; L225-E273 HydrophobicContact CB-CB 4.35Å; L225-E273 PolarHBondContact N-O 3.16Å; L225-E273 PolarHBondContact O-N 3.1Å; L225-L275 HydrophobicContact CB-CD1 3.86Å; L225-L275 HydrophobicContact CB-CD2 4.17Å; L225-L275 HydrophobicContact CB-CG 3.87Å; L225-L275 HydrophobicContact CD2-CD1 4.36Å; L225-L275 HydrophobicContact CD2-CD2 4.18Å
226	F	96.8	Very high	91.7	Very high	0 Å²	0	64.8 Å²	64.8	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	144.5	-177.7	-59	-90.9	0	0	0	111.1	L224 A230 V234 F238 R248 L249 A251 F268 Q271 L272	L224-F226 HydrophobicContact CB-CD2 4.31Å; L224-F226 HydrophobicContact CB-CE2 3.51Å; L224-F226 HydrophobicContact CB-CZ 3.81Å; L224-F226 HydrophobicContact CD1-CE2 4.2Å; L224-F226 HydrophobicContact CD1-CZ 3.81Å; L224-F226 HydrophobicContact CG-CZ 4.46Å; F226-A230 HydrophobicContact CB-CB 4.39Å; F226-V234 HydrophobicContact CB-CG2 3.75Å; F226-V234 HydrophobicContact CD1-CG2 3.51Å; F226-V234 HydrophobicContact CD2-CG1 4.01Å; F226-V234 HydrophobicContact CD2-CG2 3.71Å; F226-V234 HydrophobicContact CE1-CG2 3.91Å; F226-V234 HydrophobicContact CE2-CG1 4.26Å; F226-V234 HydrophobicContact CE2-CG2 4.1Å; F226-V234 HydrophobicContact CG-CG1 4.47Å; F226-V234 HydrophobicContact CG-CG2 3.38Å; F226-V234 HydrophobicContact CZ-CG2 4.19Å; F226-F238 HydrophobicContact CE1-CE2 4.32Å; F226-F238 HydrophobicContact CE2-CD2 4.35Å; F226-F238 AromaticContact CE2-CE2 3.95Å; F226-F238 HydrophobicContact CE2-CE2 3.95Å; F226-F238 HydrophobicContact CE2-CZ 4.48Å; F226-F238 HydrophobicContact CZ-CD2 4.3Å; F226-F238 AromaticContact CZ-CE2 3.48Å; F226-F238 HydrophobicContact CZ-CE2 3.48Å; F226-F238 VanDerWaalsContact CZ-CE2 3.48Å; F226-F238 AromaticContact CZ-CZ 3.89Å; F226-F238 HydrophobicContact CZ-CZ 3.89Å; F226-R248 CarbonylContact O-C 3.59Å; F226-R248 WeakPolarHBondContact O-CA 3.46Å; F226-R248 WeakPolarHBondContact O-CB 3.49Å; F226-L249 HydrophobicContact CB-CB 4.31Å; F226-L249 PolarHBondContact N-O 3Å; F226-L249 PolarHBondContact O-N 2.56Å; F226-A251 HydrophobicContact CE2-CB 4Å; F226-F268 HydrophobicContact CD1-CD1 4.07Å; F226-F268 HydrophobicContact CD1-CE1 4.37Å; F226-F268 AromaticContact CE1-CD1 3.64Å; F226-F268 HydrophobicContact CE1-CD1 3.64Å; F226-F268 HydrophobicContact CE1-CD2 4.32Å; F226-F268 AromaticContact CE1-CE1 3.71Å; F226-F268 HydrophobicContact CE1-CE1 3.71Å; F226-F268 HydrophobicContact CE1-CE2 4.39Å; F226-F268 AromaticContact CE1-CG 3.95Å; F226-F268 HydrophobicContact CE1-CG 3.95Å; F226-F268 HydrophobicContact CE1-CZ 4.1Å; F226-F268 HydrophobicContact CZ-CE1 4.45Å; F226-Q271 VanDerWaalsContact CA-O 3.28Å; F226-Q271 WeakPolarHBondContact CA-O 3.17Å; F226-L272 HydrophobicContact CD1-CB 4.06Å; F226-L272 HydrophobicContact CD1-CD1 3.76Å; F226-L272 HydrophobicContact CD1-CG 4.45Å; F226-L272 HydrophobicContact CE1-CB 4.09Å; F226-L272 HydrophobicContact CE1-CD1 3.38Å; F226-L272 HydrophobicContact CE1-CD2 4.39Å; F226-L272 HydrophobicContact CE1-CG 4.12Å; F226-L272 HydrophobicContact CE2-CD1 4.23Å; F226-L272 HydrophobicContact CG-CD1 4.34Å; F226-L272 HydrophobicContact CZ-CD1 3.65Å
227	D	94.9	Very high	92.4	Very high	69 Å²	69	66.4 Å²	66.4	37%	0.369	33%	0.331	S	S	.	.			trans	-69	152.2	169	-66.7	-26.9	0	0	0	111	A229 A230 Q271	D227-A229 PolarHBondContact O-N 3.16Å; D227-A229 VanDerWaalsContact O-N 3.1Å; D227-A230 PolarHBondContact O-N 2.94Å; D227-Q271 HydrophobicContact CB-CB 4.41Å; D227-Q271 PolarHBondContact N-O 2.93Å
228	C	92.5	Very high	93	Very high	80 Å²	80	57.1 Å²	57.1	54%	0.541	29%	0.287	S	S	.	.	G	3₁₀ helix	trans	-56.8	-28.5	177.4	-175.9	0	0	0	0	112.2	A230 A231	C228-A230 PolarHBondContact O-N 3.27Å; C228-A230 VanDerWaalsContact O-N 3.17Å; C228-A231 WeakPolarHBondContact O-CB 3.26Å; C228-A231 PolarHBondContact O-N 2.88Å
229	A	92.4	Very high	92.7	Very high	69 Å²	69	60.3 Å²	60.3	57%	0.57	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-61.1	-22.5	174.8	0	0	0	0	0	114.2	D227	D227-A229 PolarHBondContact O-N 3.16Å; D227-A229 VanDerWaalsContact O-N 3.1Å
230	A	92.3	Very high	92.3	Very high	0 Å²	0	62.4 Å²	62.4	0%	0	32%	0.315	C	S	.	.	G	3₁₀ helix	trans	-92.5	1.4	176.2	0	0	0	0	0	113.4	F226 D227 C228 Y232 R233 V234 Q271	F226-A230 HydrophobicContact CB-CB 4.39Å; D227-A230 PolarHBondContact O-N 2.94Å; C228-A230 PolarHBondContact O-N 3.27Å; C228-A230 VanDerWaalsContact O-N 3.17Å; A230-Y232 VanDerWaalsContact C-N 3.3Å; A230-Y232 PolarHBondContact O-N 3.42Å; A230-Y232 VanDerWaalsContact O-N 3.16Å; A230-R233 PolarHBondContact O-N 3.21Å; A230-R233 VanDerWaalsContact O-N 3.09Å; A230-V234 HydrophobicContact CB-CG2 4.08Å; A230-V234 WeakPolarHBondContact O-CG2 3.48Å; A230-V234 PolarHBondContact O-N 3.09Å; A230-Q271 HydrophobicContact CB-CB 4.01Å
231	A	90.6	Very high	92.1	Very high	29 Å²	29	62.9 Å²	62.9	24%	0.24	32%	0.318	C	S	.	.	H	α-helix	trans	-53.5	-42.1	-169.1	0	0	0	0	0	113.9	C228 R233 V234 Q235 L249	C228-A231 WeakPolarHBondContact O-CB 3.26Å; C228-A231 PolarHBondContact O-N 2.88Å; A231-R233 VanDerWaalsContact C-N 3.34Å; A231-R233 PolarHBondContact O-N 3.36Å; A231-V234 PolarHBondContact O-N 2.98Å; A231-Q235 WeakPolarHBondContact O-CB 3.32Å; A231-Q235 WeakPolarHBondContact O-CG 3.08Å; A231-Q235 PolarHBondContact O-N 3.32Å; A231-L249 HydrophobicContact CB-CD1 3.64Å
232	Y	91.1	Very high	91.9	Very high	159 Å²	159	66.1 Å²	66.1	62%	0.624	33%	0.325	S	S	*	.	H	α-helix	trans	-56.5	-48.9	180	78.9	-84.6	0	0	0	111.5	A230 Q235 E236	A230-Y232 VanDerWaalsContact C-N 3.3Å; A230-Y232 PolarHBondContact O-N 3.42Å; A230-Y232 VanDerWaalsContact O-N 3.16Å; Y232-Q235 PolarHBondContact O-N 3.49Å; Y232-E236 WeakPolarHBondContact O-CG 3.47Å; Y232-E236 PolarHBondContact O-N 3.14Å
