B5X1D0_SALSA Loading...

Splicing factor 3A subunit 3

AlphaFold DB , UniProt , Accession B5X1D0, Species SALSA (Salmo salar, Atlantic salmon), Gene SF3A3, Length 501 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	56	Low	83.1	Confident	109 Å²	109	69 Å²	69	54%	0.537	32%	0.315	S	S	.	.				0	116	0	-99.2	-155	-69	0	0	106.5	Q90 I91	M1-Q90 HydrophobicContact CE-CB 3.44Å; M1-Q90 VanDerWaalsContact CE-CB 3.44Å; M1-Q90 HydrophobicContact CE-CG 4.48Å; M1-Q90 HydrophobicContact SD-CB 3.98Å; M1-Q90 PolarHBondContact SD-OE1 2.95Å; M1-I91 HydrophobicContact CE-CD1 4.4Å; M1-I91 HydrophobicContact CE-CG1 3.59Å
2	E	64.3	Low	84	Confident	119 Å²	119	69.8 Å²	69.8	56%	0.556	32%	0.319	S	S	*	.			trans	-98.3	90.9	178.4	-64.9	-163.1	152.3	0	0	108.9	Q7 R10	E2-Q7 HydrophobicContact CB-CG 3.94Å; E2-Q7 PolarHBondContact OE2-NE2 2.92Å; E2-R10 IonicContact OE1-CZ 3.86Å; E2-R10 IonicContact OE1-NH1 3.63Å; E2-R10 PolarHBondContact OE1-NH1 2.73Å; E2-R10 IonicContact OE1-NH2 2.93Å; E2-R10 PolarHBondContact OE1-NH2 2.93Å; E2-R10 VanDerWaalsContact OE1-NH2 3.12Å
3	T	82.4	Confident	84.7	Confident	44 Å²	44	68.6 Å²	68.6	27%	0.27	31%	0.314	S	S	.	.			trans	-77.2	157.9	166.9	59.6	0	0	0	0	109.8	L5 E6 Q7 E71	T3-L5 VanDerWaalsContact C-N 3.31Å; T3-L5 PolarHBondContact O-N 3.49Å; T3-E6 PolarHBondContact O-N 3.02Å; T3-E6 VanDerWaalsContact O-N 3.16Å; T3-E6 WeakPolarHBondContact OG1-CB 3.25Å; T3-E6 PolarHBondContact OG1-N 3.15Å; T3-Q7 WeakPolarHBondContact O-CG 3.25Å; T3-Q7 PolarHBondContact O-N 3.25Å; T3-E71 WeakPolarHBondContact CB-OE1 3.27Å
4	I	86.2	Confident	85.3	Confident	44 Å²	44	64.9 Å²	64.9	23%	0.226	30%	0.297	C	S	.	.	H	α-helix	trans	-64.9	-41.2	-175.6	-62.1	170.7	0	0	0	109.8	E6 Q7 Q8 M67 R68 E71	I4-E6 VanDerWaalsContact C-N 3.32Å; I4-E6 PolarHBondContact O-N 3.48Å; I4-Q7 PolarHBondContact O-N 2.97Å; I4-Q8 WeakPolarHBondContact O-CG 3.28Å; I4-Q8 PolarHBondContact O-N 3.3Å; I4-M67 HydrophobicContact CD1-CB 3.37Å; I4-R68 HydrophobicContact CG2-CB 4.18Å; I4-R68 HydrophobicContact CG2-CG 4.28Å; I4-E71 WeakPolarHBondContact CB-OE2 3.33Å; I4-E71 PolarHBondContact N-OE2 3.08Å
5	L	86.4	Confident	85.9	Confident	54 Å²	54	63.1 Å²	63.1	28%	0.283	29%	0.288	S	S	.	.	H	α-helix	trans	-64.4	-35.8	176.5	-63.6	179.6	0	0	0	112.8	T3 R9 R68 E71 I75	T3-L5 VanDerWaalsContact C-N 3.31Å; T3-L5 PolarHBondContact O-N 3.49Å; L5-R9 WeakPolarHBondContact O-CB 3.42Å; L5-R9 PolarHBondContact O-N 2.92Å; L5-R68 HydrophobicContact CD2-CG 4.49Å; L5-E71 PolarHBondContact N-OE2 2.9Å; L5-I75 HydrophobicContact CD1-CD1 3.43Å; L5-I75 VanDerWaalsContact CD1-CD1 3.43Å
6	E	86.2	Confident	86.4	Confident	72 Å²	72	66.4 Å²	66.4	34%	0.336	30%	0.304	S	S	.	.	H	α-helix	trans	-74.5	-37.7	176.6	173	49.7	-174.7	0	0	112	T3 I4 Q8 R9 R10	T3-E6 PolarHBondContact O-N 3.02Å; T3-E6 VanDerWaalsContact O-N 3.16Å; T3-E6 WeakPolarHBondContact OG1-CB 3.25Å; T3-E6 PolarHBondContact OG1-N 3.15Å; I4-E6 VanDerWaalsContact C-N 3.32Å; I4-E6 PolarHBondContact O-N 3.48Å; E6-Q8 VanDerWaalsContact C-N 3.31Å; E6-Q8 PolarHBondContact O-N 2.91Å; E6-R9 PolarHBondContact O-N 3.42Å; E6-R9 IonicContact OE1-NH1 3Å; E6-R9 PolarHBondContact OE1-NH1 2.84Å; E6-R9 VanDerWaalsContact OE1-NH1 3.1Å; E6-R9 WeakPolarHBondContact OE2-CD 3.47Å; E6-R9 IonicContact OE2-NH1 3.98Å; E6-R9 PolarHBondContact OE2-NH1 3.06Å; E6-R10 WeakPolarHBondContact O-CB 3.03Å; E6-R10 PolarHBondContact O-N 3.48Å
7	Q	88.1	Confident	86.8	Confident	53 Å²	53	67.8 Å²	67.8	25%	0.248	31%	0.306	C	S	.	.	H	α-helix	trans	-59	-45.1	171.4	-72.5	176.5	-14.7	0	0	110.8	E2 T3 I4 R10 Y11	E2-Q7 HydrophobicContact CB-CG 3.94Å; E2-Q7 PolarHBondContact OE2-NE2 2.92Å; T3-Q7 WeakPolarHBondContact O-CG 3.25Å; T3-Q7 PolarHBondContact O-N 3.25Å; I4-Q7 PolarHBondContact O-N 2.97Å; Q7-R10 PolarHBondContact O-N 2.88Å; Q7-Y11 HydrophobicContact CB-CE2 4.12Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.46Å; Q7-Y11 VanDerWaalsContact O-CG 3.31Å; Q7-Y11 PolarHBondContact O-N 3.09Å
8	Q	90.5	Very high	87.1	Confident	7 Å²	7	64.3 Å²	64.3	3%	0.033	29%	0.291	C	S	.	.	H	α-helix	trans	-60.9	-45.8	175.3	-72.4	178.8	17.4	0	0	112.2	I4 E6 R10 Y11 H12 A60 Y61	I4-Q8 WeakPolarHBondContact O-CG 3.28Å; I4-Q8 PolarHBondContact O-N 3.3Å; E6-Q8 VanDerWaalsContact C-N 3.31Å; E6-Q8 PolarHBondContact O-N 2.91Å; Q8-R10 PolarHBondContact O-N 2.85Å; Q8-Y11 PolarHBondContact O-N 3.42Å; Q8-H12 PolarHBondContact O-CD2 2.93Å; Q8-H12 PolarHBondContact O-N 3.45Å; Q8-A60 HydrophobicContact CG-CB 4.19Å; Q8-A60 PolarHBondContact NE2-O 3.34Å; Q8-Y61 PolarHBondContact OE1-OH 3.42Å
9	R	90.9	Very high	87.5	Confident	135 Å²	135	64.3 Å²	64.3	51%	0.509	29%	0.293	S	S	.	.	H	α-helix	trans	-58.3	-47.9	175.4	180	-172.2	156.6	-86	-19.7	110.8	L5 E6 Y11 H12 E13	L5-R9 WeakPolarHBondContact O-CB 3.42Å; L5-R9 PolarHBondContact O-N 2.92Å; E6-R9 PolarHBondContact O-N 3.42Å; E6-R9 IonicContact OE1-NH1 3Å; E6-R9 PolarHBondContact OE1-NH1 2.84Å; E6-R9 VanDerWaalsContact OE1-NH1 3.1Å; E6-R9 WeakPolarHBondContact OE2-CD 3.47Å; E6-R9 IonicContact OE2-NH1 3.98Å; E6-R9 PolarHBondContact OE2-NH1 3.06Å; R9-Y11 PolarHBondContact O-N 2.78Å; R9-H12 PolarHBondContact O-N 2.88Å; R9-E13 IonicContact CZ-OE2 3.94Å; R9-E13 IonicContact NH2-OE2 2.73Å; R9-E13 PolarHBondContact NH2-OE2 3.45Å; R9-E13 PolarHBondContact O-N 3.4Å
10	R	90.4	Very high	87.7	Confident	73 Å²	73	64.6 Å²	64.6	28%	0.275	30%	0.297	S	S	.	.	H	α-helix	trans	-59	-45.9	179.4	-177	178.8	71.3	-166.6	-2	111.6	E2 E6 Q7 Q8 H12 E13 E14 M106	E2-R10 IonicContact OE1-CZ 3.86Å; E2-R10 IonicContact OE1-NH1 3.63Å; E2-R10 PolarHBondContact OE1-NH1 2.73Å; E2-R10 IonicContact OE1-NH2 2.93Å; E2-R10 PolarHBondContact OE1-NH2 2.93Å; E2-R10 VanDerWaalsContact OE1-NH2 3.12Å; E6-R10 WeakPolarHBondContact O-CB 3.03Å; E6-R10 PolarHBondContact O-N 3.48Å; Q7-R10 PolarHBondContact O-N 2.88Å; Q8-R10 PolarHBondContact O-N 2.85Å; R10-H12 PolarHBondContact O-N 2.91Å; R10-E13 WeakPolarHBondContact O-CB 3.45Å; R10-E13 PolarHBondContact O-N 2.86Å; R10-E14 WeakPolarHBondContact O-CB 3.38Å; R10-E14 PolarHBondContact O-N 2.87Å; R10-M106 HydrophobicContact CG-CE 3.74Å
11	Y	92.6	Very high	87.9	Confident	49 Å²	49	62.1 Å²	62.1	19%	0.192	29%	0.288	C	S	.	.	H	α-helix	trans	-66.4	-36	177.9	-67.1	-46.9	0	0	0	113.1	Q7 Q8 R9 E14 K15 V53 T56 V57	Q7-Y11 HydrophobicContact CB-CE2 4.12Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.46Å; Q7-Y11 VanDerWaalsContact O-CG 3.31Å; Q7-Y11 PolarHBondContact O-N 3.09Å; Q8-Y11 PolarHBondContact O-N 3.42Å; R9-Y11 PolarHBondContact O-N 2.78Å; Y11-E14 PolarHBondContact O-N 2.81Å; Y11-K15 WeakPolarHBondContact O-CG 3.26Å; Y11-K15 PolarHBondContact O-N 2.81Å; Y11-V53 HydrophobicContact CD1-CG1 3.93Å; Y11-V53 HydrophobicContact CG-CG1 4.15Å; Y11-V53 WeakPolarHBondContact O-CG1 3.44Å; Y11-T56 HydrophobicContact CD2-CG2 4.49Å; Y11-T56 HydrophobicContact CE1-CG2 4.48Å; Y11-T56 HydrophobicContact CE2-CG2 3.84Å; Y11-V57 HydrophobicContact CD2-CG2 3.95Å; Y11-V57 HydrophobicContact CG-CG2 3.83Å
12	H	94.3	Very high	89.6	Confident	78 Å²	78	60 Å²	60	36%	0.361	28%	0.276	S	S	.	.	H	α-helix	trans	-66.6	-40.4	172.2	-79.9	-66.5	0	0	0	112.1	Q8 R9 R10 K15 E16 Y61	Q8-H12 PolarHBondContact O-CD2 2.93Å; Q8-H12 PolarHBondContact O-N 3.45Å; R9-H12 PolarHBondContact O-N 2.88Å; R10-H12 PolarHBondContact O-N 2.91Å; H12-K15 PolarHBondContact O-N 3.14Å; H12-E16 PolarHBondContact O-N 3.35Å; H12-E16 VanDerWaalsContact O-N 3.08Å; H12-Y61 AromaticContact NE2-CE2 3.46Å; H12-Y61 WeakPolarHBondContact NE2-CE2 3.38Å; H12-Y61 AromaticContact NE2-CZ 3.61Å; H12-Y61 PolarHBondContact NE2-OH 3.5Å
13	E	93.1	Very high	91	Very high	55 Å²	55	57.8 Å²	57.8	26%	0.257	27%	0.271	S	S	.	.	H	α-helix	trans	-58.7	-48.6	172.4	179.6	168.9	-171	0	0	110.4	R9 R10 K15 E16 R17 M106	R9-E13 IonicContact CZ-OE2 3.94Å; R9-E13 IonicContact NH2-OE2 2.73Å; R9-E13 PolarHBondContact NH2-OE2 3.45Å; R9-E13 PolarHBondContact O-N 3.4Å; R10-E13 WeakPolarHBondContact O-CB 3.45Å; R10-E13 PolarHBondContact O-N 2.86Å; E13-K15 VanDerWaalsContact C-N 3.34Å; E13-K15 PolarHBondContact O-N 3.2Å; E13-E16 PolarHBondContact O-N 3.33Å; E13-E16 VanDerWaalsContact O-N 3.14Å; E13-R17 HydrophobicContact CG-CG 4.35Å; E13-R17 VanDerWaalsContact O-CG 3.27Å; E13-R17 WeakPolarHBondContact O-CG 3.19Å; E13-R17 PolarHBondContact O-N 2.88Å; E13-R17 IonicContact OE1-NE 2.95Å; E13-R17 IonicContact OE1-NH2 3.37Å; E13-M106 HydrophobicContact CG-SD 4.45Å
14	E	92.9	Very high	91.4	Very high	17 Å²	17	61.5 Å²	61.5	8%	0.079	28%	0.283	C	S	.	.	H	α-helix	trans	-57.1	-44.9	178.3	-169.7	170.9	174.7	0	0	112.8	R10 Y11 E16 R17 L18 R49 V53 M106	R10-E14 WeakPolarHBondContact O-CB 3.38Å; R10-E14 PolarHBondContact O-N 2.87Å; Y11-E14 PolarHBondContact O-N 2.81Å; E14-E16 PolarHBondContact O-N 3.35Å; E14-R17 PolarHBondContact O-N 3.27Å; E14-L18 HydrophobicContact CG-CD1 4.12Å; E14-L18 WeakPolarHBondContact O-CB 3.21Å; E14-L18 VanDerWaalsContact O-CG 3.3Å; E14-L18 WeakPolarHBondContact O-CG 3.38Å; E14-L18 PolarHBondContact O-N 2.91Å; E14-R49 IonicContact OE1-CZ 2.95Å; E14-R49 IonicContact OE1-NE 3.18Å; E14-R49 PolarHBondContact OE1-NE 2.86Å; E14-R49 IonicContact OE1-NH2 3.73Å; E14-R49 PolarHBondContact OE1-NH2 3.48Å; E14-V53 HydrophobicContact CG-CG2 4.3Å; E14-M106 VanDerWaalsContact CA-SD 3.5Å; E14-M106 HydrophobicContact CB-CE 3.86Å; E14-M106 HydrophobicContact CB-SD 3.52Å; E14-M106 VanDerWaalsContact CB-SD 3.52Å; E14-M106 HydrophobicContact CG-CE 4.07Å; E14-M106 HydrophobicContact CG-SD 3.93Å
15	K	94.4	Very high	91.6	Very high	37 Å²	37	59.8 Å²	59.8	16%	0.161	27%	0.274	C	S	.	.	H	α-helix	trans	-58.7	-46	175	-78.1	178.7	61.8	173.2	0	112.5	Y11 H12 E13 R17 L18 L19 Y50 V53 S54	Y11-K15 WeakPolarHBondContact O-CG 3.26Å; Y11-K15 PolarHBondContact O-N 2.81Å; H12-K15 PolarHBondContact O-N 3.14Å; E13-K15 VanDerWaalsContact C-N 3.34Å; E13-K15 PolarHBondContact O-N 3.2Å; K15-R17 VanDerWaalsContact C-N 3.32Å; K15-L18 PolarHBondContact O-N 3.24Å; K15-L19 WeakPolarHBondContact O-CG 3.33Å; K15-L19 PolarHBondContact O-N 2.93Å; K15-Y50 HydrophobicContact CB-CD2 4.05Å; K15-Y50 HydrophobicContact CB-CE2 3.66Å; K15-Y50 HydrophobicContact CD-CE2 4.39Å; K15-Y50 VanDerWaalsContact CE-CZ 3.43Å; K15-Y50 VanDerWaalsContact CE-OH 3.29Å; K15-Y50 WeakPolarHBondContact CE-OH 3.29Å; K15-Y50 HydrophobicContact CG-CD2 4.03Å; K15-Y50 HydrophobicContact CG-CE2 3.86Å; K15-V53 HydrophobicContact CD-CG1 4.14Å; K15-V53 HydrophobicContact CG-CB 4.26Å; K15-V53 HydrophobicContact CG-CG1 3.68Å; K15-S54 WeakPolarHBondContact CE-OG 3.44Å; K15-S54 PolarHBondContact NZ-OG 3.38Å
16	E	94.4	Very high	91.8	Very high	117 Å²	117	62.2 Å²	62.2	55%	0.547	29%	0.286	S	S	.	.	H	α-helix	trans	-63.9	-41.6	179	-159.8	70.2	-178.2	0	0	110.7	H12 E13 E14 L18 L19 D20	H12-E16 PolarHBondContact O-N 3.35Å; H12-E16 VanDerWaalsContact O-N 3.08Å; E13-E16 PolarHBondContact O-N 3.33Å; E13-E16 VanDerWaalsContact O-N 3.14Å; E14-E16 PolarHBondContact O-N 3.35Å; E16-L18 PolarHBondContact O-N 2.83Å; E16-L19 PolarHBondContact O-N 3.1Å; E16-D20 PolarHBondContact O-N 3.29Å
17	R	92.1	Very high	92	Very high	90 Å²	90	66.1 Å²	66.1	34%	0.34	31%	0.305	S	S	.	.	H	α-helix	trans	-64.6	-39	176.4	-63.4	-60.3	-176.5	175.8	3.6	112.8	E13 E14 K15 L19 D20 A21 F110	E13-R17 HydrophobicContact CG-CG 4.35Å; E13-R17 VanDerWaalsContact O-CG 3.27Å; E13-R17 WeakPolarHBondContact O-CG 3.19Å; E13-R17 PolarHBondContact O-N 2.88Å; E13-R17 IonicContact OE1-NE 2.95Å; E13-R17 IonicContact OE1-NH2 3.37Å; E14-R17 PolarHBondContact O-N 3.27Å; K15-R17 VanDerWaalsContact C-N 3.32Å; R17-L19 VanDerWaalsContact C-N 3.34Å; R17-D20 PolarHBondContact O-N 3.16Å; R17-A21 VanDerWaalsContact O-CB 3.27Å; R17-A21 WeakPolarHBondContact O-CB 3.37Å; R17-A21 PolarHBondContact O-N 3.1Å; R17-F110 HydrophobicContact CB-CD1 4.29Å; R17-F110 HydrophobicContact CB-CD2 3.64Å; R17-F110 HydrophobicContact CB-CE1 3.96Å; R17-F110 HydrophobicContact CB-CE2 3.28Å; R17-F110 HydrophobicContact CB-CG 4.14Å; R17-F110 HydrophobicContact CB-CZ 3.45Å; R17-F110 VanDerWaalsContact CB-CZ 3.45Å; R17-F110 HydrophobicContact CG-CD2 4.15Å; R17-F110 HydrophobicContact CG-CE2 3.94Å
18	L	93.4	Very high	92	Very high	4 Å²	4	67.1 Å²	67.1	2%	0.021	31%	0.31	C	S	.	.	H	α-helix	trans	-63.2	-41	174.3	-74.5	161.9	0	0	0	111.4	E14 K15 E16 K22 M46 R49 Y50 F110	E14-L18 HydrophobicContact CG-CD1 4.12Å; E14-L18 WeakPolarHBondContact O-CB 3.21Å; E14-L18 VanDerWaalsContact O-CG 3.3Å; E14-L18 WeakPolarHBondContact O-CG 3.38Å; E14-L18 PolarHBondContact O-N 2.91Å; K15-L18 PolarHBondContact O-N 3.24Å; E16-L18 PolarHBondContact O-N 2.83Å; L18-K22 VanDerWaalsContact O-CB 3.25Å; L18-K22 WeakPolarHBondContact O-CB 2.97Å; L18-K22 PolarHBondContact O-N 3.08Å; L18-M46 HydrophobicContact CD2-CB 4.03Å; L18-M46 HydrophobicContact CD2-CG 4.23Å; L18-R49 HydrophobicContact CD1-CB 4.27Å; L18-R49 HydrophobicContact CD1-CG 3.96Å; L18-R49 HydrophobicContact CD2-CB 4.31Å; L18-R49 HydrophobicContact CD2-CG 4.34Å; L18-Y50 HydrophobicContact CB-CD2 4.16Å; L18-Y50 HydrophobicContact CD1-CD2 4.49Å; L18-F110 HydrophobicContact CD2-CE1 3.72Å; L18-F110 HydrophobicContact CD2-CZ 4.1Å; L18-F110 HydrophobicContact CG-CE1 3.9Å; L18-F110 HydrophobicContact CG-CZ 3.92Å
19	L	93.1	Very high	92	Very high	64 Å²	64	74.9 Å²	74.9	34%	0.335	34%	0.344	S	S	.	.	H	α-helix	trans	-64.6	-44.6	174.9	-70.7	172.8	0	0	0	111.8	K15 E16 R17 T23 Y50	K15-L19 WeakPolarHBondContact O-CG 3.33Å; K15-L19 PolarHBondContact O-N 2.93Å; E16-L19 PolarHBondContact O-N 3.1Å; R17-L19 VanDerWaalsContact C-N 3.34Å; L19-T23 VanDerWaalsContact O-CB 3.32Å; L19-T23 WeakPolarHBondContact O-CB 3.4Å; L19-T23 PolarHBondContact O-N 2.86Å; L19-T23 PolarHBondContact O-OG1 3.23Å; L19-Y50 HydrophobicContact CD1-CE2 3.84Å; L19-Y50 HydrophobicContact CD2-CD2 4.38Å; L19-Y50 HydrophobicContact CD2-CE2 3.95Å; L19-Y50 HydrophobicContact CG-CD2 4.19Å; L19-Y50 HydrophobicContact CG-CE2 3.65Å
20	D	92.4	Very high	91.9	Very high	70 Å²	70	70.9 Å²	70.9	37%	0.374	33%	0.33	S	S	.	.	H	α-helix	trans	-61	-47.5	175.8	-81.7	-12.7	0	0	0	111.5	E16 R17 T23 K24	E16-D20 PolarHBondContact O-N 3.29Å; R17-D20 PolarHBondContact O-N 3.16Å; D20-T23 PolarHBondContact O-N 3.15Å; D20-K24 WeakPolarHBondContact O-CG 3.29Å; D20-K24 PolarHBondContact O-N 3.16Å
21	A	91.5	Very high	91.7	Very high	14 Å²	14	72.8 Å²	72.8	12%	0.116	35%	0.35	C	S	.	.	H	α-helix	trans	-62.9	-47.8	-179.8	0	0	0	0	0	111.4	R17 T23 K24 E25 M46 F110	R17-A21 VanDerWaalsContact O-CB 3.27Å; R17-A21 WeakPolarHBondContact O-CB 3.37Å; R17-A21 PolarHBondContact O-N 3.1Å; A21-T23 VanDerWaalsContact C-N 3.31Å; A21-T23 PolarHBondContact O-N 2.7Å; A21-K24 PolarHBondContact O-N 3.3Å; A21-E25 WeakPolarHBondContact O-CB 3.34Å; A21-E25 PolarHBondContact O-N 3.05Å; A21-M46 HydrophobicContact CB-CE 4.31Å; A21-M46 HydrophobicContact CB-SD 3.87Å; A21-F110 HydrophobicContact CB-CD1 3.71Å; A21-F110 HydrophobicContact CB-CE1 4.26Å
22	K	92.6	Very high	91.5	Very high	63 Å²	63	72.1 Å²	72.1	27%	0.274	35%	0.351	S	S	.	.	H	α-helix	trans	-56.9	-44.9	172.8	169.8	175	175.7	-175.5	0	111.6	L18 K24 E25 M26 T43 M46 L47	L18-K22 VanDerWaalsContact O-CB 3.25Å; L18-K22 WeakPolarHBondContact O-CB 2.97Å; L18-K22 PolarHBondContact O-N 3.08Å; K22-K24 PolarHBondContact O-N 3.43Å; K22-E25 PolarHBondContact O-N 2.86Å; K22-M26 HydrophobicContact CG-CG 4.29Å; K22-M26 WeakPolarHBondContact O-CB 3.37Å; K22-M26 VanDerWaalsContact O-CG 3.26Å; K22-M26 WeakPolarHBondContact O-CG 3.48Å; K22-M26 PolarHBondContact O-N 3.17Å; K22-T43 HydrophobicContact CD-CG2 4.01Å; K22-T43 HydrophobicContact CG-CG2 3.91Å; K22-M46 HydrophobicContact CB-SD 4.35Å; K22-L47 HydrophobicContact CD-CD2 3.94Å; K22-L47 HydrophobicContact CD-CG 4.24Å
23	T	92.4	Very high	91.2	Very high	74 Å²	74	71.5 Å²	71.5	45%	0.454	35%	0.35	S	S	.	.	H	α-helix	trans	-63.5	-44	-178.7	-58.8	0	0	0	0	110.8	L19 D20 A21 E25 M26 M27	L19-T23 VanDerWaalsContact O-CB 3.32Å; L19-T23 WeakPolarHBondContact O-CB 3.4Å; L19-T23 PolarHBondContact O-N 2.86Å; L19-T23 PolarHBondContact O-OG1 3.23Å; D20-T23 PolarHBondContact O-N 3.15Å; A21-T23 VanDerWaalsContact C-N 3.31Å; A21-T23 PolarHBondContact O-N 2.7Å; T23-E25 VanDerWaalsContact C-N 3.32Å; T23-E25 PolarHBondContact O-N 3.3Å; T23-M26 PolarHBondContact O-N 3.46Å; T23-M27 HydrophobicContact CG2-SD 4.17Å; T23-M27 WeakPolarHBondContact O-CB 2.95Å; T23-M27 VanDerWaalsContact O-CG 3.25Å; T23-M27 WeakPolarHBondContact O-CG 3.33Å; T23-M27 PolarHBondContact O-N 3.37Å
24	K	91.3	Very high	91	Very high	122 Å²	122	70.7 Å²	70.7	53%	0.53	35%	0.345	S	S	.	.	H	α-helix	trans	-61.3	-40.7	175	-72.3	174.2	-176.4	177.3	0	112.2	D20 A21 K22 M27 H28	D20-K24 WeakPolarHBondContact O-CG 3.29Å; D20-K24 PolarHBondContact O-N 3.16Å; A21-K24 PolarHBondContact O-N 3.3Å; K22-K24 PolarHBondContact O-N 3.43Å; K24-M27 PolarHBondContact O-N 2.78Å; K24-H28 PolarHBondContact O-N 3.06Å; K24-H28 VanDerWaalsContact O-N 3.09Å
25	E	90.8	Very high	90.7	Very high	7 Å²	7	71.9 Å²	71.9	3%	0.033	35%	0.35	C	S	.	.	H	α-helix	trans	-65.1	-43.8	177.8	-171.7	64.8	-175	0	0	111.8	A21 K22 T23 M27 H28 S39 R42 R117	A21-E25 WeakPolarHBondContact O-CB 3.34Å; A21-E25 PolarHBondContact O-N 3.05Å; K22-E25 PolarHBondContact O-N 2.86Å; T23-E25 VanDerWaalsContact C-N 3.32Å; T23-E25 PolarHBondContact O-N 3.3Å; E25-M27 VanDerWaalsContact C-N 3.29Å; E25-M27 PolarHBondContact O-N 2.82Å; E25-H28 WeakPolarHBondContact O-CB 3.49Å; E25-H28 PolarHBondContact O-N 3.43Å; E25-S39 VanDerWaalsContact CD-OG 3.26Å; E25-S39 VanDerWaalsContact CG-OG 3.24Å; E25-S39 WeakPolarHBondContact CG-OG 3.45Å; E25-S39 WeakPolarHBondContact OE1-CA 3.46Å; E25-S39 WeakPolarHBondContact OE1-CB 3.42Å; E25-S39 PolarHBondContact OE1-OG 3.36Å; E25-R42 IonicContact OE1-CZ 2.86Å; E25-R42 VanDerWaalsContact OE1-CZ 3.28Å; E25-R42 IonicContact OE1-NE 3.78Å; E25-R42 PolarHBondContact OE1-NE 3.41Å; E25-R42 IonicContact OE1-NH2 3.65Å; E25-R42 PolarHBondContact OE1-NH2 2.94Å; E25-R117 VanDerWaalsContact OE2-CD 3.29Å; E25-R117 WeakPolarHBondContact OE2-CD 3.4Å; E25-R117 IonicContact OE2-CZ 3.38Å; E25-R117 IonicContact OE2-NE 2.7Å; E25-R117 IonicContact OE2-NH1 3.12Å; E25-R117 PolarHBondContact OE2-NH1 3.47Å
26	M	90	Very high	90.6	Very high	106 Å²	106	74.5 Å²	74.5	52%	0.522	36%	0.363	S	S	.	.	H	α-helix	trans	-67	-28.2	175.6	-69.4	-68.1	-65.1	0	0	113.3	K22 T23	K22-M26 HydrophobicContact CG-CG 4.29Å; K22-M26 WeakPolarHBondContact O-CB 3.37Å; K22-M26 VanDerWaalsContact O-CG 3.26Å; K22-M26 WeakPolarHBondContact O-CG 3.48Å; K22-M26 PolarHBondContact O-N 3.17Å; T23-M26 PolarHBondContact O-N 3.46Å
27	M	90.9	Very high	90.5	Very high	153 Å²	153	69.1 Å²	69.1	75%	0.754	34%	0.338	S	S	*	.	H	α-helix	trans	-80.3	-17.8	175	-73.2	-177.9	72.1	0	0	113	T23 K24 E25	T23-M27 HydrophobicContact CG2-SD 4.17Å; T23-M27 WeakPolarHBondContact O-CB 2.95Å; T23-M27 VanDerWaalsContact O-CG 3.25Å; T23-M27 WeakPolarHBondContact O-CG 3.33Å; T23-M27 PolarHBondContact O-N 3.37Å; K24-M27 PolarHBondContact O-N 2.78Å; E25-M27 VanDerWaalsContact C-N 3.29Å; E25-M27 PolarHBondContact O-N 2.82Å
28	H	88.6	Confident	90.4	Very high	74 Å²	74	65.3 Å²	65.3	34%	0.343	32%	0.324	S	S	.	.	S	Bend	trans	-69	135.7	178.2	-165	66.2	0	0	0	110.2	K24 E25 K30 E35	K24-H28 PolarHBondContact O-N 3.06Å; K24-H28 VanDerWaalsContact O-N 3.09Å; E25-H28 WeakPolarHBondContact O-CB 3.49Å; E25-H28 PolarHBondContact O-N 3.43Å; H28-K30 PolarHBondContact O-N 2.93Å; H28-E35 IonicContact CD2-OE1 2.76Å; H28-E35 PolarHBondContact CD2-OE1 3.03Å; H28-E35 IonicContact NE2-OE1 2.6Å
29	K	88.9	Confident	90.3	Very high	171 Å²	171	65.1 Å²	65.1	74%	0.743	32%	0.323	S	S	*	.			trans	-83.8	111.3	-179.2	-177.1	-175.3	174.4	-168.3	0	108.8
30	K	89.1	Confident	90.4	Very high	51 Å²	51	63.1 Å²	63.1	22%	0.222	31%	0.313	C	S	.	.			trans	-79.5	131.3	174.5	-57.6	145	-176.9	-159.5	0	109.5	H28 E35 Q36 S39 D40	H28-K30 PolarHBondContact O-N 2.93Å; K30-E35 VanDerWaalsContact CA-OE2 3.31Å; K30-E35 WeakPolarHBondContact CA-OE2 3.39Å; K30-Q36 HydrophobicContact CB-CB 4.21Å; K30-Q36 HydrophobicContact CD-CB 4.13Å; K30-Q36 HydrophobicContact CD-CG 4.16Å; K30-Q36 HydrophobicContact CG-CB 4.48Å; K30-S39 VanDerWaalsContact CE-CB 3.41Å; K30-S39 WeakPolarHBondContact CE-OG 3.45Å; K30-S39 PolarHBondContact NZ-OG 2.81Å; K30-D40 IonicContact NZ-OD1 2.71Å; K30-D40 PolarHBondContact NZ-OD1 3.15Å
31	T	87.1	Confident	90.4	Very high	112 Å²	112	61.2 Å²	61.2	69%	0.687	30%	0.302	S	S	*	.			trans	-101.3	-37.5	-179.7	54	0	0	0	0	112.3	E35	T31-E35 PolarHBondContact N-OE2 2.91Å; T31-E35 PolarHBondContact OG1-OE2 3.23Å
32	T	87.6	Confident	90.4	Very high	36 Å²	36	62.3 Å²	62.3	22%	0.221	30%	0.303	C	S	.	.	S	Bend	trans	-110.9	159.4	-177.5	71.5	0	0	0	0	112.1	R34 E35 Q36	T32-R34 VanDerWaalsContact C-N 3.31Å; T32-E35 PolarHBondContact O-N 3.41Å; T32-E35 VanDerWaalsContact OG1-CB 3.31Å; T32-E35 WeakPolarHBondContact OG1-CB 3.33Å; T32-E35 PolarHBondContact OG1-N 3.38Å; T32-E35 VanDerWaalsContact OG1-N 3.08Å; T32-Q36 WeakPolarHBondContact O-CB 3.22Å; T32-Q36 PolarHBondContact O-N 3.45Å
33	L	88.6	Confident	90.5	Very high	64 Å²	64	59.3 Å²	59.3	34%	0.335	29%	0.29	S	S	.	.	H	α-helix	trans	-62.3	-41.1	174.6	177.2	62.5	0	0	0	111.1	Q36 I37 R138	L33-Q36 WeakPolarHBondContact O-CB 3.33Å; L33-Q36 PolarHBondContact O-N 3.32Å; L33-I37 HydrophobicContact CD1-CD1 3.97Å; L33-I37 HydrophobicContact CD1-CG1 4.26Å; L33-I37 HydrophobicContact CG-CD1 3.93Å; L33-I37 WeakPolarHBondContact O-CG1 3.23Å; L33-I37 PolarHBondContact O-N 3.22Å; L33-R138 HydrophobicContact CD2-CB 3.99Å
34	R	88.1	Confident	90.6	Very high	39 Å²	39	59.8 Å²	59.8	15%	0.147	28%	0.283	C	S	.	.	H	α-helix	trans	-60.4	-47.4	177.4	-179	176.9	-175.8	-174.2	4	111.7	T32 Q36 I37 N38 Q125 N126 Y136 S367	T32-R34 VanDerWaalsContact C-N 3.31Å; R34-Q36 VanDerWaalsContact C-N 3.3Å; R34-Q36 PolarHBondContact O-N 3.41Å; R34-I37 PolarHBondContact O-N 3.2Å; R34-N38 WeakPolarHBondContact O-CB 3.4Å; R34-N38 VanDerWaalsContact O-CG 3.28Å; R34-N38 PolarHBondContact O-N 3.21Å; R34-N38 PolarHBondContact O-ND2 3.14Å; R34-Q125 VanDerWaalsContact NH2-CD 3.27Å; R34-N126 PolarHBondContact NE-OD1 3.27Å; R34-N126 PolarHBondContact NH2-ND2 3.14Å; R34-N126 PolarHBondContact NH2-OD1 3.43Å; R34-Y136 HydrophobicContact CB-CD1 3.81Å; R34-Y136 HydrophobicContact CB-CE1 4.17Å; R34-Y136 HydrophobicContact CB-CG 4.36Å; R34-Y136 HydrophobicContact CG-CD1 3.65Å; R34-Y136 HydrophobicContact CG-CD2 4.47Å; R34-Y136 HydrophobicContact CG-CE1 3.62Å; R34-Y136 HydrophobicContact CG-CE2 4.48Å; R34-Y136 HydrophobicContact CG-CG 4.07Å; R34-S367 PolarHBondContact NH1-O 3.34Å
35	E	87.6	Confident	90.6	Very high	42 Å²	42	56.5 Å²	56.5	20%	0.196	28%	0.279	C	S	.	.	H	α-helix	trans	-61.3	-41.4	176.3	-168.3	-165	172.1	0	0	111.3	H28 K30 T31 T32 N38 S39	H28-E35 IonicContact CD2-OE1 2.76Å; H28-E35 PolarHBondContact CD2-OE1 3.03Å; H28-E35 IonicContact NE2-OE1 2.6Å; K30-E35 VanDerWaalsContact CA-OE2 3.31Å; K30-E35 WeakPolarHBondContact CA-OE2 3.39Å; T31-E35 PolarHBondContact N-OE2 2.91Å; T31-E35 PolarHBondContact OG1-OE2 3.23Å; T32-E35 PolarHBondContact O-N 3.41Å; T32-E35 VanDerWaalsContact OG1-CB 3.31Å; T32-E35 WeakPolarHBondContact OG1-CB 3.33Å; T32-E35 PolarHBondContact OG1-N 3.38Å; T32-E35 VanDerWaalsContact OG1-N 3.08Å; E35-N38 PolarHBondContact O-N 3.14Å; E35-S39 WeakPolarHBondContact O-CB 3.24Å; E35-S39 PolarHBondContact O-N 3.09Å
36	Q	91.6	Very high	90.7	Very high	91 Å²	91	57 Å²	57	43%	0.425	28%	0.282	S	S	.	.	H	α-helix	trans	-60.5	-51.4	176.5	175.5	173.4	-7.2	0	0	112	K30 T32 L33 R34 N38 S39 D40	K30-Q36 HydrophobicContact CB-CB 4.21Å; K30-Q36 HydrophobicContact CD-CB 4.13Å; K30-Q36 HydrophobicContact CD-CG 4.16Å; K30-Q36 HydrophobicContact CG-CB 4.48Å; T32-Q36 WeakPolarHBondContact O-CB 3.22Å; T32-Q36 PolarHBondContact O-N 3.45Å; L33-Q36 WeakPolarHBondContact O-CB 3.33Å; L33-Q36 PolarHBondContact O-N 3.32Å; R34-Q36 VanDerWaalsContact C-N 3.3Å; R34-Q36 PolarHBondContact O-N 3.41Å; Q36-N38 VanDerWaalsContact C-N 3.35Å; Q36-N38 PolarHBondContact O-N 3.32Å; Q36-S39 WeakPolarHBondContact O-CB 3.47Å; Q36-S39 PolarHBondContact O-N 2.98Å; Q36-D40 WeakPolarHBondContact O-CB 3.21Å; Q36-D40 PolarHBondContact O-N 3.2Å
37	I	92.8	Very high	90.9	Very high	4 Å²	4	54.4 Å²	54.4	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-61.1	-45.1	179.5	-72	170.2	0	0	0	110.5	L33 R34 S39 D40 H41 V128 F130 Y136	L33-I37 HydrophobicContact CD1-CD1 3.97Å; L33-I37 HydrophobicContact CD1-CG1 4.26Å; L33-I37 HydrophobicContact CG-CD1 3.93Å; L33-I37 WeakPolarHBondContact O-CG1 3.23Å; L33-I37 PolarHBondContact O-N 3.22Å; R34-I37 PolarHBondContact O-N 3.2Å; I37-S39 VanDerWaalsContact C-N 3.34Å; I37-S39 PolarHBondContact O-N 3.34Å; I37-D40 PolarHBondContact O-N 3.29Å; I37-H41 PolarHBondContact O-CD2 3.27Å; I37-H41 VanDerWaalsContact O-CD2 3.26Å; I37-H41 PolarHBondContact O-N 3.25Å; I37-V128 HydrophobicContact CG2-CG1 3.79Å; I37-F130 HydrophobicContact CD1-CE2 4.5Å; I37-F130 HydrophobicContact CD1-CZ 4.36Å; I37-F130 HydrophobicContact CG2-CE2 4.17Å; I37-F130 HydrophobicContact CG2-CZ 4.49Å; I37-Y136 HydrophobicContact CB-CD1 4.35Å; I37-Y136 HydrophobicContact CB-CE1 3.99Å; I37-Y136 HydrophobicContact CD1-CD1 4.16Å; I37-Y136 WeakPolarHBondContact CD1-O 3.23Å; I37-Y136 HydrophobicContact CG2-CD1 4.35Å; I37-Y136 HydrophobicContact CG2-CE1 3.77Å
38	N	90.9	Very high	91.1	Very high	10 Å²	10	50.4 Å²	50.4	5%	0.053	25%	0.251	C	S	.	.	H	α-helix	trans	-60.1	-43.8	176.9	-78.3	-23	0	0	0	112.8	R34 E35 Q36 D40 H41 R42 Q125 M127 Y136	R34-N38 WeakPolarHBondContact O-CB 3.4Å; R34-N38 VanDerWaalsContact O-CG 3.28Å; R34-N38 PolarHBondContact O-N 3.21Å; R34-N38 PolarHBondContact O-ND2 3.14Å; E35-N38 PolarHBondContact O-N 3.14Å; Q36-N38 VanDerWaalsContact C-N 3.35Å; Q36-N38 PolarHBondContact O-N 3.32Å; N38-D40 VanDerWaalsContact C-N 3.31Å; N38-D40 PolarHBondContact O-N 3.41Å; N38-H41 PolarHBondContact O-N 3.28Å; N38-R42 WeakPolarHBondContact O-CG 3.44Å; N38-R42 PolarHBondContact O-N 2.95Å; N38-Q125 PolarHBondContact ND2-O 3.16Å; N38-M127 HydrophobicContact CB-CG 4.02Å; N38-M127 WeakPolarHBondContact OD1-CB 3.4Å; N38-M127 PolarHBondContact OD1-N 3.42Å; N38-Y136 PolarHBondContact OD1-OH 3.32Å
39	S	91.3	Very high	91.4	Very high	1 Å²	1	50.9 Å²	50.9	1%	0.007	25%	0.25	C	C	.	.	H	α-helix	trans	-62.9	-39.8	176.3	-176.5	0	0	0	0	112.2	E25 K30 E35 Q36 I37 R42 T43	E25-S39 VanDerWaalsContact CD-OG 3.26Å; E25-S39 VanDerWaalsContact CG-OG 3.24Å; E25-S39 WeakPolarHBondContact CG-OG 3.45Å; E25-S39 WeakPolarHBondContact OE1-CA 3.46Å; E25-S39 WeakPolarHBondContact OE1-CB 3.42Å; E25-S39 PolarHBondContact OE1-OG 3.36Å; K30-S39 VanDerWaalsContact CE-CB 3.41Å; K30-S39 WeakPolarHBondContact CE-OG 3.45Å; K30-S39 PolarHBondContact NZ-OG 2.81Å; E35-S39 WeakPolarHBondContact O-CB 3.24Å; E35-S39 PolarHBondContact O-N 3.09Å; Q36-S39 WeakPolarHBondContact O-CB 3.47Å; Q36-S39 PolarHBondContact O-N 2.98Å; I37-S39 VanDerWaalsContact C-N 3.34Å; I37-S39 PolarHBondContact O-N 3.34Å; S39-R42 PolarHBondContact O-N 3.33Å; S39-T43 WeakPolarHBondContact O-CB 3.44Å; S39-T43 PolarHBondContact O-N 2.67Å; S39-T43 PolarHBondContact O-OG1 3.45Å
40	D	94.3	Very high	91.7	Very high	22 Å²	22	45.8 Å²	45.8	12%	0.118	23%	0.227	C	C	.	.	H	α-helix	trans	-68.8	-38	178.8	-67.4	-3.7	0	0	0	110.8	K30 Q36 I37 N38 T43 R44 P202 L203	K30-D40 IonicContact NZ-OD1 2.71Å; K30-D40 PolarHBondContact NZ-OD1 3.15Å; Q36-D40 WeakPolarHBondContact O-CB 3.21Å; Q36-D40 PolarHBondContact O-N 3.2Å; I37-D40 PolarHBondContact O-N 3.29Å; N38-D40 VanDerWaalsContact C-N 3.31Å; N38-D40 PolarHBondContact O-N 3.41Å; D40-T43 WeakPolarHBondContact O-CB 3.39Å; D40-T43 PolarHBondContact O-N 3.27Å; D40-R44 PolarHBondContact O-N 2.91Å; D40-P202 HydrophobicContact CB-CG 3.69Å; D40-L203 HydrophobicContact CB-CD1 4.02Å; D40-L203 HydrophobicContact CB-CG 4.09Å; D40-L203 WeakPolarHBondContact O-CD2 3.31Å
41	H	93.4	Very high	92	Very high	29 Å²	29	49.4 Å²	49.4	13%	0.134	25%	0.246	C	C	.	.	H	α-helix	trans	-65.5	-44.3	171.4	-85	-70.6	0	0	0	113.1	I37 N38 T43 R44 A45 M127 V128 R199 P202	I37-H41 PolarHBondContact O-CD2 3.27Å; I37-H41 VanDerWaalsContact O-CD2 3.26Å; I37-H41 PolarHBondContact O-N 3.25Å; N38-H41 PolarHBondContact O-N 3.28Å; H41-T43 PolarHBondContact O-N 2.86Å; H41-R44 WeakPolarHBondContact O-CB 3.32Å; H41-R44 PolarHBondContact O-N 2.97Å; H41-R44 VanDerWaalsContact O-N 3.17Å; H41-A45 PolarHBondContact O-N 2.68Å; H41-M127 HydrophobicContact CB-CB 3.73Å; H41-M127 HydrophobicContact CB-CG 4.36Å; H41-V128 WeakPolarHBondContact NE2-CG1 3.4Å; H41-R199 PolarHBondContact NE2-O 3.11Å; H41-P202 HydrophobicContact CB-CG 4.49Å
42	R	90.9	Very high	92.4	Very high	37 Å²	37	49.3 Å²	49.3	14%	0.14	24%	0.241	C	C	.	.	H	α-helix	trans	-57.3	-43.3	172.4	-74.7	-172.5	-63.9	-100.2	2.8	111	E25 N38 S39 A45 M46 M127	E25-R42 IonicContact OE1-CZ 2.86Å; E25-R42 VanDerWaalsContact OE1-CZ 3.28Å; E25-R42 IonicContact OE1-NE 3.78Å; E25-R42 PolarHBondContact OE1-NE 3.41Å; E25-R42 IonicContact OE1-NH2 3.65Å; E25-R42 PolarHBondContact OE1-NH2 2.94Å; N38-R42 WeakPolarHBondContact O-CG 3.44Å; N38-R42 PolarHBondContact O-N 2.95Å; S39-R42 PolarHBondContact O-N 3.33Å; R42-A45 PolarHBondContact O-N 3.41Å; R42-M46 WeakPolarHBondContact O-CG 3.31Å; R42-M46 PolarHBondContact O-N 3.36Å; R42-M127 HydrophobicContact CG-CE 3.87Å; R42-M127 HydrophobicContact CG-CG 4.26Å; R42-M127 HydrophobicContact CG-SD 3.99Å
43	T	93.4	Very high	92.8	Very high	1 Å²	1	48 Å²	48	1%	0.006	23%	0.233	C	C	.	.	H	α-helix	trans	-64.6	-39.8	177.8	-60.7	0	0	0	0	111.7	K22 S39 D40 H41 M46 L47 L203	K22-T43 HydrophobicContact CD-CG2 4.01Å; K22-T43 HydrophobicContact CG-CG2 3.91Å; S39-T43 WeakPolarHBondContact O-CB 3.44Å; S39-T43 PolarHBondContact O-N 2.67Å; S39-T43 PolarHBondContact O-OG1 3.45Å; D40-T43 WeakPolarHBondContact O-CB 3.39Å; D40-T43 PolarHBondContact O-N 3.27Å; H41-T43 PolarHBondContact O-N 2.86Å; T43-M46 PolarHBondContact O-N 2.83Å; T43-L47 HydrophobicContact CG2-CD1 4.19Å; T43-L47 WeakPolarHBondContact O-CG 3.31Å; T43-L47 PolarHBondContact O-N 2.96Å; T43-L203 HydrophobicContact CG2-CD1 4.26Å; T43-L203 HydrophobicContact CG2-CD2 3.75Å
44	R	94.4	Very high	93.1	Very high	83 Å²	83	46.4 Å²	46.4	31%	0.313	23%	0.227	S	C	.	.	H	α-helix	trans	-59.4	-50.2	173	-177.6	-177.6	178.3	114.2	-11.2	111.1	D40 H41 M46 L47 D48 P202 L203	D40-R44 PolarHBondContact O-N 2.91Å; H41-R44 WeakPolarHBondContact O-CB 3.32Å; H41-R44 PolarHBondContact O-N 2.97Å; H41-R44 VanDerWaalsContact O-N 3.17Å; R44-M46 VanDerWaalsContact C-N 3.28Å; R44-M46 PolarHBondContact O-N 3.37Å; R44-L47 WeakPolarHBondContact O-CA 3.42Å; R44-L47 WeakPolarHBondContact O-CB 3.41Å; R44-L47 PolarHBondContact O-N 2.8Å; R44-D48 IonicContact NE-OD2 2.72Å; R44-D48 PolarHBondContact O-N 3.33Å; R44-P202 HydrophobicContact CB-CB 4.25Å; R44-P202 WeakPolarHBondContact CD-O 3.14Å; R44-P202 PolarHBondContact NH1-O 2.81Å; R44-L203 HydrophobicContact CB-CD2 4.2Å
45	A	92.4	Very high	93.5	Very high	53 Å²	53	46.3 Å²	46.3	44%	0.438	23%	0.232	S	C	.	.	H	α-helix	trans	-58.7	-38.8	178.3	0	0	0	0	0	112.6	H41 R42 L47 R49	H41-A45 PolarHBondContact O-N 2.68Å; R42-A45 PolarHBondContact O-N 3.41Å; A45-L47 VanDerWaalsContact C-N 3.34Å; A45-R49 WeakPolarHBondContact O-CB 3.28Å; A45-R49 PolarHBondContact O-N 2.98Å
46	M	93.2	Very high	93.7	Very high	19 Å²	19	47 Å²	47	9%	0.094	24%	0.24	C	C	.	.	H	α-helix	trans	-65.1	-37	173.3	-67.7	178.6	-160.6	0	0	112.4	L18 A21 K22 R42 T43 R44 Y50 L113	L18-M46 HydrophobicContact CD2-CB 4.03Å; L18-M46 HydrophobicContact CD2-CG 4.23Å; A21-M46 HydrophobicContact CB-CE 4.31Å; A21-M46 HydrophobicContact CB-SD 3.87Å; K22-M46 HydrophobicContact CB-SD 4.35Å; R42-M46 WeakPolarHBondContact O-CG 3.31Å; R42-M46 PolarHBondContact O-N 3.36Å; T43-M46 PolarHBondContact O-N 2.83Å; R44-M46 VanDerWaalsContact C-N 3.28Å; R44-M46 PolarHBondContact O-N 3.37Å; M46-Y50 VanDerWaalsContact O-CB 3.3Å; M46-Y50 WeakPolarHBondContact O-CB 3.37Å; M46-Y50 PolarHBondContact O-N 2.63Å; M46-L113 HydrophobicContact CE-CD1 4.34Å
47	L	93.9	Very high	93.8	Very high	50 Å²	50	43 Å²	43	26%	0.262	22%	0.221	S	C	.	.	H	α-helix	trans	-69.3	-42.6	177.2	-74.4	167	0	0	0	112.1	K22 T43 R44 A45 Y50 M51 L203	K22-L47 HydrophobicContact CD-CD2 3.94Å; K22-L47 HydrophobicContact CD-CG 4.24Å; T43-L47 HydrophobicContact CG2-CD1 4.19Å; T43-L47 WeakPolarHBondContact O-CG 3.31Å; T43-L47 PolarHBondContact O-N 2.96Å; R44-L47 WeakPolarHBondContact O-CA 3.42Å; R44-L47 WeakPolarHBondContact O-CB 3.41Å; R44-L47 PolarHBondContact O-N 2.8Å; A45-L47 VanDerWaalsContact C-N 3.34Å; L47-Y50 WeakPolarHBondContact O-CB 3.31Å; L47-Y50 PolarHBondContact O-N 2.76Å; L47-Y50 VanDerWaalsContact O-N 3.14Å; L47-M51 WeakPolarHBondContact O-CG 3.46Å; L47-M51 PolarHBondContact O-N 2.94Å; L47-L203 HydrophobicContact CD1-CD2 4.03Å
48	D	94.4	Very high	93.9	Very high	70 Å²	70	50.1 Å²	50.1	37%	0.374	25%	0.248	S	C	.	.	H	α-helix	trans	-60.2	-49.1	176.3	-66.3	-22.8	0	0	0	110	R44 Y50 M51 D52	R44-D48 IonicContact NE-OD2 2.72Å; R44-D48 PolarHBondContact O-N 3.33Å; D48-Y50 VanDerWaalsContact C-N 3.29Å; D48-Y50 PolarHBondContact O-N 2.93Å; D48-M51 WeakPolarHBondContact O-CB 3.34Å; D48-M51 PolarHBondContact O-N 2.98Å; D48-M51 VanDerWaalsContact O-N 3.09Å; D48-D52 PolarHBondContact O-N 3.44Å
49	R	94.4	Very high	93.9	Very high	83 Å²	83	55 Å²	55	31%	0.313	27%	0.27	S	S	.	.	H	α-helix	trans	-58.1	-40.7	173.6	-171.4	174.4	172.9	176.8	1.4	111.9	E14 L18 A45 M51 D52 V53 E109	E14-R49 IonicContact OE1-CZ 2.95Å; E14-R49 IonicContact OE1-NE 3.18Å; E14-R49 PolarHBondContact OE1-NE 2.86Å; E14-R49 IonicContact OE1-NH2 3.73Å; E14-R49 PolarHBondContact OE1-NH2 3.48Å; L18-R49 HydrophobicContact CD1-CB 4.27Å; L18-R49 HydrophobicContact CD1-CG 3.96Å; L18-R49 HydrophobicContact CD2-CB 4.31Å; L18-R49 HydrophobicContact CD2-CG 4.34Å; A45-R49 WeakPolarHBondContact O-CB 3.28Å; A45-R49 PolarHBondContact O-N 2.98Å; R49-M51 VanDerWaalsContact C-N 3.34Å; R49-M51 PolarHBondContact O-N 3.27Å; R49-D52 PolarHBondContact O-N 3.44Å; R49-V53 HydrophobicContact CG-CG2 4.44Å; R49-V53 WeakPolarHBondContact O-CB 3.48Å; R49-V53 WeakPolarHBondContact O-CG2 3.49Å; R49-V53 PolarHBondContact O-N 3.49Å; R49-E109 IonicContact CZ-OE2 3.18Å; R49-E109 IonicContact NH1-OE2 3.33Å; R49-E109 PolarHBondContact NH1-OE2 3.45Å; R49-E109 IonicContact NH2-OE2 3.1Å; R49-E109 PolarHBondContact NH2-OE2 3.45Å
50	Y	95.8	Very high	93.7	Very high	65 Å²	65	56.4 Å²	56.4	26%	0.255	28%	0.282	S	S	.	.	H	α-helix	trans	-63.9	-39	177.1	-178.6	-84.1	0	0	0	112.3	K15 L18 L19 M46 L47 D48 S54	K15-Y50 HydrophobicContact CB-CD2 4.05Å; K15-Y50 HydrophobicContact CB-CE2 3.66Å; K15-Y50 HydrophobicContact CD-CE2 4.39Å; K15-Y50 VanDerWaalsContact CE-CZ 3.43Å; K15-Y50 VanDerWaalsContact CE-OH 3.29Å; K15-Y50 WeakPolarHBondContact CE-OH 3.29Å; K15-Y50 HydrophobicContact CG-CD2 4.03Å; K15-Y50 HydrophobicContact CG-CE2 3.86Å; L18-Y50 HydrophobicContact CB-CD2 4.16Å; L18-Y50 HydrophobicContact CD1-CD2 4.49Å; L19-Y50 HydrophobicContact CD1-CE2 3.84Å; L19-Y50 HydrophobicContact CD2-CD2 4.38Å; L19-Y50 HydrophobicContact CD2-CE2 3.95Å; L19-Y50 HydrophobicContact CG-CD2 4.19Å; L19-Y50 HydrophobicContact CG-CE2 3.65Å; M46-Y50 VanDerWaalsContact O-CB 3.3Å; M46-Y50 WeakPolarHBondContact O-CB 3.37Å; M46-Y50 PolarHBondContact O-N 2.63Å; L47-Y50 WeakPolarHBondContact O-CB 3.31Å; L47-Y50 PolarHBondContact O-N 2.76Å; L47-Y50 VanDerWaalsContact O-N 3.14Å; D48-Y50 VanDerWaalsContact C-N 3.29Å; D48-Y50 PolarHBondContact O-N 2.93Å; Y50-S54 WeakPolarHBondContact CE1-OG 3.49Å; Y50-S54 WeakPolarHBondContact O-CB 3.39Å; Y50-S54 PolarHBondContact O-N 2.96Å; Y50-S54 PolarHBondContact O-OG 3.38Å
51	M	95.3	Very high	93.5	Very high	126 Å²	126	59.6 Å²	59.6	62%	0.621	29%	0.293	S	S	*	.	H	α-helix	trans	-66.6	-44.9	176.9	-72.9	179.9	61	0	0	111.3	L47 D48 R49 S54 S55	L47-M51 WeakPolarHBondContact O-CG 3.46Å; L47-M51 PolarHBondContact O-N 2.94Å; D48-M51 WeakPolarHBondContact O-CB 3.34Å; D48-M51 PolarHBondContact O-N 2.98Å; D48-M51 VanDerWaalsContact O-N 3.09Å; R49-M51 VanDerWaalsContact C-N 3.34Å; R49-M51 PolarHBondContact O-N 3.27Å; M51-S54 WeakPolarHBondContact O-CB 3.44Å; M51-S54 PolarHBondContact O-N 3.38Å; M51-S55 PolarHBondContact O-N 2.96Å
52	D	96.1	Very high	93.4	Very high	110 Å²	110	62.8 Å²	62.8	59%	0.588	31%	0.308	S	S	*	.	H	α-helix	trans	-62	-48.1	178.1	-71.5	-18.7	0	0	0	112	D48 R49 S54 S55 T56	D48-D52 PolarHBondContact O-N 3.44Å; R49-D52 PolarHBondContact O-N 3.44Å; D52-S54 VanDerWaalsContact C-N 3.3Å; D52-S54 PolarHBondContact O-N 2.93Å; D52-S55 PolarHBondContact O-N 3.23Å; D52-T56 PolarHBondContact O-N 3.38Å; D52-T56 PolarHBondContact O-OG1 3.43Å
53	V	95.4	Very high	93.3	Very high	10 Å²	10	61.7 Å²	61.7	6%	0.061	31%	0.305	C	S	.	.	H	α-helix	trans	-62.2	-41.1	175.8	176.9	0	0	0	0	110.1	Y11 E14 K15 R49 S55 T56 V57	Y11-V53 HydrophobicContact CD1-CG1 3.93Å; Y11-V53 HydrophobicContact CG-CG1 4.15Å; Y11-V53 WeakPolarHBondContact O-CG1 3.44Å; E14-V53 HydrophobicContact CG-CG2 4.3Å; K15-V53 HydrophobicContact CD-CG1 4.14Å; K15-V53 HydrophobicContact CG-CB 4.26Å; K15-V53 HydrophobicContact CG-CG1 3.68Å; R49-V53 HydrophobicContact CG-CG2 4.44Å; R49-V53 WeakPolarHBondContact O-CB 3.48Å; R49-V53 WeakPolarHBondContact O-CG2 3.49Å; R49-V53 PolarHBondContact O-N 3.49Å; V53-S55 PolarHBondContact O-N 3.02Å; V53-T56 PolarHBondContact O-N 2.9Å; V53-V57 HydrophobicContact CG1-CG2 4.27Å; V53-V57 WeakPolarHBondContact O-CB 3.45Å; V53-V57 WeakPolarHBondContact O-CG2 3.25Å; V53-V57 PolarHBondContact O-N 3.42Å
54	S	95.9	Very high	93	Very high	30 Å²	30	70 Å²	70	21%	0.21	34%	0.341	C	S	.	.	H	α-helix	trans	-64.1	-38.5	177.5	-66.9	0	0	0	0	112.9	K15 Y50 M51 D52 R58	K15-S54 WeakPolarHBondContact CE-OG 3.44Å; K15-S54 PolarHBondContact NZ-OG 3.38Å; Y50-S54 WeakPolarHBondContact CE1-OG 3.49Å; Y50-S54 WeakPolarHBondContact O-CB 3.39Å; Y50-S54 PolarHBondContact O-N 2.96Å; Y50-S54 PolarHBondContact O-OG 3.38Å; M51-S54 WeakPolarHBondContact O-CB 3.44Å; M51-S54 PolarHBondContact O-N 3.38Å; D52-S54 VanDerWaalsContact C-N 3.3Å; D52-S54 PolarHBondContact O-N 2.93Å; S54-R58 WeakPolarHBondContact O-CB 3.38Å; S54-R58 PolarHBondContact O-N 3.04Å
55	S	95.7	Very high	92.7	Very high	36 Å²	36	71.2 Å²	71.2	25%	0.252	35%	0.354	S	S	.	.	H	α-helix	trans	-66.2	-45.8	175	-164.1	0	0	0	0	111	M51 D52 V53 V57 R58 E59	M51-S55 PolarHBondContact O-N 2.96Å; D52-S55 PolarHBondContact O-N 3.23Å; V53-S55 PolarHBondContact O-N 3.02Å; S55-V57 VanDerWaalsContact C-N 3.33Å; S55-V57 PolarHBondContact O-N 3.25Å; S55-R58 WeakPolarHBondContact O-CB 3.48Å; S55-R58 PolarHBondContact O-N 2.93Å; S55-R58 PolarHBondContact OG-NH2 2.85Å; S55-E59 WeakPolarHBondContact O-CG 3.43Å; S55-E59 PolarHBondContact O-N 3.21Å; S55-E59 PolarHBondContact OG-OE1 3.08Å
