A0A060XNV1_ONCMY Loading...

Splicing factor 3a, subunit 3

AlphaFold DB (A0A674D830), UniProt , Accession A0A060XNV1, Species ONCMY (Oncorhynchus mykiss, Rainbow trout), Gene LOC110496421, 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	56.5	Low	83.3	Confident	113 Å²	113	67.7 Å²	67.7	56%	0.557	31%	0.308	S	S	*	.				0	118.5	0	-100.1	-152.5	-69.6	0	0	106.3	T3 R87 Q90 I91	M1-T3 PolarHBondContact O-N 2.93Å; M1-R87 HydrophobicContact CE-CB 4.39Å; M1-R87 WeakPolarHBondContact CE-O 2.98Å; M1-Q90 HydrophobicContact CE-CB 3.55Å; M1-Q90 HydrophobicContact CE-CG 4.49Å; M1-Q90 VanDerWaalsContact CE-OE1 3.22Å; M1-Q90 HydrophobicContact SD-CB 4.08Å; M1-Q90 PolarHBondContact SD-OE1 2.99Å; M1-I91 HydrophobicContact CE-CD1 4.47Å; M1-I91 HydrophobicContact CE-CG1 3.79Å
2	E	65.3	Low	84.2	Confident	116 Å²	116	68.8 Å²	68.8	54%	0.542	31%	0.313	S	S	.	.			trans	-95.5	87.9	177.4	-63.2	-160.6	148.1	0	0	108.8	Q7 R10	E2-Q7 HydrophobicContact CB-CG 3.95Å; E2-Q7 PolarHBondContact OE2-NE2 3.1Å; E2-R10 IonicContact OE1-CZ 3.68Å; E2-R10 IonicContact OE1-NH1 3.5Å; E2-R10 PolarHBondContact OE1-NH1 3.33Å; E2-R10 IonicContact OE1-NH2 3.42Å; E2-R10 PolarHBondContact OE1-NH2 3.33Å
3	T	82.9	Confident	84.9	Confident	41 Å²	41	67.5 Å²	67.5	25%	0.252	31%	0.308	S	S	.	.			trans	-76.1	156.2	166	51.4	0	0	0	0	109.8	M1 L5 E6 Q7 E71	M1-T3 PolarHBondContact O-N 2.93Å; T3-L5 VanDerWaalsContact C-N 3.29Å; T3-L5 PolarHBondContact O-N 3.1Å; T3-E6 PolarHBondContact O-N 3.33Å; T3-E6 VanDerWaalsContact O-N 3.15Å; T3-E6 VanDerWaalsContact OG1-CB 3.26Å; T3-E6 WeakPolarHBondContact OG1-CB 3.32Å; T3-E6 PolarHBondContact OG1-N 2.83Å; T3-Q7 WeakPolarHBondContact O-CG 3.45Å; T3-Q7 PolarHBondContact O-N 3.05Å; T3-E71 WeakPolarHBondContact CB-OE1 3.47Å; T3-E71 WeakPolarHBondContact CG2-OE1 3.29Å
4	I	86	Confident	85.5	Confident	43 Å²	43	64.1 Å²	64.1	22%	0.221	29%	0.293	C	S	.	.	H	α-helix	trans	-64.6	-40.4	-175.6	-61.1	169.3	0	0	0	109.8	E6 Q7 Q8 M67 R68 E71	I4-E6 PolarHBondContact O-N 3.47Å; I4-Q7 PolarHBondContact O-N 3.31Å; I4-Q8 WeakPolarHBondContact O-CG 3.42Å; I4-Q8 PolarHBondContact O-N 3.32Å; I4-M67 HydrophobicContact CD1-CB 3.44Å; I4-M67 VanDerWaalsContact CD1-CB 3.44Å; I4-R68 HydrophobicContact CG2-CB 4.19Å; I4-R68 HydrophobicContact CG2-CG 4.27Å; I4-E71 WeakPolarHBondContact CB-OE2 3.46Å; I4-E71 PolarHBondContact N-OE2 3.37Å
5	L	86.6	Confident	86.1	Confident	54 Å²	54	62.3 Å²	62.3	28%	0.283	28%	0.284	S	S	.	.	H	α-helix	trans	-66.5	-34.7	176.6	-63.4	179.2	0	0	0	113.1	T3 R9 R68 E71 I75	T3-L5 VanDerWaalsContact C-N 3.29Å; T3-L5 PolarHBondContact O-N 3.1Å; L5-R9 PolarHBondContact O-N 2.78Å; L5-R68 HydrophobicContact CD2-CG 4.49Å; L5-E71 PolarHBondContact N-OE2 3.44Å; L5-I75 HydrophobicContact CD1-CD1 3.49Å; L5-I75 VanDerWaalsContact CD1-CD1 3.49Å
6	E	86.4	Confident	86.6	Confident	57 Å²	57	66.6 Å²	66.6	27%	0.266	30%	0.304	S	S	.	.	H	α-helix	trans	-68	-50.5	173.9	-159.1	-51.8	137	0	0	109.2	T3 I4 Q8 R9 R10	T3-E6 PolarHBondContact O-N 3.33Å; T3-E6 VanDerWaalsContact O-N 3.15Å; T3-E6 VanDerWaalsContact OG1-CB 3.26Å; T3-E6 WeakPolarHBondContact OG1-CB 3.32Å; T3-E6 PolarHBondContact OG1-N 2.83Å; I4-E6 PolarHBondContact O-N 3.47Å; E6-Q8 PolarHBondContact O-N 2.85Å; E6-R9 CarbonylContact O-C 3.58Å; E6-R9 WeakPolarHBondContact O-CA 3.23Å; E6-R9 WeakPolarHBondContact O-CB 3.21Å; E6-R9 PolarHBondContact O-N 3.03Å; E6-R9 IonicContact OE1-NH1 2.85Å; E6-R9 PolarHBondContact OE1-NH1 3.18Å; E6-R9 VanDerWaalsContact OE1-NH1 3.14Å; E6-R10 PolarHBondContact O-N 3.43Å
7	Q	88.1	Confident	87	Confident	50 Å²	50	68 Å²	68	23%	0.234	31%	0.307	C	S	.	.	H	α-helix	trans	-53.5	-44.5	178.7	-72.6	176	-17.4	0	0	111.3	E2 T3 I4 R10 Y11	E2-Q7 HydrophobicContact CB-CG 3.95Å; E2-Q7 PolarHBondContact OE2-NE2 3.1Å; T3-Q7 WeakPolarHBondContact O-CG 3.45Å; T3-Q7 PolarHBondContact O-N 3.05Å; I4-Q7 PolarHBondContact O-N 3.31Å; Q7-R10 PolarHBondContact O-N 3.43Å; Q7-Y11 HydrophobicContact CB-CD2 4.47Å; Q7-Y11 HydrophobicContact CB-CE2 4.08Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.36Å; Q7-Y11 VanDerWaalsContact O-CG 3.31Å; Q7-Y11 PolarHBondContact O-N 3.07Å
8	Q	90.3	Very high	87.3	Confident	6 Å²	6	64.5 Å²	64.5	3%	0.028	29%	0.291	C	S	.	.	H	α-helix	trans	-60	-46.7	174.1	-73	179.5	20.5	0	0	112.5	I4 E6 R10 Y11 H12 A60 Y61	I4-Q8 WeakPolarHBondContact O-CG 3.42Å; I4-Q8 PolarHBondContact O-N 3.32Å; E6-Q8 PolarHBondContact O-N 2.85Å; Q8-R10 VanDerWaalsContact C-N 3.34Å; Q8-R10 PolarHBondContact O-N 3.19Å; Q8-Y11 PolarHBondContact O-N 3.12Å; Q8-H12 PolarHBondContact O-CD2 3.33Å; Q8-H12 PolarHBondContact O-N 3.44Å; Q8-A60 HydrophobicContact CG-CB 4.17Å; Q8-A60 PolarHBondContact NE2-O 2.85Å; Q8-Y61 PolarHBondContact OE1-OH 3.35Å
9	R	91	Very high	87.6	Confident	144 Å²	144	64.6 Å²	64.6	54%	0.543	29%	0.294	S	S	.	.	H	α-helix	trans	-57.6	-47.3	174.7	178	-161.8	163.1	-91.4	-20.7	110.8	L5 E6 H12 E13	L5-R9 PolarHBondContact O-N 2.78Å; E6-R9 CarbonylContact O-C 3.58Å; E6-R9 WeakPolarHBondContact O-CA 3.23Å; E6-R9 WeakPolarHBondContact O-CB 3.21Å; E6-R9 PolarHBondContact O-N 3.03Å; E6-R9 IonicContact OE1-NH1 2.85Å; E6-R9 PolarHBondContact OE1-NH1 3.18Å; E6-R9 VanDerWaalsContact OE1-NH1 3.14Å; R9-H12 PolarHBondContact O-N 3.19Å; R9-E13 IonicContact CZ-OE2 3.62Å; R9-E13 IonicContact NH1-OE2 4Å; R9-E13 IonicContact NH2-OE2 2.69Å; R9-E13 PolarHBondContact NH2-OE2 3.32Å; R9-E13 PolarHBondContact O-N 2.62Å
10	R	90.7	Very high	87.9	Confident	71 Å²	71	64.7 Å²	64.7	27%	0.268	30%	0.297	S	S	.	.	H	α-helix	trans	-60.6	-45.7	-179.6	-177.4	178	73.1	-170.8	-2.4	111.5	E2 E6 Q7 Q8 H12 E13 E14 M106	E2-R10 IonicContact OE1-CZ 3.68Å; E2-R10 IonicContact OE1-NH1 3.5Å; E2-R10 PolarHBondContact OE1-NH1 3.33Å; E2-R10 IonicContact OE1-NH2 3.42Å; E2-R10 PolarHBondContact OE1-NH2 3.33Å; E6-R10 PolarHBondContact O-N 3.43Å; Q7-R10 PolarHBondContact O-N 3.43Å; Q8-R10 VanDerWaalsContact C-N 3.34Å; Q8-R10 PolarHBondContact O-N 3.19Å; R10-H12 PolarHBondContact O-N 3.17Å; R10-E13 WeakPolarHBondContact O-CB 3.45Å; R10-E13 PolarHBondContact O-N 2.93Å; R10-E14 WeakPolarHBondContact O-CB 3.49Å; R10-E14 PolarHBondContact O-N 3.32Å; R10-M106 HydrophobicContact CG-CE 3.7Å
11	Y	92.7	Very high	88.1	Confident	50 Å²	50	62.1 Å²	62.1	20%	0.196	29%	0.287	C	S	.	.	H	α-helix	trans	-65.8	-36.7	177	-68	-49.4	0	0	0	112.9	Q7 Q8 E14 K15 V53 T56 V57	Q7-Y11 HydrophobicContact CB-CD2 4.47Å; Q7-Y11 HydrophobicContact CB-CE2 4.08Å; Q7-Y11 WeakPolarHBondContact O-CD2 3.36Å; Q7-Y11 VanDerWaalsContact O-CG 3.31Å; Q7-Y11 PolarHBondContact O-N 3.07Å; Q8-Y11 PolarHBondContact O-N 3.12Å; Y11-E14 PolarHBondContact O-N 2.67Å; Y11-K15 WeakPolarHBondContact O-CG 3.48Å; Y11-K15 PolarHBondContact O-N 3.2Å; Y11-V53 HydrophobicContact CD1-CG1 3.87Å; Y11-V53 HydrophobicContact CG-CG1 4.14Å; Y11-V53 WeakPolarHBondContact O-CG1 3.42Å; Y11-T56 HydrophobicContact CD2-CG2 4.5Å; Y11-T56 HydrophobicContact CE1-CG2 4.43Å; Y11-T56 HydrophobicContact CE2-CG2 3.87Å; Y11-V57 HydrophobicContact CD2-CG2 4.03Å; Y11-V57 HydrophobicContact CG-CG2 3.86Å
12	H	94.4	Very high	89.8	Confident	80 Å²	80	59.8 Å²	59.8	37%	0.37	27%	0.274	S	S	.	.	H	α-helix	trans	-66.5	-40.1	172.3	-79.6	-66.5	0	0	0	112.3	Q8 R9 R10 E14 K15 E16 Y61	Q8-H12 PolarHBondContact O-CD2 3.33Å; Q8-H12 PolarHBondContact O-N 3.44Å; R9-H12 PolarHBondContact O-N 3.19Å; R10-H12 PolarHBondContact O-N 3.17Å; H12-E14 VanDerWaalsContact C-N 3.34Å; H12-K15 PolarHBondContact O-N 2.68Å; H12-E16 PolarHBondContact O-N 3.14Å; H12-E16 VanDerWaalsContact O-N 3.09Å; H12-Y61 AromaticContact NE2-CE2 3.45Å; H12-Y61 WeakPolarHBondContact NE2-CE2 3.25Å; H12-Y61 AromaticContact NE2-CZ 3.6Å; H12-Y61 PolarHBondContact NE2-OH 3.39Å
13	E	93.3	Very high	91.1	Very high	52 Å²	52	57.9 Å²	57.9	24%	0.243	27%	0.27	C	S	.	.	H	α-helix	trans	-59.3	-47.4	172.7	179.7	167.4	-169.4	0	0	110.4	R9 R10 K15 E16 R17 M106	R9-E13 IonicContact CZ-OE2 3.62Å; R9-E13 IonicContact NH1-OE2 4Å; R9-E13 IonicContact NH2-OE2 2.69Å; R9-E13 PolarHBondContact NH2-OE2 3.32Å; R9-E13 PolarHBondContact O-N 2.62Å; R10-E13 WeakPolarHBondContact O-CB 3.45Å; R10-E13 PolarHBondContact O-N 2.93Å; E13-K15 PolarHBondContact O-N 3.43Å; E13-E16 PolarHBondContact O-N 3.39Å; E13-E16 VanDerWaalsContact O-N 3.16Å; E13-R17 HydrophobicContact CG-CG 4.41Å; E13-R17 VanDerWaalsContact O-CG 3.29Å; E13-R17 WeakPolarHBondContact O-CG 3.39Å; E13-R17 PolarHBondContact O-N 3.06Å; E13-R17 IonicContact OE1-NE 3.38Å; E13-R17 IonicContact OE1-NH2 3.21Å; E13-M106 HydrophobicContact CG-SD 4.39Å
14	E	93.2	Very high	91.5	Very high	20 Å²	20	60.6 Å²	60.6	9%	0.093	28%	0.279	C	S	.	.	H	α-helix	trans	-58.3	-45.2	178.2	-170	170.9	176.4	0	0	112.8	R10 Y11 H12 E16 R17 L18 R49 V53 M106	R10-E14 WeakPolarHBondContact O-CB 3.49Å; R10-E14 PolarHBondContact O-N 3.32Å; Y11-E14 PolarHBondContact O-N 2.67Å; H12-E14 VanDerWaalsContact C-N 3.34Å; E14-E16 VanDerWaalsContact C-N 3.34Å; E14-E16 PolarHBondContact O-N 3.27Å; E14-R17 PolarHBondContact O-N 2.86Å; E14-L18 HydrophobicContact CG-CD1 4.13Å; E14-L18 WeakPolarHBondContact O-CG 3.19Å; E14-L18 PolarHBondContact O-N 2.76Å; E14-R49 IonicContact OE1-CZ 3.47Å; E14-R49 IonicContact OE1-NE 2.67Å; E14-R49 PolarHBondContact OE1-NE 3.42Å; E14-R49 IonicContact OE1-NH2 3.94Å; E14-R49 PolarHBondContact OE1-NH2 2.7Å; E14-V53 HydrophobicContact CG-CG2 4.32Å; E14-M106 WeakPolarHBondContact CA-SD 3.3Å; E14-M106 HydrophobicContact CB-CE 3.85Å; E14-M106 HydrophobicContact CB-SD 3.53Å; E14-M106 VanDerWaalsContact CB-SD 3.53Å; E14-M106 HydrophobicContact CG-CE 4.15Å; E14-M106 HydrophobicContact CG-SD 3.95Å
15	K	94.5	Very high	91.7	Very high	38 Å²	38	58.8 Å²	58.8	17%	0.165	27%	0.269	C	S	.	.	H	α-helix	trans	-57.8	-45.8	174.5	-77	177.6	67.2	-179.4	0	112.3	Y11 H12 E13 R17 L18 L19 Y50 V53 S54	Y11-K15 WeakPolarHBondContact O-CG 3.48Å; Y11-K15 PolarHBondContact O-N 3.2Å; H12-K15 PolarHBondContact O-N 2.68Å; E13-K15 PolarHBondContact O-N 3.43Å; K15-R17 VanDerWaalsContact C-N 3.32Å; K15-R17 PolarHBondContact O-N 2.9Å; K15-L18 PolarHBondContact O-N 2.79Å; K15-L19 WeakPolarHBondContact O-CG 3.49Å; K15-L19 PolarHBondContact O-N 3.35Å; K15-Y50 HydrophobicContact CB-CD2 4.03Å; K15-Y50 HydrophobicContact CB-CE2 3.63Å; K15-Y50 HydrophobicContact CD-CE2 4.41Å; K15-Y50 VanDerWaalsContact CE-OH 3.27Å; K15-Y50 WeakPolarHBondContact CE-OH 3.32Å; K15-Y50 HydrophobicContact CG-CD2 4.04Å; 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 3.67Å; K15-S54 WeakPolarHBondContact CE-OG 3.23Å; K15-S54 PolarHBondContact NZ-OG 2.86Å
16	E	94.4	Very high	91.9	Very high	130 Å²	130	61.3 Å²	61.3	61%	0.607	28%	0.281	S	S	*	.	H	α-helix	trans	-64.8	-39.5	179.4	-162.5	68.5	-174	0	0	111.1	H12 E13 E14 L19 D20	H12-E16 PolarHBondContact O-N 3.14Å; H12-E16 VanDerWaalsContact O-N 3.09Å; E13-E16 PolarHBondContact O-N 3.39Å; E13-E16 VanDerWaalsContact O-N 3.16Å; E14-E16 VanDerWaalsContact C-N 3.34Å; E14-E16 PolarHBondContact O-N 3.27Å; E16-L19 PolarHBondContact O-N 3.42Å; E16-D20 PolarHBondContact O-N 2.94Å
17	R	92.6	Very high	92.1	Very high	91 Å²	91	65.9 Å²	65.9	34%	0.343	30%	0.304	S	S	.	.	H	α-helix	trans	-66.1	-40.3	175.7	-63.6	-60.4	-179.7	178.5	1.1	112.6	E13 E14 K15 L19 D20 A21 F110	E13-R17 HydrophobicContact CG-CG 4.41Å; E13-R17 VanDerWaalsContact O-CG 3.29Å; E13-R17 WeakPolarHBondContact O-CG 3.39Å; E13-R17 PolarHBondContact O-N 3.06Å; E13-R17 IonicContact OE1-NE 3.38Å; E13-R17 IonicContact OE1-NH2 3.21Å; E14-R17 PolarHBondContact O-N 2.86Å; K15-R17 VanDerWaalsContact C-N 3.32Å; K15-R17 PolarHBondContact O-N 2.9Å; R17-L19 VanDerWaalsContact C-N 3.31Å; R17-L19 PolarHBondContact O-N 2.82Å; R17-D20 PolarHBondContact O-N 2.61Å; R17-A21 VanDerWaalsContact O-CB 3.29Å; R17-A21 WeakPolarHBondContact O-CB 3.4Å; R17-A21 PolarHBondContact O-N 3.35Å; R17-F110 HydrophobicContact CB-CD1 4.35Å; R17-F110 HydrophobicContact CB-CD2 3.63Å; R17-F110 HydrophobicContact CB-CE1 4.04Å; R17-F110 HydrophobicContact CB-CE2 3.29Å; R17-F110 HydrophobicContact CB-CG 4.16Å; R17-F110 HydrophobicContact CB-CZ 3.52Å; R17-F110 HydrophobicContact CG-CD2 4.14Å; R17-F110 HydrophobicContact CG-CE2 3.96Å
18	L	93.6	Very high	92.1	Very high	5 Å²	5	66.8 Å²	66.8	3%	0.026	31%	0.308	C	S	.	.	H	α-helix	trans	-61.6	-40.3	174.4	-74.2	161.7	0	0	0	111.4	E14 K15 K22 M46 R49 Y50 F110	E14-L18 HydrophobicContact CG-CD1 4.13Å; E14-L18 WeakPolarHBondContact O-CG 3.19Å; E14-L18 PolarHBondContact O-N 2.76Å; K15-L18 PolarHBondContact O-N 2.79Å; L18-K22 VanDerWaalsContact O-CB 3.24Å; L18-K22 WeakPolarHBondContact O-CB 3.45Å; L18-K22 PolarHBondContact O-N 3.24Å; L18-M46 HydrophobicContact CD2-CB 4.03Å; L18-M46 HydrophobicContact CD2-CG 4.22Å; L18-R49 HydrophobicContact CD1-CB 4.31Å; L18-R49 HydrophobicContact CD1-CG 3.95Å; L18-R49 HydrophobicContact CD2-CB 4.36Å; L18-R49 HydrophobicContact CD2-CG 4.36Å; L18-Y50 HydrophobicContact CB-CD2 4.16Å; L18-Y50 HydrophobicContact CD1-CD2 4.48Å; L18-F110 HydrophobicContact CD2-CE1 3.72Å; L18-F110 HydrophobicContact CD2-CZ 4.09Å; L18-F110 HydrophobicContact CG-CE1 3.93Å; L18-F110 HydrophobicContact CG-CZ 3.94Å
19	L	93	Very high	92.1	Very high	67 Å²	67	74.5 Å²	74.5	35%	0.351	34%	0.342	S	S	.	.	H	α-helix	trans	-66.3	-42.1	175.1	-70.4	173.2	0	0	0	112.5	K15 E16 R17 T23 Y50	K15-L19 WeakPolarHBondContact O-CG 3.49Å; K15-L19 PolarHBondContact O-N 3.35Å; E16-L19 PolarHBondContact O-N 3.42Å; R17-L19 VanDerWaalsContact C-N 3.31Å; R17-L19 PolarHBondContact O-N 2.82Å; L19-T23 WeakPolarHBondContact O-CB 3.31Å; L19-T23 PolarHBondContact O-N 2.96Å; L19-T23 PolarHBondContact O-OG1 2.96Å; L19-Y50 HydrophobicContact CD1-CE2 3.85Å; L19-Y50 HydrophobicContact CD2-CD2 4.4Å; L19-Y50 HydrophobicContact CD2-CE2 3.98Å; L19-Y50 HydrophobicContact CG-CD2 4.2Å; L19-Y50 HydrophobicContact CG-CE2 3.67Å
20	D	92.5	Very high	92	Very high	65 Å²	65	70.1 Å²	70.1	35%	0.348	33%	0.327	S	S	.	.	H	α-helix	trans	-64.5	-47.2	175.9	-177.1	42.2	0	0	0	111.3	E16 R17 K22 T23 K24	E16-D20 PolarHBondContact O-N 2.94Å; R17-D20 PolarHBondContact O-N 2.61Å; D20-K22 PolarHBondContact O-N 3.44Å; D20-T23 PolarHBondContact O-N 3.41Å; D20-K24 WeakPolarHBondContact O-CG 3.32Å; D20-K24 PolarHBondContact O-N 2.95Å; D20-K24 VanDerWaalsContact OD1-CE 3.28Å; D20-K24 WeakPolarHBondContact OD1-CE 3.37Å; D20-K24 IonicContact OD1-NZ 2.85Å; D20-K24 VanDerWaalsContact OD2-CE 3.26Å; D20-K24 WeakPolarHBondContact OD2-CE 3.39Å; D20-K24 IonicContact OD2-NZ 3.68Å; D20-K24 PolarHBondContact OD2-NZ 3.37Å
21	A	91.5	Very high	91.8	Very high	12 Å²	12	70.6 Å²	70.6	10%	0.099	34%	0.337	C	S	.	.	H	α-helix	trans	-60.6	-47.1	177.7	0	0	0	0	0	111.8	R17 T23 K24 E25 M46 F110	R17-A21 VanDerWaalsContact O-CB 3.29Å; R17-A21 WeakPolarHBondContact O-CB 3.4Å; R17-A21 PolarHBondContact O-N 3.35Å; A21-T23 VanDerWaalsContact C-N 3.34Å; A21-T23 PolarHBondContact O-N 3.02Å; A21-K24 PolarHBondContact O-N 3.39Å; A21-E25 WeakPolarHBondContact O-CB 3.32Å; A21-E25 PolarHBondContact O-N 3.48Å; A21-M46 HydrophobicContact CB-CE 4.2Å; A21-M46 HydrophobicContact CB-SD 3.94Å; A21-F110 HydrophobicContact CB-CD1 3.69Å; A21-F110 HydrophobicContact CB-CE1 4.26Å
22	K	92.6	Very high	91.6	Very high	64 Å²	64	70.1 Å²	70.1	28%	0.278	34%	0.34	S	S	.	.	H	α-helix	trans	-58.4	-46.1	173.6	171.1	176.6	175.5	-175.6	0	111.6	L18 D20 K24 E25 M26 T43 M46 L47	L18-K22 VanDerWaalsContact O-CB 3.24Å; L18-K22 WeakPolarHBondContact O-CB 3.45Å; L18-K22 PolarHBondContact O-N 3.24Å; D20-K22 PolarHBondContact O-N 3.44Å; K22-K24 VanDerWaalsContact C-N 3.33Å; K22-K24 PolarHBondContact O-N 3.25Å; K22-E25 WeakPolarHBondContact O-CB 3.28Å; K22-E25 PolarHBondContact O-N 2.95Å; K22-M26 HydrophobicContact CG-CG 4.34Å; K22-M26 VanDerWaalsContact O-CG 3.29Å; K22-M26 WeakPolarHBondContact O-CG 3.49Å; K22-M26 PolarHBondContact O-N 3.34Å; K22-T43 HydrophobicContact CD-CG2 4.03Å; K22-T43 HydrophobicContact CG-CG2 3.93Å; K22-M46 HydrophobicContact CB-SD 4.36Å; K22-L47 HydrophobicContact CD-CD2 4.06Å; K22-L47 HydrophobicContact CD-CG 4.36Å