233	R	93.3	Very high	91.6	Very high	41 Å²	41	72.1 Å²	72.1	16%	0.155	35%	0.353	C	S	.	.	H	α-helix	trans	-73	-37.4	-177.3	-172.9	177.2	170.6	-160.6	-9.7	111.8	A230 A231 Q235 E236 E237 S267 F268	A230-R233 PolarHBondContact O-N 3.21Å; A230-R233 VanDerWaalsContact O-N 3.09Å; A231-R233 VanDerWaalsContact C-N 3.34Å; A231-R233 PolarHBondContact O-N 3.36Å; R233-Q235 VanDerWaalsContact C-N 3.33Å; R233-E236 PolarHBondContact O-N 3.47Å; R233-E237 HydrophobicContact CG-CG 4.36Å; R233-E237 WeakPolarHBondContact CG-OE1 3.41Å; R233-E237 IonicContact CZ-OE1 2.97Å; R233-E237 IonicContact NE-OE1 3.84Å; R233-E237 PolarHBondContact NE-OE1 3.22Å; R233-E237 IonicContact NE-OE2 2.72Å; R233-E237 IonicContact NH2-OE1 2.73Å; R233-E237 PolarHBondContact NH2-OE1 3.08Å; R233-E237 IonicContact NH2-OE2 3.2Å; R233-E237 WeakPolarHBondContact O-CB 3.44Å; R233-E237 WeakPolarHBondContact O-CG 3.34Å; R233-E237 PolarHBondContact O-N 3.28Å; R233-S267 VanDerWaalsContact NH1-C 3.26Å; R233-S267 PolarHBondContact NH1-O 3.3Å; R233-S267 PolarHBondContact NH1-OG 3.44Å; R233-S267 PolarHBondContact NH2-OG 2.99Å; R233-F268 HydrophobicContact CB-CE1 4.42Å; R233-F268 HydrophobicContact CG-CE1 3.82Å; R233-F268 HydrophobicContact CG-CZ 4.4Å
234	V	91.8	Very high	91.1	Very high	0 Å²	0	74.2 Å²	74.2	0%	0	36%	0.363	C	S	.	.	H	α-helix	trans	-62.5	-43.2	177.5	173.5	0	0	0	0	110.4	F226 A230 A231 E236 E237 F238 V241 L249 F268	F226-V234 HydrophobicContact CB-CG2 3.75Å; F226-V234 HydrophobicContact CD1-CG2 3.51Å; F226-V234 HydrophobicContact CD2-CG1 4.01Å; F226-V234 HydrophobicContact CD2-CG2 3.71Å; F226-V234 HydrophobicContact CE1-CG2 3.91Å; F226-V234 HydrophobicContact CE2-CG1 4.26Å; F226-V234 HydrophobicContact CE2-CG2 4.1Å; F226-V234 HydrophobicContact CG-CG1 4.47Å; F226-V234 HydrophobicContact CG-CG2 3.38Å; F226-V234 HydrophobicContact CZ-CG2 4.19Å; A230-V234 HydrophobicContact CB-CG2 4.08Å; A230-V234 WeakPolarHBondContact O-CG2 3.48Å; A230-V234 PolarHBondContact O-N 3.09Å; A231-V234 PolarHBondContact O-N 2.98Å; V234-E236 VanDerWaalsContact C-N 3.32Å; V234-E236 PolarHBondContact O-N 3.05Å; V234-E237 PolarHBondContact O-N 2.98Å; V234-F238 HydrophobicContact CB-CD2 4.39Å; V234-F238 HydrophobicContact CG1-CD2 3.94Å; V234-F238 WeakPolarHBondContact O-CB 3.38Å; V234-F238 WeakPolarHBondContact O-CD2 3.48Å; V234-F238 PolarHBondContact O-N 3.36Å; V234-V241 HydrophobicContact CG1-CB 4.44Å; V234-V241 HydrophobicContact CG1-CG1 3.77Å; V234-V241 HydrophobicContact CG1-CG2 3.75Å; V234-L249 HydrophobicContact CB-CD1 4.22Å; V234-L249 HydrophobicContact CG1-CB 4.32Å; V234-L249 HydrophobicContact CG1-CD1 4.08Å; V234-F268 HydrophobicContact CG2-CE1 4.46Å
235	Q	87.9	Confident	90.3	Very high	117 Å²	117	83.5 Å²	83.5	55%	0.547	40%	0.404	S	S	.	.	H	α-helix	trans	-68.4	-29.3	177.4	-66.7	-72.3	-20.1	0	0	112.8	A231 Y232 R233	A231-Q235 WeakPolarHBondContact O-CB 3.32Å; A231-Q235 WeakPolarHBondContact O-CG 3.08Å; A231-Q235 PolarHBondContact O-N 3.32Å; Y232-Q235 PolarHBondContact O-N 3.49Å; R233-Q235 VanDerWaalsContact C-N 3.33Å
236	E	87.9	Confident	89.9	Confident	151 Å²	151	87.8 Å²	87.8	71%	0.706	43%	0.427	S	S	*	.	H	α-helix	trans	-73.5	-35.7	174.4	-75.4	179.1	178.8	0	0	113.1	Y232 R233 V234	Y232-E236 WeakPolarHBondContact O-CG 3.47Å; Y232-E236 PolarHBondContact O-N 3.14Å; R233-E236 PolarHBondContact O-N 3.47Å; V234-E236 VanDerWaalsContact C-N 3.32Å; V234-E236 PolarHBondContact O-N 3.05Å
237	E	89.7	Confident	89.4	Confident	78 Å²	78	92.2 Å²	92.2	36%	0.364	45%	0.45	S	S	.	.	H	α-helix	trans	-98.7	-23.1	-169.9	-65.6	-171.1	-164	0	0	113.8	R233 V234 Y264 F268	R233-E237 HydrophobicContact CG-CG 4.36Å; R233-E237 WeakPolarHBondContact CG-OE1 3.41Å; R233-E237 IonicContact CZ-OE1 2.97Å; R233-E237 IonicContact NE-OE1 3.84Å; R233-E237 PolarHBondContact NE-OE1 3.22Å; R233-E237 IonicContact NE-OE2 2.72Å; R233-E237 IonicContact NH2-OE1 2.73Å; R233-E237 PolarHBondContact NH2-OE1 3.08Å; R233-E237 IonicContact NH2-OE2 3.2Å; R233-E237 WeakPolarHBondContact O-CB 3.44Å; R233-E237 WeakPolarHBondContact O-CG 3.34Å; R233-E237 PolarHBondContact O-N 3.28Å; V234-E237 PolarHBondContact O-N 2.98Å; E237-Y264 WeakPolarHBondContact OE2-CE2 3.48Å; E237-Y264 PolarHBondContact OE2-OH 2.54Å; E237-F268 WeakPolarHBondContact OE2-CZ 3.34Å
238	F	91.9	Very high	89.4	Confident	16 Å²	16	92.5 Å²	92.5	7%	0.07	45%	0.446	C	S	.	.			trans	-125.7	139.6	-176.2	-53.4	-76.2	0	0	0	111.9	L224 F226 V234 V241 A251 V253 Y264 F268	L224-F238 HydrophobicContact CD1-CE1 4.32Å; L224-F238 HydrophobicContact CD1-CZ 4.08Å; F226-F238 HydrophobicContact CE1-CE2 4.32Å; F226-F238 HydrophobicContact CE2-CD2 4.35Å; F226-F238 AromaticContact CE2-CE2 3.95Å; F226-F238 HydrophobicContact CE2-CE2 3.95Å; F226-F238 HydrophobicContact CE2-CZ 4.48Å; F226-F238 HydrophobicContact CZ-CD2 4.3Å; F226-F238 AromaticContact CZ-CE2 3.48Å; F226-F238 HydrophobicContact CZ-CE2 3.48Å; F226-F238 VanDerWaalsContact CZ-CE2 3.48Å; F226-F238 AromaticContact CZ-CZ 3.89Å; F226-F238 HydrophobicContact CZ-CZ 3.89Å; V234-F238 HydrophobicContact CB-CD2 4.39Å; V234-F238 HydrophobicContact CG1-CD2 3.94Å; V234-F238 WeakPolarHBondContact O-CB 3.38Å; V234-F238 WeakPolarHBondContact O-CD2 3.48Å; V234-F238 PolarHBondContact O-N 3.36Å; F238-V241 HydrophobicContact CB-CG2 3.62Å; F238-A251 HydrophobicContact CB-CB 4.12Å; F238-A251 HydrophobicContact CD1-CB 4.2Å; F238-A251 HydrophobicContact CD2-CB 4.28Å; F238-A251 HydrophobicContact CG-CB 3.93Å; F238-V253 HydrophobicContact CD1-CB 4.17Å; F238-V253 HydrophobicContact CD1-CG2 4.23Å; F238-V253 HydrophobicContact CE1-CB 4.05Å; F238-V253 HydrophobicContact CE1-CG1 3.93Å; F238-V253 HydrophobicContact CE1-CG2 4.08Å; F238-Y264 HydrophobicContact CZ-CE1 4.49Å; F238-Y264 VanDerWaalsContact CZ-OH 3.3Å; F238-Y264 WeakPolarHBondContact CZ-OH 3.43Å; F238-F268 AromaticContact CE2-CZ 3.97Å; F238-F268 HydrophobicContact CE2-CZ 3.97Å; F238-F268 HydrophobicContact CZ-CZ 4.29Å
239	K	83.4	Confident	89.5	Confident	199 Å²	199	89.2 Å²	89.2	87%	0.865	42%	0.423	S	S	*	.	S	Bend	trans	-87.2	-44.3	-179	-67.2	-173.7	177.2	-175.2	0	113.6	V241	K239-V241 PolarHBondContact O-N 2.78Å
240	D	84.5	Confident	89.7	Confident	134 Å²	134	87.9 Å²	87.9	72%	0.717	41%	0.406	S	S	*	.	S	Bend	trans	-103.5	62.6	-170.5	-61.5	-52.6	0	0	0	111.4