56	T	93	Very high	92.5	Very high	58 Å²	58	69.6 Å²	69.6	36%	0.356	34%	0.343	S	S	.	.	H	α-helix	trans	-59.1	-44.1	177.9	-54.9	0	0	0	0	111.5	Y11 D52 V53 E59 A60	Y11-T56 HydrophobicContact CD2-CG2 4.49Å; Y11-T56 HydrophobicContact CE1-CG2 4.48Å; Y11-T56 HydrophobicContact CE2-CG2 3.84Å; D52-T56 PolarHBondContact O-N 3.38Å; D52-T56 PolarHBondContact O-OG1 3.43Å; V53-T56 PolarHBondContact O-N 2.9Å; T56-E59 PolarHBondContact O-N 3.33Å; T56-A60 WeakPolarHBondContact O-CB 3.35Å; T56-A60 PolarHBondContact O-N 3.43Å
57	V	92.7	Very high	92.2	Very high	6 Å²	6	73.3 Å²	73.3	4%	0.036	36%	0.361	C	S	.	.	H	α-helix	trans	-63.1	-44.6	176.6	169.7	0	0	0	0	111.4	Y11 V53 S55 E59 A60 Y61	Y11-V57 HydrophobicContact CD2-CG2 3.95Å; Y11-V57 HydrophobicContact CG-CG2 3.83Å; V53-V57 HydrophobicContact CG1-CG2 4.27Å; V53-V57 WeakPolarHBondContact O-CB 3.45Å; V53-V57 WeakPolarHBondContact O-CG2 3.25Å; V53-V57 PolarHBondContact O-N 3.42Å; S55-V57 VanDerWaalsContact C-N 3.33Å; S55-V57 PolarHBondContact O-N 3.25Å; V57-E59 VanDerWaalsContact C-N 3.33Å; V57-E59 PolarHBondContact O-N 2.87Å; V57-A60 PolarHBondContact O-N 3.18Å; V57-Y61 HydrophobicContact CG1-CD2 3.59Å; V57-Y61 HydrophobicContact CG1-CE2 3.36Å; V57-Y61 WeakPolarHBondContact O-CD2 3.25Å; V57-Y61 PolarHBondContact O-N 2.97Å
58	R	93.9	Very high	91.8	Very high	153 Å²	153	74.5 Å²	74.5	58%	0.577	36%	0.362	S	S	*	.	H	α-helix	trans	-58.5	-46.7	177.2	177.8	-179.2	59.2	-179	-4.9	110.8	S54 S55 A60 Y61 E62	S54-R58 WeakPolarHBondContact O-CB 3.38Å; S54-R58 PolarHBondContact O-N 3.04Å; S55-R58 WeakPolarHBondContact O-CB 3.48Å; S55-R58 PolarHBondContact O-N 2.93Å; S55-R58 PolarHBondContact OG-NH2 2.85Å; R58-A60 VanDerWaalsContact C-N 3.34Å; R58-A60 PolarHBondContact O-N 3.24Å; R58-Y61 PolarHBondContact O-N 3.44Å; R58-Y61 VanDerWaalsContact O-N 3.12Å; R58-E62 PolarHBondContact O-N 2.93Å
59	E	91.3	Very high	91.5	Very high	112 Å²	112	77.4 Å²	77.4	52%	0.523	37%	0.371	S	S	.	.	H	α-helix	trans	-61.7	-41	176.6	-71.1	173.1	-157.2	0	0	112.1	S55 T56 V57 Y61 E62	S55-E59 WeakPolarHBondContact O-CG 3.43Å; S55-E59 PolarHBondContact O-N 3.21Å; S55-E59 PolarHBondContact OG-OE1 3.08Å; T56-E59 PolarHBondContact O-N 3.33Å; V57-E59 VanDerWaalsContact C-N 3.33Å; V57-E59 PolarHBondContact O-N 2.87Å; E59-Y61 PolarHBondContact O-N 3.15Å; E59-E62 WeakPolarHBondContact O-CB 3.4Å; E59-E62 PolarHBondContact O-N 3.07Å
60	A	88.7	Confident	91.2	Very high	31 Å²	31	78 Å²	78	26%	0.256	38%	0.381	S	S	.	.	H	α-helix	trans	-64.2	-25.9	175.2	0	0	0	0	0	113.3	Q8 T56 V57 R58	Q8-A60 HydrophobicContact CG-CB 4.19Å; Q8-A60 PolarHBondContact NE2-O 3.34Å; T56-A60 WeakPolarHBondContact O-CB 3.35Å; T56-A60 PolarHBondContact O-N 3.43Å; V57-A60 PolarHBondContact O-N 3.18Å; R58-A60 VanDerWaalsContact C-N 3.34Å; R58-A60 PolarHBondContact O-N 3.24Å
61	Y	88.6	Confident	90.8	Very high	90 Å²	90	76 Å²	76	35%	0.353	37%	0.374	S	S	.	.	H	α-helix	trans	-84.7	-26.2	173.8	-79.9	-65.5	0	0	0	113.9	Q8 H12 V57 R58 E59 D63 R68	Q8-Y61 PolarHBondContact OE1-OH 3.42Å; H12-Y61 AromaticContact NE2-CE2 3.46Å; H12-Y61 WeakPolarHBondContact NE2-CE2 3.38Å; H12-Y61 AromaticContact NE2-CZ 3.61Å; H12-Y61 PolarHBondContact NE2-OH 3.5Å; V57-Y61 HydrophobicContact CG1-CD2 3.59Å; V57-Y61 HydrophobicContact CG1-CE2 3.36Å; V57-Y61 WeakPolarHBondContact O-CD2 3.25Å; V57-Y61 PolarHBondContact O-N 2.97Å; R58-Y61 PolarHBondContact O-N 3.44Å; R58-Y61 VanDerWaalsContact O-N 3.12Å; E59-Y61 PolarHBondContact O-N 3.15Å; Y61-D63 PolarHBondContact O-N 2.9Å; Y61-R68 VanDerWaalsContact CD1-CZ 3.49Å
62	E	91.4	Very high	90.4	Very high	96 Å²	96	74.2 Å²	74.2	45%	0.449	37%	0.366	S	S	.	.	H	α-helix	trans	-61.5	-27.8	173.9	-73.5	179	-176.8	0	0	111.8	R58 E59 K64	R58-E62 PolarHBondContact O-N 2.93Å; E59-E62 WeakPolarHBondContact O-CB 3.4Å; E59-E62 PolarHBondContact O-N 3.07Å; E62-K64 VanDerWaalsContact C-N 3.32Å; E62-K64 HydrophobicContact CB-CG 4.43Å; E62-K64 PolarHBondContact O-N 3.29Å; E62-K64 WeakPolarHBondContact OE2-CE 3.43Å; E62-K64 IonicContact OE2-NZ 3.5Å; E62-K64 PolarHBondContact OE2-NZ 3.2Å
63	D	88.4	Confident	89.9	Confident	14 Å²	14	73.9 Å²	73.9	8%	0.075	36%	0.364	C	S	.	.			trans	52.1	47.9	170.1	-174.3	45.3	0	0	0	112.3	Y61 D65 G66 M67 R68 K69	Y61-D63 PolarHBondContact O-N 2.9Å; D63-D65 PolarHBondContact O-N 2.64Å; D63-G66 PolarHBondContact O-N 2.96Å; D63-G66 VanDerWaalsContact O-N 3.14Å; D63-G66 VanDerWaalsContact OD1-CA 3.25Å; D63-G66 WeakPolarHBondContact OD1-CA 3.47Å; D63-G66 PolarHBondContact OD1-N 3.1Å; D63-M67 PolarHBondContact OD1-N 3.16Å; D63-R68 HydrophobicContact CB-CB 4.25Å; D63-R68 WeakPolarHBondContact OD1-CB 3.23Å; D63-R68 PolarHBondContact OD1-N 3.48Å; D63-K69 VanDerWaalsContact OD2-CD 3.29Å; D63-K69 WeakPolarHBondContact OD2-CD 3.25Å; D63-K69 WeakPolarHBondContact OD2-CE 3.48Å; D63-K69 VanDerWaalsContact OD2-CG 3.24Å; D63-K69 WeakPolarHBondContact OD2-CG 3.43Å; D63-K69 IonicContact OD2-NZ 2.87Å
64	K	87.4	Confident	89.4	Confident	174 Å²	174	75.3 Å²	75.3	76%	0.757	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-62.2	-29.2	-176.8	-71.4	178	-179.3	142.8	0	112.8	E62	E62-K64 VanDerWaalsContact C-N 3.32Å; E62-K64 HydrophobicContact CB-CG 4.43Å; E62-K64 PolarHBondContact O-N 3.29Å; E62-K64 WeakPolarHBondContact OE2-CE 3.43Å; E62-K64 IonicContact OE2-NZ 3.5Å; E62-K64 PolarHBondContact OE2-NZ 3.2Å
65	D	87.5	Confident	88.8	Confident	110 Å²	110	77 Å²	77	59%	0.588	38%	0.383	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.4	-10.2	178.7	59.1	1.1	0	0	0	113.5	D63 M67	D63-D65 PolarHBondContact O-N 2.64Å; D65-M67 HydrophobicContact CB-CG 3.97Å; D65-M67 VanDerWaalsContact CG-CG 3.45Å; D65-M67 PolarHBondContact O-N 2.92Å; D65-M67 PolarHBondContact OD1-N 3.09Å; D65-M67 WeakPolarHBondContact OD2-CG 3.43Å
66	G	88.5	Confident	88.3	Confident	19 Å²	19	79.3 Å²	79.3	20%	0.196	40%	0.4	C	S	.	.	S	Bend	trans	74.1	1.1	-179.4	0	0	0	0	0	114.6	D63 R68 K69 D70	D63-G66 PolarHBondContact O-N 2.96Å; D63-G66 VanDerWaalsContact O-N 3.14Å; D63-G66 VanDerWaalsContact OD1-CA 3.25Å; D63-G66 WeakPolarHBondContact OD1-CA 3.47Å; D63-G66 PolarHBondContact OD1-N 3.1Å; G66-R68 VanDerWaalsContact C-N 3.26Å; G66-R68 PolarHBondContact O-N 3.28Å; G66-K69 WeakPolarHBondContact O-CB 3.42Å; G66-K69 PolarHBondContact O-N 3.25Å; G66-K69 VanDerWaalsContact O-N 3.17Å; G66-D70 PolarHBondContact O-N 3.16Å; G66-D70 VanDerWaalsContact O-N 3.08Å
67	M	86.9	Confident	87.7	Confident	97 Å²	97	77.5 Å²	77.5	48%	0.478	39%	0.393	S	S	.	.	H	α-helix	trans	-66.8	-30.2	-171.8	-67.1	-72.7	166	0	0	112	I4 D63 D65 D70 E71	I4-M67 HydrophobicContact CD1-CB 3.37Å; D63-M67 PolarHBondContact OD1-N 3.16Å; D65-M67 HydrophobicContact CB-CG 3.97Å; D65-M67 VanDerWaalsContact CG-CG 3.45Å; D65-M67 PolarHBondContact O-N 2.92Å; D65-M67 PolarHBondContact OD1-N 3.09Å; D65-M67 WeakPolarHBondContact OD2-CG 3.43Å; M67-D70 PolarHBondContact O-N 3.37Å; M67-E71 WeakPolarHBondContact O-CB 3.27Å; M67-E71 PolarHBondContact O-N 3.5Å
68	R	87	Confident	87.1	Confident	74 Å²	74	83.7 Å²	83.7	28%	0.279	43%	0.433	S	S	.	.	H	α-helix	trans	-67.4	-42.2	176.3	-174.5	-168.6	172.9	-129.2	-11.9	111	I4 L5 Y61 D63 G66 E71 L72	I4-R68 HydrophobicContact CG2-CB 4.18Å; I4-R68 HydrophobicContact CG2-CG 4.28Å; L5-R68 HydrophobicContact CD2-CG 4.49Å; Y61-R68 VanDerWaalsContact CD1-CZ 3.49Å; D63-R68 HydrophobicContact CB-CB 4.25Å; D63-R68 WeakPolarHBondContact OD1-CB 3.23Å; D63-R68 PolarHBondContact OD1-N 3.48Å; G66-R68 VanDerWaalsContact C-N 3.26Å; G66-R68 PolarHBondContact O-N 3.28Å; R68-E71 PolarHBondContact O-N 3.16Å; R68-L72 WeakPolarHBondContact O-CB 3.46Å; R68-L72 PolarHBondContact O-N 2.93Å
69	K	88.2	Confident	86.5	Confident	131 Å²	131	82.3 Å²	82.3	57%	0.57	44%	0.437	S	S	*	.	H	α-helix	trans	-63.6	-43.2	175.5	-77.1	165.7	-169.5	162.9	0	111	D63 G66 L72 N73	D63-K69 VanDerWaalsContact OD2-CD 3.29Å; D63-K69 WeakPolarHBondContact OD2-CD 3.25Å; D63-K69 WeakPolarHBondContact OD2-CE 3.48Å; D63-K69 VanDerWaalsContact OD2-CG 3.24Å; D63-K69 WeakPolarHBondContact OD2-CG 3.43Å; D63-K69 IonicContact OD2-NZ 2.87Å; G66-K69 WeakPolarHBondContact O-CB 3.42Å; G66-K69 PolarHBondContact O-N 3.25Å; G66-K69 VanDerWaalsContact O-N 3.17Å; K69-L72 PolarHBondContact O-N 2.91Å; K69-N73 WeakPolarHBondContact O-CB 3.19Å; K69-N73 PolarHBondContact O-N 2.86Å; K69-N73 PolarHBondContact O-ND2 2.94Å
70	D	87.9	Confident	86.1	Confident	97 Å²	97	81.5 Å²	81.5	52%	0.519	43%	0.433	S	S	.	.	H	α-helix	trans	-63.1	-43.4	178.4	-72.3	-13.9	0	0	0	111.6	G66 M67 L72 N73 A74	G66-D70 PolarHBondContact O-N 3.16Å; G66-D70 VanDerWaalsContact O-N 3.08Å; M67-D70 PolarHBondContact O-N 3.37Å; D70-L72 PolarHBondContact O-N 2.84Å; D70-N73 PolarHBondContact O-N 2.88Å; D70-A74 WeakPolarHBondContact O-CB 3.28Å; D70-A74 PolarHBondContact O-N 3.37Å
71	E	87.4	Confident	85.9	Confident	22 Å²	22	87.4 Å²	87.4	10%	0.103	45%	0.453	C	S	.	.	H	α-helix	trans	-62.1	-44.3	174.5	-168.1	-174.4	170.8	0	0	111.6	T3 I4 L5 M67 R68 N73 A74 I75 R87	T3-E71 WeakPolarHBondContact CB-OE1 3.27Å; I4-E71 WeakPolarHBondContact CB-OE2 3.33Å; I4-E71 PolarHBondContact N-OE2 3.08Å; L5-E71 PolarHBondContact N-OE2 2.9Å; M67-E71 WeakPolarHBondContact O-CB 3.27Å; M67-E71 PolarHBondContact O-N 3.5Å; R68-E71 PolarHBondContact O-N 3.16Å; E71-N73 VanDerWaalsContact C-N 3.34Å; E71-N73 PolarHBondContact O-N 2.69Å; E71-A74 WeakPolarHBondContact O-CB 3.23Å; E71-A74 PolarHBondContact O-N 2.95Å; E71-I75 HydrophobicContact CG-CD1 4.16Å; E71-I75 WeakPolarHBondContact O-CG1 3.43Å; E71-I75 PolarHBondContact O-N 2.98Å; E71-R87 IonicContact OE1-CZ 3.1Å; E71-R87 IonicContact OE1-NH1 3.71Å; E71-R87 PolarHBondContact OE1-NH1 3.36Å; E71-R87 IonicContact OE1-NH2 3.6Å
72	L	86.2	Confident	85.7	Confident	88 Å²	88	85.7 Å²	85.7	46%	0.461	46%	0.457	S	S	.	.	H	α-helix	trans	-63.5	-40.8	179.2	-171.5	67.5	0	0	0	111.8	R68 K69 D70 A74 I75 S76	R68-L72 WeakPolarHBondContact O-CB 3.46Å; R68-L72 PolarHBondContact O-N 2.93Å; K69-L72 PolarHBondContact O-N 2.91Å; D70-L72 PolarHBondContact O-N 2.84Å; L72-A74 VanDerWaalsContact C-N 3.32Å; L72-I75 PolarHBondContact O-N 2.83Å; L72-S76 PolarHBondContact O-N 3.24Å
73	N	86.6	Confident	85.4	Confident	103 Å²	103	84 Å²	84	55%	0.551	45%	0.449	S	S	*	.	H	α-helix	trans	-66.8	-33.2	175.9	-71.2	-25.9	0	0	0	112.2	K69 D70 E71 I75 S76 G77	K69-N73 WeakPolarHBondContact O-CB 3.19Å; K69-N73 PolarHBondContact O-N 2.86Å; K69-N73 PolarHBondContact O-ND2 2.94Å; D70-N73 PolarHBondContact O-N 2.88Å; E71-N73 VanDerWaalsContact C-N 3.34Å; E71-N73 PolarHBondContact O-N 2.69Å; N73-I75 VanDerWaalsContact C-N 3.34Å; N73-S76 CarbonylContact O-C 3.53Å; N73-G77 WeakPolarHBondContact O-CA 3.37Å; N73-G77 PolarHBondContact O-N 3.22Å
74	A	84.3	Confident	85.2	Confident	41 Å²	41	89.3 Å²	89.3	34%	0.339	47%	0.472	S	S	.	.	H	α-helix	trans	-67.9	-35.3	174	0	0	0	0	0	111.9	D70 E71 L72	D70-A74 WeakPolarHBondContact O-CB 3.28Å; D70-A74 PolarHBondContact O-N 3.37Å; E71-A74 WeakPolarHBondContact O-CB 3.23Å; E71-A74 PolarHBondContact O-N 2.95Å; L72-A74 VanDerWaalsContact C-N 3.32Å
75	I	84	Confident	85.3	Confident	65 Å²	65	88 Å²	88	33%	0.333	46%	0.464	S	S	.	.	H	α-helix	trans	-75.9	-45.7	177.4	-63.4	165.4	0	0	0	111.3	L5 E71 L72 N73 E80	L5-I75 HydrophobicContact CD1-CD1 3.43Å; L5-I75 VanDerWaalsContact CD1-CD1 3.43Å; E71-I75 HydrophobicContact CG-CD1 4.16Å; E71-I75 WeakPolarHBondContact O-CG1 3.43Å; E71-I75 PolarHBondContact O-N 2.98Å; L72-I75 PolarHBondContact O-N 2.83Å; N73-I75 VanDerWaalsContact C-N 3.34Å; I75-E80 VanDerWaalsContact O-CG 3.32Å; I75-E80 WeakPolarHBondContact O-CG 3.04Å
76	S	84.3	Confident	85.2	Confident	85 Å²	85	87.1 Å²	87.1	59%	0.594	46%	0.459	S	S	*	.	S	Bend	trans	-104.6	49.3	-176.8	-161.4	0	0	0	0	111.6	L72 N73	L72-S76 PolarHBondContact O-N 3.24Å; N73-S76 CarbonylContact O-C 3.53Å
77	G	80.3	Confident	85	Confident	20 Å²	20	88.6 Å²	88.6	21%	0.206	46%	0.458	C	S	.	.	S	Bend	trans	-115.6	-176	-178.2	0	0	0	0	0	113	N73 N79 E80	N73-G77 WeakPolarHBondContact O-CA 3.37Å; N73-G77 PolarHBondContact O-N 3.22Å; G77-N79 PolarHBondContact O-N 3.07Å; G77-N79 VanDerWaalsContact O-N 3.13Å; G77-E80 WeakPolarHBondContact O-CG 3.35Å
78	P	79.6	Confident	85	Confident	136 Å²	136	86.5 Å²	86.5	88%	0.883	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.3	-18.5	179.5	-22	33.1	0	0	0	114.9
79	N	82.3	Confident	85.2	Confident	123 Å²	123	89.1 Å²	89.1	66%	0.658	46%	0.462	S	S	*	.	T	Hydrogen-bonded Turn	trans	-117	33.8	-172	-68.5	-28.6	0	0	0	113.2	G77 F81 A82 E83	G77-N79 PolarHBondContact O-N 3.07Å; G77-N79 VanDerWaalsContact O-N 3.13Å; N79-F81 VanDerWaalsContact C-N 3.29Å; N79-F81 PolarHBondContact O-N 3.32Å; N79-A82 HydrophobicContact CB-CB 4.48Å; N79-A82 PolarHBondContact O-N 3.3Å; N79-A82 VanDerWaalsContact O-N 3.08Å; N79-E83 PolarHBondContact O-N 3.21Å
80	E	82.8	Confident	85.1	Confident	95 Å²	95	87.6 Å²	87.6	44%	0.444	46%	0.457	S	S	.	.	H	α-helix	trans	-51	-44.9	-174	-44.8	-174.4	151.9	0	0	113.1	I75 G77 A82 E83 F84	I75-E80 VanDerWaalsContact O-CG 3.32Å; I75-E80 WeakPolarHBondContact O-CG 3.04Å; G77-E80 WeakPolarHBondContact O-CG 3.35Å; E80-A82 PolarHBondContact O-N 2.99Å; E80-E83 PolarHBondContact O-N 3.48Å; E80-F84 WeakPolarHBondContact O-CB 3.45Å; E80-F84 PolarHBondContact O-N 3.18Å
81	F	83.6	Confident	85	Confident	156 Å²	156	86.6 Å²	86.6	68%	0.684	45%	0.451	S	S	*	.	H	α-helix	trans	-64	-41.3	-178.9	-73.3	-73.8	0	0	0	112.5	N79 F84 Y85	N79-F81 VanDerWaalsContact C-N 3.29Å; N79-F81 PolarHBondContact O-N 3.32Å; F81-F84 PolarHBondContact O-N 3.31Å; F81-Y85 HydrophobicContact CB-CE2 4.45Å; F81-Y85 WeakPolarHBondContact O-CD2 2.94Å; F81-Y85 PolarHBondContact O-N 3.32Å
82	A	86.2	Confident	85	Confident	53 Å²	53	92 Å²	92	44%	0.438	47%	0.474	S	S	.	.	H	α-helix	trans	-65.8	-42.5	-180	0	0	0	0	0	110.9	N79 E80 Y85 N86	N79-A82 HydrophobicContact CB-CB 4.48Å; N79-A82 PolarHBondContact O-N 3.3Å; N79-A82 VanDerWaalsContact O-N 3.08Å; E80-A82 PolarHBondContact O-N 2.99Å; A82-Y85 PolarHBondContact O-N 2.61Å; A82-N86 WeakPolarHBondContact O-CB 3.37Å; A82-N86 PolarHBondContact O-N 3.34Å; A82-N86 PolarHBondContact O-ND2 3.38Å
83	E	84.4	Confident	85.2	Confident	60 Å²	60	92 Å²	92	28%	0.28	47%	0.472	S	S	.	.	H	α-helix	trans	-62.7	-44.7	176.3	-177.5	62.8	-169.8	0	0	111.6	N79 E80 Y85 N86 R87	N79-E83 PolarHBondContact O-N 3.21Å; E80-E83 PolarHBondContact O-N 3.48Å; E83-Y85 PolarHBondContact O-N 3.4Å; E83-N86 PolarHBondContact O-N 3.26Å; E83-R87 WeakPolarHBondContact O-CG 3.13Å; E83-R87 PolarHBondContact O-N 3.34Å; E83-R87 IonicContact OE1-CZ 2.88Å; E83-R87 IonicContact OE1-NE 3.88Å; E83-R87 PolarHBondContact OE1-NE 2.92Å; E83-R87 IonicContact OE1-NH2 3.79Å; E83-R87 PolarHBondContact OE1-NH2 3.11Å
84	F	83.6	Confident	85	Confident	127 Å²	127	91 Å²	91	56%	0.557	46%	0.463	S	S	*	.	H	α-helix	trans	-58	-48.2	175.7	-180	-94.6	0	0	0	112.4	E80 F81 N86 R87 L88	E80-F84 WeakPolarHBondContact O-CB 3.45Å; E80-F84 PolarHBondContact O-N 3.18Å; F81-F84 PolarHBondContact O-N 3.31Å; F84-N86 VanDerWaalsContact C-N 3.33Å; F84-N86 PolarHBondContact O-N 3.31Å; F84-R87 PolarHBondContact O-N 2.95Å; F84-L88 HydrophobicContact CE1-CD2 4.27Å; F84-L88 WeakPolarHBondContact O-CB 3.27Å; F84-L88 PolarHBondContact O-N 2.92Å
85	Y	89.1	Confident	85	Confident	147 Å²	147	94.7 Å²	94.7	58%	0.576	47%	0.473	S	S	*	.	H	α-helix	trans	-66.9	-33.5	179.6	-74.3	-62.5	0	0	0	112.7	F81 A82 E83 L88 K89	F81-Y85 HydrophobicContact CB-CE2 4.45Å; F81-Y85 WeakPolarHBondContact O-CD2 2.94Å; F81-Y85 PolarHBondContact O-N 3.32Å; A82-Y85 PolarHBondContact O-N 2.61Å; E83-Y85 PolarHBondContact O-N 3.4Å; Y85-L88 HydrophobicContact CD1-CD2 4.46Å; Y85-K89 WeakPolarHBondContact O-CB 3.14Å; Y85-K89 PolarHBondContact O-N 3.17Å
86	N	86.1	Confident	85.2	Confident	90 Å²	90	101.5 Å²	101.5	48%	0.481	49%	0.494	S	S	.	.	H	α-helix	trans	-63.3	-48.2	173.9	-73.4	-24.2	0	0	0	111.4	A82 E83 F84 K89 Q90	A82-N86 WeakPolarHBondContact O-CB 3.37Å; A82-N86 PolarHBondContact O-N 3.34Å; A82-N86 PolarHBondContact O-ND2 3.38Å; E83-N86 PolarHBondContact O-N 3.26Å; F84-N86 VanDerWaalsContact C-N 3.33Å; F84-N86 PolarHBondContact O-N 3.31Å; N86-K89 WeakPolarHBondContact O-CB 3.19Å; N86-K89 PolarHBondContact O-N 3.46Å; N86-Q90 WeakPolarHBondContact O-CG 3.39Å; N86-Q90 PolarHBondContact O-N 3.37Å; N86-Q90 VanDerWaalsContact O-N 3.07Å
87	R	83.9	Confident	85.4	Confident	51 Å²	51	105.2 Å²	105.2	19%	0.192	50%	0.5	C	S	.	.	H	α-helix	trans	-62.4	-43.8	176.1	-66.9	179.6	-171.4	-152.2	2.8	111.6	E71 E83 F84 K89 Q90 I91	E71-R87 IonicContact OE1-CZ 3.1Å; E71-R87 IonicContact OE1-NH1 3.71Å; E71-R87 PolarHBondContact OE1-NH1 3.36Å; E71-R87 IonicContact OE1-NH2 3.6Å; E83-R87 WeakPolarHBondContact O-CG 3.13Å; E83-R87 PolarHBondContact O-N 3.34Å; E83-R87 IonicContact OE1-CZ 2.88Å; E83-R87 IonicContact OE1-NE 3.88Å; E83-R87 PolarHBondContact OE1-NE 2.92Å; E83-R87 IonicContact OE1-NH2 3.79Å; E83-R87 PolarHBondContact OE1-NH2 3.11Å; F84-R87 PolarHBondContact O-N 2.95Å; R87-K89 VanDerWaalsContact C-N 3.31Å; R87-K89 PolarHBondContact O-N 3.4Å; R87-Q90 WeakPolarHBondContact O-CB 3.38Å; R87-Q90 PolarHBondContact O-N 3.43Å; R87-I91 WeakPolarHBondContact O-CG1 3.14Å; R87-I91 PolarHBondContact O-N 3.15Å
88	L	87.8	Confident	85.5	Confident	53 Å²	53	108.1 Å²	108.1	28%	0.277	51%	0.508	S	S	.	.	H	α-helix	trans	-61.3	-39.6	176.8	-178.5	63	0	0	0	112	F84 Y85 I91 K92	F84-L88 HydrophobicContact CE1-CD2 4.27Å; F84-L88 WeakPolarHBondContact O-CB 3.27Å; F84-L88 PolarHBondContact O-N 2.92Å; Y85-L88 HydrophobicContact CD1-CD2 4.46Å; L88-I91 PolarHBondContact O-N 3.42Å; L88-K92 HydrophobicContact CG-CD 4.37Å; L88-K92 WeakPolarHBondContact O-CG 3.2Å; L88-K92 PolarHBondContact O-N 3.39Å
89	K	90.9	Very high	85.6	Confident	129 Å²	129	106.3 Å²	106.3	56%	0.561	50%	0.496	S	S	*	.	H	α-helix	trans	-62.4	-45.2	175.9	-176.5	-178.8	173.3	-172.7	0	111	Y85 N86 R87 I91 K92 E93	Y85-K89 WeakPolarHBondContact O-CB 3.14Å; Y85-K89 PolarHBondContact O-N 3.17Å; N86-K89 WeakPolarHBondContact O-CB 3.19Å; N86-K89 PolarHBondContact O-N 3.46Å; R87-K89 VanDerWaalsContact C-N 3.31Å; R87-K89 PolarHBondContact O-N 3.4Å; K89-I91 PolarHBondContact O-N 2.93Å; K89-K92 PolarHBondContact O-N 3.45Å; K89-E93 WeakPolarHBondContact CE-OE1 3.45Å; K89-E93 WeakPolarHBondContact O-CG 3.49Å; K89-E93 PolarHBondContact O-N 3.14Å
90	Q	86.4	Confident	85.7	Confident	98 Å²	98	107.8 Å²	107.8	46%	0.458	50%	0.504	S	S	.	.	H	α-helix	trans	-60.8	-42.4	175.9	-71.2	170	-9.1	0	0	112.1	M1 N86 R87 E93 F94	M1-Q90 HydrophobicContact CE-CB 3.44Å; M1-Q90 VanDerWaalsContact CE-CB 3.44Å; M1-Q90 HydrophobicContact CE-CG 4.48Å; M1-Q90 HydrophobicContact SD-CB 3.98Å; M1-Q90 PolarHBondContact SD-OE1 2.95Å; N86-Q90 WeakPolarHBondContact O-CG 3.39Å; N86-Q90 PolarHBondContact O-N 3.37Å; N86-Q90 VanDerWaalsContact O-N 3.07Å; R87-Q90 WeakPolarHBondContact O-CB 3.38Å; R87-Q90 PolarHBondContact O-N 3.43Å; Q90-E93 PolarHBondContact O-N 3.5Å; Q90-F94 WeakPolarHBondContact O-CB 3.47Å; Q90-F94 PolarHBondContact O-N 3.17Å
91	I	84.6	Confident	85.4	Confident	77 Å²	77	108.8 Å²	108.8	40%	0.395	51%	0.508	S	S	.	.	H	α-helix	trans	-60.9	-46.6	175.4	-66.3	168.6	0	0	0	110.8	M1 R87 L88 K89 E93 F94 H95	M1-I91 HydrophobicContact CE-CD1 4.4Å; M1-I91 HydrophobicContact CE-CG1 3.59Å; R87-I91 WeakPolarHBondContact O-CG1 3.14Å; R87-I91 PolarHBondContact O-N 3.15Å; L88-I91 PolarHBondContact O-N 3.42Å; K89-I91 PolarHBondContact O-N 2.93Å; I91-E93 VanDerWaalsContact C-N 3.32Å; I91-E93 PolarHBondContact O-N 3.35Å; I91-F94 WeakPolarHBondContact O-CB 3.45Å; I91-F94 PolarHBondContact O-N 3.49Å; I91-H95 PolarHBondContact O-CD2 2.89Å; I91-H95 PolarHBondContact O-N 3.39Å
92	K	87.9	Confident	84.9	Confident	135 Å²	135	108.2 Å²	108.2	59%	0.587	51%	0.511	S	S	*	.	H	α-helix	trans	-62	-39.2	177.6	-73.9	176.1	178.4	178.5	0	112.2	L88 K89 R96	L88-K92 HydrophobicContact CG-CD 4.37Å; L88-K92 WeakPolarHBondContact O-CG 3.2Å; L88-K92 PolarHBondContact O-N 3.39Å; K89-K92 PolarHBondContact O-N 3.45Å; K92-R96 WeakPolarHBondContact O-CB 3.16Å; K92-R96 PolarHBondContact O-N 3.19Å
93	E	89.9	Confident	84.1	Confident	88 Å²	88	111 Å²	111	41%	0.411	53%	0.526	S	S	.	.	H	α-helix	trans	-67.3	-39.4	175.3	-75.3	176.7	-173.4	0	0	112	K89 Q90 I91 R96 K97	K89-E93 WeakPolarHBondContact CE-OE1 3.45Å; K89-E93 WeakPolarHBondContact O-CG 3.49Å; K89-E93 PolarHBondContact O-N 3.14Å; Q90-E93 PolarHBondContact O-N 3.5Å; I91-E93 VanDerWaalsContact C-N 3.32Å; I91-E93 PolarHBondContact O-N 3.35Å; E93-R96 PolarHBondContact O-N 3.07Å; E93-K97 WeakPolarHBondContact O-CG 3.48Å; E93-K97 PolarHBondContact O-N 3.44Å
94	F	83.6	Confident	83.6	Confident	82 Å²	82	112.6 Å²	112.6	36%	0.36	54%	0.54	S	S	.	.	H	α-helix	trans	-61.1	-50.6	175.6	-176.1	-90.5	0	0	0	111.5	Q90 I91 R96 K97 H98 E101	Q90-F94 WeakPolarHBondContact O-CB 3.47Å; Q90-F94 PolarHBondContact O-N 3.17Å; I91-F94 WeakPolarHBondContact O-CB 3.45Å; I91-F94 PolarHBondContact O-N 3.49Å; F94-R96 VanDerWaalsContact C-N 3.28Å; F94-R96 PolarHBondContact O-N 2.92Å; F94-K97 PolarHBondContact O-N 2.9Å; F94-K97 VanDerWaalsContact O-N 3.1Å; F94-H98 AromaticContact CD2-CE1 3.85Å; F94-H98 AromaticContact CD2-ND1 3.72Å; F94-H98 AromaticContact CE1-ND1 3.9Å; F94-H98 AromaticContact CE2-CE1 3.5Å; F94-H98 AromaticContact CE2-ND1 3.52Å; F94-H98 AromaticContact CZ-CE1 3.93Å; F94-H98 AromaticContact CZ-ND1 3.6Å; F94-H98 PolarHBondContact O-N 2.79Å; F94-H98 PolarHBondContact O-ND1 3.28Å; F94-H98 VanDerWaalsContact O-ND1 3.08Å; F94-E101 WeakPolarHBondContact CE1-OE2 3.42Å; F94-E101 WeakPolarHBondContact CZ-OE2 3.34Å
95	H	83.3	Confident	83.4	Confident	118 Å²	118	109.4 Å²	109.4	55%	0.546	53%	0.532	S	S	.	.	H	α-helix	trans	-64.5	-30.8	176.6	-83.3	-72.4	0	0	0	113.2	I91 H98	I91-H95 PolarHBondContact O-CD2 2.89Å; I91-H95 PolarHBondContact O-N 3.39Å; H95-H98 CarbonylContact O-C 3.33Å
96	R	87.9	Confident	83.1	Confident	208 Å²	208	104 Å²	104	79%	0.785	51%	0.512	S	S	*	.	H	α-helix	trans	-67.4	-37	173	-175.6	-175.5	-71.5	177.7	-4.1	111.9	K92 E93 F94	K92-R96 WeakPolarHBondContact O-CB 3.16Å; K92-R96 PolarHBondContact O-N 3.19Å; E93-R96 PolarHBondContact O-N 3.07Å; F94-R96 VanDerWaalsContact C-N 3.28Å; F94-R96 PolarHBondContact O-N 2.92Å
97	K	88.9	Confident	82.8	Confident	163 Å²	163	101.2 Å²	101.2	71%	0.709	50%	0.5	S	S	*	.	H	α-helix	trans	-74.7	-31.1	178.1	-75.8	-178.6	179.1	-179.7	0	112.7	E93 F94 P99	E93-K97 WeakPolarHBondContact O-CG 3.48Å; E93-K97 PolarHBondContact O-N 3.44Å; F94-K97 PolarHBondContact O-N 2.9Å; F94-K97 VanDerWaalsContact O-N 3.1Å; K97-P99 VanDerWaalsContact O-CD 3.23Å; K97-P99 WeakPolarHBondContact O-CD 3.18Å
98	H	83.9	Confident	82.7	Confident	81 Å²	81	103.4 Å²	103.4	38%	0.375	51%	0.514	S	S	.	.			trans	-119.5	65	-177.8	-50.7	96.6	0	0	0	111.5	F94 H95 N100 E101	F94-H98 AromaticContact CD2-CE1 3.85Å; F94-H98 AromaticContact CD2-ND1 3.72Å; F94-H98 AromaticContact CE1-ND1 3.9Å; F94-H98 AromaticContact CE2-CE1 3.5Å; F94-H98 AromaticContact CE2-ND1 3.52Å; F94-H98 AromaticContact CZ-CE1 3.93Å; F94-H98 AromaticContact CZ-ND1 3.6Å; F94-H98 PolarHBondContact O-N 2.79Å; F94-H98 PolarHBondContact O-ND1 3.28Å; F94-H98 VanDerWaalsContact O-ND1 3.08Å; H95-H98 CarbonylContact O-C 3.33Å; H98-N100 PolarHBondContact O-N 3.31Å; H98-E101 HydrophobicContact CB-CB 3.8Å; H98-E101 WeakPolarHBondContact CB-OE2 3.35Å; H98-E101 IonicContact CD2-OE2 2.79Å; H98-E101 IonicContact CG-OE2 2.76Å; H98-E101 PolarHBondContact O-N 2.88Å
99	P	81.5	Confident	82.4	Confident	98 Å²	98	105.4 Å²	105.4	64%	0.636	52%	0.521	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-20	-174.3	28.9	-35.9	0	0	0	113.9	K97	K97-P99 VanDerWaalsContact O-CD 3.23Å; K97-P99 WeakPolarHBondContact O-CD 3.18Å
100	N	84	Confident	82.1	Confident	154 Å²	154	100 Å²	100	82%	0.824	50%	0.498	S	S	*	.	T	Hydrogen-bonded Turn	trans	-107.1	4.3	-178.4	-60.9	-22.7	0	0	0	112.8	H98 I102	H98-N100 PolarHBondContact O-N 3.31Å; N100-I102 PolarHBondContact O-N 2.87Å
101	E	76.4	Confident	81.9	Confident	116 Å²	116	99.2 Å²	99.2	54%	0.542	50%	0.497	S	S	.	.			trans	-77.5	112	177.3	-173.3	174	-158.5	0	0	108.8	F94 H98	F94-E101 WeakPolarHBondContact CE1-OE2 3.42Å; F94-E101 WeakPolarHBondContact CZ-OE2 3.34Å; H98-E101 HydrophobicContact CB-CB 3.8Å; H98-E101 WeakPolarHBondContact CB-OE2 3.35Å; H98-E101 IonicContact CD2-OE2 2.79Å; H98-E101 IonicContact CG-OE2 2.76Å; H98-E101 PolarHBondContact O-N 2.88Å
102	I	72.1	Confident	81.8	Confident	145 Å²	145	100.5 Å²	100.5	74%	0.744	50%	0.501	S	S	*	.			trans	-82.3	118	177	-60.2	168.6	0	0	0	107	N100 V104	N100-I102 PolarHBondContact O-N 2.87Å; I102-V104 PolarHBondContact O-N 3.28Å; I102-V104 VanDerWaalsContact O-N 3.16Å
103	C	69.6	Low	81.3	Confident	112 Å²	112	97.4 Å²	97.4	76%	0.757	49%	0.491	S	S	*	.			trans	-70.3	109.3	170.1	-174.5	0	0	0	0	108.2	P105	C103-P105 VanDerWaalsContact O-CD 3.31Å; C103-P105 WeakPolarHBondContact O-CD 3.31Å
104	V	74.8	Confident	80.9	Confident	92 Å²	92	95.2 Å²	95.2	56%	0.558	48%	0.483	S	S	*	.			trans	-83.5	113.5	173.1	176.9	0	0	0	0	107.3	I102 M108	I102-V104 PolarHBondContact O-N 3.28Å; I102-V104 VanDerWaalsContact O-N 3.16Å; V104-M108 HydrophobicContact CG1-CB 3.83Å; V104-M108 HydrophobicContact CG1-CG 4.22Å; V104-M108 HydrophobicContact CG1-SD 3.78Å
105	P	79.9	Confident	80.8	Confident	60 Å²	60	96.1 Å²	96.1	39%	0.39	49%	0.487	S	S	.	.			trans	-61.9	143.1	175.1	-21.7	34.5	0	0	0	110.2	C103 S107 M108	C103-P105 VanDerWaalsContact O-CD 3.31Å; C103-P105 WeakPolarHBondContact O-CD 3.31Å; P105-S107 PolarHBondContact O-N 3.09Å; P105-M108 WeakPolarHBondContact O-CB 3.36Å; P105-M108 PolarHBondContact O-N 3.21Å
106	M	81	Confident	80.6	Confident	33 Å²	33	92.5 Å²	92.5	16%	0.163	48%	0.478	C	S	.	.	H	α-helix	trans	-54.4	-28.8	176.4	178	173.1	-81.1	0	0	112.7	R10 E13 E14 M108 E109 F110	R10-M106 HydrophobicContact CG-CE 3.74Å; E13-M106 HydrophobicContact CG-SD 4.45Å; E14-M106 VanDerWaalsContact CA-SD 3.5Å; E14-M106 HydrophobicContact CB-CE 3.86Å; E14-M106 HydrophobicContact CB-SD 3.52Å; E14-M106 VanDerWaalsContact CB-SD 3.52Å; E14-M106 HydrophobicContact CG-CE 4.07Å; E14-M106 HydrophobicContact CG-SD 3.93Å; M106-M108 PolarHBondContact O-N 2.95Å; M106-E109 PolarHBondContact O-N 2.98Å; M106-F110 HydrophobicContact CG-CD2 4.41Å; M106-F110 HydrophobicContact CG-CE2 3.84Å; M106-F110 VanDerWaalsContact O-CD2 3.31Å; M106-F110 WeakPolarHBondContact O-CD2 3.3Å
107	S	80.1	Confident	80.2	Confident	33 Å²	33	84.4 Å²	84.4	23%	0.231	45%	0.447	C	S	.	.	H	α-helix	trans	-58.6	-29.4	174.8	59.9	0	0	0	0	113.7	P105 E109 F110 D111	P105-S107 PolarHBondContact O-N 3.09Å; S107-E109 VanDerWaalsContact C-N 3.31Å; S107-E109 PolarHBondContact O-N 3.2Å; S107-F110 PolarHBondContact O-N 3.34Å; S107-D111 VanDerWaalsContact O-CG 3.31Å; S107-D111 PolarHBondContact O-N 3.44Å
108	M	82.3	Confident	79.7	Confident	97 Å²	97	82.3 Å²	82.3	48%	0.478	44%	0.44	S	S	.	.	H	α-helix	trans	-63.6	-36.5	179.1	-70.4	-167.8	165	0	0	111.9	V104 P105 M106 F110 D111 E112	V104-M108 HydrophobicContact CG1-CB 3.83Å; V104-M108 HydrophobicContact CG1-CG 4.22Å; V104-M108 HydrophobicContact CG1-SD 3.78Å; P105-M108 WeakPolarHBondContact O-CB 3.36Å; P105-M108 PolarHBondContact O-N 3.21Å; M106-M108 PolarHBondContact O-N 2.95Å; M108-F110 VanDerWaalsContact C-N 3.29Å; M108-F110 PolarHBondContact O-N 3.21Å; M108-D111 PolarHBondContact O-N 2.75Å; M108-E112 WeakPolarHBondContact O-CG 3.4Å; M108-E112 PolarHBondContact O-N 2.79Å
109	E	82.6	Confident	79.5	Confident	95 Å²	95	84.5 Å²	84.5	44%	0.444	45%	0.454	S	S	.	.	H	α-helix	trans	-60.1	-41.8	175.9	-65.4	-175.9	-175.2	0	0	111.5	R49 M106 S107 E112 L113	R49-E109 IonicContact CZ-OE2 3.18Å; R49-E109 IonicContact NH1-OE2 3.33Å; R49-E109 PolarHBondContact NH1-OE2 3.45Å; R49-E109 IonicContact NH2-OE2 3.1Å; R49-E109 PolarHBondContact NH2-OE2 3.45Å; M106-E109 PolarHBondContact O-N 2.98Å; S107-E109 VanDerWaalsContact C-N 3.31Å; S107-E109 PolarHBondContact O-N 3.2Å; E109-E112 PolarHBondContact O-N 3.21Å; E109-L113 WeakPolarHBondContact O-CG 3.36Å; E109-L113 PolarHBondContact O-N 3.45Å; E109-L113 VanDerWaalsContact O-N 3.11Å
110	F	82.9	Confident	79.1	Confident	14 Å²	14	82.7 Å²	82.7	6%	0.061	44%	0.442	C	S	.	.	H	α-helix	trans	-73.4	-32.3	178.9	-64.8	-82	0	0	0	112.6	R17 L18 A21 M106 S107 M108 L113 V114	R17-F110 HydrophobicContact CB-CD1 4.29Å; R17-F110 HydrophobicContact CB-CD2 3.64Å; R17-F110 HydrophobicContact CB-CE1 3.96Å; R17-F110 HydrophobicContact CB-CE2 3.28Å; R17-F110 HydrophobicContact CB-CG 4.14Å; R17-F110 HydrophobicContact CB-CZ 3.45Å; R17-F110 VanDerWaalsContact CB-CZ 3.45Å; R17-F110 HydrophobicContact CG-CD2 4.15Å; R17-F110 HydrophobicContact CG-CE2 3.94Å; L18-F110 HydrophobicContact CD2-CE1 3.72Å; L18-F110 HydrophobicContact CD2-CZ 4.1Å; L18-F110 HydrophobicContact CG-CE1 3.9Å; L18-F110 HydrophobicContact CG-CZ 3.92Å; A21-F110 HydrophobicContact CB-CD1 3.71Å; A21-F110 HydrophobicContact CB-CE1 4.26Å; M106-F110 HydrophobicContact CG-CD2 4.41Å; M106-F110 HydrophobicContact CG-CE2 3.84Å; M106-F110 VanDerWaalsContact O-CD2 3.31Å; M106-F110 WeakPolarHBondContact O-CD2 3.3Å; S107-F110 PolarHBondContact O-N 3.34Å; M108-F110 VanDerWaalsContact C-N 3.29Å; M108-F110 PolarHBondContact O-N 3.21Å; F110-L113 HydrophobicContact CD1-CD1 4.17Å; F110-L113 PolarHBondContact O-N 3.05Å; F110-V114 WeakPolarHBondContact O-CG2 3.28Å; F110-V114 PolarHBondContact O-N 3.46Å
111	D	81.9	Confident	78.6	Confident	83 Å²	83	79.2 Å²	79.2	44%	0.444	43%	0.427	S	S	.	.	H	α-helix	trans	-67.7	-38	173.1	-66.9	-26.2	0	0	0	111.1	S107 M108 V114 K115	S107-D111 VanDerWaalsContact O-CG 3.31Å; S107-D111 PolarHBondContact O-N 3.44Å; M108-D111 PolarHBondContact O-N 2.75Å; D111-V114 PolarHBondContact O-N 3.39Å; D111-K115 WeakPolarHBondContact O-CG 3.45Å; D111-K115 PolarHBondContact O-N 3.4Å
112	E	82.5	Confident	78	Confident	103 Å²	103	82.3 Å²	82.3	48%	0.481	44%	0.441	S	S	.	.	H	α-helix	trans	-65.3	-37.1	173.4	-68.7	-54.7	136	0	0	112	M108 E109 V114 K115 A116	M108-E112 WeakPolarHBondContact O-CG 3.4Å; M108-E112 PolarHBondContact O-N 2.79Å; E109-E112 PolarHBondContact O-N 3.21Å; E112-V114 VanDerWaalsContact C-N 3.29Å; E112-V114 PolarHBondContact O-N 2.99Å; E112-K115 PolarHBondContact O-N 3.15Å; E112-K115 IonicContact OE1-NZ 2.73Å; E112-K115 PolarHBondContact OE1-NZ 2.99Å; E112-A116 WeakPolarHBondContact O-CB 3.33Å; E112-A116 PolarHBondContact O-N 3.19Å
113	L	79.4	Confident	77.4	Confident	71 Å²	71	84.1 Å²	84.1	37%	0.372	45%	0.447	S	S	.	.	H	α-helix	trans	-60.2	-39.3	172.9	-72	171.9	0	0	0	112.3	M46 E109 F110 R117	M46-L113 HydrophobicContact CE-CD1 4.34Å; E109-L113 WeakPolarHBondContact O-CG 3.36Å; E109-L113 PolarHBondContact O-N 3.45Å; E109-L113 VanDerWaalsContact O-N 3.11Å; F110-L113 HydrophobicContact CD1-CD1 4.17Å; F110-L113 PolarHBondContact O-N 3.05Å; L113-R117 PolarHBondContact O-N 2.87Å
114	V	80.5	Confident	77.2	Confident	41 Å²	41	81.3 Å²	81.3	25%	0.248	43%	0.426	C	S	.	.	H	α-helix	trans	-66.7	-43.4	175.9	172.6	0	0	0	0	110.8	F110 D111 E112 R117 E118	F110-V114 WeakPolarHBondContact O-CG2 3.28Å; F110-V114 PolarHBondContact O-N 3.46Å; D111-V114 PolarHBondContact O-N 3.39Å; E112-V114 VanDerWaalsContact C-N 3.29Å; E112-V114 PolarHBondContact O-N 2.99Å; V114-R117 WeakPolarHBondContact O-CB 3.47Å; V114-R117 PolarHBondContact O-N 3.46Å; V114-E118 WeakPolarHBondContact O-CG 3.46Å; V114-E118 PolarHBondContact O-N 2.89Å
115	K	82.4	Confident	77	Confident	102 Å²	102	79.1 Å²	79.1	44%	0.443	41%	0.41	S	S	.	.	H	α-helix	trans	-64.7	-39.9	177	-69.7	175	-168.1	167.5	0	112.6	D111 E112 R117 E118 N119	D111-K115 WeakPolarHBondContact O-CG 3.45Å; D111-K115 PolarHBondContact O-N 3.4Å; E112-K115 PolarHBondContact O-N 3.15Å; E112-K115 IonicContact OE1-NZ 2.73Å; E112-K115 PolarHBondContact OE1-NZ 2.99Å; K115-R117 PolarHBondContact O-N 3.44Å; K115-E118 PolarHBondContact O-N 3.27Å; K115-E118 VanDerWaalsContact O-N 3.16Å; K115-N119 PolarHBondContact O-N 2.92Å
116	A	78.5	Confident	77.1	Confident	42 Å²	42	79.7 Å²	79.7	35%	0.347	41%	0.41	S	S	.	.	H	α-helix	trans	-64.6	-29.9	177.7	0	0	0	0	0	111.9	E112 N119 P120	E112-A116 WeakPolarHBondContact O-CB 3.33Å; E112-A116 PolarHBondContact O-N 3.19Å; A116-N119 CarbonylContact O-C 3.45Å; A116-P120 VanDerWaalsContact O-CA 3.22Å; A116-P120 WeakPolarHBondContact O-CA 3.3Å
117	R	79.4	Confident	77.2	Confident	37 Å²	37	82 Å²	82	14%	0.14	42%	0.421	C	S	.	.	H	α-helix	trans	-71	-44.7	169.8	-179.2	-167.7	69.2	-150.8	-2.3	112.1	E25 L113 V114 K115	E25-R117 VanDerWaalsContact OE2-CD 3.29Å; E25-R117 WeakPolarHBondContact OE2-CD 3.4Å; E25-R117 IonicContact OE2-CZ 3.38Å; E25-R117 IonicContact OE2-NE 2.7Å; E25-R117 IonicContact OE2-NH1 3.12Å; E25-R117 PolarHBondContact OE2-NH1 3.47Å; L113-R117 PolarHBondContact O-N 2.87Å; V114-R117 WeakPolarHBondContact O-CB 3.47Å; V114-R117 PolarHBondContact O-N 3.46Å; K115-R117 PolarHBondContact O-N 3.44Å
118	E	78.5	Confident	77.6	Confident	120 Å²	120	81.5 Å²	81.5	56%	0.561	42%	0.416	S	S	*	.	H	α-helix	trans	-72.7	-31	-176.8	-71.5	176.3	-176.9	0	0	113	V114 K115	V114-E118 WeakPolarHBondContact O-CG 3.46Å; V114-E118 PolarHBondContact O-N 2.89Å; K115-E118 PolarHBondContact O-N 3.27Å; K115-E118 VanDerWaalsContact O-N 3.16Å
119	N	78.8	Confident	77.9	Confident	127 Å²	127	85.1 Å²	85.1	68%	0.679	43%	0.432	S	S	*	.	S	Bend	trans	-132.6	74.7	177.3	-61.5	-49.3	0	0	0	109.2	K115 A116 T121	K115-N119 PolarHBondContact O-N 2.92Å; A116-N119 CarbonylContact O-C 3.45Å; N119-T121 PolarHBondContact O-N 3.38Å
120	P	72.6	Confident	78.3	Confident	59 Å²	59	82.1 Å²	82.1	38%	0.383	42%	0.418	S	S	.	.			trans	-65.7	129.1	178.1	26	-30.2	0	0	0	109.8	A116 Q125	A116-P120 VanDerWaalsContact O-CA 3.22Å; A116-P120 WeakPolarHBondContact O-CA 3.3Å; P120-Q125 HydrophobicContact CB-CB 4.45Å
121	T	74.3	Confident	78.7	Confident	81 Å²	81	84 Å²	84	50%	0.497	43%	0.433	S	S	.	.			trans	-74.8	160.7	163.7	59.3	0	0	0	0	110.4	N119 E123 T124 Q125	N119-T121 PolarHBondContact O-N 3.38Å; T121-E123 PolarHBondContact O-N 3.36Å; T121-E123 VanDerWaalsContact O-N 3.14Å; T121-T124 PolarHBondContact N-OG1 3.35Å; T121-T124 CarbonylContact O-C 3.56Å; T121-T124 PolarHBondContact O-N 2.97Å; T121-T124 PolarHBondContact O-OG1 2.86Å; T121-T124 WeakPolarHBondContact OG1-CG2 3.25Å; T121-T124 PolarHBondContact OG1-OG1 3.04Å; T121-Q125 PolarHBondContact O-N 3.18Å
122	E	63.4	Low	78.9	Confident	181 Å²	181	86.3 Å²	86.3	85%	0.846	45%	0.445	S	S	*	.	H	α-helix	trans	-49.7	-39.8	175.7	-75.5	177.3	168.3	0	0	112.2	T124	E122-T124 VanDerWaalsContact C-N 3.31Å; E122-T124 PolarHBondContact O-N 2.97Å
123	E	60.4	Low	79.2	Confident	183 Å²	183	85.8 Å²	85.8	86%	0.855	44%	0.443	S	S	*	.	H	α-helix	trans	-71.2	-21.2	178.5	-65	-178.2	174.1	0	0	114.1	T121	T121-E123 PolarHBondContact O-N 3.36Å; T121-E123 VanDerWaalsContact O-N 3.14Å
124	T	65.2	Low	79.8	Confident	54 Å²	54	82.8 Å²	82.8	33%	0.331	43%	0.426	S	S	.	.	H	α-helix	trans	-110.1	-2.5	-177.4	57.3	0	0	0	0	113	T121 E122 N126	T121-T124 PolarHBondContact N-OG1 3.35Å; T121-T124 CarbonylContact O-C 3.56Å; T121-T124 PolarHBondContact O-N 2.97Å; T121-T124 PolarHBondContact O-OG1 2.86Å; T121-T124 WeakPolarHBondContact OG1-CG2 3.25Å; T121-T124 PolarHBondContact OG1-OG1 3.04Å; E122-T124 VanDerWaalsContact C-N 3.31Å; E122-T124 PolarHBondContact O-N 2.97Å; T124-N126 VanDerWaalsContact C-N 3.33Å
125	Q	71.3	Confident	80.3	Confident	45 Å²	45	82.5 Å²	82.5	21%	0.21	43%	0.429	C	S	.	.	H	α-helix	trans	-71.1	-32.7	-177.4	-161.5	-176.7	1.9	0	0	111.2	R34 N38 P120 T121 D371	R34-Q125 VanDerWaalsContact NH2-CD 3.27Å; N38-Q125 PolarHBondContact ND2-O 3.16Å; P120-Q125 HydrophobicContact CB-CB 4.45Å; T121-Q125 PolarHBondContact O-N 3.18Å; Q125-D371 PolarHBondContact NE2-OD2 2.86Å
126	N	80.2	Confident	80.7	Confident	73 Å²	73	79.1 Å²	79.1	39%	0.39	41%	0.413	S	S	.	.			trans	-114.8	116.8	174.6	-69.6	-19.4	0	0	0	110.2	R34 T124 V128 Y136	R34-N126 PolarHBondContact NE-OD1 3.27Å; R34-N126 PolarHBondContact NH2-ND2 3.14Å; R34-N126 PolarHBondContact NH2-OD1 3.43Å; T124-N126 VanDerWaalsContact C-N 3.33Å; N126-V128 VanDerWaalsContact C-N 3.28Å; N126-Y136 WeakPolarHBondContact CA-OH 3.36Å; N126-Y136 HydrophobicContact CB-CE2 4.04Å; N126-Y136 WeakPolarHBondContact OD1-CE2 3.48Å
127	M	83.3	Confident	81.3	Confident	82 Å²	82	77.1 Å²	77.1	40%	0.404	40%	0.397	S	S	.	.	S	Bend	trans	-80.9	-15.2	174.1	-65.5	-65.5	-58.8	0	0	112.3	N38 H41 R42 Y136	N38-M127 HydrophobicContact CB-CG 4.02Å; N38-M127 WeakPolarHBondContact OD1-CB 3.4Å; N38-M127 PolarHBondContact OD1-N 3.42Å; H41-M127 HydrophobicContact CB-CB 3.73Å; H41-M127 HydrophobicContact CB-CG 4.36Å; R42-M127 HydrophobicContact CG-CE 3.87Å; R42-M127 HydrophobicContact CG-CG 4.26Å; R42-M127 HydrophobicContact CG-SD 3.99Å; M127-Y136 PolarHBondContact N-OH 2.99Å
128	V	88.8	Confident	82	Confident	21 Å²	21	80.9 Å²	80.9	13%	0.127	41%	0.411	C	S	.	.	S	Bend	trans	-148.8	146.8	-174.5	59.9	0	0	0	0	109.6	I37 H41 N126 F130 Y136 R199	I37-V128 HydrophobicContact CG2-CG1 3.79Å; H41-V128 WeakPolarHBondContact NE2-CG1 3.4Å; N126-V128 VanDerWaalsContact C-N 3.28Å; V128-F130 HydrophobicContact CB-CE2 4.49Å; V128-F130 HydrophobicContact CG1-CD2 4.01Å; V128-F130 HydrophobicContact CG1-CE2 3.41Å; V128-F130 VanDerWaalsContact CG1-CE2 3.41Å; V128-F130 HydrophobicContact CG1-CZ 4.27Å; V128-F130 HydrophobicContact CG2-CE2 4.34Å; V128-Y136 HydrophobicContact CG1-CE1 4.29Å; V128-Y136 WeakPolarHBondContact O-CE2 3.43Å; V128-Y136 PolarHBondContact O-OH 3.42Å; V128-R199 HydrophobicContact CG2-CB 3.82Å; V128-R199 HydrophobicContact CG2-CG 3.53Å
129	E	88.6	Confident	82.8	Confident	174 Å²	174	75.9 Å²	75.9	81%	0.813	39%	0.387	S	S	*	.			trans	-90.6	135.9	178.7	-65.1	-178.8	-177.2	0	0	110.6	R199	E129-R199 WeakPolarHBondContact O-CD 3.47Å