23	T	92.6	Very high	91.3	Very high	75 Å²	75	69.7 Å²	69.7	46%	0.46	34%	0.34	S	S	.	.	H	α-helix	trans	-60.6	-45.1	179.7	-59.4	0	0	0	0	110.9	L19 D20 A21 E25 M26 M27	L19-T23 WeakPolarHBondContact O-CB 3.31Å; L19-T23 PolarHBondContact O-N 2.96Å; L19-T23 PolarHBondContact O-OG1 2.96Å; D20-T23 PolarHBondContact O-N 3.41Å; A21-T23 VanDerWaalsContact C-N 3.34Å; A21-T23 PolarHBondContact O-N 3.02Å; T23-E25 VanDerWaalsContact C-N 3.33Å; T23-E25 PolarHBondContact O-N 2.96Å; T23-M26 PolarHBondContact O-N 2.93Å; T23-M27 HydrophobicContact CG2-CG 4.47Å; T23-M27 HydrophobicContact CG2-SD 4.08Å; T23-M27 WeakPolarHBondContact O-CB 3.35Å; T23-M27 VanDerWaalsContact O-CG 3.27Å; T23-M27 WeakPolarHBondContact O-CG 3.27Å; T23-M27 PolarHBondContact O-N 3.44Å
24	K	91.1	Very high	91.1	Very high	98 Å²	98	69 Å²	69	43%	0.426	34%	0.335	S	S	.	.	H	α-helix	trans	-61.3	-41.3	175.7	-72.7	172.5	-174.6	162.5	0	112.2	D20 A21 K22 M27 H28	D20-K24 WeakPolarHBondContact O-CG 3.32Å; D20-K24 PolarHBondContact O-N 2.95Å; D20-K24 VanDerWaalsContact OD1-CE 3.28Å; D20-K24 WeakPolarHBondContact OD1-CE 3.37Å; D20-K24 IonicContact OD1-NZ 2.85Å; D20-K24 VanDerWaalsContact OD2-CE 3.26Å; D20-K24 WeakPolarHBondContact OD2-CE 3.39Å; D20-K24 IonicContact OD2-NZ 3.68Å; D20-K24 PolarHBondContact OD2-NZ 3.37Å; A21-K24 PolarHBondContact O-N 3.39Å; K22-K24 VanDerWaalsContact C-N 3.33Å; K22-K24 PolarHBondContact O-N 3.25Å; K24-M27 PolarHBondContact O-N 3.39Å; K24-H28 PolarHBondContact O-N 3.34Å
25	E	90.8	Very high	90.8	Very high	6 Å²	6	70.1 Å²	70.1	3%	0.028	34%	0.34	C	S	.	.	H	α-helix	trans	-63.8	-42.2	177.3	-171.4	64.4	-172.8	0	0	111.9	A21 K22 T23 M27 H28 S39 R42 R117	A21-E25 WeakPolarHBondContact O-CB 3.32Å; A21-E25 PolarHBondContact O-N 3.48Å; K22-E25 WeakPolarHBondContact O-CB 3.28Å; K22-E25 PolarHBondContact O-N 2.95Å; T23-E25 VanDerWaalsContact C-N 3.33Å; T23-E25 PolarHBondContact O-N 2.96Å; E25-M27 VanDerWaalsContact C-N 3.32Å; E25-M27 PolarHBondContact O-N 2.82Å; E25-H28 WeakPolarHBondContact O-CB 3.38Å; E25-H28 PolarHBondContact O-N 2.95Å; E25-S39 VanDerWaalsContact CD-OG 3.26Å; E25-S39 VanDerWaalsContact CG-OG 3.25Å; E25-S39 WeakPolarHBondContact CG-OG 3.43Å; E25-S39 WeakPolarHBondContact OE1-CA 3.22Å; E25-S39 WeakPolarHBondContact OE1-CB 3.47Å; E25-S39 PolarHBondContact OE1-OG 3.24Å; E25-R42 IonicContact OE1-CZ 3.08Å; E25-R42 VanDerWaalsContact OE1-CZ 3.26Å; E25-R42 IonicContact OE1-NE 3.72Å; E25-R42 PolarHBondContact OE1-NE 2.96Å; E25-R42 IonicContact OE1-NH2 3.54Å; E25-R42 PolarHBondContact OE1-NH2 3.1Å; E25-R117 VanDerWaalsContact OE2-CD 3.29Å; E25-R117 WeakPolarHBondContact OE2-CD 3.5Å; E25-R117 IonicContact OE2-CZ 3.44Å; E25-R117 IonicContact OE2-NE 3.08Å; E25-R117 IonicContact OE2-NH1 3.95Å; E25-R117 PolarHBondContact OE2-NH1 3.24Å
26	M	90	Very high	90.7	Very high	106 Å²	106	72.7 Å²	72.7	52%	0.522	35%	0.353	S	S	.	.	H	α-helix	trans	-69.9	-27	176.1	-68.7	-67.1	-65.2	0	0	113.4	K22 T23	K22-M26 HydrophobicContact CG-CG 4.34Å; K22-M26 VanDerWaalsContact O-CG 3.29Å; K22-M26 WeakPolarHBondContact O-CG 3.49Å; K22-M26 PolarHBondContact O-N 3.34Å; T23-M26 PolarHBondContact O-N 2.93Å
27	M	90.9	Very high	90.6	Very high	153 Å²	153	66.7 Å²	66.7	75%	0.754	33%	0.325	S	S	*	.	H	α-helix	trans	-81.1	-21	175.8	-74.1	-177.7	69.9	0	0	113	T23 K24 E25	T23-M27 HydrophobicContact CG2-CG 4.47Å; T23-M27 HydrophobicContact CG2-SD 4.08Å; T23-M27 WeakPolarHBondContact O-CB 3.35Å; T23-M27 VanDerWaalsContact O-CG 3.27Å; T23-M27 WeakPolarHBondContact O-CG 3.27Å; T23-M27 PolarHBondContact O-N 3.44Å; K24-M27 PolarHBondContact O-N 3.39Å; E25-M27 VanDerWaalsContact C-N 3.32Å; E25-M27 PolarHBondContact O-N 2.82Å
28	H	88.7	Confident	90.5	Very high	70 Å²	70	62.9 Å²	62.9	32%	0.324	31%	0.311	S	S	.	.	S	Bend	trans	-67.9	134.5	178	-175	66.5	0	0	0	110.2	K24 E25 K30 E35	K24-H28 PolarHBondContact O-N 3.34Å; E25-H28 WeakPolarHBondContact O-CB 3.38Å; E25-H28 PolarHBondContact O-N 2.95Å; H28-K30 PolarHBondContact O-N 3.19Å; H28-E35 IonicContact CD2-OE1 3.85Å; H28-E35 PolarHBondContact CD2-OE1 3.4Å; H28-E35 IonicContact NE2-OE1 3.18Å; H28-E35 PolarHBondContact NE2-OE1 2.9Å
29	K	89.1	Confident	90.4	Very high	167 Å²	167	62.7 Å²	62.7	73%	0.726	31%	0.31	S	S	*	.	P	Polyproline II helix	trans	-81.8	118.2	-178.7	-174.9	-171.7	174.9	-162.8	0	108.6
30	K	89.3	Confident	90.5	Very high	53 Å²	53	60.6 Å²	60.6	23%	0.23	30%	0.299	C	S	.	.	P	Polyproline II helix	trans	-85.5	127.4	175.6	-59.3	147.9	-179.5	-159.7	0	109.2	H28 E35 Q36 S39 D40	H28-K30 PolarHBondContact O-N 3.19Å; K30-E35 VanDerWaalsContact CA-OE2 3.29Å; K30-E35 WeakPolarHBondContact CA-OE2 3.23Å; K30-Q36 HydrophobicContact CB-CB 4.21Å; K30-Q36 HydrophobicContact CD-CB 4.09Å; K30-Q36 HydrophobicContact CD-CG 4.14Å; K30-Q36 HydrophobicContact CG-CB 4.47Å; K30-S39 WeakPolarHBondContact CE-OG 3.37Å; K30-S39 PolarHBondContact NZ-OG 3.45Å; K30-S39 VanDerWaalsContact NZ-OG 3.15Å; K30-D40 IonicContact NZ-OD1 2.71Å; K30-D40 PolarHBondContact NZ-OD1 3.08Å
31	T	87.4	Confident	90.6	Very high	80 Å²	80	58.9 Å²	58.9	49%	0.491	29%	0.289	S	S	.	.			trans	-96	-37.7	179.9	55.4	0	0	0	0	112.2	E35 E372	T31-E35 PolarHBondContact N-OE2 3.07Å; T31-E35 PolarHBondContact OG1-OE2 3.17Å; T31-E372 PolarHBondContact OG1-OE1 3.29Å; T31-E372 VanDerWaalsContact OG1-OE1 3.13Å
32	T	87.9	Confident	90.5	Very high	41 Å²	41	60.1 Å²	60.1	25%	0.252	29%	0.291	S	S	.	.	S	Bend	trans	-112.3	159	-176.9	73.1	0	0	0	0	112.6	R34 E35 Q36	T32-R34 VanDerWaalsContact C-N 3.29Å; T32-R34 PolarHBondContact O-N 3.32Å; T32-E35 PolarHBondContact O-N 2.97Å; T32-E35 WeakPolarHBondContact OG1-CB 3.48Å; T32-E35 PolarHBondContact OG1-N 2.99Å; T32-E35 VanDerWaalsContact OG1-N 3.09Å; T32-Q36 WeakPolarHBondContact O-CB 3.35Å; T32-Q36 PolarHBondContact O-N 2.92Å
33	L	88.8	Confident	90.6	Very high	70 Å²	70	57 Å²	57	37%	0.366	28%	0.278	S	S	.	.	H	α-helix	trans	-61.2	-40.5	174.3	177.3	63	0	0	0	111.1	Q36 I37 R138	L33-Q36 WeakPolarHBondContact O-CB 3.42Å; L33-Q36 PolarHBondContact O-N 3.32Å; L33-I37 HydrophobicContact CD1-CD1 3.97Å; L33-I37 HydrophobicContact CD1-CG1 4.25Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CG1 3.05Å; L33-I37 PolarHBondContact O-N 3.31Å; L33-R138 HydrophobicContact CD2-CB 4Å
34	R	88.1	Confident	90.7	Very high	38 Å²	38	57.3 Å²	57.3	14%	0.143	27%	0.271	C	S	.	.	H	α-helix	trans	-61.6	-46.8	177.4	-178.8	175.5	-176.9	-175.7	3.8	111.7	T32 Q36 I37 N38 N126 Y136 S367	T32-R34 VanDerWaalsContact C-N 3.29Å; T32-R34 PolarHBondContact O-N 3.32Å; R34-Q36 VanDerWaalsContact C-N 3.29Å; R34-Q36 PolarHBondContact O-N 3.4Å; R34-I37 PolarHBondContact O-N 3.32Å; R34-N38 WeakPolarHBondContact O-CB 3.38Å; R34-N38 VanDerWaalsContact O-CG 3.28Å; R34-N38 PolarHBondContact O-N 3.31Å; R34-N38 PolarHBondContact O-ND2 2.99Å; R34-N126 PolarHBondContact NE-OD1 3.28Å; R34-N126 PolarHBondContact NH2-ND2 3.19Å; R34-N126 PolarHBondContact NH2-OD1 3.13Å; R34-Y136 HydrophobicContact CB-CD1 3.83Å; R34-Y136 HydrophobicContact CB-CE1 4.2Å; R34-Y136 HydrophobicContact CB-CG 4.38Å; R34-Y136 HydrophobicContact CG-CD1 3.65Å; R34-Y136 HydrophobicContact CG-CD2 4.5Å; R34-Y136 HydrophobicContact CG-CE1 3.65Å; R34-Y136 HydrophobicContact CG-CG 4.08Å; R34-S367 PolarHBondContact NH1-O 2.95Å
35	E	87.8	Confident	90.7	Very high	44 Å²	44	55.2 Å²	55.2	21%	0.206	27%	0.272	C	S	.	.	H	α-helix	trans	-61.3	-41	175.6	-169.6	-171.3	-173.2	0	0	111.1	H28 K30 T31 T32 N38 S39	H28-E35 IonicContact CD2-OE1 3.85Å; H28-E35 PolarHBondContact CD2-OE1 3.4Å; H28-E35 IonicContact NE2-OE1 3.18Å; H28-E35 PolarHBondContact NE2-OE1 2.9Å; K30-E35 VanDerWaalsContact CA-OE2 3.29Å; K30-E35 WeakPolarHBondContact CA-OE2 3.23Å; T31-E35 PolarHBondContact N-OE2 3.07Å; T31-E35 PolarHBondContact OG1-OE2 3.17Å; T32-E35 PolarHBondContact O-N 2.97Å; T32-E35 WeakPolarHBondContact OG1-CB 3.48Å; T32-E35 PolarHBondContact OG1-N 2.99Å; T32-E35 VanDerWaalsContact OG1-N 3.09Å; E35-N38 PolarHBondContact O-N 3.44Å; E35-S39 WeakPolarHBondContact O-CB 3.36Å; E35-S39 PolarHBondContact O-N 3.4Å
36	Q	91.7	Very high	90.8	Very high	92 Å²	92	55.9 Å²	55.9	43%	0.43	28%	0.275	S	S	.	.	H	α-helix	trans	-60.6	-51.8	176.6	175.3	174.4	-7	0	0	112.1	K30 T32 L33 R34 N38 S39 D40	K30-Q36 HydrophobicContact CB-CB 4.21Å; K30-Q36 HydrophobicContact CD-CB 4.09Å; K30-Q36 HydrophobicContact CD-CG 4.14Å; K30-Q36 HydrophobicContact CG-CB 4.47Å; T32-Q36 WeakPolarHBondContact O-CB 3.35Å; T32-Q36 PolarHBondContact O-N 2.92Å; L33-Q36 WeakPolarHBondContact O-CB 3.42Å; L33-Q36 PolarHBondContact O-N 3.32Å; R34-Q36 VanDerWaalsContact C-N 3.29Å; R34-Q36 PolarHBondContact O-N 3.4Å; Q36-N38 VanDerWaalsContact C-N 3.35Å; Q36-N38 PolarHBondContact O-N 2.98Å; Q36-S39 WeakPolarHBondContact O-CB 3.41Å; Q36-S39 PolarHBondContact O-N 3.05Å; Q36-D40 WeakPolarHBondContact O-CB 3.48Å; Q36-D40 PolarHBondContact O-N 3.11Å
37	I	92.9	Very high	91	Very high	4 Å²	4	53.5 Å²	53.5	2%	0.021	26%	0.264	C	S	.	.	H	α-helix	trans	-61.3	-45.1	179.7	-72.1	169.7	0	0	0	110.6	L33 R34 S39 D40 H41 V128 F130 Y136	L33-I37 HydrophobicContact CD1-CD1 3.97Å; L33-I37 HydrophobicContact CD1-CG1 4.25Å; L33-I37 HydrophobicContact CG-CD1 3.91Å; L33-I37 WeakPolarHBondContact O-CG1 3.05Å; L33-I37 PolarHBondContact O-N 3.31Å; R34-I37 PolarHBondContact O-N 3.32Å; I37-S39 VanDerWaalsContact C-N 3.33Å; I37-S39 PolarHBondContact O-N 2.94Å; I37-D40 PolarHBondContact O-N 2.93Å; I37-H41 PolarHBondContact O-CD2 3.39Å; I37-H41 VanDerWaalsContact O-CD2 3.25Å; I37-H41 PolarHBondContact O-N 3.02Å; I37-V128 HydrophobicContact CG2-CG1 3.83Å; I37-F130 HydrophobicContact CD1-CZ 4.39Å; I37-F130 HydrophobicContact CG2-CE2 4.17Å; I37-F130 HydrophobicContact CG2-CZ 4.5Å; I37-Y136 HydrophobicContact CB-CD1 4.35Å; I37-Y136 HydrophobicContact CB-CE1 4.02Å; I37-Y136 HydrophobicContact CD1-CD1 4.18Å; I37-Y136 WeakPolarHBondContact CD1-O 3.22Å; I37-Y136 HydrophobicContact CG2-CD1 4.34Å; I37-Y136 HydrophobicContact CG2-CE1 3.79Å
38	N	91.2	Very high	91.2	Very high	11 Å²	11	49.7 Å²	49.7	6%	0.059	25%	0.247	C	C	.	.	H	α-helix	trans	-60.6	-42.6	177.3	-77.6	-23.7	0	0	0	112.7	R34 E35 Q36 D40 H41 R42 Q125 M127 Y136	R34-N38 WeakPolarHBondContact O-CB 3.38Å; R34-N38 VanDerWaalsContact O-CG 3.28Å; R34-N38 PolarHBondContact O-N 3.31Å; R34-N38 PolarHBondContact O-ND2 2.99Å; E35-N38 PolarHBondContact O-N 3.44Å; Q36-N38 VanDerWaalsContact C-N 3.35Å; Q36-N38 PolarHBondContact O-N 2.98Å; N38-D40 VanDerWaalsContact C-N 3.32Å; N38-H41 PolarHBondContact O-N 3.4Å; N38-R42 WeakPolarHBondContact O-CG 3.46Å; N38-R42 PolarHBondContact O-N 3.49Å; N38-Q125 PolarHBondContact ND2-O 2.68Å; N38-M127 HydrophobicContact CB-CG 4.1Å; N38-M127 WeakPolarHBondContact OD1-CB 3.47Å; N38-M127 PolarHBondContact OD1-N 3.01Å; N38-M127 VanDerWaalsContact OD1-N 3.09Å; N38-Y136 PolarHBondContact OD1-OH 3.48Å
39	S	91.4	Very high	91.5	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	24%	0.244	C	C	.	.	H	α-helix	trans	-63.4	-39.6	176.1	-177.7	0	0	0	0	112.4	E25 K30 E35 Q36 I37 R42 T43	E25-S39 VanDerWaalsContact CD-OG 3.26Å; E25-S39 VanDerWaalsContact CG-OG 3.25Å; E25-S39 WeakPolarHBondContact CG-OG 3.43Å; E25-S39 WeakPolarHBondContact OE1-CA 3.22Å; E25-S39 WeakPolarHBondContact OE1-CB 3.47Å; E25-S39 PolarHBondContact OE1-OG 3.24Å; K30-S39 WeakPolarHBondContact CE-OG 3.37Å; K30-S39 PolarHBondContact NZ-OG 3.45Å; K30-S39 VanDerWaalsContact NZ-OG 3.15Å; E35-S39 WeakPolarHBondContact O-CB 3.36Å; E35-S39 PolarHBondContact O-N 3.4Å; Q36-S39 WeakPolarHBondContact O-CB 3.41Å; Q36-S39 PolarHBondContact O-N 3.05Å; I37-S39 VanDerWaalsContact C-N 3.33Å; I37-S39 PolarHBondContact O-N 2.94Å; S39-R42 PolarHBondContact O-N 3.49Å; S39-T43 WeakPolarHBondContact O-CB 3.25Å; S39-T43 PolarHBondContact O-N 3.46Å; S39-T43 PolarHBondContact O-OG1 3.24Å
40	D	94.3	Very high	91.8	Very high	23 Å²	23	44.8 Å²	44.8	12%	0.123	22%	0.221	C	C	.	.	H	α-helix	trans	-68.3	-38.2	178.2	-66.7	-5.3	0	0	0	110.7	K30 Q36 I37 N38 T43 R44 P202 L203	K30-D40 IonicContact NZ-OD1 2.71Å; K30-D40 PolarHBondContact NZ-OD1 3.08Å; Q36-D40 WeakPolarHBondContact O-CB 3.48Å; Q36-D40 PolarHBondContact O-N 3.11Å; I37-D40 PolarHBondContact O-N 2.93Å; N38-D40 VanDerWaalsContact C-N 3.32Å; D40-T43 PolarHBondContact O-N 2.71Å; D40-R44 PolarHBondContact O-N 3.3Å; D40-P202 HydrophobicContact CB-CG 3.66Å; D40-L203 HydrophobicContact CB-CD1 4.02Å; D40-L203 HydrophobicContact CB-CG 4.09Å; D40-L203 WeakPolarHBondContact O-CD2 3.35Å
41	H	93.6	Very high	92.1	Very high	29 Å²	29	48.3 Å²	48.3	13%	0.134	24%	0.24	C	C	.	.	H	α-helix	trans	-65.3	-44.2	171.6	-84.8	-70.6	0	0	0	113.1	I37 N38 T43 R44 A45 M127 V128 R199 P202	I37-H41 PolarHBondContact O-CD2 3.39Å; I37-H41 VanDerWaalsContact O-CD2 3.25Å; I37-H41 PolarHBondContact O-N 3.02Å; N38-H41 PolarHBondContact O-N 3.4Å; H41-T43 VanDerWaalsContact C-N 3.25Å; H41-T43 PolarHBondContact O-N 3.39Å; H41-R44 WeakPolarHBondContact O-CB 3.08Å; H41-R44 PolarHBondContact O-N 3.25Å; H41-A45 PolarHBondContact O-N 3.33Å; H41-M127 HydrophobicContact CB-CB 3.8Å; H41-M127 HydrophobicContact CB-CE 4.45Å; H41-M127 HydrophobicContact CB-CG 4.41Å; H41-V128 WeakPolarHBondContact NE2-CG1 3.13Å; H41-R199 PolarHBondContact NE2-O 3.21Å; H41-P202 HydrophobicContact CB-CG 4.49Å
42	R	91.1	Very high	92.5	Very high	38 Å²	38	49.8 Å²	49.8	14%	0.143	25%	0.245	C	C	.	.	H	α-helix	trans	-57.8	-43.1	172.7	-74.9	-172.3	-63.7	-97.7	2.8	111	E25 N38 S39 A45 M46 M127	E25-R42 IonicContact OE1-CZ 3.08Å; E25-R42 VanDerWaalsContact OE1-CZ 3.26Å; E25-R42 IonicContact OE1-NE 3.72Å; E25-R42 PolarHBondContact OE1-NE 2.96Å; E25-R42 IonicContact OE1-NH2 3.54Å; E25-R42 PolarHBondContact OE1-NH2 3.1Å; N38-R42 WeakPolarHBondContact O-CG 3.46Å; N38-R42 PolarHBondContact O-N 3.49Å; S39-R42 PolarHBondContact O-N 3.49Å; R42-A45 PolarHBondContact O-N 2.7Å; R42-M46 WeakPolarHBondContact O-CG 3.46Å; R42-M46 PolarHBondContact O-N 3.08Å; R42-M127 HydrophobicContact CG-CE 3.82Å; R42-M127 HydrophobicContact CG-CG 4.32Å; R42-M127 HydrophobicContact CG-SD 4.03Å
43	T	93.4	Very high	92.9	Very high	0 Å²	0	48.3 Å²	48.3	0%	0	24%	0.236	C	C	.	.	H	α-helix	trans	-64.7	-39.8	177.8	-60.7	0	0	0	0	111.7	K22 S39 D40 H41 M46 L47 L203	K22-T43 HydrophobicContact CD-CG2 4.03Å; K22-T43 HydrophobicContact CG-CG2 3.93Å; S39-T43 WeakPolarHBondContact O-CB 3.25Å; S39-T43 PolarHBondContact O-N 3.46Å; S39-T43 PolarHBondContact O-OG1 3.24Å; D40-T43 PolarHBondContact O-N 2.71Å; H41-T43 VanDerWaalsContact C-N 3.25Å; H41-T43 PolarHBondContact O-N 3.39Å; T43-M46 PolarHBondContact O-N 3.49Å; T43-L47 HydrophobicContact CG2-CD1 4.37Å; T43-L47 WeakPolarHBondContact O-CG 3.23Å; T43-L47 PolarHBondContact O-N 3.37Å; T43-L203 HydrophobicContact CG2-CD1 4.26Å; T43-L203 HydrophobicContact CG2-CD2 3.74Å
44	R	94.4	Very high	93.2	Very high	81 Å²	81	46.4 Å²	46.4	31%	0.306	23%	0.229	S	C	.	.	H	α-helix	trans	-59.6	-49.9	173.1	-177.6	-175.3	177.8	116.2	-12.4	111.1	D40 H41 M46 L47 D48 P202 L203	D40-R44 PolarHBondContact O-N 3.3Å; H41-R44 WeakPolarHBondContact O-CB 3.08Å; H41-R44 PolarHBondContact O-N 3.25Å; R44-M46 VanDerWaalsContact C-N 3.28Å; R44-M46 PolarHBondContact O-N 3.17Å; R44-L47 WeakPolarHBondContact O-CA 3.37Å; R44-L47 WeakPolarHBondContact O-CB 3.01Å; R44-L47 PolarHBondContact O-N 3.32Å; R44-D48 IonicContact NE-OD2 2.76Å; R44-D48 PolarHBondContact O-N 3.43Å; R44-P202 HydrophobicContact CB-CB 4.25Å; R44-P202 WeakPolarHBondContact CD-O 3.48Å; R44-P202 PolarHBondContact NH1-O 3.43Å; R44-L203 HydrophobicContact CB-CD2 4.2Å