241	V	90.7	Very high	89.9	Confident	28 Å²	28	88 Å²	88	17%	0.17	41%	0.407	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	126.1	-178.6	-174.9	0	0	0	0	109.9	V234 F238 K239 L249 I250 A251	V234-V241 HydrophobicContact CG1-CB 4.44Å; V234-V241 HydrophobicContact CG1-CG1 3.77Å; V234-V241 HydrophobicContact CG1-CG2 3.75Å; F238-V241 HydrophobicContact CB-CG2 3.62Å; K239-V241 PolarHBondContact O-N 2.78Å; V241-L249 HydrophobicContact CG1-CB 3.72Å; V241-L249 HydrophobicContact CG1-CD1 4.29Å; V241-L249 HydrophobicContact CG1-CD2 4.05Å; V241-L249 HydrophobicContact CG1-CG 4.24Å; V241-I250 WeakPolarHBondContact CA-O 3.19Å; V241-A251 HydrophobicContact CG2-CB 4.46Å
242	R	92.3	Very high	90.1	Very high	190 Å²	190	90 Å²	90	72%	0.717	42%	0.416	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-107.6	138.1	176.3	-61.6	179.5	-176.4	159.5	2.6	110	L249 I250	R242-L249 CarbonylContact O-C 3.54Å; R242-L249 WeakPolarHBondContact O-CA 3.14Å; R242-I250 PolarHBondContact N-O 3.38Å; R242-I250 PolarHBondContact O-N 3.27Å
243	Q	90	Very high	90.2	Very high	125 Å²	125	83.8 Å²	83.8	58%	0.584	40%	0.395	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-88.9	131.4	172.2	-170.6	169.3	-9.1	0	0	109.8	D247 L249	Q243-D247 PolarHBondContact NE2-OD1 3.3Å; Q243-L249 HydrophobicContact CB-CD2 4.1Å; Q243-L249 HydrophobicContact CG-CD2 4.23Å
244	N	86	Confident	90.2	Very high	63 Å²	63	85.2 Å²	85.2	34%	0.337	41%	0.408	S	S	.	.			trans	-85.3	172.1	172.2	-163.9	9.2	0	0	0	110.4	D246 D247 R248 I250	N244-D246 PolarHBondContact O-N 3.43Å; N244-D246 VanDerWaalsContact O-N 3.12Å; N244-D247 PolarHBondContact O-N 2.48Å; N244-D247 VanDerWaalsContact O-N 3.12Å; N244-R248 PolarHBondContact N-O 2.81Å; N244-I250 HydrophobicContact CB-CD1 4.14Å
245	K	80.5	Confident	90.3	Very high	195 Å²	195	86.6 Å²	86.6	85%	0.848	42%	0.415	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59	-23.9	-178	-64.8	-176.8	179.1	-179.8	0	114.6
246	D	86.7	Confident	90.5	Very high	101 Å²	101	82.6 Å²	82.6	54%	0.54	40%	0.4	S	S	.	.	T	Hydrogen-bonded Turn	trans	-95.8	19.9	-179.8	-48.7	-32.8	0	0	0	112.8	N244 R248	N244-D246 PolarHBondContact O-N 3.43Å; N244-D246 VanDerWaalsContact O-N 3.12Å; D246-R248 PolarHBondContact O-N 2.8Å; D246-R248 IonicContact OD2-CZ 3.62Å; D246-R248 IonicContact OD2-NE 3.51Å; D246-R248 IonicContact OD2-NH2 2.8Å; D246-R248 PolarHBondContact OD2-NH2 3.04Å
247	D	87.9	Confident	90.7	Very high	93 Å²	93	77 Å²	77	50%	0.497	38%	0.375	S	S	.	.	S	Bend	trans	61.9	5.2	-174.1	-60.5	-34.6	0	0	0	116.3	Q243 N244	Q243-D247 PolarHBondContact NE2-OD1 3.3Å; N244-D247 PolarHBondContact O-N 2.48Å; N244-D247 VanDerWaalsContact O-N 3.12Å
248	R	93.9	Very high	90.7	Very high	75 Å²	75	76.6 Å²	76.6	28%	0.283	38%	0.375	S	S	.	.			trans	-74	149.8	170.2	-69	-174.2	-70.6	171.9	-1.7	111.4	L225 F226 N244 D246	L225-R248 HydrophobicContact CD1-CB 3.8Å; L225-R248 HydrophobicContact CG-CB 4.46Å; F226-R248 CarbonylContact O-C 3.59Å; F226-R248 WeakPolarHBondContact O-CA 3.46Å; F226-R248 WeakPolarHBondContact O-CB 3.49Å; N244-R248 PolarHBondContact N-O 2.81Å; D246-R248 PolarHBondContact O-N 2.8Å; D246-R248 IonicContact OD2-CZ 3.62Å; D246-R248 IonicContact OD2-NE 3.51Å; D246-R248 IonicContact OD2-NH2 2.8Å; D246-R248 PolarHBondContact OD2-NH2 3.04Å
249	L	95.6	Very high	90.4	Very high	10 Å²	10	79.7 Å²	79.7	5%	0.052	40%	0.395	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.9	133.6	-173.7	-59.5	175.6	0	0	0	110.7	L225 F226 A231 V234 V241 R242 Q243	L225-L249 CarbonylContact C-O 3.58Å; L225-L249 WeakPolarHBondContact CA-O 3.35Å; F226-L249 HydrophobicContact CB-CB 4.31Å; F226-L249 PolarHBondContact N-O 3Å; F226-L249 PolarHBondContact O-N 2.56Å; A231-L249 HydrophobicContact CB-CD1 3.64Å; V234-L249 HydrophobicContact CB-CD1 4.22Å; V234-L249 HydrophobicContact CG1-CB 4.32Å; V234-L249 HydrophobicContact CG1-CD1 4.08Å; V241-L249 HydrophobicContact CG1-CB 3.72Å; V241-L249 HydrophobicContact CG1-CD1 4.29Å; V241-L249 HydrophobicContact CG1-CD2 4.05Å; V241-L249 HydrophobicContact CG1-CG 4.24Å; R242-L249 CarbonylContact O-C 3.54Å; R242-L249 WeakPolarHBondContact O-CA 3.14Å; Q243-L249 HydrophobicContact CB-CD2 4.1Å; Q243-L249 HydrophobicContact CG-CD2 4.23Å
250	I	95.8	Very high	90.6	Very high	41 Å²	41	73.9 Å²	73.9	21%	0.21	38%	0.376	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.6	127.6	177.1	-62.8	173.2	0	0	0	108.6	T223 L224 L225 V241 R242 N244	T223-I250 HydrophobicContact CG2-CG2 3.97Å; L224-I250 CarbonylContact O-C 3.57Å; L224-I250 VanDerWaalsContact O-CA 3.26Å; L224-I250 WeakPolarHBondContact O-CA 3.34Å; L225-I250 HydrophobicContact CD1-CD1 4.19Å; L225-I250 HydrophobicContact CD1-CG1 3.49Å; L225-I250 VanDerWaalsContact CD1-CG1 3.49Å; V241-I250 WeakPolarHBondContact CA-O 3.19Å; R242-I250 PolarHBondContact N-O 3.38Å; R242-I250 PolarHBondContact O-N 3.27Å; N244-I250 HydrophobicContact CB-CD1 4.14Å
251	A	95.6	Very high	91.1	Very high	2 Å²	2	67.7 Å²	67.7	2%	0.017	34%	0.343	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.8	139.3	170.5	0	0	0	0	0	110.1	L224 F226 F238 V241	L224-A251 PolarHBondContact N-O 3.19Å; L224-A251 PolarHBondContact O-N 3.47Å; F226-A251 HydrophobicContact CE2-CB 4Å; F238-A251 HydrophobicContact CB-CB 4.12Å; F238-A251 HydrophobicContact CD1-CB 4.2Å; F238-A251 HydrophobicContact CD2-CB 4.28Å; F238-A251 HydrophobicContact CG-CB 3.93Å; V241-A251 HydrophobicContact CG2-CB 4.46Å
252	V	95.2	Very high	91.2	Very high	73 Å²	73	66.5 Å²	66.5	44%	0.442	34%	0.336	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-108.9	123	170.4	-177.7	0	0	0	0	107.8	E221 L222 T223	E221-V252 HydrophobicContact CG-CG1 3.85Å; L222-V252 WeakPolarHBondContact O-CA 3.26Å; T223-V252 HydrophobicContact CG2-CG2 4.38Å
253	V	94.6	Very high	91.2	Very high	28 Å²	28	62.2 Å²	62.2	17%	0.17	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-142.9	143.1	-173.4	65.6	0	0	0	0	111.5	E221 L222 L224 F238 L255	E221-V253 CarbonylContact C-O 3.52Å; E221-V253 WeakPolarHBondContact CA-O 3.41Å; L222-V253 HydrophobicContact CB-CG1 4.26Å; L222-V253 PolarHBondContact N-O 3.09Å; L222-V253 PolarHBondContact O-N 3.38Å; L224-V253 HydrophobicContact CD1-CG1 3.72Å; L224-V253 HydrophobicContact CG-CG1 4.32Å; F238-V253 HydrophobicContact CD1-CB 4.17Å; F238-V253 HydrophobicContact CD1-CG2 4.23Å; F238-V253 HydrophobicContact CE1-CB 4.05Å; F238-V253 HydrophobicContact CE1-CG1 3.93Å; F238-V253 HydrophobicContact CE1-CG2 4.08Å; V253-L255 HydrophobicContact CG1-CD1 4.02Å; V253-L255 HydrophobicContact CG1-CG 4.03Å; V253-L255 HydrophobicContact CG2-CD2 3.85Å; V253-L255 HydrophobicContact CG2-CG 3.95Å