130	F	91.6	Very high	83.5	Confident	32 Å²	32	70.1 Å²	70.1	14%	0.14	36%	0.356	C	S	.	.			trans	-128.9	152	170.7	-74.4	-85.4	0	0	0	108.6	I37 V128 E134 Y136 Y196 R199 V200	I37-F130 HydrophobicContact CD1-CE2 4.5Å; I37-F130 HydrophobicContact CD1-CZ 4.36Å; I37-F130 HydrophobicContact CG2-CE2 4.17Å; I37-F130 HydrophobicContact CG2-CZ 4.49Å; V128-F130 HydrophobicContact CB-CE2 4.49Å; V128-F130 HydrophobicContact CG1-CD2 4.01Å; V128-F130 HydrophobicContact CG1-CE2 3.41Å; V128-F130 VanDerWaalsContact CG1-CE2 3.41Å; V128-F130 HydrophobicContact CG1-CZ 4.27Å; V128-F130 HydrophobicContact CG2-CE2 4.34Å; F130-E134 WeakPolarHBondContact CA-OE2 3.27Å; F130-E134 HydrophobicContact CB-CB 4.21Å; F130-E134 HydrophobicContact CD1-CB 4.04Å; F130-E134 WeakPolarHBondContact CD1-OE2 3.49Å; F130-Y136 HydrophobicContact CD2-CD1 4.11Å; F130-Y136 AromaticContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CE1 4.35Å; F130-Y136 AromaticContact CD2-CE2 3.84Å; F130-Y136 HydrophobicContact CD2-CE2 3.84Å; F130-Y136 AromaticContact CD2-CG 3.76Å; F130-Y136 HydrophobicContact CD2-CG 3.76Å; F130-Y136 AromaticContact CE2-CD1 3.97Å; F130-Y136 HydrophobicContact CE2-CD1 3.97Å; F130-Y136 HydrophobicContact CE2-CD2 4.28Å; F130-Y136 HydrophobicContact CE2-CE1 4.09Å; F130-Y136 HydrophobicContact CE2-CE2 4.34Å; F130-Y136 HydrophobicContact CE2-CG 4.1Å; F130-Y136 HydrophobicContact CG-CD2 4.48Å; F130-Y196 HydrophobicContact CD1-CE2 4.49Å; F130-Y196 HydrophobicContact CE1-CE2 4.28Å; F130-R199 HydrophobicContact CE1-CB 3.66Å; F130-R199 HydrophobicContact CE2-CB 4.38Å; F130-R199 HydrophobicContact CZ-CB 3.54Å; F130-V200 HydrophobicContact CE1-CG1 3.72Å; F130-V200 HydrophobicContact CZ-CG1 3.79Å
131	S	90.7	Very high	84.6	Confident	53 Å²	53	69.5 Å²	69.5	37%	0.371	35%	0.35	S	S	.	.			trans	-65.5	152.4	165.7	179.9	0	0	0	0	110.1	E133 E134 A135	S131-E133 PolarHBondContact O-N 3.35Å; S131-E134 PolarHBondContact N-OE2 3.24Å; S131-E134 WeakPolarHBondContact O-CB 3.38Å; S131-E134 PolarHBondContact O-N 3.42Å; S131-A135 PolarHBondContact O-N 3.11Å
132	D	87	Confident	85.5	Confident	132 Å²	132	65.7 Å²	65.7	71%	0.706	33%	0.326	S	S	*	.	G	3₁₀ helix	trans	-57	-38.9	176.5	-58	-29.1	0	0	0	111	E134 A135	D132-E134 VanDerWaalsContact C-N 3.27Å; D132-E134 PolarHBondContact O-N 2.91Å; D132-A135 PolarHBondContact O-N 2.77Å; D132-A135 VanDerWaalsContact O-N 3.13Å
133	E	88.6	Confident	86.9	Confident	92 Å²	92	61.3 Å²	61.3	43%	0.43	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-69.2	-22.3	177.3	-67.1	-65	157.4	0	0	113.3	S131 A135 Y139 D141 K348	S131-E133 PolarHBondContact O-N 3.35Å; E133-A135 VanDerWaalsContact C-N 3.28Å; E133-Y139 WeakPolarHBondContact O-CB 3.36Å; E133-D141 HydrophobicContact CB-CB 4.26Å; E133-K348 IonicContact OE1-NZ 3.28Å; E133-K348 IonicContact OE2-NZ 3.72Å
134	E	92.3	Very high	88.4	Confident	7 Å²	7	57.3 Å²	57.3	3%	0.033	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-78.8	-16.2	175.4	-67	173.4	140.5	0	0	111.9	F130 S131 D132 Y136 G137 R138 Y139 D141 Y192 Y196 R199	F130-E134 WeakPolarHBondContact CA-OE2 3.27Å; F130-E134 HydrophobicContact CB-CB 4.21Å; F130-E134 HydrophobicContact CD1-CB 4.04Å; F130-E134 WeakPolarHBondContact CD1-OE2 3.49Å; S131-E134 PolarHBondContact N-OE2 3.24Å; S131-E134 WeakPolarHBondContact O-CB 3.38Å; S131-E134 PolarHBondContact O-N 3.42Å; D132-E134 VanDerWaalsContact C-N 3.27Å; D132-E134 PolarHBondContact O-N 2.91Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 2.84Å; E134-G137 PolarHBondContact O-N 3.46Å; E134-G137 VanDerWaalsContact O-N 3.08Å; E134-R138 PolarHBondContact O-N 3.43Å; E134-Y139 VanDerWaalsContact CA-O 3.23Å; E134-Y139 WeakPolarHBondContact CA-O 3.45Å; E134-Y139 PolarHBondContact O-N 2.93Å; E134-D141 HydrophobicContact CG-CB 4.07Å; E134-Y192 PolarHBondContact OE1-OH 3.47Å; E134-Y196 HydrophobicContact CB-CE2 4.18Å; E134-Y196 HydrophobicContact CG-CD2 4.39Å; E134-Y196 HydrophobicContact CG-CE2 3.92Å; E134-Y196 VanDerWaalsContact OE1-CD2 3.23Å; E134-Y196 WeakPolarHBondContact OE1-CD2 3.43Å; E134-R199 IonicContact OE1-CZ 3.42Å; E134-R199 IonicContact OE1-NH2 3.38Å; E134-R199 PolarHBondContact OE1-NH2 3.24Å; E134-R199 IonicContact OE2-NH2 3.51Å
135	A	90	Very high	89.7	Confident	36 Å²	36	55 Å²	55	30%	0.298	28%	0.276	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.4	55.3	179.4	0	0	0	0	0	112.3	S131 D132 E133 G137 R138 Y139	S131-A135 PolarHBondContact O-N 3.11Å; D132-A135 PolarHBondContact O-N 2.77Å; D132-A135 VanDerWaalsContact O-N 3.13Å; E133-A135 VanDerWaalsContact C-N 3.28Å; A135-G137 VanDerWaalsContact C-N 3.32Å; A135-G137 PolarHBondContact O-N 3.45Å; A135-R138 HydrophobicContact CB-CB 4.05Å; A135-R138 VanDerWaalsContact O-CB 3.28Å; A135-R138 WeakPolarHBondContact O-CB 3.45Å; A135-R138 PolarHBondContact O-N 3.43Å; A135-Y139 HydrophobicContact CB-CD2 3.72Å; A135-Y139 HydrophobicContact CB-CE2 4.04Å
136	Y	90.3	Very high	90.7	Very high	30 Å²	30	54.8 Å²	54.8	12%	0.118	27%	0.274	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.5	42.8	-178.4	-145.1	-93.1	0	0	0	114.4	R34 I37 N38 N126 M127 V128 F130 E134	R34-Y136 HydrophobicContact CB-CD1 3.81Å; R34-Y136 HydrophobicContact CB-CE1 4.17Å; R34-Y136 HydrophobicContact CB-CG 4.36Å; R34-Y136 HydrophobicContact CG-CD1 3.65Å; R34-Y136 HydrophobicContact CG-CD2 4.47Å; R34-Y136 HydrophobicContact CG-CE1 3.62Å; R34-Y136 HydrophobicContact CG-CE2 4.48Å; R34-Y136 HydrophobicContact CG-CG 4.07Å; I37-Y136 HydrophobicContact CB-CD1 4.35Å; I37-Y136 HydrophobicContact CB-CE1 3.99Å; I37-Y136 HydrophobicContact CD1-CD1 4.16Å; I37-Y136 WeakPolarHBondContact CD1-O 3.23Å; I37-Y136 HydrophobicContact CG2-CD1 4.35Å; I37-Y136 HydrophobicContact CG2-CE1 3.77Å; N38-Y136 PolarHBondContact OD1-OH 3.32Å; N126-Y136 WeakPolarHBondContact CA-OH 3.36Å; N126-Y136 HydrophobicContact CB-CE2 4.04Å; N126-Y136 WeakPolarHBondContact OD1-CE2 3.48Å; M127-Y136 PolarHBondContact N-OH 2.99Å; V128-Y136 HydrophobicContact CG1-CE1 4.29Å; V128-Y136 WeakPolarHBondContact O-CE2 3.43Å; V128-Y136 PolarHBondContact O-OH 3.42Å; F130-Y136 HydrophobicContact CD2-CD1 4.11Å; F130-Y136 AromaticContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CE1 4.35Å; F130-Y136 AromaticContact CD2-CE2 3.84Å; F130-Y136 HydrophobicContact CD2-CE2 3.84Å; F130-Y136 AromaticContact CD2-CG 3.76Å; F130-Y136 HydrophobicContact CD2-CG 3.76Å; F130-Y136 AromaticContact CE2-CD1 3.97Å; F130-Y136 HydrophobicContact CE2-CD1 3.97Å; F130-Y136 HydrophobicContact CE2-CD2 4.28Å; F130-Y136 HydrophobicContact CE2-CE1 4.09Å; F130-Y136 HydrophobicContact CE2-CE2 4.34Å; F130-Y136 HydrophobicContact CE2-CG 4.1Å; F130-Y136 HydrophobicContact CG-CD2 4.48Å; E134-Y136 VanDerWaalsContact C-N 3.33Å; E134-Y136 PolarHBondContact O-N 2.84Å
137	G	92.6	Very high	91.2	Very high	0 Å²	0	58.4 Å²	58.4	0%	0	28%	0.282	C	S	.	.	T	Hydrogen-bonded Turn	trans	92.4	5.7	176	0	0	0	0	0	115.2	E134 A135 Y196 Q337	E134-G137 PolarHBondContact O-N 3.46Å; E134-G137 VanDerWaalsContact O-N 3.08Å; A135-G137 VanDerWaalsContact C-N 3.32Å; A135-G137 PolarHBondContact O-N 3.45Å; G137-Y196 WeakPolarHBondContact CA-OH 3.17Å; G137-Y196 PolarHBondContact O-OH 2.73Å; G137-Q337 WeakPolarHBondContact O-CG 3.3Å
138	R	92.9	Very high	91.5	Very high	116 Å²	116	60.3 Å²	60.3	44%	0.438	29%	0.288	S	S	.	.	T	Hydrogen-bonded Turn	trans	-77.6	-37.4	176.8	-169.3	179.6	-175.9	102.1	-0.8	112.3	L33 E134 A135	L33-R138 HydrophobicContact CD2-CB 3.99Å; E134-R138 PolarHBondContact O-N 3.43Å; A135-R138 HydrophobicContact CB-CB 4.05Å; A135-R138 VanDerWaalsContact O-CB 3.28Å; A135-R138 WeakPolarHBondContact O-CB 3.45Å; A135-R138 PolarHBondContact O-N 3.43Å
139	Y	95.1	Very high	91.5	Very high	16 Å²	16	60.3 Å²	60.3	6%	0.063	29%	0.286	C	S	.	.	S	Bend	trans	-128	156.9	-175.8	-54.4	-53.5	0	0	0	111.8	E133 E134 A135 Y196 L340 T341 N344	E133-Y139 WeakPolarHBondContact O-CB 3.36Å; E134-Y139 VanDerWaalsContact CA-O 3.23Å; E134-Y139 WeakPolarHBondContact CA-O 3.45Å; E134-Y139 PolarHBondContact O-N 2.93Å; A135-Y139 HydrophobicContact CB-CD2 3.72Å; A135-Y139 HydrophobicContact CB-CE2 4.04Å; Y139-Y196 WeakPolarHBondContact O-CE2 3.43Å; Y139-Y196 PolarHBondContact O-OH 3Å; Y139-L340 HydrophobicContact CD1-CB 4.03Å; Y139-L340 HydrophobicContact CE1-CB 3.96Å; Y139-L340 WeakPolarHBondContact CE1-O 3.44Å; Y139-T341 WeakPolarHBondContact CA-OG1 3.46Å; Y139-N344 HydrophobicContact CD1-CB 4.04Å; Y139-N344 HydrophobicContact CE1-CB 3.68Å; Y139-N344 HydrophobicContact CE2-CB 4.48Å
140	L	95	Very high	91.5	Very high	5 Å²	5	54.5 Å²	54.5	3%	0.026	26%	0.262	C	S	.	.			trans	-98.3	125.5	174	-62.9	159.4	0	0	0	109.2	L142 Y192 L193 Y196 L334 Q337 R338 T341	L140-L142 HydrophobicContact CB-CD1 4.29Å; L140-L142 HydrophobicContact CB-CD2 4.48Å; L140-L142 HydrophobicContact CB-CG 3.97Å; L140-L142 PolarHBondContact O-N 2.96Å; L140-Y192 WeakPolarHBondContact CA-OH 3.44Å; L140-Y192 HydrophobicContact CB-CE1 4.49Å; L140-Y192 HydrophobicContact CD2-CE1 4.04Å; L140-L193 HydrophobicContact CD2-CD2 4.47Å; L140-Y196 HydrophobicContact CD2-CD1 3.49Å; L140-Y196 VanDerWaalsContact CD2-CD1 3.49Å; L140-Y196 HydrophobicContact CD2-CD2 3.98Å; L140-Y196 HydrophobicContact CD2-CE1 3.43Å; L140-Y196 VanDerWaalsContact CD2-CE1 3.43Å; L140-Y196 HydrophobicContact CD2-CE2 3.92Å; L140-Y196 HydrophobicContact CD2-CG 3.78Å; L140-Y196 HydrophobicContact CG-CE1 4.39Å; L140-L334 HydrophobicContact CD2-CD1 4.19Å; L140-Q337 HydrophobicContact CD1-CB 4.26Å; L140-Q337 HydrophobicContact CG-CB 4.15Å; L140-R338 HydrophobicContact CD1-CB 4.23Å; L140-T341 HydrophobicContact CB-CG2 4.41Å; L140-T341 PolarHBondContact N-OG1 3.01Å; L140-T341 VanDerWaalsContact O-CG2 3.28Å; L140-T341 WeakPolarHBondContact O-CG2 3.45Å
141	D	94.2	Very high	91.3	Very high	46 Å²	46	59 Å²	59	25%	0.246	29%	0.288	C	S	.	.			trans	-82.8	93.2	166.8	-174.2	1.8	0	0	0	110.5	E133 E134 H143 Y192	E133-D141 HydrophobicContact CB-CB 4.26Å; E134-D141 HydrophobicContact CG-CB 4.07Å; D141-H143 WeakPolarHBondContact OD1-CB 3.29Å; D141-H143 PolarHBondContact OD1-N 3.49Å; D141-H143 VanDerWaalsContact OD1-N 3.09Å; D141-Y192 PolarHBondContact N-OH 3.44Å
142	L	94.3	Very high	91.1	Very high	1 Å²	1	57.5 Å²	57.5	1%	0.005	28%	0.275	C	S	.	.			trans	-102.1	13.1	176.7	-60.5	178.3	0	0	0	112.6	L140 D144 C145 Y146 Y160 Y163 L164 F167 L189 Y192	L140-L142 HydrophobicContact CB-CD1 4.29Å; L140-L142 HydrophobicContact CB-CD2 4.48Å; L140-L142 HydrophobicContact CB-CG 3.97Å; L140-L142 PolarHBondContact O-N 2.96Å; L142-D144 PolarHBondContact O-N 3.27Å; L142-C145 HydrophobicContact CB-CB 4.48Å; L142-C145 WeakPolarHBondContact O-CB 3.41Å; L142-C145 PolarHBondContact O-N 3.22Å; L142-Y146 WeakPolarHBondContact O-CB 3.5Å; L142-Y146 PolarHBondContact O-N 3.19Å; L142-Y160 PolarHBondContact N-OH 3.42Å; L142-Y163 HydrophobicContact CB-CE1 4.21Å; L142-L164 HydrophobicContact CB-CD2 4.06Å; L142-L164 HydrophobicContact CD1-CD2 3.68Å; L142-L164 HydrophobicContact CG-CD2 4.39Å; L142-F167 HydrophobicContact CD1-CD1 4.36Å; L142-F167 HydrophobicContact CD1-CD2 4.38Å; L142-F167 HydrophobicContact CD1-CE1 4.01Å; L142-F167 HydrophobicContact CD1-CE2 4.03Å; L142-F167 HydrophobicContact CD1-CZ 3.83Å; L142-L189 HydrophobicContact CD2-CD1 4.09Å; L142-Y192 HydrophobicContact CD2-CD1 3.73Å; L142-Y192 HydrophobicContact CD2-CE1 3.5Å; L142-Y192 VanDerWaalsContact CD2-CE1 3.5Å
143	H	91.9	Very high	90.6	Very high	90 Å²	90	59.3 Å²	59.3	42%	0.417	28%	0.277	S	S	.	.	H	α-helix	trans	-66.4	-42.4	-174.9	-165	78	0	0	0	111.7	D141 Y146 R147 Y160	D141-H143 WeakPolarHBondContact OD1-CB 3.29Å; D141-H143 PolarHBondContact OD1-N 3.49Å; D141-H143 VanDerWaalsContact OD1-N 3.09Å; H143-Y146 WeakPolarHBondContact O-CB 3.39Å; H143-Y146 PolarHBondContact O-N 3.26Å; H143-R147 WeakPolarHBondContact O-CG 3.17Å; H143-R147 PolarHBondContact O-N 2.93Å; H143-Y160 HydrophobicContact CB-CE2 4.49Å; H143-Y160 PolarHBondContact N-OH 3.07Å
144	D	92	Very high	89.7	Confident	98 Å²	98	57.2 Å²	57.2	52%	0.524	28%	0.28	S	S	.	.	H	α-helix	trans	-67.1	-37.5	176.1	-86.3	-13.3	0	0	0	112.5	L142 R147 K148	L142-D144 PolarHBondContact O-N 3.27Å; D144-R147 PolarHBondContact O-N 3.01Å; D144-R147 IonicContact OD1-NH1 3.48Å; D144-K148 WeakPolarHBondContact O-CG 3.5Å; D144-K148 PolarHBondContact O-N 3.37Å; D144-K148 VanDerWaalsContact O-N 3.15Å
145	C	93	Very high	88.7	Confident	5 Å²	5	58.2 Å²	58.2	3%	0.034	29%	0.29	C	S	.	.	H	α-helix	trans	-59	-47.5	171.4	-68.2	0	0	0	0	111.4	L142 R147 K148 F149 Y163 Y185 M188 L189	L142-C145 HydrophobicContact CB-CB 4.48Å; L142-C145 WeakPolarHBondContact O-CB 3.41Å; L142-C145 PolarHBondContact O-N 3.22Å; C145-R147 PolarHBondContact O-N 3.25Å; C145-K148 PolarHBondContact O-N 3.48Å; C145-F149 PolarHBondContact O-N 2.7Å; C145-Y163 WeakPolarHBondContact CB-OH 3.47Å; C145-Y185 HydrophobicContact CB-CE2 4.49Å; C145-Y185 WeakPolarHBondContact O-CE2 3.46Å; C145-M188 HydrophobicContact CB-CE 4.18Å; C145-L189 HydrophobicContact CB-CD1 4.36Å
146	Y	92.8	Very high	88	Confident	42 Å²	42	62.4 Å²	62.4	17%	0.165	30%	0.303	C	S	.	.	H	α-helix	trans	-59.1	-45	176.5	168.4	-111.9	0	0	0	112.6	L142 H143 K148 F149 V150 L158 Y160 Y163	L142-Y146 WeakPolarHBondContact O-CB 3.5Å; L142-Y146 PolarHBondContact O-N 3.19Å; H143-Y146 WeakPolarHBondContact O-CB 3.39Å; H143-Y146 PolarHBondContact O-N 3.26Å; Y146-K148 VanDerWaalsContact C-N 3.26Å; Y146-K148 PolarHBondContact O-N 2.96Å; Y146-F149 WeakPolarHBondContact O-CB 3.39Å; Y146-F149 PolarHBondContact O-N 3.45Å; Y146-F149 VanDerWaalsContact O-N 3.07Å; Y146-V150 HydrophobicContact CD2-CG2 3.9Å; Y146-V150 HydrophobicContact CE1-CG2 4.12Å; Y146-V150 HydrophobicContact CE2-CG2 3.41Å; Y146-V150 VanDerWaalsContact CE2-CG2 3.41Å; Y146-V150 HydrophobicContact CG-CG2 4.45Å; Y146-V150 WeakPolarHBondContact O-CG2 3.31Å; Y146-V150 PolarHBondContact O-N 3.34Å; Y146-L158 VanDerWaalsContact CE2-O 3.23Å; Y146-L158 WeakPolarHBondContact CE2-O 3.29Å; Y146-L158 PolarHBondContact OH-O 3.25Å; Y146-Y160 AromaticContact CD1-CD2 3.66Å; Y146-Y160 HydrophobicContact CD1-CD2 3.66Å; Y146-Y160 HydrophobicContact CD1-CE2 4.47Å; Y146-Y160 HydrophobicContact CD1-CG 4.4Å; Y146-Y160 HydrophobicContact CD2-CD2 4.02Å; Y146-Y160 HydrophobicContact CE1-CD2 4.33Å; Y146-Y160 AromaticContact CG-CD2 3.48Å; Y146-Y160 HydrophobicContact CG-CD2 3.48Å; Y146-Y160 VanDerWaalsContact CG-CD2 3.48Å; Y146-Y160 HydrophobicContact CG-CE2 4.15Å; Y146-Y160 HydrophobicContact CG-CG 4.49Å; Y146-Y163 AromaticContact CD2-CD1 3.98Å; Y146-Y163 HydrophobicContact CD2-CD1 3.98Å; Y146-Y163 HydrophobicContact CD2-CD2 4.1Å; Y146-Y163 AromaticContact CD2-CG 3.63Å; Y146-Y163 HydrophobicContact CD2-CG 3.63Å; Y146-Y163 HydrophobicContact CE2-CG 4.47Å; Y146-Y163 HydrophobicContact CG-CD1 4.37Å; Y146-Y163 HydrophobicContact CG-CG 4.44Å
147	R	91.3	Very high	87.4	Confident	148 Å²	148	70.2 Å²	70.2	56%	0.558	34%	0.338	S	S	*	.	H	α-helix	trans	-60.3	-36.8	178.1	-69.8	177.1	77.9	-171.5	9.9	112	H143 D144 C145 N151	H143-R147 WeakPolarHBondContact O-CG 3.17Å; H143-R147 PolarHBondContact O-N 2.93Å; D144-R147 PolarHBondContact O-N 3.01Å; D144-R147 IonicContact OD1-NH1 3.48Å; C145-R147 PolarHBondContact O-N 3.25Å; R147-N151 PolarHBondContact O-ND2 2.91Å
148	K	89.6	Confident	87.1	Confident	122 Å²	122	72.3 Å²	72.3	53%	0.53	35%	0.349	S	S	.	.	H	α-helix	trans	-71.3	-39.7	173.7	-64.5	-64.4	-176	176.2	0	111.8	D144 C145 Y146 N151 L152 Y185 M188	D144-K148 WeakPolarHBondContact O-CG 3.5Å; D144-K148 PolarHBondContact O-N 3.37Å; D144-K148 VanDerWaalsContact O-N 3.15Å; C145-K148 PolarHBondContact O-N 3.48Å; Y146-K148 VanDerWaalsContact C-N 3.26Å; Y146-K148 PolarHBondContact O-N 2.96Å; K148-N151 PolarHBondContact O-N 3.1Å; K148-L152 PolarHBondContact O-N 2.7Å; K148-Y185 HydrophobicContact CB-CD2 4.22Å; K148-M188 HydrophobicContact CB-CE 3.89Å; K148-M188 HydrophobicContact CG-CE 3.6Å; K148-M188 HydrophobicContact CG-SD 3.78Å
149	F	88.7	Confident	87	Confident	22 Å²	22	73.4 Å²	73.4	10%	0.096	36%	0.359	C	S	.	.	H	α-helix	trans	-59	-47.3	176.9	-179.5	-93.7	0	0	0	112.3	C145 Y146 N151 L152 A155 L158 Y163 Y185	C145-F149 PolarHBondContact O-N 2.7Å; Y146-F149 WeakPolarHBondContact O-CB 3.39Å; Y146-F149 PolarHBondContact O-N 3.45Å; Y146-F149 VanDerWaalsContact O-N 3.07Å; F149-N151 PolarHBondContact O-N 3.32Å; F149-L152 HydrophobicContact CD2-CD1 3.94Å; F149-L152 HydrophobicContact CE2-CD1 4.49Å; F149-L152 VanDerWaalsContact O-CB 3.25Å; F149-L152 WeakPolarHBondContact O-CB 3.24Å; F149-L152 WeakPolarHBondContact O-CG 3.49Å; F149-L152 PolarHBondContact O-N 3.07Å; F149-A155 HydrophobicContact CE1-CB 4.32Å; F149-A155 HydrophobicContact CZ-CB 4.27Å; F149-L158 HydrophobicContact CE1-CD1 3.91Å; F149-L158 HydrophobicContact CE1-CG 4.44Å; F149-L158 HydrophobicContact CZ-CD1 4.26Å; F149-Y163 HydrophobicContact CB-CD2 4.13Å; F149-Y163 HydrophobicContact CB-CE2 3.69Å; F149-Y163 AromaticContact CD1-CD2 3.75Å; F149-Y163 HydrophobicContact CD1-CD2 3.75Å; F149-Y163 HydrophobicContact CD1-CE2 4.12Å; F149-Y163 HydrophobicContact CD2-CD2 4.32Å; F149-Y163 AromaticContact CD2-CE2 3.99Å; F149-Y163 HydrophobicContact CD2-CE2 3.99Å; F149-Y163 HydrophobicContact CE1-CD2 4.24Å; F149-Y163 AromaticContact CG-CD2 3.8Å; F149-Y163 HydrophobicContact CG-CD2 3.8Å; F149-Y163 AromaticContact CG-CE2 3.66Å; F149-Y163 HydrophobicContact CG-CE2 3.66Å; F149-Y185 HydrophobicContact CB-CD2 4.3Å; F149-Y185 HydrophobicContact CB-CE2 3.78Å; F149-Y185 HydrophobicContact CD2-CE1 4.16Å; F149-Y185 HydrophobicContact CD2-CE2 4.26Å; F149-Y185 AromaticContact CD2-CZ 3.88Å
150	V	88.6	Confident	86.8	Confident	51 Å²	51	74.7 Å²	74.7	31%	0.309	36%	0.364	S	S	.	.	H	α-helix	trans	-62	-28.6	178.6	176.3	0	0	0	0	112.2	Y146 L152	Y146-V150 HydrophobicContact CD2-CG2 3.9Å; Y146-V150 HydrophobicContact CE1-CG2 4.12Å; Y146-V150 HydrophobicContact CE2-CG2 3.41Å; Y146-V150 VanDerWaalsContact CE2-CG2 3.41Å; Y146-V150 HydrophobicContact CG-CG2 4.45Å; Y146-V150 WeakPolarHBondContact O-CG2 3.31Å; Y146-V150 PolarHBondContact O-N 3.34Å; V150-L152 VanDerWaalsContact C-N 3.3Å
151	N	87.3	Confident	86.5	Confident	127 Å²	127	76.6 Å²	76.6	68%	0.679	37%	0.374	S	S	*	.	T	Hydrogen-bonded Turn	trans	-80.2	-8.5	177.3	-74.1	-43.9	0	0	0	113.6	R147 K148 F149 K153	R147-N151 PolarHBondContact O-ND2 2.91Å; K148-N151 PolarHBondContact O-N 3.1Å; F149-N151 PolarHBondContact O-N 3.32Å; N151-K153 PolarHBondContact O-N 2.97Å
152	L	85.4	Confident	86.3	Confident	21 Å²	21	76.7 Å²	76.7	11%	0.11	38%	0.378	C	S	.	.	S	Bend	trans	-66.4	129.8	178	-69.1	173	0	0	0	111	K148 F149 V150 G154 A155 E181 Y182 Y185	K148-L152 PolarHBondContact O-N 2.7Å; F149-L152 HydrophobicContact CD2-CD1 3.94Å; F149-L152 HydrophobicContact CE2-CD1 4.49Å; F149-L152 VanDerWaalsContact O-CB 3.25Å; F149-L152 WeakPolarHBondContact O-CB 3.24Å; F149-L152 WeakPolarHBondContact O-CG 3.49Å; F149-L152 PolarHBondContact O-N 3.07Å; V150-L152 VanDerWaalsContact C-N 3.3Å; L152-G154 PolarHBondContact O-N 2.81Å; L152-G154 VanDerWaalsContact O-N 3.09Å; L152-A155 HydrophobicContact CB-CB 3.88Å; L152-A155 PolarHBondContact O-N 3.44Å; L152-A155 VanDerWaalsContact O-N 3.14Å; L152-E181 HydrophobicContact CD2-CB 3.91Å; L152-Y182 HydrophobicContact CD1-CD2 4.17Å; L152-Y185 HydrophobicContact CD1-CD1 4.11Å; L152-Y185 HydrophobicContact CD1-CG 4Å
153	K	76.3	Confident	86.2	Confident	170 Å²	170	76.7 Å²	76.7	74%	0.739	38%	0.378	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.1	113	-178.3	-169.2	177.6	-177.3	178	0	111.4	N151	N151-K153 PolarHBondContact O-N 2.97Å
154	G	69.8	Low	86.1	Confident	48 Å²	48	72.8 Å²	72.8	50%	0.495	36%	0.36	S	S	.	.	T	Hydrogen-bonded Turn	trans	88.4	7.9	179.1	0	0	0	0	0	114.5	L152 R177	L152-G154 PolarHBondContact O-N 2.81Å; L152-G154 VanDerWaalsContact O-N 3.09Å; G154-R177 PolarHBondContact O-NE 3.02Å; G154-R177 PolarHBondContact O-NH1 2.7Å
155	A	71.6	Confident	85.9	Confident	29 Å²	29	70.8 Å²	70.8	24%	0.24	35%	0.354	C	S	.	.			trans	-72.4	148.6	163.9	0	0	0	0	0	110.4	F149 L152	F149-A155 HydrophobicContact CE1-CB 4.32Å; F149-A155 HydrophobicContact CZ-CB 4.27Å; L152-A155 HydrophobicContact CB-CB 3.88Å; L152-A155 PolarHBondContact O-N 3.44Å; L152-A155 VanDerWaalsContact O-N 3.14Å
156	E	74.7	Confident	85.6	Confident	124 Å²	124	72.2 Å²	72.2	58%	0.579	36%	0.364	S	S	*	.			trans	-71	141.5	173.1	-71.6	179.3	-170.7	0	0	109.6	L158	E156-L158 VanDerWaalsContact C-N 3.28Å; E156-L158 HydrophobicContact CB-CD2 4.3Å; E156-L158 HydrophobicContact CB-CG 4.32Å; E156-L158 PolarHBondContact O-N 2.89Å
157	K	79.7	Confident	85.4	Confident	194 Å²	194	70.5 Å²	70.5	84%	0.843	36%	0.357	S	S	*	.			trans	-76.1	87.4	175.4	-67.5	-173.5	179	-173.9	0	108.3
158	L	84.7	Confident	85	Confident	43 Å²	43	64.9 Å²	64.9	23%	0.225	34%	0.339	C	S	.	.			trans	-86.3	147.4	176.3	-61.6	177	0	0	0	110.1	Y146 F149 E156	Y146-L158 VanDerWaalsContact CE2-O 3.23Å; Y146-L158 WeakPolarHBondContact CE2-O 3.29Å; Y146-L158 PolarHBondContact OH-O 3.25Å; F149-L158 HydrophobicContact CE1-CD1 3.91Å; F149-L158 HydrophobicContact CE1-CG 4.44Å; F149-L158 HydrophobicContact CZ-CD1 4.26Å; E156-L158 VanDerWaalsContact C-N 3.28Å; E156-L158 HydrophobicContact CB-CD2 4.3Å; E156-L158 HydrophobicContact CB-CG 4.32Å; E156-L158 PolarHBondContact O-N 2.89Å
159	E	90.3	Very high	84.7	Confident	139 Å²	139	62.8 Å²	62.8	65%	0.65	33%	0.33	S	S	*	.			trans	-72	158.7	164.3	-66.4	-178.6	177.4	0	0	109.9	I161 S162 Y163	E159-I161 VanDerWaalsContact C-N 3.29Å; E159-I161 HydrophobicContact CB-CG2 4.27Å; E159-I161 PolarHBondContact O-N 3.1Å; E159-S162 PolarHBondContact O-N 3.32Å; E159-S162 VanDerWaalsContact O-N 3.1Å; E159-Y163 PolarHBondContact O-N 2.87Å
160	Y	91.1	Very high	84.5	Confident	43 Å²	43	61.9 Å²	61.9	17%	0.169	33%	0.327	C	S	.	.	H	α-helix	trans	-56.7	-42.7	-175.6	-175.7	-122.2	0	0	0	112.6	L142 H143 Y146 S162 Y163 L164 V345	L142-Y160 PolarHBondContact N-OH 3.42Å; H143-Y160 HydrophobicContact CB-CE2 4.49Å; H143-Y160 PolarHBondContact N-OH 3.07Å; Y146-Y160 AromaticContact CD1-CD2 3.66Å; Y146-Y160 HydrophobicContact CD1-CD2 3.66Å; Y146-Y160 HydrophobicContact CD1-CE2 4.47Å; Y146-Y160 HydrophobicContact CD1-CG 4.4Å; Y146-Y160 HydrophobicContact CD2-CD2 4.02Å; Y146-Y160 HydrophobicContact CE1-CD2 4.33Å; Y146-Y160 AromaticContact CG-CD2 3.48Å; Y146-Y160 HydrophobicContact CG-CD2 3.48Å; Y146-Y160 VanDerWaalsContact CG-CD2 3.48Å; Y146-Y160 HydrophobicContact CG-CE2 4.15Å; Y146-Y160 HydrophobicContact CG-CG 4.49Å; Y160-S162 PolarHBondContact O-N 2.95Å; Y160-Y163 HydrophobicContact CD2-CD1 4.32Å; Y160-Y163 HydrophobicContact CE2-CD1 4.32Å; Y160-Y163 WeakPolarHBondContact O-CB 3.25Å; Y160-Y163 PolarHBondContact O-N 2.87Å; Y160-L164 HydrophobicContact CD1-CD1 4.12Å; Y160-L164 HydrophobicContact CE1-CD1 3.74Å; Y160-L164 HydrophobicContact CE1-CG 4.29Å; Y160-L164 HydrophobicContact CE2-CD2 4.29Å; Y160-L164 HydrophobicContact CE2-CG 4.39Å; Y160-L164 WeakPolarHBondContact O-CG 3.34Å; Y160-L164 PolarHBondContact O-N 2.73Å; Y160-V345 HydrophobicContact CD1-CG1 3.82Å; Y160-V345 HydrophobicContact CD1-CG2 4.21Å; Y160-V345 HydrophobicContact CE1-CG1 4.2Å; Y160-V345 HydrophobicContact CE1-CG2 3.71Å
161	I	90	Very high	84.1	Confident	45 Å²	45	63.8 Å²	63.8	23%	0.231	33%	0.331	C	S	.	.	H	α-helix	trans	-60.5	-44.2	177	-170.3	171.8	0	0	0	112.5	E159 Y163 L164 S165 Q346	E159-I161 VanDerWaalsContact C-N 3.29Å; E159-I161 HydrophobicContact CB-CG2 4.27Å; E159-I161 PolarHBondContact O-N 3.1Å; I161-Y163 VanDerWaalsContact C-N 3.29Å; I161-Y163 PolarHBondContact O-N 2.91Å; I161-L164 PolarHBondContact O-N 2.69Å; I161-S165 PolarHBondContact O-N 3Å; I161-S165 PolarHBondContact O-OG 3.24Å; I161-Q346 HydrophobicContact CD1-CB 4.5Å; I161-Q346 HydrophobicContact CD1-CG 3.28Å; I161-Q346 HydrophobicContact CG1-CG 4.2Å
162	S	89.9	Confident	83.8	Confident	49 Å²	49	63.1 Å²	63.1	34%	0.343	33%	0.328	S	S	.	.	H	α-helix	trans	-67.4	-33.8	178.1	-53	0	0	0	0	111.8	E159 Y160 S165 S166	E159-S162 PolarHBondContact O-N 3.32Å; E159-S162 VanDerWaalsContact O-N 3.1Å; Y160-S162 PolarHBondContact O-N 2.95Å; S162-S165 PolarHBondContact O-N 3.4Å; S162-S166 PolarHBondContact O-N 3.41Å; S162-S166 PolarHBondContact O-OG 2.97Å
163	Y	91.9	Very high	83.5	Confident	1 Å²	1	63.8 Å²	63.8	0%	0.004	33%	0.331	C	S	.	.	H	α-helix	trans	-62.8	-46.4	171.3	167.8	-93.5	0	0	0	111.2	L142 C145 Y146 F149 E159 Y160 I161 S165 S166 F167 Y185	L142-Y163 HydrophobicContact CB-CE1 4.21Å; C145-Y163 WeakPolarHBondContact CB-OH 3.47Å; Y146-Y163 AromaticContact CD2-CD1 3.98Å; Y146-Y163 HydrophobicContact CD2-CD1 3.98Å; Y146-Y163 HydrophobicContact CD2-CD2 4.1Å; Y146-Y163 AromaticContact CD2-CG 3.63Å; Y146-Y163 HydrophobicContact CD2-CG 3.63Å; Y146-Y163 HydrophobicContact CE2-CG 4.47Å; Y146-Y163 HydrophobicContact CG-CD1 4.37Å; Y146-Y163 HydrophobicContact CG-CG 4.44Å; F149-Y163 HydrophobicContact CB-CD2 4.13Å; F149-Y163 HydrophobicContact CB-CE2 3.69Å; F149-Y163 AromaticContact CD1-CD2 3.75Å; F149-Y163 HydrophobicContact CD1-CD2 3.75Å; F149-Y163 HydrophobicContact CD1-CE2 4.12Å; F149-Y163 HydrophobicContact CD2-CD2 4.32Å; F149-Y163 AromaticContact CD2-CE2 3.99Å; F149-Y163 HydrophobicContact CD2-CE2 3.99Å; F149-Y163 HydrophobicContact CE1-CD2 4.24Å; F149-Y163 AromaticContact CG-CD2 3.8Å; F149-Y163 HydrophobicContact CG-CD2 3.8Å; F149-Y163 AromaticContact CG-CE2 3.66Å; F149-Y163 HydrophobicContact CG-CE2 3.66Å; E159-Y163 PolarHBondContact O-N 2.87Å; Y160-Y163 HydrophobicContact CD2-CD1 4.32Å; Y160-Y163 HydrophobicContact CE2-CD1 4.32Å; Y160-Y163 WeakPolarHBondContact O-CB 3.25Å; Y160-Y163 PolarHBondContact O-N 2.87Å; I161-Y163 VanDerWaalsContact C-N 3.29Å; I161-Y163 PolarHBondContact O-N 2.91Å; Y163-S165 PolarHBondContact O-N 2.75Å; Y163-S166 CarbonylContact O-C 3.56Å; Y163-S166 PolarHBondContact O-N 3.16Å; Y163-F167 HydrophobicContact CD1-CB 4.43Å; Y163-F167 HydrophobicContact CD2-CB 4.22Å; Y163-F167 HydrophobicContact CE1-CB 4.02Å; Y163-F167 HydrophobicContact CE2-CB 3.8Å; Y163-F167 WeakPolarHBondContact O-CB 3.4Å; Y163-F167 PolarHBondContact O-N 2.95Å; Y163-Y185 VanDerWaalsContact CE2-OH 3.31Å; Y163-Y185 WeakPolarHBondContact CE2-OH 3.48Å; Y163-Y185 PolarHBondContact OH-OH 2.86Å
164	L	90.5	Very high	83.5	Confident	7 Å²	7	58.3 Å²	58.3	4%	0.037	31%	0.314	C	S	.	.	H	α-helix	trans	-60.6	-28.5	177.1	-68.2	178	0	0	0	113.6	L142 Y160 I161 S166 F167 T341 V345	L142-L164 HydrophobicContact CB-CD2 4.06Å; L142-L164 HydrophobicContact CD1-CD2 3.68Å; L142-L164 HydrophobicContact CG-CD2 4.39Å; Y160-L164 HydrophobicContact CD1-CD1 4.12Å; Y160-L164 HydrophobicContact CE1-CD1 3.74Å; Y160-L164 HydrophobicContact CE1-CG 4.29Å; Y160-L164 HydrophobicContact CE2-CD2 4.29Å; Y160-L164 HydrophobicContact CE2-CG 4.39Å; Y160-L164 WeakPolarHBondContact O-CG 3.34Å; Y160-L164 PolarHBondContact O-N 2.73Å; I161-L164 PolarHBondContact O-N 2.69Å; L164-S166 VanDerWaalsContact C-N 3.35Å; L164-F167 VanDerWaalsContact O-CD1 3.25Å; L164-F167 WeakPolarHBondContact O-CD1 3.37Å; L164-F167 WeakPolarHBondContact O-CE1 3.45Å; L164-T341 HydrophobicContact CD1-CG2 4.27Å; L164-V345 HydrophobicContact CD1-CB 4.09Å; L164-V345 HydrophobicContact CD1-CG1 4.25Å; L164-V345 HydrophobicContact CD1-CG2 3.76Å
165	S	87.6	Confident	83.9	Confident	57 Å²	57	60.3 Å²	60.3	40%	0.399	31%	0.309	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.9	-14.2	175.2	-43	0	0	0	0	114.4	I161 S162 Y163 H342	I161-S165 PolarHBondContact O-N 3Å; I161-S165 PolarHBondContact O-OG 3.24Å; S162-S165 PolarHBondContact O-N 3.4Å; Y163-S165 PolarHBondContact O-N 2.75Å; S165-H342 PolarHBondContact OG-NE2 2.88Å
166	S	86.5	Confident	83.9	Confident	35 Å²	35	66 Å²	66	25%	0.245	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-134.8	-3.2	-168.5	60.6	0	0	0	0	115.3	S162 Y163 L164 D168 Q169	S162-S166 PolarHBondContact O-N 3.41Å; S162-S166 PolarHBondContact O-OG 2.97Å; Y163-S166 CarbonylContact O-C 3.56Å; Y163-S166 PolarHBondContact O-N 3.16Å; L164-S166 VanDerWaalsContact C-N 3.35Å; S166-D168 PolarHBondContact O-N 3.18Å; S166-D168 VanDerWaalsContact O-N 3.14Å; S166-Q169 WeakPolarHBondContact O-CB 3.4Å; S166-Q169 PolarHBondContact O-N 3.33Å
167	F	87.7	Confident	84.1	Confident	5 Å²	5	65.3 Å²	65.3	2%	0.022	33%	0.328	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.7	-20.9	-178.1	78.4	-83.7	0	0	0	113.1	L142 Y163 L164 L170 L189 V331 R338	L142-F167 HydrophobicContact CD1-CD1 4.36Å; L142-F167 HydrophobicContact CD1-CD2 4.38Å; L142-F167 HydrophobicContact CD1-CE1 4.01Å; L142-F167 HydrophobicContact CD1-CE2 4.03Å; L142-F167 HydrophobicContact CD1-CZ 3.83Å; Y163-F167 HydrophobicContact CD1-CB 4.43Å; Y163-F167 HydrophobicContact CD2-CB 4.22Å; Y163-F167 HydrophobicContact CE1-CB 4.02Å; Y163-F167 HydrophobicContact CE2-CB 3.8Å; Y163-F167 WeakPolarHBondContact O-CB 3.4Å; Y163-F167 PolarHBondContact O-N 2.95Å; L164-F167 VanDerWaalsContact O-CD1 3.25Å; L164-F167 WeakPolarHBondContact O-CD1 3.37Å; L164-F167 WeakPolarHBondContact O-CE1 3.45Å; F167-L170 VanDerWaalsContact O-CD2 3.28Å; F167-L170 WeakPolarHBondContact O-CD2 3.41Å; F167-L189 HydrophobicContact CD2-CD1 4.49Å; F167-L189 HydrophobicContact CD2-CD2 4.28Å; F167-V331 HydrophobicContact CE2-CG2 3.67Å; F167-V331 HydrophobicContact CZ-CG1 4.38Å; F167-V331 HydrophobicContact CZ-CG2 4.17Å; F167-R338 HydrophobicContact CE1-CG 3.78Å; F167-R338 HydrophobicContact CZ-CG 3.94Å
168	D	82.4	Confident	84.4	Confident	31 Å²	31	56.2 Å²	56.2	17%	0.166	29%	0.288	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.9	-7.6	175	69.7	-42.8	0	0	0	113.2	S166 L170 Y328 V331 R338	S166-D168 PolarHBondContact O-N 3.18Å; S166-D168 VanDerWaalsContact O-N 3.14Å; D168-L170 PolarHBondContact O-N 3.13Å; D168-L170 VanDerWaalsContact O-N 3.12Å; D168-Y328 WeakPolarHBondContact O-CD1 3.48Å; D168-Y328 WeakPolarHBondContact O-CE1 3.23Å; D168-V331 HydrophobicContact CB-CB 4.39Å; D168-V331 HydrophobicContact CB-CG1 3.72Å; D168-V331 HydrophobicContact CB-CG2 4.36Å; D168-R338 VanDerWaalsContact CG-NH1 3.34Å; D168-R338 IonicContact OD2-CZ 3.65Å; D168-R338 IonicContact OD2-NH1 3.15Å; D168-R338 PolarHBondContact OD2-NH1 3.17Å
169	Q	84.7	Confident	84.5	Confident	77 Å²	77	56.5 Å²	56.5	36%	0.36	29%	0.289	S	S	.	.			trans	-88.6	48.9	178.6	-60.6	177.2	-6.9	0	0	111.4	S166 F171 D172	S166-Q169 WeakPolarHBondContact O-CB 3.4Å; S166-Q169 PolarHBondContact O-N 3.33Å; Q169-F171 HydrophobicContact CB-CE1 4.27Å; Q169-F171 HydrophobicContact CB-CE2 4.37Å; Q169-F171 HydrophobicContact CB-CZ 3.96Å; Q169-F171 HydrophobicContact CG-CE1 4.41Å; Q169-F171 HydrophobicContact CG-CZ 3.98Å; Q169-F171 PolarHBondContact O-N 2.71Å; Q169-F171 VanDerWaalsContact O-N 3.09Å; Q169-D172 PolarHBondContact O-N 2.76Å
170	L	83.1	Confident	84.3	Confident	3 Å²	3	53.1 Å²	53.1	2%	0.016	29%	0.285	C	S	.	.	G	3₁₀ helix	trans	-65.9	-15.2	-176	-54.2	173.6	0	0	0	113.1	F167 D168 D172 I173 K178 L186 E324 I327 Y328	F167-L170 VanDerWaalsContact O-CD2 3.28Å; F167-L170 WeakPolarHBondContact O-CD2 3.41Å; D168-L170 PolarHBondContact O-N 3.13Å; D168-L170 VanDerWaalsContact O-N 3.12Å; L170-D172 VanDerWaalsContact C-N 3.32Å; L170-I173 HydrophobicContact CD2-CD1 4.13Å; L170-I173 PolarHBondContact O-N 3.26Å; L170-K178 PolarHBondContact O-NZ 3.42Å; L170-L186 HydrophobicContact CD1-CD2 3.74Å; L170-L186 HydrophobicContact CD2-CD2 3.99Å; L170-E324 HydrophobicContact CB-CG 4.24Å; L170-E324 HydrophobicContact CD1-CB 4.22Å; L170-E324 HydrophobicContact CD1-CG 3.97Å; L170-I327 HydrophobicContact CD1-CB 4.1Å; L170-I327 HydrophobicContact CD1-CD1 4.02Å; L170-I327 HydrophobicContact CD1-CG2 3.89Å; L170-Y328 HydrophobicContact CB-CE1 3.81Å; L170-Y328 WeakPolarHBondContact CB-OH 3.28Å; L170-Y328 HydrophobicContact CD1-CE1 4.15Å; L170-Y328 HydrophobicContact CG-CE1 4.09Å
171	F	81.4	Confident	84.2	Confident	91 Å²	91	55.8 Å²	55.8	40%	0.399	30%	0.3	S	S	.	.	G	3₁₀ helix	trans	-72.7	-22.2	177.2	51.4	-99.5	0	0	0	113.4	Q169 I173 P227 Y328	Q169-F171 HydrophobicContact CB-CE1 4.27Å; Q169-F171 HydrophobicContact CB-CE2 4.37Å; Q169-F171 HydrophobicContact CB-CZ 3.96Å; Q169-F171 HydrophobicContact CG-CE1 4.41Å; Q169-F171 HydrophobicContact CG-CZ 3.98Å; Q169-F171 PolarHBondContact O-N 2.71Å; Q169-F171 VanDerWaalsContact O-N 3.09Å; F171-I173 VanDerWaalsContact C-N 3.32Å; F171-P227 HydrophobicContact CB-CB 3.85Å; F171-Y328 HydrophobicContact CD1-CE1 4.26Å; F171-Y328 PolarHBondContact N-OH 2.91Å
172	D	80.1	Confident	84.2	Confident	114 Å²	114	53.9 Å²	53.9	61%	0.61	29%	0.289	S	S	*	.	G	3₁₀ helix	trans	-81.3	-14.7	178.1	-70.6	-28.7	0	0	0	112.6	Q169 L170 S174	Q169-D172 PolarHBondContact O-N 2.76Å; L170-D172 VanDerWaalsContact C-N 3.32Å; D172-S174 PolarHBondContact O-N 2.6Å
173	I	80.6	Confident	84.3	Confident	35 Å²	35	53.7 Å²	53.7	18%	0.179	28%	0.282	C	S	.	.	S	Bend	trans	-74.1	116.9	178.6	-59	178.5	0	0	0	109.6	L170 F171 R177 K178 Y182	L170-I173 HydrophobicContact CD2-CD1 4.13Å; L170-I173 PolarHBondContact O-N 3.26Å; F171-I173 VanDerWaalsContact C-N 3.32Å; I173-R177 HydrophobicContact CG2-CB 3.93Å; I173-K178 HydrophobicContact CG2-CG 4.32Å; I173-K178 WeakPolarHBondContact O-CE 3.37Å; I173-Y182 HydrophobicContact CD1-CE2 3.55Å; I173-Y182 HydrophobicContact CG2-CE2 4.37Å
174	S	76.1	Confident	84.3	Confident	55 Å²	55	60.5 Å²	60.5	39%	0.385	31%	0.312	S	S	.	.			trans	-54.1	140.3	177.3	174.8	0	0	0	0	112.4	D172 D176 R177	D172-S174 PolarHBondContact O-N 2.6Å; S174-D176 PolarHBondContact O-N 3.47Å; S174-D176 VanDerWaalsContact O-N 3.08Å; S174-D176 PolarHBondContact OG-N 3.07Å; S174-R177 WeakPolarHBondContact O-CB 3.23Å; S174-R177 PolarHBondContact O-N 3.45Å
175	K	76.4	Confident	84.4	Confident	90 Å²	90	60.4 Å²	60.4	39%	0.391	31%	0.311	S	S	.	.	G	3₁₀ helix	trans	-51.1	-33.3	176.3	-174.1	179.6	175.6	-176	0	113	R177 K178 W229 E232	K175-R177 PolarHBondContact O-N 3.4Å; K175-K178 PolarHBondContact O-N 2.96Å; K175-W229 HydrophobicContact CD-CZ3 4.43Å; K175-W229 HydrophobicContact CG-CZ3 4.13Å; K175-E232 IonicContact NZ-OE1 2.78Å; K175-E232 PolarHBondContact NZ-OE1 2.85Å; K175-E232 VanDerWaalsContact NZ-OE1 3.15Å
176	D	73.4	Confident	84.7	Confident	148 Å²	148	57.7 Å²	57.7	79%	0.791	29%	0.292	S	S	*	.	G	3₁₀ helix	trans	-67.5	-23.9	178.9	-60.7	-46.5	0	0	0	113	S174	S174-D176 PolarHBondContact O-N 3.47Å; S174-D176 VanDerWaalsContact O-N 3.08Å; S174-D176 PolarHBondContact OG-N 3.07Å
177	R	78.9	Confident	85.1	Confident	110 Å²	110	60 Å²	60	42%	0.415	30%	0.299	S	S	.	.	G	3₁₀ helix	trans	-88.2	-14.2	177.5	-60.1	-176.1	-178.3	-179.6	-0.9	112.6	G154 I173 S174 K175 N179	G154-R177 PolarHBondContact O-NE 3.02Å; G154-R177 PolarHBondContact O-NH1 2.7Å; I173-R177 HydrophobicContact CG2-CB 3.93Å; S174-R177 WeakPolarHBondContact O-CB 3.23Å; S174-R177 PolarHBondContact O-N 3.45Å; K175-R177 PolarHBondContact O-N 3.4Å; R177-N179 PolarHBondContact O-N 2.83Å
178	K	85.1	Confident	85.5	Confident	3 Å²	3	62.5 Å²	62.5	1%	0.013	31%	0.312	C	S	.	.			trans	-77.6	63.3	178	-57.6	-167.1	-178.9	-167.8	0	111.8	L170 I173 K175 Y182 W229 I320 E324	L170-K178 PolarHBondContact O-NZ 3.42Å; I173-K178 HydrophobicContact CG2-CG 4.32Å; I173-K178 WeakPolarHBondContact O-CE 3.37Å; K175-K178 PolarHBondContact O-N 2.96Å; K178-Y182 HydrophobicContact CB-CD1 3.9Å; K178-Y182 HydrophobicContact CB-CE1 4.11Å; K178-Y182 HydrophobicContact CD-CE1 4.05Å; K178-Y182 HydrophobicContact CG-CD1 3.96Å; K178-Y182 HydrophobicContact CG-CE1 3.71Å; K178-W229 HydrophobicContact CB-CH2 4.44Å; K178-W229 HydrophobicContact CD-CH2 3.95Å; K178-W229 HydrophobicContact CD-CZ2 3.41Å; K178-W229 VanDerWaalsContact CD-CZ2 3.41Å; K178-I320 HydrophobicContact CD-CG2 4.4Å; K178-E324 WeakPolarHBondContact CD-OE1 3.28Å; K178-E324 WeakPolarHBondContact CE-OE1 3.25Å; K178-E324 IonicContact NZ-OE1 2.79Å; K178-E324 PolarHBondContact NZ-OE1 2.98Å; K178-E324 IonicContact NZ-OE2 2.85Å; K178-E324 PolarHBondContact NZ-OE2 2.89Å
179	N	85.8	Confident	86.1	Confident	48 Å²	48	61 Å²	61	26%	0.257	30%	0.304	S	S	.	.			trans	-91.4	-174	-178.8	69.1	28.8	0	0	0	111.8	R177 E181 Y182 K183	R177-N179 PolarHBondContact O-N 2.83Å; N179-E181 VanDerWaalsContact C-N 3.32Å; N179-E181 PolarHBondContact O-N 3.48Å; N179-E181 WeakPolarHBondContact OD1-CA 3.43Å; N179-E181 WeakPolarHBondContact OD1-CB 3.45Å; N179-E181 PolarHBondContact OD1-N 3.47Å; N179-Y182 PolarHBondContact O-N 3.21Å; N179-Y182 PolarHBondContact OD1-N 2.85Å; N179-K183 PolarHBondContact O-N 2.79Å
180	A	87.9	Confident	86.6	Confident	68 Å²	68	57.7 Å²	57.7	56%	0.562	29%	0.288	S	S	*	.	H	α-helix	trans	-67.3	-28.1	180	0	0	0	0	0	113.9	K184	A180-K184 WeakPolarHBondContact O-CG 3.29Å; A180-K184 PolarHBondContact O-N 2.76Å
181	E	88.4	Confident	87.3	Confident	100 Å²	100	64 Å²	64	47%	0.467	32%	0.318	S	S	.	.	H	α-helix	trans	-72.5	-40.4	175.6	-62.4	175	175.2	0	0	110.7	L152 N179 K183 K184 Y185	L152-E181 HydrophobicContact CD2-CB 3.91Å; N179-E181 VanDerWaalsContact C-N 3.32Å; N179-E181 PolarHBondContact O-N 3.48Å; N179-E181 WeakPolarHBondContact OD1-CA 3.43Å; N179-E181 WeakPolarHBondContact OD1-CB 3.45Å; N179-E181 PolarHBondContact OD1-N 3.47Å; E181-K183 VanDerWaalsContact C-N 3.34Å; E181-K184 PolarHBondContact O-N 2.8Å; E181-Y185 PolarHBondContact O-N 2.87Å
182	Y	89.8	Confident	88	Confident	5 Å²	5	61.5 Å²	61.5	2%	0.02	31%	0.306	C	S	.	.	H	α-helix	trans	-61.1	-42.6	172.4	176.6	-104.5	0	0	0	111.7	L152 I173 K178 N179 K184 Y185 L186 I320 E324	L152-Y182 HydrophobicContact CD1-CD2 4.17Å; I173-Y182 HydrophobicContact CD1-CE2 3.55Å; I173-Y182 HydrophobicContact CG2-CE2 4.37Å; K178-Y182 HydrophobicContact CB-CD1 3.9Å; K178-Y182 HydrophobicContact CB-CE1 4.11Å; K178-Y182 HydrophobicContact CD-CE1 4.05Å; K178-Y182 HydrophobicContact CG-CD1 3.96Å; K178-Y182 HydrophobicContact CG-CE1 3.71Å; N179-Y182 PolarHBondContact O-N 3.21Å; N179-Y182 PolarHBondContact OD1-N 2.85Å; Y182-K184 VanDerWaalsContact C-N 3.32Å; Y182-K184 PolarHBondContact O-N 2.92Å; Y182-Y185 HydrophobicContact CD2-CD1 4.26Å; Y182-Y185 HydrophobicContact CE2-CD1 4.35Å; Y182-Y185 WeakPolarHBondContact O-CB 3.47Å; Y182-Y185 PolarHBondContact O-N 3.34Å; Y182-L186 HydrophobicContact CD1-CD1 3.92Å; Y182-L186 HydrophobicContact CD1-CG 4.27Å; Y182-L186 HydrophobicContact CE1-CD1 3.34Å; Y182-L186 HydrophobicContact CE1-CD2 4.36Å; Y182-L186 HydrophobicContact CE1-CG 3.89Å; Y182-L186 HydrophobicContact CE2-CD2 4.16Å; Y182-L186 HydrophobicContact CE2-CG 4.25Å; Y182-L186 WeakPolarHBondContact O-CG 3.34Å; Y182-L186 PolarHBondContact O-N 3.14Å; Y182-I320 HydrophobicContact CD1-CG2 4.25Å; Y182-I320 HydrophobicContact CE1-CG2 3.98Å; Y182-E324 WeakPolarHBondContact CE1-OE1 3.32Å; Y182-E324 PolarHBondContact OH-OE1 3.09Å
183	K	91.1	Very high	88.8	Confident	44 Å²	44	56.1 Å²	56.1	19%	0.191	28%	0.277	C	S	.	.	H	α-helix	trans	-56	-46.4	174	-172.3	-177.6	-178.9	-165.6	0	111.7	N179 E181 Y185 L186 E187 E319 I320 L323	N179-K183 PolarHBondContact O-N 2.79Å; E181-K183 VanDerWaalsContact C-N 3.34Å; K183-Y185 VanDerWaalsContact C-N 3.33Å; K183-Y185 PolarHBondContact O-N 3.27Å; K183-L186 PolarHBondContact O-N 3.12Å; K183-E187 WeakPolarHBondContact CE-OE1 3.42Å; K183-E187 IonicContact NZ-OE1 3.93Å; K183-E187 WeakPolarHBondContact O-CG 3.39Å; K183-E187 PolarHBondContact O-N 3.18Å; K183-E319 IonicContact NZ-OE2 2.98Å; K183-E319 PolarHBondContact NZ-OE2 3.43Å; K183-I320 HydrophobicContact CB-CD1 4.36Å; K183-I320 HydrophobicContact CB-CG1 4.17Å; K183-I320 HydrophobicContact CD-CG1 4.18Å; K183-I320 HydrophobicContact CG-CG1 4.05Å; K183-L323 HydrophobicContact CG-CD1 3.92Å