45	A	92.6	Very high	93.6	Very high	54 Å²	54	46.2 Å²	46.2	45%	0.446	23%	0.233	S	C	.	.	H	α-helix	trans	-58.8	-39.1	178.2	0	0	0	0	0	112.5	H41 R42 R49	H41-A45 PolarHBondContact O-N 3.33Å; R42-A45 PolarHBondContact O-N 2.7Å; A45-R49 WeakPolarHBondContact O-CB 3.23Å; A45-R49 PolarHBondContact O-N 3.48Å; A45-R49 VanDerWaalsContact O-N 3.08Å
46	M	93.4	Very high	93.8	Very high	19 Å²	19	46.9 Å²	46.9	9%	0.094	24%	0.24	C	C	.	.	H	α-helix	trans	-65	-37.9	173.7	-68.2	176.7	-167.2	0	0	112.4	L18 A21 K22 R42 T43 R44 Y50 L113	L18-M46 HydrophobicContact CD2-CB 4.03Å; L18-M46 HydrophobicContact CD2-CG 4.22Å; A21-M46 HydrophobicContact CB-CE 4.2Å; A21-M46 HydrophobicContact CB-SD 3.94Å; K22-M46 HydrophobicContact CB-SD 4.36Å; R42-M46 WeakPolarHBondContact O-CG 3.46Å; R42-M46 PolarHBondContact O-N 3.08Å; T43-M46 PolarHBondContact O-N 3.49Å; R44-M46 VanDerWaalsContact C-N 3.28Å; R44-M46 PolarHBondContact O-N 3.17Å; M46-Y50 VanDerWaalsContact O-CB 3.32Å; M46-Y50 WeakPolarHBondContact O-CB 3.41Å; M46-Y50 PolarHBondContact O-N 2.89Å; M46-L113 HydrophobicContact CE-CD1 4.25Å
47	L	94	Very high	93.9	Very high	56 Å²	56	42.8 Å²	42.8	29%	0.293	22%	0.221	S	C	.	.	H	α-helix	trans	-67.5	-44	176.8	-77.9	174.5	0	0	0	112.1	K22 T43 R44 Y50 M51 L203	K22-L47 HydrophobicContact CD-CD2 4.06Å; K22-L47 HydrophobicContact CD-CG 4.36Å; T43-L47 HydrophobicContact CG2-CD1 4.37Å; T43-L47 WeakPolarHBondContact O-CG 3.23Å; T43-L47 PolarHBondContact O-N 3.37Å; R44-L47 WeakPolarHBondContact O-CA 3.37Å; R44-L47 WeakPolarHBondContact O-CB 3.01Å; R44-L47 PolarHBondContact O-N 3.32Å; L47-Y50 WeakPolarHBondContact O-CB 3.21Å; L47-Y50 PolarHBondContact O-N 3.38Å; L47-Y50 VanDerWaalsContact O-N 3.14Å; L47-M51 WeakPolarHBondContact O-CG 3.43Å; L47-M51 PolarHBondContact O-N 3.04Å; L47-L203 HydrophobicContact CD1-CD2 4.11Å
48	D	94.4	Very high	93.9	Very high	74 Å²	74	49.7 Å²	49.7	40%	0.396	25%	0.247	S	C	.	.	H	α-helix	trans	-60.1	-49	177.5	-67.1	-22.4	0	0	0	110.1	R44 Y50 M51 D52	R44-D48 IonicContact NE-OD2 2.76Å; R44-D48 PolarHBondContact O-N 3.43Å; D48-Y50 VanDerWaalsContact C-N 3.3Å; D48-Y50 PolarHBondContact O-N 3.38Å; D48-M51 WeakPolarHBondContact O-CB 3.35Å; D48-M51 PolarHBondContact O-N 3.31Å; D48-M51 VanDerWaalsContact O-N 3.08Å; D48-D52 PolarHBondContact O-N 2.84Å
49	R	94.5	Very high	93.9	Very high	71 Å²	71	54.4 Å²	54.4	27%	0.268	27%	0.269	S	S	.	.	H	α-helix	trans	-59	-40.4	173.9	-173.9	174.9	172.4	176.6	0.7	112.3	E14 L18 A45 M51 D52 V53 E109	E14-R49 IonicContact OE1-CZ 3.47Å; E14-R49 IonicContact OE1-NE 2.67Å; E14-R49 PolarHBondContact OE1-NE 3.42Å; E14-R49 IonicContact OE1-NH2 3.94Å; E14-R49 PolarHBondContact OE1-NH2 2.7Å; L18-R49 HydrophobicContact CD1-CB 4.31Å; L18-R49 HydrophobicContact CD1-CG 3.95Å; L18-R49 HydrophobicContact CD2-CB 4.36Å; L18-R49 HydrophobicContact CD2-CG 4.36Å; A45-R49 WeakPolarHBondContact O-CB 3.23Å; A45-R49 PolarHBondContact O-N 3.48Å; A45-R49 VanDerWaalsContact O-N 3.08Å; R49-M51 VanDerWaalsContact C-N 3.31Å; R49-M51 PolarHBondContact O-N 3.06Å; R49-D52 PolarHBondContact O-N 3.08Å; R49-V53 HydrophobicContact CG-CG2 4.37Å; R49-V53 WeakPolarHBondContact O-CB 3.5Å; R49-V53 VanDerWaalsContact O-CG2 3.24Å; R49-V53 WeakPolarHBondContact O-CG2 3.24Å; R49-V53 PolarHBondContact O-N 2.95Å; R49-E109 IonicContact CZ-OE1 3.86Å; R49-E109 IonicContact CZ-OE2 2.79Å; R49-E109 VanDerWaalsContact NH1-CD 3.34Å; R49-E109 IonicContact NH1-OE1 3.95Å; R49-E109 PolarHBondContact NH1-OE1 3.4Å; R49-E109 IonicContact NH1-OE2 2.94Å; R49-E109 PolarHBondContact NH1-OE2 2.99Å; R49-E109 IonicContact NH2-OE1 3.39Å; R49-E109 PolarHBondContact NH2-OE1 3.43Å; R49-E109 IonicContact NH2-OE2 3.77Å; R49-E109 PolarHBondContact NH2-OE2 2.73Å
50	Y	95.9	Very high	93.8	Very high	62 Å²	62	55.9 Å²	55.9	24%	0.243	28%	0.281	C	S	.	.	H	α-helix	trans	-62.7	-39.1	176.7	-178.5	-83.3	0	0	0	111.8	K15 L18 L19 M46 L47 D48 S54	K15-Y50 HydrophobicContact CB-CD2 4.03Å; K15-Y50 HydrophobicContact CB-CE2 3.63Å; K15-Y50 HydrophobicContact CD-CE2 4.41Å; K15-Y50 VanDerWaalsContact CE-OH 3.27Å; K15-Y50 WeakPolarHBondContact CE-OH 3.32Å; K15-Y50 HydrophobicContact CG-CD2 4.04Å; K15-Y50 HydrophobicContact CG-CE2 3.86Å; L18-Y50 HydrophobicContact CB-CD2 4.16Å; L18-Y50 HydrophobicContact CD1-CD2 4.48Å; L19-Y50 HydrophobicContact CD1-CE2 3.85Å; L19-Y50 HydrophobicContact CD2-CD2 4.4Å; L19-Y50 HydrophobicContact CD2-CE2 3.98Å; L19-Y50 HydrophobicContact CG-CD2 4.2Å; L19-Y50 HydrophobicContact CG-CE2 3.67Å; M46-Y50 VanDerWaalsContact O-CB 3.32Å; M46-Y50 WeakPolarHBondContact O-CB 3.41Å; M46-Y50 PolarHBondContact O-N 2.89Å; L47-Y50 WeakPolarHBondContact O-CB 3.21Å; L47-Y50 PolarHBondContact O-N 3.38Å; L47-Y50 VanDerWaalsContact O-N 3.14Å; D48-Y50 VanDerWaalsContact C-N 3.3Å; D48-Y50 PolarHBondContact O-N 3.38Å; Y50-S54 WeakPolarHBondContact CE1-OG 3.44Å; Y50-S54 WeakPolarHBondContact O-CB 3.37Å; Y50-S54 PolarHBondContact O-N 3.28Å; Y50-S54 PolarHBondContact O-OG 3.24Å
51	M	95.3	Very high	93.5	Very high	128 Å²	128	59.1 Å²	59.1	63%	0.631	29%	0.292	S	S	*	.	H	α-helix	trans	-66.2	-44.7	176.6	-71.9	-179.1	60.9	0	0	111.5	L47 D48 R49 S54 S55	L47-M51 WeakPolarHBondContact O-CG 3.43Å; L47-M51 PolarHBondContact O-N 3.04Å; D48-M51 WeakPolarHBondContact O-CB 3.35Å; D48-M51 PolarHBondContact O-N 3.31Å; D48-M51 VanDerWaalsContact O-N 3.08Å; R49-M51 VanDerWaalsContact C-N 3.31Å; R49-M51 PolarHBondContact O-N 3.06Å; M51-S54 WeakPolarHBondContact O-CB 3.35Å; M51-S54 PolarHBondContact O-N 3.46Å; M51-S55 PolarHBondContact O-N 3.08Å
52	D	96.1	Very high	93.4	Very high	111 Å²	111	62.4 Å²	62.4	59%	0.594	31%	0.307	S	S	*	.	H	α-helix	trans	-62.1	-48	178.2	-71.3	-19.1	0	0	0	112	D48 R49 S54 S55 T56	D48-D52 PolarHBondContact O-N 2.84Å; R49-D52 PolarHBondContact O-N 3.08Å; D52-S54 VanDerWaalsContact C-N 3.29Å; D52-S54 PolarHBondContact O-N 2.96Å; D52-S55 PolarHBondContact O-N 2.98Å; D52-T56 PolarHBondContact O-N 3.09Å; D52-T56 PolarHBondContact O-OG1 3.17Å
53	V	95.5	Very high	93.3	Very high	10 Å²	10	61.2 Å²	61.2	6%	0.061	30%	0.304	C	S	.	.	H	α-helix	trans	-61.9	-41.2	175.5	176.6	0	0	0	0	110.2	Y11 E14 K15 R49 S55 T56 V57	Y11-V53 HydrophobicContact CD1-CG1 3.87Å; Y11-V53 HydrophobicContact CG-CG1 4.14Å; Y11-V53 WeakPolarHBondContact O-CG1 3.42Å; E14-V53 HydrophobicContact CG-CG2 4.32Å; K15-V53 HydrophobicContact CD-CG1 4.14Å; K15-V53 HydrophobicContact CG-CB 4.26Å; K15-V53 HydrophobicContact CG-CG1 3.67Å; R49-V53 HydrophobicContact CG-CG2 4.37Å; R49-V53 WeakPolarHBondContact O-CB 3.5Å; R49-V53 VanDerWaalsContact O-CG2 3.24Å; R49-V53 WeakPolarHBondContact O-CG2 3.24Å; R49-V53 PolarHBondContact O-N 2.95Å; V53-S55 PolarHBondContact O-N 2.99Å; V53-T56 PolarHBondContact O-N 3.23Å; V53-V57 HydrophobicContact CG1-CG2 4.28Å; V53-V57 WeakPolarHBondContact O-CB 3.49Å; V53-V57 WeakPolarHBondContact O-CG2 3.42Å; V53-V57 PolarHBondContact O-N 2.98Å
54	S	95.9	Very high	93	Very high	30 Å²	30	69.5 Å²	69.5	21%	0.21	34%	0.34	C	S	.	.	H	α-helix	trans	-63.9	-38.7	177.4	-65.6	0	0	0	0	112.9	K15 Y50 M51 D52 R58	K15-S54 WeakPolarHBondContact CE-OG 3.23Å; K15-S54 PolarHBondContact NZ-OG 2.86Å; Y50-S54 WeakPolarHBondContact CE1-OG 3.44Å; Y50-S54 WeakPolarHBondContact O-CB 3.37Å; Y50-S54 PolarHBondContact O-N 3.28Å; Y50-S54 PolarHBondContact O-OG 3.24Å; M51-S54 WeakPolarHBondContact O-CB 3.35Å; M51-S54 PolarHBondContact O-N 3.46Å; D52-S54 VanDerWaalsContact C-N 3.29Å; D52-S54 PolarHBondContact O-N 2.96Å; S54-R58 WeakPolarHBondContact O-CB 3.34Å; S54-R58 PolarHBondContact O-N 3.39Å
55	S	95.7	Very high	92.7	Very high	34 Å²	34	71.2 Å²	71.2	24%	0.238	36%	0.355	C	S	.	.	H	α-helix	trans	-66.2	-45.9	175.5	-163.7	0	0	0	0	111.1	M51 D52 V53 V57 R58 E59	M51-S55 PolarHBondContact O-N 3.08Å; D52-S55 PolarHBondContact O-N 2.98Å; V53-S55 PolarHBondContact O-N 2.99Å; S55-V57 VanDerWaalsContact C-N 3.33Å; S55-V57 PolarHBondContact O-N 2.98Å; S55-R58 WeakPolarHBondContact O-CB 3.24Å; S55-R58 PolarHBondContact O-N 3.42Å; S55-R58 PolarHBondContact OG-NH2 2.91Å; S55-R58 VanDerWaalsContact OG-NH2 3.13Å; S55-E59 WeakPolarHBondContact O-CG 3.26Å; S55-E59 PolarHBondContact O-N 2.9Å
56	T	92.9	Very high	92.5	Very high	57 Å²	57	69.5 Å²	69.5	35%	0.35	34%	0.343	S	S	.	.	H	α-helix	trans	-58.7	-44.5	177.5	-54.5	0	0	0	0	111.5	Y11 D52 V53 E59 A60	Y11-T56 HydrophobicContact CD2-CG2 4.5Å; Y11-T56 HydrophobicContact CE1-CG2 4.43Å; Y11-T56 HydrophobicContact CE2-CG2 3.87Å; D52-T56 PolarHBondContact O-N 3.09Å; D52-T56 PolarHBondContact O-OG1 3.17Å; V53-T56 PolarHBondContact O-N 3.23Å; T56-E59 PolarHBondContact O-N 3.35Å; T56-A60 WeakPolarHBondContact O-CB 3.44Å; T56-A60 PolarHBondContact O-N 2.86Å
57	V	92.9	Very high	92.2	Very high	6 Å²	6	73.6 Å²	73.6	4%	0.036	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-44.6	176.7	169.5	0	0	0	0	111.5	Y11 V53 S55 E59 A60 Y61	Y11-V57 HydrophobicContact CD2-CG2 4.03Å; Y11-V57 HydrophobicContact CG-CG2 3.86Å; V53-V57 HydrophobicContact CG1-CG2 4.28Å; V53-V57 WeakPolarHBondContact O-CB 3.49Å; V53-V57 WeakPolarHBondContact O-CG2 3.42Å; V53-V57 PolarHBondContact O-N 2.98Å; S55-V57 VanDerWaalsContact C-N 3.33Å; S55-V57 PolarHBondContact O-N 2.98Å; V57-E59 VanDerWaalsContact C-N 3.33Å; V57-E59 PolarHBondContact O-N 3.3Å; V57-A60 PolarHBondContact O-N 2.94Å; V57-Y61 HydrophobicContact CG1-CD2 3.59Å; V57-Y61 HydrophobicContact CG1-CE2 3.36Å; V57-Y61 WeakPolarHBondContact O-CD2 3.32Å; V57-Y61 PolarHBondContact O-N 2.72Å
58	R	93.8	Very high	91.8	Very high	149 Å²	149	74.5 Å²	74.5	56%	0.562	36%	0.362	S	S	*	.	H	α-helix	trans	-59.1	-46.2	177.5	176.9	-179.5	57.4	178.2	-4.9	110.9	S54 S55 A60 Y61 E62	S54-R58 WeakPolarHBondContact O-CB 3.34Å; S54-R58 PolarHBondContact O-N 3.39Å; S55-R58 WeakPolarHBondContact O-CB 3.24Å; S55-R58 PolarHBondContact O-N 3.42Å; S55-R58 PolarHBondContact OG-NH2 2.91Å; S55-R58 VanDerWaalsContact OG-NH2 3.13Å; R58-A60 VanDerWaalsContact C-N 3.34Å; R58-A60 PolarHBondContact O-N 2.81Å; R58-Y61 PolarHBondContact O-N 3.1Å; R58-Y61 VanDerWaalsContact O-N 3.12Å; R58-E62 PolarHBondContact O-N 3.31Å
59	E	91.3	Very high	91.5	Very high	111 Å²	111	77.1 Å²	77.1	52%	0.519	37%	0.371	S	S	.	.	H	α-helix	trans	-61.6	-40.9	176.3	-71.2	173.8	-158.6	0	0	112.1	S55 T56 V57 Y61 E62 D63	S55-E59 WeakPolarHBondContact O-CG 3.26Å; S55-E59 PolarHBondContact O-N 2.9Å; T56-E59 PolarHBondContact O-N 3.35Å; V57-E59 VanDerWaalsContact C-N 3.33Å; V57-E59 PolarHBondContact O-N 3.3Å; E59-Y61 PolarHBondContact O-N 2.96Å; E59-E62 PolarHBondContact O-N 2.92Å; E59-D63 PolarHBondContact O-N 3.41Å
60	A	88.8	Confident	91.2	Very high	30 Å²	30	78.6 Å²	78.6	25%	0.248	38%	0.384	C	S	.	.	H	α-helix	trans	-64.5	-26.3	175.2	0	0	0	0	0	113.4	Q8 T56 V57 R58	Q8-A60 HydrophobicContact CG-CB 4.17Å; Q8-A60 PolarHBondContact NE2-O 2.85Å; T56-A60 WeakPolarHBondContact O-CB 3.44Å; T56-A60 PolarHBondContact O-N 2.86Å; V57-A60 PolarHBondContact O-N 2.94Å; R58-A60 VanDerWaalsContact C-N 3.34Å; R58-A60 PolarHBondContact O-N 2.81Å
61	Y	88.5	Confident	90.8	Very high	92 Å²	92	76.7 Å²	76.7	36%	0.361	38%	0.377	S	S	.	.	H	α-helix	trans	-84.1	-27.8	173.7	-79.8	-65.9	0	0	0	113.8	Q8 H12 V57 R58 E59 D63 R68	Q8-Y61 PolarHBondContact OE1-OH 3.35Å; H12-Y61 AromaticContact NE2-CE2 3.45Å; H12-Y61 WeakPolarHBondContact NE2-CE2 3.25Å; H12-Y61 AromaticContact NE2-CZ 3.6Å; H12-Y61 PolarHBondContact NE2-OH 3.39Å; V57-Y61 HydrophobicContact CG1-CD2 3.59Å; V57-Y61 HydrophobicContact CG1-CE2 3.36Å; V57-Y61 WeakPolarHBondContact O-CD2 3.32Å; V57-Y61 PolarHBondContact O-N 2.72Å; R58-Y61 PolarHBondContact O-N 3.1Å; R58-Y61 VanDerWaalsContact O-N 3.12Å; E59-Y61 PolarHBondContact O-N 2.96Å; Y61-D63 PolarHBondContact O-N 3.22Å; Y61-R68 VanDerWaalsContact CD1-CZ 3.45Å
62	E	91.6	Very high	90.4	Very high	97 Å²	97	74.9 Å²	74.9	45%	0.453	37%	0.369	S	S	.	.	H	α-helix	trans	-61.3	-29	173.5	-74.2	178.7	-175.6	0	0	111.7	R58 E59 K64	R58-E62 PolarHBondContact O-N 3.31Å; E59-E62 PolarHBondContact O-N 2.92Å; E62-K64 VanDerWaalsContact C-N 3.32Å; E62-K64 HydrophobicContact CB-CG 4.46Å; E62-K64 PolarHBondContact O-N 2.91Å; E62-K64 WeakPolarHBondContact OE2-CE 3.2Å; E62-K64 IonicContact OE2-NZ 3.42Å; E62-K64 PolarHBondContact OE2-NZ 3.34Å
63	D	88.4	Confident	89.9	Confident	14 Å²	14	74.5 Å²	74.5	8%	0.075	37%	0.367	C	S	.	.			trans	52.1	48.4	170.5	-174.6	45.5	0	0	0	112.1	E59 Y61 D65 G66 M67 R68 K69	E59-D63 PolarHBondContact O-N 3.41Å; Y61-D63 PolarHBondContact O-N 3.22Å; D63-D65 PolarHBondContact O-N 2.87Å; D63-G66 PolarHBondContact O-N 3.25Å; D63-G66 VanDerWaalsContact O-N 3.12Å; D63-G66 VanDerWaalsContact OD1-CA 3.24Å; D63-G66 WeakPolarHBondContact OD1-CA 3.43Å; D63-G66 PolarHBondContact OD1-N 3.17Å; D63-M67 PolarHBondContact OD1-N 2.74Å; D63-M67 VanDerWaalsContact OD1-N 3.15Å; D63-R68 HydrophobicContact CB-CB 4.25Å; D63-R68 WeakPolarHBondContact OD1-CB 3.37Å; D63-R68 PolarHBondContact OD1-N 2.68Å; D63-K69 VanDerWaalsContact OD2-CD 3.29Å; D63-K69 WeakPolarHBondContact OD2-CD 3.49Å; D63-K69 WeakPolarHBondContact OD2-CE 3.42Å; D63-K69 WeakPolarHBondContact OD2-CG 3.15Å; D63-K69 IonicContact OD2-NZ 3.72Å
64	K	87.4	Confident	89.4	Confident	173 Å²	173	76 Å²	76	75%	0.752	38%	0.381	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.1	-29.8	-177	-73.1	176.9	-179.8	139.6	0	112.8	E62	E62-K64 VanDerWaalsContact C-N 3.32Å; E62-K64 HydrophobicContact CB-CG 4.46Å; E62-K64 PolarHBondContact O-N 2.91Å; E62-K64 WeakPolarHBondContact OE2-CE 3.2Å; E62-K64 IonicContact OE2-NZ 3.42Å; E62-K64 PolarHBondContact OE2-NZ 3.34Å
65	D	87.3	Confident	88.8	Confident	117 Å²	117	77.7 Å²	77.7	63%	0.626	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-90.3	-10.5	178.9	58	-3.7	0	0	0	113.4	D63 M67	D63-D65 PolarHBondContact O-N 2.87Å; D65-M67 HydrophobicContact CB-CG 3.96Å; D65-M67 VanDerWaalsContact CG-CG 3.48Å; D65-M67 PolarHBondContact O-N 2.95Å; D65-M67 PolarHBondContact OD1-N 3.39Å; D65-M67 WeakPolarHBondContact OD2-CG 3.37Å
66	G	88.4	Confident	88.2	Confident	19 Å²	19	80.1 Å²	80.1	20%	0.196	40%	0.404	C	S	.	.	S	Bend	trans	74.5	0.4	179.8	0	0	0	0	0	114.6	D63 R68 K69 D70	D63-G66 PolarHBondContact O-N 3.25Å; D63-G66 VanDerWaalsContact O-N 3.12Å; D63-G66 VanDerWaalsContact OD1-CA 3.24Å; D63-G66 WeakPolarHBondContact OD1-CA 3.43Å; D63-G66 PolarHBondContact OD1-N 3.17Å; G66-R68 VanDerWaalsContact C-N 3.27Å; G66-R68 PolarHBondContact O-N 3.34Å; G66-K69 PolarHBondContact O-N 3.47Å; G66-D70 PolarHBondContact O-N 3.1Å
67	M	87.1	Confident	87.6	Confident	104 Å²	104	78.3 Å²	78.3	51%	0.512	40%	0.397	S	S	.	.	H	α-helix	trans	-66	-30.9	-172.2	-67.6	-72.8	-123.3	0	0	112.1	I4 D63 D65 D70 E71	I4-M67 HydrophobicContact CD1-CB 3.44Å; I4-M67 VanDerWaalsContact CD1-CB 3.44Å; D63-M67 PolarHBondContact OD1-N 2.74Å; D63-M67 VanDerWaalsContact OD1-N 3.15Å; D65-M67 HydrophobicContact CB-CG 3.96Å; D65-M67 VanDerWaalsContact CG-CG 3.48Å; D65-M67 PolarHBondContact O-N 2.95Å; D65-M67 PolarHBondContact OD1-N 3.39Å; D65-M67 WeakPolarHBondContact OD2-CG 3.37Å; M67-D70 PolarHBondContact O-N 2.89Å; M67-E71 WeakPolarHBondContact O-CB 3.45Å; M67-E71 PolarHBondContact O-N 3.49Å
68	R	86.8	Confident	87	Confident	75 Å²	75	84.7 Å²	84.7	28%	0.283	44%	0.438	S	S	.	.	H	α-helix	trans	-67.6	-42.4	176.5	-175	-168.5	173.8	-131	-12.4	111	I4 L5 Y61 D63 G66 E71 L72	I4-R68 HydrophobicContact CG2-CB 4.19Å; I4-R68 HydrophobicContact CG2-CG 4.27Å; L5-R68 HydrophobicContact CD2-CG 4.49Å; Y61-R68 VanDerWaalsContact CD1-CZ 3.45Å; D63-R68 HydrophobicContact CB-CB 4.25Å; D63-R68 WeakPolarHBondContact OD1-CB 3.37Å; D63-R68 PolarHBondContact OD1-N 2.68Å; G66-R68 VanDerWaalsContact C-N 3.27Å; G66-R68 PolarHBondContact O-N 3.34Å; R68-E71 PolarHBondContact O-N 3.27Å; R68-L72 WeakPolarHBondContact O-CB 3.47Å; R68-L72 PolarHBondContact O-N 3.23Å