254	T	93.6	Very high	91.3	Very high	70 Å²	70	59.3 Å²	59.3	43%	0.429	31%	0.311	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.7	118	173	-54.6	0	0	0	0	110.2	Q219 V220	Q219-T254 HydrophobicContact CB-CG2 3.81Å; Q219-T254 HydrophobicContact CG-CG2 4.39Å; V220-T254 WeakPolarHBondContact O-CA 3.36Å
255	L	92.4	Very high	91.8	Very high	30 Å²	30	56.4 Å²	56.4	16%	0.157	30%	0.295	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.5	160.8	-176.1	-65.6	-178.7	0	0	0	111.4	Q219 V220 L222 V253 D257 T261 Y264 L265	Q219-L255 CarbonylContact C-O 3.52Å; Q219-L255 VanDerWaalsContact CA-O 3.31Å; Q219-L255 WeakPolarHBondContact CA-O 3.41Å; V220-L255 PolarHBondContact N-O 3.04Å; V220-L255 PolarHBondContact O-N 3.49Å; L222-L255 HydrophobicContact CD1-CB 4.41Å; L222-L255 HydrophobicContact CD1-CD1 4.06Å; V253-L255 HydrophobicContact CG1-CD1 4.02Å; V253-L255 HydrophobicContact CG1-CG 4.03Å; V253-L255 HydrophobicContact CG2-CD2 3.85Å; V253-L255 HydrophobicContact CG2-CG 3.95Å; L255-D257 PolarHBondContact O-N 3.4Å; L255-T261 HydrophobicContact CB-CG2 3.81Å; L255-T261 HydrophobicContact CD1-CG2 3.81Å; L255-T261 HydrophobicContact CG-CG2 4.47Å; L255-Y264 HydrophobicContact CD1-CD1 4Å; L255-Y264 HydrophobicContact CD1-CE1 3.86Å; L255-L265 HydrophobicContact CD1-CD2 4.46Å
256	P	92.1	Very high	92.4	Very high	33 Å²	33	50 Å²	50	21%	0.214	27%	0.268	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-55.4	135.3	171.2	-14.6	20.9	0	0	0	111.6	P216 D258 T261	P216-P256 HydrophobicContact CB-CB 3.9Å; P216-P256 HydrophobicContact CB-CG 4.27Å; P216-P256 HydrophobicContact CG-CB 3.78Å; P216-P256 HydrophobicContact CG-CG 3.58Å; P256-D258 VanDerWaalsContact C-N 3.26Å; P256-D258 PolarHBondContact O-N 3.1Å; P256-T261 WeakPolarHBondContact O-CB 3.24Å; P256-T261 PolarHBondContact O-OG1 2.95Å
257	D	92.7	Very high	92.7	Very high	34 Å²	34	48.2 Å²	48.2	18%	0.182	26%	0.263	C	S	.	.	S	Bend	trans	-86.3	66.5	173.5	-178.3	21.6	0	0	0	111.4	K218 V220 L255 K283	K218-D257 HydrophobicContact CB-CB 4.45Å; K218-D257 HydrophobicContact CD-CB 3.96Å; K218-D257 WeakPolarHBondContact CD-OD2 3.45Å; K218-D257 WeakPolarHBondContact CE-OD2 3.45Å; K218-D257 HydrophobicContact CG-CB 3.97Å; K218-D257 IonicContact NZ-OD2 3.85Å; K218-D257 PolarHBondContact NZ-OD2 3.29Å; K218-D257 PolarHBondContact O-N 3.31Å; V220-D257 HydrophobicContact CB-CB 4.09Å; V220-D257 HydrophobicContact CG1-CB 3.95Å; L255-D257 PolarHBondContact O-N 3.4Å; D257-K283 IonicContact OD1-NZ 3.1Å; D257-K283 PolarHBondContact OD1-NZ 2.97Å
258	D	88.5	Confident	93	Very high	68 Å²	68	44.1 Å²	44.1	36%	0.364	24%	0.241	S	C	.	.	S	Bend	trans	-138.9	-170.8	178	71	23.9	0	0	0	112.3	P256 T260 T261	P256-D258 VanDerWaalsContact C-N 3.26Å; P256-D258 PolarHBondContact O-N 3.1Å; D258-T260 VanDerWaalsContact C-N 3.27Å; D258-T260 PolarHBondContact O-N 3.31Å; D258-T260 WeakPolarHBondContact OD1-CA 3.35Å; D258-T260 VanDerWaalsContact OD1-CB 3.26Å; D258-T260 WeakPolarHBondContact OD1-CB 3.24Å; D258-T260 PolarHBondContact OD1-N 3.49Å; D258-T260 PolarHBondContact OD1-OG1 2.56Å; D258-T261 PolarHBondContact OD1-N 3.44Å
259	V	87.1	Confident	93	Very high	81 Å²	81	42.8 Å²	42.8	49%	0.491	25%	0.251	S	S	.	.	H	α-helix	trans	-70.3	-22.6	-179	72.6	0	0	0	0	113	I262 N263	V259-I262 PolarHBondContact O-N 2.69Å; V259-N263 VanDerWaalsContact O-CG 3.32Å; V259-N263 PolarHBondContact O-N 3.2Å; V259-N263 PolarHBondContact O-ND2 3.29Å
260	T	87.6	Confident	92.8	Very high	78 Å²	78	49.5 Å²	49.5	48%	0.479	29%	0.287	S	S	.	.	H	α-helix	trans	-67.1	-41.6	-179.8	69.5	0	0	0	0	110.7	D258 N263 Y264	D258-T260 VanDerWaalsContact C-N 3.27Å; D258-T260 PolarHBondContact O-N 3.31Å; D258-T260 WeakPolarHBondContact OD1-CA 3.35Å; D258-T260 VanDerWaalsContact OD1-CB 3.26Å; D258-T260 WeakPolarHBondContact OD1-CB 3.24Å; D258-T260 PolarHBondContact OD1-N 3.49Å; D258-T260 PolarHBondContact OD1-OG1 2.56Å; T260-N263 PolarHBondContact O-N 3.45Å; T260-Y264 VanDerWaalsContact O-CB 3.26Å; T260-Y264 WeakPolarHBondContact O-CB 3.49Å; T260-Y264 PolarHBondContact O-N 2.89Å
261	T	93.8	Very high	92.8	Very high	3 Å²	3	50.4 Å²	50.4	2%	0.018	29%	0.29	C	S	.	.	H	α-helix	trans	-63	-41.6	173.1	-63.2	0	0	0	0	111.6	L222 L255 P256 D258 N263 Y264 L265 F280	L222-T261 HydrophobicContact CD1-CG2 3.98Å; L255-T261 HydrophobicContact CB-CG2 3.81Å; L255-T261 HydrophobicContact CD1-CG2 3.81Å; L255-T261 HydrophobicContact CG-CG2 4.47Å; P256-T261 WeakPolarHBondContact O-CB 3.24Å; P256-T261 PolarHBondContact O-OG1 2.95Å; D258-T261 PolarHBondContact OD1-N 3.44Å; T261-N263 PolarHBondContact O-N 3.18Å; T261-Y264 PolarHBondContact O-N 3.47Å; T261-L265 HydrophobicContact CG2-CD1 3.91Å; T261-L265 HydrophobicContact CG2-CG 4.26Å; T261-L265 WeakPolarHBondContact O-CB 3.3Å; T261-L265 VanDerWaalsContact O-CG 3.24Å; T261-L265 WeakPolarHBondContact O-CG 3.28Å; T261-L265 PolarHBondContact O-N 3.41Å; T261-F280 HydrophobicContact CG2-CE2 4.4Å; T261-F280 HydrophobicContact CG2-CZ 3.79Å
262	I	92.9	Very high	92.8	Very high	3 Å²	3	51.5 Å²	51.5	2%	0.015	30%	0.295	C	S	.	.	H	α-helix	trans	-59.6	-50.4	176.5	-62.9	172.6	0	0	0	110.7	V259 Y264 L265 F266 F280 K283 M284 H287	V259-I262 PolarHBondContact O-N 2.69Å; I262-Y264 VanDerWaalsContact C-N 3.31Å; I262-Y264 PolarHBondContact O-N 3.28Å; I262-L265 PolarHBondContact O-N 3.41Å; I262-F266 HydrophobicContact CG2-CD2 3.62Å; I262-F266 HydrophobicContact CG2-CE2 3.53Å; I262-F266 VanDerWaalsContact O-CD2 3.24Å; I262-F266 WeakPolarHBondContact O-CD2 3.35Å; I262-F266 PolarHBondContact O-N 2.77Å; I262-F280 HydrophobicContact CG1-CZ 4.02Å; I262-K283 HydrophobicContact CD1-CD 3.96Å; I262-K283 HydrophobicContact CD1-CG 4.25Å; I262-M284 HydrophobicContact CG2-CE 4.22Å; I262-M284 HydrophobicContact CG2-SD 4.29Å; I262-H287 WeakPolarHBondContact CD1-NE2 3.45Å