184	K	92.6	Very high	89.5	Confident	144 Å²	144	56.9 Å²	56.9	63%	0.626	28%	0.28	S	S	*	.	H	α-helix	trans	-62.7	-38.5	177.5	-71.2	175.5	178.6	-176.1	0	112.9	A180 E181 Y182 E187 M188	A180-K184 WeakPolarHBondContact O-CG 3.29Å; A180-K184 PolarHBondContact O-N 2.76Å; E181-K184 PolarHBondContact O-N 2.8Å; Y182-K184 VanDerWaalsContact C-N 3.32Å; Y182-K184 PolarHBondContact O-N 2.92Å; K184-E187 PolarHBondContact O-N 2.96Å; K184-M188 WeakPolarHBondContact O-CB 3.49Å; K184-M188 PolarHBondContact O-N 3.13Å
185	Y	93	Very high	90.4	Very high	6 Å²	6	57.7 Å²	57.7	2%	0.024	28%	0.28	C	S	.	.	H	α-helix	trans	-62.4	-45	173.7	160.1	-95.9	0	0	0	111.2	C145 K148 F149 L152 Y163 E181 Y182 K183 M188 L189	C145-Y185 HydrophobicContact CB-CE2 4.49Å; C145-Y185 WeakPolarHBondContact O-CE2 3.46Å; K148-Y185 HydrophobicContact CB-CD2 4.22Å; F149-Y185 HydrophobicContact CB-CD2 4.3Å; F149-Y185 HydrophobicContact CB-CE2 3.78Å; F149-Y185 HydrophobicContact CD2-CE1 4.16Å; F149-Y185 HydrophobicContact CD2-CE2 4.26Å; F149-Y185 AromaticContact CD2-CZ 3.88Å; L152-Y185 HydrophobicContact CD1-CD1 4.11Å; L152-Y185 HydrophobicContact CD1-CG 4Å; Y163-Y185 VanDerWaalsContact CE2-OH 3.31Å; Y163-Y185 WeakPolarHBondContact CE2-OH 3.48Å; Y163-Y185 PolarHBondContact OH-OH 2.86Å; E181-Y185 PolarHBondContact O-N 2.87Å; Y182-Y185 HydrophobicContact CD2-CD1 4.26Å; Y182-Y185 HydrophobicContact CE2-CD1 4.35Å; Y182-Y185 WeakPolarHBondContact O-CB 3.47Å; Y182-Y185 PolarHBondContact O-N 3.34Å; K183-Y185 VanDerWaalsContact C-N 3.33Å; K183-Y185 PolarHBondContact O-N 3.27Å; Y185-M188 PolarHBondContact O-N 3.03Å; Y185-L189 HydrophobicContact CE1-CD2 4.29Å; Y185-L189 WeakPolarHBondContact O-CB 3.42Å; Y185-L189 PolarHBondContact O-N 3.43Å
186	L	93.8	Very high	91.4	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-63.7	-41.4	176.5	-68.4	-178.7	0	0	0	112.5	L170 Y182 K183 M188 L189 L190 I320 L323 E324 I327	L170-L186 HydrophobicContact CD1-CD2 3.74Å; L170-L186 HydrophobicContact CD2-CD2 3.99Å; Y182-L186 HydrophobicContact CD1-CD1 3.92Å; Y182-L186 HydrophobicContact CD1-CG 4.27Å; Y182-L186 HydrophobicContact CE1-CD1 3.34Å; Y182-L186 HydrophobicContact CE1-CD2 4.36Å; Y182-L186 HydrophobicContact CE1-CG 3.89Å; Y182-L186 HydrophobicContact CE2-CD2 4.16Å; Y182-L186 HydrophobicContact CE2-CG 4.25Å; Y182-L186 WeakPolarHBondContact O-CG 3.34Å; Y182-L186 PolarHBondContact O-N 3.14Å; K183-L186 PolarHBondContact O-N 3.12Å; L186-M188 VanDerWaalsContact C-N 3.33Å; L186-M188 PolarHBondContact O-N 3.24Å; L186-L189 PolarHBondContact O-N 2.64Å; L186-L190 WeakPolarHBondContact O-CB 3.44Å; L186-L190 PolarHBondContact O-N 3.28Å; L186-I320 HydrophobicContact CD1-CG2 3.91Å; L186-L323 HydrophobicContact CB-CB 4.4Å; L186-L323 HydrophobicContact CB-CD1 4.47Å; L186-L323 HydrophobicContact CD1-CB 4.38Å; L186-E324 HydrophobicContact CD1-CG 3.69Å; L186-I327 HydrophobicContact CB-CD1 4.04Å; L186-I327 HydrophobicContact CD2-CD1 3.54Å; L186-I327 HydrophobicContact CG-CD1 4.31Å
187	E	95.4	Very high	92.4	Very high	84 Å²	84	46.3 Å²	46.3	39%	0.393	22%	0.223	S	C	.	.	H	α-helix	trans	-58.6	-47.1	175.7	-73.7	168.4	168.3	0	0	110.6	K183 K184 L190 E191 L323	K183-E187 WeakPolarHBondContact CE-OE1 3.42Å; K183-E187 IonicContact NZ-OE1 3.93Å; K183-E187 WeakPolarHBondContact O-CG 3.39Å; K183-E187 PolarHBondContact O-N 3.18Å; K184-E187 PolarHBondContact O-N 2.96Å; E187-L190 PolarHBondContact O-N 3.39Å; E187-E191 VanDerWaalsContact O-CB 3.29Å; E187-E191 WeakPolarHBondContact O-CB 3.4Å; E187-E191 PolarHBondContact O-N 2.65Å; E187-L323 HydrophobicContact CG-CD1 3.81Å; E187-L323 HydrophobicContact CG-CD2 4.41Å
188	M	95.6	Very high	93.2	Very high	57 Å²	57	44.9 Å²	44.9	28%	0.281	22%	0.221	S	C	.	.	H	α-helix	trans	-65.6	-43.2	178.3	-172.8	-168.3	78.4	0	0	112.8	C145 K148 K184 Y185 L186 Y192	C145-M188 HydrophobicContact CB-CE 4.18Å; K148-M188 HydrophobicContact CB-CE 3.89Å; K148-M188 HydrophobicContact CG-CE 3.6Å; K148-M188 HydrophobicContact CG-SD 3.78Å; K184-M188 WeakPolarHBondContact O-CB 3.49Å; K184-M188 PolarHBondContact O-N 3.13Å; Y185-M188 PolarHBondContact O-N 3.03Å; L186-M188 VanDerWaalsContact C-N 3.33Å; L186-M188 PolarHBondContact O-N 3.24Å; M188-Y192 PolarHBondContact O-N 3.46Å; M188-Y192 VanDerWaalsContact O-N 3.07Å
189	L	95.4	Very high	93.7	Very high	0 Å²	0	46.5 Å²	46.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-63.7	-43.8	176.6	174.8	62.1	0	0	0	111	L142 C145 F167 Y185 L186 Y192 L193 I327	L142-L189 HydrophobicContact CD2-CD1 4.09Å; C145-L189 HydrophobicContact CB-CD1 4.36Å; F167-L189 HydrophobicContact CD2-CD1 4.49Å; F167-L189 HydrophobicContact CD2-CD2 4.28Å; Y185-L189 HydrophobicContact CE1-CD2 4.29Å; Y185-L189 WeakPolarHBondContact O-CB 3.42Å; Y185-L189 PolarHBondContact O-N 3.43Å; L186-L189 PolarHBondContact O-N 2.64Å; L189-Y192 PolarHBondContact O-N 3.48Å; L189-L193 HydrophobicContact CD1-CD1 4Å; L189-L193 HydrophobicContact CD1-CG 4.13Å; L189-L193 HydrophobicContact CG-CD1 3.98Å; L189-L193 HydrophobicContact CG-CG 4.47Å; L189-L193 WeakPolarHBondContact O-CB 3.43Å; L189-L193 VanDerWaalsContact O-CG 3.25Å; L189-L193 WeakPolarHBondContact O-CG 3.3Å; L189-L193 PolarHBondContact O-N 2.95Å; L189-I327 HydrophobicContact CD2-CD1 4.2Å; L189-I327 HydrophobicContact CD2-CG2 4.21Å; L189-I327 HydrophobicContact CG-CD1 4.47Å
190	L	95.7	Very high	94.2	Very high	7 Å²	7	44.7 Å²	44.7	4%	0.037	22%	0.218	C	C	.	.	H	α-helix	trans	-65	-44.7	178.8	178.7	62.2	0	0	0	111.3	L186 E187 Y192 L193 Q194 L323 Q326 I327 Y330	L186-L190 WeakPolarHBondContact O-CB 3.44Å; L186-L190 PolarHBondContact O-N 3.28Å; E187-L190 PolarHBondContact O-N 3.39Å; L190-Y192 VanDerWaalsContact C-N 3.33Å; L190-Y192 PolarHBondContact O-N 3.15Å; L190-L193 PolarHBondContact O-N 3.17Å; L190-Q194 HydrophobicContact CD1-CG 3.95Å; L190-Q194 HydrophobicContact CG-CG 4.22Å; L190-Q194 VanDerWaalsContact O-CB 3.31Å; L190-Q194 WeakPolarHBondContact O-CB 3.45Å; L190-Q194 VanDerWaalsContact O-CG 3.27Å; L190-Q194 WeakPolarHBondContact O-CG 3.27Å; L190-Q194 PolarHBondContact O-N 3.35Å; L190-L323 HydrophobicContact CD2-CD2 3.57Å; L190-Q326 HydrophobicContact CD1-CB 3.63Å; L190-Q326 HydrophobicContact CD2-CB 3.96Å; L190-Q326 HydrophobicContact CG-CB 4.48Å; L190-I327 HydrophobicContact CB-CD1 4.25Å; L190-I327 HydrophobicContact CB-CG1 3.92Å; L190-I327 HydrophobicContact CD1-CG1 3.96Å; L190-I327 HydrophobicContact CG-CG1 4.46Å; L190-Y330 HydrophobicContact CD1-CD2 3.56Å; L190-Y330 HydrophobicContact CD1-CE2 3.78Å
191	E	96.5	Very high	94.5	Very high	136 Å²	136	45 Å²	45	64%	0.636	21%	0.207	S	C	*	.	H	α-helix	trans	-56.3	-48.5	176.5	-178	174.6	-163.1	0	0	110.8	E187 Q194 D195	E187-E191 VanDerWaalsContact O-CB 3.29Å; E187-E191 WeakPolarHBondContact O-CB 3.4Å; E187-E191 PolarHBondContact O-N 2.65Å; E191-Q194 PolarHBondContact O-N 3.48Å; E191-D195 VanDerWaalsContact O-CB 3.24Å; E191-D195 WeakPolarHBondContact O-CB 3.41Å; E191-D195 PolarHBondContact O-N 3.02Å
192	Y	96.5	Very high	94.8	Very high	38 Å²	38	40.3 Å²	40.3	15%	0.149	19%	0.185	C	C	.	.	H	α-helix	trans	-59.1	-48.7	174.6	172.6	-93.6	0	0	0	112.3	E134 L140 D141 L142 M188 L189 L190 Q194 Y196	E134-Y192 PolarHBondContact OE1-OH 3.47Å; L140-Y192 WeakPolarHBondContact CA-OH 3.44Å; L140-Y192 HydrophobicContact CB-CE1 4.49Å; L140-Y192 HydrophobicContact CD2-CE1 4.04Å; D141-Y192 PolarHBondContact N-OH 3.44Å; L142-Y192 HydrophobicContact CD2-CD1 3.73Å; L142-Y192 HydrophobicContact CD2-CE1 3.5Å; L142-Y192 VanDerWaalsContact CD2-CE1 3.5Å; M188-Y192 PolarHBondContact O-N 3.46Å; M188-Y192 VanDerWaalsContact O-N 3.07Å; L189-Y192 PolarHBondContact O-N 3.48Å; L190-Y192 VanDerWaalsContact C-N 3.33Å; L190-Y192 PolarHBondContact O-N 3.15Å; Y192-Q194 VanDerWaalsContact C-N 3.33Å; Y192-Q194 PolarHBondContact O-N 2.9Å; Y192-Y196 AromaticContact CZ-CD2 3.97Å; Y192-Y196 WeakPolarHBondContact O-CB 3.36Å; Y192-Y196 PolarHBondContact O-N 3.46Å; Y192-Y196 WeakPolarHBondContact OH-CD2 3.44Å
193	L	95.9	Very high	95	Very high	1 Å²	1	43.6 Å²	43.6	1%	0.005	20%	0.202	C	C	.	.	H	α-helix	trans	-66	-35.7	-178.4	-69.8	173.2	0	0	0	112.5	L140 L189 L190 T197 I327 V331 L334	L140-L193 HydrophobicContact CD2-CD2 4.47Å; L189-L193 HydrophobicContact CD1-CD1 4Å; L189-L193 HydrophobicContact CD1-CG 4.13Å; L189-L193 HydrophobicContact CG-CD1 3.98Å; L189-L193 HydrophobicContact CG-CG 4.47Å; L189-L193 WeakPolarHBondContact O-CB 3.43Å; L189-L193 VanDerWaalsContact O-CG 3.25Å; L189-L193 WeakPolarHBondContact O-CG 3.3Å; L189-L193 PolarHBondContact O-N 2.95Å; L190-L193 PolarHBondContact O-N 3.17Å; L193-T197 VanDerWaalsContact O-CB 3.28Å; L193-T197 WeakPolarHBondContact O-CB 3.37Å; L193-T197 PolarHBondContact O-N 2.77Å; L193-T197 PolarHBondContact O-OG1 2.8Å; L193-I327 HydrophobicContact CD1-CG2 4.02Å; L193-V331 HydrophobicContact CD1-CG2 3.84Å; L193-L334 HydrophobicContact CD2-CD1 3.87Å
194	Q	95.4	Very high	95.2	Very high	51 Å²	51	44.3 Å²	44.3	24%	0.238	21%	0.208	C	C	.	.	H	α-helix	trans	-64.4	-55.1	176.4	-81.1	179.3	-22.8	0	0	111	L190 E191 Y192 T197 E198 Q206 Y330	L190-Q194 HydrophobicContact CD1-CG 3.95Å; L190-Q194 HydrophobicContact CG-CG 4.22Å; L190-Q194 VanDerWaalsContact O-CB 3.31Å; L190-Q194 WeakPolarHBondContact O-CB 3.45Å; L190-Q194 VanDerWaalsContact O-CG 3.27Å; L190-Q194 WeakPolarHBondContact O-CG 3.27Å; L190-Q194 PolarHBondContact O-N 3.35Å; E191-Q194 PolarHBondContact O-N 3.48Å; Y192-Q194 VanDerWaalsContact C-N 3.33Å; Y192-Q194 PolarHBondContact O-N 2.9Å; Q194-T197 WeakPolarHBondContact O-CB 3.38Å; Q194-T197 PolarHBondContact O-N 2.96Å; Q194-T197 VanDerWaalsContact O-N 3.14Å; Q194-E198 PolarHBondContact O-N 3.46Å; Q194-Q206 PolarHBondContact O-NE2 2.86Å; Q194-Y330 HydrophobicContact CG-CD2 4.08Å; Q194-Y330 HydrophobicContact CG-CE1 4.03Å; Q194-Y330 HydrophobicContact CG-CE2 3.49Å; Q194-Y330 VanDerWaalsContact CG-CE2 3.49Å; Q194-Y330 VanDerWaalsContact CG-CZ 3.45Å; Q194-Y330 PolarHBondContact NE2-OH 3.21Å
195	D	96.3	Very high	95.1	Very high	71 Å²	71	41.7 Å²	41.7	38%	0.38	20%	0.201	S	C	.	.	H	α-helix	trans	-59.8	-47	179	175.1	44	0	0	0	111.2	E191 T197 E198 R199	E191-D195 VanDerWaalsContact O-CB 3.24Å; E191-D195 WeakPolarHBondContact O-CB 3.41Å; E191-D195 PolarHBondContact O-N 3.02Å; D195-T197 VanDerWaalsContact C-N 3.31Å; D195-T197 PolarHBondContact O-N 2.9Å; D195-E198 WeakPolarHBondContact O-CB 3.41Å; D195-E198 PolarHBondContact O-N 2.93Å; D195-E198 VanDerWaalsContact O-N 3.12Å; D195-R199 WeakPolarHBondContact O-CG 3.43Å; D195-R199 PolarHBondContact O-N 3Å; D195-R199 IonicContact OD1-NH1 3.99Å; D195-R199 PolarHBondContact OD1-NH1 3.33Å; D195-R199 VanDerWaalsContact OD1-NH1 3.1Å; D195-R199 IonicContact OD2-CZ 3.82Å; D195-R199 IonicContact OD2-NH1 2.72Å; D195-R199 PolarHBondContact OD2-NH1 2.99Å; D195-R199 IonicContact OD2-NH2 3.97Å
196	Y	96.4	Very high	94.9	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	21%	0.206	C	C	.	.	H	α-helix	trans	-57.2	-44.1	173.4	-172.1	-85.2	0	0	0	111.9	F130 E134 G137 Y139 L140 Y192 E198 R199 V200 L334 Q337	F130-Y196 HydrophobicContact CD1-CE2 4.49Å; F130-Y196 HydrophobicContact CE1-CE2 4.28Å; E134-Y196 HydrophobicContact CB-CE2 4.18Å; E134-Y196 HydrophobicContact CG-CD2 4.39Å; E134-Y196 HydrophobicContact CG-CE2 3.92Å; E134-Y196 VanDerWaalsContact OE1-CD2 3.23Å; E134-Y196 WeakPolarHBondContact OE1-CD2 3.43Å; G137-Y196 WeakPolarHBondContact CA-OH 3.17Å; G137-Y196 PolarHBondContact O-OH 2.73Å; Y139-Y196 WeakPolarHBondContact O-CE2 3.43Å; Y139-Y196 PolarHBondContact O-OH 3Å; L140-Y196 HydrophobicContact CD2-CD1 3.49Å; L140-Y196 VanDerWaalsContact CD2-CD1 3.49Å; L140-Y196 HydrophobicContact CD2-CD2 3.98Å; L140-Y196 HydrophobicContact CD2-CE1 3.43Å; L140-Y196 VanDerWaalsContact CD2-CE1 3.43Å; L140-Y196 HydrophobicContact CD2-CE2 3.92Å; L140-Y196 HydrophobicContact CD2-CG 3.78Å; L140-Y196 HydrophobicContact CG-CE1 4.39Å; Y192-Y196 AromaticContact CZ-CD2 3.97Å; Y192-Y196 WeakPolarHBondContact O-CB 3.36Å; Y192-Y196 PolarHBondContact O-N 3.46Å; Y192-Y196 WeakPolarHBondContact OH-CD2 3.44Å; Y196-E198 VanDerWaalsContact C-N 3.34Å; Y196-E198 PolarHBondContact O-N 2.98Å; Y196-R199 PolarHBondContact O-N 2.93Å; Y196-R199 VanDerWaalsContact O-N 3.16Å; Y196-V200 HydrophobicContact CD1-CG1 3.94Å; Y196-V200 HydrophobicContact CD1-CG2 3.92Å; Y196-V200 HydrophobicContact CE1-CB 4.24Å; Y196-V200 HydrophobicContact CE1-CG1 3.37Å; Y196-V200 HydrophobicContact CE1-CG2 3.82Å; Y196-V200 HydrophobicContact CE2-CG1 4.36Å; Y196-V200 WeakPolarHBondContact O-CG2 3.44Å; Y196-V200 PolarHBondContact O-N 3.2Å; Y196-L334 HydrophobicContact CD1-CD1 3.94Å; Y196-L334 HydrophobicContact CD1-CD2 3.84Å; Y196-L334 HydrophobicContact CE1-CD2 3.94Å; Y196-Q337 HydrophobicContact CE1-CG 4.21Å
197	T	95.9	Very high	94.8	Very high	0 Å²	0	49.1 Å²	49.1	0%	0	24%	0.24	C	C	.	.	H	α-helix	trans	-63.3	-38.6	177.7	-58.3	0	0	0	0	111.9	L193 Q194 D195 R199 K201 L204 Y330 I333 L334	L193-T197 VanDerWaalsContact O-CB 3.28Å; L193-T197 WeakPolarHBondContact O-CB 3.37Å; L193-T197 PolarHBondContact O-N 2.77Å; L193-T197 PolarHBondContact O-OG1 2.8Å; Q194-T197 WeakPolarHBondContact O-CB 3.38Å; Q194-T197 PolarHBondContact O-N 2.96Å; Q194-T197 VanDerWaalsContact O-N 3.14Å; D195-T197 VanDerWaalsContact C-N 3.31Å; D195-T197 PolarHBondContact O-N 2.9Å; T197-R199 VanDerWaalsContact C-N 3.3Å; T197-R199 PolarHBondContact O-N 3.27Å; T197-K201 CarbonylContact O-C 3.5Å; T197-K201 WeakPolarHBondContact O-CA 3.46Å; T197-K201 PolarHBondContact O-N 3.48Å; T197-L204 HydrophobicContact CG2-CD2 3.96Å; T197-Y330 HydrophobicContact CG2-CD1 4.25Å; T197-Y330 HydrophobicContact CG2-CE1 4.39Å; T197-I333 HydrophobicContact CG2-CG2 4.22Å; T197-L334 WeakPolarHBondContact OG1-CD1 3.34Å
198	E	95.1	Very high	94.7	Very high	79 Å²	79	48.9 Å²	48.9	37%	0.369	24%	0.242	S	C	.	.	H	α-helix	trans	-61	-41	173.3	-66.8	-167.2	159	0	0	111.6	Q194 D195 Y196 P202 Q206	Q194-E198 PolarHBondContact O-N 3.46Å; D195-E198 WeakPolarHBondContact O-CB 3.41Å; D195-E198 PolarHBondContact O-N 2.93Å; D195-E198 VanDerWaalsContact O-N 3.12Å; Y196-E198 VanDerWaalsContact C-N 3.34Å; Y196-E198 PolarHBondContact O-N 2.98Å; E198-P202 VanDerWaalsContact O-CA 3.3Å; E198-P202 WeakPolarHBondContact O-CA 3.45Å; E198-Q206 VanDerWaalsContact CG-CD 3.42Å; E198-Q206 HydrophobicContact CG-CG 3.97Å; E198-Q206 WeakPolarHBondContact OE1-CG 3.15Å; E198-Q206 PolarHBondContact OE1-OE1 2.98Å
199	R	95.4	Very high	94.6	Very high	37 Å²	37	47.1 Å²	47.1	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-68.3	-45.8	178.4	-66.4	-160.9	-74.1	-90.2	3.2	113	H41 V128 E129 F130 E134 D195 Y196 T197	H41-R199 PolarHBondContact NE2-O 3.11Å; V128-R199 HydrophobicContact CG2-CB 3.82Å; V128-R199 HydrophobicContact CG2-CG 3.53Å; E129-R199 WeakPolarHBondContact O-CD 3.47Å; F130-R199 HydrophobicContact CE1-CB 3.66Å; F130-R199 HydrophobicContact CE2-CB 4.38Å; F130-R199 HydrophobicContact CZ-CB 3.54Å; E134-R199 IonicContact OE1-CZ 3.42Å; E134-R199 IonicContact OE1-NH2 3.38Å; E134-R199 PolarHBondContact OE1-NH2 3.24Å; E134-R199 IonicContact OE2-NH2 3.51Å; D195-R199 WeakPolarHBondContact O-CG 3.43Å; D195-R199 PolarHBondContact O-N 3Å; D195-R199 IonicContact OD1-NH1 3.99Å; D195-R199 PolarHBondContact OD1-NH1 3.33Å; D195-R199 VanDerWaalsContact OD1-NH1 3.1Å; D195-R199 IonicContact OD2-CZ 3.82Å; D195-R199 IonicContact OD2-NH1 2.72Å; D195-R199 PolarHBondContact OD2-NH1 2.99Å; D195-R199 IonicContact OD2-NH2 3.97Å; Y196-R199 PolarHBondContact O-N 2.93Å; Y196-R199 VanDerWaalsContact O-N 3.16Å; T197-R199 VanDerWaalsContact C-N 3.3Å; T197-R199 PolarHBondContact O-N 3.27Å
200	V	95.4	Very high	94.5	Very high	10 Å²	10	51.9 Å²	51.9	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-83.6	-26.4	-175.7	-62.5	0	0	0	0	114.1	F130 Y196 L334	F130-V200 HydrophobicContact CE1-CG1 3.72Å; F130-V200 HydrophobicContact CZ-CG1 3.79Å; Y196-V200 HydrophobicContact CD1-CG1 3.94Å; Y196-V200 HydrophobicContact CD1-CG2 3.92Å; Y196-V200 HydrophobicContact CE1-CB 4.24Å; Y196-V200 HydrophobicContact CE1-CG1 3.37Å; Y196-V200 HydrophobicContact CE1-CG2 3.82Å; Y196-V200 HydrophobicContact CE2-CG1 4.36Å; Y196-V200 WeakPolarHBondContact O-CG2 3.44Å; Y196-V200 PolarHBondContact O-N 3.2Å; V200-L334 HydrophobicContact CG2-CD2 3.73Å
201	K	94.8	Very high	94.5	Very high	75 Å²	75	53.5 Å²	53.5	33%	0.326	27%	0.271	S	S	.	.			trans	-133.4	62.8	-177.1	-68.1	179.2	-178.1	-179.7	0	110.3	T197 L203 L204 I333	T197-K201 CarbonylContact O-C 3.5Å; T197-K201 WeakPolarHBondContact O-CA 3.46Å; T197-K201 PolarHBondContact O-N 3.48Å; K201-L203 PolarHBondContact O-N 2.94Å; K201-L203 VanDerWaalsContact O-N 3.08Å; K201-L204 HydrophobicContact CB-CB 4.24Å; K201-L204 VanDerWaalsContact O-CB 3.28Å; K201-L204 WeakPolarHBondContact O-CB 3.28Å; K201-L204 PolarHBondContact O-N 3.35Å; K201-I333 HydrophobicContact CD-CG2 3.95Å; K201-I333 PolarHBondContact NZ-O 3.46Å
202	P	95.1	Very high	94.4	Very high	2 Å²	2	52.8 Å²	52.8	1%	0.013	27%	0.265	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.5	-174.9	27.3	-37	0	0	0	113.9	D40 H41 R44 E198 L204	D40-P202 HydrophobicContact CB-CG 3.69Å; H41-P202 HydrophobicContact CB-CG 4.49Å; R44-P202 HydrophobicContact CB-CB 4.25Å; R44-P202 WeakPolarHBondContact CD-O 3.14Å; R44-P202 PolarHBondContact NH1-O 2.81Å; E198-P202 VanDerWaalsContact O-CA 3.3Å; E198-P202 WeakPolarHBondContact O-CA 3.45Å; P202-L204 VanDerWaalsContact C-N 3.31Å
203	L	94.4	Very high	94.3	Very high	73 Å²	73	51.2 Å²	51.2	38%	0.382	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.9	-5	176.8	-60.5	179.7	0	0	0	113.7	D40 T43 R44 L47 K201	D40-L203 HydrophobicContact CB-CD1 4.02Å; D40-L203 HydrophobicContact CB-CG 4.09Å; D40-L203 WeakPolarHBondContact O-CD2 3.31Å; T43-L203 HydrophobicContact CG2-CD1 4.26Å; T43-L203 HydrophobicContact CG2-CD2 3.75Å; R44-L203 HydrophobicContact CB-CD2 4.2Å; L47-L203 HydrophobicContact CD1-CD2 4.03Å; K201-L203 PolarHBondContact O-N 2.94Å; K201-L203 VanDerWaalsContact O-N 3.08Å
204	L	94.1	Very high	94.2	Very high	60 Å²	60	53.8 Å²	53.8	31%	0.314	27%	0.273	S	S	.	.	S	Bend	trans	-78.9	123.1	174.2	-176	64.3	0	0	0	109.8	T197 K201 P202 Q206 L209 I333	T197-L204 HydrophobicContact CG2-CD2 3.96Å; K201-L204 HydrophobicContact CB-CB 4.24Å; K201-L204 VanDerWaalsContact O-CB 3.28Å; K201-L204 WeakPolarHBondContact O-CB 3.28Å; K201-L204 PolarHBondContact O-N 3.35Å; P202-L204 VanDerWaalsContact C-N 3.31Å; L204-Q206 PolarHBondContact O-N 3.2Å; L204-Q206 VanDerWaalsContact O-N 3.11Å; L204-L209 HydrophobicContact CD2-CD2 4.17Å; L204-I333 HydrophobicContact CD2-CD1 4.22Å; L204-I333 HydrophobicContact CD2-CG2 4.3Å
205	D	92.1	Very high	94.1	Very high	88 Å²	88	52.5 Å²	52.5	47%	0.471	27%	0.274	S	S	.	.			trans	-74.6	102.6	174.9	-173.1	-12.6	0	0	0	110.4	N207 D208 L209	D205-N207 VanDerWaalsContact C-N 3.27Å; D205-N207 PolarHBondContact O-N 3.32Å; D205-N207 WeakPolarHBondContact OD1-CB 3.49Å; D205-N207 PolarHBondContact OD1-N 3.47Å; D205-D208 HydrophobicContact CB-CB 4.02Å; D205-D208 PolarHBondContact O-N 3.49Å; D205-D208 PolarHBondContact OD1-N 3.08Å; D205-L209 WeakPolarHBondContact O-CB 3.11Å; D205-L209 PolarHBondContact O-N 3.42Å
206	Q	88.3	Confident	94	Very high	28 Å²	28	53.5 Å²	53.5	13%	0.131	28%	0.276	C	S	.	.	H	α-helix	trans	-60.6	-33.4	177.2	-69.1	-111.3	-10.7	0	0	112.7	Q194 E198 L204 L209 Y210 Y330	Q194-Q206 PolarHBondContact O-NE2 2.86Å; E198-Q206 VanDerWaalsContact CG-CD 3.42Å; E198-Q206 HydrophobicContact CG-CG 3.97Å; E198-Q206 WeakPolarHBondContact OE1-CG 3.15Å; E198-Q206 PolarHBondContact OE1-OE1 2.98Å; L204-Q206 PolarHBondContact O-N 3.2Å; L204-Q206 VanDerWaalsContact O-N 3.11Å; Q206-L209 PolarHBondContact O-N 3Å; Q206-Y210 WeakPolarHBondContact O-CB 3.41Å; Q206-Y210 PolarHBondContact O-N 2.95Å; Q206-Y330 PolarHBondContact OE1-OH 3.34Å
207	N	91.7	Very high	93.9	Very high	135 Å²	135	53.7 Å²	53.7	72%	0.722	28%	0.277	S	S	*	.	H	α-helix	trans	-72.1	-43.1	-178.6	-63.3	-57.5	0	0	0	110.9	D205 Y210 G211	D205-N207 VanDerWaalsContact C-N 3.27Å; D205-N207 PolarHBondContact O-N 3.32Å; D205-N207 WeakPolarHBondContact OD1-CB 3.49Å; D205-N207 PolarHBondContact OD1-N 3.47Å; N207-Y210 PolarHBondContact O-N 2.93Å; N207-G211 PolarHBondContact O-N 3.43Å
208	D	93.3	Very high	93.8	Very high	79 Å²	79	57.7 Å²	57.7	42%	0.422	30%	0.296	S	S	.	.	H	α-helix	trans	-64.3	-42.2	174.2	-176.6	44.8	0	0	0	110.9	D205 G211 K212	D205-D208 HydrophobicContact CB-CB 4.02Å; D205-D208 PolarHBondContact O-N 3.49Å; D205-D208 PolarHBondContact OD1-N 3.08Å; D208-G211 PolarHBondContact O-N 3.06Å; D208-K212 WeakPolarHBondContact O-CG 3.4Å; D208-K212 PolarHBondContact O-N 2.91Å; D208-K212 WeakPolarHBondContact OD1-CE 3.32Å; D208-K212 IonicContact OD1-NZ 3.44Å; D208-K212 WeakPolarHBondContact OD2-CE 3.44Å; D208-K212 IonicContact OD2-NZ 3.91Å; D208-K212 PolarHBondContact OD2-NZ 2.85Å
209	L	93	Very high	93.6	Very high	20 Å²	20	60.6 Å²	60.6	11%	0.105	31%	0.307	C	S	.	.	H	α-helix	trans	-58.8	-51.5	174.2	180	62.9	0	0	0	111.3	L204 D205 Q206 G211 K212 I213 Y330 I333	L204-L209 HydrophobicContact CD2-CD2 4.17Å; D205-L209 WeakPolarHBondContact O-CB 3.11Å; D205-L209 PolarHBondContact O-N 3.42Å; Q206-L209 PolarHBondContact O-N 3Å; L209-G211 VanDerWaalsContact C-N 3.31Å; L209-G211 PolarHBondContact O-N 3.41Å; L209-K212 WeakPolarHBondContact O-CB 3.01Å; L209-K212 PolarHBondContact O-N 3.42Å; L209-K212 VanDerWaalsContact O-N 3.12Å; L209-I213 HydrophobicContact CD1-CD1 4.04Å; L209-I213 HydrophobicContact CD1-CG1 4.22Å; L209-I213 HydrophobicContact CD2-CD1 4.46Å; L209-I213 HydrophobicContact CG-CD1 3.82Å; L209-I213 HydrophobicContact CG-CG1 4.39Å; L209-I213 VanDerWaalsContact O-CG1 3.28Å; L209-I213 WeakPolarHBondContact O-CG1 3.33Å; L209-I213 PolarHBondContact O-N 3.33Å; L209-Y330 HydrophobicContact CD2-CD1 4.31Å; L209-Y330 HydrophobicContact CD2-CE1 3.67Å; L209-I333 HydrophobicContact CD1-CD1 3.91Å; L209-I333 HydrophobicContact CD2-CD1 3.53Å; L209-I333 HydrophobicContact CG-CD1 4.39Å
210	Y	93.1	Very high	93.3	Very high	99 Å²	99	62.4 Å²	62.4	39%	0.388	32%	0.316	S	S	.	.	H	α-helix	trans	-57.1	-44.2	177.9	-179.2	-89.6	0	0	0	112	Q206 N207 K212 I213 L214 F322	Q206-Y210 WeakPolarHBondContact O-CB 3.41Å; Q206-Y210 PolarHBondContact O-N 2.95Å; N207-Y210 PolarHBondContact O-N 2.93Å; Y210-K212 VanDerWaalsContact C-N 3.33Å; Y210-K212 PolarHBondContact O-N 3.13Å; Y210-I213 PolarHBondContact O-N 2.95Å; Y210-L214 HydrophobicContact CE1-CD2 4.27Å; Y210-L214 WeakPolarHBondContact O-CB 3.2Å; Y210-L214 PolarHBondContact O-N 3.39Å; Y210-F322 HydrophobicContact CD2-CZ 4.5Å; Y210-F322 AromaticContact CE2-CE1 3.88Å; Y210-F322 HydrophobicContact CE2-CE1 3.88Å; Y210-F322 AromaticContact CE2-CZ 3.66Å; Y210-F322 HydrophobicContact CE2-CZ 3.66Å; Y210-F322 AromaticContact CZ-CE1 3.96Å; Y210-F322 AromaticContact CZ-CZ 3.74Å; Y210-F322 WeakPolarHBondContact OH-CE1 3.31Å
211	G	94.8	Very high	93.1	Very high	42 Å²	42	65.1 Å²	65.1	43%	0.433	33%	0.325	S	S	.	.	H	α-helix	trans	-60.1	-40.8	176.6	0	0	0	0	0	113	N207 D208 L209 G215	N207-G211 PolarHBondContact O-N 3.43Å; D208-G211 PolarHBondContact O-N 3.06Å; L209-G211 VanDerWaalsContact C-N 3.31Å; L209-G211 PolarHBondContact O-N 3.41Å; G211-G215 PolarHBondContact O-N 3.41Å
212	K	95.1	Very high	92.7	Very high	121 Å²	121	68.7 Å²	68.7	53%	0.526	34%	0.343	S	S	.	.	H	α-helix	trans	-64.7	-48.8	174.3	-71.8	170.6	-171.3	163.1	0	111.6	D208 L209 Y210 L214 G215 E216	D208-K212 WeakPolarHBondContact O-CG 3.4Å; D208-K212 PolarHBondContact O-N 2.91Å; D208-K212 WeakPolarHBondContact OD1-CE 3.32Å; D208-K212 IonicContact OD1-NZ 3.44Å; D208-K212 WeakPolarHBondContact OD2-CE 3.44Å; D208-K212 IonicContact OD2-NZ 3.91Å; D208-K212 PolarHBondContact OD2-NZ 2.85Å; L209-K212 WeakPolarHBondContact O-CB 3.01Å; L209-K212 PolarHBondContact O-N 3.42Å; L209-K212 VanDerWaalsContact O-N 3.12Å; Y210-K212 VanDerWaalsContact C-N 3.33Å; Y210-K212 PolarHBondContact O-N 3.13Å; K212-L214 VanDerWaalsContact C-N 3.33Å; K212-L214 PolarHBondContact O-N 3.42Å; K212-G215 PolarHBondContact O-N 3.03Å; K212-E216 WeakPolarHBondContact O-CG 3.22Å; K212-E216 PolarHBondContact O-N 3.23Å
213	I	94.2	Very high	92.3	Very high	4 Å²	4	74.9 Å²	74.9	2%	0.021	37%	0.373	C	S	.	.	H	α-helix	trans	-58.7	-46.9	179.6	-63.2	172.1	0	0	0	110.1	L209 Y210 E216 F217 F322 Q326 E329	L209-I213 HydrophobicContact CD1-CD1 4.04Å; L209-I213 HydrophobicContact CD1-CG1 4.22Å; L209-I213 HydrophobicContact CD2-CD1 4.46Å; L209-I213 HydrophobicContact CG-CD1 3.82Å; L209-I213 HydrophobicContact CG-CG1 4.39Å; L209-I213 VanDerWaalsContact O-CG1 3.28Å; L209-I213 WeakPolarHBondContact O-CG1 3.33Å; L209-I213 PolarHBondContact O-N 3.33Å; Y210-I213 PolarHBondContact O-N 2.95Å; I213-E216 PolarHBondContact O-N 3.14Å; I213-F217 WeakPolarHBondContact O-CB 3.13Å; I213-F217 PolarHBondContact O-N 3.43Å; I213-F322 HydrophobicContact CG2-CE2 4.27Å; I213-Q326 HydrophobicContact CG2-CG 3.89Å; I213-E329 HydrophobicContact CD1-CB 3.74Å; I213-E329 HydrophobicContact CD1-CG 4.14Å; I213-E329 HydrophobicContact CG1-CB 4.02Å; I213-E329 HydrophobicContact CG1-CG 3.9Å; I213-E329 HydrophobicContact CG2-CG 4.43Å
214	L	94.6	Very high	91.8	Very high	55 Å²	55	72.4 Å²	72.4	29%	0.288	37%	0.365	S	S	.	.	H	α-helix	trans	-59.8	-49	177.6	-179.5	62.3	0	0	0	111.5	Y210 K212 E216 F217 E218 F322	Y210-L214 HydrophobicContact CE1-CD2 4.27Å; Y210-L214 WeakPolarHBondContact O-CB 3.2Å; Y210-L214 PolarHBondContact O-N 3.39Å; K212-L214 VanDerWaalsContact C-N 3.33Å; K212-L214 PolarHBondContact O-N 3.42Å; L214-E216 VanDerWaalsContact C-N 3.35Å; L214-E216 PolarHBondContact O-N 3.45Å; L214-F217 PolarHBondContact O-N 2.92Å; L214-E218 HydrophobicContact CD1-CG 4.17Å; L214-E218 WeakPolarHBondContact O-CB 3.33Å; L214-E218 WeakPolarHBondContact O-CG 3.28Å; L214-E218 PolarHBondContact O-N 2.84Å; L214-F322 HydrophobicContact CB-CE2 4.27Å; L214-F322 HydrophobicContact CB-CZ 4.4Å; L214-F322 HydrophobicContact CD1-CE2 3.86Å; L214-F322 HydrophobicContact CD1-CZ 4.03Å
215	G	93.5	Very high	91.5	Very high	25 Å²	25	73.7 Å²	73.7	26%	0.258	38%	0.375	S	S	.	.	H	α-helix	trans	-64.2	-36.1	-179.9	0	0	0	0	0	113.6	G211 K212 K219	G211-G215 PolarHBondContact O-N 3.41Å; K212-G215 PolarHBondContact O-N 3.03Å; G215-K219 WeakPolarHBondContact O-CD 3.46Å; G215-K219 VanDerWaalsContact O-CG 3.27Å; G215-K219 WeakPolarHBondContact O-CG 3.47Å; G215-K219 PolarHBondContact O-N 3.02Å
216	E	93.7	Very high	91.2	Very high	91 Å²	91	70 Å²	70	43%	0.425	36%	0.355	S	S	.	.	H	α-helix	trans	-72	-43	173.6	-72.6	-144.2	169.3	0	0	112.6	K212 I213 L214 K219 K220	K212-E216 WeakPolarHBondContact O-CG 3.22Å; K212-E216 PolarHBondContact O-N 3.23Å; I213-E216 PolarHBondContact O-N 3.14Å; L214-E216 VanDerWaalsContact C-N 3.35Å; L214-E216 PolarHBondContact O-N 3.45Å; E216-K219 PolarHBondContact O-N 3.33Å; E216-K220 WeakPolarHBondContact O-CG 3.46Å; E216-K220 PolarHBondContact O-N 2.8Å; E216-K220 IonicContact OE2-NZ 3.35Å; E216-K220 PolarHBondContact OE2-NZ 2.82Å
217	F	94.1	Very high	91	Very high	5 Å²	5	71.5 Å²	71.5	2%	0.022	37%	0.368	C	S	.	.	H	α-helix	trans	-60.1	-48.1	177.8	172	-103.6	0	0	0	110.8	I213 L214 K219 K220 W221 F226 K318 A321 F322	I213-F217 WeakPolarHBondContact O-CB 3.13Å; I213-F217 PolarHBondContact O-N 3.43Å; L214-F217 PolarHBondContact O-N 2.92Å; F217-K219 VanDerWaalsContact C-N 3.31Å; F217-K219 PolarHBondContact O-N 3.35Å; F217-K220 PolarHBondContact O-N 3.33Å; F217-W221 HydrophobicContact CE1-CB 4.35Å; F217-W221 HydrophobicContact CE1-CG 4.42Å; F217-W221 HydrophobicContact CE2-CB 4.44Å; F217-W221 HydrophobicContact CE2-CD2 4.5Å; F217-W221 HydrophobicContact CE2-CE3 4Å; F217-W221 HydrophobicContact CZ-CB 4.24Å; F217-W221 HydrophobicContact CZ-CD2 4.01Å; F217-W221 AromaticContact CZ-CE3 3.86Å; F217-W221 HydrophobicContact CZ-CE3 3.86Å; F217-W221 HydrophobicContact CZ-CG 4.18Å; F217-W221 WeakPolarHBondContact O-CB 3.42Å; F217-W221 PolarHBondContact O-N 3.1Å; F217-F226 AromaticContact CD2-CD2 3.85Å; F217-F226 HydrophobicContact CD2-CD2 3.85Å; F217-F226 AromaticContact CD2-CE2 3.7Å; F217-F226 HydrophobicContact CD2-CE2 3.7Å; F217-F226 HydrophobicContact CD2-CZ 4.27Å; F217-F226 HydrophobicContact CE2-CD1 4.49Å; F217-F226 HydrophobicContact CE2-CD2 4.03Å; F217-F226 HydrophobicContact CE2-CE1 4.45Å; F217-F226 AromaticContact CE2-CE2 4Å; F217-F226 HydrophobicContact CE2-CE2 4Å; F217-F226 HydrophobicContact CE2-CG 4.3Å; F217-F226 HydrophobicContact CE2-CZ 4.21Å; F217-K318 HydrophobicContact CE1-CG 4.04Å; F217-K318 HydrophobicContact CZ-CG 4.06Å; F217-A321 HydrophobicContact CE2-CB 3.83Å; F217-A321 HydrophobicContact CZ-CB 3.98Å; F217-F322 HydrophobicContact CB-CD2 4.13Å; F217-F322 HydrophobicContact CB-CE2 4.43Å; F217-F322 HydrophobicContact CD1-CB 4.28Å; F217-F322 AromaticContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CE2 4.36Å; F217-F322 HydrophobicContact CD1-CG 4.28Å; F217-F322 HydrophobicContact CD2-CD2 4.35Å; F217-F322 HydrophobicContact CE1-CB 3.84Å; F217-F322 HydrophobicContact CE1-CD2 4.01Å; F217-F322 HydrophobicContact CE1-CG 4.28Å; F217-F322 HydrophobicContact CE2-CB 4.32Å; F217-F322 AromaticContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CG-CE2 4.49Å; F217-F322 HydrophobicContact CZ-CB 3.87Å
218	E	93.1	Very high	90.5	Very high	84 Å²	84	66.1 Å²	66.1	39%	0.393	34%	0.344	S	S	.	.	H	α-helix	trans	-57.9	-44	178.9	-74.4	-176.7	157.5	0	0	111.7	L214 W221 E222	L214-E218 HydrophobicContact CD1-CG 4.17Å; L214-E218 WeakPolarHBondContact O-CB 3.33Å; L214-E218 WeakPolarHBondContact O-CG 3.28Å; L214-E218 PolarHBondContact O-N 2.84Å; E218-W221 PolarHBondContact O-N 3.12Å; E218-E222 WeakPolarHBondContact O-CB 3.45Å; E218-E222 VanDerWaalsContact O-CG 3.29Å; E218-E222 WeakPolarHBondContact O-CG 3.49Å; E218-E222 PolarHBondContact O-N 3.21Å
219	K	92.2	Very high	90	Very high	139 Å²	139	63.3 Å²	63.3	60%	0.604	33%	0.327	S	S	*	.	H	α-helix	trans	-61	-51.4	174.9	-68.8	168.3	-172.1	170.4	0	111.9	G215 E216 F217 W221 E222 M223	G215-K219 WeakPolarHBondContact O-CD 3.46Å; G215-K219 VanDerWaalsContact O-CG 3.27Å; G215-K219 WeakPolarHBondContact O-CG 3.47Å; G215-K219 PolarHBondContact O-N 3.02Å; E216-K219 PolarHBondContact O-N 3.33Å; F217-K219 VanDerWaalsContact C-N 3.31Å; F217-K219 PolarHBondContact O-N 3.35Å; K219-W221 VanDerWaalsContact C-N 3.3Å; K219-W221 PolarHBondContact O-N 2.96Å; K219-E222 PolarHBondContact O-N 2.98Å; K219-M223 WeakPolarHBondContact O-CB 3.36Å; K219-M223 WeakPolarHBondContact O-CG 3.46Å; K219-M223 PolarHBondContact O-N 3.38Å
220	K	89.8	Confident	88.9	Confident	76 Å²	76	67.4 Å²	67.4	33%	0.33	36%	0.356	S	S	.	.	H	α-helix	trans	-62.8	-37.3	-179.9	-69.6	170.6	-170.8	162.9	0	111.2	E216 F217 G224 T225 F226	E216-K220 WeakPolarHBondContact O-CG 3.46Å; E216-K220 PolarHBondContact O-N 2.8Å; E216-K220 IonicContact OE2-NZ 3.35Å; E216-K220 PolarHBondContact OE2-NZ 2.82Å; F217-K220 PolarHBondContact O-N 3.33Å; K220-G224 PolarHBondContact O-N 3.14Å; K220-T225 PolarHBondContact O-N 3.43Å; K220-T225 PolarHBondContact O-OG1 3.03Å; K220-F226 HydrophobicContact CB-CD2 4.3Å
221	W	89.3	Confident	87.7	Confident	66 Å²	66	68.4 Å²	68.4	25%	0.25	36%	0.362	C	S	.	.	H	α-helix	trans	-70.3	-46.8	179	-173.4	-100.4	0	0	0	112.3	F217 E218 K219 M223 G224 F226 W229 K318 A321	F217-W221 HydrophobicContact CE1-CB 4.35Å; F217-W221 HydrophobicContact CE1-CG 4.42Å; F217-W221 HydrophobicContact CE2-CB 4.44Å; F217-W221 HydrophobicContact CE2-CD2 4.5Å; F217-W221 HydrophobicContact CE2-CE3 4Å; F217-W221 HydrophobicContact CZ-CB 4.24Å; F217-W221 HydrophobicContact CZ-CD2 4.01Å; F217-W221 AromaticContact CZ-CE3 3.86Å; F217-W221 HydrophobicContact CZ-CE3 3.86Å; F217-W221 HydrophobicContact CZ-CG 4.18Å; F217-W221 WeakPolarHBondContact O-CB 3.42Å; F217-W221 PolarHBondContact O-N 3.1Å; E218-W221 PolarHBondContact O-N 3.12Å; K219-W221 VanDerWaalsContact C-N 3.3Å; K219-W221 PolarHBondContact O-N 2.96Å; W221-M223 VanDerWaalsContact C-N 3.33Å; W221-M223 PolarHBondContact O-N 2.65Å; W221-G224 PolarHBondContact O-N 2.97Å; W221-F226 HydrophobicContact CE3-CB 4.24Å; W221-F226 HydrophobicContact CE3-CG 4.48Å; W221-W229 HydrophobicContact CZ3-CB 3.89Å; W221-W229 HydrophobicContact CZ3-CD2 4.46Å; W221-W229 HydrophobicContact CZ3-CG 4.06Å; W221-K318 HydrophobicContact CD2-CG 4.35Å; W221-K318 HydrophobicContact CH2-CB 4.41Å; W221-K318 HydrophobicContact CZ2-CB 3.83Å; W221-K318 HydrophobicContact CZ2-CG 4.06Å; W221-A321 HydrophobicContact CE3-CB 4.07Å; W221-A321 HydrophobicContact CH2-CB 4.15Å; W221-A321 HydrophobicContact CZ3-CB 3.49Å; W221-A321 VanDerWaalsContact CZ3-CB 3.49Å
222	E	87.3	Confident	85.8	Confident	151 Å²	151	72.8 Å²	72.8	71%	0.706	37%	0.371	S	S	*	.	H	α-helix	trans	-62.4	-40.9	175.9	-75.9	-176.7	174.5	0	0	111.8	E218 K219 G224 K231	E218-E222 WeakPolarHBondContact O-CB 3.45Å; E218-E222 VanDerWaalsContact O-CG 3.29Å; E218-E222 WeakPolarHBondContact O-CG 3.49Å; E218-E222 PolarHBondContact O-N 3.21Å; K219-E222 PolarHBondContact O-N 2.98Å; E222-G224 VanDerWaalsContact C-N 3.25Å; E222-G224 PolarHBondContact O-N 3.18Å; E222-K231 PolarHBondContact O-NZ 3.48Å
223	M	86.1	Confident	83.3	Confident	132 Å²	132	73.1 Å²	73.1	65%	0.65	38%	0.384	S	S	*	.	H	α-helix	trans	-67.3	-28.3	173.5	-68.5	174.2	67.6	0	0	111.8	K219 W221 T225 K231	K219-M223 WeakPolarHBondContact O-CB 3.36Å; K219-M223 WeakPolarHBondContact O-CG 3.46Å; K219-M223 PolarHBondContact O-N 3.38Å; W221-M223 VanDerWaalsContact C-N 3.33Å; W221-M223 PolarHBondContact O-N 2.65Å; M223-T225 HydrophobicContact CB-CG2 4.14Å; M223-K231 VanDerWaalsContact C-NZ 3.27Å; M223-K231 PolarHBondContact O-NZ 3.49Å
224	G	84	Confident	80.6	Confident	20 Å²	20	78 Å²	78	21%	0.206	42%	0.418	C	S	.	.	T	Hydrogen-bonded Turn	trans	77	26.7	-177	0	0	0	0	0	113.2	K220 W221 E222 K231	K220-G224 PolarHBondContact O-N 3.14Å; W221-G224 PolarHBondContact O-N 2.97Å; E222-G224 VanDerWaalsContact C-N 3.25Å; E222-G224 PolarHBondContact O-N 3.18Å; G224-K231 VanDerWaalsContact CA-CE 3.44Å
225	T	87.3	Confident	77.8	Confident	87 Å²	87	78.3 Å²	78.3	53%	0.534	43%	0.425	S	S	.	.			trans	-100.4	6.2	179	53.7	0	0	0	0	112.1	K220 M223 P227	K220-T225 PolarHBondContact O-N 3.43Å; K220-T225 PolarHBondContact O-OG1 3.03Å; M223-T225 HydrophobicContact CB-CG2 4.14Å; T225-P227 WeakPolarHBondContact O-CD 3.46Å
226	F	87	Confident	75.1	Confident	10 Å²	10	80.6 Å²	80.6	4%	0.044	44%	0.441	C	S	.	.			trans	-67.4	124	-178.4	-168.3	-97.2	0	0	0	111.4	F217 K220 W221 W229 A321 E324 Y328	F217-F226 AromaticContact CD2-CD2 3.85Å; F217-F226 HydrophobicContact CD2-CD2 3.85Å; F217-F226 AromaticContact CD2-CE2 3.7Å; F217-F226 HydrophobicContact CD2-CE2 3.7Å; F217-F226 HydrophobicContact CD2-CZ 4.27Å; F217-F226 HydrophobicContact CE2-CD1 4.49Å; F217-F226 HydrophobicContact CE2-CD2 4.03Å; F217-F226 HydrophobicContact CE2-CE1 4.45Å; F217-F226 AromaticContact CE2-CE2 4Å; F217-F226 HydrophobicContact CE2-CE2 4Å; F217-F226 HydrophobicContact CE2-CG 4.3Å; F217-F226 HydrophobicContact CE2-CZ 4.21Å; K220-F226 HydrophobicContact CB-CD2 4.3Å; W221-F226 HydrophobicContact CE3-CB 4.24Å; W221-F226 HydrophobicContact CE3-CG 4.48Å; F226-W229 HydrophobicContact CD1-CB 4.14Å; F226-W229 AromaticContact CD1-CD1 3.49Å; F226-W229 VanDerWaalsContact CD1-CD1 3.49Å; F226-W229 HydrophobicContact CD1-CG 4.11Å; F226-W229 AromaticContact CE1-CD1 3.61Å; F226-W229 PolarHBondContact O-N 3.29Å; F226-A321 HydrophobicContact CD1-CB 4.06Å; F226-A321 HydrophobicContact CE1-CB 3.84Å; F226-A321 WeakPolarHBondContact CE1-O 3.45Å; F226-A321 WeakPolarHBondContact CZ-O 3.22Å; F226-E324 HydrophobicContact CZ-CB 4.47Å; F226-Y328 HydrophobicContact CZ-CD2 4.5Å; F226-Y328 HydrophobicContact CZ-CE2 4.08Å
227	P	83.9	Confident	72.5	Confident	61 Å²	61	83.9 Å²	83.9	40%	0.396	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.3	143	-178	-25.8	34.9	0	0	0	113.3	F171 T225 W229	F171-P227 HydrophobicContact CB-CB 3.85Å; T225-P227 WeakPolarHBondContact O-CD 3.46Å; P227-W229 PolarHBondContact O-N 3.02Å; P227-W229 VanDerWaalsContact O-N 3.13Å
228	G	80.9	Confident	70.1	Confident	22 Å²	22	88.2 Å²	88.2	23%	0.227	49%	0.488	C	S	.	.	T	Hydrogen-bonded Turn	trans	72.3	-3.3	-179.2	0	0	0	0	0	115.3
229	W	82.9	Confident	67.8	Low	19 Å²	19	92 Å²	92	7%	0.072	51%	0.505	C	S	.	.			trans	-132.2	64.3	178.2	-64.2	88.8	0	0	0	111.5	K175 K178 W221 F226 P227 K231 N317 I320 A321 E324	K175-W229 HydrophobicContact CD-CZ3 4.43Å; K175-W229 HydrophobicContact CG-CZ3 4.13Å; K178-W229 HydrophobicContact CB-CH2 4.44Å; K178-W229 HydrophobicContact CD-CH2 3.95Å; K178-W229 HydrophobicContact CD-CZ2 3.41Å; K178-W229 VanDerWaalsContact CD-CZ2 3.41Å; W221-W229 HydrophobicContact CZ3-CB 3.89Å; W221-W229 HydrophobicContact CZ3-CD2 4.46Å; W221-W229 HydrophobicContact CZ3-CG 4.06Å; F226-W229 HydrophobicContact CD1-CB 4.14Å; F226-W229 AromaticContact CD1-CD1 3.49Å; F226-W229 VanDerWaalsContact CD1-CD1 3.49Å; F226-W229 HydrophobicContact CD1-CG 4.11Å; F226-W229 AromaticContact CE1-CD1 3.61Å; F226-W229 PolarHBondContact O-N 3.29Å; P227-W229 PolarHBondContact O-N 3.02Å; P227-W229 VanDerWaalsContact O-N 3.13Å; W229-K231 PolarHBondContact O-N 2.88Å; W229-N317 HydrophobicContact CE3-CB 4.12Å; W229-N317 HydrophobicContact CH2-CB 3.64Å; W229-N317 HydrophobicContact CZ3-CB 3.37Å; W229-I320 HydrophobicContact CH2-CB 4.46Å; W229-I320 HydrophobicContact CZ2-CB 3.94Å; W229-I320 HydrophobicContact CZ2-CG2 3.75Å; W229-A321 HydrophobicContact CD2-CB 4.17Å; W229-A321 HydrophobicContact CG-CB 4.05Å; W229-A321 HydrophobicContact CZ2-CB 4.46Å; W229-E324 PolarHBondContact NE1-OE2 3.39Å
230	P	70.1	Confident	65.8	Low	107 Å²	107	88.9 Å²	88.9	70%	0.695	51%	0.505	S	S	*	.			trans	-59	135.4	176.1	25.7	-32.7	0	0	0	109.4	E232	P230-E232 PolarHBondContact O-N 3.14Å; P230-E232 VanDerWaalsContact O-N 3.16Å
231	K	67	Low	64.2	Low	120 Å²	120	85.9 Å²	85.9	52%	0.522	50%	0.496	S	S	.	.			trans	-53.5	127.2	163.3	-85.3	179.2	178.9	162.8	0	106.4	E222 M223 G224 W229 T233	E222-K231 PolarHBondContact O-NZ 3.48Å; M223-K231 VanDerWaalsContact C-NZ 3.27Å; M223-K231 PolarHBondContact O-NZ 3.49Å; G224-K231 VanDerWaalsContact CA-CE 3.44Å; W229-K231 PolarHBondContact O-N 2.88Å; K231-T233 PolarHBondContact O-N 3.41Å
232	E	55.8	Low	63.2	Low	133 Å²	133	84.7 Å²	84.7	62%	0.621	50%	0.501	S	S	*	.			trans	-55	99.5	166.4	-76.2	178	-164.1	0	0	105.7	K175 P230 S234	K175-E232 IonicContact NZ-OE1 2.78Å; K175-E232 PolarHBondContact NZ-OE1 2.85Å; K175-E232 VanDerWaalsContact NZ-OE1 3.15Å; P230-E232 PolarHBondContact O-N 3.14Å; P230-E232 VanDerWaalsContact O-N 3.16Å; E232-S234 PolarHBondContact O-N 2.69Å