69	K	88.1	Confident	86.4	Confident	130 Å²	130	83.4 Å²	83.4	57%	0.565	44%	0.442	S	S	*	.	H	α-helix	trans	-64.2	-43.1	175.5	-76.6	166.4	-166.9	162.9	0	111	D63 G66 L72 N73	D63-K69 VanDerWaalsContact OD2-CD 3.29Å; D63-K69 WeakPolarHBondContact OD2-CD 3.49Å; D63-K69 WeakPolarHBondContact OD2-CE 3.42Å; D63-K69 WeakPolarHBondContact OD2-CG 3.15Å; D63-K69 IonicContact OD2-NZ 3.72Å; G66-K69 PolarHBondContact O-N 3.47Å; K69-L72 PolarHBondContact O-N 3.45Å; K69-N73 WeakPolarHBondContact O-CB 3.23Å; K69-N73 PolarHBondContact O-N 3.11Å; K69-N73 PolarHBondContact O-ND2 3.35Å
70	D	87.8	Confident	86	Confident	101 Å²	101	82.6 Å²	82.6	54%	0.54	44%	0.439	S	S	.	.	H	α-helix	trans	-63.1	-43.2	178.3	-72.9	-12.8	0	0	0	111.5	G66 M67 L72 N73 A74	G66-D70 PolarHBondContact O-N 3.1Å; M67-D70 PolarHBondContact O-N 2.89Å; D70-L72 PolarHBondContact O-N 3.49Å; D70-N73 PolarHBondContact O-N 2.91Å; D70-A74 WeakPolarHBondContact O-CB 3.42Å; D70-A74 PolarHBondContact O-N 3.2Å
71	E	87.3	Confident	85.7	Confident	23 Å²	23	88.5 Å²	88.5	11%	0.107	46%	0.459	C	S	.	.	H	α-helix	trans	-61.8	-44.7	174.5	-170.4	-178	178.2	0	0	111.6	T3 I4 L5 M67 R68 N73 A74 I75 R87	T3-E71 WeakPolarHBondContact CB-OE1 3.47Å; T3-E71 WeakPolarHBondContact CG2-OE1 3.29Å; I4-E71 WeakPolarHBondContact CB-OE2 3.46Å; I4-E71 PolarHBondContact N-OE2 3.37Å; L5-E71 PolarHBondContact N-OE2 3.44Å; M67-E71 WeakPolarHBondContact O-CB 3.45Å; M67-E71 PolarHBondContact O-N 3.49Å; R68-E71 PolarHBondContact O-N 3.27Å; E71-N73 VanDerWaalsContact C-N 3.34Å; E71-N73 PolarHBondContact O-N 3.38Å; E71-A74 WeakPolarHBondContact O-CB 3.11Å; E71-A74 PolarHBondContact O-N 2.9Å; E71-I75 HydrophobicContact CG-CD1 4.11Å; E71-I75 VanDerWaalsContact O-CG1 3.32Å; E71-I75 WeakPolarHBondContact O-CG1 3.43Å; E71-I75 PolarHBondContact O-N 3.29Å; E71-R87 IonicContact OE1-CZ 3.55Å; E71-R87 IonicContact OE1-NH1 3.69Å; E71-R87 PolarHBondContact OE1-NH1 2.87Å; E71-R87 IonicContact OE1-NH2 2.88Å
72	L	86.3	Confident	85.6	Confident	89 Å²	89	86.6 Å²	86.6	47%	0.466	46%	0.462	S	S	.	.	H	α-helix	trans	-63.4	-41	179.2	-172.4	66.5	0	0	0	111.8	R68 K69 D70 A74 I75 S76	R68-L72 WeakPolarHBondContact O-CB 3.47Å; R68-L72 PolarHBondContact O-N 3.23Å; K69-L72 PolarHBondContact O-N 3.45Å; D70-L72 PolarHBondContact O-N 3.49Å; L72-A74 VanDerWaalsContact C-N 3.33Å; L72-I75 PolarHBondContact O-N 2.96Å; L72-S76 PolarHBondContact O-N 3.3Å
73	N	86.5	Confident	85.3	Confident	103 Å²	103	84.7 Å²	84.7	55%	0.551	45%	0.453	S	S	*	.	H	α-helix	trans	-66.7	-33.8	176.1	-71	-25.9	0	0	0	112.2	K69 D70 E71 I75 S76 G77	K69-N73 WeakPolarHBondContact O-CB 3.23Å; K69-N73 PolarHBondContact O-N 3.11Å; K69-N73 PolarHBondContact O-ND2 3.35Å; D70-N73 PolarHBondContact O-N 2.91Å; E71-N73 VanDerWaalsContact C-N 3.34Å; E71-N73 PolarHBondContact O-N 3.38Å; N73-I75 VanDerWaalsContact C-N 3.33Å; N73-S76 CarbonylContact O-C 3.55Å; N73-G77 WeakPolarHBondContact O-CA 3.27Å; N73-G77 PolarHBondContact O-N 3.11Å
74	A	84.3	Confident	85.1	Confident	42 Å²	42	90 Å²	90	35%	0.347	48%	0.476	S	S	.	.	H	α-helix	trans	-67.4	-35.1	174	0	0	0	0	0	111.9	D70 E71 L72	D70-A74 WeakPolarHBondContact O-CB 3.42Å; D70-A74 PolarHBondContact O-N 3.2Å; E71-A74 WeakPolarHBondContact O-CB 3.11Å; E71-A74 PolarHBondContact O-N 2.9Å; L72-A74 VanDerWaalsContact C-N 3.33Å
75	I	83.6	Confident	85.2	Confident	66 Å²	66	88.8 Å²	88.8	34%	0.338	47%	0.468	S	S	.	.	H	α-helix	trans	-75.4	-45.6	176.9	-63.6	163.9	0	0	0	111.3	L5 E71 L72 N73 E80	L5-I75 HydrophobicContact CD1-CD1 3.49Å; L5-I75 VanDerWaalsContact CD1-CD1 3.49Å; E71-I75 HydrophobicContact CG-CD1 4.11Å; E71-I75 VanDerWaalsContact O-CG1 3.32Å; E71-I75 WeakPolarHBondContact O-CG1 3.43Å; E71-I75 PolarHBondContact O-N 3.29Å; L72-I75 PolarHBondContact O-N 2.96Å; N73-I75 VanDerWaalsContact C-N 3.33Å; I75-E80 WeakPolarHBondContact O-CG 3.46Å
76	S	84.1	Confident	85.1	Confident	85 Å²	85	87.6 Å²	87.6	59%	0.594	46%	0.461	S	S	*	.	S	Bend	trans	-103.2	46.6	-176.1	-161.4	0	0	0	0	111.9	L72 N73	L72-S76 PolarHBondContact O-N 3.3Å; N73-S76 CarbonylContact O-C 3.55Å
77	G	80.3	Confident	84.9	Confident	19 Å²	19	89 Å²	89	20%	0.196	46%	0.461	C	S	.	.	S	Bend	trans	-114.4	-176.7	-178.4	0	0	0	0	0	113.1	N73 N79 E80	N73-G77 WeakPolarHBondContact O-CA 3.27Å; N73-G77 PolarHBondContact O-N 3.11Å; G77-N79 PolarHBondContact O-N 3.21Å; G77-N79 VanDerWaalsContact O-N 3.1Å; G77-E80 WeakPolarHBondContact O-CG 3.34Å
78	P	79.3	Confident	85	Confident	139 Å²	139	86.6 Å²	86.6	90%	0.903	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.7	-18	179.6	-22.2	33.1	0	0	0	115
79	N	82.1	Confident	85.2	Confident	122 Å²	122	89.1 Å²	89.1	65%	0.652	46%	0.463	S	S	*	.	T	Hydrogen-bonded Turn	trans	-114.3	32.5	-172.8	-69.3	-26.2	0	0	0	113.4	G77 F81 A82 E83	G77-N79 PolarHBondContact O-N 3.21Å; G77-N79 VanDerWaalsContact O-N 3.1Å; N79-F81 VanDerWaalsContact C-N 3.3Å; N79-F81 PolarHBondContact O-N 3.45Å; N79-A82 PolarHBondContact O-N 3.12Å; N79-A82 VanDerWaalsContact O-N 3.09Å; N79-E83 PolarHBondContact O-N 3.14Å
80	E	81.9	Confident	85.2	Confident	95 Å²	95	87.6 Å²	87.6	44%	0.444	46%	0.457	S	S	.	.	H	α-helix	trans	-50.7	-45.4	-173.9	-44.9	-174.7	152.6	0	0	113	I75 G77 A82 E83 F84	I75-E80 WeakPolarHBondContact O-CG 3.46Å; G77-E80 WeakPolarHBondContact O-CG 3.34Å; E80-A82 PolarHBondContact O-N 3.32Å; E80-E83 PolarHBondContact O-N 2.84Å; E80-F84 WeakPolarHBondContact O-CB 3.45Å; E80-F84 PolarHBondContact O-N 2.92Å
81	F	83.8	Confident	85	Confident	154 Å²	154	86.5 Å²	86.5	68%	0.675	45%	0.451	S	S	*	.	H	α-helix	trans	-64.7	-41.3	-178.4	-72.1	-72	0	0	0	112.6	N79 F84 Y85	N79-F81 VanDerWaalsContact C-N 3.3Å; N79-F81 PolarHBondContact O-N 3.45Å; F81-F84 PolarHBondContact O-N 2.95Å; F81-Y85 HydrophobicContact CB-CE2 4.38Å; F81-Y85 WeakPolarHBondContact O-CD2 3.39Å; F81-Y85 PolarHBondContact O-N 3.45Å
82	A	86.3	Confident	85.1	Confident	52 Å²	52	91.6 Å²	91.6	43%	0.43	47%	0.473	S	S	.	.	H	α-helix	trans	-65.7	-43	-179.9	0	0	0	0	0	111	N79 E80 Y85 N86	N79-A82 PolarHBondContact O-N 3.12Å; N79-A82 VanDerWaalsContact O-N 3.09Å; E80-A82 PolarHBondContact O-N 3.32Å; A82-Y85 PolarHBondContact O-N 2.83Å; A82-N86 WeakPolarHBondContact O-CB 3.43Å; A82-N86 PolarHBondContact O-N 2.91Å; A82-N86 PolarHBondContact O-ND2 2.9Å
83	E	84.5	Confident	85.3	Confident	57 Å²	57	91.4 Å²	91.4	27%	0.266	47%	0.469	S	S	.	.	H	α-helix	trans	-62.9	-44.4	176.3	-177.1	62.7	-169.4	0	0	111.6	N79 E80 Y85 N86 R87	N79-E83 PolarHBondContact O-N 3.14Å; E80-E83 PolarHBondContact O-N 2.84Å; E83-Y85 PolarHBondContact O-N 2.86Å; E83-N86 PolarHBondContact O-N 3.42Å; E83-R87 WeakPolarHBondContact O-CG 3.34Å; E83-R87 PolarHBondContact O-N 3.41Å; E83-R87 IonicContact OE1-CZ 3.38Å; E83-R87 IonicContact OE1-NE 2.89Å; E83-R87 PolarHBondContact OE1-NE 3Å; E83-R87 IonicContact OE1-NH2 2.96Å; E83-R87 PolarHBondContact OE1-NH2 3.24Å
84	F	83.9	Confident	85.2	Confident	126 Å²	126	90.5 Å²	90.5	55%	0.553	46%	0.461	S	S	*	.	H	α-helix	trans	-58.2	-48.1	175.2	179.5	-94.7	0	0	0	112.4	E80 F81 N86 R87 L88	E80-F84 WeakPolarHBondContact O-CB 3.45Å; E80-F84 PolarHBondContact O-N 2.92Å; F81-F84 PolarHBondContact O-N 2.95Å; F84-N86 VanDerWaalsContact C-N 3.32Å; F84-N86 PolarHBondContact O-N 3.12Å; F84-R87 PolarHBondContact O-N 2.81Å; F84-L88 HydrophobicContact CE1-CD2 4.22Å; F84-L88 WeakPolarHBondContact O-CB 3.43Å; F84-L88 PolarHBondContact O-N 3.44Å
85	Y	89.2	Confident	85.2	Confident	147 Å²	147	94.1 Å²	94.1	58%	0.576	47%	0.47	S	S	*	.	H	α-helix	trans	-66.4	-33.9	179.4	-74.2	-61.3	0	0	0	112.7	F81 A82 E83 L88 K89	F81-Y85 HydrophobicContact CB-CE2 4.38Å; F81-Y85 WeakPolarHBondContact O-CD2 3.39Å; F81-Y85 PolarHBondContact O-N 3.45Å; A82-Y85 PolarHBondContact O-N 2.83Å; E83-Y85 PolarHBondContact O-N 2.86Å; Y85-L88 HydrophobicContact CD1-CD2 4.49Å; Y85-K89 WeakPolarHBondContact O-CB 3.45Å; Y85-K89 PolarHBondContact O-N 3.37Å
86	N	86.4	Confident	85.4	Confident	91 Å²	91	100.6 Å²	100.6	49%	0.487	49%	0.49	S	S	.	.	H	α-helix	trans	-63.2	-48.5	173.9	-73	-24.1	0	0	0	111.5	A82 E83 F84 L88 K89 Q90	A82-N86 WeakPolarHBondContact O-CB 3.43Å; A82-N86 PolarHBondContact O-N 2.91Å; A82-N86 PolarHBondContact O-ND2 2.9Å; E83-N86 PolarHBondContact O-N 3.42Å; F84-N86 VanDerWaalsContact C-N 3.32Å; F84-N86 PolarHBondContact O-N 3.12Å; N86-L88 PolarHBondContact O-N 2.96Å; N86-K89 WeakPolarHBondContact O-CB 3.27Å; N86-K89 PolarHBondContact O-N 2.91Å; N86-Q90 WeakPolarHBondContact O-CG 3.45Å; N86-Q90 PolarHBondContact O-N 3.46Å; N86-Q90 VanDerWaalsContact O-N 3.08Å
87	R	84.6	Confident	85.7	Confident	50 Å²	50	104.3 Å²	104.3	19%	0.189	50%	0.496	C	S	.	.	H	α-helix	trans	-63	-42.8	176.6	-66.8	179.8	-171.3	-151.4	3	111.7	M1 E71 E83 F84 K89 Q90 I91	M1-R87 HydrophobicContact CE-CB 4.39Å; M1-R87 WeakPolarHBondContact CE-O 2.98Å; E71-R87 IonicContact OE1-CZ 3.55Å; E71-R87 IonicContact OE1-NH1 3.69Å; E71-R87 PolarHBondContact OE1-NH1 2.87Å; E71-R87 IonicContact OE1-NH2 2.88Å; E83-R87 WeakPolarHBondContact O-CG 3.34Å; E83-R87 PolarHBondContact O-N 3.41Å; E83-R87 IonicContact OE1-CZ 3.38Å; E83-R87 IonicContact OE1-NE 2.89Å; E83-R87 PolarHBondContact OE1-NE 3Å; E83-R87 IonicContact OE1-NH2 2.96Å; E83-R87 PolarHBondContact OE1-NH2 3.24Å; F84-R87 PolarHBondContact O-N 2.81Å; R87-K89 VanDerWaalsContact C-N 3.31Å; R87-K89 PolarHBondContact O-N 2.74Å; R87-Q90 WeakPolarHBondContact O-CB 3.46Å; R87-Q90 PolarHBondContact O-N 3.46Å; R87-I91 WeakPolarHBondContact O-CG1 3.44Å; R87-I91 PolarHBondContact O-N 2.86Å
88	L	88.4	Confident	86	Confident	52 Å²	52	107.2 Å²	107.2	27%	0.272	50%	0.504	S	S	.	.	H	α-helix	trans	-61.8	-39.4	176.3	-178.7	62.7	0	0	0	111.9	F84 Y85 N86 I91 K92	F84-L88 HydrophobicContact CE1-CD2 4.22Å; F84-L88 WeakPolarHBondContact O-CB 3.43Å; F84-L88 PolarHBondContact O-N 3.44Å; Y85-L88 HydrophobicContact CD1-CD2 4.49Å; N86-L88 PolarHBondContact O-N 2.96Å; L88-I91 PolarHBondContact O-N 3.39Å; L88-K92 HydrophobicContact CG-CD 4.38Å; L88-K92 WeakPolarHBondContact O-CG 3.38Å; L88-K92 PolarHBondContact O-N 3.22Å
89	K	91.3	Very high	86.2	Confident	129 Å²	129	105.3 Å²	105.3	56%	0.561	49%	0.491	S	S	*	.	H	α-helix	trans	-62.1	-44.9	175.9	-175.6	-177.9	174.3	-171.7	0	111	Y85 N86 R87 I91 K92 E93	Y85-K89 WeakPolarHBondContact O-CB 3.45Å; Y85-K89 PolarHBondContact O-N 3.37Å; N86-K89 WeakPolarHBondContact O-CB 3.27Å; N86-K89 PolarHBondContact O-N 2.91Å; R87-K89 VanDerWaalsContact C-N 3.31Å; R87-K89 PolarHBondContact O-N 2.74Å; K89-I91 PolarHBondContact O-N 3.33Å; K89-K92 PolarHBondContact O-N 3.16Å; K89-E93 WeakPolarHBondContact CE-OE1 3.5Å; K89-E93 WeakPolarHBondContact O-CG 3.36Å; K89-E93 PolarHBondContact O-N 2.71Å
90	Q	86.8	Confident	86.4	Confident	97 Å²	97	106.7 Å²	106.7	45%	0.453	50%	0.499	S	S	.	.	H	α-helix	trans	-60.6	-42.6	175.8	-70.8	168.9	-11.3	0	0	112.1	M1 N86 R87 E93 F94	M1-Q90 HydrophobicContact CE-CB 3.55Å; M1-Q90 HydrophobicContact CE-CG 4.49Å; M1-Q90 VanDerWaalsContact CE-OE1 3.22Å; M1-Q90 HydrophobicContact SD-CB 4.08Å; M1-Q90 PolarHBondContact SD-OE1 2.99Å; N86-Q90 WeakPolarHBondContact O-CG 3.45Å; N86-Q90 PolarHBondContact O-N 3.46Å; N86-Q90 VanDerWaalsContact O-N 3.08Å; R87-Q90 WeakPolarHBondContact O-CB 3.46Å; R87-Q90 PolarHBondContact O-N 3.46Å; Q90-E93 PolarHBondContact O-N 3.38Å; Q90-F94 WeakPolarHBondContact O-CB 3.46Å; Q90-F94 PolarHBondContact O-N 2.94Å
91	I	84.9	Confident	86.2	Confident	78 Å²	78	107.6 Å²	107.6	40%	0.4	50%	0.503	S	S	.	.	H	α-helix	trans	-61.2	-46	175.5	-66.5	167.5	0	0	0	110.9	M1 R87 L88 K89 E93 F94 H95	M1-I91 HydrophobicContact CE-CD1 4.47Å; M1-I91 HydrophobicContact CE-CG1 3.79Å; R87-I91 WeakPolarHBondContact O-CG1 3.44Å; R87-I91 PolarHBondContact O-N 2.86Å; L88-I91 PolarHBondContact O-N 3.39Å; K89-I91 PolarHBondContact O-N 3.33Å; I91-E93 VanDerWaalsContact C-N 3.32Å; I91-E93 PolarHBondContact O-N 3.44Å; I91-F94 WeakPolarHBondContact O-CB 3.35Å; I91-F94 PolarHBondContact O-N 3.39Å; I91-H95 PolarHBondContact O-N 3.28Å
92	K	88.3	Confident	85.8	Confident	131 Å²	131	107.1 Å²	107.1	57%	0.57	51%	0.506	S	S	*	.	H	α-helix	trans	-62.4	-38.8	177.2	-73.7	176.4	178.4	178.8	0	112.2	L88 K89 R96	L88-K92 HydrophobicContact CG-CD 4.38Å; L88-K92 WeakPolarHBondContact O-CG 3.38Å; L88-K92 PolarHBondContact O-N 3.22Å; K89-K92 PolarHBondContact O-N 3.16Å; K92-R96 WeakPolarHBondContact O-CB 3.4Å; K92-R96 PolarHBondContact O-N 3.08Å
93	E	90.5	Very high	85.1	Confident	85 Å²	85	110 Å²	110	40%	0.397	52%	0.522	S	S	.	.	H	α-helix	trans	-67.1	-39.9	175	-75.3	176.4	-172.7	0	0	112	K89 Q90 I91 R96 K97	K89-E93 WeakPolarHBondContact CE-OE1 3.5Å; K89-E93 WeakPolarHBondContact O-CG 3.36Å; K89-E93 PolarHBondContact O-N 2.71Å; Q90-E93 PolarHBondContact O-N 3.38Å; I91-E93 VanDerWaalsContact C-N 3.32Å; I91-E93 PolarHBondContact O-N 3.44Å; E93-R96 PolarHBondContact O-N 2.87Å; E93-K97 WeakPolarHBondContact O-CG 3.3Å; E93-K97 PolarHBondContact O-N 3.15Å
94	F	84.4	Confident	84.8	Confident	84 Å²	84	112.1 Å²	112.1	37%	0.368	54%	0.538	S	S	.	.	H	α-helix	trans	-60.8	-50.6	175.3	-175.8	-90.1	0	0	0	111.5	Q90 I91 R96 K97 H98 E101	Q90-F94 WeakPolarHBondContact O-CB 3.46Å; Q90-F94 PolarHBondContact O-N 2.94Å; I91-F94 WeakPolarHBondContact O-CB 3.35Å; I91-F94 PolarHBondContact O-N 3.39Å; F94-R96 VanDerWaalsContact C-N 3.27Å; F94-R96 PolarHBondContact O-N 2.73Å; F94-K97 PolarHBondContact O-N 3.02Å; F94-K97 VanDerWaalsContact O-N 3.09Å; F94-H98 AromaticContact CD2-CE1 3.87Å; F94-H98 AromaticContact CD2-ND1 3.72Å; F94-H98 AromaticContact CE1-ND1 3.81Å; F94-H98 AromaticContact CE2-CE1 3.49Å; F94-H98 VanDerWaalsContact CE2-CE1 3.49Å; F94-H98 WeakPolarHBondContact CE2-CE1 3.14Å; F94-H98 AromaticContact CE2-ND1 3.49Å; F94-H98 WeakPolarHBondContact CE2-ND1 3.29Å; F94-H98 AromaticContact CG-ND1 3.98Å; F94-H98 AromaticContact CZ-CE1 3.88Å; F94-H98 AromaticContact CZ-ND1 3.53Å; F94-H98 PolarHBondContact O-N 2.79Å; F94-H98 PolarHBondContact O-ND1 3.04Å; F94-H98 VanDerWaalsContact O-ND1 3.12Å; F94-E101 WeakPolarHBondContact CE1-OE2 3.24Å; F94-E101 WeakPolarHBondContact CZ-OE2 3.24Å
95	H	84.6	Confident	84.7	Confident	117 Å²	117	109.5 Å²	109.5	54%	0.542	53%	0.534	S	S	.	.	H	α-helix	trans	-63.8	-31.5	176.5	-86.1	-71.7	0	0	0	113.3	I91 K97 H98	I91-H95 PolarHBondContact O-N 3.28Å; H95-K97 VanDerWaalsContact C-N 3.35Å; H95-H98 CarbonylContact O-C 3.54Å
96	R	88.9	Confident	84.4	Confident	203 Å²	203	104.5 Å²	104.5	77%	0.766	52%	0.517	S	S	*	.	H	α-helix	trans	-67.1	-36.8	173.6	-174	-175.1	-67.7	176.4	-2.4	111.9	K92 E93 F94	K92-R96 WeakPolarHBondContact O-CB 3.4Å; K92-R96 PolarHBondContact O-N 3.08Å; E93-R96 PolarHBondContact O-N 2.87Å; F94-R96 VanDerWaalsContact C-N 3.27Å; F94-R96 PolarHBondContact O-N 2.73Å
97	K	90.1	Very high	84.2	Confident	163 Å²	163	101.8 Å²	101.8	71%	0.709	50%	0.504	S	S	*	.	H	α-helix	trans	-74.3	-31.4	177.5	-74.6	-179.1	179.4	-179.4	0	112.6	E93 F94 H95 P99	E93-K97 WeakPolarHBondContact O-CG 3.3Å; E93-K97 PolarHBondContact O-N 3.15Å; F94-K97 PolarHBondContact O-N 3.02Å; F94-K97 VanDerWaalsContact O-N 3.09Å; H95-K97 VanDerWaalsContact C-N 3.35Å; K97-P99 VanDerWaalsContact O-CD 3.25Å; K97-P99 WeakPolarHBondContact O-CD 3.48Å