263	N	92	Very high	92.8	Very high	100 Å²	100	51.5 Å²	51.5	54%	0.535	29%	0.29	S	S	.	.	H	α-helix	trans	-63.6	-38.3	179.7	-67.6	-19.1	0	0	0	112.3	V259 T260 T261 F266 S267	V259-N263 VanDerWaalsContact O-CG 3.32Å; V259-N263 PolarHBondContact O-N 3.2Å; V259-N263 PolarHBondContact O-ND2 3.29Å; T260-N263 PolarHBondContact O-N 3.45Å; T261-N263 PolarHBondContact O-N 3.18Å; N263-F266 PolarHBondContact O-N 2.92Å; N263-S267 PolarHBondContact O-N 3.46Å
264	Y	93.5	Very high	92.9	Very high	64 Å²	64	50.6 Å²	50.6	25%	0.251	28%	0.284	S	S	.	.	H	α-helix	trans	-62.3	-49.3	175.5	166.4	-108.5	0	0	0	111.2	E237 F238 L255 T260 T261 I262 F266 S267 F268	E237-Y264 WeakPolarHBondContact OE2-CE2 3.48Å; E237-Y264 PolarHBondContact OE2-OH 2.54Å; F238-Y264 HydrophobicContact CZ-CE1 4.49Å; F238-Y264 VanDerWaalsContact CZ-OH 3.3Å; F238-Y264 WeakPolarHBondContact CZ-OH 3.43Å; L255-Y264 HydrophobicContact CD1-CD1 4Å; L255-Y264 HydrophobicContact CD1-CE1 3.86Å; T260-Y264 VanDerWaalsContact O-CB 3.26Å; T260-Y264 WeakPolarHBondContact O-CB 3.49Å; T260-Y264 PolarHBondContact O-N 2.89Å; T261-Y264 PolarHBondContact O-N 3.47Å; I262-Y264 VanDerWaalsContact C-N 3.31Å; I262-Y264 PolarHBondContact O-N 3.28Å; Y264-F266 VanDerWaalsContact C-N 3.35Å; Y264-F266 PolarHBondContact O-N 2.9Å; Y264-S267 VanDerWaalsContact O-CB 3.32Å; Y264-S267 WeakPolarHBondContact O-CB 3.48Å; Y264-S267 PolarHBondContact O-N 3.32Å; Y264-S267 PolarHBondContact O-OG 3.33Å; Y264-F268 HydrophobicContact CE1-CE2 4.15Å; Y264-F268 AromaticContact CE2-CE2 3.99Å; Y264-F268 HydrophobicContact CE2-CE2 3.99Å; Y264-F268 HydrophobicContact CE2-CZ 4.49Å; Y264-F268 AromaticContact CZ-CE2 3.74Å
265	L	95.4	Very high	93	Very high	2 Å²	2	50.1 Å²	50.1	1%	0.01	28%	0.279	C	S	.	.	H	α-helix	trans	-64.2	-39.3	177.7	-64.2	174.3	0	0	0	111.8	L222 L224 L255 T261 I262 S267 F268 L272 I274 F280 M284	L222-L265 HydrophobicContact CD1-CD1 3.89Å; L224-L265 HydrophobicContact CD1-CD2 3.77Å; L224-L265 HydrophobicContact CD2-CD2 4.1Å; L255-L265 HydrophobicContact CD1-CD2 4.46Å; T261-L265 HydrophobicContact CG2-CD1 3.91Å; T261-L265 HydrophobicContact CG2-CG 4.26Å; T261-L265 WeakPolarHBondContact O-CB 3.3Å; T261-L265 VanDerWaalsContact O-CG 3.24Å; T261-L265 WeakPolarHBondContact O-CG 3.28Å; T261-L265 PolarHBondContact O-N 3.41Å; I262-L265 PolarHBondContact O-N 3.41Å; L265-S267 PolarHBondContact O-N 2.88Å; L265-S267 VanDerWaalsContact O-N 3.14Å; L265-F268 PolarHBondContact O-N 3.02Å; L265-F268 VanDerWaalsContact O-N 3.08Å; L265-L272 HydrophobicContact CB-CD2 3.67Å; L265-L272 HydrophobicContact CD2-CD2 3.74Å; L265-L272 HydrophobicContact CG-CD2 4.22Å; L265-L272 WeakPolarHBondContact O-CD2 3.41Å; L265-I274 HydrophobicContact CD1-CD1 3.77Å; L265-F280 HydrophobicContact CD1-CE1 3.65Å; L265-F280 HydrophobicContact CD1-CZ 4.19Å; L265-M284 HydrophobicContact CB-CE 3.68Å; L265-M284 HydrophobicContact CD1-CE 4.11Å
266	F	93.2	Very high	93.2	Very high	62 Å²	62	54.1 Å²	54.1	27%	0.272	30%	0.297	S	S	.	.	H	α-helix	trans	-58.1	-26.5	172.8	-92.5	-63.8	0	0	0	113.9	I262 N263 Y264 F268 G269 M284 H287 I288 L291	I262-F266 HydrophobicContact CG2-CD2 3.62Å; I262-F266 HydrophobicContact CG2-CE2 3.53Å; I262-F266 VanDerWaalsContact O-CD2 3.24Å; I262-F266 WeakPolarHBondContact O-CD2 3.35Å; I262-F266 PolarHBondContact O-N 2.77Å; N263-F266 PolarHBondContact O-N 2.92Å; Y264-F266 VanDerWaalsContact C-N 3.35Å; Y264-F266 PolarHBondContact O-N 2.9Å; F266-F268 PolarHBondContact O-N 2.97Å; F266-G269 PolarHBondContact O-N 2.94Å; F266-M284 HydrophobicContact CD1-SD 4.49Å; F266-M284 HydrophobicContact CD2-CE 4.3Å; F266-M284 HydrophobicContact CD2-SD 3.87Å; F266-M284 HydrophobicContact CE1-SD 4.05Å; F266-M284 HydrophobicContact CE2-CE 4.31Å; F266-M284 HydrophobicContact CE2-SD 3.35Å; F266-M284 WeakPolarHBondContact CE2-SD 3.45Å; F266-M284 HydrophobicContact CG-SD 4.4Å; F266-M284 HydrophobicContact CZ-SD 3.45Å; F266-M284 WeakPolarHBondContact CZ-SD 3.33Å; F266-H287 HydrophobicContact CE2-CB 3.68Å; F266-H287 HydrophobicContact CZ-CB 3.76Å; F266-I288 HydrophobicContact CE1-CG1 3.7Å; F266-I288 HydrophobicContact CZ-CG1 3.74Å; F266-L291 HydrophobicContact CE1-CD2 4.28Å
267	S	94.1	Very high	93.5	Very high	63 Å²	63	54.5 Å²	54.5	44%	0.441	30%	0.299	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.8	-12.8	179	75.4	0	0	0	0	113.4	R233 N263 Y264 L265 G269	R233-S267 VanDerWaalsContact NH1-C 3.26Å; R233-S267 PolarHBondContact NH1-O 3.3Å; R233-S267 PolarHBondContact NH1-OG 3.44Å; R233-S267 PolarHBondContact NH2-OG 2.99Å; N263-S267 PolarHBondContact O-N 3.46Å; Y264-S267 VanDerWaalsContact O-CB 3.32Å; Y264-S267 WeakPolarHBondContact O-CB 3.48Å; Y264-S267 PolarHBondContact O-N 3.32Å; Y264-S267 PolarHBondContact O-OG 3.33Å; L265-S267 PolarHBondContact O-N 2.88Å; L265-S267 VanDerWaalsContact O-N 3.14Å; S267-G269 VanDerWaalsContact C-N 3.26Å
268	F	94.4	Very high	93.7	Very high	7 Å²	7	57 Å²	57	3%	0.031	32%	0.318	C	S	.	.	T	Hydrogen-bonded Turn	trans	-81.7	-5.4	170	-69.7	-90.2	0	0	0	112.9	F226 R233 V234 E237 F238 Y264 L265 F266 Q271 L272	F226-F268 HydrophobicContact CD1-CD1 4.07Å; F226-F268 HydrophobicContact CD1-CE1 4.37Å; F226-F268 AromaticContact CE1-CD1 3.64Å; F226-F268 HydrophobicContact CE1-CD1 3.64Å; F226-F268 HydrophobicContact CE1-CD2 4.32Å; F226-F268 AromaticContact CE1-CE1 3.71Å; F226-F268 HydrophobicContact CE1-CE1 3.71Å; F226-F268 HydrophobicContact CE1-CE2 4.39Å; F226-F268 AromaticContact CE1-CG 3.95Å; F226-F268 HydrophobicContact CE1-CG 3.95Å; F226-F268 HydrophobicContact CE1-CZ 4.1Å; F226-F268 HydrophobicContact CZ-CE1 4.45Å; R233-F268 HydrophobicContact CB-CE1 4.42Å; R233-F268 HydrophobicContact CG-CE1 3.82Å; R233-F268 HydrophobicContact CG-CZ 4.4Å; V234-F268 HydrophobicContact CG2-CE1 4.46Å; E237-F268 WeakPolarHBondContact OE2-CZ 3.34Å; F238-F268 AromaticContact CE2-CZ 3.97Å; F238-F268 HydrophobicContact CE2-CZ 3.97Å; F238-F268 HydrophobicContact CZ-CZ 4.29Å; Y264-F268 HydrophobicContact CE1-CE2 4.15Å; Y264-F268 AromaticContact CE2-CE2 3.99Å; Y264-F268 HydrophobicContact CE2-CE2 3.99Å; Y264-F268 HydrophobicContact CE2-CZ 4.49Å; Y264-F268 AromaticContact CZ-CE2 3.74Å; L265-F268 PolarHBondContact O-N 3.02Å; L265-F268 VanDerWaalsContact O-N 3.08Å; F266-F268 PolarHBondContact O-N 2.97Å; F268-Q271 PolarHBondContact O-N 2.95Å; F268-L272 HydrophobicContact CB-CB 3.66Å; F268-L272 HydrophobicContact CB-CD2 4.14Å; F268-L272 HydrophobicContact CD2-CD2 4.16Å; F268-L272 HydrophobicContact CG-CB 4.41Å; F268-L272 HydrophobicContact CG-CD2 4.39Å