233	T	41.8	Very low	62.4	Low	129 Å²	129	84.3 Å²	84.3	79%	0.791	50%	0.498	S	S	*	.			trans	-56.8	97.7	157.4	35.4	0	0	0	0	102.2	K231 S235	K231-T233 PolarHBondContact O-N 3.41Å; T233-S235 PolarHBondContact O-N 3.3Å
234	S	38.1	Very low	62.1	Low	105 Å²	105	79.1 Å²	79.1	73%	0.734	47%	0.473	S	S	*	.			trans	-51.7	106	172.9	-68.6	0	0	0	0	103.5	E232 A236	E232-S234 PolarHBondContact O-N 2.69Å; S234-A236 PolarHBondContact O-N 3.08Å
235	S	35	Very low	61.8	Low	63 Å²	63	82.7 Å²	82.7	44%	0.441	49%	0.488	S	S	.	.			trans	-60.4	96.5	174.5	179.2	0	0	0	0	104.1	T233 L237 T238	T233-S235 PolarHBondContact O-N 3.3Å; S235-L237 PolarHBondContact O-N 3.31Å; S235-T238 PolarHBondContact O-N 2.96Å; S235-T238 VanDerWaalsContact O-N 3.14Å; S235-T238 PolarHBondContact O-OG1 2.99Å
236	A	38.3	Very low	61.5	Low	73 Å²	73	79.4 Å²	79.4	60%	0.603	47%	0.466	S	S	*	.	H	α-helix	trans	-58.7	-12.5	178	0	0	0	0	0	110.3	S234 A240	S234-A236 PolarHBondContact O-N 3.08Å; A236-A240 WeakPolarHBondContact O-CB 3.44Å
237	L	39.2	Very low	61.1	Low	160 Å²	160	82.6 Å²	82.6	84%	0.838	49%	0.49	S	S	*	.	H	α-helix	trans	-82	-19.4	178.4	-96	76.3	0	0	0	115.5	S235	S235-L237 PolarHBondContact O-N 3.31Å
238	T	43.6	Very low	60.8	Low	95 Å²	95	83.3 Å²	83.3	58%	0.583	50%	0.501	S	S	*	.	H	α-helix	trans	-103.2	-14.1	-175.2	56.5	0	0	0	0	114.8	S235	S235-T238 PolarHBondContact O-N 2.96Å; S235-T238 VanDerWaalsContact O-N 3.14Å; S235-T238 PolarHBondContact O-OG1 2.99Å
239	H	44.2	Very low	60.9	Low	163 Å²	163	84.1 Å²	84.1	76%	0.755	50%	0.499	S	S	*	.	H	α-helix	trans	-124.1	-13.2	-175.8	-68.6	-60.7	0	0	0	115.7	G241	H239-G241 PolarHBondContact O-N 2.84Å
240	A	49.5	Very low	60.9	Low	74 Å²	74	87.4 Å²	87.4	61%	0.612	53%	0.525	S	S	*	.			trans	-92.9	97.2	174.1	0	0	0	0	0	109.2	A236	A236-A240 WeakPolarHBondContact O-CB 3.44Å
241	G	56	Low	61.7	Low	14 Å²	14	83.8 Å²	83.8	14%	0.144	50%	0.502	C	S	.	.	P	Polyproline II helix	trans	-57.9	156	164.8	0	0	0	0	0	111.5	H239 S265 A269	H239-G241 PolarHBondContact O-N 2.84Å; G241-S265 WeakPolarHBondContact CA-O 3.49Å; G241-A269 VanDerWaalsContact C-CB 3.46Å; G241-A269 WeakPolarHBondContact O-CB 3.3Å
242	A	69.4	Low	62.6	Low	41 Å²	41	81.3 Å²	81.3	34%	0.339	49%	0.489	S	S	.	.	P	Polyproline II helix	trans	-79.2	128.3	177.5	0	0	0	0	0	110.6	L244 S265	A242-L244 PolarHBondContact O-N 2.86Å; A242-S265 PolarHBondContact N-OG 3.27Å
243	H	69.9	Low	64	Low	143 Å²	143	79.7 Å²	79.7	66%	0.662	48%	0.482	S	S	*	.	P	Polyproline II helix	trans	-61.6	131.4	176.1	-165.4	-79.3	0	0	0	110.2
244	L	79.3	Confident	66	Low	23 Å²	23	77.1 Å²	77.1	12%	0.12	46%	0.461	C	S	.	.			trans	-111.3	124.1	176.3	-174.4	72.7	0	0	0	108.2	A242 L246 F249 L255 L258 A266 L285	A242-L244 PolarHBondContact O-N 2.86Å; L244-L246 HydrophobicContact CD2-CD2 4.04Å; L244-L246 HydrophobicContact CG-CD2 4.38Å; L244-L246 PolarHBondContact O-N 3.28Å; L244-F249 HydrophobicContact CD1-CE2 4.44Å; L244-F249 HydrophobicContact CD2-CE2 4.41Å; L244-F249 HydrophobicContact CG-CE2 4.37Å; L244-L255 HydrophobicContact CD2-CD2 3.75Å; L244-L258 HydrophobicContact CD1-CD1 4.35Å; L244-L258 HydrophobicContact CD2-CD1 3.72Å; L244-A266 HydrophobicContact CB-CB 3.72Å; L244-A266 HydrophobicContact CD2-CB 4.22Å; L244-L285 HydrophobicContact CD2-CD2 3.89Å
245	D	78.9	Confident	68.1	Low	95 Å²	95	72.1 Å²	72.1	51%	0.508	43%	0.426	S	S	.	.			trans	-73.4	116.6	172.7	-177.3	11.7	0	0	0	109.8	S247 F249	D245-S247 VanDerWaalsContact C-N 3.34Å; D245-S247 VanDerWaalsContact OD1-CB 3.23Å; D245-S247 WeakPolarHBondContact OD1-CB 3.1Å; D245-S247 PolarHBondContact OD1-N 3.41Å; D245-S247 PolarHBondContact OD1-OG 2.92Å; D245-S247 VanDerWaalsContact OD1-OG 3.07Å; D245-S247 PolarHBondContact OD2-OG 2.64Å; D245-F249 WeakPolarHBondContact O-CD2 3.37Å; D245-F249 WeakPolarHBondContact O-CE2 3.48Å
246	L	80.4	Confident	70.5	Confident	17 Å²	17	70 Å²	70	9%	0.089	41%	0.412	C	S	.	.			trans	-85.8	-8.3	-179.2	-56.2	177.1	0	0	0	112.5	L244 A248 F249 L255 L285 K289	L244-L246 HydrophobicContact CD2-CD2 4.04Å; L244-L246 HydrophobicContact CG-CD2 4.38Å; L244-L246 PolarHBondContact O-N 3.28Å; L246-A248 PolarHBondContact O-N 2.72Å; L246-F249 PolarHBondContact O-N 3.25Å; L246-L255 HydrophobicContact CD2-CD1 4.14Å; L246-L255 HydrophobicContact CD2-CD2 4Å; L246-L285 HydrophobicContact CD1-CG 4.44Å; L246-L285 VanDerWaalsContact CD1-O 3.23Å; L246-L285 WeakPolarHBondContact CD1-O 3.42Å; L246-L285 HydrophobicContact CD2-CD1 4.5Å; L246-L285 HydrophobicContact CD2-CD2 4.13Å; L246-L285 HydrophobicContact CD2-CG 3.91Å; L246-K289 HydrophobicContact CB-CB 4.2Å; L246-K289 HydrophobicContact CB-CD 4.3Å; L246-K289 HydrophobicContact CB-CG 4.03Å; L246-K289 HydrophobicContact CD1-CB 4.24Å; L246-K289 WeakPolarHBondContact O-CD 3.44Å; L246-K289 WeakPolarHBondContact O-CE 3.4Å; L246-K289 PolarHBondContact O-NZ 2.87Å
247	S	78.6	Confident	72.7	Confident	77 Å²	77	71.2 Å²	71.2	54%	0.538	42%	0.416	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58.5	-38.5	-179.8	76.9	0	0	0	0	111.8	D245 F249 K289	D245-S247 VanDerWaalsContact C-N 3.34Å; D245-S247 VanDerWaalsContact OD1-CB 3.23Å; D245-S247 WeakPolarHBondContact OD1-CB 3.1Å; D245-S247 PolarHBondContact OD1-N 3.41Å; D245-S247 PolarHBondContact OD1-OG 2.92Å; D245-S247 VanDerWaalsContact OD1-OG 3.07Å; D245-S247 PolarHBondContact OD2-OG 2.64Å; S247-F249 VanDerWaalsContact C-N 3.3Å; S247-F249 PolarHBondContact O-N 3.36Å; S247-K289 PolarHBondContact O-NZ 3.35Å
248	A	77.4	Confident	74.7	Confident	77 Å²	77	66.6 Å²	66.6	64%	0.636	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-73.2	-10.3	-176.6	0	0	0	0	0	115.4	L246	L246-A248 PolarHBondContact O-N 2.72Å
249	F	84.2	Confident	76.5	Confident	38 Å²	38	63.2 Å²	63.2	17%	0.167	38%	0.376	C	S	.	.			trans	-108.8	126.4	-175.1	-61.8	-85.6	0	0	0	111.3	L244 D245 L246 S247 E254 L255 L258 K289	L244-F249 HydrophobicContact CD1-CE2 4.44Å; L244-F249 HydrophobicContact CD2-CE2 4.41Å; L244-F249 HydrophobicContact CG-CE2 4.37Å; D245-F249 WeakPolarHBondContact O-CD2 3.37Å; D245-F249 WeakPolarHBondContact O-CE2 3.48Å; L246-F249 PolarHBondContact O-N 3.25Å; S247-F249 VanDerWaalsContact C-N 3.3Å; S247-F249 PolarHBondContact O-N 3.36Å; F249-E254 WeakPolarHBondContact CA-OE2 3.27Å; F249-E254 HydrophobicContact CD1-CB 3.97Å; F249-L255 HydrophobicContact CB-CD2 4.11Å; F249-L255 HydrophobicContact CB-CG 4.03Å; F249-L255 HydrophobicContact CD1-CD2 3.76Å; F249-L255 HydrophobicContact CD1-CG 4.09Å; F249-L255 HydrophobicContact CD2-CD2 3.61Å; F249-L255 HydrophobicContact CD2-CG 4.45Å; F249-L255 HydrophobicContact CE1-CD2 4.05Å; F249-L255 HydrophobicContact CE2-CD2 3.92Å; F249-L255 HydrophobicContact CG-CD2 3.52Å; F249-L255 HydrophobicContact CG-CG 3.92Å; F249-L255 HydrophobicContact CZ-CD2 4.13Å; F249-L258 HydrophobicContact CE1-CD1 3.92Å; F249-L258 HydrophobicContact CE1-CD2 4.24Å; F249-L258 HydrophobicContact CE1-CG 4.26Å; F249-L258 HydrophobicContact CE2-CD1 4.48Å; F249-L258 HydrophobicContact CZ-CD1 3.71Å; F249-L258 HydrophobicContact CZ-CD2 4.26Å; F249-L258 HydrophobicContact CZ-CG 4.41Å; F249-K289 PolarHBondContact O-NZ 2.76Å
250	S	82.9	Confident	78.2	Confident	89 Å²	89	59.1 Å²	59.1	62%	0.622	36%	0.36	S	S	*	.	S	Bend	trans	-88.3	-19.8	-175.7	75.3	0	0	0	0	113.5	E254	S250-E254 PolarHBondContact N-OE2 3.43Å; S250-E254 VanDerWaalsContact OG-CD 3.3Å; S250-E254 PolarHBondContact OG-OE1 3.31Å; S250-E254 PolarHBondContact OG-OE2 2.93Å
251	S	86.1	Confident	79.5	Confident	31 Å²	31	62.1 Å²	62.1	22%	0.217	37%	0.365	C	S	.	.	S	Bend	trans	-149	165.5	-175.8	68.6	0	0	0	0	111.8	E253 E254	S251-E253 VanDerWaalsContact C-N 3.31Å; S251-E253 VanDerWaalsContact CB-OE2 3.23Å; S251-E253 WeakPolarHBondContact CB-OE2 3.46Å; S251-E253 PolarHBondContact OG-OE2 2.91Å; S251-E254 PolarHBondContact OG-N 3.13Å
252	W	85.1	Confident	80.7	Confident	67 Å²	67	66.9 Å²	66.9	25%	0.254	38%	0.379	S	S	.	.	H	α-helix	trans	-76.9	-22.5	177.9	65	-87.3	0	0	0	111.6	E254 L255 A256 E279 A282 Q283 F286	W252-E254 VanDerWaalsContact C-N 3.33Å; W252-L255 WeakPolarHBondContact O-CB 3.42Å; W252-L255 PolarHBondContact O-N 3.1Å; W252-A256 PolarHBondContact O-N 3Å; W252-E279 HydrophobicContact CH2-CB 4.33Å; W252-E279 HydrophobicContact CH2-CG 4.39Å; W252-E279 HydrophobicContact CZ3-CB 3.71Å; W252-E279 HydrophobicContact CZ3-CG 3.88Å; W252-A282 HydrophobicContact CE3-CB 4.35Å; W252-A282 WeakPolarHBondContact O-CB 3.44Å; W252-Q283 HydrophobicContact CB-CG 4.16Å; W252-Q283 HydrophobicContact CD2-CG 3.51Å; W252-Q283 HydrophobicContact CE3-CG 3.74Å; W252-Q283 HydrophobicContact CG-CG 3.69Å; W252-Q283 HydrophobicContact CZ3-CG 4.42Å; W252-F286 HydrophobicContact CB-CB 3.92Å; W252-F286 HydrophobicContact CB-CD1 4.39Å; W252-F286 HydrophobicContact CB-CG 4.11Å
253	E	86	Confident	81.3	Confident	99 Å²	99	65 Å²	65	46%	0.463	36%	0.363	S	S	.	.	H	α-helix	trans	-64.5	-35.8	174.5	-64.1	85.6	164.6	0	0	111.6	S251 A256 S257	S251-E253 VanDerWaalsContact C-N 3.31Å; S251-E253 VanDerWaalsContact CB-OE2 3.23Å; S251-E253 WeakPolarHBondContact CB-OE2 3.46Å; S251-E253 PolarHBondContact OG-OE2 2.91Å; E253-A256 WeakPolarHBondContact O-CB 3.35Å; E253-A256 PolarHBondContact O-N 3.05Å; E253-S257 PolarHBondContact O-N 2.84Å
254	E	83.8	Confident	81.9	Confident	76 Å²	76	62.6 Å²	62.6	36%	0.355	35%	0.351	S	S	.	.	H	α-helix	trans	-68.2	-36.2	172.8	-71.2	173.3	-174.6	0	0	111.9	F249 S250 S251 W252 S257	F249-E254 WeakPolarHBondContact CA-OE2 3.27Å; F249-E254 HydrophobicContact CD1-CB 3.97Å; S250-E254 PolarHBondContact N-OE2 3.43Å; S250-E254 VanDerWaalsContact OG-CD 3.3Å; S250-E254 PolarHBondContact OG-OE1 3.31Å; S250-E254 PolarHBondContact OG-OE2 2.93Å; S251-E254 PolarHBondContact OG-N 3.13Å; W252-E254 VanDerWaalsContact C-N 3.33Å; E254-S257 WeakPolarHBondContact O-CB 3.35Å; E254-S257 PolarHBondContact O-N 3.37Å; E254-S257 PolarHBondContact O-OG 2.92Å
255	L	82.7	Confident	81.9	Confident	0 Å²	0	62.9 Å²	62.9	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-69.8	-34.7	174.8	-73.6	171.4	0	0	0	112.4	L244 L246 F249 W252 S257 L258 L263 A282 F286	L244-L255 HydrophobicContact CD2-CD2 3.75Å; L246-L255 HydrophobicContact CD2-CD1 4.14Å; L246-L255 HydrophobicContact CD2-CD2 4Å; F249-L255 HydrophobicContact CB-CD2 4.11Å; F249-L255 HydrophobicContact CB-CG 4.03Å; F249-L255 HydrophobicContact CD1-CD2 3.76Å; F249-L255 HydrophobicContact CD1-CG 4.09Å; F249-L255 HydrophobicContact CD2-CD2 3.61Å; F249-L255 HydrophobicContact CD2-CG 4.45Å; F249-L255 HydrophobicContact CE1-CD2 4.05Å; F249-L255 HydrophobicContact CE2-CD2 3.92Å; F249-L255 HydrophobicContact CG-CD2 3.52Å; F249-L255 HydrophobicContact CG-CG 3.92Å; F249-L255 HydrophobicContact CZ-CD2 4.13Å; W252-L255 WeakPolarHBondContact O-CB 3.42Å; W252-L255 PolarHBondContact O-N 3.1Å; L255-S257 PolarHBondContact O-N 2.84Å; L255-L258 HydrophobicContact CD2-CD1 3.85Å; L255-L258 WeakPolarHBondContact O-CB 3.49Å; L255-L258 PolarHBondContact O-N 3.23Å; L255-L258 VanDerWaalsContact O-N 3.14Å; L255-L263 HydrophobicContact CB-CD2 4.22Å; L255-A282 HydrophobicContact CB-CB 4.13Å; L255-F286 HydrophobicContact CD1-CB 3.81Å; L255-F286 HydrophobicContact CD1-CD2 3.69Å; L255-F286 HydrophobicContact CD1-CG 4.22Å
256	A	84.4	Confident	82	Confident	17 Å²	17	58.4 Å²	58.4	14%	0.14	33%	0.331	C	S	.	.	H	α-helix	trans	-58	-35.2	174.7	0	0	0	0	0	111.8	W252 E253 L258 G259 L278 A282	W252-A256 PolarHBondContact O-N 3Å; E253-A256 WeakPolarHBondContact O-CB 3.35Å; E253-A256 PolarHBondContact O-N 3.05Å; A256-L258 PolarHBondContact O-N 3.08Å; A256-G259 PolarHBondContact O-N 3.2Å; A256-L278 HydrophobicContact CB-CD2 3.41Å; A256-L278 VanDerWaalsContact CB-CD2 3.41Å; A256-L278 WeakPolarHBondContact O-CD2 3.46Å; A256-A282 HydrophobicContact CB-CB 4.07Å
257	S	84.6	Confident	82.2	Confident	100 Å²	100	57.6 Å²	57.6	70%	0.699	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65	-18.4	178.2	80.3	0	0	0	0	114.5	E253 E254 L255 G259	E253-S257 PolarHBondContact O-N 2.84Å; E254-S257 WeakPolarHBondContact O-CB 3.35Å; E254-S257 PolarHBondContact O-N 3.37Å; E254-S257 PolarHBondContact O-OG 2.92Å; L255-S257 PolarHBondContact O-N 2.84Å; S257-G259 PolarHBondContact O-N 3.24Å
258	L	82.3	Confident	82.2	Confident	62 Å²	62	57.5 Å²	57.5	33%	0.325	32%	0.319	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-11.9	177.4	-60.2	176.6	0	0	0	113.6	L244 F249 L255 A256 R262	L244-L258 HydrophobicContact CD1-CD1 4.35Å; L244-L258 HydrophobicContact CD2-CD1 3.72Å; F249-L258 HydrophobicContact CE1-CD1 3.92Å; F249-L258 HydrophobicContact CE1-CD2 4.24Å; F249-L258 HydrophobicContact CE1-CG 4.26Å; F249-L258 HydrophobicContact CE2-CD1 4.48Å; F249-L258 HydrophobicContact CZ-CD1 3.71Å; F249-L258 HydrophobicContact CZ-CD2 4.26Å; F249-L258 HydrophobicContact CZ-CG 4.41Å; L255-L258 HydrophobicContact CD2-CD1 3.85Å; L255-L258 WeakPolarHBondContact O-CB 3.49Å; L255-L258 PolarHBondContact O-N 3.23Å; L255-L258 VanDerWaalsContact O-N 3.14Å; A256-L258 PolarHBondContact O-N 3.08Å; L258-R262 HydrophobicContact CB-CB 4.09Å; L258-R262 HydrophobicContact CB-CG 4.19Å; L258-R262 HydrophobicContact CD1-CG 4.42Å; L258-R262 WeakPolarHBondContact O-CB 3.48Å
259	G	81.1	Confident	82.3	Confident	25 Å²	25	55.6 Å²	55.6	26%	0.258	30%	0.303	S	S	.	.	H	α-helix	trans	82.5	165.1	177.3	0	0	0	0	0	114.9	A256 S257 D261 R262 L263	A256-G259 PolarHBondContact O-N 3.2Å; S257-G259 PolarHBondContact O-N 3.24Å; G259-D261 VanDerWaalsContact C-N 3.34Å; G259-D261 PolarHBondContact O-N 3.48Å; G259-R262 PolarHBondContact O-N 3.2Å; G259-L263 WeakPolarHBondContact O-CG 3.29Å; G259-L263 PolarHBondContact O-N 3.27Å
260	L	79.4	Confident	81.9	Confident	77 Å²	77	55.4 Å²	55.4	40%	0.403	30%	0.303	S	S	.	.	H	α-helix	trans	-59.8	-39.2	-172	-85.7	162.3	0	0	0	113.6	K264 L278	L260-K264 WeakPolarHBondContact O-CB 3.12Å; L260-K264 PolarHBondContact O-N 3.12Å; L260-L278 HydrophobicContact CD2-CB 4.02Å; L260-L278 HydrophobicContact CG-CB 4.22Å; L260-L278 HydrophobicContact CG-CD1 4.13Å; L260-L278 HydrophobicContact CG-CG 4.42Å
261	D	76.1	Confident	81.6	Confident	136 Å²	136	53 Å²	53	73%	0.727	29%	0.292	S	S	*	.	H	α-helix	trans	-72.2	-39.2	-174.5	-66.8	-45.7	0	0	0	112.3	G259 K264 S265	G259-D261 VanDerWaalsContact C-N 3.34Å; G259-D261 PolarHBondContact O-N 3.48Å; D261-K264 PolarHBondContact O-N 3.49Å; D261-S265 WeakPolarHBondContact O-CB 3.35Å; D261-S265 PolarHBondContact O-N 3.28Å
262	R	81.9	Confident	81.5	Confident	115 Å²	115	51.7 Å²	51.7	43%	0.434	28%	0.283	S	S	.	.	H	α-helix	trans	-69.7	-41	177.7	-166.4	65.7	178.8	179.2	3.6	111.5	L258 G259 S265 A266	L258-R262 HydrophobicContact CB-CB 4.09Å; L258-R262 HydrophobicContact CB-CG 4.19Å; L258-R262 HydrophobicContact CD1-CG 4.42Å; L258-R262 WeakPolarHBondContact O-CB 3.48Å; G259-R262 PolarHBondContact O-N 3.2Å; R262-S265 PolarHBondContact O-N 2.9Å; R262-A266 WeakPolarHBondContact O-CB 3.34Å; R262-A266 PolarHBondContact O-N 3.43Å
263	L	82.1	Confident	81.5	Confident	0 Å²	0	52.9 Å²	52.9	0%	0	29%	0.29	C	S	.	.	H	α-helix	trans	-65.2	-42.1	175	-69.6	174.1	0	0	0	112.2	L255 G259 S265 A266 L267 L278 R281 A282 L285	L255-L263 HydrophobicContact CB-CD2 4.22Å; G259-L263 WeakPolarHBondContact O-CG 3.29Å; G259-L263 PolarHBondContact O-N 3.27Å; L263-S265 VanDerWaalsContact C-N 3.35Å; L263-A266 PolarHBondContact O-N 3.28Å; L263-L267 WeakPolarHBondContact O-CB 3.28Å; L263-L267 VanDerWaalsContact O-CG 3.28Å; L263-L267 WeakPolarHBondContact O-CG 3.32Å; L263-L267 PolarHBondContact O-N 3.5Å; L263-L278 HydrophobicContact CD1-CG 4.25Å; L263-R281 HydrophobicContact CB-CB 4.37Å; L263-R281 HydrophobicContact CD1-CB 4.41Å; L263-A282 HydrophobicContact CD1-CB 4Å; L263-A282 HydrophobicContact CD2-CB 4.29Å; L263-L285 HydrophobicContact CD2-CD2 3.7Å
264	K	81.9	Confident	81.3	Confident	94 Å²	94	49.6 Å²	49.6	41%	0.409	28%	0.277	S	S	.	.	H	α-helix	trans	-60.9	-45.8	175	-170.7	-172.3	177.4	-175.1	0	110.5	L260 D261 L267 M268 C274	L260-K264 WeakPolarHBondContact O-CB 3.12Å; L260-K264 PolarHBondContact O-N 3.12Å; D261-K264 PolarHBondContact O-N 3.49Å; K264-L267 PolarHBondContact O-N 2.9Å; K264-M268 HydrophobicContact CD-CE 4.38Å; K264-M268 HydrophobicContact CG-CE 3.92Å; K264-M268 HydrophobicContact CG-SD 4.28Å; K264-M268 WeakPolarHBondContact O-CB 3.17Å; K264-M268 VanDerWaalsContact O-CG 3.25Å; K264-M268 WeakPolarHBondContact O-CG 3.35Å; K264-M268 PolarHBondContact O-N 2.95Å; K264-C274 HydrophobicContact CG-CB 4.14Å
265	S	80.3	Confident	81	Confident	29 Å²	29	48.1 Å²	48.1	20%	0.203	28%	0.283	C	S	.	.	H	α-helix	trans	-60.6	-48	177.3	-167.3	0	0	0	0	111.8	G241 A242 D261 R262 L263 L267 M268 A269	G241-S265 WeakPolarHBondContact CA-O 3.49Å; A242-S265 PolarHBondContact N-OG 3.27Å; D261-S265 WeakPolarHBondContact O-CB 3.35Å; D261-S265 PolarHBondContact O-N 3.28Å; R262-S265 PolarHBondContact O-N 2.9Å; L263-S265 VanDerWaalsContact C-N 3.35Å; S265-L267 PolarHBondContact O-N 3.37Å; S265-M268 PolarHBondContact O-N 3.45Å; S265-A269 PolarHBondContact O-N 3.45Å
266	A	80.7	Confident	81	Confident	1 Å²	1	50 Å²	50	1%	0.008	30%	0.302	C	S	.	.	H	α-helix	trans	-65.2	-38.2	178.7	0	0	0	0	0	113.5	L244 R262 L263 A269 L270 L285	L244-A266 HydrophobicContact CB-CB 3.72Å; L244-A266 HydrophobicContact CD2-CB 4.22Å; R262-A266 WeakPolarHBondContact O-CB 3.34Å; R262-A266 PolarHBondContact O-N 3.43Å; L263-A266 PolarHBondContact O-N 3.28Å; A266-A269 WeakPolarHBondContact O-CB 3.23Å; A266-A269 PolarHBondContact O-N 2.89Å; A266-L270 PolarHBondContact O-N 2.87Å; A266-L285 HydrophobicContact CB-CD1 3.89Å; A266-L285 HydrophobicContact CB-CD2 3.58Å; A266-L285 HydrophobicContact CB-CG 4.41Å
267	L	84.1	Confident	81.1	Confident	0 Å²	0	52.7 Å²	52.7	0%	0	32%	0.317	C	S	.	.	H	α-helix	trans	-67.3	-38.1	174.8	-74	169.5	0	0	0	112.2	L263 K264 S265 A269 L270 G271 L272 R281 R284 L285	L263-L267 WeakPolarHBondContact O-CB 3.28Å; L263-L267 VanDerWaalsContact O-CG 3.28Å; L263-L267 WeakPolarHBondContact O-CG 3.32Å; L263-L267 PolarHBondContact O-N 3.5Å; K264-L267 PolarHBondContact O-N 2.9Å; S265-L267 PolarHBondContact O-N 3.37Å; L267-A269 VanDerWaalsContact C-N 3.34Å; L267-L270 PolarHBondContact O-N 3.46Å; L267-G271 PolarHBondContact O-N 3.47Å; L267-L272 HydrophobicContact CB-CB 4.41Å; L267-L272 HydrophobicContact CD2-CB 3.85Å; L267-L272 HydrophobicContact CD2-CD1 3.82Å; L267-L272 PolarHBondContact O-N 2.73Å; L267-R281 HydrophobicContact CD1-CB 3.73Å; L267-R281 HydrophobicContact CD1-CG 3.94Å; L267-R284 HydrophobicContact CD2-CB 4.29Å; L267-R284 HydrophobicContact CD2-CG 4.13Å; L267-L285 HydrophobicContact CD2-CB 3.88Å; L267-L285 HydrophobicContact CD2-CD1 4.08Å; L267-L285 HydrophobicContact CG-CB 4.29Å; L267-L285 HydrophobicContact CG-CD1 4.35Å
268	M	79.1	Confident	81.1	Confident	75 Å²	75	50.8 Å²	50.8	37%	0.369	30%	0.298	S	S	.	.	H	α-helix	trans	-65.4	-37.6	173.6	-72.4	-176.4	-57.7	0	0	111.6	K264 S265 L270 G271 C274	K264-M268 HydrophobicContact CD-CE 4.38Å; K264-M268 HydrophobicContact CG-CE 3.92Å; K264-M268 HydrophobicContact CG-SD 4.28Å; K264-M268 WeakPolarHBondContact O-CB 3.17Å; K264-M268 VanDerWaalsContact O-CG 3.25Å; K264-M268 WeakPolarHBondContact O-CG 3.35Å; K264-M268 PolarHBondContact O-N 2.95Å; S265-M268 PolarHBondContact O-N 3.45Å; M268-L270 PolarHBondContact O-N 3.04Å; M268-G271 PolarHBondContact O-N 3.41Å; M268-G271 VanDerWaalsContact O-N 3.11Å; M268-C274 WeakPolarHBondContact CG-SG 3.45Å
269	A	78.8	Confident	81.3	Confident	37 Å²	37	53.1 Å²	53.1	31%	0.306	31%	0.308	S	S	.	.	H	α-helix	trans	-59.1	-32.2	176.2	0	0	0	0	0	112.6	G241 S265 A266 L267	G241-A269 VanDerWaalsContact C-CB 3.46Å; G241-A269 WeakPolarHBondContact O-CB 3.3Å; S265-A269 PolarHBondContact O-N 3.45Å; A266-A269 WeakPolarHBondContact O-CB 3.23Å; A266-A269 PolarHBondContact O-N 2.89Å; L267-A269 VanDerWaalsContact C-N 3.34Å
270	L	77.5	Confident	81.6	Confident	33 Å²	33	56.2 Å²	56.2	17%	0.173	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97.1	2.8	179.7	-60.8	173.9	0	0	0	113.5	A266 L267 M268 L272 L285 L293	A266-L270 PolarHBondContact O-N 2.87Å; L267-L270 PolarHBondContact O-N 3.46Å; M268-L270 PolarHBondContact O-N 3.04Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 HydrophobicContact CB-CD1 3.77Å; L270-L272 HydrophobicContact CB-CG 4.07Å; L270-L272 HydrophobicContact CD1-CD1 4.1Å; L270-L272 PolarHBondContact O-N 2.98Å; L270-L285 HydrophobicContact CD1-CD1 3.67Å; L270-L293 HydrophobicContact CD2-CD2 4.29Å
271	G	76.1	Confident	81.9	Confident	38 Å²	38	54.7 Å²	54.7	39%	0.392	30%	0.304	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.3	19.6	-179.4	0	0	0	0	0	115.1	L267 M268 A302	L267-G271 PolarHBondContact O-N 3.47Å; M268-G271 PolarHBondContact O-N 3.41Å; M268-G271 VanDerWaalsContact O-N 3.11Å; G271-A302 PolarHBondContact O-N 3.25Å
272	L	83.3	Confident	82.3	Confident	4 Å²	4	48.2 Å²	48.2	2%	0.021	27%	0.27	C	S	.	.	B	Isolated β-bridge	trans	-91	157.7	-175.5	-64.3	163.9	0	0	0	112.3	L267 L270 C274 T288 L300 F301	L267-L272 HydrophobicContact CB-CB 4.41Å; L267-L272 HydrophobicContact CD2-CB 3.85Å; L267-L272 HydrophobicContact CD2-CD1 3.82Å; L267-L272 PolarHBondContact O-N 2.73Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 HydrophobicContact CB-CD1 3.77Å; L270-L272 HydrophobicContact CB-CG 4.07Å; L270-L272 HydrophobicContact CD1-CD1 4.1Å; L270-L272 PolarHBondContact O-N 2.98Å; L272-C274 PolarHBondContact O-N 3.38Å; L272-C274 PolarHBondContact O-SG 3Å; L272-T288 HydrophobicContact CD1-CG2 3.65Å; L272-L300 HydrophobicContact CD2-CB 3.99Å; L272-F301 HydrophobicContact CD2-CD1 4.19Å; L272-F301 HydrophobicContact CD2-CE1 4.2Å; L272-F301 HydrophobicContact CD2-CG 4.48Å
273	K	84.7	Confident	82.6	Confident	92 Å²	92	47 Å²	47	40%	0.4	27%	0.269	S	S	.	.			trans	-60.3	130.9	175.1	-72.3	173.7	178.7	169.3	0	111.2	R284 S299 L300 F301 A302	K273-R284 WeakPolarHBondContact O-CD 3.43Å; K273-R284 PolarHBondContact O-NH1 3.43Å; K273-S299 VanDerWaalsContact CE-O 3.24Å; K273-S299 WeakPolarHBondContact CE-O 3.46Å; K273-S299 PolarHBondContact NZ-O 3.47Å; K273-L300 PolarHBondContact N-O 3.09Å; K273-F301 WeakPolarHBondContact CE-O 3.46Å; K273-A302 HydrophobicContact CG-CB 4.46Å
274	C	82.1	Confident	82.8	Confident	30 Å²	30	49.1 Å²	49.1	20%	0.203	28%	0.277	C	S	.	.			trans	-101.5	6.8	-178.9	-64.9	0	0	0	0	114.2	K264 M268 L272 R281	K264-C274 HydrophobicContact CG-CB 4.14Å; M268-C274 WeakPolarHBondContact CG-SG 3.45Å; L272-C274 PolarHBondContact O-N 3.38Å; L272-C274 PolarHBondContact O-SG 3Å; C274-R281 PolarHBondContact O-NE 3.38Å; C274-R281 PolarHBondContact O-NH1 3.33Å; C274-R281 PolarHBondContact O-NH2 2.83Å; C274-R281 VanDerWaalsContact O-NH2 3.16Å
275	G	77.8	Confident	83	Confident	45 Å²	45	44.7 Å²	44.7	46%	0.464	26%	0.258	S	S	.	.			trans	-81.7	161.7	177	0	0	0	0	0	112.9	R284	G275-R284 PolarHBondContact O-NH1 2.88Å; G275-R284 PolarHBondContact O-NH2 2.91Å
276	G	83.3	Confident	83.3	Confident	39 Å²	39	46 Å²	46	40%	0.402	26%	0.26	S	S	.	.	S	Bend	trans	106.3	179.4	179.3	0	0	0	0	0	114.5	E280 R281	G276-E280 WeakPolarHBondContact CA-OE2 3.35Å; G276-R281 PolarHBondContact O-NE 3.39Å; G276-R281 VanDerWaalsContact O-NE 3.1Å; G276-R281 PolarHBondContact O-NH2 2.87Å
277	T	85.9	Confident	83.5	Confident	74 Å²	74	48.1 Å²	48.1	45%	0.454	28%	0.275	S	S	.	.			trans	-68.3	165.8	176.8	67.7	0	0	0	0	111.3	E279 E280 R281	T277-E279 PolarHBondContact O-N 3.22Å; T277-E280 PolarHBondContact N-OE2 3.46Å; T277-E280 PolarHBondContact O-N 2.99Å; T277-E280 VanDerWaalsContact OG1-CG 3.29Å; T277-E280 WeakPolarHBondContact OG1-CG 3.32Å; T277-E280 PolarHBondContact OG1-N 2.92Å; T277-R281 WeakPolarHBondContact O-CG 3.32Å; T277-R281 PolarHBondContact O-N 2.82Å; T277-R281 VanDerWaalsContact O-N 3.1Å
278	L	85.6	Confident	83.5	Confident	60 Å²	60	48.8 Å²	48.8	31%	0.314	28%	0.278	S	S	.	.	H	α-helix	trans	-58	-39.4	178.4	177.2	157.4	0	0	0	111.4	A256 L260 L263 R281 A282	A256-L278 HydrophobicContact CB-CD2 3.41Å; A256-L278 VanDerWaalsContact CB-CD2 3.41Å; A256-L278 WeakPolarHBondContact O-CD2 3.46Å; L260-L278 HydrophobicContact CD2-CB 4.02Å; L260-L278 HydrophobicContact CG-CB 4.22Å; L260-L278 HydrophobicContact CG-CD1 4.13Å; L260-L278 HydrophobicContact CG-CG 4.42Å; L263-L278 HydrophobicContact CD1-CG 4.25Å; L278-R281 PolarHBondContact O-N 3.4Å; L278-A282 PolarHBondContact O-N 3.39Å
279	E	85.9	Confident	83.6	Confident	111 Å²	111	48.8 Å²	48.8	52%	0.519	28%	0.277	S	S	.	.	H	α-helix	trans	-66.4	-46.3	178.1	-58.3	177	175.7	0	0	111.8	W252 T277 R281 A282 Q283	W252-E279 HydrophobicContact CH2-CB 4.33Å; W252-E279 HydrophobicContact CH2-CG 4.39Å; W252-E279 HydrophobicContact CZ3-CB 3.71Å; W252-E279 HydrophobicContact CZ3-CG 3.88Å; T277-E279 PolarHBondContact O-N 3.22Å; E279-R281 VanDerWaalsContact C-N 3.26Å; E279-R281 PolarHBondContact O-N 2.75Å; E279-A282 PolarHBondContact O-N 3.35Å; E279-Q283 WeakPolarHBondContact O-CB 3.1Å; E279-Q283 WeakPolarHBondContact O-CG 3.46Å; E279-Q283 PolarHBondContact O-N 3.34Å
280	E	86.7	Confident	83.4	Confident	91 Å²	91	51.2 Å²	51.2	43%	0.425	31%	0.305	S	S	.	.	H	α-helix	trans	-61.6	-34.6	177.7	-72.1	170.5	173.5	0	0	112.3	G276 T277 R284	G276-E280 WeakPolarHBondContact CA-OE2 3.35Å; T277-E280 PolarHBondContact N-OE2 3.46Å; T277-E280 PolarHBondContact O-N 2.99Å; T277-E280 VanDerWaalsContact OG1-CG 3.29Å; T277-E280 WeakPolarHBondContact OG1-CG 3.32Å; T277-E280 PolarHBondContact OG1-N 2.92Å; E280-R284 WeakPolarHBondContact O-CB 3.5Å; E280-R284 PolarHBondContact O-N 3.05Å
281	R	85.2	Confident	83.6	Confident	44 Å²	44	55.5 Å²	55.5	17%	0.166	32%	0.323	C	S	.	.	H	α-helix	trans	-70.9	-42.6	175.4	-69.5	178.5	-161.2	-158.4	1.1	111.7	L263 L267 C274 G276 T277 L278 E279 R284 L285	L263-R281 HydrophobicContact CB-CB 4.37Å; L263-R281 HydrophobicContact CD1-CB 4.41Å; L267-R281 HydrophobicContact CD1-CB 3.73Å; L267-R281 HydrophobicContact CD1-CG 3.94Å; C274-R281 PolarHBondContact O-NE 3.38Å; C274-R281 PolarHBondContact O-NH1 3.33Å; C274-R281 PolarHBondContact O-NH2 2.83Å; C274-R281 VanDerWaalsContact O-NH2 3.16Å; G276-R281 PolarHBondContact O-NE 3.39Å; G276-R281 VanDerWaalsContact O-NE 3.1Å; G276-R281 PolarHBondContact O-NH2 2.87Å; T277-R281 WeakPolarHBondContact O-CG 3.32Å; T277-R281 PolarHBondContact O-N 2.82Å; T277-R281 VanDerWaalsContact O-N 3.1Å; L278-R281 PolarHBondContact O-N 3.4Å; E279-R281 VanDerWaalsContact C-N 3.26Å; E279-R281 PolarHBondContact O-N 2.75Å; R281-R284 PolarHBondContact O-N 2.81Å; R281-L285 WeakPolarHBondContact O-CB 3.31Å; R281-L285 PolarHBondContact O-N 3.48Å
282	A	84.9	Confident	83.4	Confident	0 Å²	0	57.1 Å²	57.1	0%	0	33%	0.327	C	S	.	.	H	α-helix	trans	-65	-43.8	177.3	0	0	0	0	0	111.7	W252 L255 A256 L263 L278 E279 L285 F286	W252-A282 HydrophobicContact CE3-CB 4.35Å; W252-A282 WeakPolarHBondContact O-CB 3.44Å; L255-A282 HydrophobicContact CB-CB 4.13Å; A256-A282 HydrophobicContact CB-CB 4.07Å; L263-A282 HydrophobicContact CD1-CB 4Å; L263-A282 HydrophobicContact CD2-CB 4.29Å; L278-A282 PolarHBondContact O-N 3.39Å; E279-A282 PolarHBondContact O-N 3.35Å; A282-L285 PolarHBondContact O-N 3.16Å; A282-F286 VanDerWaalsContact O-CB 3.31Å; A282-F286 WeakPolarHBondContact O-CB 3.44Å; A282-F286 PolarHBondContact O-N 3.3Å
283	Q	87.7	Confident	82.6	Confident	90 Å²	90	61.2 Å²	61.2	42%	0.421	35%	0.349	S	S	.	.	H	α-helix	trans	-62.8	-42.4	175.1	-71.4	174.4	4.3	0	0	112	W252 E279 F286 S287	W252-Q283 HydrophobicContact CB-CG 4.16Å; W252-Q283 HydrophobicContact CD2-CG 3.51Å; W252-Q283 HydrophobicContact CE3-CG 3.74Å; W252-Q283 HydrophobicContact CG-CG 3.69Å; W252-Q283 HydrophobicContact CZ3-CG 4.42Å; E279-Q283 WeakPolarHBondContact O-CB 3.1Å; E279-Q283 WeakPolarHBondContact O-CG 3.46Å; E279-Q283 PolarHBondContact O-N 3.34Å; Q283-F286 PolarHBondContact O-N 2.99Å; Q283-S287 WeakPolarHBondContact O-CB 3.43Å; Q283-S287 PolarHBondContact O-N 3.28Å
284	R	87.3	Confident	82	Confident	44 Å²	44	65.8 Å²	65.8	17%	0.166	37%	0.372	C	S	.	.	H	α-helix	trans	-63.2	-43.6	176.7	-169.6	179.2	-54.6	121.3	11.7	111.9	L267 K273 G275 E280 R281 S287 L300	L267-R284 HydrophobicContact CD2-CB 4.29Å; L267-R284 HydrophobicContact CD2-CG 4.13Å; K273-R284 WeakPolarHBondContact O-CD 3.43Å; K273-R284 PolarHBondContact O-NH1 3.43Å; G275-R284 PolarHBondContact O-NH1 2.88Å; G275-R284 PolarHBondContact O-NH2 2.91Å; E280-R284 WeakPolarHBondContact O-CB 3.5Å; E280-R284 PolarHBondContact O-N 3.05Å; R281-R284 PolarHBondContact O-N 2.81Å; R284-S287 PolarHBondContact O-N 3.26Å; R284-S287 PolarHBondContact O-OG 2.92Å; R284-L300 HydrophobicContact CG-CD2 4.48Å
285	L	85.8	Confident	81.6	Confident	1 Å²	1	67.8 Å²	67.8	1%	0.005	39%	0.386	C	S	.	.	H	α-helix	trans	-67.7	-40.5	176.2	-173.3	64.8	0	0	0	111.6	L244 L246 L263 A266 L267 L270 R281 A282 S287 T288	L244-L285 HydrophobicContact CD2-CD2 3.89Å; L246-L285 HydrophobicContact CD1-CG 4.44Å; L246-L285 VanDerWaalsContact CD1-O 3.23Å; L246-L285 WeakPolarHBondContact CD1-O 3.42Å; L246-L285 HydrophobicContact CD2-CD1 4.5Å; L246-L285 HydrophobicContact CD2-CD2 4.13Å; L246-L285 HydrophobicContact CD2-CG 3.91Å; L263-L285 HydrophobicContact CD2-CD2 3.7Å; A266-L285 HydrophobicContact CB-CD1 3.89Å; A266-L285 HydrophobicContact CB-CD2 3.58Å; A266-L285 HydrophobicContact CB-CG 4.41Å; L267-L285 HydrophobicContact CD2-CB 3.88Å; L267-L285 HydrophobicContact CD2-CD1 4.08Å; L267-L285 HydrophobicContact CG-CB 4.29Å; L267-L285 HydrophobicContact CG-CD1 4.35Å; L270-L285 HydrophobicContact CD1-CD1 3.67Å; R281-L285 WeakPolarHBondContact O-CB 3.31Å; R281-L285 PolarHBondContact O-N 3.48Å; A282-L285 PolarHBondContact O-N 3.16Å; L285-S287 VanDerWaalsContact C-N 3.3Å; L285-S287 PolarHBondContact O-N 2.94Å; L285-T288 PolarHBondContact O-N 2.89Å; L285-T288 PolarHBondContact O-OG1 3.37Å
286	F	86.6	Confident	81.5	Confident	58 Å²	58	66.3 Å²	66.3	25%	0.254	37%	0.367	S	S	.	.	H	α-helix	trans	-66.1	-32.8	177.2	-167.1	-106.5	0	0	0	112.4	W252 L255 A282 Q283 T288 K289	W252-F286 HydrophobicContact CB-CB 3.92Å; W252-F286 HydrophobicContact CB-CD1 4.39Å; W252-F286 HydrophobicContact CB-CG 4.11Å; L255-F286 HydrophobicContact CD1-CB 3.81Å; L255-F286 HydrophobicContact CD1-CD2 3.69Å; L255-F286 HydrophobicContact CD1-CG 4.22Å; A282-F286 VanDerWaalsContact O-CB 3.31Å; A282-F286 WeakPolarHBondContact O-CB 3.44Å; A282-F286 PolarHBondContact O-N 3.3Å; Q283-F286 PolarHBondContact O-N 2.99Å; F286-T288 PolarHBondContact O-N 3.01Å; F286-T288 VanDerWaalsContact O-N 3.07Å; F286-K289 HydrophobicContact CD2-CD 4.39Å; F286-K289 HydrophobicContact CE2-CD 3.87Å; F286-K289 HydrophobicContact CZ-CD 4.33Å; F286-K289 WeakPolarHBondContact O-CB 3.34Å; F286-K289 PolarHBondContact O-N 2.75Å
287	S	85.4	Confident	81.1	Confident	45 Å²	45	68.6 Å²	68.6	32%	0.315	37%	0.371	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.2	-16.4	178.7	78.8	0	0	0	0	114.2	Q283 R284 L285	Q283-S287 WeakPolarHBondContact O-CB 3.43Å; Q283-S287 PolarHBondContact O-N 3.28Å; R284-S287 PolarHBondContact O-N 3.26Å; R284-S287 PolarHBondContact O-OG 2.92Å; L285-S287 VanDerWaalsContact C-N 3.3Å; L285-S287 PolarHBondContact O-N 2.94Å
288	T	83.3	Confident	80.7	Confident	13 Å²	13	70.3 Å²	70.3	8%	0.08	38%	0.383	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.1	-3.9	175.6	69.5	0	0	0	0	113.4	L272 L285 F286 G290 K291 L296	L272-T288 HydrophobicContact CD1-CG2 3.65Å; L285-T288 PolarHBondContact O-N 2.89Å; L285-T288 PolarHBondContact O-OG1 3.37Å; F286-T288 PolarHBondContact O-N 3.01Å; F286-T288 VanDerWaalsContact O-N 3.07Å; T288-G290 PolarHBondContact O-N 2.84Å; T288-K291 PolarHBondContact O-N 3.24Å; T288-L296 HydrophobicContact CG2-CD1 3.5Å; T288-L296 HydrophobicContact CG2-CD2 4.02Å; T288-L296 HydrophobicContact CG2-CG 4.44Å
289	K	82	Confident	80.3	Confident	76 Å²	76	70.3 Å²	70.3	33%	0.33	39%	0.388	S	S	.	.	T	Hydrogen-bonded Turn	trans	-63.6	120.2	177.9	-172.6	176.7	-179.6	171.1	0	110.3	L246 S247 F249 F286 K291	L246-K289 HydrophobicContact CB-CB 4.2Å; L246-K289 HydrophobicContact CB-CD 4.3Å; L246-K289 HydrophobicContact CB-CG 4.03Å; L246-K289 HydrophobicContact CD1-CB 4.24Å; L246-K289 WeakPolarHBondContact O-CD 3.44Å; L246-K289 WeakPolarHBondContact O-CE 3.4Å; L246-K289 PolarHBondContact O-NZ 2.87Å; S247-K289 PolarHBondContact O-NZ 3.35Å; F249-K289 PolarHBondContact O-NZ 2.76Å; F286-K289 HydrophobicContact CD2-CD 4.39Å; F286-K289 HydrophobicContact CE2-CD 3.87Å; F286-K289 HydrophobicContact CZ-CD 4.33Å; F286-K289 WeakPolarHBondContact O-CB 3.34Å; F286-K289 PolarHBondContact O-N 2.75Å; K289-K291 VanDerWaalsContact C-N 3.27Å; K289-K291 PolarHBondContact O-N 2.55Å
290	G	74.3	Confident	79.8	Confident	88 Å²	88	67.2 Å²	67.2	91%	0.907	38%	0.375	S	S	*	.	T	Hydrogen-bonded Turn	trans	74.4	9.6	176.8	0	0	0	0	0	115.4	T288	T288-G290 PolarHBondContact O-N 2.84Å
291	K	81.3	Confident	79.5	Confident	123 Å²	123	65.7 Å²	65.7	54%	0.535	37%	0.367	S	S	.	.			trans	-111.8	140.9	176.2	-68.6	-173.9	-175.6	174.8	0	110.5	T288 K289 L296	T288-K291 PolarHBondContact O-N 3.24Å; K289-K291 VanDerWaalsContact C-N 3.27Å; K289-K291 PolarHBondContact O-N 2.55Å; K291-L296 HydrophobicContact CB-CD2 4.1Å; K291-L296 HydrophobicContact CD-CD2 4.05Å
292	S	72.3	Confident	79	Confident	71 Å²	71	65.9 Å²	65.9	50%	0.497	38%	0.377	S	S	.	.			trans	-71	147.7	169.8	63	0	0	0	0	109.9	E294 S295	S292-E294 PolarHBondContact O-N 2.98Å; S292-E294 VanDerWaalsContact O-N 3.1Å; S292-S295 PolarHBondContact N-OG 3.36Å; S292-S295 PolarHBondContact O-N 3.21Å; S292-S295 PolarHBondContact O-OG 3.32Å
293	L	67.3	Low	77.9	Confident	91 Å²	91	75.1 Å²	75.1	48%	0.476	42%	0.418	S	S	.	.	G	3₁₀ helix	trans	-57	-28.2	-178.5	-72	168.6	0	0	0	113	L270 S295 L296 F301	L270-L293 HydrophobicContact CD2-CD2 4.29Å; L293-S295 VanDerWaalsContact C-N 3.32Å; L293-S295 PolarHBondContact O-N 3.22Å; L293-L296 HydrophobicContact CD2-CD1 4.01Å; L293-F301 HydrophobicContact CD2-CE1 4.48Å; L293-F301 WeakPolarHBondContact O-CZ 3.24Å
294	E	70.7	Confident	76.1	Confident	188 Å²	188	76.7 Å²	76.7	88%	0.879	43%	0.429	S	S	*	.	G	3₁₀ helix	trans	-73	-21.2	178.2	-63.6	168.2	-178	0	0	113.6	S292	S292-E294 PolarHBondContact O-N 2.98Å; S292-E294 VanDerWaalsContact O-N 3.1Å
295	S	73.8	Confident	74.1	Confident	72 Å²	72	80.4 Å²	80.4	50%	0.503	46%	0.459	S	S	.	.	G	3₁₀ helix	trans	-91.1	-1	-179.6	69.9	0	0	0	0	113.8	S292 L293	S292-S295 PolarHBondContact N-OG 3.36Å; S292-S295 PolarHBondContact O-N 3.21Å; S292-S295 PolarHBondContact O-OG 3.32Å; L293-S295 VanDerWaalsContact C-N 3.32Å; L293-S295 PolarHBondContact O-N 3.22Å
296	L	77.1	Confident	72.3	Confident	13 Å²	13	87.2 Å²	87.2	7%	0.068	49%	0.488	C	S	.	.	S	Bend	trans	-85.6	147.9	179.6	-61.9	176.4	0	0	0	110.9	T288 K291 L293 P298 F301	T288-L296 HydrophobicContact CG2-CD1 3.5Å; T288-L296 HydrophobicContact CG2-CD2 4.02Å; T288-L296 HydrophobicContact CG2-CG 4.44Å; K291-L296 HydrophobicContact CB-CD2 4.1Å; K291-L296 HydrophobicContact CD-CD2 4.05Å; L293-L296 HydrophobicContact CD2-CD1 4.01Å; L296-P298 WeakPolarHBondContact O-CD 3.17Å; L296-F301 HydrophobicContact CB-CE2 3.88Å; L296-F301 HydrophobicContact CB-CZ 4.12Å; L296-F301 HydrophobicContact CD1-CZ 4.15Å
297	D	75	Confident	70.1	Confident	88 Å²	88	89.5 Å²	89.5	47%	0.471	51%	0.512	S	S	.	.			trans	-59.2	122.1	176.5	177.6	-1.7	0	0	0	110.3	S299 L300	D297-S299 PolarHBondContact O-N 3Å; D297-S299 VanDerWaalsContact OD1-CB 3.31Å; D297-S299 WeakPolarHBondContact OD1-CB 3.31Å; D297-S299 PolarHBondContact OD1-N 3.48Å; D297-S299 PolarHBondContact OD1-OG 3.06Å; D297-S299 PolarHBondContact OD2-OG 3.27Å; D297-L300 HydrophobicContact CB-CD1 4.12Å; D297-L300 HydrophobicContact CB-CG 4.18Å; D297-L300 WeakPolarHBondContact O-CB 3.5Å; D297-L300 PolarHBondContact O-N 3.18Å
298	P	76.4	Confident	67.8	Low	109 Å²	109	97.3 Å²	97.3	71%	0.708	54%	0.54	S	S	*	.	G	3₁₀ helix	trans	-50.5	-23.8	175	-29.1	36.5	0	0	0	114.6	L296 L300	L296-P298 WeakPolarHBondContact O-CD 3.17Å; P298-L300 VanDerWaalsContact C-N 3.28Å; P298-L300 PolarHBondContact O-N 3.29Å
299	S	76.8	Confident	65.9	Low	60 Å²	60	98.2 Å²	98.2	42%	0.42	55%	0.552	S	S	.	*	G	3₁₀ helix	trans	-68.6	-21.4	177.4	87.2	0	0	0	0	114.1	K273 D297	K273-S299 VanDerWaalsContact CE-O 3.24Å; K273-S299 WeakPolarHBondContact CE-O 3.46Å; K273-S299 PolarHBondContact NZ-O 3.47Å; D297-S299 PolarHBondContact O-N 3Å; D297-S299 VanDerWaalsContact OD1-CB 3.31Å; D297-S299 WeakPolarHBondContact OD1-CB 3.31Å; D297-S299 PolarHBondContact OD1-N 3.48Å; D297-S299 PolarHBondContact OD1-OG 3.06Å; D297-S299 PolarHBondContact OD2-OG 3.27Å
300	L	75.8	Confident	64.5	Low	47 Å²	47	97 Å²	97	25%	0.246	55%	0.552	C	S	.	*	G	3₁₀ helix	trans	-82.7	-21.4	-177.8	-64	174.3	0	0	0	113	L272 K273 R284 D297 P298	L272-L300 HydrophobicContact CD2-CB 3.99Å; K273-L300 PolarHBondContact N-O 3.09Å; R284-L300 HydrophobicContact CG-CD2 4.48Å; D297-L300 HydrophobicContact CB-CD1 4.12Å; D297-L300 HydrophobicContact CB-CG 4.18Å; D297-L300 WeakPolarHBondContact O-CB 3.5Å; D297-L300 PolarHBondContact O-N 3.18Å; P298-L300 VanDerWaalsContact C-N 3.28Å; P298-L300 PolarHBondContact O-N 3.29Å
301	F	80.3	Confident	63.4	Low	59 Å²	59	101.2 Å²	101.2	26%	0.259	55%	0.545	S	S	.	.	B	Isolated β-bridge	trans	-72.3	142.5	177.2	-69.1	-84.5	0	0	0	111.3	L272 K273 L293 L296 K303	L272-F301 HydrophobicContact CD2-CD1 4.19Å; L272-F301 HydrophobicContact CD2-CE1 4.2Å; L272-F301 HydrophobicContact CD2-CG 4.48Å; K273-F301 WeakPolarHBondContact CE-O 3.46Å; L293-F301 HydrophobicContact CD2-CE1 4.48Å; L293-F301 WeakPolarHBondContact O-CZ 3.24Å; L296-F301 HydrophobicContact CB-CE2 3.88Å; L296-F301 HydrophobicContact CB-CZ 4.12Å; L296-F301 HydrophobicContact CD1-CZ 4.15Å; F301-K303 PolarHBondContact O-N 3.4Å
302	A	75.8	Confident	62.5	Low	47 Å²	47	103.2 Å²	103.2	39%	0.388	55%	0.554	S	S	.	*			trans	-64.9	127.3	172.3	0	0	0	0	0	108.4	G271 K273 N304	G271-A302 PolarHBondContact O-N 3.25Å; K273-A302 HydrophobicContact CG-CB 4.46Å; A302-N304 PolarHBondContact O-N 2.85Å
303	K	61.3	Low	62.3	Low	195 Å²	195	103.3 Å²	103.3	85%	0.848	55%	0.549	S	S	*	.			trans	-62.6	110.3	170.5	-73.7	-172.4	178.6	-179.3	0	107.1	F301 P305	F301-K303 PolarHBondContact O-N 3.4Å; K303-P305 WeakPolarHBondContact O-CD 3.35Å
304	N	50	Low	62.7	Low	123 Å²	123	103 Å²	103	66%	0.658	55%	0.551	S	S	*	*			trans	-60.5	123.7	168.6	-98.4	-13.8	0	0	0	107.7	A302 K306	A302-N304 PolarHBondContact O-N 2.85Å; N304-K306 PolarHBondContact O-N 3.33Å
305	P	45.7	Very low	63.3	Low	122 Å²	122	100 Å²	100	79%	0.792	54%	0.537	S	S	*	.	G	3₁₀ helix	trans	-59	-11	172.1	-17.5	28.7	0	0	0	112.6	K303 S307	K303-P305 WeakPolarHBondContact O-CD 3.35Å; P305-S307 PolarHBondContact O-N 3.11Å