98	H	85.7	Confident	84.2	Confident	80 Å²	80	101.6 Å²	101.6	37%	0.37	51%	0.509	S	S	.	.			trans	-119.9	65.4	-178	-50.5	100.6	0	0	0	111.6	F94 H95 N100 E101	F94-H98 AromaticContact CD2-CE1 3.87Å; F94-H98 AromaticContact CD2-ND1 3.72Å; F94-H98 AromaticContact CE1-ND1 3.81Å; F94-H98 AromaticContact CE2-CE1 3.49Å; F94-H98 VanDerWaalsContact CE2-CE1 3.49Å; F94-H98 WeakPolarHBondContact CE2-CE1 3.14Å; F94-H98 AromaticContact CE2-ND1 3.49Å; F94-H98 WeakPolarHBondContact CE2-ND1 3.29Å; F94-H98 AromaticContact CG-ND1 3.98Å; F94-H98 AromaticContact CZ-CE1 3.88Å; F94-H98 AromaticContact CZ-ND1 3.53Å; F94-H98 PolarHBondContact O-N 2.79Å; F94-H98 PolarHBondContact O-ND1 3.04Å; F94-H98 VanDerWaalsContact O-ND1 3.12Å; H95-H98 CarbonylContact O-C 3.54Å; H98-N100 PolarHBondContact O-N 3Å; H98-E101 HydrophobicContact CB-CB 3.79Å; H98-E101 WeakPolarHBondContact CB-OE2 3.29Å; H98-E101 IonicContact CG-OE2 3.14Å; H98-E101 IonicContact ND1-OE2 2.85Å; H98-E101 PolarHBondContact O-N 3.28Å
99	P	82.9	Confident	84	Confident	98 Å²	98	102.9 Å²	102.9	64%	0.636	51%	0.513	S	S	*	.	T	Hydrogen-bonded Turn	trans	-70.2	-20.5	-174.1	28.9	-35.9	0	0	0	113.8	K97	K97-P99 VanDerWaalsContact O-CD 3.25Å; K97-P99 WeakPolarHBondContact O-CD 3.48Å
100	N	86.6	Confident	83.7	Confident	151 Å²	151	97.3 Å²	97.3	81%	0.807	49%	0.489	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105.3	3	-178.5	-61.2	-22.8	0	0	0	112.8	H98 I102	H98-N100 PolarHBondContact O-N 3Å; N100-I102 PolarHBondContact O-N 3.23Å
101	E	78.6	Confident	83.5	Confident	115 Å²	115	96.7 Å²	96.7	54%	0.537	49%	0.489	S	S	.	.			trans	-76.8	114.1	177.9	-173.5	174.5	-160.1	0	0	109	F94 H98	F94-E101 WeakPolarHBondContact CE1-OE2 3.24Å; F94-E101 WeakPolarHBondContact CZ-OE2 3.24Å; H98-E101 HydrophobicContact CB-CB 3.79Å; H98-E101 WeakPolarHBondContact CB-OE2 3.29Å; H98-E101 IonicContact CG-OE2 3.14Å; H98-E101 IonicContact ND1-OE2 2.85Å; H98-E101 PolarHBondContact O-N 3.28Å
102	I	74.4	Confident	83.5	Confident	144 Å²	144	98.5 Å²	98.5	74%	0.738	50%	0.496	S	S	*	.			trans	-84.9	121.8	177	-57.4	173.2	0	0	0	107	N100 V104	N100-I102 PolarHBondContact O-N 3.23Å; I102-V104 PolarHBondContact O-N 3.44Å; I102-V104 VanDerWaalsContact O-N 3.14Å
103	C	72.8	Confident	83.1	Confident	113 Å²	113	95.6 Å²	95.6	76%	0.764	49%	0.486	S	S	*	.			trans	-68.2	110.5	170.5	-175.5	0	0	0	0	108.3	P105	C103-P105 WeakPolarHBondContact O-CD 3.41Å
104	V	77.7	Confident	82.7	Confident	100 Å²	100	93.5 Å²	93.5	61%	0.606	48%	0.479	S	S	*	.			trans	-87.5	114.1	174	-178.6	0	0	0	0	107.5	I102 V108	I102-V104 PolarHBondContact O-N 3.44Å; I102-V104 VanDerWaalsContact O-N 3.14Å; V104-V108 HydrophobicContact CG1-CB 3.71Å; V104-V108 HydrophobicContact CG1-CG1 3.98Å; V104-V108 HydrophobicContact CG1-CG2 3.88Å
105	P	81.9	Confident	82.6	Confident	72 Å²	72	95.6 Å²	95.6	47%	0.468	49%	0.488	S	S	.	.			trans	-60.8	143.8	174.7	-22.9	34.6	0	0	0	110.5	C103 S107 V108	C103-P105 WeakPolarHBondContact O-CD 3.41Å; P105-S107 PolarHBondContact O-N 2.81Å; P105-V108 HydrophobicContact CB-CG2 4.48Å; P105-V108 WeakPolarHBondContact O-CB 3.27Å; P105-V108 WeakPolarHBondContact O-CG2 3.4Å; P105-V108 PolarHBondContact O-N 3.21Å
106	M	82.6	Confident	82.3	Confident	42 Å²	42	92 Å²	92	21%	0.207	48%	0.479	C	S	.	.	T	Hydrogen-bonded Turn	trans	-55.2	-27.4	176	179.7	176	-79.5	0	0	112.7	R10 E13 E14 V108 E109 F110	R10-M106 HydrophobicContact CG-CE 3.7Å; E13-M106 HydrophobicContact CG-SD 4.39Å; E14-M106 WeakPolarHBondContact CA-SD 3.3Å; E14-M106 HydrophobicContact CB-CE 3.85Å; E14-M106 HydrophobicContact CB-SD 3.53Å; E14-M106 VanDerWaalsContact CB-SD 3.53Å; E14-M106 HydrophobicContact CG-CE 4.15Å; E14-M106 HydrophobicContact CG-SD 3.95Å; M106-V108 PolarHBondContact O-N 3Å; M106-E109 PolarHBondContact O-N 2.92Å; M106-F110 HydrophobicContact CG-CD2 4.41Å; M106-F110 HydrophobicContact CG-CE2 3.84Å; M106-F110 VanDerWaalsContact O-CD2 3.3Å; M106-F110 WeakPolarHBondContact O-CD2 3.42Å; M106-F110 HydrophobicContact SD-CE2 4.48Å
107	S	82.6	Confident	81.9	Confident	33 Å²	33	84.2 Å²	84.2	23%	0.231	45%	0.45	C	S	.	.	H	α-helix	trans	-59.8	-27.4	175.3	59.3	0	0	0	0	114	P105 E109 F110 D111	P105-S107 PolarHBondContact O-N 2.81Å; S107-E109 VanDerWaalsContact C-N 3.31Å; S107-E109 PolarHBondContact O-N 3.41Å; S107-F110 PolarHBondContact O-N 3.45Å; S107-D111 VanDerWaalsContact O-CG 3.27Å; S107-D111 PolarHBondContact O-N 3.14Å
108	V	84.4	Confident	81.3	Confident	46 Å²	46	82.2 Å²	82.2	28%	0.279	44%	0.443	S	S	.	.	H	α-helix	trans	-62.8	-39.9	-178.7	177	0	0	0	0	111.1	V104 P105 M106 F110 D111 E112	V104-V108 HydrophobicContact CG1-CB 3.71Å; V104-V108 HydrophobicContact CG1-CG1 3.98Å; V104-V108 HydrophobicContact CG1-CG2 3.88Å; P105-V108 HydrophobicContact CB-CG2 4.48Å; P105-V108 WeakPolarHBondContact O-CB 3.27Å; P105-V108 WeakPolarHBondContact O-CG2 3.4Å; P105-V108 PolarHBondContact O-N 3.21Å; M106-V108 PolarHBondContact O-N 3Å; V108-F110 VanDerWaalsContact C-N 3.32Å; V108-F110 PolarHBondContact O-N 2.76Å; V108-D111 PolarHBondContact O-N 3.12Å; V108-E112 HydrophobicContact CG1-CG 4.49Å; V108-E112 WeakPolarHBondContact O-CG 3.4Å; V108-E112 PolarHBondContact O-N 3.11Å
109	E	84.4	Confident	81.1	Confident	79 Å²	79	84.3 Å²	84.3	37%	0.369	46%	0.456	S	S	.	.	H	α-helix	trans	-59.8	-43.8	176.6	-174.3	-175.5	-176.9	0	0	111.3	R49 M106 S107 E112 L113	R49-E109 IonicContact CZ-OE1 3.86Å; R49-E109 IonicContact CZ-OE2 2.79Å; R49-E109 VanDerWaalsContact NH1-CD 3.34Å; R49-E109 IonicContact NH1-OE1 3.95Å; R49-E109 PolarHBondContact NH1-OE1 3.4Å; R49-E109 IonicContact NH1-OE2 2.94Å; R49-E109 PolarHBondContact NH1-OE2 2.99Å; R49-E109 IonicContact NH2-OE1 3.39Å; R49-E109 PolarHBondContact NH2-OE1 3.43Å; R49-E109 IonicContact NH2-OE2 3.77Å; R49-E109 PolarHBondContact NH2-OE2 2.73Å; M106-E109 PolarHBondContact O-N 2.92Å; S107-E109 VanDerWaalsContact C-N 3.31Å; S107-E109 PolarHBondContact O-N 3.41Å; E109-E112 PolarHBondContact O-N 3.18Å; E109-L113 WeakPolarHBondContact O-CG 3.44Å; E109-L113 PolarHBondContact O-N 3.23Å
110	F	84.2	Confident	80.6	Confident	13 Å²	13	82.9 Å²	82.9	6%	0.057	45%	0.447	C	S	.	.	H	α-helix	trans	-71	-33.5	178.2	-65	-81.1	0	0	0	112.7	R17 L18 A21 M106 S107 V108 E112 L113 V114	R17-F110 HydrophobicContact CB-CD1 4.35Å; R17-F110 HydrophobicContact CB-CD2 3.63Å; R17-F110 HydrophobicContact CB-CE1 4.04Å; R17-F110 HydrophobicContact CB-CE2 3.29Å; R17-F110 HydrophobicContact CB-CG 4.16Å; R17-F110 HydrophobicContact CB-CZ 3.52Å; R17-F110 HydrophobicContact CG-CD2 4.14Å; R17-F110 HydrophobicContact CG-CE2 3.96Å; L18-F110 HydrophobicContact CD2-CE1 3.72Å; L18-F110 HydrophobicContact CD2-CZ 4.09Å; L18-F110 HydrophobicContact CG-CE1 3.93Å; L18-F110 HydrophobicContact CG-CZ 3.94Å; A21-F110 HydrophobicContact CB-CD1 3.69Å; 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 3.3Å; M106-F110 WeakPolarHBondContact O-CD2 3.42Å; M106-F110 HydrophobicContact SD-CE2 4.48Å; S107-F110 PolarHBondContact O-N 3.45Å; V108-F110 VanDerWaalsContact C-N 3.32Å; V108-F110 PolarHBondContact O-N 2.76Å; F110-E112 VanDerWaalsContact C-N 3.32Å; F110-L113 HydrophobicContact CD1-CD1 4.2Å; F110-L113 PolarHBondContact O-N 2.98Å; F110-V114 WeakPolarHBondContact O-CG2 3.22Å; F110-V114 PolarHBondContact O-N 3.34Å
111	D	83.4	Confident	80	Confident	84 Å²	84	79.5 Å²	79.5	45%	0.449	43%	0.432	S	S	.	.	H	α-helix	trans	-67.5	-34.9	173.2	-67	-25.6	0	0	0	111.3	S107 V108 V114 K115	S107-D111 VanDerWaalsContact O-CG 3.27Å; S107-D111 PolarHBondContact O-N 3.14Å; V108-D111 PolarHBondContact O-N 3.12Å; D111-V114 PolarHBondContact O-N 3.06Å; D111-K115 WeakPolarHBondContact O-CG 3.19Å; D111-K115 PolarHBondContact O-N 2.91Å
112	E	83.9	Confident	79.2	Confident	115 Å²	115	82.6 Å²	82.6	54%	0.537	45%	0.447	S	S	.	.	H	α-helix	trans	-67.3	-39.4	173.7	-75.5	178.3	176.5	0	0	112	V108 E109 F110 V114 K115 A116	V108-E112 HydrophobicContact CG1-CG 4.49Å; V108-E112 WeakPolarHBondContact O-CG 3.4Å; V108-E112 PolarHBondContact O-N 3.11Å; E109-E112 PolarHBondContact O-N 3.18Å; F110-E112 VanDerWaalsContact C-N 3.32Å; E112-V114 VanDerWaalsContact C-N 3.29Å; E112-V114 PolarHBondContact O-N 3.45Å; E112-K115 PolarHBondContact O-N 3.39Å; E112-A116 WeakPolarHBondContact O-CB 3.41Å; E112-A116 PolarHBondContact O-N 3.41Å
113	L	80.4	Confident	78.5	Confident	71 Å²	71	84.5 Å²	84.5	37%	0.372	45%	0.453	S	S	.	.	H	α-helix	trans	-59	-40.6	172.8	-70.1	173.1	0	0	0	112.1	M46 E109 F110 R117	M46-L113 HydrophobicContact CE-CD1 4.25Å; E109-L113 WeakPolarHBondContact O-CG 3.44Å; E109-L113 PolarHBondContact O-N 3.23Å; F110-L113 HydrophobicContact CD1-CD1 4.2Å; F110-L113 PolarHBondContact O-N 2.98Å; L113-R117 PolarHBondContact O-N 3.47Å; L113-R117 VanDerWaalsContact O-N 3.17Å
114	V	81.4	Confident	78.2	Confident	41 Å²	41	81.8 Å²	81.8	25%	0.248	43%	0.432	C	S	.	.	H	α-helix	trans	-65.2	-43.8	175.7	171.8	0	0	0	0	111	F110 D111 E112 R117 E118	F110-V114 WeakPolarHBondContact O-CG2 3.22Å; F110-V114 PolarHBondContact O-N 3.34Å; D111-V114 PolarHBondContact O-N 3.06Å; E112-V114 VanDerWaalsContact C-N 3.29Å; E112-V114 PolarHBondContact O-N 3.45Å; V114-R117 WeakPolarHBondContact O-CB 3.27Å; V114-R117 PolarHBondContact O-N 3.01Å; V114-E118 WeakPolarHBondContact O-CG 3.5Å; V114-E118 PolarHBondContact O-N 3.18Å
115	K	82.9	Confident	77.8	Confident	127 Å²	127	79.7 Å²	79.7	55%	0.552	42%	0.416	S	S	*	.	H	α-helix	trans	-65.5	-39	177.7	-72.5	171.3	-174.3	168.7	0	112.8	D111 E112 R117 E118 N119	D111-K115 WeakPolarHBondContact O-CG 3.19Å; D111-K115 PolarHBondContact O-N 2.91Å; E112-K115 PolarHBondContact O-N 3.39Å; K115-R117 PolarHBondContact O-N 3.2Å; K115-E118 PolarHBondContact O-N 3.27Å; K115-N119 PolarHBondContact O-N 3.35Å
116	A	79	Confident	77.7	Confident	43 Å²	43	79.9 Å²	79.9	36%	0.355	41%	0.413	S	S	.	.	H	α-helix	trans	-65.2	-31.6	177.3	0	0	0	0	0	111.7	E112 N119 P120	E112-A116 WeakPolarHBondContact O-CB 3.41Å; E112-A116 PolarHBondContact O-N 3.41Å; A116-N119 CarbonylContact O-C 3.35Å; A116-P120 VanDerWaalsContact O-CA 3.22Å; A116-P120 WeakPolarHBondContact O-CA 3.4Å
117	R	79.8	Confident	77.7	Confident	39 Å²	39	82 Å²	82	15%	0.147	42%	0.423	C	S	.	.	H	α-helix	trans	-69.6	-43.7	170.1	-178.8	-166.9	69.2	-150.1	-1	112.3	E25 L113 V114 K115	E25-R117 VanDerWaalsContact OE2-CD 3.29Å; E25-R117 WeakPolarHBondContact OE2-CD 3.5Å; E25-R117 IonicContact OE2-CZ 3.44Å; E25-R117 IonicContact OE2-NE 3.08Å; E25-R117 IonicContact OE2-NH1 3.95Å; E25-R117 PolarHBondContact OE2-NH1 3.24Å; L113-R117 PolarHBondContact O-N 3.47Å; L113-R117 VanDerWaalsContact O-N 3.17Å; V114-R117 WeakPolarHBondContact O-CB 3.27Å; V114-R117 PolarHBondContact O-N 3.01Å; K115-R117 PolarHBondContact O-N 3.2Å
118	E	78.8	Confident	78	Confident	121 Å²	121	81.3 Å²	81.3	57%	0.565	42%	0.418	S	S	*	.	H	α-helix	trans	-72.1	-29.6	-178.3	-71.7	177.9	178.6	0	0	113	V114 K115	V114-E118 WeakPolarHBondContact O-CG 3.5Å; V114-E118 PolarHBondContact O-N 3.18Å; K115-E118 PolarHBondContact O-N 3.27Å
119	N	79.6	Confident	78.2	Confident	123 Å²	123	87.4 Å²	87.4	66%	0.658	44%	0.443	S	S	*	.	S	Bend	trans	-132.1	74.8	176.5	-57.5	-69.3	0	0	0	109.1	K115 A116 T121	K115-N119 PolarHBondContact O-N 3.35Å; A116-N119 CarbonylContact O-C 3.35Å; N119-T121 PolarHBondContact O-N 3.16Å
120	P	73	Confident	78.5	Confident	68 Å²	68	85.2 Å²	85.2	44%	0.442	43%	0.433	S	S	.	.			trans	-66	127.6	178.4	26.3	-30.2	0	0	0	109.6	A116 Q125	A116-P120 VanDerWaalsContact O-CA 3.22Å; A116-P120 WeakPolarHBondContact O-CA 3.4Å; P120-Q125 HydrophobicContact CB-CB 4.5Å
121	T	73.6	Confident	78.8	Confident	81 Å²	81	87 Å²	87	50%	0.497	45%	0.447	S	S	.	.			trans	-76.6	158.8	162.9	58.1	0	0	0	0	110.2	N119 E123 T124 Q125	N119-T121 PolarHBondContact O-N 3.16Å; T121-E123 PolarHBondContact O-N 3.17Å; T121-E123 VanDerWaalsContact O-N 3.12Å; T121-T124 WeakPolarHBondContact CA-OG1 3.47Å; T121-T124 PolarHBondContact N-OG1 3.33Å; T121-T124 CarbonylContact O-C 3.59Å; T121-T124 WeakPolarHBondContact O-CA 3.13Å; T121-T124 PolarHBondContact O-N 3.29Å; T121-T124 PolarHBondContact O-OG1 3.46Å; T121-T124 WeakPolarHBondContact OG1-CG2 3.27Å; T121-T124 PolarHBondContact OG1-OG1 3.19Å; T121-Q125 PolarHBondContact O-N 3.05Å
122	E	62.9	Low	78.9	Confident	179 Å²	179	89.2 Å²	89.2	84%	0.836	46%	0.459	S	S	*	.	H	α-helix	trans	-48.3	-41	176.9	-74.4	177.7	168	0	0	112.3	T124 Q125	E122-T124 VanDerWaalsContact C-N 3.31Å; E122-T124 PolarHBondContact O-N 3.02Å; E122-Q125 PolarHBondContact O-N 3.11Å
123	E	60	Low	79.2	Confident	185 Å²	185	88 Å²	88	86%	0.864	45%	0.453	S	S	*	.	H	α-helix	trans	-69.9	-23.5	178.9	-64.2	-178.1	172.7	0	0	114	T121	T121-E123 PolarHBondContact O-N 3.17Å; T121-E123 VanDerWaalsContact O-N 3.12Å
124	T	65.1	Low	79.7	Confident	55 Å²	55	84.9 Å²	84.9	34%	0.337	44%	0.437	S	S	.	.	H	α-helix	trans	-104.9	-3.7	-178.4	54.4	0	0	0	0	113.1	T121 E122 N126	T121-T124 WeakPolarHBondContact CA-OG1 3.47Å; T121-T124 PolarHBondContact N-OG1 3.33Å; T121-T124 CarbonylContact O-C 3.59Å; T121-T124 WeakPolarHBondContact O-CA 3.13Å; T121-T124 PolarHBondContact O-N 3.29Å; T121-T124 PolarHBondContact O-OG1 3.46Å; T121-T124 WeakPolarHBondContact OG1-CG2 3.27Å; T121-T124 PolarHBondContact OG1-OG1 3.19Å; E122-T124 VanDerWaalsContact C-N 3.31Å; E122-T124 PolarHBondContact O-N 3.02Å; T124-N126 VanDerWaalsContact C-N 3.34Å
125	Q	70.3	Confident	80.1	Confident	56 Å²	56	84.6 Å²	84.6	26%	0.262	44%	0.439	S	S	.	.	H	α-helix	trans	-73.9	-28.8	-175.3	-163.4	174.4	-15.8	0	0	111.8	N38 P120 T121 E122	N38-Q125 PolarHBondContact ND2-O 2.68Å; P120-Q125 HydrophobicContact CB-CB 4.5Å; T121-Q125 PolarHBondContact O-N 3.05Å; E122-Q125 PolarHBondContact O-N 3.11Å
126	N	79.5	Confident	80.5	Confident	76 Å²	76	80 Å²	80	41%	0.406	42%	0.418	S	S	.	.			trans	-116.8	115.5	173.9	-68.9	-18.7	0	0	0	110.1	R34 T124 V128 Y136	R34-N126 PolarHBondContact NE-OD1 3.28Å; R34-N126 PolarHBondContact NH2-ND2 3.19Å; R34-N126 PolarHBondContact NH2-OD1 3.13Å; T124-N126 VanDerWaalsContact C-N 3.34Å; N126-V128 VanDerWaalsContact C-N 3.3Å; N126-Y136 WeakPolarHBondContact CA-OH 3.3Å; N126-Y136 HydrophobicContact CB-CE2 4.06Å; N126-Y136 WeakPolarHBondContact OD1-CE2 3.45Å
127	M	82.9	Confident	81.1	Confident	86 Å²	86	78 Å²	78	42%	0.424	40%	0.401	S	S	.	.	S	Bend	trans	-81.8	-15.8	173.8	-68.3	-70.6	-61.7	0	0	112.3	N38 H41 R42 Y136	N38-M127 HydrophobicContact CB-CG 4.1Å; N38-M127 WeakPolarHBondContact OD1-CB 3.47Å; N38-M127 PolarHBondContact OD1-N 3.01Å; N38-M127 VanDerWaalsContact OD1-N 3.09Å; H41-M127 HydrophobicContact CB-CB 3.8Å; H41-M127 HydrophobicContact CB-CE 4.45Å; H41-M127 HydrophobicContact CB-CG 4.41Å; R42-M127 HydrophobicContact CG-CE 3.82Å; R42-M127 HydrophobicContact CG-CG 4.32Å; R42-M127 HydrophobicContact CG-SD 4.03Å; M127-Y136 PolarHBondContact N-OH 3.41Å
128	V	88.4	Confident	81.7	Confident	19 Å²	19	81.5 Å²	81.5	12%	0.115	41%	0.414	C	S	.	.	S	Bend	trans	-147.6	146.2	-174.1	60.1	0	0	0	0	109.6	I37 H41 N126 F130 Y136 R199	I37-V128 HydrophobicContact CG2-CG1 3.83Å; H41-V128 WeakPolarHBondContact NE2-CG1 3.13Å; N126-V128 VanDerWaalsContact C-N 3.3Å; V128-F130 HydrophobicContact CB-CE2 4.49Å; V128-F130 HydrophobicContact CG1-CD2 3.99Å; V128-F130 HydrophobicContact CG1-CE2 3.42Å; V128-F130 VanDerWaalsContact CG1-CE2 3.42Å; V128-F130 HydrophobicContact CG1-CZ 4.3Å; V128-F130 HydrophobicContact CG2-CE2 4.34Å; V128-Y136 HydrophobicContact CG1-CE1 4.26Å; V128-Y136 WeakPolarHBondContact O-CE2 3.43Å; V128-Y136 PolarHBondContact O-OH 3.21Å; V128-R199 HydrophobicContact CG2-CB 3.82Å; V128-R199 HydrophobicContact CG2-CG 3.53Å
129	E	88.2	Confident	82.5	Confident	175 Å²	175	76.6 Å²	76.6	82%	0.818	39%	0.391	S	S	*	.			trans	-90.3	134.6	178.9	-65	-179	-178.3	0	0	110.5	R199	E129-R199 WeakPolarHBondContact O-CD 3.36Å; E129-R199 PolarHBondContact O-NE 3.16Å