269	G	92.4	Very high	94	Very high	47 Å²	47	57.2 Å²	57.2	49%	0.485	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	66.6	-138.8	179.8	0	0	0	0	0	112.4	F266 S267 Q271	F266-G269 PolarHBondContact O-N 2.94Å; S267-G269 VanDerWaalsContact C-N 3.26Å; G269-Q271 VanDerWaalsContact C-N 3.34Å
270	D	92.3	Very high	94.4	Very high	151 Å²	151	53.6 Å²	53.6	81%	0.807	31%	0.306	S	S	*	.	G	3₁₀ helix	trans	-84.3	-5.3	178.3	58.9	-15.6	0	0	0	113.8	L272	D270-L272 PolarHBondContact O-N 3.17Å
271	Q	95	Very high	94.8	Very high	60 Å²	60	55 Å²	55	28%	0.28	30%	0.303	S	S	.	.	G	3₁₀ helix	trans	-79	0.6	179.7	-55	180	-37.5	0	0	113.7	F226 D227 A230 F268 G269	F226-Q271 VanDerWaalsContact CA-O 3.28Å; F226-Q271 WeakPolarHBondContact CA-O 3.17Å; D227-Q271 HydrophobicContact CB-CB 4.41Å; D227-Q271 PolarHBondContact N-O 2.93Å; A230-Q271 HydrophobicContact CB-CB 4.01Å; F268-Q271 PolarHBondContact O-N 2.95Å; G269-Q271 VanDerWaalsContact C-N 3.34Å
272	L	96.1	Very high	94.9	Very high	24 Å²	24	60.1 Å²	60.1	13%	0.126	33%	0.326	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	131	-177.8	167.1	67.7	0	0	0	110.8	L224 F226 L265 F268 D270	L224-L272 HydrophobicContact CB-CD1 3.76Å; L224-L272 HydrophobicContact CD1-CD1 4.42Å; L224-L272 HydrophobicContact CD2-CD1 4Å; L224-L272 HydrophobicContact CG-CD1 4.27Å; F226-L272 HydrophobicContact CD1-CB 4.06Å; F226-L272 HydrophobicContact CD1-CD1 3.76Å; F226-L272 HydrophobicContact CD1-CG 4.45Å; F226-L272 HydrophobicContact CE1-CB 4.09Å; F226-L272 HydrophobicContact CE1-CD1 3.38Å; F226-L272 HydrophobicContact CE1-CD2 4.39Å; F226-L272 HydrophobicContact CE1-CG 4.12Å; F226-L272 HydrophobicContact CE2-CD1 4.23Å; F226-L272 HydrophobicContact CG-CD1 4.34Å; F226-L272 HydrophobicContact CZ-CD1 3.65Å; L265-L272 HydrophobicContact CB-CD2 3.67Å; L265-L272 HydrophobicContact CD2-CD2 3.74Å; L265-L272 HydrophobicContact CG-CD2 4.22Å; L265-L272 WeakPolarHBondContact O-CD2 3.41Å; F268-L272 HydrophobicContact CB-CB 3.66Å; F268-L272 HydrophobicContact CB-CD2 4.14Å; F268-L272 HydrophobicContact CD2-CD2 4.16Å; F268-L272 HydrophobicContact CG-CB 4.41Å; F268-L272 HydrophobicContact CG-CD2 4.39Å; D270-L272 PolarHBondContact O-N 3.17Å
273	E	95.8	Very high	94.9	Very high	73 Å²	73	62.7 Å²	62.7	34%	0.341	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-121	132.7	169.5	-174.1	176.6	-175.9	0	0	110.9	L225 L275 R281	L225-E273 HydrophobicContact CB-CB 4.35Å; L225-E273 PolarHBondContact N-O 3.16Å; L225-E273 PolarHBondContact O-N 3.1Å; E273-L275 HydrophobicContact CG-CD2 4.2Å; E273-R281 IonicContact OE1-CZ 3.94Å; E273-R281 IonicContact OE1-NH1 3.21Å; E273-R281 PolarHBondContact OE1-NH1 3.12Å; E273-R281 IonicContact OE1-NH2 2.7Å; E273-R281 PolarHBondContact OE1-NH2 2.9Å
274	I	96.7	Very high	95	Very high	9 Å²	9	58.7 Å²	58.7	5%	0.046	32%	0.316	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	116.5	175.2	-54.1	178.9	0	0	0	108.6	L222 L224 L265 F280 R281 M284	L222-I274 HydrophobicContact CD2-CG2 4.39Å; L224-I274 HydrophobicContact CD2-CG1 4.02Å; L224-I274 HydrophobicContact CD2-CG2 4.44Å; L265-I274 HydrophobicContact CD1-CD1 3.77Å; I274-F280 HydrophobicContact CD1-CD1 3.65Å; I274-F280 HydrophobicContact CD1-CE1 3.81Å; I274-F280 HydrophobicContact CG2-CD1 4.43Å; I274-R281 HydrophobicContact CG2-CB 4.46Å; I274-R281 WeakPolarHBondContact O-CD 3.47Å; I274-R281 PolarHBondContact O-NH1 2.69Å; I274-M284 HydrophobicContact CD1-CB 3.9Å; I274-M284 HydrophobicContact CD1-CE 3.83Å; I274-M284 HydrophobicContact CD1-CG 4.01Å
275	L	95.6	Very high	95.1	Very high	61 Å²	61	58.2 Å²	58.2	32%	0.319	33%	0.325	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-87.2	-47.3	178.1	-58.8	-173.4	0	0	0	111.5	T223 L225 E273	T223-L275 HydrophobicContact CG2-CB 4.1Å; T223-L275 HydrophobicContact CG2-CD1 4.21Å; T223-L275 PolarHBondContact O-N 2.95Å; L225-L275 HydrophobicContact CB-CD1 3.86Å; L225-L275 HydrophobicContact CB-CD2 4.17Å; L225-L275 HydrophobicContact CB-CG 3.87Å; L225-L275 HydrophobicContact CD2-CD1 4.36Å; L225-L275 HydrophobicContact CD2-CD2 4.18Å; E273-L275 HydrophobicContact CG-CD2 4.2Å
276	E	96.6	Very high	95	Very high	114 Å²	114	65.5 Å²	65.5	53%	0.533	35%	0.353	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-136.4	151.4	-178.1	-62.5	-176.8	153.1	0	0	112.3	L222 T223	L222-E276 WeakPolarHBondContact CA-O 3.13Å; T223-E276 PolarHBondContact N-O 2.68Å; T223-E276 VanDerWaalsContact N-O 3.09Å; T223-E276 PolarHBondContact O-N 3.01Å; T223-E276 PolarHBondContact OG1-OE2 2.91Å
277	P	97.6	Very high	95	Very high	40 Å²	40	65.6 Å²	65.6	26%	0.26	35%	0.354	S	S	.	.			cis	-80.2	156.1	-8.5	33.8	-32.7	0	0	0	110.5	V220 E221 A279 F280 R281	V220-P277 HydrophobicContact CG2-CG 3.84Å; E221-P277 WeakPolarHBondContact O-CD 3.09Å; P277-A279 PolarHBondContact O-N 3.37Å; P277-F280 HydrophobicContact CG-CB 3.94Å; P277-F280 PolarHBondContact O-N 3.29Å; P277-R281 PolarHBondContact O-N 3.08Å; P277-R281 VanDerWaalsContact O-N 3.12Å
278	P	96.6	Very high	95	Very high	87 Å²	87	66.8 Å²	66.8	57%	0.565	35%	0.354	S	S	*	.	H	α-helix	trans	-52.7	-33.4	177.1	-28.4	35.1	0	0	0	113.6	F280 R281 Q282	P278-F280 PolarHBondContact O-N 3.1Å; P278-R281 PolarHBondContact O-N 3.49Å; P278-Q282 WeakPolarHBondContact O-CG 3.31Å; P278-Q282 PolarHBondContact O-N 2.95Å
279	A	95.3	Very high	95	Very high	72 Å²	72	71.2 Å²	71.2	60%	0.595	38%	0.375	S	S	*	.	H	α-helix	trans	-60.4	-41.4	176	0	0	0	0	0	112.7	P277 K283	P277-A279 PolarHBondContact O-N 3.37Å; A279-K283 PolarHBondContact O-N 2.89Å; A279-K283 VanDerWaalsContact O-N 3.08Å