306	K	46.9	Very low	63.8	Low	143 Å²	143	101.4 Å²	101.4	62%	0.622	53%	0.531	S	S	*	.	G	3₁₀ helix	trans	-86.6	12.8	-171.6	-64.7	-159.7	177.1	-170.8	0	116	N304 P310	N304-K306 PolarHBondContact O-N 3.33Å; K306-P310 HydrophobicContact CB-CG 4.12Å; K306-P310 WeakPolarHBondContact O-CD 3.38Å; K306-P310 WeakPolarHBondContact O-CG 3.48Å
307	S	40	Very low	64.2	Low	106 Å²	106	101.9 Å²	101.9	74%	0.741	53%	0.534	S	S	*	.	G	3₁₀ helix	trans	-95.1	-13.2	-178.2	81.1	0	0	0	0	116.5	P305	P305-S307 PolarHBondContact O-N 3.11Å
308	K	37.4	Very low	64.9	Low	209 Å²	209	101.6 Å²	101.6	91%	0.909	53%	0.528	S	S	*	.	S	Bend	trans	-125.2	-10.4	178.3	-75	-169.5	175.8	-175	0	116.4
309	G	43.8	Very low	65.6	Low	33 Å²	33	100.5 Å²	100.5	34%	0.34	51%	0.514	S	S	.	.	S	Bend	trans	-107.5	-35.1	-177.8	0	0	0	0	0	118.1	K311 K312 D313	G309-K311 PolarHBondContact O-N 3.45Å; G309-K312 PolarHBondContact O-N 3.35Å; G309-D313 PolarHBondContact O-N 3.38Å
310	P	51.7	Low	66.3	Low	49 Å²	49	97.7 Å²	97.7	32%	0.318	49%	0.494	S	S	.	.	H	α-helix	trans	-76.5	-27.4	-160.8	27.8	-33.8	0	0	0	114.4	K306 D313 T314	K306-P310 HydrophobicContact CB-CG 4.12Å; K306-P310 WeakPolarHBondContact O-CD 3.38Å; K306-P310 WeakPolarHBondContact O-CG 3.48Å; P310-D313 PolarHBondContact O-N 3.29Å; P310-T314 WeakPolarHBondContact O-CB 3.36Å; P310-T314 VanDerWaalsContact O-CG2 3.29Å; P310-T314 WeakPolarHBondContact O-CG2 3.46Å; P310-T314 PolarHBondContact O-N 3.45Å; P310-T314 PolarHBondContact O-OG1 3.34Å
311	K	53.1	Low	67.1	Low	177 Å²	177	95.4 Å²	95.4	77%	0.77	48%	0.482	S	S	*	.	H	α-helix	trans	-62.9	-43.8	177.8	-82.8	-169.5	173.8	-172.7	0	112	G309 T314 E315	G309-K311 PolarHBondContact O-N 3.45Å; K311-T314 WeakPolarHBondContact CA-OG1 3.27Å; K311-T314 PolarHBondContact O-N 3.45Å; K311-T314 PolarHBondContact O-OG1 3.18Å; K311-E315 VanDerWaalsContact O-CB 3.3Å; K311-E315 WeakPolarHBondContact O-CB 3.39Å; K311-E315 PolarHBondContact O-N 2.59Å
312	K	60.9	Low	67.7	Low	165 Å²	165	94 Å²	94	72%	0.717	48%	0.476	S	S	*	.	H	α-helix	trans	-69.3	-38	179.9	-169.9	175.6	-179.6	177.9	0	111.8	G309 R316	G309-K312 PolarHBondContact O-N 3.35Å; K312-R316 VanDerWaalsContact O-CB 3.27Å; K312-R316 WeakPolarHBondContact O-CB 3.46Å; K312-R316 PolarHBondContact O-N 3.06Å
313	D	68.4	Low	68.6	Low	73 Å²	73	92.9 Å²	92.9	39%	0.39	46%	0.463	S	S	.	.	H	α-helix	trans	-71.9	-36	176	-71.7	-34.8	0	0	0	112.2	G309 P310 R316 N317	G309-D313 PolarHBondContact O-N 3.38Å; P310-D313 PolarHBondContact O-N 3.29Å; D313-R316 IonicContact OD1-CZ 3.75Å; D313-R316 IonicContact OD1-NH1 2.78Å; D313-R316 PolarHBondContact OD1-NH1 3.42Å; D313-N317 WeakPolarHBondContact O-CB 3.2Å; D313-N317 PolarHBondContact O-N 3.3Å; D313-N317 PolarHBondContact O-ND2 3.02Å; D313-N317 VanDerWaalsContact O-ND2 3.17Å; D313-N317 PolarHBondContact O-OD1 3.15Å
314	T	76.8	Confident	70.1	Confident	84 Å²	84	83.6 Å²	83.6	52%	0.515	42%	0.423	S	S	.	.	H	α-helix	trans	-67.3	-37.4	173.7	48.8	0	0	0	0	112.4	P310 K311 K318	P310-T314 WeakPolarHBondContact O-CB 3.36Å; P310-T314 VanDerWaalsContact O-CG2 3.29Å; P310-T314 WeakPolarHBondContact O-CG2 3.46Å; P310-T314 PolarHBondContact O-N 3.45Å; P310-T314 PolarHBondContact O-OG1 3.34Å; K311-T314 WeakPolarHBondContact CA-OG1 3.27Å; K311-T314 PolarHBondContact O-N 3.45Å; K311-T314 PolarHBondContact O-OG1 3.18Å; T314-K318 WeakPolarHBondContact O-CB 3.46Å; T314-K318 PolarHBondContact O-N 2.97Å
315	E	82.5	Confident	72.2	Confident	125 Å²	125	78.1 Å²	78.1	58%	0.584	39%	0.394	S	S	*	.	H	α-helix	trans	-70.6	-46.4	177.5	-168.3	161.2	-152.9	0	0	110.8	K311 N317 K318 E319	K311-E315 VanDerWaalsContact O-CB 3.3Å; K311-E315 WeakPolarHBondContact O-CB 3.39Å; K311-E315 PolarHBondContact O-N 2.59Å; E315-N317 VanDerWaalsContact C-N 3.29Å; E315-N317 PolarHBondContact O-N 3.34Å; E315-K318 WeakPolarHBondContact O-CB 3.35Å; E315-K318 PolarHBondContact O-N 3.03Å; E315-K318 VanDerWaalsContact O-N 3.1Å; E315-E319 WeakPolarHBondContact O-CG 3.37Å; E315-E319 PolarHBondContact O-N 3.23Å
316	R	84	Confident	74.6	Confident	102 Å²	102	72.7 Å²	72.7	39%	0.385	36%	0.358	S	S	.	.	H	α-helix	trans	-56.3	-43	172	-170.1	-172.2	86	-161	9.6	112.4	K312 D313 E319 I320	K312-R316 VanDerWaalsContact O-CB 3.27Å; K312-R316 WeakPolarHBondContact O-CB 3.46Å; K312-R316 PolarHBondContact O-N 3.06Å; D313-R316 IonicContact OD1-CZ 3.75Å; D313-R316 IonicContact OD1-NH1 2.78Å; D313-R316 PolarHBondContact OD1-NH1 3.42Å; R316-E319 WeakPolarHBondContact O-CB 3.35Å; R316-E319 PolarHBondContact O-N 3.36Å; R316-I320 HydrophobicContact CG-CD1 4.41Å; R316-I320 WeakPolarHBondContact O-CG1 3.49Å; R316-I320 PolarHBondContact O-N 2.88Å
317	N	86.3	Confident	76.9	Confident	23 Å²	23	65.9 Å²	65.9	12%	0.123	33%	0.329	C	S	.	.	H	α-helix	trans	-68	-37.5	178.5	-72.9	-11.4	0	0	0	111.7	W229 D313 E315 I320 A321	W229-N317 HydrophobicContact CE3-CB 4.12Å; W229-N317 HydrophobicContact CH2-CB 3.64Å; W229-N317 HydrophobicContact CZ3-CB 3.37Å; D313-N317 WeakPolarHBondContact O-CB 3.2Å; D313-N317 PolarHBondContact O-N 3.3Å; D313-N317 PolarHBondContact O-ND2 3.02Å; D313-N317 VanDerWaalsContact O-ND2 3.17Å; D313-N317 PolarHBondContact O-OD1 3.15Å; E315-N317 VanDerWaalsContact C-N 3.29Å; E315-N317 PolarHBondContact O-N 3.34Å; N317-I320 PolarHBondContact O-N 3.39Å; N317-A321 VanDerWaalsContact O-CB 3.31Å; N317-A321 WeakPolarHBondContact O-CB 3.44Å; N317-A321 PolarHBondContact O-N 3.31Å
318	K	89.3	Confident	79.4	Confident	83 Å²	83	62.9 Å²	62.9	36%	0.361	30%	0.301	S	S	.	.	H	α-helix	trans	-63.6	-41.7	174	-170.8	-178.6	-179.5	-171.1	0	111.1	F217 W221 T314 E315 A321 F322	F217-K318 HydrophobicContact CE1-CG 4.04Å; F217-K318 HydrophobicContact CZ-CG 4.06Å; W221-K318 HydrophobicContact CD2-CG 4.35Å; W221-K318 HydrophobicContact CH2-CB 4.41Å; W221-K318 HydrophobicContact CZ2-CB 3.83Å; W221-K318 HydrophobicContact CZ2-CG 4.06Å; T314-K318 WeakPolarHBondContact O-CB 3.46Å; T314-K318 PolarHBondContact O-N 2.97Å; E315-K318 WeakPolarHBondContact O-CB 3.35Å; E315-K318 PolarHBondContact O-N 3.03Å; E315-K318 VanDerWaalsContact O-N 3.1Å; K318-A321 PolarHBondContact O-N 3.44Å; K318-F322 WeakPolarHBondContact O-CB 3.21Å; K318-F322 PolarHBondContact O-N 3.35Å
319	E	91.3	Very high	82.1	Confident	86 Å²	86	55.2 Å²	55.2	40%	0.402	27%	0.269	S	S	.	.	H	α-helix	trans	-59.7	-48.3	174.6	-70.8	171.2	-165.7	0	0	111.8	K183 E315 R316 F322 L323	K183-E319 IonicContact NZ-OE2 2.98Å; K183-E319 PolarHBondContact NZ-OE2 3.43Å; E315-E319 WeakPolarHBondContact O-CG 3.37Å; E315-E319 PolarHBondContact O-N 3.23Å; R316-E319 WeakPolarHBondContact O-CB 3.35Å; R316-E319 PolarHBondContact O-N 3.36Å; E319-F322 PolarHBondContact O-N 3.41Å; E319-L323 WeakPolarHBondContact O-CG 3.28Å; E319-L323 PolarHBondContact O-N 3.27Å
320	I	91.5	Very high	84.5	Confident	0 Å²	0	53.8 Å²	53.8	0%	0	25%	0.253	C	S	.	.	H	α-helix	trans	-63.1	-45	178.3	-64.5	170	0	0	0	110.5	K178 Y182 K183 L186 W229 R316 N317 F322 L323 E324	K178-I320 HydrophobicContact CD-CG2 4.4Å; Y182-I320 HydrophobicContact CD1-CG2 4.25Å; Y182-I320 HydrophobicContact CE1-CG2 3.98Å; K183-I320 HydrophobicContact CB-CD1 4.36Å; K183-I320 HydrophobicContact CB-CG1 4.17Å; K183-I320 HydrophobicContact CD-CG1 4.18Å; K183-I320 HydrophobicContact CG-CG1 4.05Å; L186-I320 HydrophobicContact CD1-CG2 3.91Å; W229-I320 HydrophobicContact CH2-CB 4.46Å; W229-I320 HydrophobicContact CZ2-CB 3.94Å; W229-I320 HydrophobicContact CZ2-CG2 3.75Å; R316-I320 HydrophobicContact CG-CD1 4.41Å; R316-I320 WeakPolarHBondContact O-CG1 3.49Å; R316-I320 PolarHBondContact O-N 2.88Å; N317-I320 PolarHBondContact O-N 3.39Å; I320-F322 PolarHBondContact O-N 2.85Å; I320-L323 WeakPolarHBondContact O-CB 3.46Å; I320-L323 PolarHBondContact O-N 3.49Å; I320-E324 WeakPolarHBondContact O-CG 3.4Å; I320-E324 PolarHBondContact O-N 3.11Å
321	A	91.7	Very high	86.5	Confident	0 Å²	0	51.6 Å²	51.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-59.8	-36.2	177	0	0	0	0	0	112.3	F217 W221 F226 W229 N317 K318 E324 S325	F217-A321 HydrophobicContact CE2-CB 3.83Å; F217-A321 HydrophobicContact CZ-CB 3.98Å; W221-A321 HydrophobicContact CE3-CB 4.07Å; W221-A321 HydrophobicContact CH2-CB 4.15Å; W221-A321 HydrophobicContact CZ3-CB 3.49Å; W221-A321 VanDerWaalsContact CZ3-CB 3.49Å; F226-A321 HydrophobicContact CD1-CB 4.06Å; F226-A321 HydrophobicContact CE1-CB 3.84Å; F226-A321 WeakPolarHBondContact CE1-O 3.45Å; F226-A321 WeakPolarHBondContact CZ-O 3.22Å; W229-A321 HydrophobicContact CD2-CB 4.17Å; W229-A321 HydrophobicContact CG-CB 4.05Å; W229-A321 HydrophobicContact CZ2-CB 4.46Å; N317-A321 VanDerWaalsContact O-CB 3.31Å; N317-A321 WeakPolarHBondContact O-CB 3.44Å; N317-A321 PolarHBondContact O-N 3.31Å; K318-A321 PolarHBondContact O-N 3.44Å; A321-E324 PolarHBondContact O-N 3.12Å; A321-S325 PolarHBondContact O-N 3.31Å
322	F	93.8	Very high	88.4	Confident	30 Å²	30	50.2 Å²	50.2	13%	0.132	24%	0.235	C	C	.	.	H	α-helix	trans	-71.7	-34.4	176.6	-176.8	-119.6	0	0	0	113	Y210 I213 L214 F217 K318 E319 I320 S325 Q326	Y210-F322 HydrophobicContact CD2-CZ 4.5Å; Y210-F322 AromaticContact CE2-CE1 3.88Å; Y210-F322 HydrophobicContact CE2-CE1 3.88Å; Y210-F322 AromaticContact CE2-CZ 3.66Å; Y210-F322 HydrophobicContact CE2-CZ 3.66Å; Y210-F322 AromaticContact CZ-CE1 3.96Å; Y210-F322 AromaticContact CZ-CZ 3.74Å; Y210-F322 WeakPolarHBondContact OH-CE1 3.31Å; I213-F322 HydrophobicContact CG2-CE2 4.27Å; L214-F322 HydrophobicContact CB-CE2 4.27Å; L214-F322 HydrophobicContact CB-CZ 4.4Å; L214-F322 HydrophobicContact CD1-CE2 3.86Å; L214-F322 HydrophobicContact CD1-CZ 4.03Å; F217-F322 HydrophobicContact CB-CD2 4.13Å; F217-F322 HydrophobicContact CB-CE2 4.43Å; F217-F322 HydrophobicContact CD1-CB 4.28Å; F217-F322 AromaticContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CE2 4.36Å; F217-F322 HydrophobicContact CD1-CG 4.28Å; F217-F322 HydrophobicContact CD2-CD2 4.35Å; F217-F322 HydrophobicContact CE1-CB 3.84Å; F217-F322 HydrophobicContact CE1-CD2 4.01Å; F217-F322 HydrophobicContact CE1-CG 4.28Å; F217-F322 HydrophobicContact CE2-CB 4.32Å; F217-F322 AromaticContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CG-CE2 4.49Å; F217-F322 HydrophobicContact CZ-CB 3.87Å; K318-F322 WeakPolarHBondContact O-CB 3.21Å; K318-F322 PolarHBondContact O-N 3.35Å; E319-F322 PolarHBondContact O-N 3.41Å; I320-F322 PolarHBondContact O-N 2.85Å; F322-S325 WeakPolarHBondContact CA-OG 3.33Å; F322-S325 WeakPolarHBondContact CD2-OG 3.47Å; F322-S325 PolarHBondContact O-N 2.92Å; F322-S325 PolarHBondContact O-OG 3Å; F322-Q326 HydrophobicContact CE2-CG 4.36Å; F322-Q326 HydrophobicContact CZ-CG 4.24Å; F322-Q326 WeakPolarHBondContact O-CG 3.48Å; F322-Q326 PolarHBondContact O-N 2.89Å; F322-Q326 VanDerWaalsContact O-N 3.14Å; F322-Q326 PolarHBondContact O-NE2 2.99Å; F322-Q326 VanDerWaalsContact O-NE2 3.13Å
323	L	94.6	Very high	90	Very high	22 Å²	22	44.3 Å²	44.3	12%	0.115	21%	0.211	C	C	.	.	H	α-helix	trans	-63.7	-44.7	170.1	-67.9	170.9	0	0	0	110.8	K183 L186 E187 L190 E319 I320 S325 Q326 I327	K183-L323 HydrophobicContact CG-CD1 3.92Å; L186-L323 HydrophobicContact CB-CB 4.4Å; L186-L323 HydrophobicContact CB-CD1 4.47Å; L186-L323 HydrophobicContact CD1-CB 4.38Å; E187-L323 HydrophobicContact CG-CD1 3.81Å; E187-L323 HydrophobicContact CG-CD2 4.41Å; L190-L323 HydrophobicContact CD2-CD2 3.57Å; E319-L323 WeakPolarHBondContact O-CG 3.28Å; E319-L323 PolarHBondContact O-N 3.27Å; I320-L323 WeakPolarHBondContact O-CB 3.46Å; I320-L323 PolarHBondContact O-N 3.49Å; L323-S325 VanDerWaalsContact C-N 3.32Å; L323-S325 PolarHBondContact O-N 3.41Å; L323-Q326 PolarHBondContact O-N 2.95Å; L323-I327 WeakPolarHBondContact O-CG1 3.5Å; L323-I327 PolarHBondContact O-N 3.43Å
324	E	93.5	Very high	91.3	Very high	0 Å²	0	41 Å²	41	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-60.6	-41.1	176.1	-67.6	177.9	166.5	0	0	111.7	L170 K178 Y182 L186 F226 W229 I320 A321 Q326 I327 Y328	L170-E324 HydrophobicContact CB-CG 4.24Å; L170-E324 HydrophobicContact CD1-CB 4.22Å; L170-E324 HydrophobicContact CD1-CG 3.97Å; K178-E324 WeakPolarHBondContact CD-OE1 3.28Å; K178-E324 WeakPolarHBondContact CE-OE1 3.25Å; K178-E324 IonicContact NZ-OE1 2.79Å; K178-E324 PolarHBondContact NZ-OE1 2.98Å; K178-E324 IonicContact NZ-OE2 2.85Å; K178-E324 PolarHBondContact NZ-OE2 2.89Å; Y182-E324 WeakPolarHBondContact CE1-OE1 3.32Å; Y182-E324 PolarHBondContact OH-OE1 3.09Å; L186-E324 HydrophobicContact CD1-CG 3.69Å; F226-E324 HydrophobicContact CZ-CB 4.47Å; W229-E324 PolarHBondContact NE1-OE2 3.39Å; I320-E324 WeakPolarHBondContact O-CG 3.4Å; I320-E324 PolarHBondContact O-N 3.11Å; A321-E324 PolarHBondContact O-N 3.12Å; E324-Q326 VanDerWaalsContact C-N 3.32Å; E324-Q326 PolarHBondContact O-N 2.94Å; E324-I327 PolarHBondContact O-N 3.08Å; E324-Y328 HydrophobicContact CB-CE2 4.19Å; E324-Y328 WeakPolarHBondContact O-CD2 3.49Å; E324-Y328 VanDerWaalsContact O-CG 3.26Å; E324-Y328 PolarHBondContact O-N 2.78Å
325	S	93.8	Very high	92.2	Very high	8 Å²	8	38.1 Å²	38.1	6%	0.056	18%	0.18	C	C	.	.	H	α-helix	trans	-62.4	-39.9	177.1	67	0	0	0	0	112.6	A321 F322 L323 E329	A321-S325 PolarHBondContact O-N 3.31Å; F322-S325 WeakPolarHBondContact CA-OG 3.33Å; F322-S325 WeakPolarHBondContact CD2-OG 3.47Å; F322-S325 PolarHBondContact O-N 2.92Å; F322-S325 PolarHBondContact O-OG 3Å; L323-S325 VanDerWaalsContact C-N 3.32Å; L323-S325 PolarHBondContact O-N 3.41Å; S325-E329 VanDerWaalsContact O-CG 3.23Å; S325-E329 WeakPolarHBondContact O-CG 3.44Å; S325-E329 PolarHBondContact O-N 3.43Å
326	Q	94.6	Very high	92.7	Very high	9 Å²	9	38.5 Å²	38.5	4%	0.042	18%	0.182	C	C	.	.	H	α-helix	trans	-65.2	-45.4	176.7	-72.1	171.1	89.6	0	0	110.8	L190 I213 F322 L323 E324 Y328 E329 Y330	L190-Q326 HydrophobicContact CD1-CB 3.63Å; L190-Q326 HydrophobicContact CD2-CB 3.96Å; L190-Q326 HydrophobicContact CG-CB 4.48Å; I213-Q326 HydrophobicContact CG2-CG 3.89Å; F322-Q326 HydrophobicContact CE2-CG 4.36Å; F322-Q326 HydrophobicContact CZ-CG 4.24Å; F322-Q326 WeakPolarHBondContact O-CG 3.48Å; F322-Q326 PolarHBondContact O-N 2.89Å; F322-Q326 VanDerWaalsContact O-N 3.14Å; F322-Q326 PolarHBondContact O-NE2 2.99Å; F322-Q326 VanDerWaalsContact O-NE2 3.13Å; L323-Q326 PolarHBondContact O-N 2.95Å; E324-Q326 VanDerWaalsContact C-N 3.32Å; E324-Q326 PolarHBondContact O-N 2.94Å; Q326-Y328 VanDerWaalsContact C-N 3.33Å; Q326-Y328 PolarHBondContact O-N 3.17Å; Q326-E329 PolarHBondContact O-N 3.36Å; Q326-Y330 HydrophobicContact CB-CD2 4.35Å; Q326-Y330 HydrophobicContact CB-CE2 4.25Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.46Å; Q326-Y330 PolarHBondContact O-N 2.76Å
327	I	95.1	Very high	93.1	Very high	0 Å²	0	34.5 Å²	34.5	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-59.3	-43.6	179.3	-68.2	163.3	0	0	0	111.3	L170 L186 L189 L190 L193 L323 E324 E329 Y330 V331	L170-I327 HydrophobicContact CD1-CB 4.1Å; L170-I327 HydrophobicContact CD1-CD1 4.02Å; L170-I327 HydrophobicContact CD1-CG2 3.89Å; L186-I327 HydrophobicContact CB-CD1 4.04Å; L186-I327 HydrophobicContact CD2-CD1 3.54Å; L186-I327 HydrophobicContact CG-CD1 4.31Å; L189-I327 HydrophobicContact CD2-CD1 4.2Å; L189-I327 HydrophobicContact CD2-CG2 4.21Å; L189-I327 HydrophobicContact CG-CD1 4.47Å; L190-I327 HydrophobicContact CB-CD1 4.25Å; L190-I327 HydrophobicContact CB-CG1 3.92Å; L190-I327 HydrophobicContact CD1-CG1 3.96Å; L190-I327 HydrophobicContact CG-CG1 4.46Å; L193-I327 HydrophobicContact CD1-CG2 4.02Å; L323-I327 WeakPolarHBondContact O-CG1 3.5Å; L323-I327 PolarHBondContact O-N 3.43Å; E324-I327 PolarHBondContact O-N 3.08Å; I327-E329 VanDerWaalsContact C-N 3.28Å; I327-E329 PolarHBondContact O-N 3.37Å; I327-Y330 PolarHBondContact O-N 2.91Å; I327-V331 HydrophobicContact CG2-CG2 4.01Å; I327-V331 VanDerWaalsContact O-CB 3.32Å; I327-V331 WeakPolarHBondContact O-CB 3.1Å; I327-V331 WeakPolarHBondContact O-CG2 3.43Å; I327-V331 PolarHBondContact O-N 3.19Å
328	Y	93.8	Very high	93.5	Very high	43 Å²	43	36.8 Å²	36.8	17%	0.169	18%	0.175	C	C	.	.	H	α-helix	trans	-57.1	-43.3	177.7	-61.8	-39.3	0	0	0	112.4	D168 L170 F171 F226 E324 Q326 V331 E332	D168-Y328 WeakPolarHBondContact O-CD1 3.48Å; D168-Y328 WeakPolarHBondContact O-CE1 3.23Å; L170-Y328 HydrophobicContact CB-CE1 3.81Å; L170-Y328 WeakPolarHBondContact CB-OH 3.28Å; L170-Y328 HydrophobicContact CD1-CE1 4.15Å; L170-Y328 HydrophobicContact CG-CE1 4.09Å; F171-Y328 HydrophobicContact CD1-CE1 4.26Å; F171-Y328 PolarHBondContact N-OH 2.91Å; F226-Y328 HydrophobicContact CZ-CD2 4.5Å; F226-Y328 HydrophobicContact CZ-CE2 4.08Å; E324-Y328 HydrophobicContact CB-CE2 4.19Å; E324-Y328 WeakPolarHBondContact O-CD2 3.49Å; E324-Y328 VanDerWaalsContact O-CG 3.26Å; E324-Y328 PolarHBondContact O-N 2.78Å; Q326-Y328 VanDerWaalsContact C-N 3.33Å; Q326-Y328 PolarHBondContact O-N 3.17Å; Y328-V331 PolarHBondContact O-N 2.92Å; Y328-E332 WeakPolarHBondContact O-CB 3.46Å; Y328-E332 PolarHBondContact O-N 2.88Å
329	E	93.7	Very high	93.7	Very high	48 Å²	48	37.2 Å²	37.2	22%	0.224	18%	0.178	C	C	.	.	H	α-helix	trans	-71.5	-43.2	-177.3	-62.4	-79.1	167.7	0	0	111.3	I213 S325 Q326 I327 V331 E332 I333	I213-E329 HydrophobicContact CD1-CB 3.74Å; I213-E329 HydrophobicContact CD1-CG 4.14Å; I213-E329 HydrophobicContact CG1-CB 4.02Å; I213-E329 HydrophobicContact CG1-CG 3.9Å; I213-E329 HydrophobicContact CG2-CG 4.43Å; S325-E329 VanDerWaalsContact O-CG 3.23Å; S325-E329 WeakPolarHBondContact O-CG 3.44Å; S325-E329 PolarHBondContact O-N 3.43Å; Q326-E329 PolarHBondContact O-N 3.36Å; I327-E329 VanDerWaalsContact C-N 3.28Å; I327-E329 PolarHBondContact O-N 3.37Å; E329-V331 VanDerWaalsContact C-N 3.35Å; E329-V331 PolarHBondContact O-N 3.42Å; E329-E332 PolarHBondContact O-N 3.26Å; E329-I333 VanDerWaalsContact O-CG1 3.31Å; E329-I333 WeakPolarHBondContact O-CG1 3.39Å; E329-I333 PolarHBondContact O-N 3.48Å
330	Y	94.6	Very high	93.8	Very high	2 Å²	2	35.4 Å²	35.4	1%	0.008	17%	0.171	C	C	.	.	H	α-helix	trans	-64.8	-39	174.5	-75.1	-69.4	0	0	0	112.2	L190 Q194 T197 Q206 L209 Q326 I327 E332 I333 L334	L190-Y330 HydrophobicContact CD1-CD2 3.56Å; L190-Y330 HydrophobicContact CD1-CE2 3.78Å; Q194-Y330 HydrophobicContact CG-CD2 4.08Å; Q194-Y330 HydrophobicContact CG-CE1 4.03Å; Q194-Y330 HydrophobicContact CG-CE2 3.49Å; Q194-Y330 VanDerWaalsContact CG-CE2 3.49Å; Q194-Y330 VanDerWaalsContact CG-CZ 3.45Å; Q194-Y330 PolarHBondContact NE2-OH 3.21Å; T197-Y330 HydrophobicContact CG2-CD1 4.25Å; T197-Y330 HydrophobicContact CG2-CE1 4.39Å; Q206-Y330 PolarHBondContact OE1-OH 3.34Å; L209-Y330 HydrophobicContact CD2-CD1 4.31Å; L209-Y330 HydrophobicContact CD2-CE1 3.67Å; Q326-Y330 HydrophobicContact CB-CD2 4.35Å; Q326-Y330 HydrophobicContact CB-CE2 4.25Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.46Å; Q326-Y330 PolarHBondContact O-N 2.76Å; I327-Y330 PolarHBondContact O-N 2.91Å; Y330-E332 VanDerWaalsContact C-N 3.33Å; Y330-I333 PolarHBondContact O-N 2.92Å; Y330-L334 WeakPolarHBondContact O-CB 3.39Å; Y330-L334 WeakPolarHBondContact O-CG 3.34Å; Y330-L334 PolarHBondContact O-N 3.49Å
331	V	93.8	Very high	93.9	Very high	4 Å²	4	35.7 Å²	35.7	2%	0.024	17%	0.172	C	C	.	.	H	α-helix	trans	-66.9	-35.9	175.9	171.3	0	0	0	0	111.5	F167 D168 L193 I327 Y328 E329 L334 G335	F167-V331 HydrophobicContact CE2-CG2 3.67Å; F167-V331 HydrophobicContact CZ-CG1 4.38Å; F167-V331 HydrophobicContact CZ-CG2 4.17Å; D168-V331 HydrophobicContact CB-CB 4.39Å; D168-V331 HydrophobicContact CB-CG1 3.72Å; D168-V331 HydrophobicContact CB-CG2 4.36Å; L193-V331 HydrophobicContact CD1-CG2 3.84Å; I327-V331 HydrophobicContact CG2-CG2 4.01Å; I327-V331 VanDerWaalsContact O-CB 3.32Å; I327-V331 WeakPolarHBondContact O-CB 3.1Å; I327-V331 WeakPolarHBondContact O-CG2 3.43Å; I327-V331 PolarHBondContact O-N 3.19Å; Y328-V331 PolarHBondContact O-N 2.92Å; E329-V331 VanDerWaalsContact C-N 3.35Å; E329-V331 PolarHBondContact O-N 3.42Å; V331-L334 CarbonylContact O-C 3.59Å; V331-L334 PolarHBondContact O-N 3.42Å; V331-G335 WeakPolarHBondContact O-CA 3.45Å; V331-G335 PolarHBondContact O-N 3.02Å
332	E	93.6	Very high	94	Very high	148 Å²	148	37 Å²	37	69%	0.692	18%	0.179	S	C	*	.	H	α-helix	trans	-63.5	-44.4	173.2	-174.6	171.2	172.6	0	0	111.1	Y328 E329 Y330 L334 G335	Y328-E332 WeakPolarHBondContact O-CB 3.46Å; Y328-E332 PolarHBondContact O-N 2.88Å; E329-E332 PolarHBondContact O-N 3.26Å; Y330-E332 VanDerWaalsContact C-N 3.33Å; E332-L334 VanDerWaalsContact C-N 3.27Å; E332-L334 PolarHBondContact O-N 3.36Å; E332-G335 PolarHBondContact O-N 3.08Å
333	I	94.6	Very high	93.9	Very high	41 Å²	41	39.6 Å²	39.6	21%	0.21	19%	0.191	C	C	.	.	H	α-helix	trans	-61.3	-35.7	175.2	-68.6	163.9	0	0	0	111.8	T197 K201 L204 L209 E329 Y330	T197-I333 HydrophobicContact CG2-CG2 4.22Å; K201-I333 HydrophobicContact CD-CG2 3.95Å; K201-I333 PolarHBondContact NZ-O 3.46Å; L204-I333 HydrophobicContact CD2-CD1 4.22Å; L204-I333 HydrophobicContact CD2-CG2 4.3Å; L209-I333 HydrophobicContact CD1-CD1 3.91Å; L209-I333 HydrophobicContact CD2-CD1 3.53Å; L209-I333 HydrophobicContact CG-CD1 4.39Å; E329-I333 VanDerWaalsContact O-CG1 3.31Å; E329-I333 WeakPolarHBondContact O-CG1 3.39Å; E329-I333 PolarHBondContact O-N 3.48Å; Y330-I333 PolarHBondContact O-N 2.92Å
334	L	95.4	Very high	93.8	Very high	2 Å²	2	38.9 Å²	38.9	1%	0.01	19%	0.187	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.6	19.2	-179.1	-63.6	173.6	0	0	0	113.1	L140 L193 Y196 T197 V200 Y330 V331 E332 E336 Q337 R338	L140-L334 HydrophobicContact CD2-CD1 4.19Å; L193-L334 HydrophobicContact CD2-CD1 3.87Å; Y196-L334 HydrophobicContact CD1-CD1 3.94Å; Y196-L334 HydrophobicContact CD1-CD2 3.84Å; Y196-L334 HydrophobicContact CE1-CD2 3.94Å; T197-L334 WeakPolarHBondContact OG1-CD1 3.34Å; V200-L334 HydrophobicContact CG2-CD2 3.73Å; Y330-L334 WeakPolarHBondContact O-CB 3.39Å; Y330-L334 WeakPolarHBondContact O-CG 3.34Å; Y330-L334 PolarHBondContact O-N 3.49Å; V331-L334 CarbonylContact O-C 3.59Å; V331-L334 PolarHBondContact O-N 3.42Å; E332-L334 VanDerWaalsContact C-N 3.27Å; E332-L334 PolarHBondContact O-N 3.36Å; L334-E336 VanDerWaalsContact C-N 3.25Å; L334-E336 PolarHBondContact O-N 2.9Å; L334-Q337 PolarHBondContact O-N 3.23Å; L334-R338 WeakPolarHBondContact O-CB 3.37Å; L334-R338 PolarHBondContact O-N 3.44Å
335	G	94	Very high	93.6	Very high	24 Å²	24	40 Å²	40	25%	0.247	19%	0.194	C	C	.	.	H	α-helix	trans	-59.7	-33.2	-174	0	0	0	0	0	114	V331 E332 Q339	V331-G335 WeakPolarHBondContact O-CA 3.45Å; V331-G335 PolarHBondContact O-N 3.02Å; E332-G335 PolarHBondContact O-N 3.08Å; G335-Q339 PolarHBondContact O-N 3.47Å; G335-Q339 VanDerWaalsContact O-N 3.13Å
336	E	93.1	Very high	93.5	Very high	134 Å²	134	43.8 Å²	43.8	63%	0.626	21%	0.211	S	C	*	.	H	α-helix	trans	-67.1	-53.3	175.4	-178.2	176.9	-170.5	0	0	111.3	L334 R338 Q339 L340	L334-E336 VanDerWaalsContact C-N 3.25Å; L334-E336 PolarHBondContact O-N 2.9Å; E336-R338 PolarHBondContact O-N 3.24Å; E336-Q339 PolarHBondContact O-N 3.36Å; E336-Q339 VanDerWaalsContact O-N 3.1Å; E336-L340 HydrophobicContact CG-CD1 4.07Å; E336-L340 WeakPolarHBondContact O-CG 3.24Å; E336-L340 PolarHBondContact O-N 2.83Å
337	Q	94.3	Very high	93.2	Very high	17 Å²	17	47.8 Å²	47.8	8%	0.079	23%	0.226	C	C	.	.	H	α-helix	trans	-58.7	-38.4	178	-69.6	74.7	13.4	0	0	111.1	G137 L140 Y196 L334 L340 T341	G137-Q337 WeakPolarHBondContact O-CG 3.3Å; L140-Q337 HydrophobicContact CD1-CB 4.26Å; L140-Q337 HydrophobicContact CG-CB 4.15Å; Y196-Q337 HydrophobicContact CE1-CG 4.21Å; L334-Q337 PolarHBondContact O-N 3.23Å; Q337-L340 PolarHBondContact O-N 2.88Å; Q337-T341 WeakPolarHBondContact O-CB 3.5Å; Q337-T341 PolarHBondContact O-N 2.75Å; Q337-T341 PolarHBondContact O-OG1 3.37Å
338	R	93.4	Very high	92.9	Very high	71 Å²	71	49.1 Å²	49.1	27%	0.268	23%	0.232	S	C	.	.	H	α-helix	trans	-59.5	-49.1	174.6	-174.3	-174.7	72.9	-178.3	12.9	112.1	L140 F167 D168 L334 E336 T341 H342	L140-R338 HydrophobicContact CD1-CB 4.23Å; F167-R338 HydrophobicContact CE1-CG 3.78Å; F167-R338 HydrophobicContact CZ-CG 3.94Å; D168-R338 VanDerWaalsContact CG-NH1 3.34Å; D168-R338 IonicContact OD2-CZ 3.65Å; D168-R338 IonicContact OD2-NH1 3.15Å; D168-R338 PolarHBondContact OD2-NH1 3.17Å; L334-R338 WeakPolarHBondContact O-CB 3.37Å; L334-R338 PolarHBondContact O-N 3.44Å; E336-R338 PolarHBondContact O-N 3.24Å; R338-T341 PolarHBondContact O-N 3.22Å; R338-H342 PolarHBondContact O-N 3.06Å
339	Q	92.9	Very high	92.6	Very high	93 Å²	93	54.1 Å²	54.1	44%	0.435	26%	0.256	S	S	.	.	H	α-helix	trans	-63.4	-45.2	179.3	-177.1	60.6	28	0	0	111.1	G335 E336 T341 H342 E343	G335-Q339 PolarHBondContact O-N 3.47Å; G335-Q339 VanDerWaalsContact O-N 3.13Å; E336-Q339 PolarHBondContact O-N 3.36Å; E336-Q339 VanDerWaalsContact O-N 3.1Å; Q339-T341 VanDerWaalsContact C-N 3.31Å; Q339-T341 PolarHBondContact O-N 2.96Å; Q339-H342 PolarHBondContact O-N 2.88Å; Q339-E343 PolarHBondContact NE2-OE1 2.98Å; Q339-E343 WeakPolarHBondContact O-CG 3.02Å; Q339-E343 PolarHBondContact O-N 3.14Å
340	L	94.1	Very high	92.2	Very high	48 Å²	48	56 Å²	56	25%	0.251	28%	0.28	S	S	.	.	H	α-helix	trans	-59.6	-41.7	176.9	-70.6	174.6	0	0	0	112.1	Y139 E336 Q337 E343 N344	Y139-L340 HydrophobicContact CD1-CB 4.03Å; Y139-L340 HydrophobicContact CE1-CB 3.96Å; Y139-L340 WeakPolarHBondContact CE1-O 3.44Å; E336-L340 HydrophobicContact CG-CD1 4.07Å; E336-L340 WeakPolarHBondContact O-CG 3.24Å; E336-L340 PolarHBondContact O-N 2.83Å; Q337-L340 PolarHBondContact O-N 2.88Å; L340-E343 PolarHBondContact O-N 2.62Å; L340-N344 VanDerWaalsContact O-CB 3.29Å; L340-N344 WeakPolarHBondContact O-CB 3.21Å; L340-N344 PolarHBondContact O-N 3.28Å
341	T	94.1	Very high	91.9	Very high	5 Å²	5	59.2 Å²	59.2	3%	0.031	29%	0.292	C	S	.	.	H	α-helix	trans	-63.3	-45.6	177.1	-55.2	0	0	0	0	111	Y139 L140 L164 Q337 R338 Q339 E343 N344 V345	Y139-T341 WeakPolarHBondContact CA-OG1 3.46Å; L140-T341 HydrophobicContact CB-CG2 4.41Å; L140-T341 PolarHBondContact N-OG1 3.01Å; L140-T341 VanDerWaalsContact O-CG2 3.28Å; L140-T341 WeakPolarHBondContact O-CG2 3.45Å; L164-T341 HydrophobicContact CD1-CG2 4.27Å; Q337-T341 WeakPolarHBondContact O-CB 3.5Å; Q337-T341 PolarHBondContact O-N 2.75Å; Q337-T341 PolarHBondContact O-OG1 3.37Å; R338-T341 PolarHBondContact O-N 3.22Å; Q339-T341 VanDerWaalsContact C-N 3.31Å; Q339-T341 PolarHBondContact O-N 2.96Å; T341-E343 PolarHBondContact O-N 3.43Å; T341-N344 PolarHBondContact O-N 3.09Å; T341-V345 VanDerWaalsContact O-CG2 3.3Å; T341-V345 WeakPolarHBondContact O-CG2 3.31Å; T341-V345 PolarHBondContact O-N 3.3Å
342	H	93.1	Very high	91.6	Very high	29 Å²	29	62.7 Å²	62.7	13%	0.134	31%	0.314	C	S	.	.	H	α-helix	trans	-62.1	-44.3	178.8	-177.2	-88.1	0	0	0	112	S165 R338 Q339 V345 Q346	S165-H342 PolarHBondContact OG-NE2 2.88Å; R338-H342 PolarHBondContact O-N 3.06Å; Q339-H342 PolarHBondContact O-N 2.88Å; H342-V345 PolarHBondContact O-N 2.87Å; H342-Q346 VanDerWaalsContact CE1-CD 3.49Å; H342-Q346 PolarHBondContact CE1-NE2 3.4Å; H342-Q346 WeakPolarHBondContact O-CB 3.5Å; H342-Q346 WeakPolarHBondContact O-CG 3.36Å; H342-Q346 PolarHBondContact O-N 3.28Å
343	E	92.2	Very high	91.2	Very high	84 Å²	84	57.7 Å²	57.7	39%	0.393	30%	0.301	S	S	.	.	H	α-helix	trans	-64.5	-40	175.3	-72	176	-168.2	0	0	112.3	Q339 L340 T341 Q346 R347	Q339-E343 PolarHBondContact NE2-OE1 2.98Å; Q339-E343 WeakPolarHBondContact O-CG 3.02Å; Q339-E343 PolarHBondContact O-N 3.14Å; L340-E343 PolarHBondContact O-N 2.62Å; T341-E343 PolarHBondContact O-N 3.43Å; E343-Q346 PolarHBondContact O-N 3.21Å; E343-R347 WeakPolarHBondContact O-CB 3.29Å; E343-R347 PolarHBondContact O-N 2.95Å
344	N	91.4	Very high	90.6	Very high	6 Å²	6	62.8 Å²	62.8	3%	0.032	33%	0.325	C	S	.	.	H	α-helix	trans	-61.8	-46.5	176.8	-168.8	51.3	0	0	0	111.6	Y139 L340 T341 R347 K348	Y139-N344 HydrophobicContact CD1-CB 4.04Å; Y139-N344 HydrophobicContact CE1-CB 3.68Å; Y139-N344 HydrophobicContact CE2-CB 4.48Å; L340-N344 VanDerWaalsContact O-CB 3.29Å; L340-N344 WeakPolarHBondContact O-CB 3.21Å; L340-N344 PolarHBondContact O-N 3.28Å; T341-N344 PolarHBondContact O-N 3.09Å; N344-R347 WeakPolarHBondContact O-CB 3.36Å; N344-R347 PolarHBondContact O-N 3.36Å; N344-R347 PolarHBondContact OD1-NH1 3.34Å; N344-K348 PolarHBondContact O-N 3.01Å
345	V	91.3	Very high	90.1	Very high	24 Å²	24	67.1 Å²	67.1	15%	0.145	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-41.8	177.8	170.9	0	0	0	0	111.2	Y160 L164 T341 H342 R347 K348 Q349	Y160-V345 HydrophobicContact CD1-CG1 3.82Å; Y160-V345 HydrophobicContact CD1-CG2 4.21Å; Y160-V345 HydrophobicContact CE1-CG1 4.2Å; Y160-V345 HydrophobicContact CE1-CG2 3.71Å; L164-V345 HydrophobicContact CD1-CB 4.09Å; L164-V345 HydrophobicContact CD1-CG1 4.25Å; L164-V345 HydrophobicContact CD1-CG2 3.76Å; T341-V345 VanDerWaalsContact O-CG2 3.3Å; T341-V345 WeakPolarHBondContact O-CG2 3.31Å; T341-V345 PolarHBondContact O-N 3.3Å; H342-V345 PolarHBondContact O-N 2.87Å; V345-R347 VanDerWaalsContact C-N 3.32Å; V345-R347 PolarHBondContact O-N 2.7Å; V345-K348 PolarHBondContact O-N 3.39Å; V345-Q349 VanDerWaalsContact O-CB 3.25Å; V345-Q349 WeakPolarHBondContact O-CB 3.42Å; V345-Q349 PolarHBondContact O-N 3.22Å
346	Q	90.8	Very high	89.6	Confident	88 Å²	88	69.6 Å²	69.6	41%	0.411	35%	0.347	S	S	.	.	H	α-helix	trans	-58.4	-43.9	173.1	-81.7	-177.4	-15.4	0	0	112.3	I161 H342 E343 Q349 A350	I161-Q346 HydrophobicContact CD1-CB 4.5Å; I161-Q346 HydrophobicContact CD1-CG 3.28Å; I161-Q346 HydrophobicContact CG1-CG 4.2Å; H342-Q346 VanDerWaalsContact CE1-CD 3.49Å; H342-Q346 PolarHBondContact CE1-NE2 3.4Å; H342-Q346 WeakPolarHBondContact O-CB 3.5Å; H342-Q346 WeakPolarHBondContact O-CG 3.36Å; H342-Q346 PolarHBondContact O-N 3.28Å; E343-Q346 PolarHBondContact O-N 3.21Å; Q346-Q349 PolarHBondContact O-N 2.83Å; Q346-A350 PolarHBondContact O-N 2.98Å; Q346-A350 VanDerWaalsContact O-N 3.14Å
347	R	89.2	Confident	89	Confident	93 Å²	93	69.3 Å²	69.3	35%	0.351	35%	0.345	S	S	.	.	H	α-helix	trans	-64.9	-51	178	-156.4	-167.3	-45.6	113.1	10.8	111.3	E343 N344 V345 Q349 A350 R351 E359	E343-R347 WeakPolarHBondContact O-CB 3.29Å; E343-R347 PolarHBondContact O-N 2.95Å; N344-R347 WeakPolarHBondContact O-CB 3.36Å; N344-R347 PolarHBondContact O-N 3.36Å; N344-R347 PolarHBondContact OD1-NH1 3.34Å; V345-R347 VanDerWaalsContact C-N 3.32Å; V345-R347 PolarHBondContact O-N 2.7Å; R347-Q349 PolarHBondContact O-N 3.22Å; R347-A350 PolarHBondContact O-N 2.83Å; R347-A350 VanDerWaalsContact O-N 3.16Å; R347-R351 WeakPolarHBondContact O-CG 3.39Å; R347-R351 PolarHBondContact O-N 2.9Å; R347-E359 IonicContact NH1-OE1 3.8Å; R347-E359 PolarHBondContact NH1-OE1 2.85Å
348	K	87.7	Confident	88.3	Confident	28 Å²	28	73.4 Å²	73.4	12%	0.122	37%	0.368	C	S	.	.	H	α-helix	trans	-58.6	-34	176.6	-82.6	-166	176	-170.6	0	112.1	E133 N344 V345 R356	E133-K348 IonicContact OE1-NZ 3.28Å; E133-K348 IonicContact OE2-NZ 3.72Å; N344-K348 PolarHBondContact O-N 3.01Å; V345-K348 PolarHBondContact O-N 3.39Å; K348-R356 PolarHBondContact O-NH2 3.21Å
349	Q	86.6	Confident	87.6	Confident	148 Å²	148	70.6 Å²	70.6	69%	0.692	36%	0.358	S	S	*	.	H	α-helix	trans	-73.5	-32.5	178.7	-170.8	64.5	38.8	0	0	113.2	V345 Q346 R347	V345-Q349 VanDerWaalsContact O-CB 3.25Å; V345-Q349 WeakPolarHBondContact O-CB 3.42Å; V345-Q349 PolarHBondContact O-N 3.22Å; Q346-Q349 PolarHBondContact O-N 2.83Å; R347-Q349 PolarHBondContact O-N 3.22Å
350	A	87.3	Confident	86.8	Confident	88 Å²	88	70.1 Å²	70.1	73%	0.727	36%	0.355	S	S	*	.	H	α-helix	trans	-79.5	-16.9	-179	0	0	0	0	0	113.8	Q346 R347	Q346-A350 PolarHBondContact O-N 2.98Å; Q346-A350 VanDerWaalsContact O-N 3.14Å; R347-A350 PolarHBondContact O-N 2.83Å; R347-A350 VanDerWaalsContact O-N 3.16Å
351	R	86.9	Confident	85.8	Confident	69 Å²	69	74.4 Å²	74.4	26%	0.26	37%	0.374	S	S	.	.	S	Bend	trans	-78.4	152	-175.8	-75.4	172.9	-175.7	-124.1	11.7	113.8	R347 E355 R356 E359	R347-R351 WeakPolarHBondContact O-CG 3.39Å; R347-R351 PolarHBondContact O-N 2.9Å; R351-E355 HydrophobicContact CB-CB 4.03Å; R351-E355 HydrophobicContact CG-CB 4.15Å; R351-E355 PolarHBondContact NH1-O 3.07Å; R351-R356 PolarHBondContact O-NH2 2.79Å; R351-E359 VanDerWaalsContact CD-OE2 3.25Å; R351-E359 WeakPolarHBondContact CD-OE2 3.01Å; R351-E359 IonicContact CZ-OE1 3.96Å; R351-E359 IonicContact CZ-OE2 3.37Å; R351-E359 IonicContact NE-OE1 3.97Å; R351-E359 IonicContact NE-OE2 3.88Å; R351-E359 PolarHBondContact NE-OE2 2.8Å; R351-E359 IonicContact NH1-OE2 2.62Å; R351-E359 PolarHBondContact NH1-OE2 2.78Å; R351-E359 IonicContact NH2-OE1 3.61Å; R351-E359 PolarHBondContact NH2-OE1 3.32Å; R351-E359 IonicContact NH2-OE2 2.7Å; R351-E359 PolarHBondContact NH2-OE2 3.02Å
352	T	87.9	Confident	84.6	Confident	77 Å²	77	79.9 Å²	79.9	47%	0.472	40%	0.399	S	S	.	.			trans	-71.6	-177	170.8	62.9	0	0	0	0	111.7	E355 R356	T352-E355 PolarHBondContact N-OE2 3.38Å; T352-E355 VanDerWaalsContact OG1-CG 3.28Å; T352-E355 WeakPolarHBondContact OG1-CG 2.96Å; T352-E355 PolarHBondContact OG1-OE2 3.27Å; T352-R356 PolarHBondContact O-N 2.8Å; T352-R356 PolarHBondContact O-NH1 2.63Å
353	G	85.8	Confident	83.3	Confident	42 Å²	42	80.6 Å²	80.6	43%	0.433	40%	0.403	S	S	.	.	S	Bend	trans	-65.1	-56.2	179.6	0	0	0	0	0	112.2	E355 R356 E357	G353-E355 PolarHBondContact O-N 3.16Å; G353-R356 WeakPolarHBondContact O-CB 3.22Å; G353-R356 PolarHBondContact O-N 2.72Å; G353-R356 VanDerWaalsContact O-N 3.16Å; G353-E357 PolarHBondContact O-N 2.81Å
354	E	82.1	Confident	81.7	Confident	149 Å²	149	81.4 Å²	81.4	70%	0.696	41%	0.409	S	S	*	.	H	α-helix	trans	-60.3	-45.5	-179.1	-65.5	174.2	172.8	0	0	111.6	R356 E357 D358	E354-R356 PolarHBondContact O-N 2.85Å; E354-R356 VanDerWaalsContact O-N 3.09Å; E354-E357 PolarHBondContact O-N 3.21Å; E354-E357 VanDerWaalsContact O-N 3.16Å; E354-D358 PolarHBondContact O-N 2.78Å
355	E	84.8	Confident	80	Confident	92 Å²	92	83.8 Å²	83.8	43%	0.43	43%	0.426	S	S	.	.	H	α-helix	trans	-64.1	-17.7	178.7	-68.2	168.3	158.2	0	0	114.7	R351 T352 G353	R351-E355 HydrophobicContact CB-CB 4.03Å; R351-E355 HydrophobicContact CG-CB 4.15Å; R351-E355 PolarHBondContact NH1-O 3.07Å; T352-E355 PolarHBondContact N-OE2 3.38Å; T352-E355 VanDerWaalsContact OG1-CG 3.28Å; T352-E355 WeakPolarHBondContact OG1-CG 2.96Å; T352-E355 PolarHBondContact OG1-OE2 3.27Å; G353-E355 PolarHBondContact O-N 3.16Å
356	R	82.4	Confident	78.1	Confident	77 Å²	77	87.4 Å²	87.4	29%	0.291	44%	0.442	S	S	.	.	H	α-helix	trans	-86.7	-41.2	175.5	-176.8	-175.5	-63.7	84.7	11.7	110.9	K348 R351 T352 G353 E354 D358 E359 E360	K348-R356 PolarHBondContact O-NH2 3.21Å; R351-R356 PolarHBondContact O-NH2 2.79Å; T352-R356 PolarHBondContact O-N 2.8Å; T352-R356 PolarHBondContact O-NH1 2.63Å; G353-R356 WeakPolarHBondContact O-CB 3.22Å; G353-R356 PolarHBondContact O-N 2.72Å; G353-R356 VanDerWaalsContact O-N 3.16Å; E354-R356 PolarHBondContact O-N 2.85Å; E354-R356 VanDerWaalsContact O-N 3.09Å; R356-D358 VanDerWaalsContact C-N 3.35Å; R356-E359 PolarHBondContact O-N 3.35Å; R356-E360 PolarHBondContact O-N 3.12Å
357	E	80.8	Confident	76.2	Confident	128 Å²	128	86.1 Å²	86.1	60%	0.598	44%	0.443	S	S	*	.	H	α-helix	trans	-62.1	-44.6	174.8	-68.2	174.4	-173	0	0	110.2	G353 E354 E359 E360 E361	G353-E357 PolarHBondContact O-N 2.81Å; E354-E357 PolarHBondContact O-N 3.21Å; E354-E357 VanDerWaalsContact O-N 3.16Å; E357-E359 VanDerWaalsContact C-N 3.35Å; E357-E359 PolarHBondContact O-N 3.42Å; E357-E360 PolarHBondContact O-N 3.35Å; E357-E361 PolarHBondContact O-N 3.22Å
358	D	80.3	Confident	74.1	Confident	103 Å²	103	89.6 Å²	89.6	55%	0.551	46%	0.463	S	S	*	.	H	α-helix	trans	-61.2	-38.4	176.7	-69.6	-17.9	0	0	0	112.6	E354 R356 E362	E354-D358 PolarHBondContact O-N 2.78Å; R356-D358 VanDerWaalsContact C-N 3.35Å; D358-E362 VanDerWaalsContact O-CB 3.3Å; D358-E362 WeakPolarHBondContact O-CB 3.46Å; D358-E362 PolarHBondContact O-N 2.88Å
359	E	78.3	Confident	71.8	Confident	12 Å²	12	92 Å²	92	6%	0.056	48%	0.483	C	S	.	.	H	α-helix	trans	-74.5	-32.7	178.3	-167.2	176.4	-150.9	0	0	112.4	R347 R351 R356 E357 E362 Q363	R347-E359 IonicContact NH1-OE1 3.8Å; R347-E359 PolarHBondContact NH1-OE1 2.85Å; R351-E359 VanDerWaalsContact CD-OE2 3.25Å; R351-E359 WeakPolarHBondContact CD-OE2 3.01Å; R351-E359 IonicContact CZ-OE1 3.96Å; R351-E359 IonicContact CZ-OE2 3.37Å; R351-E359 IonicContact NE-OE1 3.97Å; R351-E359 IonicContact NE-OE2 3.88Å; R351-E359 PolarHBondContact NE-OE2 2.8Å; R351-E359 IonicContact NH1-OE2 2.62Å; R351-E359 PolarHBondContact NH1-OE2 2.78Å; R351-E359 IonicContact NH2-OE1 3.61Å; R351-E359 PolarHBondContact NH2-OE1 3.32Å; R351-E359 IonicContact NH2-OE2 2.7Å; R351-E359 PolarHBondContact NH2-OE2 3.02Å; R356-E359 PolarHBondContact O-N 3.35Å; E357-E359 VanDerWaalsContact C-N 3.35Å; E357-E359 PolarHBondContact O-N 3.42Å; E359-E362 PolarHBondContact O-N 3.49Å; E359-Q363 WeakPolarHBondContact O-CB 3.38Å; E359-Q363 VanDerWaalsContact O-CG 3.28Å; E359-Q363 WeakPolarHBondContact O-CG 3.42Å; E359-Q363 PolarHBondContact O-N 3.01Å
360	E	75.4	Confident	69.8	Low	83 Å²	83	89.2 Å²	89.2	39%	0.388	47%	0.47	S	S	.	.	H	α-helix	trans	-66.2	-43.4	173	-77.9	174.5	-174.5	0	0	110.5	R356 E357 L364	R356-E360 PolarHBondContact O-N 3.12Å; E357-E360 PolarHBondContact O-N 3.35Å; E360-L364 WeakPolarHBondContact O-CB 3.23Å; E360-L364 WeakPolarHBondContact O-CD1 3.45Å; E360-L364 WeakPolarHBondContact O-CG 3.44Å; E360-L364 PolarHBondContact O-N 3.15Å
361	E	73.8	Confident	67.8	Low	138 Å²	138	90.3 Å²	90.3	65%	0.645	46%	0.464	S	S	*	.	H	α-helix	trans	-63.9	-40.9	172.6	-74.7	-168.8	174.1	0	0	112.2	E357 L364 S365	E357-E361 PolarHBondContact O-N 3.22Å; E361-L364 PolarHBondContact O-N 2.72Å; E361-S365 WeakPolarHBondContact O-CB 3.45Å; E361-S365 PolarHBondContact O-N 2.98Å; E361-S365 PolarHBondContact O-OG 3.46Å
362	E	68.9	Low	65.7	Low	120 Å²	120	95.6 Å²	95.6	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-65.3	-44.3	178	-165.8	171.9	-155.9	0	0	111.2	D358 E359 L364 S365 E366	D358-E362 VanDerWaalsContact O-CB 3.3Å; D358-E362 WeakPolarHBondContact O-CB 3.46Å; D358-E362 PolarHBondContact O-N 2.88Å; E359-E362 PolarHBondContact O-N 3.49Å; E362-L364 PolarHBondContact O-N 2.84Å; E362-S365 WeakPolarHBondContact CA-OG 3.4Å; E362-S365 PolarHBondContact O-N 2.73Å; E362-S365 VanDerWaalsContact O-N 3.15Å; E362-S365 PolarHBondContact O-OG 3.4Å; E362-E366 VanDerWaalsContact O-CB 3.32Å; E362-E366 WeakPolarHBondContact O-CB 3.2Å; E362-E366 PolarHBondContact O-N 3.06Å
363	Q	65.2	Low	63.6	Low	44 Å²	44	98.8 Å²	98.8	21%	0.206	51%	0.505	C	S	.	.	H	α-helix	trans	-61.7	-41.6	175.9	-79	178.5	-10.6	0	0	112.6	E359 S367	E359-Q363 WeakPolarHBondContact O-CB 3.38Å; E359-Q363 VanDerWaalsContact O-CG 3.28Å; E359-Q363 WeakPolarHBondContact O-CG 3.42Å; E359-Q363 PolarHBondContact O-N 3.01Å; Q363-S367 WeakPolarHBondContact O-CB 3.45Å; Q363-S367 PolarHBondContact O-N 3.4Å; Q363-S367 VanDerWaalsContact O-N 3.17Å