130	F	91.3	Very high	83.2	Confident	32 Å²	32	71 Å²	71	14%	0.14	36%	0.361	C	S	.	.			trans	-127.4	152.7	170.9	-75.4	-85.5	0	0	0	108.7	I37 V128 E134 Y136 Y196 R199 V200	I37-F130 HydrophobicContact CD1-CZ 4.39Å; I37-F130 HydrophobicContact CG2-CE2 4.17Å; I37-F130 HydrophobicContact CG2-CZ 4.5Å; V128-F130 HydrophobicContact CB-CE2 4.49Å; V128-F130 HydrophobicContact CG1-CD2 3.99Å; V128-F130 HydrophobicContact CG1-CE2 3.42Å; V128-F130 VanDerWaalsContact CG1-CE2 3.42Å; V128-F130 HydrophobicContact CG1-CZ 4.3Å; V128-F130 HydrophobicContact CG2-CE2 4.34Å; F130-E134 WeakPolarHBondContact CA-OE2 3.21Å; F130-E134 HydrophobicContact CB-CB 4.21Å; F130-E134 HydrophobicContact CD1-CB 4.05Å; F130-E134 WeakPolarHBondContact CD1-OE2 3.17Å; F130-Y136 HydrophobicContact CD2-CD1 4.13Å; F130-Y136 AromaticContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CE1 4.37Å; F130-Y136 AromaticContact CD2-CE2 3.85Å; F130-Y136 HydrophobicContact CD2-CE2 3.85Å; F130-Y136 AromaticContact CD2-CG 3.78Å; F130-Y136 HydrophobicContact CD2-CG 3.78Å; F130-Y136 AromaticContact CE2-CD1 4Å; F130-Y136 HydrophobicContact CE2-CD1 4Å; F130-Y136 HydrophobicContact CE2-CD2 4.3Å; F130-Y136 HydrophobicContact CE2-CE1 4.12Å; F130-Y136 HydrophobicContact CE2-CE2 4.37Å; F130-Y136 HydrophobicContact CE2-CG 4.12Å; F130-Y136 HydrophobicContact CG-CD2 4.47Å; F130-Y196 HydrophobicContact CD1-CE2 4.39Å; F130-Y196 HydrophobicContact CE1-CE2 4.19Å; F130-R199 HydrophobicContact CE1-CB 3.64Å; F130-R199 HydrophobicContact CE2-CB 4.33Å; F130-R199 HydrophobicContact CZ-CB 3.51Å; F130-V200 HydrophobicContact CE1-CG1 3.69Å; F130-V200 HydrophobicContact CZ-CG1 3.77Å
131	S	90.6	Very high	84.2	Confident	51 Å²	51	69.7 Å²	69.7	36%	0.357	35%	0.35	S	S	.	.			trans	-65.8	152.5	166.1	179.7	0	0	0	0	110.1	E133 E134 A135	S131-E133 PolarHBondContact O-N 2.92Å; S131-E134 PolarHBondContact N-OE2 3.41Å; S131-E134 WeakPolarHBondContact O-CB 3.49Å; S131-E134 PolarHBondContact O-N 2.78Å; S131-A135 PolarHBondContact O-N 3.45Å
132	D	86.4	Confident	85.2	Confident	130 Å²	130	65.9 Å²	65.9	70%	0.695	33%	0.327	S	S	*	.	G	3₁₀ helix	trans	-57.3	-39.1	176.3	-58	-30.1	0	0	0	111	E134 A135	D132-E134 PolarHBondContact O-N 2.97Å; D132-A135 PolarHBondContact O-N 3.08Å; D132-A135 VanDerWaalsContact O-N 3.11Å
133	E	88.3	Confident	86.6	Confident	91 Å²	91	61.5 Å²	61.5	43%	0.425	31%	0.306	S	S	.	.	G	3₁₀ helix	trans	-67.7	-21.5	177	-66.1	-70.6	160.4	0	0	113.1	S131 A135 Y139 D141 K348	S131-E133 PolarHBondContact O-N 2.92Å; E133-A135 VanDerWaalsContact C-N 3.32Å; E133-Y139 WeakPolarHBondContact O-CB 3.24Å; E133-D141 HydrophobicContact CB-CB 4.25Å; E133-K348 IonicContact OE1-NZ 3.5Å
134	E	92	Very high	88.1	Confident	5 Å²	5	57.3 Å²	57.3	2%	0.023	29%	0.29	C	S	.	.	G	3₁₀ helix	trans	-81.1	-15.5	176.2	-66.8	175.8	144.5	0	0	112.2	F130 S131 D132 Y136 G137 R138 Y139 D141 Y192 Y196 R199	F130-E134 WeakPolarHBondContact CA-OE2 3.21Å; F130-E134 HydrophobicContact CB-CB 4.21Å; F130-E134 HydrophobicContact CD1-CB 4.05Å; F130-E134 WeakPolarHBondContact CD1-OE2 3.17Å; S131-E134 PolarHBondContact N-OE2 3.41Å; S131-E134 WeakPolarHBondContact O-CB 3.49Å; S131-E134 PolarHBondContact O-N 2.78Å; D132-E134 PolarHBondContact O-N 2.97Å; E134-Y136 VanDerWaalsContact C-N 3.32Å; E134-Y136 PolarHBondContact O-N 2.84Å; E134-G137 PolarHBondContact O-N 3.03Å; E134-G137 VanDerWaalsContact O-N 3.08Å; E134-R138 PolarHBondContact O-N 3.43Å; E134-Y139 VanDerWaalsContact CA-O 3.22Å; E134-Y139 WeakPolarHBondContact CA-O 3.16Å; E134-Y139 WeakPolarHBondContact CB-O 3.29Å; E134-Y139 PolarHBondContact O-N 2.92Å; E134-D141 HydrophobicContact CG-CB 3.98Å; E134-Y192 VanDerWaalsContact OE1-CE2 3.24Å; E134-Y192 WeakPolarHBondContact OE1-CE2 3.32Å; E134-Y192 PolarHBondContact OE1-OH 2.6Å; E134-Y196 HydrophobicContact CB-CE2 4.15Å; E134-Y196 HydrophobicContact CG-CD2 4.42Å; E134-Y196 HydrophobicContact CG-CE2 3.93Å; E134-Y196 VanDerWaalsContact OE1-CD2 3.23Å; E134-Y196 WeakPolarHBondContact OE1-CD2 3.11Å; E134-R199 IonicContact OE1-NH2 2.79Å; E134-R199 PolarHBondContact OE1-NH2 3.13Å; E134-R199 VanDerWaalsContact OE1-NH2 3.08Å; E134-R199 IonicContact OE2-NH2 2.73Å; E134-R199 PolarHBondContact OE2-NH2 2.78Å
135	A	89.8	Confident	89.4	Confident	35 Å²	35	55 Å²	55	29%	0.289	28%	0.275	S	S	.	.	T	Hydrogen-bonded Turn	trans	45.1	55	179.2	0	0	0	0	0	112.4	S131 D132 E133 G137 R138 Y139	S131-A135 PolarHBondContact O-N 3.45Å; D132-A135 PolarHBondContact O-N 3.08Å; D132-A135 VanDerWaalsContact O-N 3.11Å; E133-A135 VanDerWaalsContact C-N 3.32Å; A135-G137 VanDerWaalsContact C-N 3.32Å; A135-G137 PolarHBondContact O-N 3.41Å; A135-R138 HydrophobicContact CB-CB 4.05Å; A135-R138 VanDerWaalsContact O-CB 3.3Å; A135-R138 WeakPolarHBondContact O-CB 3.49Å; A135-R138 PolarHBondContact O-N 2.83Å; A135-Y139 HydrophobicContact CB-CD2 3.72Å; A135-Y139 HydrophobicContact CB-CE2 4.03Å
136	Y	90.2	Very high	90.4	Very high	30 Å²	30	54 Å²	54	12%	0.118	27%	0.269	C	S	.	.	T	Hydrogen-bonded Turn	trans	52.2	43.2	-178.7	-144.7	-93.7	0	0	0	114.3	R34 I37 N38 N126 M127 V128 F130 E134	R34-Y136 HydrophobicContact CB-CD1 3.83Å; R34-Y136 HydrophobicContact CB-CE1 4.2Å; R34-Y136 HydrophobicContact CB-CG 4.38Å; R34-Y136 HydrophobicContact CG-CD1 3.65Å; R34-Y136 HydrophobicContact CG-CD2 4.5Å; R34-Y136 HydrophobicContact CG-CE1 3.65Å; R34-Y136 HydrophobicContact CG-CG 4.08Å; I37-Y136 HydrophobicContact CB-CD1 4.35Å; I37-Y136 HydrophobicContact CB-CE1 4.02Å; I37-Y136 HydrophobicContact CD1-CD1 4.18Å; I37-Y136 WeakPolarHBondContact CD1-O 3.22Å; I37-Y136 HydrophobicContact CG2-CD1 4.34Å; I37-Y136 HydrophobicContact CG2-CE1 3.79Å; N38-Y136 PolarHBondContact OD1-OH 3.48Å; N126-Y136 WeakPolarHBondContact CA-OH 3.3Å; N126-Y136 HydrophobicContact CB-CE2 4.06Å; N126-Y136 WeakPolarHBondContact OD1-CE2 3.45Å; M127-Y136 PolarHBondContact N-OH 3.41Å; V128-Y136 HydrophobicContact CG1-CE1 4.26Å; V128-Y136 WeakPolarHBondContact O-CE2 3.43Å; V128-Y136 PolarHBondContact O-OH 3.21Å; F130-Y136 HydrophobicContact CD2-CD1 4.13Å; F130-Y136 AromaticContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CD2 3.62Å; F130-Y136 HydrophobicContact CD2-CE1 4.37Å; F130-Y136 AromaticContact CD2-CE2 3.85Å; F130-Y136 HydrophobicContact CD2-CE2 3.85Å; F130-Y136 AromaticContact CD2-CG 3.78Å; F130-Y136 HydrophobicContact CD2-CG 3.78Å; F130-Y136 AromaticContact CE2-CD1 4Å; F130-Y136 HydrophobicContact CE2-CD1 4Å; F130-Y136 HydrophobicContact CE2-CD2 4.3Å; F130-Y136 HydrophobicContact CE2-CE1 4.12Å; F130-Y136 HydrophobicContact CE2-CE2 4.37Å; F130-Y136 HydrophobicContact CE2-CG 4.12Å; F130-Y136 HydrophobicContact CG-CD2 4.47Å; E134-Y136 VanDerWaalsContact C-N 3.32Å; E134-Y136 PolarHBondContact O-N 2.84Å
137	G	92.4	Very high	91	Very high	0 Å²	0	57.3 Å²	57.3	0%	0	28%	0.276	C	S	.	.	T	Hydrogen-bonded Turn	trans	93.5	5.3	175.6	0	0	0	0	0	115.2	E134 A135 Y196 V200 Q337	E134-G137 PolarHBondContact O-N 3.03Å; E134-G137 VanDerWaalsContact O-N 3.08Å; A135-G137 VanDerWaalsContact C-N 3.32Å; A135-G137 PolarHBondContact O-N 3.41Å; G137-Y196 WeakPolarHBondContact CA-OH 3.5Å; G137-Y196 PolarHBondContact O-OH 3.41Å; G137-V200 VanDerWaalsContact CA-CG1 3.49Å; G137-Q337 WeakPolarHBondContact O-CG 3.17Å
138	R	92.5	Very high	91.2	Very high	114 Å²	114	58.5 Å²	58.5	43%	0.43	28%	0.279	S	S	.	.	T	Hydrogen-bonded Turn	trans	-78.1	-37.3	177.2	-169	178	-174.8	117.6	0.8	112.4	L33 E134 A135	L33-R138 HydrophobicContact CD2-CB 4Å; E134-R138 PolarHBondContact O-N 3.43Å; A135-R138 HydrophobicContact CB-CB 4.05Å; A135-R138 VanDerWaalsContact O-CB 3.3Å; A135-R138 WeakPolarHBondContact O-CB 3.49Å; A135-R138 PolarHBondContact O-N 2.83Å
139	Y	94.9	Very high	91.2	Very high	17 Å²	17	59 Å²	59	7%	0.067	28%	0.28	C	S	.	.	S	Bend	trans	-128.5	156.7	-175.6	-53.8	-53.3	0	0	0	111.8	E133 E134 A135 Y196 L340 T341 N344	E133-Y139 WeakPolarHBondContact O-CB 3.24Å; E134-Y139 VanDerWaalsContact CA-O 3.22Å; E134-Y139 WeakPolarHBondContact CA-O 3.16Å; E134-Y139 WeakPolarHBondContact CB-O 3.29Å; E134-Y139 PolarHBondContact O-N 2.92Å; A135-Y139 HydrophobicContact CB-CD2 3.72Å; A135-Y139 HydrophobicContact CB-CE2 4.03Å; Y139-Y196 WeakPolarHBondContact O-CE2 3.07Å; Y139-Y196 PolarHBondContact O-OH 2.65Å; Y139-L340 HydrophobicContact CD1-CB 4.05Å; Y139-L340 HydrophobicContact CE1-CB 3.99Å; Y139-T341 WeakPolarHBondContact CA-OG1 3.49Å; Y139-N344 HydrophobicContact CD1-CB 4.04Å; Y139-N344 HydrophobicContact CE1-CB 3.68Å; Y139-N344 HydrophobicContact CE2-CB 4.49Å
140	L	94.9	Very high	91.2	Very high	6 Å²	6	53.4 Å²	53.4	3%	0.031	26%	0.255	C	S	.	.			trans	-98.9	126.6	174.7	-65.7	153.5	0	0	0	109.3	L142 Y192 L193 Y196 L334 Q337 R338 T341	L140-L142 HydrophobicContact CB-CD1 4.31Å; L140-L142 HydrophobicContact CB-CG 4.01Å; L140-L142 PolarHBondContact O-N 3.26Å; L140-Y192 HydrophobicContact CD2-CE1 4.02Å; L140-L193 HydrophobicContact CD2-CD2 4.34Å; L140-Y196 HydrophobicContact CD2-CD1 3.51Å; L140-Y196 HydrophobicContact CD2-CD2 4.1Å; L140-Y196 HydrophobicContact CD2-CE1 3.49Å; L140-Y196 VanDerWaalsContact CD2-CE1 3.49Å; L140-Y196 HydrophobicContact CD2-CE2 4.07Å; L140-Y196 HydrophobicContact CD2-CG 3.82Å; L140-Y196 HydrophobicContact CG-CE1 4.28Å; L140-L334 HydrophobicContact CD2-CD1 4.17Å; L140-Q337 HydrophobicContact CD1-CB 4.1Å; L140-Q337 HydrophobicContact CG-CB 4.15Å; L140-R338 HydrophobicContact CD1-CB 4.15Å; L140-T341 HydrophobicContact CB-CG2 4.42Å; L140-T341 PolarHBondContact N-OG1 2.96Å; L140-T341 VanDerWaalsContact O-CG2 3.28Å; L140-T341 WeakPolarHBondContact O-CG2 3.42Å
141	D	94.1	Very high	91.1	Very high	41 Å²	41	58.1 Å²	58.1	22%	0.219	28%	0.282	C	S	.	.			trans	-85.1	91.9	168.8	-174.9	2.3	0	0	0	110.3	E133 E134 H143 Y192	E133-D141 HydrophobicContact CB-CB 4.25Å; E134-D141 HydrophobicContact CG-CB 3.98Å; D141-H143 WeakPolarHBondContact OD1-CB 3.23Å; D141-H143 PolarHBondContact OD1-N 2.98Å; D141-H143 VanDerWaalsContact OD1-N 3.11Å; D141-Y192 PolarHBondContact N-OH 2.93Å
142	L	93.9	Very high	90.8	Very high	1 Å²	1	56.8 Å²	56.8	1%	0.005	27%	0.27	C	S	.	.			trans	-101.1	12.9	177.3	-60.8	177.7	0	0	0	112.7	L140 D144 C145 Y146 Y160 Y163 L164 F167 L189 Y192	L140-L142 HydrophobicContact CB-CD1 4.31Å; L140-L142 HydrophobicContact CB-CG 4.01Å; L140-L142 PolarHBondContact O-N 3.26Å; L142-D144 PolarHBondContact O-N 3.5Å; L142-C145 HydrophobicContact CB-CB 4.47Å; L142-C145 HydrophobicContact CD2-CB 4.49Å; L142-C145 WeakPolarHBondContact O-CB 3.37Å; L142-C145 PolarHBondContact O-N 3.32Å; L142-Y146 WeakPolarHBondContact O-CB 3.32Å; L142-Y146 PolarHBondContact O-N 3.42Å; L142-Y160 PolarHBondContact N-OH 3.25Å; L142-Y163 HydrophobicContact CB-CE1 4.22Å; L142-L164 HydrophobicContact CB-CD2 4.08Å; L142-L164 HydrophobicContact CD1-CD2 3.68Å; L142-L164 HydrophobicContact CG-CD2 4.42Å; L142-F167 HydrophobicContact CD1-CD1 4.39Å; L142-F167 HydrophobicContact CD1-CD2 4.47Å; L142-F167 HydrophobicContact CD1-CE1 4Å; L142-F167 HydrophobicContact CD1-CE2 4.09Å; L142-F167 HydrophobicContact CD1-CZ 3.83Å; L142-L189 HydrophobicContact CD2-CD1 4.07Å; L142-Y192 HydrophobicContact CD2-CD1 3.68Å; L142-Y192 HydrophobicContact CD2-CE1 3.52Å; L142-Y192 HydrophobicContact CG-CE1 4.48Å
143	H	91.9	Very high	90.3	Very high	87 Å²	87	58.6 Å²	58.6	40%	0.403	27%	0.272	S	S	.	.	H	α-helix	trans	-66.4	-42.5	-174.9	-163.9	77.5	0	0	0	111.7	D141 C145 Y146 R147 Y160	D141-H143 WeakPolarHBondContact OD1-CB 3.23Å; D141-H143 PolarHBondContact OD1-N 2.98Å; D141-H143 VanDerWaalsContact OD1-N 3.11Å; H143-C145 VanDerWaalsContact C-N 3.34Å; H143-C145 PolarHBondContact O-N 2.92Å; H143-Y146 WeakPolarHBondContact O-CB 3.35Å; H143-Y146 PolarHBondContact O-N 3.37Å; H143-R147 WeakPolarHBondContact O-CG 3.5Å; H143-R147 PolarHBondContact O-N 2.92Å; H143-Y160 HydrophobicContact CB-CE2 4.5Å; H143-Y160 PolarHBondContact N-OH 3.19Å
144	D	91.8	Very high	89.5	Confident	97 Å²	97	56.5 Å²	56.5	52%	0.519	28%	0.275	S	S	.	.	H	α-helix	trans	-66.8	-36.2	175.7	-84.8	-13.9	0	0	0	112.5	L142 R147 K148	L142-D144 PolarHBondContact O-N 3.5Å; D144-R147 PolarHBondContact O-N 3.03Å; D144-R147 IonicContact OD1-NH1 2.73Å; D144-K148 PolarHBondContact O-N 3.45Å
145	C	92.4	Very high	88.6	Confident	5 Å²	5	57.6 Å²	57.6	3%	0.034	29%	0.285	C	S	.	.	H	α-helix	trans	-60.2	-48.1	172.2	-67.3	0	0	0	0	111.4	L142 H143 R147 K148 F149 Y163 Y185 M188 L189	L142-C145 HydrophobicContact CB-CB 4.47Å; L142-C145 HydrophobicContact CD2-CB 4.49Å; L142-C145 WeakPolarHBondContact O-CB 3.37Å; L142-C145 PolarHBondContact O-N 3.32Å; H143-C145 VanDerWaalsContact C-N 3.34Å; H143-C145 PolarHBondContact O-N 2.92Å; C145-R147 PolarHBondContact O-N 3.46Å; C145-K148 PolarHBondContact O-N 2.95Å; C145-F149 PolarHBondContact O-N 2.87Å; C145-Y163 WeakPolarHBondContact CB-OH 3.44Å; C145-Y185 HydrophobicContact CB-CE2 4.5Å; C145-Y185 WeakPolarHBondContact O-CE2 3.22Å; C145-M188 HydrophobicContact CB-CE 4.12Å; C145-L189 HydrophobicContact CB-CD1 4.33Å
146	Y	92.1	Very high	87.9	Confident	35 Å²	35	61.6 Å²	61.6	14%	0.137	30%	0.298	C	S	.	.	H	α-helix	trans	-59.1	-43.7	176.4	166.2	-113.5	0	0	0	112.9	L142 H143 K148 F149 I150 L158 Y160 Y163	L142-Y146 WeakPolarHBondContact O-CB 3.32Å; L142-Y146 PolarHBondContact O-N 3.42Å; H143-Y146 WeakPolarHBondContact O-CB 3.35Å; H143-Y146 PolarHBondContact O-N 3.37Å; Y146-K148 VanDerWaalsContact C-N 3.3Å; Y146-K148 PolarHBondContact O-N 3.11Å; Y146-F149 WeakPolarHBondContact O-CB 3.22Å; Y146-F149 PolarHBondContact O-N 2.83Å; Y146-F149 VanDerWaalsContact O-N 3.09Å; Y146-I150 HydrophobicContact CD1-CD1 3.91Å; Y146-I150 HydrophobicContact CD2-CD1 3.93Å; Y146-I150 HydrophobicContact CD2-CG1 4.07Å; Y146-I150 HydrophobicContact CE1-CD1 3.39Å; Y146-I150 HydrophobicContact CE2-CD1 3.41Å; Y146-I150 VanDerWaalsContact CE2-CD1 3.41Å; Y146-I150 HydrophobicContact CE2-CG1 3.71Å; Y146-I150 HydrophobicContact CG-CD1 4.16Å; Y146-I150 WeakPolarHBondContact O-CG1 3.28Å; Y146-I150 PolarHBondContact O-N 3.08Å; Y146-I150 WeakPolarHBondContact OH-CD1 3.47Å; Y146-L158 WeakPolarHBondContact CE2-O 3.15Å; Y146-L158 PolarHBondContact OH-O 2.69Å; Y146-Y160 AromaticContact CD1-CD2 3.58Å; Y146-Y160 HydrophobicContact CD1-CD2 3.58Å; Y146-Y160 HydrophobicContact CD1-CE2 4.35Å; Y146-Y160 HydrophobicContact CD1-CG 4.35Å; Y146-Y160 AromaticContact CD2-CD2 4Å; Y146-Y160 HydrophobicContact CD2-CD2 4Å; Y146-Y160 HydrophobicContact CE1-CD2 4.14Å; 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 4.13Å; Y146-Y160 PolarHBondContact OH-N 2.88Å; Y146-Y163 HydrophobicContact CD2-CD1 4.04Å; Y146-Y163 HydrophobicContact CD2-CD2 4.16Å; Y146-Y163 AromaticContact CD2-CG 3.69Å; Y146-Y163 HydrophobicContact CD2-CG 3.69Å; Y146-Y163 HydrophobicContact CG-CD1 4.37Å; Y146-Y163 HydrophobicContact CG-CG 4.44Å
147	R	91	Very high	87.4	Confident	146 Å²	146	69.5 Å²	69.5	55%	0.551	33%	0.333	S	S	*	.	H	α-helix	trans	-60.5	-39.7	177.7	-69.9	175.8	80.3	-170.9	10.2	111.9	H143 D144 C145 N151	H143-R147 WeakPolarHBondContact O-CG 3.5Å; H143-R147 PolarHBondContact O-N 2.92Å; D144-R147 PolarHBondContact O-N 3.03Å; D144-R147 IonicContact OD1-NH1 2.73Å; C145-R147 PolarHBondContact O-N 3.46Å; R147-N151 PolarHBondContact O-ND2 2.89Å
148	K	88.9	Confident	87	Confident	111 Å²	111	71.6 Å²	71.6	48%	0.483	34%	0.344	S	S	.	.	H	α-helix	trans	-70.8	-36.4	174.2	-64.5	-156.4	-164.7	166.5	0	112	D144 C145 Y146 N151 L152 Y185 M188	D144-K148 PolarHBondContact O-N 3.45Å; C145-K148 PolarHBondContact O-N 2.95Å; Y146-K148 VanDerWaalsContact C-N 3.3Å; Y146-K148 PolarHBondContact O-N 3.11Å; K148-N151 PolarHBondContact O-N 2.65Å; K148-L152 PolarHBondContact O-N 3.26Å; K148-Y185 HydrophobicContact CB-CD2 4.33Å; K148-M188 HydrophobicContact CB-CE 3.93Å; K148-M188 HydrophobicContact CD-CE 3.61Å; K148-M188 HydrophobicContact CD-SD 3.37Å; K148-M188 WeakPolarHBondContact CD-SD 3.38Å; K148-M188 WeakPolarHBondContact CE-SD 3.48Å; K148-M188 HydrophobicContact CG-CE 3.94Å; K148-M188 HydrophobicContact CG-SD 4.15Å; K148-M188 PolarHBondContact NZ-SD 3.3Å