280	F	95.7	Very high	95.1	Very high	6 Å²	6	75.7 Å²	75.7	3%	0.026	38%	0.381	C	S	.	.	H	α-helix	trans	-76.2	-36.4	178.3	-158.5	-79.4	0	0	0	111.3	V220 L222 T261 I262 L265 I274 P277 P278 Q282 K283 M284	V220-F280 HydrophobicContact CB-CD2 4.42Å; V220-F280 HydrophobicContact CG1-CD2 3.84Å; V220-F280 HydrophobicContact CG1-CE2 3.8Å; V220-F280 HydrophobicContact CG2-CB 4.5Å; V220-F280 HydrophobicContact CG2-CD2 4.06Å; L222-F280 HydrophobicContact CD1-CE1 4.48Å; L222-F280 HydrophobicContact CD2-CB 3.86Å; L222-F280 HydrophobicContact CD2-CD1 3.74Å; L222-F280 HydrophobicContact CD2-CD2 4.02Å; L222-F280 HydrophobicContact CD2-CE1 4.29Å; L222-F280 HydrophobicContact CD2-CG 3.59Å; T261-F280 HydrophobicContact CG2-CE2 4.4Å; T261-F280 HydrophobicContact CG2-CZ 3.79Å; I262-F280 HydrophobicContact CG1-CZ 4.02Å; L265-F280 HydrophobicContact CD1-CE1 3.65Å; L265-F280 HydrophobicContact CD1-CZ 4.19Å; I274-F280 HydrophobicContact CD1-CD1 3.65Å; I274-F280 HydrophobicContact CD1-CE1 3.81Å; I274-F280 HydrophobicContact CG2-CD1 4.43Å; P277-F280 HydrophobicContact CG-CB 3.94Å; P277-F280 PolarHBondContact O-N 3.29Å; P278-F280 PolarHBondContact O-N 3.1Å; F280-Q282 VanDerWaalsContact C-N 3.33Å; F280-Q282 PolarHBondContact O-N 3.39Å; F280-K283 HydrophobicContact CD2-CD 4.21Å; F280-K283 HydrophobicContact CE2-CD 4.15Å; F280-K283 WeakPolarHBondContact O-CA 3.39Å; F280-K283 VanDerWaalsContact O-CB 3.28Å; F280-K283 WeakPolarHBondContact O-CB 3.28Å; F280-K283 PolarHBondContact O-N 3.27Å; F280-K283 VanDerWaalsContact O-N 3.12Å; F280-M284 PolarHBondContact O-N 2.78Å
281	R	95.7	Very high	95	Very high	107 Å²	107	72.2 Å²	72.2	40%	0.404	36%	0.362	S	S	.	.	H	α-helix	trans	-56.6	-45.7	171	-172.7	-177.6	179.1	110	-3.2	111.6	E273 I274 P277 P278 K283 M284 A285	E273-R281 IonicContact OE1-CZ 3.94Å; E273-R281 IonicContact OE1-NH1 3.21Å; E273-R281 PolarHBondContact OE1-NH1 3.12Å; E273-R281 IonicContact OE1-NH2 2.7Å; E273-R281 PolarHBondContact OE1-NH2 2.9Å; I274-R281 HydrophobicContact CG2-CB 4.46Å; I274-R281 WeakPolarHBondContact O-CD 3.47Å; I274-R281 PolarHBondContact O-NH1 2.69Å; P277-R281 PolarHBondContact O-N 3.08Å; P277-R281 VanDerWaalsContact O-N 3.12Å; P278-R281 PolarHBondContact O-N 3.49Å; R281-K283 PolarHBondContact O-N 3.42Å; R281-M284 PolarHBondContact O-N 2.74Å; R281-A285 PolarHBondContact O-N 2.92Å
282	Q	95.2	Very high	94.9	Very high	110 Å²	110	71.8 Å²	71.8	51%	0.514	37%	0.366	S	S	.	.	H	α-helix	trans	-63.5	-39.3	174.8	-71.6	176.4	18.1	0	0	112.5	P278 F280 M284 A285 R286	P278-Q282 WeakPolarHBondContact O-CG 3.31Å; P278-Q282 PolarHBondContact O-N 2.95Å; F280-Q282 VanDerWaalsContact C-N 3.33Å; F280-Q282 PolarHBondContact O-N 3.39Å; Q282-M284 VanDerWaalsContact C-N 3.34Å; Q282-A285 PolarHBondContact O-N 3.29Å; Q282-R286 WeakPolarHBondContact O-CG 3.47Å; Q282-R286 PolarHBondContact O-N 2.91Å; Q282-R286 VanDerWaalsContact O-N 3.1Å
283	K	94	Very high	94.9	Very high	57 Å²	57	76.7 Å²	76.7	25%	0.248	39%	0.386	C	S	.	.	H	α-helix	trans	-57.2	-49	173.6	-166	-171.6	-167.9	-170.2	0	110.1	D257 I262 A279 F280 R281 R286 H287	D257-K283 IonicContact OD1-NZ 3.1Å; D257-K283 PolarHBondContact OD1-NZ 2.97Å; I262-K283 HydrophobicContact CD1-CD 3.96Å; I262-K283 HydrophobicContact CD1-CG 4.25Å; A279-K283 PolarHBondContact O-N 2.89Å; A279-K283 VanDerWaalsContact O-N 3.08Å; F280-K283 HydrophobicContact CD2-CD 4.21Å; F280-K283 HydrophobicContact CE2-CD 4.15Å; F280-K283 WeakPolarHBondContact O-CA 3.39Å; F280-K283 VanDerWaalsContact O-CB 3.28Å; F280-K283 WeakPolarHBondContact O-CB 3.28Å; F280-K283 PolarHBondContact O-N 3.27Å; F280-K283 VanDerWaalsContact O-N 3.12Å; R281-K283 PolarHBondContact O-N 3.42Å; K283-R286 PolarHBondContact O-N 2.77Å; K283-H287 PolarHBondContact O-CD2 3.05Å; K283-H287 VanDerWaalsContact O-CD2 3.31Å; K283-H287 PolarHBondContact O-N 2.81Å
284	M	94.3	Very high	94.7	Very high	17 Å²	17	81.4 Å²	81.4	8%	0.084	41%	0.406	C	S	.	.	H	α-helix	trans	-62	-45.7	177.8	-172.8	58.6	83.2	0	0	112.3	I262 L265 F266 I274 F280 R281 Q282 R286 H287 I288	I262-M284 HydrophobicContact CG2-CE 4.22Å; I262-M284 HydrophobicContact CG2-SD 4.29Å; L265-M284 HydrophobicContact CB-CE 3.68Å; L265-M284 HydrophobicContact CD1-CE 4.11Å; F266-M284 HydrophobicContact CD1-SD 4.49Å; F266-M284 HydrophobicContact CD2-CE 4.3Å; F266-M284 HydrophobicContact CD2-SD 3.87Å; F266-M284 HydrophobicContact CE1-SD 4.05Å; F266-M284 HydrophobicContact CE2-CE 4.31Å; F266-M284 HydrophobicContact CE2-SD 3.35Å; F266-M284 WeakPolarHBondContact CE2-SD 3.45Å; F266-M284 HydrophobicContact CG-SD 4.4Å; F266-M284 HydrophobicContact CZ-SD 3.45Å; F266-M284 WeakPolarHBondContact CZ-SD 3.33Å; I274-M284 HydrophobicContact CD1-CB 3.9Å; I274-M284 HydrophobicContact CD1-CE 3.83Å; I274-M284 HydrophobicContact CD1-CG 4.01Å; F280-M284 PolarHBondContact O-N 2.78Å; R281-M284 PolarHBondContact O-N 2.74Å; Q282-M284 VanDerWaalsContact C-N 3.34Å; M284-R286 VanDerWaalsContact C-N 3.31Å; M284-R286 PolarHBondContact O-N 3.41Å; M284-H287 WeakPolarHBondContact O-CA 3.47Å; M284-H287 WeakPolarHBondContact O-CB 3.38Å; M284-H287 PolarHBondContact O-N 3.46Å; M284-I288 HydrophobicContact CG-CD1 3.95Å; M284-I288 HydrophobicContact CG-CG1 4.42Å; M284-I288 WeakPolarHBondContact O-CG1 3.5Å; M284-I288 PolarHBondContact O-N 2.93Å
285	A	94.5	Very high	94.5	Very high	54 Å²	54	89.5 Å²	89.5	45%	0.446	44%	0.437	S	S	.	.	H	α-helix	trans	-56.2	-42.1	177.5	0	0	0	0	0	112.7	R281 Q282 H287 I288 E289	R281-A285 PolarHBondContact O-N 2.92Å; Q282-A285 PolarHBondContact O-N 3.29Å; A285-H287 VanDerWaalsContact C-N 3.31Å; A285-H287 PolarHBondContact O-N 2.92Å; A285-I288 PolarHBondContact O-N 3.36Å; A285-E289 PolarHBondContact O-N 3.12Å
286	R	94.6	Very high	94.2	Very high	155 Å²	155	93.9 Å²	93.9	59%	0.585	45%	0.453	S	S	*	.	H	α-helix	trans	-62.9	-35.8	174.8	-67.9	173.4	-167.6	163.3	6.1	112.5	Q282 K283 M284 K290	Q282-R286 WeakPolarHBondContact O-CG 3.47Å; Q282-R286 PolarHBondContact O-N 2.91Å; Q282-R286 VanDerWaalsContact O-N 3.1Å; K283-R286 PolarHBondContact O-N 2.77Å; M284-R286 VanDerWaalsContact C-N 3.31Å; M284-R286 PolarHBondContact O-N 3.41Å; R286-K290 WeakPolarHBondContact O-CG 3.37Å; R286-K290 PolarHBondContact O-N 2.87Å