364	L	59.9	Low	61.5	Low	101 Å²	101	104.2 Å²	104.2	53%	0.529	52%	0.524	S	S	.	.	H	α-helix	trans	-62.4	-43.9	173	-82.5	154.5	0	0	0	110.8	E360 E361 E362 S367 E368	E360-L364 WeakPolarHBondContact O-CB 3.23Å; E360-L364 WeakPolarHBondContact O-CD1 3.45Å; E360-L364 WeakPolarHBondContact O-CG 3.44Å; E360-L364 PolarHBondContact O-N 3.15Å; E361-L364 PolarHBondContact O-N 2.72Å; E362-L364 PolarHBondContact O-N 2.84Å; L364-S367 PolarHBondContact O-N 3.49Å; L364-S367 PolarHBondContact O-OG 2.97Å; L364-E368 PolarHBondContact O-N 3.08Å
365	S	55.8	Low	59.8	Low	56 Å²	56	105.6 Å²	105.6	39%	0.392	53%	0.531	S	S	.	.	H	α-helix	trans	-70.2	-41.7	-179.9	73.6	0	0	0	0	113.5	E361 E362 S367 E368 S369	E361-S365 WeakPolarHBondContact O-CB 3.45Å; E361-S365 PolarHBondContact O-N 2.98Å; E361-S365 PolarHBondContact O-OG 3.46Å; E362-S365 WeakPolarHBondContact CA-OG 3.4Å; E362-S365 PolarHBondContact O-N 2.73Å; E362-S365 VanDerWaalsContact O-N 3.15Å; E362-S365 PolarHBondContact O-OG 3.4Å; S365-S367 PolarHBondContact O-N 3.12Å; S365-E368 CarbonylContact O-C 3.52Å; S365-E368 WeakPolarHBondContact O-CA 3.46Å; S365-E368 PolarHBondContact O-N 3.17Å; S365-S369 WeakPolarHBondContact O-CB 3.49Å; S365-S369 PolarHBondContact O-N 3.46Å; S365-S369 PolarHBondContact O-OG 2.89Å
366	E	51.5	Low	58.1	Low	99 Å²	99	109.1 Å²	109.1	46%	0.463	55%	0.551	S	S	.	*	H	α-helix	trans	-63.8	-32.6	178.6	-160.2	175.4	-153.2	0	0	110.2	E362 E368 E370	E362-E366 VanDerWaalsContact O-CB 3.32Å; E362-E366 WeakPolarHBondContact O-CB 3.2Å; E362-E366 PolarHBondContact O-N 3.06Å; E366-E368 VanDerWaalsContact C-N 3.26Å; E366-E368 PolarHBondContact O-N 3.39Å; E366-E370 HydrophobicContact CG-CG 3.88Å; E366-E370 WeakPolarHBondContact CG-OE1 3.22Å; E366-E370 WeakPolarHBondContact O-CG 3.22Å
367	S	50.4	Low	56.6	Low	62 Å²	62	109.3 Å²	109.3	43%	0.434	56%	0.557	S	S	.	*	H	α-helix	trans	-67	-22.5	171.5	82.4	0	0	0	0	114.2	R34 Q363 L364 S365	R34-S367 PolarHBondContact NH1-O 3.34Å; Q363-S367 WeakPolarHBondContact O-CB 3.45Å; Q363-S367 PolarHBondContact O-N 3.4Å; Q363-S367 VanDerWaalsContact O-N 3.17Å; L364-S367 PolarHBondContact O-N 3.49Å; L364-S367 PolarHBondContact O-OG 2.97Å; S365-S367 PolarHBondContact O-N 3.12Å
368	E	44.3	Very low	55.3	Low	166 Å²	166	112.6 Å²	112.6	78%	0.776	57%	0.565	S	S	*	*	H	α-helix	trans	-106.3	-16.8	179.9	-66.9	-155.2	163.7	0	0	114.4	L364 S365 E366	L364-E368 PolarHBondContact O-N 3.08Å; S365-E368 CarbonylContact O-C 3.52Å; S365-E368 WeakPolarHBondContact O-CA 3.46Å; S365-E368 PolarHBondContact O-N 3.17Å; E366-E368 VanDerWaalsContact C-N 3.26Å; E366-E368 PolarHBondContact O-N 3.39Å
369	S	39.8	Very low	54.6	Low	77 Å²	77	109.5 Å²	109.5	54%	0.538	55%	0.549	S	S	.	.	H	α-helix	trans	-132.5	20.8	-167.2	74.3	0	0	0	0	116.4	S365 D371	S365-S369 WeakPolarHBondContact O-CB 3.49Å; S365-S369 PolarHBondContact O-N 3.46Å; S365-S369 PolarHBondContact O-OG 2.89Å; S369-D371 PolarHBondContact O-N 3.25Å
370	E	43.7	Very low	53.9	Low	91 Å²	91	113.4 Å²	113.4	43%	0.425	58%	0.575	S	S	.	*	T	Hydrogen-bonded Turn	trans	-72.4	-3.8	172.8	-88.8	-173.8	179.4	0	0	114.1	E366	E366-E370 HydrophobicContact CG-CG 3.88Å; E366-E370 WeakPolarHBondContact CG-OE1 3.22Å; E366-E370 WeakPolarHBondContact O-CG 3.22Å
371	D	46.6	Very low	53.3	Low	111 Å²	111	116.3 Å²	116.3	59%	0.594	59%	0.586	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.2	-7.7	-171.4	-77	-33.6	0	0	0	115.8	Q125 S369	Q125-D371 PolarHBondContact NE2-OD2 2.86Å; S369-D371 PolarHBondContact O-N 3.25Å
372	E	42.3	Very low	52.9	Low	179 Å²	179	115.7 Å²	115.7	84%	0.836	59%	0.587	S	S	*	*	S	Bend	trans	-106.3	-15.8	-170.2	-76.2	-161.1	161.2	0	0	117.6
373	D	43	Very low	53.2	Low	144 Å²	144	110.8 Å²	110.8	77%	0.77	57%	0.565	S	S	*	*	S	Bend	trans	-118	90.4	-174.5	-78	-31.2	0	0	0	111.4
374	N	42	Very low	53.3	Low	156 Å²	156	110.4 Å²	110.4	83%	0.834	57%	0.566	S	S	*	*			trans	164.4	39.7	137.4	-81.2	-48.8	0	0	0	115.8
375	E	46	Very low	54.1	Low	178 Å²	178	110.2 Å²	110.2	83%	0.832	57%	0.565	S	S	*	*			trans	-107.8	100	154	-71.7	-154.7	160.3	0	0	110.1	I377	E375-I377 PolarHBondContact O-N 2.88Å
376	I	49.3	Very low	54.8	Low	167 Å²	167	108.9 Å²	108.9	86%	0.856	56%	0.561	S	S	*	*			trans	-64.3	90.7	164.8	-60.1	173.4	0	0	0	106.9	Y378	I376-Y378 PolarHBondContact O-N 3.17Å
377	I	51.3	Low	55.5	Low	80 Å²	80	116.2 Å²	116.2	41%	0.41	58%	0.584	S	S	.	*			trans	-57.7	116.1	177.4	-60.4	174.5	0	0	0	107.7	E375 N379 G389 P391	E375-I377 PolarHBondContact O-N 2.88Å; I377-N379 PolarHBondContact O-N 3.42Å; I377-G389 WeakPolarHBondContact CD1-O 3.5Å; I377-P391 HydrophobicContact CG2-CG 4.33Å
378	Y	54.5	Low	56.1	Low	198 Å²	198	117.6 Å²	117.6	78%	0.776	59%	0.587	S	S	*	*			trans	-62.1	93.1	-178.3	-177.1	-106.5	0	0	0	110.7	I376 P380	I376-Y378 PolarHBondContact O-N 3.17Å; Y378-P380 HydrophobicContact CD1-CG 3.98Å; Y378-P380 HydrophobicContact CE1-CB 4.22Å; Y378-P380 HydrophobicContact CE1-CG 3.53Å; Y378-P380 HydrophobicContact CE2-CB 4.49Å; Y378-P380 WeakPolarHBondContact O-CD 3.38Å
379	N	65	Low	57.1	Low	38 Å²	38	111.2 Å²	111.2	20%	0.203	57%	0.565	C	S	.	*			trans	-113.9	67.1	179.6	-171.8	7.1	0	0	0	111.5	I377 K381 N382 L383 P391	I377-N379 PolarHBondContact O-N 3.42Å; N379-K381 PolarHBondContact O-N 2.76Å; N379-N382 PolarHBondContact O-N 3.22Å; N379-N382 WeakPolarHBondContact OD1-CA 3.18Å; N379-N382 PolarHBondContact OD1-N 3.29Å; N379-N382 VanDerWaalsContact OD1-N 3.15Å; N379-L383 PolarHBondContact ND2-N 3.39Å; N379-L383 PolarHBondContact ND2-O 2.99Å; N379-L383 PolarHBondContact OD1-N 2.71Å; N379-P391 HydrophobicContact CB-CG 3.94Å
380	P	62.8	Low	58.9	Low	93 Å²	93	113.4 Å²	113.4	60%	0.604	57%	0.565	S	S	*	*	T	Hydrogen-bonded Turn	trans	-65	-13.8	-174.4	28.3	-38	0	0	0	113.9	Y378	Y378-P380 HydrophobicContact CD1-CG 3.98Å; Y378-P380 HydrophobicContact CE1-CB 4.22Å; Y378-P380 HydrophobicContact CE1-CG 3.53Å; Y378-P380 HydrophobicContact CE2-CB 4.49Å; Y378-P380 WeakPolarHBondContact O-CD 3.38Å
381	K	64	Low	60.5	Low	144 Å²	144	110.9 Å²	110.9	63%	0.626	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-103.8	4.1	177.1	-68.7	-173.5	178.9	178.1	0	113.5	N379 L383	N379-K381 PolarHBondContact O-N 2.76Å; K381-L383 HydrophobicContact CB-CD1 4.11Å; K381-L383 HydrophobicContact CB-CG 3.93Å; K381-L383 PolarHBondContact O-N 2.93Å; K381-L383 VanDerWaalsContact O-N 3.1Å
382	N	64.4	Low	62	Low	125 Å²	125	107.2 Å²	107.2	67%	0.668	54%	0.537	S	S	*	.			trans	44.6	42.9	-178.8	-143.6	2.1	0	0	0	112.6	N379	N379-N382 PolarHBondContact O-N 3.22Å; N379-N382 WeakPolarHBondContact OD1-CA 3.18Å; N379-N382 PolarHBondContact OD1-N 3.29Å; N379-N382 VanDerWaalsContact OD1-N 3.15Å
383	L	75.1	Confident	63.9	Low	18 Å²	18	102 Å²	102	9%	0.094	52%	0.518	C	S	.	.	P	Polyproline II helix	trans	-72.3	145.8	178.4	-69.6	167.5	0	0	0	108.5	N379 K381 P391 Y394 Y397	N379-L383 PolarHBondContact ND2-N 3.39Å; N379-L383 PolarHBondContact ND2-O 2.99Å; N379-L383 PolarHBondContact OD1-N 2.71Å; K381-L383 HydrophobicContact CB-CD1 4.11Å; K381-L383 HydrophobicContact CB-CG 3.93Å; K381-L383 PolarHBondContact O-N 2.93Å; K381-L383 VanDerWaalsContact O-N 3.1Å; L383-P391 HydrophobicContact CB-CB 4.15Å; L383-Y394 HydrophobicContact CD2-CD2 4.25Å; L383-Y397 HydrophobicContact CD2-CD1 3.47Å; L383-Y397 VanDerWaalsContact CD2-CD1 3.47Å; L383-Y397 HydrophobicContact CD2-CD2 4.07Å; L383-Y397 HydrophobicContact CD2-CE1 3.7Å; L383-Y397 HydrophobicContact CD2-CE2 4.31Å; L383-Y397 HydrophobicContact CD2-CG 3.66Å
384	P	68.9	Low	65.5	Low	36 Å²	36	100.9 Å²	100.9	23%	0.234	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-53.3	149.9	173.6	-20.9	31.4	0	0	0	110.6	I392 Y397	P384-I392 HydrophobicContact CB-CD1 3.99Å; P384-I392 HydrophobicContact CB-CG1 4.22Å; P384-I392 WeakPolarHBondContact O-CG1 3.37Å; P384-I392 PolarHBondContact O-N 3.07Å; P384-Y397 HydrophobicContact CG-CD2 4.16Å; P384-Y397 HydrophobicContact CG-CE2 3.91Å
385	L	76.3	Confident	67.4	Low	97 Å²	97	101.4 Å²	101.4	51%	0.508	49%	0.494	S	S	.	.	B	Isolated β-bridge	trans	-85.9	141.2	175.3	-56.8	179	0	0	0	108.9	G389 P391	L385-G389 WeakPolarHBondContact CD2-O 3.3Å; L385-P391 HydrophobicContact CD2-CB 4.41Å; L385-P391 HydrophobicContact CD2-CG 3.98Å
386	G	70.1	Confident	69	Low	28 Å²	28	95 Å²	95	29%	0.289	47%	0.466	S	S	.	.			trans	-73.4	-177.9	170.5	0	0	0	0	0	111.3	D388 G389 K390	G386-D388 PolarHBondContact O-N 3.48Å; G386-G389 PolarHBondContact O-N 2.74Å; G386-G389 VanDerWaalsContact O-N 3.17Å; G386-K390 PolarHBondContact N-O 3.3Å
387	W	66.4	Low	70.4	Confident	253 Å²	253	88.1 Å²	88.1	96%	0.958	43%	0.429	S	S	*	.	T	Hydrogen-bonded Turn	trans	-65.4	-14.8	170.8	62.7	-87.9	0	0	0	113.1	G389	W387-G389 VanDerWaalsContact C-N 3.34Å
388	D	61.8	Low	71.8	Confident	91 Å²	91	88.8 Å²	88.8	49%	0.487	43%	0.429	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	12	175.3	-178.1	28.2	0	0	0	112.3	G386 K390	G386-D388 PolarHBondContact O-N 3.48Å; D388-K390 PolarHBondContact O-N 2.87Å; D388-K390 IonicContact OD1-NZ 3.07Å; D388-K390 WeakPolarHBondContact OD2-CD 3.3Å; D388-K390 IonicContact OD2-NZ 3.13Å
389	G	65.2	Low	73.2	Confident	31 Å²	31	85 Å²	85	32%	0.32	42%	0.422	S	S	.	.	S	Bend	trans	66.5	-10.3	-178.4	0	0	0	0	0	115.6	I377 L385 G386 W387	I377-G389 WeakPolarHBondContact CD1-O 3.5Å; L385-G389 WeakPolarHBondContact CD2-O 3.3Å; G386-G389 PolarHBondContact O-N 2.74Å; G386-G389 VanDerWaalsContact O-N 3.17Å; W387-G389 VanDerWaalsContact C-N 3.34Å
390	K	78.3	Confident	73.8	Confident	123 Å²	123	88.8 Å²	88.8	54%	0.535	44%	0.438	S	S	.	.	S	Bend	trans	-89.2	149.7	179.7	-67.3	172.4	-166.2	151.4	0	112.4	G386 D388 I392	G386-K390 PolarHBondContact N-O 3.3Å; D388-K390 PolarHBondContact O-N 2.87Å; D388-K390 IonicContact OD1-NZ 3.07Å; D388-K390 WeakPolarHBondContact OD2-CD 3.3Å; D388-K390 IonicContact OD2-NZ 3.13Å; K390-I392 PolarHBondContact O-N 3.16Å
391	P	77.6	Confident	74.7	Confident	38 Å²	38	84.8 Å²	84.8	25%	0.247	41%	0.413	C	S	.	.	B	Isolated β-bridge	trans	-58	129.3	176.2	-23.5	33.2	0	0	0	112.1	I377 N379 L383 L385	I377-P391 HydrophobicContact CG2-CG 4.33Å; N379-P391 HydrophobicContact CB-CG 3.94Å; L383-P391 HydrophobicContact CB-CB 4.15Å; L385-P391 HydrophobicContact CD2-CB 4.41Å; L385-P391 HydrophobicContact CD2-CG 3.98Å
392	I	77.8	Confident	75.5	Confident	35 Å²	35	80.1 Å²	80.1	18%	0.179	40%	0.395	C	S	.	.	P	Polyproline II helix	trans	-61	137.8	-178.2	-24.7	-164.8	0	0	0	109.9	P384 K390 Y394 L396 L402	P384-I392 HydrophobicContact CB-CD1 3.99Å; P384-I392 HydrophobicContact CB-CG1 4.22Å; P384-I392 WeakPolarHBondContact O-CG1 3.37Å; P384-I392 PolarHBondContact O-N 3.07Å; K390-I392 PolarHBondContact O-N 3.16Å; I392-Y394 PolarHBondContact O-N 3.41Å; I392-L396 HydrophobicContact CG2-CB 4.31Å; I392-L396 HydrophobicContact CG2-CD2 3.73Å; I392-L396 HydrophobicContact CG2-CG 4.19Å; I392-L402 HydrophobicContact CD1-CD1 4.27Å
393	P	82.3	Confident	76.2	Confident	68 Å²	68	76.5 Å²	76.5	44%	0.442	38%	0.376	S	S	.	.	P	Polyproline II helix	trans	-49.5	135.1	175.2	-31.5	35.5	0	0	0	113.6	W395 L396 Y397	P393-W395 VanDerWaalsContact C-N 3.28Å; P393-W395 PolarHBondContact O-N 2.94Å; P393-L396 HydrophobicContact CB-CB 4.38Å; P393-L396 WeakPolarHBondContact O-CA 3.31Å; P393-L396 WeakPolarHBondContact O-CB 3.25Å; P393-L396 PolarHBondContact O-N 3.21Å; P393-Y397 PolarHBondContact O-N 2.93Å
394	Y	76.7	Confident	76.6	Confident	121 Å²	121	79.1 Å²	79.1	48%	0.475	39%	0.389	S	S	.	.	H	α-helix	trans	-58.9	-34.6	-171.9	-177.4	-106.6	0	0	0	114.2	L383 I392 L396 Y397 K398	L383-Y394 HydrophobicContact CD2-CD2 4.25Å; I392-Y394 PolarHBondContact O-N 3.41Å; Y394-L396 VanDerWaalsContact C-N 3.34Å; Y394-Y397 HydrophobicContact CD2-CD1 4.33Å; Y394-Y397 HydrophobicContact CE2-CD1 4.43Å; Y394-Y397 WeakPolarHBondContact O-CB 3.47Å; Y394-K398 HydrophobicContact CE1-CG 4.15Å; Y394-K398 WeakPolarHBondContact O-CG 3.37Å; Y394-K398 PolarHBondContact O-N 3.39Å; Y394-K398 WeakPolarHBondContact OH-CE 3.48Å
395	W	81.9	Confident	77.4	Confident	167 Å²	167	81.9 Å²	81.9	63%	0.633	40%	0.402	S	S	*	.	H	α-helix	trans	-68	-35.2	176.2	66.5	-93.8	0	0	0	111.7	P393 K398 L399	P393-W395 VanDerWaalsContact C-N 3.28Å; P393-W395 PolarHBondContact O-N 2.94Å; W395-K398 PolarHBondContact O-N 2.89Å; W395-L399 HydrophobicContact CE3-CD2 4.39Å; W395-L399 HydrophobicContact CZ3-CD2 3.97Å; W395-L399 VanDerWaalsContact O-CB 3.27Å; W395-L399 WeakPolarHBondContact O-CB 3.26Å; W395-L399 PolarHBondContact O-N 3.21Å
396	L	80.3	Confident	78	Confident	45 Å²	45	81.2 Å²	81.2	24%	0.236	39%	0.393	C	S	.	.	H	α-helix	trans	-73	-38.7	178.5	-170.7	60.1	0	0	0	110.7	I392 P393 Y394 K398 L399 H400	I392-L396 HydrophobicContact CG2-CB 4.31Å; I392-L396 HydrophobicContact CG2-CD2 3.73Å; I392-L396 HydrophobicContact CG2-CG 4.19Å; P393-L396 HydrophobicContact CB-CB 4.38Å; P393-L396 WeakPolarHBondContact O-CA 3.31Å; P393-L396 WeakPolarHBondContact O-CB 3.25Å; P393-L396 PolarHBondContact O-N 3.21Å; Y394-L396 VanDerWaalsContact C-N 3.34Å; L396-K398 VanDerWaalsContact C-N 3.3Å; L396-K398 PolarHBondContact O-N 3.22Å; L396-L399 HydrophobicContact CD1-CD2 4.23Å; L396-L399 PolarHBondContact O-N 3.11Å; L396-H400 WeakPolarHBondContact CD1-CD2 3.42Å; L396-H400 WeakPolarHBondContact CD1-NE2 3.36Å; L396-H400 PolarHBondContact O-CD2 2.9Å; L396-H400 PolarHBondContact O-N 2.91Å
397	Y	78.4	Confident	79.1	Confident	22 Å²	22	83.7 Å²	83.7	9%	0.086	40%	0.4	C	S	.	.	H	α-helix	trans	-57.3	-41.2	169.9	177.9	-112.2	0	0	0	112.3	L383 P384 P393 Y394 L402 N403 R417	L383-Y397 HydrophobicContact CD2-CD1 3.47Å; L383-Y397 VanDerWaalsContact CD2-CD1 3.47Å; L383-Y397 HydrophobicContact CD2-CD2 4.07Å; L383-Y397 HydrophobicContact CD2-CE1 3.7Å; L383-Y397 HydrophobicContact CD2-CE2 4.31Å; L383-Y397 HydrophobicContact CD2-CG 3.66Å; P384-Y397 HydrophobicContact CG-CD2 4.16Å; P384-Y397 HydrophobicContact CG-CE2 3.91Å; P393-Y397 PolarHBondContact O-N 2.93Å; Y394-Y397 HydrophobicContact CD2-CD1 4.33Å; Y394-Y397 HydrophobicContact CE2-CD1 4.43Å; Y394-Y397 WeakPolarHBondContact O-CB 3.47Å; Y397-L402 HydrophobicContact CD2-CB 3.32Å; Y397-L402 HydrophobicContact CD2-CD1 4.12Å; Y397-L402 HydrophobicContact CD2-CG 4.37Å; Y397-L402 VanDerWaalsContact CE2-C 3.43Å; Y397-L402 HydrophobicContact CE2-CB 3.43Å; Y397-L402 VanDerWaalsContact CE2-CB 3.43Å; Y397-L402 WeakPolarHBondContact CE2-O 3.38Å; Y397-L402 HydrophobicContact CG-CB 4.25Å; Y397-L402 PolarHBondContact O-N 2.93Å; Y397-L402 PolarHBondContact OH-O 3.17Å; Y397-N403 HydrophobicContact CD1-CB 3.88Å; Y397-N403 HydrophobicContact CE1-CB 3.32Å; Y397-N403 VanDerWaalsContact CZ-CA 3.47Å; Y397-N403 WeakPolarHBondContact OH-CA 3.42Å; Y397-R417 PolarHBondContact OH-NH2 3.26Å
398	K	80.2	Confident	80.3	Confident	93 Å²	93	71.6 Å²	71.6	40%	0.404	35%	0.354	S	S	.	.	H	α-helix	trans	-73.9	-41.1	175	-73.8	-77.5	175.6	-179.4	0	113	Y394 W395 L396 H400 G401 N403	Y394-K398 HydrophobicContact CE1-CG 4.15Å; Y394-K398 WeakPolarHBondContact O-CG 3.37Å; Y394-K398 PolarHBondContact O-N 3.39Å; Y394-K398 WeakPolarHBondContact OH-CE 3.48Å; W395-K398 PolarHBondContact O-N 2.89Å; L396-K398 VanDerWaalsContact C-N 3.3Å; L396-K398 PolarHBondContact O-N 3.22Å; K398-H400 PolarHBondContact O-N 3.03Å; K398-G401 PolarHBondContact O-N 3.26Å; K398-G401 VanDerWaalsContact O-N 3.15Å; K398-N403 HydrophobicContact CD-CB 4.21Å; K398-N403 PolarHBondContact NZ-ND2 2.98Å
399	L	82.9	Confident	81.9	Confident	120 Å²	120	71.1 Å²	71.1	63%	0.628	35%	0.349	S	S	*	.	H	α-helix	trans	-61.8	-44.2	-179.3	-178.9	67.1	0	0	0	111.7	W395 L396 G401	W395-L399 HydrophobicContact CE3-CD2 4.39Å; W395-L399 HydrophobicContact CZ3-CD2 3.97Å; W395-L399 VanDerWaalsContact O-CB 3.27Å; W395-L399 WeakPolarHBondContact O-CB 3.26Å; W395-L399 PolarHBondContact O-N 3.21Å; L396-L399 HydrophobicContact CD1-CD2 4.23Å; L396-L399 PolarHBondContact O-N 3.11Å; L399-G401 PolarHBondContact O-N 3.42Å
400	H	78.8	Confident	83.1	Confident	117 Å²	117	70.2 Å²	70.2	54%	0.542	34%	0.336	S	S	.	.	T	Hydrogen-bonded Turn	trans	-82.8	3.4	178.1	-71.5	-58.8	0	0	0	113.9	L396 K398 L402	L396-H400 WeakPolarHBondContact CD1-CD2 3.42Å; L396-H400 WeakPolarHBondContact CD1-NE2 3.36Å; L396-H400 PolarHBondContact O-CD2 2.9Å; L396-H400 PolarHBondContact O-N 2.91Å; K398-H400 PolarHBondContact O-N 3.03Å; H400-L402 HydrophobicContact CB-CD1 4.34Å; H400-L402 HydrophobicContact CB-CG 4.18Å; H400-L402 PolarHBondContact O-N 3.49Å
401	G	81.8	Confident	83.7	Confident	9 Å²	9	65.1 Å²	65.1	9%	0.093	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	66.1	17.9	177.8	0	0	0	0	0	114.2	K398 L399 N403 I404 G418	K398-G401 PolarHBondContact O-N 3.26Å; K398-G401 VanDerWaalsContact O-N 3.15Å; L399-G401 PolarHBondContact O-N 3.42Å; G401-N403 PolarHBondContact O-N 3.29Å; G401-N403 VanDerWaalsContact O-N 3.12Å; G401-I404 WeakPolarHBondContact O-CB 3.38Å; G401-I404 PolarHBondContact O-N 3.4Å; G401-G418 WeakPolarHBondContact O-CA 3.48Å
402	L	80.8	Confident	84.3	Confident	45 Å²	45	66.5 Å²	66.5	24%	0.236	34%	0.338	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-15.4	179.3	-68.5	169.2	0	0	0	112.5	I392 Y397 H400 I404	I392-L402 HydrophobicContact CD1-CD1 4.27Å; Y397-L402 HydrophobicContact CD2-CB 3.32Å; Y397-L402 HydrophobicContact CD2-CD1 4.12Å; Y397-L402 HydrophobicContact CD2-CG 4.37Å; Y397-L402 VanDerWaalsContact CE2-C 3.43Å; Y397-L402 HydrophobicContact CE2-CB 3.43Å; Y397-L402 VanDerWaalsContact CE2-CB 3.43Å; Y397-L402 WeakPolarHBondContact CE2-O 3.38Å; Y397-L402 HydrophobicContact CG-CB 4.25Å; Y397-L402 PolarHBondContact O-N 2.93Å; Y397-L402 PolarHBondContact OH-O 3.17Å; H400-L402 HydrophobicContact CB-CD1 4.34Å; H400-L402 HydrophobicContact CB-CG 4.18Å; H400-L402 PolarHBondContact O-N 3.49Å; L402-I404 PolarHBondContact O-N 3.09Å
403	N	78.3	Confident	84.9	Confident	50 Å²	50	69.7 Å²	69.7	27%	0.267	36%	0.355	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.4	1.6	173.2	74.4	-75.6	0	0	0	114.6	Y397 K398 G401	Y397-N403 HydrophobicContact CD1-CB 3.88Å; Y397-N403 HydrophobicContact CE1-CB 3.32Å; Y397-N403 VanDerWaalsContact CZ-CA 3.47Å; Y397-N403 WeakPolarHBondContact OH-CA 3.42Å; K398-N403 HydrophobicContact CD-CB 4.21Å; K398-N403 PolarHBondContact NZ-ND2 2.98Å; G401-N403 PolarHBondContact O-N 3.29Å; G401-N403 VanDerWaalsContact O-N 3.12Å
404	I	83.5	Confident	85.2	Confident	73 Å²	73	71.7 Å²	71.7	37%	0.374	36%	0.355	S	S	.	.	S	Bend	trans	-109.2	121.4	179.5	-53.8	175.5	0	0	0	107.3	G401 L402 Y406 G418	G401-I404 WeakPolarHBondContact O-CB 3.38Å; G401-I404 PolarHBondContact O-N 3.4Å; L402-I404 PolarHBondContact O-N 3.09Å; I404-Y406 HydrophobicContact CB-CE2 4.1Å; I404-Y406 HydrophobicContact CG2-CD2 4.23Å; I404-Y406 HydrophobicContact CG2-CE2 3.55Å; I404-G418 PolarHBondContact O-N 3.02Å
405	N	86.1	Confident	85.8	Confident	94 Å²	94	68.9 Å²	68.9	50%	0.503	35%	0.35	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.8	131.9	179.9	-68.6	-15.7	0	0	0	109.5	T415	N405-T415 HydrophobicContact CB-CG2 3.67Å
406	Y	89.9	Confident	86.1	Confident	82 Å²	82	61.9 Å²	61.9	32%	0.322	32%	0.323	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	134.1	173	-67.9	-89.6	0	0	0	109.2	I404 T415 Y416 P419 F422	I404-Y406 HydrophobicContact CB-CE2 4.1Å; I404-Y406 HydrophobicContact CG2-CD2 4.23Å; I404-Y406 HydrophobicContact CG2-CE2 3.55Å; Y406-T415 CarbonylContact O-C 3.55Å; Y406-Y416 PolarHBondContact N-O 3.06Å; Y406-Y416 PolarHBondContact O-N 3.34Å; Y406-P419 HydrophobicContact CE2-CB 4.27Å; Y406-P419 HydrophobicContact CE2-CG 3.86Å; Y406-F422 VanDerWaalsContact CB-CD2 3.4Å; Y406-F422 HydrophobicContact CD1-CD1 4.19Å; Y406-F422 HydrophobicContact CD1-CE1 4.31Å; Y406-F422 HydrophobicContact CD1-CG 4.49Å; Y406-F422 HydrophobicContact CD2-CB 4.25Å; Y406-F422 HydrophobicContact CD2-CG 4.48Å; Y406-F422 HydrophobicContact CG-CB 4.22Å; Y406-F422 HydrophobicContact CG-CD1 4.1Å; Y406-F422 HydrophobicContact CG-CD2 4.31Å; Y406-F422 AromaticContact CG-CG 3.95Å; Y406-F422 HydrophobicContact CG-CG 3.95Å
407	N	91.3	Very high	86.4	Confident	80 Å²	80	64.8 Å²	64.8	43%	0.428	33%	0.331	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-107.4	140.1	-178.6	-58.9	-13.7	0	0	0	109.8	Y414 T415	N407-Y414 WeakPolarHBondContact CA-O 3.5Å; N407-T415 WeakPolarHBondContact OD1-CG2 3.41Å; N407-T415 PolarHBondContact OD1-OG1 3.4Å
408	C	93.6	Very high	86.9	Confident	0 Å²	0	63.8 Å²	63.8	0%	0	33%	0.328	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-116.7	113.8	173	-177.5	0	0	0	0	110	C411 N413 Y414 Y416 F422 H425	C408-C411 HydrophobicContact CB-CB 4.06Å; C408-C411 PolarHBondContact O-N 3.5Å; C408-N413 WeakPolarHBondContact O-CA 3.27Å; C408-N413 PolarHBondContact O-N 2.97Å; C408-Y414 PolarHBondContact N-O 3.34Å; C408-Y414 PolarHBondContact O-N 2.79Å; C408-Y416 HydrophobicContact CB-CD2 4.41Å; C408-Y416 HydrophobicContact CB-CE2 3.97Å; C408-F422 HydrophobicContact CB-CE2 4.11Å; C408-H425 PolarHBondContact SG-NE2 3.23Å; C408-H425 VanDerWaalsContact SG-NE2 3.38Å
409	E	94.1	Very high	87.2	Confident	80 Å²	80	61.5 Å²	61.5	37%	0.374	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.5	-41.7	-178.7	-163.8	-170.7	162.3	0	0	111.5	C411 G412 N413 T450 Q451 I452	E409-C411 PolarHBondContact O-N 3.02Å; E409-C411 VanDerWaalsContact O-N 3.12Å; E409-G412 PolarHBondContact O-N 3.39Å; E409-N413 PolarHBondContact O-N 3.36Å; E409-T450 VanDerWaalsContact CB-O 3.24Å; E409-T450 WeakPolarHBondContact CB-O 3.27Å; E409-T450 PolarHBondContact N-O 2.93Å; E409-T450 VanDerWaalsContact N-O 3.15Å; E409-Q451 VanDerWaalsContact OE2-CA 3.31Å; E409-Q451 WeakPolarHBondContact OE2-CA 3.32Å; E409-I452 HydrophobicContact CG-CD1 4.16Å; E409-I452 HydrophobicContact CG-CG1 4.22Å; E409-I452 PolarHBondContact OE2-N 3.03Å
410	I	91	Very high	87.4	Confident	12 Å²	12	64.2 Å²	64.2	6%	0.062	33%	0.329	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.8	-27.6	176.6	-62.5	162.3	0	0	0	112.1	G412 M435 L438 V449 T450 I452 A455	I410-G412 VanDerWaalsContact C-N 3.32Å; I410-G412 PolarHBondContact O-N 3.32Å; I410-M435 HydrophobicContact CD1-SD 3.98Å; I410-M435 HydrophobicContact CG2-CG 4.18Å; I410-M435 HydrophobicContact CG2-SD 4.03Å; I410-L438 HydrophobicContact CG1-CD1 4.35Å; I410-L438 HydrophobicContact CG2-CD1 4.2Å; I410-V449 WeakPolarHBondContact CD1-O 3.27Å; I410-T450 WeakPolarHBondContact CG1-O 3.49Å; I410-T450 PolarHBondContact N-O 3.45Å; I410-I452 HydrophobicContact CG1-CG1 3.87Å; I410-A455 HydrophobicContact CD1-CB 4.19Å
411	C	91	Very high	87.8	Confident	16 Å²	16	60.2 Å²	60.2	11%	0.108	32%	0.316	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.2	15.5	175.9	-63.6	0	0	0	0	113.9	C408 E409 R430	C408-C411 HydrophobicContact CB-CB 4.06Å; C408-C411 PolarHBondContact O-N 3.5Å; E409-C411 PolarHBondContact O-N 3.02Å; E409-C411 VanDerWaalsContact O-N 3.12Å; C411-R430 HydrophobicContact CB-CG 4.49Å
412	G	88.9	Confident	88.3	Confident	68 Å²	68	60.9 Å²	60.9	70%	0.701	32%	0.317	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.5	36.8	-174.3	0	0	0	0	0	113.1	E409 I410 Y414	E409-G412 PolarHBondContact O-N 3.39Å; I410-G412 VanDerWaalsContact C-N 3.32Å; I410-G412 PolarHBondContact O-N 3.32Å; G412-Y414 PolarHBondContact O-N 3.43Å
413	N	90.3	Very high	88.8	Confident	101 Å²	101	64.9 Å²	64.9	54%	0.54	33%	0.334	S	S	.	.	S	Bend	trans	56.5	34	-175.4	-154.5	21.6	0	0	0	113.7	C408 E409	C408-N413 WeakPolarHBondContact O-CA 3.27Å; C408-N413 PolarHBondContact O-N 2.97Å; E409-N413 PolarHBondContact O-N 3.36Å
414	Y	89.3	Confident	89.3	Confident	111 Å²	111	70.6 Å²	70.6	44%	0.435	35%	0.352	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-70.5	136.1	-179.9	-172	-99.2	0	0	0	111.2	N407 C408 G412 Y416 R430	N407-Y414 WeakPolarHBondContact CA-O 3.5Å; C408-Y414 PolarHBondContact N-O 3.34Å; C408-Y414 PolarHBondContact O-N 2.79Å; G412-Y414 PolarHBondContact O-N 3.43Å; Y414-Y416 HydrophobicContact CD1-CD1 4.16Å; Y414-Y416 HydrophobicContact CD1-CD2 4.04Å; Y414-Y416 AromaticContact CD1-CE1 3.76Å; Y414-Y416 HydrophobicContact CD1-CE1 3.76Å; Y414-Y416 AromaticContact CD1-CE2 3.66Å; Y414-Y416 HydrophobicContact CD1-CE2 3.66Å; Y414-Y416 HydrophobicContact CD1-CG 4.29Å; Y414-Y416 AromaticContact CD1-CZ 3.5Å; Y414-Y416 VanDerWaalsContact CD1-CZ 3.5Å; Y414-Y416 HydrophobicContact CE1-CD1 4.08Å; Y414-Y416 AromaticContact CE1-CE1 3.79Å; Y414-Y416 HydrophobicContact CE1-CE1 3.79Å; Y414-Y416 HydrophobicContact CE1-CE2 4.49Å; Y414-R430 VanDerWaalsContact CE2-NH1 3.27Å
415	T	89.6	Confident	89.8	Confident	62 Å²	62	67.1 Å²	67.1	38%	0.38	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	121	-177.9	-52.6	0	0	0	0	111.1	N405 Y406 N407	N405-T415 HydrophobicContact CB-CG2 3.67Å; Y406-T415 CarbonylContact O-C 3.55Å; N407-T415 WeakPolarHBondContact OD1-CG2 3.41Å; N407-T415 PolarHBondContact OD1-OG1 3.4Å
416	Y	88.4	Confident	90	Very high	19 Å²	19	63.6 Å²	63.6	8%	0.075	31%	0.314	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-101.8	135.1	171.9	-64.5	-86	0	0	0	110.5	Y406 C408 Y414 F422 H425	Y406-Y416 PolarHBondContact N-O 3.06Å; Y406-Y416 PolarHBondContact O-N 3.34Å; C408-Y416 HydrophobicContact CB-CD2 4.41Å; C408-Y416 HydrophobicContact CB-CE2 3.97Å; Y414-Y416 HydrophobicContact CD1-CD1 4.16Å; Y414-Y416 HydrophobicContact CD1-CD2 4.04Å; Y414-Y416 AromaticContact CD1-CE1 3.76Å; Y414-Y416 HydrophobicContact CD1-CE1 3.76Å; Y414-Y416 AromaticContact CD1-CE2 3.66Å; Y414-Y416 HydrophobicContact CD1-CE2 3.66Å; Y414-Y416 HydrophobicContact CD1-CG 4.29Å; Y414-Y416 AromaticContact CD1-CZ 3.5Å; Y414-Y416 VanDerWaalsContact CD1-CZ 3.5Å; Y414-Y416 HydrophobicContact CE1-CD1 4.08Å; Y414-Y416 AromaticContact CE1-CE1 3.79Å; Y414-Y416 HydrophobicContact CE1-CE1 3.79Å; Y414-Y416 HydrophobicContact CE1-CE2 4.49Å; Y416-F422 AromaticContact CD2-CD2 3.74Å; Y416-F422 HydrophobicContact CD2-CD2 3.74Å; Y416-F422 HydrophobicContact CD2-CE2 4.15Å; Y416-F422 HydrophobicContact CG-CD2 4.08Å; Y416-H425 HydrophobicContact CD1-CB 3.99Å; Y416-H425 HydrophobicContact CE1-CB 3.41Å; Y416-H425 VanDerWaalsContact CE1-CB 3.41Å; Y416-H425 AromaticContact CE1-CG 3.92Å; Y416-H425 HydrophobicContact CE2-CB 4.04Å; Y416-H425 AromaticContact CE2-CD2 3.42Å; Y416-H425 VanDerWaalsContact CE2-CD2 3.42Å; Y416-H425 WeakPolarHBondContact CE2-CD2 3.49Å; Y416-H425 AromaticContact CE2-CG 3.58Å; Y416-H425 AromaticContact CE2-NE2 3.91Å; Y416-H425 VanDerWaalsContact CZ-CB 3.43Å; Y416-H425 AromaticContact CZ-CD2 3.51Å; Y416-H425 AromaticContact CZ-CG 3.49Å; Y416-H425 VanDerWaalsContact CZ-CG 3.49Å; Y416-H425 PolarHBondContact OH-CD2 3.29Å
417	R	87.3	Confident	90	Very high	106 Å²	106	63.9 Å²	63.9	40%	0.4	33%	0.333	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-92.1	109.7	177.9	-69.1	-179.7	122.7	-179.5	0.1	110.1	Y397	Y397-R417 PolarHBondContact OH-NH2 3.26Å
418	G	88	Confident	89.9	Confident	1 Å²	1	63.1 Å²	63.1	1%	0.01	33%	0.328	C	S	.	.	S	Bend	trans	91.7	152.5	173.3	0	0	0	0	0	115.7	G401 I404 K420 A421 F422	G401-G418 WeakPolarHBondContact O-CA 3.48Å; I404-G418 PolarHBondContact O-N 3.02Å; G418-K420 PolarHBondContact O-N 2.95Å; G418-A421 PolarHBondContact O-N 3.38Å; G418-F422 WeakPolarHBondContact O-CB 3.11Å; G418-F422 PolarHBondContact O-N 3.19Å; G418-F422 VanDerWaalsContact O-N 3.11Å
419	P	87.4	Confident	89.8	Confident	45 Å²	45	72.1 Å²	72.1	29%	0.292	36%	0.362	S	S	.	.	H	α-helix	trans	-64.1	-37	-172.6	-20.8	31.1	0	0	0	113.7	Y406 F422 Q423	Y406-P419 HydrophobicContact CE2-CB 4.27Å; Y406-P419 HydrophobicContact CE2-CG 3.86Å; P419-F422 CarbonylContact O-C 3.49Å; P419-F422 PolarHBondContact O-N 2.99Å; P419-Q423 WeakPolarHBondContact O-CG 3.38Å; P419-Q423 PolarHBondContact O-N 3.15Å
420	K	87.1	Confident	89.5	Confident	178 Å²	178	74.1 Å²	74.1	77%	0.774	37%	0.366	S	S	*	.	H	α-helix	trans	-68.5	-43.3	-177.3	-172	178.7	-179.4	-179.2	0	112.1	G418 F422 Q423 R424	G418-K420 PolarHBondContact O-N 2.95Å; K420-F422 VanDerWaalsContact C-N 3.3Å; K420-Q423 PolarHBondContact O-N 3.07Å; K420-R424 PolarHBondContact O-N 3.03Å; K420-R424 VanDerWaalsContact O-N 3.09Å
421	A	87.4	Confident	89.6	Confident	32 Å²	32	73.6 Å²	73.6	26%	0.264	36%	0.363	S	S	.	.	H	α-helix	trans	-62.9	-42.1	174.1	0	0	0	0	0	110.3	G418 Q423 R424 H425	G418-A421 PolarHBondContact O-N 3.38Å; A421-Q423 VanDerWaalsContact C-N 3.32Å; A421-Q423 PolarHBondContact O-N 3.1Å; A421-R424 PolarHBondContact O-N 3.37Å; A421-H425 PolarHBondContact O-N 3.28Å
422	F	91.7	Very high	89.5	Confident	24 Å²	24	74 Å²	74	11%	0.105	37%	0.367	C	S	.	.	H	α-helix	trans	-67.3	-24.6	175.2	-168.7	-107.9	0	0	0	114.2	Y406 C408 Y416 G418 P419 K420 H425 F426 T450	Y406-F422 VanDerWaalsContact CB-CD2 3.4Å; Y406-F422 HydrophobicContact CD1-CD1 4.19Å; Y406-F422 HydrophobicContact CD1-CE1 4.31Å; Y406-F422 HydrophobicContact CD1-CG 4.49Å; Y406-F422 HydrophobicContact CD2-CB 4.25Å; Y406-F422 HydrophobicContact CD2-CG 4.48Å; Y406-F422 HydrophobicContact CG-CB 4.22Å; Y406-F422 HydrophobicContact CG-CD1 4.1Å; Y406-F422 HydrophobicContact CG-CD2 4.31Å; Y406-F422 AromaticContact CG-CG 3.95Å; Y406-F422 HydrophobicContact CG-CG 3.95Å; C408-F422 HydrophobicContact CB-CE2 4.11Å; Y416-F422 AromaticContact CD2-CD2 3.74Å; Y416-F422 HydrophobicContact CD2-CD2 3.74Å; Y416-F422 HydrophobicContact CD2-CE2 4.15Å; Y416-F422 HydrophobicContact CG-CD2 4.08Å; G418-F422 WeakPolarHBondContact O-CB 3.11Å; G418-F422 PolarHBondContact O-N 3.19Å; G418-F422 VanDerWaalsContact O-N 3.11Å; P419-F422 CarbonylContact O-C 3.49Å; P419-F422 PolarHBondContact O-N 2.99Å; K420-F422 VanDerWaalsContact C-N 3.3Å; F422-H425 AromaticContact CD2-CE1 3.44Å; F422-H425 VanDerWaalsContact CD2-CE1 3.44Å; F422-H425 WeakPolarHBondContact CD2-CE1 3.46Å; F422-H425 AromaticContact CD2-ND1 3.58Å; F422-H425 AromaticContact CE2-CE1 3.4Å; F422-H425 WeakPolarHBondContact CE2-CE1 3.44Å; F422-H425 AromaticContact CG-ND1 3.97Å; F422-H425 AromaticContact CZ-CE1 3.89Å; F422-H425 PolarHBondContact O-CE1 2.87Å; F422-H425 PolarHBondContact O-ND1 3.32Å; F422-F426 HydrophobicContact CD1-CE2 4.38Å; F422-F426 HydrophobicContact CE1-CE2 4.2Å; F422-F426 HydrophobicContact CE1-CZ 4.2Å; F422-F426 HydrophobicContact CZ-CZ 4.37Å; F422-F426 WeakPolarHBondContact O-CD2 3.36Å; F422-F426 WeakPolarHBondContact O-CE2 3.47Å; F422-T450 HydrophobicContact CE1-CG2 4.06Å; F422-T450 HydrophobicContact CE2-CG2 4.44Å; F422-T450 HydrophobicContact CZ-CG2 3.45Å; F422-T450 VanDerWaalsContact CZ-CG2 3.45Å
423	Q	90.3	Very high	89.6	Confident	128 Å²	128	74.5 Å²	74.5	60%	0.598	35%	0.351	S	S	*	.	H	α-helix	trans	-79.2	-36.7	172.1	-76.2	174.4	-6.7	0	0	111.6	P419 K420 A421 H425	P419-Q423 WeakPolarHBondContact O-CG 3.38Å; P419-Q423 PolarHBondContact O-N 3.15Å; K420-Q423 PolarHBondContact O-N 3.07Å; A421-Q423 VanDerWaalsContact C-N 3.32Å; A421-Q423 PolarHBondContact O-N 3.1Å; Q423-H425 VanDerWaalsContact C-N 3.34Å; Q423-H425 PolarHBondContact O-N 3Å
424	R	89.6	Confident	89.7	Confident	171 Å²	171	70.3 Å²	70.3	65%	0.645	33%	0.332	S	S	*	.	H	α-helix	trans	-67.4	-34.8	179.9	-166.5	174.8	66.3	-165.5	-2.6	112.4	K420 A421 F426 A427 E428	K420-R424 PolarHBondContact O-N 3.03Å; K420-R424 VanDerWaalsContact O-N 3.09Å; A421-R424 PolarHBondContact O-N 3.37Å; R424-F426 PolarHBondContact O-N 3.14Å; R424-F426 VanDerWaalsContact O-N 3.08Å; R424-A427 PolarHBondContact O-N 3.32Å; R424-E428 IonicContact CZ-OE1 3.54Å; R424-E428 IonicContact NE-OE1 3.94Å; R424-E428 PolarHBondContact NE-OE1 3.3Å; R424-E428 IonicContact NH2-OE1 2.87Å
425	H	93.4	Very high	89.8	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.311	C	S	.	.	G	3₁₀ helix	trans	-59.8	-25.1	-174.9	93.2	-79.9	0	0	0	114.5	C408 Y416 A421 F422 Q423 A427 E428 H431	C408-H425 PolarHBondContact SG-NE2 3.23Å; C408-H425 VanDerWaalsContact SG-NE2 3.38Å; Y416-H425 HydrophobicContact CD1-CB 3.99Å; Y416-H425 HydrophobicContact CE1-CB 3.41Å; Y416-H425 VanDerWaalsContact CE1-CB 3.41Å; Y416-H425 AromaticContact CE1-CG 3.92Å; Y416-H425 HydrophobicContact CE2-CB 4.04Å; Y416-H425 AromaticContact CE2-CD2 3.42Å; Y416-H425 VanDerWaalsContact CE2-CD2 3.42Å; Y416-H425 WeakPolarHBondContact CE2-CD2 3.49Å; Y416-H425 AromaticContact CE2-CG 3.58Å; Y416-H425 AromaticContact CE2-NE2 3.91Å; Y416-H425 VanDerWaalsContact CZ-CB 3.43Å; Y416-H425 AromaticContact CZ-CD2 3.51Å; Y416-H425 AromaticContact CZ-CG 3.49Å; Y416-H425 VanDerWaalsContact CZ-CG 3.49Å; Y416-H425 PolarHBondContact OH-CD2 3.29Å; A421-H425 PolarHBondContact O-N 3.28Å; F422-H425 AromaticContact CD2-CE1 3.44Å; F422-H425 VanDerWaalsContact CD2-CE1 3.44Å; F422-H425 WeakPolarHBondContact CD2-CE1 3.46Å; F422-H425 AromaticContact CD2-ND1 3.58Å; F422-H425 AromaticContact CE2-CE1 3.4Å; F422-H425 WeakPolarHBondContact CE2-CE1 3.44Å; F422-H425 AromaticContact CG-ND1 3.97Å; F422-H425 AromaticContact CZ-CE1 3.89Å; F422-H425 PolarHBondContact O-CE1 2.87Å; F422-H425 PolarHBondContact O-ND1 3.32Å; Q423-H425 VanDerWaalsContact C-N 3.34Å; Q423-H425 PolarHBondContact O-N 3Å; H425-A427 PolarHBondContact O-N 3.41Å; H425-E428 WeakPolarHBondContact O-CB 3.49Å; H425-E428 PolarHBondContact O-N 3.16Å; H425-H431 AromaticContact CD2-ND1 3.65Å; H425-H431 AromaticContact NE2-ND1 3.45Å; H425-H431 PolarHBondContact NE2-ND1 3Å; H425-H431 WeakPolarHBondContact O-CB 3.11Å
426	F	91.5	Very high	89.9	Confident	19 Å²	19	70.4 Å²	70.4	8%	0.083	32%	0.324	C	S	.	.	G	3₁₀ helix	trans	-60.8	-28.6	176.7	-71.5	-71.3	0	0	0	113.2	F422 R424 H431 N442 V449 T450	F422-F426 HydrophobicContact CD1-CE2 4.38Å; F422-F426 HydrophobicContact CE1-CE2 4.2Å; F422-F426 HydrophobicContact CE1-CZ 4.2Å; F422-F426 HydrophobicContact CZ-CZ 4.37Å; F422-F426 WeakPolarHBondContact O-CD2 3.36Å; F422-F426 WeakPolarHBondContact O-CE2 3.47Å; R424-F426 PolarHBondContact O-N 3.14Å; R424-F426 VanDerWaalsContact O-N 3.08Å; F426-H431 AromaticContact CD1-CD2 4Å; F426-H431 AromaticContact CD1-CE1 3.55Å; F426-H431 AromaticContact CD1-NE2 3.48Å; F426-H431 WeakPolarHBondContact CD1-NE2 3.44Å; F426-H431 AromaticContact CE1-CE1 3.69Å; F426-H431 AromaticContact CE1-NE2 3.99Å; F426-N442 PolarHBondContact O-ND2 3.43Å; F426-V449 WeakPolarHBondContact CE1-O 3.4Å; F426-T450 HydrophobicContact CE1-CG2 4.42Å; F426-T450 HydrophobicContact CZ-CG2 3.97Å
427	A	88.8	Confident	90	Very high	88 Å²	88	74 Å²	74	73%	0.727	35%	0.352	S	S	*	.	G	3₁₀ helix	trans	-95.7	-4.5	175.8	0	0	0	0	0	113	R424 H425	R424-A427 PolarHBondContact O-N 3.32Å; H425-A427 PolarHBondContact O-N 3.41Å
428	E	90.4	Very high	90.1	Very high	65 Å²	65	72 Å²	72	30%	0.304	35%	0.348	S	S	.	.	S	Bend	trans	-80.3	154.1	-179.3	-68.9	173.4	-176.1	0	0	111.2	R424 H425 R430 H431 A432	R424-E428 IonicContact CZ-OE1 3.54Å; R424-E428 IonicContact NE-OE1 3.94Å; R424-E428 PolarHBondContact NE-OE1 3.3Å; R424-E428 IonicContact NH2-OE1 2.87Å; H425-E428 WeakPolarHBondContact O-CB 3.49Å; H425-E428 PolarHBondContact O-N 3.16Å; E428-R430 VanDerWaalsContact C-N 3.27Å; E428-R430 PolarHBondContact O-N 2.89Å; E428-H431 PolarHBondContact O-N 3.2Å; E428-A432 PolarHBondContact O-N 3.12Å; E428-A432 VanDerWaalsContact O-N 3.11Å
429	W	89.8	Confident	90.2	Very high	189 Å²	189	74.4 Å²	74.4	72%	0.716	37%	0.374	S	S	*	.	H	α-helix	trans	-56.4	-38.6	-173.6	178.7	93.3	0	0	0	113.2	H431 A432 H433	W429-H431 PolarHBondContact O-N 3.03Å; W429-A432 PolarHBondContact O-N 3.02Å; W429-H433 HydrophobicContact CE3-CB 4.49Å; W429-H433 HydrophobicContact CH2-CB 4.38Å; W429-H433 HydrophobicContact CZ2-CB 4.4Å; W429-H433 HydrophobicContact CZ3-CB 4.43Å; W429-H433 VanDerWaalsContact O-CB 3.3Å; W429-H433 WeakPolarHBondContact O-CB 3.02Å; W429-H433 PolarHBondContact O-N 3.18Å
430	R	89.3	Confident	90.3	Very high	122 Å²	122	72.6 Å²	72.6	46%	0.46	36%	0.361	S	S	.	.	H	α-helix	trans	-62.1	-45.4	-178.2	-177.6	179.1	-75.9	-163	-3	111.9	C411 Y414 E428 H433 G434	C411-R430 HydrophobicContact CB-CG 4.49Å; Y414-R430 VanDerWaalsContact CE2-NH1 3.27Å; E428-R430 VanDerWaalsContact C-N 3.27Å; E428-R430 PolarHBondContact O-N 2.89Å; R430-H433 PolarHBondContact O-N 3.47Å; R430-G434 PolarHBondContact O-N 2.96Å
431	H	91.3	Very high	90.3	Very high	1 Å²	1	66.9 Å²	66.9	1%	0.005	34%	0.342	C	S	.	.	H	α-helix	trans	-69.1	-42.2	178	-170.2	89.1	0	0	0	111.1	H425 F426 E428 W429 H433 G434 M435	H425-H431 AromaticContact CD2-ND1 3.65Å; H425-H431 AromaticContact NE2-ND1 3.45Å; H425-H431 PolarHBondContact NE2-ND1 3Å; H425-H431 WeakPolarHBondContact O-CB 3.11Å; F426-H431 AromaticContact CD1-CD2 4Å; F426-H431 AromaticContact CD1-CE1 3.55Å; F426-H431 AromaticContact CD1-NE2 3.48Å; F426-H431 WeakPolarHBondContact CD1-NE2 3.44Å; F426-H431 AromaticContact CE1-CE1 3.69Å; F426-H431 AromaticContact CE1-NE2 3.99Å; E428-H431 PolarHBondContact O-N 3.2Å; W429-H431 PolarHBondContact O-N 3.03Å; H431-H433 VanDerWaalsContact C-N 3.27Å; H431-H433 PolarHBondContact O-N 2.93Å; H431-G434 PolarHBondContact O-N 3.29Å; H431-M435 WeakPolarHBondContact O-CG 3.42Å; H431-M435 PolarHBondContact O-N 3.1Å
432	A	90	Very high	90.3	Very high	24 Å²	24	68.6 Å²	68.6	20%	0.198	35%	0.347	C	S	.	.	H	α-helix	trans	-60.2	-37.7	175.3	0	0	0	0	0	112.4	E428 W429 R436 N442	E428-A432 PolarHBondContact O-N 3.12Å; E428-A432 VanDerWaalsContact O-N 3.11Å; W429-A432 PolarHBondContact O-N 3.02Å; A432-R436 WeakPolarHBondContact O-CB 3.48Å; A432-R436 PolarHBondContact O-N 3.35Å; A432-N442 WeakPolarHBondContact CB-ND2 3.46Å
433	H	90.9	Very high	90.1	Very high	78 Å²	78	70.2 Å²	70.2	36%	0.361	36%	0.359	S	S	.	.	H	α-helix	trans	-68.2	-44.1	175.1	-172.1	74.3	0	0	0	111.6	W429 R430 H431 M435 R436 C437	W429-H433 HydrophobicContact CE3-CB 4.49Å; W429-H433 HydrophobicContact CH2-CB 4.38Å; W429-H433 HydrophobicContact CZ2-CB 4.4Å; W429-H433 HydrophobicContact CZ3-CB 4.43Å; W429-H433 VanDerWaalsContact O-CB 3.3Å; W429-H433 WeakPolarHBondContact O-CB 3.02Å; W429-H433 PolarHBondContact O-N 3.18Å; R430-H433 PolarHBondContact O-N 3.47Å; H431-H433 VanDerWaalsContact C-N 3.27Å; H431-H433 PolarHBondContact O-N 2.93Å; H433-M435 VanDerWaalsContact C-N 3.34Å; H433-M435 PolarHBondContact O-N 3.22Å; H433-R436 WeakPolarHBondContact O-CB 3.47Å; H433-R436 PolarHBondContact O-N 3.03Å; H433-R436 VanDerWaalsContact O-N 3.11Å; H433-C437 PolarHBondContact O-N 3.38Å; H433-C437 PolarHBondContact O-SG 3.46Å; H433-C437 VanDerWaalsContact O-SG 3.35Å
434	G	92.1	Very high	89.9	Confident	13 Å²	13	68.6 Å²	68.6	13%	0.134	37%	0.368	C	S	.	.	H	α-helix	trans	-56.2	-46.6	173.5	0	0	0	0	0	112.5	R430 H431 R436 C437 L438	R430-G434 PolarHBondContact O-N 2.96Å; H431-G434 PolarHBondContact O-N 3.29Å; G434-R436 VanDerWaalsContact C-N 3.33Å; G434-R436 PolarHBondContact O-N 3Å; G434-C437 PolarHBondContact O-N 3.45Å; G434-L438 WeakPolarHBondContact O-CG 3.35Å; G434-L438 PolarHBondContact O-N 3.3Å