149	F	87.8	Confident	86.9	Confident	31 Å²	31	72.9 Å²	72.9	14%	0.136	36%	0.355	C	S	.	.	H	α-helix	trans	-59.8	-47.4	176.5	-179.9	-94.4	0	0	0	112.4	C145 Y146 N151 L152 A155 L158 Y163 Y185	C145-F149 PolarHBondContact O-N 2.87Å; Y146-F149 WeakPolarHBondContact O-CB 3.22Å; Y146-F149 PolarHBondContact O-N 2.83Å; Y146-F149 VanDerWaalsContact O-N 3.09Å; F149-N151 PolarHBondContact O-N 2.85Å; F149-L152 HydrophobicContact CD2-CD1 3.94Å; F149-L152 HydrophobicContact CE2-CD1 4.49Å; F149-L152 VanDerWaalsContact O-CB 3.24Å; F149-L152 WeakPolarHBondContact O-CB 3.4Å; F149-L152 WeakPolarHBondContact O-CG 3.46Å; F149-L152 PolarHBondContact O-N 2.65Å; F149-A155 HydrophobicContact CE1-CB 4.32Å; F149-A155 HydrophobicContact CZ-CB 4.36Å; F149-L158 HydrophobicContact CE1-CD1 3.93Å; F149-L158 HydrophobicContact CZ-CD1 4.31Å; F149-Y163 HydrophobicContact CB-CD2 4.16Å; F149-Y163 HydrophobicContact CB-CE2 3.7Å; F149-Y163 AromaticContact CD1-CD2 3.76Å; F149-Y163 HydrophobicContact CD1-CD2 3.76Å; F149-Y163 HydrophobicContact CD1-CE2 4.11Å; F149-Y163 HydrophobicContact CD2-CD2 4.35Å; F149-Y163 AromaticContact CD2-CE2 4Å; F149-Y163 HydrophobicContact CD2-CE2 4Å; F149-Y163 HydrophobicContact CE1-CD2 4.24Å; F149-Y163 AromaticContact CG-CD2 3.82Å; F149-Y163 HydrophobicContact CG-CD2 3.82Å; F149-Y163 AromaticContact CG-CE2 3.66Å; F149-Y163 HydrophobicContact CG-CE2 3.66Å; F149-Y185 HydrophobicContact CB-CD2 4.26Å; F149-Y185 HydrophobicContact CB-CE2 3.76Å; F149-Y185 HydrophobicContact CD2-CE1 4.19Å; F149-Y185 HydrophobicContact CD2-CE2 4.23Å; F149-Y185 AromaticContact CD2-CZ 3.89Å; F149-Y185 HydrophobicContact CG-CE2 4.49Å
150	I	88.5	Confident	86.7	Confident	57 Å²	57	74.1 Å²	74.1	29%	0.292	36%	0.36	S	S	.	.	H	α-helix	trans	-61.2	-32.3	178.6	-63.9	163.5	0	0	0	111.9	Y146 L152	Y146-I150 HydrophobicContact CD1-CD1 3.91Å; Y146-I150 HydrophobicContact CD2-CD1 3.93Å; Y146-I150 HydrophobicContact CD2-CG1 4.07Å; Y146-I150 HydrophobicContact CE1-CD1 3.39Å; Y146-I150 HydrophobicContact CE2-CD1 3.41Å; Y146-I150 VanDerWaalsContact CE2-CD1 3.41Å; Y146-I150 HydrophobicContact CE2-CG1 3.71Å; Y146-I150 HydrophobicContact CG-CD1 4.16Å; Y146-I150 WeakPolarHBondContact O-CG1 3.28Å; Y146-I150 PolarHBondContact O-N 3.08Å; Y146-I150 WeakPolarHBondContact OH-CD1 3.47Å; I150-L152 PolarHBondContact O-N 3Å
151	N	87.6	Confident	86.4	Confident	131 Å²	131	76.1 Å²	76.1	70%	0.701	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.5	-9	179.5	-71.8	-30.8	0	0	0	113.2	R147 K148 F149 K153	R147-N151 PolarHBondContact O-ND2 2.89Å; K148-N151 PolarHBondContact O-N 2.65Å; F149-N151 PolarHBondContact O-N 2.85Å; N151-K153 PolarHBondContact O-N 2.94Å
152	L	85.3	Confident	86.2	Confident	22 Å²	22	76.5 Å²	76.5	12%	0.115	38%	0.376	C	S	.	.	S	Bend	trans	-66	131.8	177.5	-67.7	173.3	0	0	0	111	K148 F149 I150 G154 A155 E181 Y182 Y185	K148-L152 PolarHBondContact O-N 3.26Å; F149-L152 HydrophobicContact CD2-CD1 3.94Å; F149-L152 HydrophobicContact CE2-CD1 4.49Å; F149-L152 VanDerWaalsContact O-CB 3.24Å; F149-L152 WeakPolarHBondContact O-CB 3.4Å; F149-L152 WeakPolarHBondContact O-CG 3.46Å; F149-L152 PolarHBondContact O-N 2.65Å; I150-L152 PolarHBondContact O-N 3Å; L152-G154 PolarHBondContact O-N 3.24Å; L152-G154 VanDerWaalsContact O-N 3.08Å; L152-A155 HydrophobicContact CB-CB 3.91Å; L152-A155 WeakPolarHBondContact O-CB 3.43Å; L152-A155 PolarHBondContact O-N 3.47Å; L152-A155 VanDerWaalsContact O-N 3.11Å; L152-E181 HydrophobicContact CD2-CB 3.84Å; L152-Y182 HydrophobicContact CD1-CD2 4.13Å; L152-Y185 HydrophobicContact CD1-CD1 4.17Å; L152-Y185 HydrophobicContact CD1-CG 4.04Å
153	K	76.9	Confident	86.1	Confident	168 Å²	168	76.5 Å²	76.5	73%	0.73	38%	0.376	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.7	113.2	-179.2	-170.5	177.3	-177.6	177.8	0	111.6	N151	N151-K153 PolarHBondContact O-N 2.94Å
154	G	70.9	Confident	86	Confident	48 Å²	48	72.7 Å²	72.7	50%	0.495	36%	0.358	S	S	.	.	T	Hydrogen-bonded Turn	trans	87.6	8.7	179.2	0	0	0	0	0	114.4	L152 R177	L152-G154 PolarHBondContact O-N 3.24Å; L152-G154 VanDerWaalsContact O-N 3.08Å; G154-R177 PolarHBondContact O-NE 3.28Å; G154-R177 PolarHBondContact O-NH1 3.33Å
155	A	72.4	Confident	85.8	Confident	28 Å²	28	70.9 Å²	70.9	23%	0.231	35%	0.353	C	S	.	.			trans	-71.5	146.5	164.5	0	0	0	0	0	110.5	F149 L152	F149-A155 HydrophobicContact CE1-CB 4.32Å; F149-A155 HydrophobicContact CZ-CB 4.36Å; L152-A155 HydrophobicContact CB-CB 3.91Å; L152-A155 WeakPolarHBondContact O-CB 3.43Å; L152-A155 PolarHBondContact O-N 3.47Å; L152-A155 VanDerWaalsContact O-N 3.11Å
156	E	74.5	Confident	85.5	Confident	119 Å²	119	72.3 Å²	72.3	56%	0.556	36%	0.363	S	S	*	.			trans	-72.6	142.5	173.1	-73.1	173.2	-159.9	0	0	109.4	L158	E156-L158 HydrophobicContact CB-CD2 4.29Å; E156-L158 HydrophobicContact CB-CG 4.3Å; E156-L158 PolarHBondContact O-N 3.4Å
157	K	80.1	Confident	85.3	Confident	195 Å²	195	71 Å²	71	85%	0.848	36%	0.358	S	S	*	.			trans	-75.7	85.7	174.9	-66.9	-173.6	179.1	-174	0	108.3
158	L	84.6	Confident	84.9	Confident	45 Å²	45	65.5 Å²	65.5	24%	0.236	34%	0.34	C	S	.	.			trans	-85	149.3	175.6	-61.4	176.9	0	0	0	109.8	Y146 F149 E156	Y146-L158 WeakPolarHBondContact CE2-O 3.15Å; Y146-L158 PolarHBondContact OH-O 2.69Å; F149-L158 HydrophobicContact CE1-CD1 3.93Å; F149-L158 HydrophobicContact CZ-CD1 4.31Å; E156-L158 HydrophobicContact CB-CD2 4.29Å; E156-L158 HydrophobicContact CB-CG 4.3Å; E156-L158 PolarHBondContact O-N 3.4Å
159	E	90.2	Very high	84.6	Confident	141 Å²	141	64 Å²	64	66%	0.659	33%	0.334	S	S	*	.			trans	-74.4	159.8	165.3	-65.2	-178.8	177.3	0	0	110.1	I161 S162 Y163	E159-I161 VanDerWaalsContact C-N 3.31Å; E159-I161 HydrophobicContact CB-CG2 4.49Å; E159-I161 PolarHBondContact O-N 3.44Å; E159-S162 PolarHBondContact O-N 3.49Å; E159-S162 VanDerWaalsContact O-N 3.12Å; E159-Y163 PolarHBondContact O-N 3.37Å
160	Y	90.7	Very high	84.3	Confident	43 Å²	43	62.8 Å²	62.8	17%	0.169	33%	0.329	C	S	.	.	H	α-helix	trans	-58	-42.3	-175.8	-175	-121.7	0	0	0	112.6	L142 H143 Y146 S162 Y163 L164 V345	L142-Y160 PolarHBondContact N-OH 3.25Å; H143-Y160 HydrophobicContact CB-CE2 4.5Å; H143-Y160 PolarHBondContact N-OH 3.19Å; Y146-Y160 AromaticContact CD1-CD2 3.58Å; Y146-Y160 HydrophobicContact CD1-CD2 3.58Å; Y146-Y160 HydrophobicContact CD1-CE2 4.35Å; Y146-Y160 HydrophobicContact CD1-CG 4.35Å; Y146-Y160 AromaticContact CD2-CD2 4Å; Y146-Y160 HydrophobicContact CD2-CD2 4Å; Y146-Y160 HydrophobicContact CE1-CD2 4.14Å; 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 4.13Å; Y146-Y160 PolarHBondContact OH-N 2.88Å; Y160-S162 PolarHBondContact O-N 2.86Å; Y160-Y163 HydrophobicContact CD2-CD1 4.32Å; Y160-Y163 HydrophobicContact CE2-CD1 4.31Å; Y160-Y163 WeakPolarHBondContact O-CB 3.35Å; Y160-Y163 PolarHBondContact O-N 2.87Å; Y160-L164 HydrophobicContact CD1-CD1 4.13Å; Y160-L164 HydrophobicContact CE1-CD1 3.74Å; Y160-L164 HydrophobicContact CE1-CG 4.27Å; Y160-L164 HydrophobicContact CE2-CD2 4.3Å; Y160-L164 HydrophobicContact CE2-CG 4.4Å; Y160-L164 WeakPolarHBondContact O-CG 3.45Å; Y160-L164 PolarHBondContact O-N 3.15Å; Y160-V345 HydrophobicContact CD1-CG1 3.8Å; Y160-V345 HydrophobicContact CD1-CG2 4.2Å; Y160-V345 HydrophobicContact CE1-CG1 4.18Å; Y160-V345 HydrophobicContact CE1-CG2 3.71Å
161	I	89.8	Confident	83.9	Confident	47 Å²	47	64.5 Å²	64.5	24%	0.241	34%	0.335	C	S	.	.	H	α-helix	trans	-62.9	-41.8	178	-165.1	166.7	0	0	0	112	E159 Y163 L164 S165 V345 Q346	E159-I161 VanDerWaalsContact C-N 3.31Å; E159-I161 HydrophobicContact CB-CG2 4.49Å; E159-I161 PolarHBondContact O-N 3.44Å; I161-Y163 VanDerWaalsContact C-N 3.31Å; I161-Y163 PolarHBondContact O-N 3.45Å; I161-L164 PolarHBondContact O-N 2.84Å; I161-S165 PolarHBondContact O-N 3.23Å; I161-S165 PolarHBondContact O-OG 3.46Å; I161-S165 VanDerWaalsContact O-OG 3.12Å; I161-V345 HydrophobicContact CB-CG1 4.5Å; I161-Q346 HydrophobicContact CD1-CB 3.87Å; I161-Q346 HydrophobicContact CD1-CG 4.06Å
162	S	89.6	Confident	83.4	Confident	50 Å²	50	63.6 Å²	63.6	35%	0.35	33%	0.33	S	S	.	.	H	α-helix	trans	-67.2	-34	176.8	-53	0	0	0	0	112.1	E159 Y160 S165 S166	E159-S162 PolarHBondContact O-N 3.49Å; E159-S162 VanDerWaalsContact O-N 3.12Å; Y160-S162 PolarHBondContact O-N 2.86Å; S162-S165 PolarHBondContact O-N 2.86Å; S162-S166 PolarHBondContact O-N 3.03Å; S162-S166 PolarHBondContact O-OG 2.89Å
163	Y	91.3	Very high	83.1	Confident	1 Å²	1	64.1 Å²	64.1	0%	0.004	33%	0.334	C	S	.	.	H	α-helix	trans	-63.4	-46.3	171.6	168.1	-93.4	0	0	0	111.1	L142 C145 Y146 F149 E159 Y160 I161 S165 S166 F167 Y185	L142-Y163 HydrophobicContact CB-CE1 4.22Å; C145-Y163 WeakPolarHBondContact CB-OH 3.44Å; Y146-Y163 HydrophobicContact CD2-CD1 4.04Å; Y146-Y163 HydrophobicContact CD2-CD2 4.16Å; Y146-Y163 AromaticContact CD2-CG 3.69Å; Y146-Y163 HydrophobicContact CD2-CG 3.69Å; Y146-Y163 HydrophobicContact CG-CD1 4.37Å; Y146-Y163 HydrophobicContact CG-CG 4.44Å; F149-Y163 HydrophobicContact CB-CD2 4.16Å; F149-Y163 HydrophobicContact CB-CE2 3.7Å; F149-Y163 AromaticContact CD1-CD2 3.76Å; F149-Y163 HydrophobicContact CD1-CD2 3.76Å; F149-Y163 HydrophobicContact CD1-CE2 4.11Å; F149-Y163 HydrophobicContact CD2-CD2 4.35Å; F149-Y163 AromaticContact CD2-CE2 4Å; F149-Y163 HydrophobicContact CD2-CE2 4Å; F149-Y163 HydrophobicContact CE1-CD2 4.24Å; F149-Y163 AromaticContact CG-CD2 3.82Å; F149-Y163 HydrophobicContact CG-CD2 3.82Å; F149-Y163 AromaticContact CG-CE2 3.66Å; F149-Y163 HydrophobicContact CG-CE2 3.66Å; E159-Y163 PolarHBondContact O-N 3.37Å; Y160-Y163 HydrophobicContact CD2-CD1 4.32Å; Y160-Y163 HydrophobicContact CE2-CD1 4.31Å; Y160-Y163 WeakPolarHBondContact O-CB 3.35Å; Y160-Y163 PolarHBondContact O-N 2.87Å; I161-Y163 VanDerWaalsContact C-N 3.31Å; I161-Y163 PolarHBondContact O-N 3.45Å; Y163-S165 PolarHBondContact O-N 2.92Å; Y163-S166 CarbonylContact O-C 3.6Å; Y163-S166 PolarHBondContact O-N 3.43Å; Y163-F167 HydrophobicContact CD1-CB 4.46Å; Y163-F167 HydrophobicContact CD2-CB 4.22Å; Y163-F167 HydrophobicContact CE1-CB 4.04Å; Y163-F167 HydrophobicContact CE2-CB 3.8Å; Y163-F167 WeakPolarHBondContact O-CB 3.35Å; Y163-F167 PolarHBondContact O-N 3.21Å; Y163-Y185 WeakPolarHBondContact CE2-OH 3.49Å; Y163-Y185 PolarHBondContact OH-OH 3.46Å
164	L	90.3	Very high	82.8	Confident	7 Å²	7	58.9 Å²	58.9	4%	0.037	32%	0.318	C	S	.	.	H	α-helix	trans	-60.2	-29.3	177.1	-68.1	178.7	0	0	0	113.5	L142 Y160 I161 F167 T341 V345	L142-L164 HydrophobicContact CB-CD2 4.08Å; L142-L164 HydrophobicContact CD1-CD2 3.68Å; L142-L164 HydrophobicContact CG-CD2 4.42Å; Y160-L164 HydrophobicContact CD1-CD1 4.13Å; Y160-L164 HydrophobicContact CE1-CD1 3.74Å; Y160-L164 HydrophobicContact CE1-CG 4.27Å; Y160-L164 HydrophobicContact CE2-CD2 4.3Å; Y160-L164 HydrophobicContact CE2-CG 4.4Å; Y160-L164 WeakPolarHBondContact O-CG 3.45Å; Y160-L164 PolarHBondContact O-N 3.15Å; I161-L164 PolarHBondContact O-N 2.84Å; L164-F167 VanDerWaalsContact O-CD1 3.27Å; L164-F167 WeakPolarHBondContact O-CD1 3.41Å; L164-F167 WeakPolarHBondContact O-CE1 3.48Å; L164-T341 HydrophobicContact CD1-CG2 4.29Å; L164-V345 HydrophobicContact CD1-CB 4.1Å; L164-V345 HydrophobicContact CD1-CG1 4.26Å; L164-V345 HydrophobicContact CD1-CG2 3.79Å
165	S	87.4	Confident	82.9	Confident	58 Å²	58	61.2 Å²	61.2	41%	0.406	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79	-14.2	175.6	-42.5	0	0	0	0	114.5	I161 S162 Y163 Q169 H342	I161-S165 PolarHBondContact O-N 3.23Å; I161-S165 PolarHBondContact O-OG 3.46Å; I161-S165 VanDerWaalsContact O-OG 3.12Å; S162-S165 PolarHBondContact O-N 2.86Å; Y163-S165 PolarHBondContact O-N 2.92Å; S165-Q169 PolarHBondContact O-NE2 2.89Å; S165-H342 PolarHBondContact OG-NE2 2.94Å; S165-H342 VanDerWaalsContact OG-NE2 3.11Å
166	S	86.3	Confident	82.8	Confident	36 Å²	36	66.9 Å²	66.9	25%	0.252	34%	0.342	S	S	.	.	T	Hydrogen-bonded Turn	trans	-133.6	-5	-168.5	60.9	0	0	0	0	115.3	S162 Y163 D168 Q169	S162-S166 PolarHBondContact O-N 3.03Å; S162-S166 PolarHBondContact O-OG 2.89Å; Y163-S166 CarbonylContact O-C 3.6Å; Y163-S166 PolarHBondContact O-N 3.43Å; S166-D168 PolarHBondContact O-N 3.38Å; S166-D168 VanDerWaalsContact O-N 3.14Å; S166-Q169 WeakPolarHBondContact O-CB 3.28Å; S166-Q169 PolarHBondContact O-N 2.85Å
167	F	87	Confident	82.9	Confident	7 Å²	7	66.4 Å²	66.4	3%	0.031	34%	0.335	C	S	.	.	T	Hydrogen-bonded Turn	trans	-63.3	-22.2	-178.1	79.4	-83.9	0	0	0	113	L142 Y163 L164 L170 L189 V331 R338	L142-F167 HydrophobicContact CD1-CD1 4.39Å; L142-F167 HydrophobicContact CD1-CD2 4.47Å; L142-F167 HydrophobicContact CD1-CE1 4Å; L142-F167 HydrophobicContact CD1-CE2 4.09Å; L142-F167 HydrophobicContact CD1-CZ 3.83Å; Y163-F167 HydrophobicContact CD1-CB 4.46Å; Y163-F167 HydrophobicContact CD2-CB 4.22Å; Y163-F167 HydrophobicContact CE1-CB 4.04Å; Y163-F167 HydrophobicContact CE2-CB 3.8Å; Y163-F167 WeakPolarHBondContact O-CB 3.35Å; Y163-F167 PolarHBondContact O-N 3.21Å; L164-F167 VanDerWaalsContact O-CD1 3.27Å; L164-F167 WeakPolarHBondContact O-CD1 3.41Å; L164-F167 WeakPolarHBondContact O-CE1 3.48Å; F167-L170 VanDerWaalsContact O-CD2 3.29Å; F167-L170 WeakPolarHBondContact O-CD2 3.31Å; F167-L189 HydrophobicContact CD2-CD1 4.44Å; F167-L189 HydrophobicContact CD2-CD2 4.25Å; F167-V331 HydrophobicContact CE2-CG2 3.65Å; F167-V331 HydrophobicContact CZ-CG1 4.38Å; F167-V331 HydrophobicContact CZ-CG2 4.13Å; F167-R338 HydrophobicContact CE1-CG 3.88Å; F167-R338 HydrophobicContact CZ-CG 4.05Å
168	D	82.4	Confident	83	Confident	31 Å²	31	57.5 Å²	57.5	17%	0.166	30%	0.296	C	S	.	.	T	Hydrogen-bonded Turn	trans	-90	-8.2	175.3	70.3	-39.5	0	0	0	113.1	S166 L170 Y328 V331 R338	S166-D168 PolarHBondContact O-N 3.38Å; S166-D168 VanDerWaalsContact O-N 3.14Å; D168-L170 PolarHBondContact O-N 2.73Å; D168-L170 VanDerWaalsContact O-N 3.08Å; D168-Y328 WeakPolarHBondContact O-CD1 3.46Å; D168-Y328 WeakPolarHBondContact O-CE1 3.4Å; D168-V331 HydrophobicContact CB-CB 4.45Å; D168-V331 HydrophobicContact CB-CG1 3.74Å; D168-V331 HydrophobicContact CB-CG2 4.44Å; D168-R338 IonicContact OD2-CZ 2.64Å; D168-R338 IonicContact OD2-NH1 3.96Å; D168-R338 PolarHBondContact OD2-NH1 3.3Å
169	Q	83.9	Confident	83	Confident	79 Å²	79	57.9 Å²	57.9	37%	0.369	30%	0.298	S	S	.	.			trans	-87.3	49	178.6	-60.7	175.9	-4.4	0	0	111.4	S165 S166 F171 D172	S165-Q169 PolarHBondContact O-NE2 2.89Å; S166-Q169 WeakPolarHBondContact O-CB 3.28Å; S166-Q169 PolarHBondContact O-N 2.85Å; Q169-F171 HydrophobicContact CB-CE1 4.28Å; Q169-F171 HydrophobicContact CB-CE2 4.35Å; Q169-F171 HydrophobicContact CB-CZ 3.95Å; Q169-F171 HydrophobicContact CG-CE1 4.45Å; Q169-F171 HydrophobicContact CG-CZ 3.99Å; Q169-F171 PolarHBondContact O-N 2.96Å; Q169-D172 PolarHBondContact O-N 3.32Å; Q169-D172 VanDerWaalsContact O-N 3.15Å
170	L	81.8	Confident	82.9	Confident	6 Å²	6	54.7 Å²	54.7	3%	0.031	30%	0.296	C	S	.	.	G	3₁₀ helix	trans	-64.4	-14.3	-175.5	-53.1	171.1	0	0	0	113.2	F167 D168 D172 V173 Y182 L186 E324 V327 Y328	F167-L170 VanDerWaalsContact O-CD2 3.29Å; F167-L170 WeakPolarHBondContact O-CD2 3.31Å; D168-L170 PolarHBondContact O-N 2.73Å; D168-L170 VanDerWaalsContact O-N 3.08Å; L170-D172 VanDerWaalsContact C-N 3.33Å; L170-V173 PolarHBondContact O-N 2.89Å; L170-Y182 WeakPolarHBondContact CD2-OH 3.21Å; L170-L186 HydrophobicContact CD1-CD2 4.31Å; L170-E324 HydrophobicContact CB-CG 4.31Å; L170-E324 HydrophobicContact CD1-CB 4.18Å; L170-E324 HydrophobicContact CD1-CG 4Å; L170-V327 HydrophobicContact CD1-CB 3.91Å; L170-V327 HydrophobicContact CD1-CG1 3.8Å; L170-V327 HydrophobicContact CD1-CG2 4.48Å; L170-Y328 HydrophobicContact CB-CE1 3.81Å; L170-Y328 WeakPolarHBondContact CB-OH 3.39Å; L170-Y328 HydrophobicContact CD1-CE1 4.09Å; L170-Y328 HydrophobicContact CG-CE1 4.06Å