287	H	93.1	Very high	93.2	Very high	64 Å²	64	98.7 Å²	98.7	30%	0.296	49%	0.491	S	S	.	.	H	α-helix	trans	-70	-42.6	175.1	-84.4	-98	0	0	0	111.7	I262 F266 K283 M284 A285 E289 K290 L291	I262-H287 WeakPolarHBondContact CD1-NE2 3.45Å; F266-H287 HydrophobicContact CE2-CB 3.68Å; F266-H287 HydrophobicContact CZ-CB 3.76Å; K283-H287 PolarHBondContact O-CD2 3.05Å; K283-H287 VanDerWaalsContact O-CD2 3.31Å; K283-H287 PolarHBondContact O-N 2.81Å; M284-H287 WeakPolarHBondContact O-CA 3.47Å; M284-H287 WeakPolarHBondContact O-CB 3.38Å; M284-H287 PolarHBondContact O-N 3.46Å; A285-H287 VanDerWaalsContact C-N 3.31Å; A285-H287 PolarHBondContact O-N 2.92Å; H287-E289 VanDerWaalsContact C-N 3.33Å; H287-E289 PolarHBondContact O-N 3.09Å; H287-K290 PolarHBondContact O-N 2.72Å; H287-L291 WeakPolarHBondContact O-CB 3.46Å; H287-L291 PolarHBondContact O-N 2.73Å
288	I	93.9	Very high	93	Very high	87 Å²	87	101.7 Å²	101.7	45%	0.446	50%	0.502	S	S	.	.	H	α-helix	trans	-60.4	-43.1	175.1	-66.7	166.7	0	0	0	110.4	F266 M284 A285 K290 L291 S292	F266-I288 HydrophobicContact CE1-CG1 3.7Å; F266-I288 HydrophobicContact CZ-CG1 3.74Å; M284-I288 HydrophobicContact CG-CD1 3.95Å; M284-I288 HydrophobicContact CG-CG1 4.42Å; M284-I288 WeakPolarHBondContact O-CG1 3.5Å; M284-I288 PolarHBondContact O-N 2.93Å; A285-I288 PolarHBondContact O-N 3.36Å; I288-K290 PolarHBondContact O-N 2.78Å; I288-L291 WeakPolarHBondContact O-CB 3.34Å; I288-L291 PolarHBondContact O-N 3.33Å; I288-S292 WeakPolarHBondContact O-CB 3.34Å; I288-S292 PolarHBondContact O-N 2.72Å
289	E	94.7	Very high	92.8	Very high	101 Å²	101	102.4 Å²	102.4	47%	0.472	50%	0.499	S	S	.	.	H	α-helix	trans	-61.6	-44.3	177.4	-166.6	-163.4	159.8	0	0	111.7	A285 H287 L291 S292 K293	A285-E289 PolarHBondContact O-N 3.12Å; H287-E289 VanDerWaalsContact C-N 3.33Å; H287-E289 PolarHBondContact O-N 3.09Å; E289-L291 VanDerWaalsContact C-N 3.31Å; E289-L291 PolarHBondContact O-N 2.83Å; E289-S292 PolarHBondContact O-N 2.84Å; E289-K293 WeakPolarHBondContact O-CG 3.35Å; E289-K293 PolarHBondContact O-N 2.97Å; E289-K293 WeakPolarHBondContact OE1-CE 3.37Å; E289-K293 IonicContact OE1-NZ 3.52Å; E289-K293 PolarHBondContact OE1-NZ 2.79Å
290	K	93.1	Very high	92.6	Very high	141 Å²	141	104.1 Å²	104.1	61%	0.613	49%	0.494	S	S	*	.	H	α-helix	trans	-61.6	-39.5	174.5	-74.4	177	-178.8	-178.1	0	112.2	R286 H287 I288	R286-K290 WeakPolarHBondContact O-CG 3.37Å; R286-K290 PolarHBondContact O-N 2.87Å; H287-K290 PolarHBondContact O-N 2.72Å; I288-K290 PolarHBondContact O-N 2.78Å
291	L	91.2	Very high	92.4	Very high	78 Å²	78	109.9 Å²	109.9	41%	0.408	52%	0.521	S	S	.	.	H	α-helix	trans	-65.5	-52.9	176.2	-174.9	66.3	0	0	0	110	F266 H287 I288 E289 K293 K294 Y295	F266-L291 HydrophobicContact CE1-CD2 4.28Å; H287-L291 WeakPolarHBondContact O-CB 3.46Å; H287-L291 PolarHBondContact O-N 2.73Å; I288-L291 WeakPolarHBondContact O-CB 3.34Å; I288-L291 PolarHBondContact O-N 3.33Å; E289-L291 VanDerWaalsContact C-N 3.31Å; E289-L291 PolarHBondContact O-N 2.83Å; L291-K293 VanDerWaalsContact C-N 3.29Å; L291-K293 PolarHBondContact O-N 2.84Å; L291-K294 WeakPolarHBondContact O-CB 3.37Å; L291-K294 PolarHBondContact O-N 2.99Å; L291-Y295 HydrophobicContact CD1-CD2 4.45Å; L291-Y295 HydrophobicContact CD1-CE2 3.7Å; L291-Y295 HydrophobicContact CG-CD2 4.44Å; L291-Y295 HydrophobicContact CG-CE2 4.09Å; L291-Y295 VanDerWaalsContact O-CD2 3.26Å; L291-Y295 WeakPolarHBondContact O-CD2 3.32Å
292	S	93.3	Very high	92.2	Very high	51 Å²	51	110.1 Å²	110.1	36%	0.357	53%	0.528	S	S	.	.	H	α-helix	trans	-53.7	-43.3	178.5	179.8	0	0	0	0	112.1	I288 E289 K294 Y295 K296	I288-S292 WeakPolarHBondContact O-CB 3.34Å; I288-S292 PolarHBondContact O-N 2.72Å; E289-S292 PolarHBondContact O-N 2.84Å; S292-K294 PolarHBondContact O-N 2.73Å; S292-K294 VanDerWaalsContact O-N 3.16Å; S292-Y295 PolarHBondContact O-N 3.12Å; S292-K296 PolarHBondContact O-N 3.12Å; S292-K296 VanDerWaalsContact O-N 3.09Å; S292-K296 WeakPolarHBondContact OG-CE 3.26Å
293	K	95.1	Very high	92	Very high	127 Å²	127	110.1 Å²	110.1	55%	0.552	53%	0.529	S	S	*	.	H	α-helix	trans	-57.2	-27.6	175.8	-78.1	175.5	-176.4	169.1	0	114.2	E289 L291 Y295	E289-K293 WeakPolarHBondContact O-CG 3.35Å; E289-K293 PolarHBondContact O-N 2.97Å; E289-K293 WeakPolarHBondContact OE1-CE 3.37Å; E289-K293 IonicContact OE1-NZ 3.52Å; E289-K293 PolarHBondContact OE1-NZ 2.79Å; L291-K293 VanDerWaalsContact C-N 3.29Å; L291-K293 PolarHBondContact O-N 2.84Å; K293-Y295 VanDerWaalsContact C-N 3.32Å
294	K	92.6	Very high	91.9	Very high	172 Å²	172	113.9 Å²	113.9	75%	0.748	55%	0.55	S	S	*	.	H	α-helix	trans	-76.5	-19.4	176.4	-65.7	-177.5	175	-173	0	113.8	L291 S292	L291-K294 WeakPolarHBondContact O-CB 3.37Å; L291-K294 PolarHBondContact O-N 2.99Å; S292-K294 PolarHBondContact O-N 2.73Å; S292-K294 VanDerWaalsContact O-N 3.16Å
295	Y	92.6	Very high	91.7	Very high	179 Å²	179	121.3 Å²	121.3	70%	0.702	59%	0.585	S	S	*	*	H	α-helix	trans	-109.2	-3.9	-177.5	-65.3	-84.3	0	0	0	113	L291 S292 K293 T297	L291-Y295 HydrophobicContact CD1-CD2 4.45Å; L291-Y295 HydrophobicContact CD1-CE2 3.7Å; L291-Y295 HydrophobicContact CG-CD2 4.44Å; L291-Y295 HydrophobicContact CG-CE2 4.09Å; L291-Y295 VanDerWaalsContact O-CD2 3.26Å; L291-Y295 WeakPolarHBondContact O-CD2 3.32Å; S292-Y295 PolarHBondContact O-N 3.12Å; K293-Y295 VanDerWaalsContact C-N 3.32Å; Y295-T297 PolarHBondContact O-N 3.27Å
296	K	88.9	Confident	91.5	Very high	153 Å²	153	126.9 Å²	126.9	67%	0.665	60%	0.597	S	S	*	*			trans	-76.2	107	166	-70.4	-177.3	-179.5	-171.4	0	107.4	S292	S292-K296 PolarHBondContact O-N 3.12Å; S292-K296 VanDerWaalsContact O-N 3.09Å; S292-K296 WeakPolarHBondContact OG-CE 3.26Å
297	T	74.6	Confident	91.2	Very high	215 Å²	215	124.4 Å²	124.4	100%	1.319	60%	0.598	S	S	*	*			trans	-73.9	0	170.2	28.8	0	0	0	0	110.8	Y295	Y295-T297 PolarHBondContact O-N 3.27Å

Retrieved 297 of 297 residues in 133.3 ms (Link to these results)

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