435	M	91.3	Very high	89.7	Confident	1 Å²	1	66.3 Å²	66.3	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-61.7	-39.2	174.8	-69.6	-65.4	-77.8	0	0	112.7	I410 H431 H433 L438 G439 I440 N442 F446	I410-M435 HydrophobicContact CD1-SD 3.98Å; I410-M435 HydrophobicContact CG2-CG 4.18Å; I410-M435 HydrophobicContact CG2-SD 4.03Å; H431-M435 WeakPolarHBondContact O-CG 3.42Å; H431-M435 PolarHBondContact O-N 3.1Å; H433-M435 VanDerWaalsContact C-N 3.34Å; H433-M435 PolarHBondContact O-N 3.22Å; M435-L438 PolarHBondContact O-N 2.92Å; M435-G439 PolarHBondContact O-N 3.49Å; M435-I440 CarbonylContact C-O 3.45Å; M435-I440 HydrophobicContact CE-CB 3.91Å; M435-I440 HydrophobicContact CE-CG2 3.51Å; M435-I440 PolarHBondContact O-N 3.49Å; M435-I440 VanDerWaalsContact O-O 3.1Å; M435-N442 HydrophobicContact CB-CB 4.41Å; M435-F446 HydrophobicContact CE-CB 3.69Å; M435-F446 HydrophobicContact CE-CD1 3.87Å; M435-F446 HydrophobicContact CE-CD2 4.05Å; M435-F446 HydrophobicContact CE-CG 3.59Å
436	R	91.1	Very high	89.5	Confident	174 Å²	174	66.4 Å²	66.4	66%	0.657	37%	0.365	S	S	*	.	H	α-helix	trans	-65.1	-40.1	176.1	-173.9	-178.4	-68.2	155.5	-0.2	112.1	A432 H433 G434 L438 G439	A432-R436 WeakPolarHBondContact O-CB 3.48Å; A432-R436 PolarHBondContact O-N 3.35Å; H433-R436 WeakPolarHBondContact O-CB 3.47Å; H433-R436 PolarHBondContact O-N 3.03Å; H433-R436 VanDerWaalsContact O-N 3.11Å; G434-R436 VanDerWaalsContact C-N 3.33Å; G434-R436 PolarHBondContact O-N 3Å; R436-L438 PolarHBondContact O-N 3.02Å; R436-G439 PolarHBondContact O-N 3.26Å
437	C	91	Very high	89.2	Confident	96 Å²	96	68 Å²	68	65%	0.649	38%	0.381	S	S	*	.	H	α-helix	trans	-63.7	-29.7	175.1	-68.4	0	0	0	0	112.4	H433 G434 G439	H433-C437 PolarHBondContact O-N 3.38Å; H433-C437 PolarHBondContact O-SG 3.46Å; H433-C437 VanDerWaalsContact O-SG 3.35Å; G434-C437 PolarHBondContact O-N 3.45Å; C437-G439 VanDerWaalsContact C-N 3.26Å; C437-G439 PolarHBondContact O-N 2.86Å
438	L	90.3	Very high	89.2	Confident	62 Å²	62	69.1 Å²	69.1	33%	0.325	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.2	-5	172.2	-62.9	171.1	0	0	0	113.4	I410 G434 M435 R436 I440 I452	I410-L438 HydrophobicContact CG1-CD1 4.35Å; I410-L438 HydrophobicContact CG2-CD1 4.2Å; G434-L438 WeakPolarHBondContact O-CG 3.35Å; G434-L438 PolarHBondContact O-N 3.3Å; M435-L438 PolarHBondContact O-N 2.92Å; R436-L438 PolarHBondContact O-N 3.02Å; L438-I440 VanDerWaalsContact C-N 3.28Å; L438-I440 HydrophobicContact CB-CD1 4.15Å; L438-I440 HydrophobicContact CB-CG1 4.13Å; L438-I440 PolarHBondContact O-N 3.26Å; L438-I452 HydrophobicContact CD1-CG1 4.4Å; L438-I452 HydrophobicContact CD1-CG2 4.07Å; L438-I452 HydrophobicContact CD2-CG2 3.68Å
439	G	88.7	Confident	89.2	Confident	53 Å²	53	67.1 Å²	67.1	55%	0.546	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	71.4	19.8	-176.2	0	0	0	0	0	114.1	M435 R436 C437	M435-G439 PolarHBondContact O-N 3.49Å; R436-G439 PolarHBondContact O-N 3.26Å; C437-G439 VanDerWaalsContact C-N 3.26Å; C437-G439 PolarHBondContact O-N 2.86Å
440	I	90.8	Very high	89.2	Confident	6 Å²	6	59.9 Å²	59.9	3%	0.031	34%	0.344	C	S	.	.			trans	-104.5	129.2	-179	-54.8	176.4	0	0	0	109.2	M435 L438 N442 F446 A455 V456 W459	M435-I440 CarbonylContact C-O 3.45Å; M435-I440 HydrophobicContact CE-CB 3.91Å; M435-I440 HydrophobicContact CE-CG2 3.51Å; M435-I440 PolarHBondContact O-N 3.49Å; M435-I440 VanDerWaalsContact O-O 3.1Å; L438-I440 VanDerWaalsContact C-N 3.28Å; L438-I440 HydrophobicContact CB-CD1 4.15Å; L438-I440 HydrophobicContact CB-CG1 4.13Å; L438-I440 PolarHBondContact O-N 3.26Å; I440-N442 PolarHBondContact O-N 3Å; I440-F446 HydrophobicContact CG2-CD1 4.23Å; I440-F446 HydrophobicContact CG2-CD2 4.09Å; I440-F446 HydrophobicContact CG2-CE1 3.71Å; I440-F446 HydrophobicContact CG2-CE2 3.55Å; I440-F446 HydrophobicContact CG2-CG 4.41Å; I440-F446 HydrophobicContact CG2-CZ 3.34Å; I440-A455 HydrophobicContact CD1-CB 3.95Å; I440-V456 HydrophobicContact CD1-CG2 4.2Å; I440-W459 HydrophobicContact CD1-CB 4.07Å; I440-W459 HydrophobicContact CG1-CB 4.1Å; I440-W459 HydrophobicContact CG1-CG 4.01Å; I440-W459 HydrophobicContact CG2-CB 4.17Å; I440-W459 HydrophobicContact CG2-CD2 4.28Å; I440-W459 HydrophobicContact CG2-CG 4.14Å
441	P	87.4	Confident	89.4	Confident	58 Å²	58	58.3 Å²	58.3	38%	0.377	34%	0.342	S	S	.	.			trans	-69.6	128	175.8	28.3	-33.3	0	0	0	111	T443 F446 W459	P441-T443 HydrophobicContact CB-CG2 4.29Å; P441-T443 PolarHBondContact O-N 3.18Å; P441-F446 WeakPolarHBondContact O-CD2 3.16Å; P441-W459 HydrophobicContact CG-CE3 4.35Å; P441-W459 HydrophobicContact CG-CH2 3.54Å; P441-W459 HydrophobicContact CG-CZ2 4.15Å; P441-W459 HydrophobicContact CG-CZ3 3.65Å
442	N	86.3	Confident	89.4	Confident	69 Å²	69	60.9 Å²	60.9	37%	0.369	36%	0.355	S	S	.	.			trans	-72.1	91.2	178.8	-168.6	15.3	0	0	0	110.8	F426 A432 M435 I440	F426-N442 PolarHBondContact O-ND2 3.43Å; A432-N442 WeakPolarHBondContact CB-ND2 3.46Å; M435-N442 HydrophobicContact CB-CB 4.41Å; I440-N442 PolarHBondContact O-N 3Å
443	T	87.3	Confident	89.5	Confident	57 Å²	57	67 Å²	67	35%	0.35	38%	0.379	S	S	.	.			trans	-121.6	162.3	-179.6	60	0	0	0	0	110.2	P441 H445 F446	P441-T443 HydrophobicContact CB-CG2 4.29Å; P441-T443 PolarHBondContact O-N 3.18Å; T443-H445 PolarHBondContact O-N 3.08Å; T443-F446 PolarHBondContact O-N 3.47Å; T443-F446 WeakPolarHBondContact OG1-CD2 3.29Å
444	A	86.3	Confident	89.6	Confident	95 Å²	95	67.3 Å²	67.3	79%	0.785	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-57.6	-19.9	-178.2	0	0	0	0	0	114.4	F446 A447	A444-F446 PolarHBondContact O-N 3.14Å; A444-A447 WeakPolarHBondContact O-CB 3.31Å; A444-A447 PolarHBondContact O-N 3.42Å
445	H	86.2	Confident	89.6	Confident	122 Å²	122	66.7 Å²	66.7	57%	0.565	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-61.4	-23.4	174.1	-61.6	-67.9	0	0	0	113.6	T443 L462	T443-H445 PolarHBondContact O-N 3.08Å; H445-L462 HydrophobicContact CB-CD1 4.12Å
446	F	88.7	Confident	89.6	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.009	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-100.3	9.5	-179.4	-59.8	-79.8	0	0	0	113.1	M435 I440 P441 T443 A444 N448 V449 L458 W459 L462	M435-F446 HydrophobicContact CE-CB 3.69Å; M435-F446 HydrophobicContact CE-CD1 3.87Å; M435-F446 HydrophobicContact CE-CD2 4.05Å; M435-F446 HydrophobicContact CE-CG 3.59Å; I440-F446 HydrophobicContact CG2-CD1 4.23Å; I440-F446 HydrophobicContact CG2-CD2 4.09Å; I440-F446 HydrophobicContact CG2-CE1 3.71Å; I440-F446 HydrophobicContact CG2-CE2 3.55Å; I440-F446 HydrophobicContact CG2-CG 4.41Å; I440-F446 HydrophobicContact CG2-CZ 3.34Å; P441-F446 WeakPolarHBondContact O-CD2 3.16Å; T443-F446 PolarHBondContact O-N 3.47Å; T443-F446 WeakPolarHBondContact OG1-CD2 3.29Å; A444-F446 PolarHBondContact O-N 3.14Å; F446-N448 PolarHBondContact O-N 3.28Å; F446-V449 PolarHBondContact O-N 3.37Å; F446-L458 HydrophobicContact CD1-CD2 3.83Å; F446-L458 HydrophobicContact CD1-CG 4.45Å; F446-L458 HydrophobicContact CE1-CB 4.15Å; F446-L458 HydrophobicContact CE1-CD2 3.89Å; F446-L458 HydrophobicContact CE1-CG 4.01Å; F446-W459 HydrophobicContact CE1-CB 4.16Å; F446-W459 HydrophobicContact CE2-CE3 4.39Å; F446-W459 HydrophobicContact CZ-CB 4Å; F446-W459 HydrophobicContact CZ-CD2 4.47Å; F446-W459 AromaticContact CZ-CE3 3.9Å; F446-W459 HydrophobicContact CZ-CE3 3.9Å; F446-L462 HydrophobicContact CE2-CD1 4.35Å; F446-L462 HydrophobicContact CZ-CD1 3.91Å
447	A	86.1	Confident	89.7	Confident	53 Å²	53	64.3 Å²	64.3	44%	0.438	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.1	135.9	173.7	0	0	0	0	0	110.4	A444 V449	A444-A447 WeakPolarHBondContact O-CB 3.31Å; A444-A447 PolarHBondContact O-N 3.42Å; A447-V449 PolarHBondContact O-N 2.88Å
448	N	88.1	Confident	89.6	Confident	111 Å²	111	62.5 Å²	62.5	59%	0.594	37%	0.368	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.3	5.8	-175.8	-51.5	-46.1	0	0	0	116.1	F446	F446-N448 PolarHBondContact O-N 3.28Å
449	V	90.3	Very high	89.7	Confident	24 Å²	24	62.8 Å²	62.8	15%	0.145	37%	0.365	C	S	.	.			trans	-87.6	117.7	173.8	-174.5	0	0	0	0	109.3	I410 F426 F446 A447 D454 A455 L458	I410-V449 WeakPolarHBondContact CD1-O 3.27Å; F426-V449 WeakPolarHBondContact CE1-O 3.4Å; F446-V449 PolarHBondContact O-N 3.37Å; A447-V449 PolarHBondContact O-N 2.88Å; V449-D454 HydrophobicContact CG1-CB 3.96Å; V449-A455 HydrophobicContact CG1-CB 3.81Å; V449-L458 HydrophobicContact CG2-CD2 4.2Å
450	T	90.7	Very high	89.8	Confident	36 Å²	36	63.5 Å²	63.5	22%	0.221	36%	0.362	C	S	.	.			trans	-114.1	-27.7	-171.9	59	0	0	0	0	113.2	E409 I410 F422 F426	E409-T450 VanDerWaalsContact CB-O 3.24Å; E409-T450 WeakPolarHBondContact CB-O 3.27Å; E409-T450 PolarHBondContact N-O 2.93Å; E409-T450 VanDerWaalsContact N-O 3.15Å; I410-T450 WeakPolarHBondContact CG1-O 3.49Å; I410-T450 PolarHBondContact N-O 3.45Å; F422-T450 HydrophobicContact CE1-CG2 4.06Å; F422-T450 HydrophobicContact CE2-CG2 4.44Å; F422-T450 HydrophobicContact CZ-CG2 3.45Å; F422-T450 VanDerWaalsContact CZ-CG2 3.45Å; F426-T450 HydrophobicContact CE1-CG2 4.42Å; F426-T450 HydrophobicContact CZ-CG2 3.97Å
451	Q	93.2	Very high	89.8	Confident	89 Å²	89	69.7 Å²	69.7	42%	0.416	39%	0.388	S	S	.	.	S	Bend	trans	-87.2	141.8	178.5	-63.3	-173.8	12.9	0	0	110.5	E409 D454 A455	E409-Q451 VanDerWaalsContact OE2-CA 3.31Å; E409-Q451 WeakPolarHBondContact OE2-CA 3.32Å; Q451-D454 HydrophobicContact CB-CB 4.29Å; Q451-A455 PolarHBondContact O-N 2.85Å
452	I	91.1	Very high	89.8	Confident	56 Å²	56	68.3 Å²	68.3	29%	0.287	38%	0.378	S	S	.	.	H	α-helix	trans	-68.7	-41.1	-177.4	-64.3	172.7	0	0	0	110.3	E409 I410 L438 D454 A455 V456	E409-I452 HydrophobicContact CG-CD1 4.16Å; E409-I452 HydrophobicContact CG-CG1 4.22Å; E409-I452 PolarHBondContact OE2-N 3.03Å; I410-I452 HydrophobicContact CG1-CG1 3.87Å; L438-I452 HydrophobicContact CD1-CG1 4.4Å; L438-I452 HydrophobicContact CD1-CG2 4.07Å; L438-I452 HydrophobicContact CD2-CG2 3.68Å; I452-D454 PolarHBondContact O-N 3.34Å; I452-A455 PolarHBondContact O-N 3.38Å; I452-V456 HydrophobicContact CG2-CG2 4.41Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 2.71Å
453	E	92.7	Very high	89.8	Confident	151 Å²	151	71.4 Å²	71.4	71%	0.706	39%	0.388	S	S	*	.	H	α-helix	trans	-60.2	-45.5	-179.2	-60.8	-177.1	176.8	0	0	112	A455 V456 S457	E453-A455 PolarHBondContact O-N 2.9Å; E453-V456 PolarHBondContact O-N 2.88Å; E453-S457 WeakPolarHBondContact O-CB 3.25Å; E453-S457 PolarHBondContact O-N 2.92Å
454	D	92.2	Very high	89.7	Confident	86 Å²	86	72.1 Å²	72.1	46%	0.46	40%	0.395	S	S	.	.	H	α-helix	trans	-63.6	-41.9	178.1	-72	-23.7	0	0	0	112	V449 Q451 I452 S457 L458	V449-D454 HydrophobicContact CG1-CB 3.96Å; Q451-D454 HydrophobicContact CB-CB 4.29Å; I452-D454 PolarHBondContact O-N 3.34Å; D454-S457 PolarHBondContact O-N 3.04Å; D454-L458 VanDerWaalsContact O-CB 3.27Å; D454-L458 WeakPolarHBondContact O-CB 3.45Å; D454-L458 PolarHBondContact O-N 3.48Å
455	A	91.6	Very high	89.7	Confident	0 Å²	0	72.9 Å²	72.9	0%	0	38%	0.383	C	S	.	.	H	α-helix	trans	-63	-44.4	178.3	0	0	0	0	0	111.7	I410 I440 V449 Q451 I452 E453 L458 W459	I410-A455 HydrophobicContact CD1-CB 4.19Å; I440-A455 HydrophobicContact CD1-CB 3.95Å; V449-A455 HydrophobicContact CG1-CB 3.81Å; Q451-A455 PolarHBondContact O-N 2.85Å; I452-A455 PolarHBondContact O-N 3.38Å; E453-A455 PolarHBondContact O-N 2.9Å; A455-L458 PolarHBondContact O-N 3.25Å; A455-W459 WeakPolarHBondContact O-CB 3.15Å; A455-W459 PolarHBondContact O-N 3.17Å
456	V	91.6	Very high	89.5	Confident	65 Å²	65	73.3 Å²	73.3	39%	0.394	38%	0.383	S	S	.	.	H	α-helix	trans	-67.5	-40.8	178.6	174.7	0	0	0	0	111.5	I440 I452 E453 W459 S460	I440-V456 HydrophobicContact CD1-CG2 4.2Å; I452-V456 HydrophobicContact CG2-CG2 4.41Å; I452-V456 WeakPolarHBondContact O-CG2 3.34Å; I452-V456 PolarHBondContact O-N 2.71Å; E453-V456 PolarHBondContact O-N 2.88Å; V456-W459 PolarHBondContact O-N 3.26Å; V456-S460 WeakPolarHBondContact O-CB 3.25Å; V456-S460 PolarHBondContact O-N 3.08Å; V456-S460 PolarHBondContact O-OG 2.93Å
457	S	92.6	Very high	89	Confident	60 Å²	60	76.1 Å²	76.1	42%	0.42	40%	0.403	S	S	.	.	H	α-helix	trans	-62.8	-46.2	176.1	-177.7	0	0	0	0	111.7	E453 D454 S460 K461	E453-S457 WeakPolarHBondContact O-CB 3.25Å; E453-S457 PolarHBondContact O-N 2.92Å; D454-S457 PolarHBondContact O-N 3.04Å; S457-S460 PolarHBondContact O-N 3.05Å; S457-K461 PolarHBondContact O-N 2.94Å; S457-K461 VanDerWaalsContact O-N 3.08Å
458	L	90.9	Very high	88.5	Confident	57 Å²	57	77.7 Å²	77.7	30%	0.298	41%	0.411	S	S	.	.	H	α-helix	trans	-63.5	-42.9	177.2	-176.4	62.1	0	0	0	111.6	F446 V449 D454 A455 S460 K461 L462	F446-L458 HydrophobicContact CD1-CD2 3.83Å; F446-L458 HydrophobicContact CD1-CG 4.45Å; F446-L458 HydrophobicContact CE1-CB 4.15Å; F446-L458 HydrophobicContact CE1-CD2 3.89Å; F446-L458 HydrophobicContact CE1-CG 4.01Å; V449-L458 HydrophobicContact CG2-CD2 4.2Å; D454-L458 VanDerWaalsContact O-CB 3.27Å; D454-L458 WeakPolarHBondContact O-CB 3.45Å; D454-L458 PolarHBondContact O-N 3.48Å; A455-L458 PolarHBondContact O-N 3.25Å; L458-S460 VanDerWaalsContact C-N 3.35Å; L458-S460 PolarHBondContact O-N 3.26Å; L458-K461 PolarHBondContact O-N 3.02Å; L458-L462 HydrophobicContact CG-CD1 4.17Å; L458-L462 WeakPolarHBondContact O-CG 3.12Å; L458-L462 PolarHBondContact O-N 2.91Å
459	W	91.1	Very high	88	Confident	69 Å²	69	79.9 Å²	79.9	26%	0.261	42%	0.417	S	S	.	.	H	α-helix	trans	-63	-41.2	176.8	178.5	-129.5	0	0	0	112.3	I440 P441 F446 A455 V456 K461 L462 K463	I440-W459 HydrophobicContact CD1-CB 4.07Å; I440-W459 HydrophobicContact CG1-CB 4.1Å; I440-W459 HydrophobicContact CG1-CG 4.01Å; I440-W459 HydrophobicContact CG2-CB 4.17Å; I440-W459 HydrophobicContact CG2-CD2 4.28Å; I440-W459 HydrophobicContact CG2-CG 4.14Å; P441-W459 HydrophobicContact CG-CE3 4.35Å; P441-W459 HydrophobicContact CG-CH2 3.54Å; P441-W459 HydrophobicContact CG-CZ2 4.15Å; P441-W459 HydrophobicContact CG-CZ3 3.65Å; F446-W459 HydrophobicContact CE1-CB 4.16Å; F446-W459 HydrophobicContact CE2-CE3 4.39Å; F446-W459 HydrophobicContact CZ-CB 4Å; F446-W459 HydrophobicContact CZ-CD2 4.47Å; F446-W459 AromaticContact CZ-CE3 3.9Å; F446-W459 HydrophobicContact CZ-CE3 3.9Å; A455-W459 WeakPolarHBondContact O-CB 3.15Å; A455-W459 PolarHBondContact O-N 3.17Å; V456-W459 PolarHBondContact O-N 3.26Å; W459-K461 VanDerWaalsContact C-N 3.34Å; W459-K461 PolarHBondContact O-N 3.17Å; W459-L462 HydrophobicContact CE3-CB 4.33Å; W459-L462 PolarHBondContact O-N 3.3Å; W459-K463 VanDerWaalsContact O-CB 3.27Å; W459-K463 WeakPolarHBondContact O-CB 3.49Å; W459-K463 PolarHBondContact O-N 3.43Å
460	S	90.2	Very high	87.3	Confident	68 Å²	68	87.9 Å²	87.9	48%	0.476	45%	0.445	S	S	.	.	H	α-helix	trans	-61.8	-42	176.9	-60.5	0	0	0	0	111.8	V456 S457 L458 S464	V456-S460 WeakPolarHBondContact O-CB 3.25Å; V456-S460 PolarHBondContact O-N 3.08Å; V456-S460 PolarHBondContact O-OG 2.93Å; S457-S460 PolarHBondContact O-N 3.05Å; L458-S460 VanDerWaalsContact C-N 3.35Å; L458-S460 PolarHBondContact O-N 3.26Å; S460-S464 WeakPolarHBondContact O-CB 3.48Å; S460-S464 PolarHBondContact O-N 3.27Å
461	K	90.6	Very high	86.6	Confident	135 Å²	135	93.1 Å²	93.1	59%	0.587	46%	0.461	S	S	*	.	H	α-helix	trans	-63.5	-48	174.2	-72.5	-179.8	-176.9	175.6	0	112.2	S457 L458 W459 K463 S464 Q465	S457-K461 PolarHBondContact O-N 2.94Å; S457-K461 VanDerWaalsContact O-N 3.08Å; L458-K461 PolarHBondContact O-N 3.02Å; W459-K461 VanDerWaalsContact C-N 3.34Å; W459-K461 PolarHBondContact O-N 3.17Å; K461-K463 VanDerWaalsContact C-N 3.32Å; K461-K463 PolarHBondContact O-N 3.31Å; K461-S464 WeakPolarHBondContact O-CB 3.49Å; K461-S464 PolarHBondContact O-N 3.47Å; K461-Q465 PolarHBondContact O-N 2.97Å
462	L	87.7	Confident	85.7	Confident	29 Å²	29	93.5 Å²	93.5	15%	0.152	46%	0.462	C	S	.	.	H	α-helix	trans	-62.9	-38.8	178.9	-75	171.5	0	0	0	112.2	H445 F446 L458 W459 K466	H445-L462 HydrophobicContact CB-CD1 4.12Å; F446-L462 HydrophobicContact CE2-CD1 4.35Å; F446-L462 HydrophobicContact CZ-CD1 3.91Å; L458-L462 HydrophobicContact CG-CD1 4.17Å; L458-L462 WeakPolarHBondContact O-CG 3.12Å; L458-L462 PolarHBondContact O-N 2.91Å; W459-L462 HydrophobicContact CE3-CB 4.33Å; W459-L462 PolarHBondContact O-N 3.3Å; L462-K466 WeakPolarHBondContact O-CB 3.41Å; L462-K466 WeakPolarHBondContact O-CG 3.43Å; L462-K466 PolarHBondContact O-N 3.38Å
463	K	86.9	Confident	84.8	Confident	134 Å²	134	93 Å²	93	58%	0.583	46%	0.463	S	S	*	.	H	α-helix	trans	-65.7	-42.2	176.3	-169.5	178.3	-177.6	-177.4	0	111.2	W459 K461 S467	W459-K463 VanDerWaalsContact O-CB 3.27Å; W459-K463 WeakPolarHBondContact O-CB 3.49Å; W459-K463 PolarHBondContact O-N 3.43Å; K461-K463 VanDerWaalsContact C-N 3.32Å; K461-K463 PolarHBondContact O-N 3.31Å; K463-S467 VanDerWaalsContact O-CB 3.27Å; K463-S467 WeakPolarHBondContact O-CB 3.48Å; K463-S467 PolarHBondContact O-N 3.39Å; K463-S467 PolarHBondContact O-OG 3.44Å
464	S	86.2	Confident	83.7	Confident	72 Å²	72	90.2 Å²	90.2	50%	0.503	45%	0.453	S	S	.	.	H	α-helix	trans	-61.3	-51.2	175	-174.6	0	0	0	0	111.4	S460 K461 K466 S467 S468	S460-S464 WeakPolarHBondContact O-CB 3.48Å; S460-S464 PolarHBondContact O-N 3.27Å; K461-S464 WeakPolarHBondContact O-CB 3.49Å; K461-S464 PolarHBondContact O-N 3.47Å; S464-K466 PolarHBondContact O-N 2.93Å; S464-S467 WeakPolarHBondContact CA-OG 3.37Å; S464-S467 PolarHBondContact O-N 3.37Å; S464-S467 VanDerWaalsContact O-N 3.08Å; S464-S467 PolarHBondContact O-OG 2.95Å; S464-S468 PolarHBondContact O-N 3.37Å; S464-S468 PolarHBondContact O-OG 3.48Å
465	Q	85.8	Confident	82.8	Confident	112 Å²	112	89.8 Å²	89.8	52%	0.523	45%	0.453	S	S	.	.	H	α-helix	trans	-58.4	-47.5	177.7	-76.2	179.4	-32.1	0	0	112.5	K461 S467 S468 E469	K461-Q465 PolarHBondContact O-N 2.97Å; Q465-S467 VanDerWaalsContact C-N 3.28Å; Q465-S467 PolarHBondContact O-N 2.96Å; Q465-S468 WeakPolarHBondContact CA-OG 3.17Å; Q465-S468 PolarHBondContact O-N 3.39Å; Q465-S468 PolarHBondContact O-OG 3.21Å; Q465-E469 WeakPolarHBondContact O-CG 3.18Å; Q465-E469 PolarHBondContact O-N 3.44Å
466	K	81.6	Confident	81.9	Confident	131 Å²	131	94.5 Å²	94.5	57%	0.57	48%	0.475	S	S	*	.	H	α-helix	trans	-64.8	-32.1	176.1	-77.2	-171.2	176.4	-174.9	0	112.9	L462 S464 R470	L462-K466 WeakPolarHBondContact O-CB 3.41Å; L462-K466 WeakPolarHBondContact O-CG 3.43Å; L462-K466 PolarHBondContact O-N 3.38Å; S464-K466 PolarHBondContact O-N 2.93Å; K466-R470 VanDerWaalsContact O-CB 3.27Å; K466-R470 WeakPolarHBondContact O-CB 3.34Å; K466-R470 PolarHBondContact O-N 3.18Å; K466-R470 VanDerWaalsContact O-N 3.16Å
467	S	77.9	Confident	81.2	Confident	60 Å²	60	93.9 Å²	93.9	42%	0.42	47%	0.468	S	S	.	.	H	α-helix	trans	-72.7	-32.2	176.5	69.9	0	0	0	0	112.9	K463 S464 Q465	K463-S467 VanDerWaalsContact O-CB 3.27Å; K463-S467 WeakPolarHBondContact O-CB 3.48Å; K463-S467 PolarHBondContact O-N 3.39Å; K463-S467 PolarHBondContact O-OG 3.44Å; S464-S467 WeakPolarHBondContact CA-OG 3.37Å; S464-S467 PolarHBondContact O-N 3.37Å; S464-S467 VanDerWaalsContact O-N 3.08Å; S464-S467 PolarHBondContact O-OG 2.95Å; Q465-S467 VanDerWaalsContact C-N 3.28Å; Q465-S467 PolarHBondContact O-N 2.96Å
468	S	76.5	Confident	80.8	Confident	87 Å²	87	98.1 Å²	98.1	61%	0.608	48%	0.481	S	S	*	.	H	α-helix	trans	-76.6	-30	174	52.8	0	0	0	0	113.3	S464 Q465 R470	S464-S468 PolarHBondContact O-N 3.37Å; S464-S468 PolarHBondContact O-OG 3.48Å; Q465-S468 WeakPolarHBondContact CA-OG 3.17Å; Q465-S468 PolarHBondContact O-N 3.39Å; Q465-S468 PolarHBondContact O-OG 3.21Å; S468-R470 VanDerWaalsContact C-N 3.34Å
469	E	76.4	Confident	80.2	Confident	156 Å²	156	99.2 Å²	99.2	73%	0.729	48%	0.482	S	S	*	.	H	α-helix	trans	-80.7	-16.7	175.9	-71.9	174	176	0	0	112.8	Q465 W471	Q465-E469 WeakPolarHBondContact O-CG 3.18Å; Q465-E469 PolarHBondContact O-N 3.44Å; E469-W471 PolarHBondContact O-N 3.28Å
470	R	76.9	Confident	79.6	Confident	192 Å²	192	102.1 Å²	102.1	73%	0.725	50%	0.499	S	S	*	.	S	Bend	trans	-81.5	103.9	-179.1	-175.2	177.9	-175.8	-178.6	0.7	109.7	K466 S468 Q472	K466-R470 VanDerWaalsContact O-CB 3.27Å; K466-R470 WeakPolarHBondContact O-CB 3.34Å; K466-R470 PolarHBondContact O-N 3.18Å; K466-R470 VanDerWaalsContact O-N 3.16Å; S468-R470 VanDerWaalsContact C-N 3.34Å; R470-Q472 WeakPolarHBondContact O-CG 3.4Å; R470-Q472 PolarHBondContact O-N 2.96Å
471	W	74.9	Confident	79	Confident	147 Å²	147	100.3 Å²	100.3	56%	0.557	48%	0.483	S	S	*	.			trans	-46.7	123.3	172.2	-176.6	72.5	0	0	0	111.6	E469 P473 E477	E469-W471 PolarHBondContact O-N 3.28Å; W471-P473 HydrophobicContact CE3-CB 4.24Å; W471-P473 HydrophobicContact CE3-CG 3.81Å; W471-P473 HydrophobicContact CH2-CB 3.47Å; W471-P473 VanDerWaalsContact CH2-CB 3.47Å; W471-P473 HydrophobicContact CH2-CG 3.91Å; W471-P473 HydrophobicContact CZ2-CB 4.15Å; W471-P473 HydrophobicContact CZ3-CB 3.53Å; W471-P473 HydrophobicContact CZ3-CG 3.38Å; W471-P473 WeakPolarHBondContact O-CD 3.32Å; W471-E477 HydrophobicContact CH2-CB 4.44Å; W471-E477 HydrophobicContact CH2-CG 4.5Å; W471-E477 HydrophobicContact CZ2-CB 4.02Å; W471-E477 HydrophobicContact CZ2-CG 4.28Å
472	Q	74.2	Confident	78.4	Confident	97 Å²	97	98.6 Å²	98.6	45%	0.453	49%	0.489	S	S	.	.			trans	-105.6	100.7	178.4	-62.4	-172.2	9.8	0	0	110.7	R470 D474 T475 E476	R470-Q472 WeakPolarHBondContact O-CG 3.4Å; R470-Q472 PolarHBondContact O-N 2.96Å; Q472-D474 PolarHBondContact O-N 3.15Å; Q472-D474 VanDerWaalsContact O-N 3.16Å; Q472-T475 VanDerWaalsContact CB-OG1 3.31Å; Q472-T475 WeakPolarHBondContact CB-OG1 3.35Å; Q472-T475 PolarHBondContact O-N 3.02Å; Q472-T475 VanDerWaalsContact O-N 3.15Å; Q472-T475 PolarHBondContact OE1-OG1 2.88Å; Q472-E476 PolarHBondContact N-OE1 2.82Å; Q472-E476 VanDerWaalsContact N-OE1 3.15Å; Q472-E476 WeakPolarHBondContact O-CB 3.35Å; Q472-E476 PolarHBondContact O-N 3.4Å
473	P	72.2	Confident	77.8	Confident	46 Å²	46	101.8 Å²	101.8	30%	0.299	51%	0.513	S	S	.	.	H	α-helix	trans	-55	-37.1	-177.5	-5.3	-0.7	0	0	0	113.8	W471 T475 E477	W471-P473 HydrophobicContact CE3-CB 4.24Å; W471-P473 HydrophobicContact CE3-CG 3.81Å; W471-P473 HydrophobicContact CH2-CB 3.47Å; W471-P473 VanDerWaalsContact CH2-CB 3.47Å; W471-P473 HydrophobicContact CH2-CG 3.91Å; W471-P473 HydrophobicContact CZ2-CB 4.15Å; W471-P473 HydrophobicContact CZ3-CB 3.53Å; W471-P473 HydrophobicContact CZ3-CG 3.38Å; W471-P473 WeakPolarHBondContact O-CD 3.32Å; P473-T475 PolarHBondContact O-N 3.49Å; P473-E477 WeakPolarHBondContact O-CB 3.5Å; P473-E477 PolarHBondContact O-N 2.95Å; P473-E477 VanDerWaalsContact O-N 3.08Å
474	D	69.7	Low	77.3	Confident	91 Å²	91	97.2 Å²	97.2	49%	0.487	50%	0.504	S	S	.	.	H	α-helix	trans	-65.1	-26.9	-176.1	-69.7	-14	0	0	0	113.7	Q472 K490	Q472-D474 PolarHBondContact O-N 3.15Å; Q472-D474 VanDerWaalsContact O-N 3.16Å; D474-K490 HydrophobicContact CB-CB 4.24Å; D474-K490 WeakPolarHBondContact O-CB 3.47Å; D474-K490 PolarHBondContact O-N 2.88Å
475	T	72.4	Confident	77	Confident	78 Å²	78	98.2 Å²	98.2	48%	0.479	50%	0.504	S	S	.	.	H	α-helix	trans	-112.5	-30.2	-173.4	10.4	0	0	0	0	113	Q472 P473	Q472-T475 VanDerWaalsContact CB-OG1 3.31Å; Q472-T475 WeakPolarHBondContact CB-OG1 3.35Å; Q472-T475 PolarHBondContact O-N 3.02Å; Q472-T475 VanDerWaalsContact O-N 3.15Å; Q472-T475 PolarHBondContact OE1-OG1 2.88Å; P473-T475 PolarHBondContact O-N 3.49Å
476	E	73.5	Confident	76.9	Confident	98 Å²	98	96.9 Å²	96.9	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-106.4	-11.3	-174.2	-62	171.6	-139.4	0	0	113.1	Q472	Q472-E476 PolarHBondContact N-OE1 2.82Å; Q472-E476 VanDerWaalsContact N-OE1 3.15Å; Q472-E476 WeakPolarHBondContact O-CB 3.35Å; Q472-E476 PolarHBondContact O-N 3.4Å
477	E	77.6	Confident	76.9	Confident	53 Å²	53	92.1 Å²	92.1	25%	0.248	49%	0.485	C	S	.	.			trans	-90.7	119.2	172.7	-158.5	-176.6	170.6	0	0	109.6	W471 P473 Y479 N488 K489	W471-E477 HydrophobicContact CH2-CB 4.44Å; W471-E477 HydrophobicContact CH2-CG 4.5Å; W471-E477 HydrophobicContact CZ2-CB 4.02Å; W471-E477 HydrophobicContact CZ2-CG 4.28Å; P473-E477 WeakPolarHBondContact O-CB 3.5Å; P473-E477 PolarHBondContact O-N 2.95Å; P473-E477 VanDerWaalsContact O-N 3.08Å; E477-Y479 HydrophobicContact CB-CE2 4.32Å; E477-Y479 HydrophobicContact CG-CE2 3.74Å; E477-Y479 PolarHBondContact OE1-OH 2.95Å; E477-N488 CarbonylContact O-C 3.57Å; E477-N488 WeakPolarHBondContact O-CA 3.46Å; E477-K489 HydrophobicContact CB-CB 4.33Å; E477-K489 PolarHBondContact O-N 3.1Å; E477-K489 IonicContact OE1-NZ 3.81Å; E477-K489 WeakPolarHBondContact OE2-CD 3.37Å; E477-K489 IonicContact OE2-NZ 3Å; E477-K489 PolarHBondContact OE2-NZ 2.89Å
478	E	82.7	Confident	77.2	Confident	148 Å²	148	91.6 Å²	91.6	69%	0.692	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-99.4	133.7	-176.9	-69.7	-177.7	170.2	0	0	111.2	V486	E478-V486 HydrophobicContact CB-CG1 3.62Å; E478-V486 HydrophobicContact CG-CG1 3.97Å; E478-V486 WeakPolarHBondContact OE2-CG1 3.47Å
479	Y	78.3	Confident	77.5	Confident	81 Å²	81	89.5 Å²	89.5	32%	0.318	46%	0.457	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120	143.4	176.5	-75.3	-103.2	0	0	0	109.4	E477 V487 K489 Y492	E477-Y479 HydrophobicContact CB-CE2 4.32Å; E477-Y479 HydrophobicContact CG-CE2 3.74Å; E477-Y479 PolarHBondContact OE1-OH 2.95Å; Y479-V487 PolarHBondContact N-O 3.24Å; Y479-V487 PolarHBondContact O-N 3.26Å; Y479-V487 VanDerWaalsContact O-O 3.05Å; Y479-K489 HydrophobicContact CD2-CB 3.73Å; Y479-K489 HydrophobicContact CD2-CG 3.99Å; Y479-K489 HydrophobicContact CE2-CB 3.61Å; Y479-K489 HydrophobicContact CE2-CD 3.97Å; Y479-K489 HydrophobicContact CE2-CG 3.52Å; Y479-Y492 HydrophobicContact CD1-CD1 4.47Å; Y479-Y492 HydrophobicContact CG-CD1 4.48Å; Y479-Y492 HydrophobicContact CG-CG 4.32Å
480	E	80.4	Confident	77.8	Confident	130 Å²	130	87.7 Å²	87.7	61%	0.607	45%	0.447	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.9	132.9	177.9	-162.4	176.3	173.8	0	0	110.2	G484 N485	E480-G484 VanDerWaalsContact OE1-CA 3.28Å; E480-G484 WeakPolarHBondContact OE1-CA 3.48Å; E480-N485 WeakPolarHBondContact CA-O 3.24Å
481	D	77.2	Confident	78.1	Confident	29 Å²	29	81.4 Å²	81.4	16%	0.155	43%	0.43	C	S	.	.			trans	-79.1	172.3	174.7	76.1	14	0	0	0	112.9	S483 G484 N485 L501	D481-S483 PolarHBondContact O-N 3.38Å; D481-S483 VanDerWaalsContact O-N 3.09Å; D481-S483 VanDerWaalsContact OD1-C 3.22Å; D481-S483 VanDerWaalsContact OD1-CA 3.26Å; D481-S483 WeakPolarHBondContact OD1-CA 3.29Å; D481-S483 WeakPolarHBondContact OD1-CB 3.48Å; D481-S483 PolarHBondContact OD1-N 3.44Å; D481-G484 PolarHBondContact O-N 2.87Å; D481-G484 PolarHBondContact OD1-N 3.28Å; D481-N485 PolarHBondContact N-O 3.22Å; D481-N485 PolarHBondContact OD1-N 3.19Å; D481-N485 PolarHBondContact OD1-ND2 3.36Å; D481-N485 WeakPolarHBondContact OD2-CB 3.35Å; D481-N485 PolarHBondContact OD2-ND2 3.01Å; D481-L501 HydrophobicContact CB-CD2 3.54Å
482	S	77.4	Confident	78.5	Confident	100 Å²	100	77.1 Å²	77.1	70%	0.699	41%	0.414	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.4	-13	179.3	57.7	0	0	0	0	114	L501	S482-L501 PolarHBondContact OG-OXT 3.49Å
483	S	75.2	Confident	78.9	Confident	96 Å²	96	76 Å²	76	67%	0.671	41%	0.409	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103	1.4	177.8	-59.9	0	0	0	0	113.1	D481	D481-S483 PolarHBondContact O-N 3.38Å; D481-S483 VanDerWaalsContact O-N 3.09Å; D481-S483 VanDerWaalsContact OD1-C 3.22Å; D481-S483 VanDerWaalsContact OD1-CA 3.26Å; D481-S483 WeakPolarHBondContact OD1-CA 3.29Å; D481-S483 WeakPolarHBondContact OD1-CB 3.48Å; D481-S483 PolarHBondContact OD1-N 3.44Å
484	G	76.6	Confident	79.5	Confident	38 Å²	38	76.9 Å²	76.9	39%	0.392	41%	0.411	S	S	.	.	S	Bend	trans	84.6	14	178.6	0	0	0	0	0	115.2	E480 D481	E480-G484 VanDerWaalsContact OE1-CA 3.28Å; E480-G484 WeakPolarHBondContact OE1-CA 3.48Å; D481-G484 PolarHBondContact O-N 2.87Å; D481-G484 PolarHBondContact OD1-N 3.28Å
485	N	80.3	Confident	80.1	Confident	92 Å²	92	74.8 Å²	74.8	49%	0.492	40%	0.4	S	S	.	.			trans	-87.2	136.5	175.7	-50	-62.5	0	0	0	110.5	E480 D481	E480-N485 WeakPolarHBondContact CA-O 3.24Å; D481-N485 PolarHBondContact N-O 3.22Å; D481-N485 PolarHBondContact OD1-N 3.19Å; D481-N485 PolarHBondContact OD1-ND2 3.36Å; D481-N485 WeakPolarHBondContact OD2-CB 3.35Å; D481-N485 PolarHBondContact OD2-ND2 3.01Å
486	V	82.4	Confident	80.5	Confident	85 Å²	85	77.6 Å²	77.6	52%	0.515	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.1	121.5	178.3	-175.4	0	0	0	0	109.8	E478	E478-V486 HydrophobicContact CB-CG1 3.62Å; E478-V486 HydrophobicContact CG-CG1 3.97Å; E478-V486 WeakPolarHBondContact OE2-CG1 3.47Å
487	V	82.3	Confident	81.1	Confident	31 Å²	31	82 Å²	82	19%	0.188	42%	0.418	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.2	177.4	-70.4	0	0	0	0	110	Y479 T491 Y492	Y479-V487 PolarHBondContact N-O 3.24Å; Y479-V487 PolarHBondContact O-N 3.26Å; Y479-V487 VanDerWaalsContact O-O 3.05Å; V487-T491 HydrophobicContact CB-CG2 4.39Å; V487-T491 HydrophobicContact CG1-CG2 4.47Å; V487-Y492 HydrophobicContact CG2-CD2 3.83Å; V487-Y492 HydrophobicContact CG2-CG 4.34Å
488	N	84.5	Confident	81.4	Confident	49 Å²	49	85.8 Å²	85.8	26%	0.262	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.2	156	174	68.1	34.4	0	0	0	110.8	E477 K490 T491 Y492	E477-N488 CarbonylContact O-C 3.57Å; E477-N488 WeakPolarHBondContact O-CA 3.46Å; N488-K490 VanDerWaalsContact C-N 3.27Å; N488-K490 PolarHBondContact O-N 3.07Å; N488-K490 PolarHBondContact OD1-N 3.44Å; N488-T491 PolarHBondContact O-N 3.01Å; N488-T491 VanDerWaalsContact O-N 3.14Å; N488-T491 WeakPolarHBondContact OD1-CB 3.44Å; N488-T491 PolarHBondContact OD1-N 3.26Å; N488-T491 PolarHBondContact OD1-OG1 2.95Å; N488-Y492 PolarHBondContact O-N 3.46Å
489	K	82.4	Confident	81.3	Confident	42 Å²	42	81.8 Å²	81.8	18%	0.183	43%	0.434	C	S	.	.	H	α-helix	trans	-51.1	-44.2	-176.9	-174.4	-175.8	-156.8	157.7	0	113.4	E477 Y479 Y492 E493	E477-K489 HydrophobicContact CB-CB 4.33Å; E477-K489 PolarHBondContact O-N 3.1Å; E477-K489 IonicContact OE1-NZ 3.81Å; E477-K489 WeakPolarHBondContact OE2-CD 3.37Å; E477-K489 IonicContact OE2-NZ 3Å; E477-K489 PolarHBondContact OE2-NZ 2.89Å; Y479-K489 HydrophobicContact CD2-CB 3.73Å; Y479-K489 HydrophobicContact CD2-CG 3.99Å; Y479-K489 HydrophobicContact CE2-CB 3.61Å; Y479-K489 HydrophobicContact CE2-CD 3.97Å; Y479-K489 HydrophobicContact CE2-CG 3.52Å; K489-Y492 WeakPolarHBondContact O-CB 3.33Å; K489-Y492 PolarHBondContact O-N 2.98Å; K489-E493 HydrophobicContact CG-CG 4.48Å; K489-E493 WeakPolarHBondContact O-CG 3.36Å; K489-E493 PolarHBondContact O-N 2.98Å
490	K	83	Confident	80.9	Confident	119 Å²	119	83.5 Å²	83.5	52%	0.517	45%	0.448	S	S	.	.	H	α-helix	trans	-63	-46.3	-178.3	-173.8	177.3	179.8	179.9	0	111.6	D474 N488 Y492 E493 D494	D474-K490 HydrophobicContact CB-CB 4.24Å; D474-K490 WeakPolarHBondContact O-CB 3.47Å; D474-K490 PolarHBondContact O-N 2.88Å; N488-K490 VanDerWaalsContact C-N 3.27Å; N488-K490 PolarHBondContact O-N 3.07Å; N488-K490 PolarHBondContact OD1-N 3.44Å; K490-Y492 VanDerWaalsContact C-N 3.34Å; K490-E493 PolarHBondContact O-N 2.9Å; K490-D494 WeakPolarHBondContact O-CB 3.38Å; K490-D494 PolarHBondContact O-N 2.94Å
491	T	82.4	Confident	80.4	Confident	59 Å²	59	80.6 Å²	80.6	36%	0.362	44%	0.436	S	S	.	.	H	α-helix	trans	-65.8	-38.8	176.3	-60.4	0	0	0	0	111.1	V487 N488 D494 L495	V487-T491 HydrophobicContact CB-CG2 4.39Å; V487-T491 HydrophobicContact CG1-CG2 4.47Å; N488-T491 PolarHBondContact O-N 3.01Å; N488-T491 VanDerWaalsContact O-N 3.14Å; N488-T491 WeakPolarHBondContact OD1-CB 3.44Å; N488-T491 PolarHBondContact OD1-N 3.26Å; N488-T491 PolarHBondContact OD1-OG1 2.95Å; T491-D494 PolarHBondContact O-N 3.39Å; T491-L495 HydrophobicContact CG2-CD1 3.79Å; T491-L495 HydrophobicContact CG2-CG 4.15Å; T491-L495 WeakPolarHBondContact O-CB 3.36Å; T491-L495 WeakPolarHBondContact O-CG 2.99Å; T491-L495 PolarHBondContact O-N 3.45Å
492	Y	83.1	Confident	80.5	Confident	58 Å²	58	83.2 Å²	83.2	23%	0.227	45%	0.45	C	S	.	.	H	α-helix	trans	-60.1	-49.7	174	-172.3	-90.1	0	0	0	111.6	Y479 V487 N488 K489 K490 D494 L495 K496 L501	Y479-Y492 HydrophobicContact CD1-CD1 4.47Å; Y479-Y492 HydrophobicContact CG-CD1 4.48Å; Y479-Y492 HydrophobicContact CG-CG 4.32Å; V487-Y492 HydrophobicContact CG2-CD2 3.83Å; V487-Y492 HydrophobicContact CG2-CG 4.34Å; N488-Y492 PolarHBondContact O-N 3.46Å; K489-Y492 WeakPolarHBondContact O-CB 3.33Å; K489-Y492 PolarHBondContact O-N 2.98Å; K490-Y492 VanDerWaalsContact C-N 3.34Å; Y492-D494 PolarHBondContact O-N 3.06Å; Y492-L495 PolarHBondContact O-N 3.49Å; Y492-K496 HydrophobicContact CE1-CD 4.29Å; Y492-K496 VanDerWaalsContact O-CB 3.25Å; Y492-K496 WeakPolarHBondContact O-CB 3.46Å; Y492-K496 PolarHBondContact O-N 2.91Å; Y492-L501 HydrophobicContact CD1-CD1 4.13Å; Y492-L501 HydrophobicContact CD2-CD1 3.54Å; Y492-L501 HydrophobicContact CD2-CD2 4.41Å; Y492-L501 HydrophobicContact CE1-CD1 4.21Å; Y492-L501 HydrophobicContact CE2-CD1 3.65Å; Y492-L501 HydrophobicContact CE2-CD2 4.44Å; Y492-L501 HydrophobicContact CG-CD1 3.79Å; Y492-L501 WeakPolarHBondContact O-CD1 2.9Å
493	E	82.8	Confident	80.7	Confident	74 Å²	74	82.3 Å²	82.3	35%	0.346	44%	0.437	S	S	.	.	H	α-helix	trans	-64.1	-39.3	178.8	-73.5	-170.9	-167.6	0	0	112.6	K489 K490 K496 R497	K489-E493 HydrophobicContact CG-CG 4.48Å; K489-E493 WeakPolarHBondContact O-CG 3.36Å; K489-E493 PolarHBondContact O-N 2.98Å; K490-E493 PolarHBondContact O-N 2.9Å; E493-K496 PolarHBondContact O-N 3.22Å; E493-R497 WeakPolarHBondContact O-CB 3.33Å; E493-R497 VanDerWaalsContact O-CG 3.25Å; E493-R497 WeakPolarHBondContact O-CG 3.32Å; E493-R497 PolarHBondContact O-N 3.41Å; E493-R497 IonicContact OE2-NH2 2.64Å; E493-R497 PolarHBondContact OE2-NH2 3.42Å
494	D	84.6	Confident	81	Confident	64 Å²	64	81.6 Å²	81.6	34%	0.342	42%	0.424	S	S	.	.	H	α-helix	trans	-67.5	-43.9	177.4	-77.5	-19.1	0	0	0	111.6	K490 T491 Y492 K496 R497 Q498	K490-D494 WeakPolarHBondContact O-CB 3.38Å; K490-D494 PolarHBondContact O-N 2.94Å; T491-D494 PolarHBondContact O-N 3.39Å; Y492-D494 PolarHBondContact O-N 3.06Å; D494-K496 VanDerWaalsContact C-N 3.32Å; D494-K496 PolarHBondContact O-N 3.08Å; D494-R497 PolarHBondContact O-N 3.05Å; D494-Q498 VanDerWaalsContact O-CG 3.29Å; D494-Q498 WeakPolarHBondContact O-CG 3.37Å; D494-Q498 PolarHBondContact O-N 3.19Å
495	L	82.6	Confident	81.2	Confident	46 Å²	46	84.1 Å²	84.1	24%	0.241	43%	0.426	C	S	.	.	H	α-helix	trans	-65.4	-37.4	175.1	-68.9	170.1	0	0	0	111.3	T491 Y492 Q498 G499 L500 L501	T491-L495 HydrophobicContact CG2-CD1 3.79Å; T491-L495 HydrophobicContact CG2-CG 4.15Å; T491-L495 WeakPolarHBondContact O-CB 3.36Å; T491-L495 WeakPolarHBondContact O-CG 2.99Å; T491-L495 PolarHBondContact O-N 3.45Å; Y492-L495 PolarHBondContact O-N 3.49Å; L495-Q498 CarbonylContact O-C 3.56Å; L495-Q498 PolarHBondContact O-N 3.2Å; L495-G499 PolarHBondContact O-N 3.46Å; L495-L500 HydrophobicContact CB-CB 4.47Å; L495-L500 HydrophobicContact CD2-CB 4.11Å; L495-L500 HydrophobicContact CD2-CD1 4.05Å; L495-L500 PolarHBondContact O-N 3.13Å; L495-L501 HydrophobicContact CB-CD1 3.69Å; L495-L501 HydrophobicContact CB-CD2 4.13Å; L495-L501 HydrophobicContact CB-CG 3.56Å; L495-L501 HydrophobicContact CD1-CD2 4.08Å; L495-L501 HydrophobicContact CD1-CG 4.42Å
496	K	81.7	Confident	81.3	Confident	138 Å²	138	83.6 Å²	83.6	60%	0.6	42%	0.422	S	S	*	.	H	α-helix	trans	-62.5	-43.6	174.6	-171.6	175.6	-177.8	175.2	0	111.1	Y492 E493 D494 Q498 G499 L501	Y492-K496 HydrophobicContact CE1-CD 4.29Å; Y492-K496 VanDerWaalsContact O-CB 3.25Å; Y492-K496 WeakPolarHBondContact O-CB 3.46Å; Y492-K496 PolarHBondContact O-N 2.91Å; E493-K496 PolarHBondContact O-N 3.22Å; D494-K496 VanDerWaalsContact C-N 3.32Å; D494-K496 PolarHBondContact O-N 3.08Å; K496-Q498 VanDerWaalsContact C-N 3.3Å; K496-Q498 PolarHBondContact O-N 3.26Å; K496-G499 PolarHBondContact O-N 2.86Å; K496-G499 VanDerWaalsContact O-N 3.15Å; K496-L501 HydrophobicContact CB-CD1 3.96Å
497	R	85.7	Confident	81.2	Confident	189 Å²	189	83.5 Å²	83.5	71%	0.713	42%	0.416	S	S	*	.	H	α-helix	trans	-66.7	-31.9	177	-74.4	173.3	-169.7	176.4	9.5	112.5	E493 D494 G499	E493-R497 WeakPolarHBondContact O-CB 3.33Å; E493-R497 VanDerWaalsContact O-CG 3.25Å; E493-R497 WeakPolarHBondContact O-CG 3.32Å; E493-R497 PolarHBondContact O-N 3.41Å; E493-R497 IonicContact OE2-NH2 2.64Å; E493-R497 PolarHBondContact OE2-NH2 3.42Å; D494-R497 PolarHBondContact O-N 3.05Å; R497-G499 VanDerWaalsContact C-N 3.28Å
498	Q	84.6	Confident	81.1	Confident	134 Å²	134	87.3 Å²	87.3	63%	0.626	43%	0.432	S	S	*	.	H	α-helix	trans	-79.7	-8.4	174.3	-68.2	173.4	36.8	0	0	113.2	D494 L495 K496 L500	D494-Q498 VanDerWaalsContact O-CG 3.29Å; D494-Q498 WeakPolarHBondContact O-CG 3.37Å; D494-Q498 PolarHBondContact O-N 3.19Å; L495-Q498 CarbonylContact O-C 3.56Å; L495-Q498 PolarHBondContact O-N 3.2Å; K496-Q498 VanDerWaalsContact C-N 3.3Å; K496-Q498 PolarHBondContact O-N 3.26Å; Q498-L500 HydrophobicContact CB-CD1 3.87Å; Q498-L500 HydrophobicContact CB-CG 4.05Å
499	G	79.1	Confident	80.9	Confident	63 Å²	63	90.2 Å²	90.2	65%	0.649	45%	0.445	S	S	*	.	T	Hydrogen-bonded Turn	trans	75.3	25.7	-179.5	0	0	0	0	0	114.1	L495 K496 R497	L495-G499 PolarHBondContact O-N 3.46Å; K496-G499 PolarHBondContact O-N 2.86Å; K496-G499 VanDerWaalsContact O-N 3.15Å; R497-G499 VanDerWaalsContact C-N 3.28Å
500	L	71.4	Confident	80.8	Confident	118 Å²	118	94.3 Å²	94.3	62%	0.618	47%	0.467	S	S	*	.			trans	-103.2	10.7	-173.5	-64.8	172.2	0	0	0	114	L495 Q498	L495-L500 HydrophobicContact CB-CB 4.47Å; L495-L500 HydrophobicContact CD2-CB 4.11Å; L495-L500 HydrophobicContact CD2-CD1 4.05Å; L495-L500 PolarHBondContact O-N 3.13Å; Q498-L500 HydrophobicContact CB-CD1 3.87Å; Q498-L500 HydrophobicContact CB-CG 4.05Å
501	L	68	Low	80.6	Confident	69 Å²	69	92 Å²	92	36%	0.361	46%	0.462	S	S	.	.			trans	-119.6	0	-178.6	-74.1	174.9	0	0	0	114	D481 S482 Y492 L495 K496	D481-L501 HydrophobicContact CB-CD2 3.54Å; S482-L501 PolarHBondContact OG-OXT 3.49Å; Y492-L501 HydrophobicContact CD1-CD1 4.13Å; Y492-L501 HydrophobicContact CD2-CD1 3.54Å; Y492-L501 HydrophobicContact CD2-CD2 4.41Å; Y492-L501 HydrophobicContact CE1-CD1 4.21Å; Y492-L501 HydrophobicContact CE2-CD1 3.65Å; Y492-L501 HydrophobicContact CE2-CD2 4.44Å; Y492-L501 HydrophobicContact CG-CD1 3.79Å; Y492-L501 WeakPolarHBondContact O-CD1 2.9Å; L495-L501 HydrophobicContact CB-CD1 3.69Å; L495-L501 HydrophobicContact CB-CD2 4.13Å; L495-L501 HydrophobicContact CB-CG 3.56Å; L495-L501 HydrophobicContact CD1-CD2 4.08Å; L495-L501 HydrophobicContact CD1-CG 4.42Å; K496-L501 HydrophobicContact CB-CD1 3.96Å

Retrieved 501 of 501 residues in 1927 ms (Link to these results)

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