171	F	79.1	Confident	82.8	Confident	92 Å²	92	57.3 Å²	57.3	40%	0.404	31%	0.31	S	S	.	.	G	3₁₀ helix	trans	-74.6	-22.1	178.9	50.6	-100.3	0	0	0	112.9	Q169 V173 P227 Y328	Q169-F171 HydrophobicContact CB-CE1 4.28Å; Q169-F171 HydrophobicContact CB-CE2 4.35Å; Q169-F171 HydrophobicContact CB-CZ 3.95Å; Q169-F171 HydrophobicContact CG-CE1 4.45Å; Q169-F171 HydrophobicContact CG-CZ 3.99Å; Q169-F171 PolarHBondContact O-N 2.96Å; F171-V173 VanDerWaalsContact C-N 3.32Å; F171-P227 HydrophobicContact CB-CB 3.9Å; F171-Y328 HydrophobicContact CD1-CE1 4.29Å; F171-Y328 PolarHBondContact N-OH 3.44Å
172	D	77.7	Confident	82.7	Confident	112 Å²	112	55.3 Å²	55.3	60%	0.599	30%	0.299	S	S	*	.	G	3₁₀ helix	trans	-82	-13.6	177.1	-70.1	-28.8	0	0	0	112.5	Q169 L170 S174	Q169-D172 PolarHBondContact O-N 3.32Å; Q169-D172 VanDerWaalsContact O-N 3.15Å; L170-D172 VanDerWaalsContact C-N 3.33Å; D172-S174 PolarHBondContact O-N 3.43Å
173	V	77.8	Confident	82.8	Confident	34 Å²	34	55.1 Å²	55.1	21%	0.206	29%	0.292	C	S	.	.	S	Bend	trans	-72.1	114.7	177	-176.5	0	0	0	0	109.8	L170 F171 R177 K178 Y182	L170-V173 PolarHBondContact O-N 2.89Å; F171-V173 VanDerWaalsContact C-N 3.32Å; V173-R177 HydrophobicContact CG1-CB 3.93Å; V173-K178 HydrophobicContact CG1-CG 4.22Å; V173-K178 VanDerWaalsContact O-CE 3.23Å; V173-K178 WeakPolarHBondContact O-CE 3.37Å; V173-Y182 HydrophobicContact CG1-CE2 4.09Å; V173-Y182 HydrophobicContact CG2-CE2 4.39Å
174	S	71.9	Confident	82.8	Confident	57 Å²	57	61.9 Å²	61.9	40%	0.399	32%	0.321	S	S	.	.			trans	-54.2	140.9	176.8	174.2	0	0	0	0	112.4	D172 D176 R177 K178	D172-S174 PolarHBondContact O-N 3.43Å; S174-D176 PolarHBondContact O-N 2.88Å; S174-D176 VanDerWaalsContact O-N 3.08Å; S174-D176 PolarHBondContact OG-N 3.41Å; S174-R177 WeakPolarHBondContact O-CA 3.33Å; S174-R177 WeakPolarHBondContact O-CB 3.41Å; S174-R177 PolarHBondContact O-N 3.36Å; S174-K178 PolarHBondContact O-N 3.35Å
175	K	72.5	Confident	82.9	Confident	97 Å²	97	61.8 Å²	61.8	42%	0.422	32%	0.32	S	S	.	.	G	3₁₀ helix	trans	-51.9	-32	176.5	-171.8	178.8	177.5	-178.7	0	113	R177 K178 W229 E232	K175-R177 VanDerWaalsContact C-N 3.26Å; K175-R177 PolarHBondContact O-N 3.41Å; K175-K178 PolarHBondContact O-N 2.75Å; K175-W229 HydrophobicContact CG-CZ3 4.25Å; K175-E232 IonicContact NZ-OE1 2.72Å; K175-E232 PolarHBondContact NZ-OE1 3.32Å; K175-E232 VanDerWaalsContact NZ-OE1 3.1Å
176	D	69.9	Low	83.2	Confident	148 Å²	148	59 Å²	59	79%	0.791	30%	0.301	S	S	*	.	G	3₁₀ helix	trans	-69.6	-23.7	178.4	-61.5	-44.8	0	0	0	113.1	S174	S174-D176 PolarHBondContact O-N 2.88Å; S174-D176 VanDerWaalsContact O-N 3.08Å; S174-D176 PolarHBondContact OG-N 3.41Å
177	R	76.7	Confident	83.6	Confident	109 Å²	109	61 Å²	61	41%	0.411	31%	0.307	S	S	.	.	G	3₁₀ helix	trans	-87.2	-15.7	176.7	-62.3	-175.9	-179.4	179	-1.5	112.6	G154 V173 S174 K175 N179 Y182	G154-R177 PolarHBondContact O-NE 3.28Å; G154-R177 PolarHBondContact O-NH1 3.33Å; V173-R177 HydrophobicContact CG1-CB 3.93Å; S174-R177 WeakPolarHBondContact O-CA 3.33Å; S174-R177 WeakPolarHBondContact O-CB 3.41Å; S174-R177 PolarHBondContact O-N 3.36Å; K175-R177 VanDerWaalsContact C-N 3.26Å; K175-R177 PolarHBondContact O-N 3.41Å; R177-N179 PolarHBondContact O-N 3.22Å; R177-Y182 WeakPolarHBondContact O-CB 3.31Å
178	K	83.4	Confident	84	Confident	8 Å²	8	62.1 Å²	62.1	4%	0.035	31%	0.312	C	S	.	.			trans	-76.9	59.3	177.7	-57.9	-168.3	177.9	-168.3	0	112.1	V173 S174 K175 Y182 W229 E324	V173-K178 HydrophobicContact CG1-CG 4.22Å; V173-K178 VanDerWaalsContact O-CE 3.23Å; V173-K178 WeakPolarHBondContact O-CE 3.37Å; S174-K178 PolarHBondContact O-N 3.35Å; K175-K178 PolarHBondContact O-N 2.75Å; K178-Y182 HydrophobicContact CB-CD1 3.92Å; K178-Y182 HydrophobicContact CB-CE1 4.19Å; K178-Y182 HydrophobicContact CD-CE1 4.14Å; K178-Y182 HydrophobicContact CG-CD1 3.94Å; K178-Y182 HydrophobicContact CG-CE1 3.73Å; K178-W229 HydrophobicContact CD-CH2 3.97Å; K178-W229 HydrophobicContact CD-CZ2 3.43Å; K178-W229 VanDerWaalsContact CD-CZ2 3.43Å; K178-E324 VanDerWaalsContact CD-OE1 3.27Å; K178-E324 WeakPolarHBondContact CD-OE1 3.27Å; K178-E324 WeakPolarHBondContact CE-OE1 3.33Å; K178-E324 IonicContact NZ-OE1 3.75Å; K178-E324 PolarHBondContact NZ-OE1 3.13Å; K178-E324 IonicContact NZ-OE2 2.96Å; K178-E324 PolarHBondContact NZ-OE2 3.2Å
179	N	84.6	Confident	84.6	Confident	53 Å²	53	60.7 Å²	60.7	28%	0.283	30%	0.304	S	S	.	.	S	Bend	trans	-89	-174.3	-179	68.2	30.3	0	0	0	111.7	R177 E181 Y182 K183	R177-N179 PolarHBondContact O-N 3.22Å; N179-E181 VanDerWaalsContact C-N 3.29Å; N179-E181 PolarHBondContact O-N 3.42Å; N179-E181 WeakPolarHBondContact OD1-CA 3.33Å; N179-E181 WeakPolarHBondContact OD1-CB 3.46Å; N179-E181 PolarHBondContact OD1-N 3.42Å; N179-Y182 PolarHBondContact O-N 2.97Å; N179-Y182 PolarHBondContact OD1-N 3.44Å; N179-K183 PolarHBondContact O-N 3.45Å
180	A	87.2	Confident	85.1	Confident	74 Å²	74	57.5 Å²	57.5	61%	0.612	29%	0.29	S	S	*	.	H	α-helix	trans	-65.7	-28	-179.9	0	0	0	0	0	113.9	K184	A180-K184 WeakPolarHBondContact O-CG 3.28Å; A180-K184 PolarHBondContact O-N 2.85Å
181	E	87.8	Confident	85.8	Confident	97 Å²	97	63.4 Å²	63.4	45%	0.453	32%	0.318	S	S	.	.	H	α-helix	trans	-72.8	-40.1	175.7	-61.2	173.7	176	0	0	110.6	L152 N179 K184 Y185	L152-E181 HydrophobicContact CD2-CB 3.84Å; N179-E181 VanDerWaalsContact C-N 3.29Å; N179-E181 PolarHBondContact O-N 3.42Å; N179-E181 WeakPolarHBondContact OD1-CA 3.33Å; N179-E181 WeakPolarHBondContact OD1-CB 3.46Å; N179-E181 PolarHBondContact OD1-N 3.42Å; E181-K184 PolarHBondContact O-N 2.94Å; E181-Y185 PolarHBondContact O-N 3.49Å
182	Y	89	Confident	86.6	Confident	5 Å²	5	60.8 Å²	60.8	2%	0.02	31%	0.305	C	S	.	.	H	α-helix	trans	-61	-43.5	172.9	179.8	-104.8	0	0	0	111.7	L152 L170 V173 R177 K178 N179 K184 Y185 L186 V320 E324	L152-Y182 HydrophobicContact CD1-CD2 4.13Å; L170-Y182 WeakPolarHBondContact CD2-OH 3.21Å; V173-Y182 HydrophobicContact CG1-CE2 4.09Å; V173-Y182 HydrophobicContact CG2-CE2 4.39Å; R177-Y182 WeakPolarHBondContact O-CB 3.31Å; K178-Y182 HydrophobicContact CB-CD1 3.92Å; K178-Y182 HydrophobicContact CB-CE1 4.19Å; K178-Y182 HydrophobicContact CD-CE1 4.14Å; K178-Y182 HydrophobicContact CG-CD1 3.94Å; K178-Y182 HydrophobicContact CG-CE1 3.73Å; N179-Y182 PolarHBondContact O-N 2.97Å; N179-Y182 PolarHBondContact OD1-N 3.44Å; Y182-K184 VanDerWaalsContact C-N 3.32Å; Y182-K184 PolarHBondContact O-N 3.35Å; Y182-Y185 HydrophobicContact CD2-CD1 4.29Å; Y182-Y185 HydrophobicContact CE2-CD1 4.37Å; Y182-Y185 WeakPolarHBondContact O-CB 3.16Å; Y182-Y185 PolarHBondContact O-N 3.47Å; Y182-L186 HydrophobicContact CD1-CD1 3.76Å; Y182-L186 HydrophobicContact CD2-CD1 4.47Å; Y182-L186 HydrophobicContact CE1-CD1 3.11Å; Y182-L186 HydrophobicContact CE2-CD1 3.91Å; Y182-L186 HydrophobicContact CG-CD1 4.41Å; Y182-L186 PolarHBondContact O-N 3.03Å; Y182-L186 WeakPolarHBondContact OH-CD1 2.99Å; Y182-V320 HydrophobicContact CD1-CG1 4.36Å; Y182-V320 HydrophobicContact CE1-CG1 4.27Å; Y182-E324 WeakPolarHBondContact CE1-OE1 3.35Å
183	K	90.4	Very high	87.5	Confident	46 Å²	46	55.5 Å²	55.5	20%	0.2	28%	0.277	C	S	.	.	H	α-helix	trans	-55.9	-46.6	174.4	-172.8	-178.9	-177.8	-166.7	0	111.5	N179 Y185 L186 E187 E319 V320 L323	N179-K183 PolarHBondContact O-N 3.45Å; K183-Y185 PolarHBondContact O-N 3.47Å; K183-L186 WeakPolarHBondContact O-CB 3.42Å; K183-L186 PolarHBondContact O-N 3.35Å; K183-E187 WeakPolarHBondContact CE-OE1 3.46Å; K183-E187 HydrophobicContact CG-CG 4.49Å; K183-E187 IonicContact NZ-OE1 3.32Å; K183-E187 WeakPolarHBondContact O-CG 3.46Å; K183-E187 PolarHBondContact O-N 3.13Å; K183-E319 IonicContact NZ-OE2 3.72Å; K183-E319 PolarHBondContact NZ-OE2 2.82Å; K183-V320 HydrophobicContact CB-CG2 4.2Å; K183-V320 HydrophobicContact CD-CG2 4.04Å; K183-V320 HydrophobicContact CG-CG2 4.03Å; K183-L323 HydrophobicContact CG-CD1 3.95Å
184	K	92.2	Very high	88.3	Confident	144 Å²	144	56.1 Å²	56.1	63%	0.626	28%	0.277	S	S	*	.	H	α-helix	trans	-63.7	-38.5	177.9	-71.4	175.8	179.7	-175.8	0	113.3	A180 E181 Y182 L186 M188	A180-K184 WeakPolarHBondContact O-CG 3.28Å; A180-K184 PolarHBondContact O-N 2.85Å; E181-K184 PolarHBondContact O-N 2.94Å; Y182-K184 VanDerWaalsContact C-N 3.32Å; Y182-K184 PolarHBondContact O-N 3.35Å; K184-L186 VanDerWaalsContact C-N 3.33Å; K184-M188 PolarHBondContact O-N 3.34Å; K184-M188 VanDerWaalsContact O-N 3.11Å
185	Y	92.4	Very high	89.5	Confident	4 Å²	4	56.8 Å²	56.8	2%	0.016	28%	0.277	C	S	.	.	H	α-helix	trans	-61.6	-44.9	173	158.5	-95.2	0	0	0	110.7	C145 K148 F149 L152 Y163 E181 Y182 K183 M188 L189	C145-Y185 HydrophobicContact CB-CE2 4.5Å; C145-Y185 WeakPolarHBondContact O-CE2 3.22Å; K148-Y185 HydrophobicContact CB-CD2 4.33Å; F149-Y185 HydrophobicContact CB-CD2 4.26Å; F149-Y185 HydrophobicContact CB-CE2 3.76Å; F149-Y185 HydrophobicContact CD2-CE1 4.19Å; F149-Y185 HydrophobicContact CD2-CE2 4.23Å; F149-Y185 AromaticContact CD2-CZ 3.89Å; F149-Y185 HydrophobicContact CG-CE2 4.49Å; L152-Y185 HydrophobicContact CD1-CD1 4.17Å; L152-Y185 HydrophobicContact CD1-CG 4.04Å; Y163-Y185 WeakPolarHBondContact CE2-OH 3.49Å; Y163-Y185 PolarHBondContact OH-OH 3.46Å; E181-Y185 PolarHBondContact O-N 3.49Å; Y182-Y185 HydrophobicContact CD2-CD1 4.29Å; Y182-Y185 HydrophobicContact CE2-CD1 4.37Å; Y182-Y185 WeakPolarHBondContact O-CB 3.16Å; Y182-Y185 PolarHBondContact O-N 3.47Å; K183-Y185 PolarHBondContact O-N 3.47Å; Y185-M188 HydrophobicContact CD2-CE 4.26Å; Y185-M188 PolarHBondContact O-N 3.13Å; Y185-L189 HydrophobicContact CE1-CD2 4.3Å; Y185-L189 WeakPolarHBondContact O-CB 3.35Å; Y185-L189 PolarHBondContact O-N 3.15Å
186	L	93	Very high	90.6	Very high	0 Å²	0	52.2 Å²	52.2	0%	0	26%	0.257	C	S	.	.	H	α-helix	trans	-64.2	-42.7	178.6	-121	128.6	0	0	0	112.6	L170 Y182 K183 K184 M188 L189 L190 L323 E324 V327	L170-L186 HydrophobicContact CD1-CD2 4.31Å; Y182-L186 HydrophobicContact CD1-CD1 3.76Å; Y182-L186 HydrophobicContact CD2-CD1 4.47Å; Y182-L186 HydrophobicContact CE1-CD1 3.11Å; Y182-L186 HydrophobicContact CE2-CD1 3.91Å; Y182-L186 HydrophobicContact CG-CD1 4.41Å; Y182-L186 PolarHBondContact O-N 3.03Å; Y182-L186 WeakPolarHBondContact OH-CD1 2.99Å; K183-L186 WeakPolarHBondContact O-CB 3.42Å; K183-L186 PolarHBondContact O-N 3.35Å; K184-L186 VanDerWaalsContact C-N 3.33Å; L186-M188 VanDerWaalsContact C-N 3.34Å; L186-L189 PolarHBondContact O-N 3.45Å; L186-L190 WeakPolarHBondContact O-CB 3.31Å; L186-L190 PolarHBondContact O-N 3.28Å; L186-L323 HydrophobicContact CD2-CB 3.63Å; L186-E324 HydrophobicContact CD1-CG 3.95Å; L186-E324 HydrophobicContact CD2-CB 4.43Å; L186-E324 HydrophobicContact CD2-CG 3.84Å; L186-V327 HydrophobicContact CD2-CG2 3.76Å
187	E	94.9	Very high	91.9	Very high	78 Å²	78	45.2 Å²	45.2	36%	0.364	22%	0.219	S	C	.	.	H	α-helix	trans	-58.2	-46.9	174.9	-74.3	168.6	168.7	0	0	110.8	K183 L190 E191 L323	K183-E187 WeakPolarHBondContact CE-OE1 3.46Å; K183-E187 HydrophobicContact CG-CG 4.49Å; K183-E187 IonicContact NZ-OE1 3.32Å; K183-E187 WeakPolarHBondContact O-CG 3.46Å; K183-E187 PolarHBondContact O-N 3.13Å; E187-L190 PolarHBondContact O-N 2.96Å; E187-E191 VanDerWaalsContact O-CB 3.29Å; E187-E191 WeakPolarHBondContact O-CB 3.37Å; E187-E191 PolarHBondContact O-N 3.45Å; E187-L323 HydrophobicContact CG-CD1 3.79Å; E187-L323 HydrophobicContact CG-CD2 4.45Å
188	M	95.4	Very high	92.7	Very high	31 Å²	31	43.7 Å²	43.7	15%	0.153	22%	0.217	C	C	.	.	H	α-helix	trans	-65.5	-44.9	177.1	178.2	-163.3	63.9	0	0	112.7	C145 K148 K184 Y185 L186 L190 E191 Y192	C145-M188 HydrophobicContact CB-CE 4.12Å; K148-M188 HydrophobicContact CB-CE 3.93Å; K148-M188 HydrophobicContact CD-CE 3.61Å; K148-M188 HydrophobicContact CD-SD 3.37Å; K148-M188 WeakPolarHBondContact CD-SD 3.38Å; K148-M188 WeakPolarHBondContact CE-SD 3.48Å; K148-M188 HydrophobicContact CG-CE 3.94Å; K148-M188 HydrophobicContact CG-SD 4.15Å; K148-M188 PolarHBondContact NZ-SD 3.3Å; K184-M188 PolarHBondContact O-N 3.34Å; K184-M188 VanDerWaalsContact O-N 3.11Å; Y185-M188 HydrophobicContact CD2-CE 4.26Å; Y185-M188 PolarHBondContact O-N 3.13Å; L186-M188 VanDerWaalsContact C-N 3.34Å; M188-L190 VanDerWaalsContact C-N 3.28Å; M188-L190 PolarHBondContact O-N 3.49Å; M188-E191 PolarHBondContact O-N 3.36Å; M188-Y192 PolarHBondContact O-N 3.47Å
189	L	95	Very high	93.3	Very high	0 Å²	0	45 Å²	45	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-60.2	-44	178.4	173.6	63.6	0	0	0	110.4	L142 C145 F167 Y185 L186 Y192 L193 V327	L142-L189 HydrophobicContact CD2-CD1 4.07Å; C145-L189 HydrophobicContact CB-CD1 4.33Å; F167-L189 HydrophobicContact CD2-CD1 4.44Å; F167-L189 HydrophobicContact CD2-CD2 4.25Å; Y185-L189 HydrophobicContact CE1-CD2 4.3Å; Y185-L189 WeakPolarHBondContact O-CB 3.35Å; Y185-L189 PolarHBondContact O-N 3.15Å; L186-L189 PolarHBondContact O-N 3.45Å; L189-Y192 PolarHBondContact O-N 3.39Å; L189-L193 HydrophobicContact CD1-CD1 4.03Å; L189-L193 HydrophobicContact CD1-CG 4.18Å; L189-L193 HydrophobicContact CG-CD1 3.97Å; L189-L193 HydrophobicContact CG-CG 4.48Å; L189-L193 WeakPolarHBondContact O-CB 3.43Å; L189-L193 VanDerWaalsContact O-CG 3.24Å; L189-L193 WeakPolarHBondContact O-CG 3.4Å; L189-L193 PolarHBondContact O-N 2.98Å; L189-V327 HydrophobicContact CD2-CG1 4.05Å
190	L	95.4	Very high	93.8	Very high	12 Å²	12	43 Å²	43	6%	0.063	21%	0.211	C	C	.	.	H	α-helix	trans	-66.5	-43.2	178.8	178.7	147.1	0	0	0	111.9	L186 E187 M188 Y192 L193 Q194 L323 Q326 V327	L186-L190 WeakPolarHBondContact O-CB 3.31Å; L186-L190 PolarHBondContact O-N 3.28Å; E187-L190 PolarHBondContact O-N 2.96Å; M188-L190 VanDerWaalsContact C-N 3.28Å; M188-L190 PolarHBondContact O-N 3.49Å; L190-Y192 VanDerWaalsContact C-N 3.32Å; L190-Y192 PolarHBondContact O-N 3.38Å; L190-L193 PolarHBondContact O-N 3.35Å; L190-Q194 HydrophobicContact CD2-CG 4.16Å; L190-Q194 VanDerWaalsContact CD2-OE1 3.27Å; L190-Q194 HydrophobicContact CG-CG 4.4Å; L190-Q194 VanDerWaalsContact O-CB 3.3Å; L190-Q194 WeakPolarHBondContact O-CB 3.44Å; L190-Q194 VanDerWaalsContact O-CG 3.27Å; L190-Q194 WeakPolarHBondContact O-CG 3.43Å; L190-Q194 PolarHBondContact O-N 2.93Å; L190-L323 HydrophobicContact CD1-CD2 3.97Å; L190-Q326 HydrophobicContact CD1-CB 3.33Å; L190-Q326 HydrophobicContact CD1-CG 4.22Å; L190-Q326 HydrophobicContact CG-CB 4.44Å; L190-V327 HydrophobicContact CB-CG2 3.95Å; L190-V327 HydrophobicContact CD1-CG2 4.13Å
191	E	96.2	Very high	94.2	Very high	131 Å²	131	43 Å²	43	61%	0.612	20%	0.198	S	C	*	.	H	α-helix	trans	-56.7	-47.6	174.9	-178.4	175.9	-161.8	0	0	110.7	E187 M188 Q194 D195	E187-E191 VanDerWaalsContact O-CB 3.29Å; E187-E191 WeakPolarHBondContact O-CB 3.37Å; E187-E191 PolarHBondContact O-N 3.45Å; M188-E191 PolarHBondContact O-N 3.36Å; E191-Q194 PolarHBondContact O-N 3.12Å; E191-D195 VanDerWaalsContact O-CB 3.24Å; E191-D195 WeakPolarHBondContact O-CB 3.35Å; E191-D195 PolarHBondContact O-N 3.47Å
192	Y	96.3	Very high	94.5	Very high	37 Å²	37	38.5 Å²	38.5	15%	0.145	18%	0.176	C	C	.	.	H	α-helix	trans	-59.9	-49.7	174.8	174.5	-100.1	0	0	0	112.4	E134 L140 D141 L142 M188 L189 L190 Q194 D195 Y196	E134-Y192 VanDerWaalsContact OE1-CE2 3.24Å; E134-Y192 WeakPolarHBondContact OE1-CE2 3.32Å; E134-Y192 PolarHBondContact OE1-OH 2.6Å; L140-Y192 HydrophobicContact CD2-CE1 4.02Å; D141-Y192 PolarHBondContact N-OH 2.93Å; L142-Y192 HydrophobicContact CD2-CD1 3.68Å; L142-Y192 HydrophobicContact CD2-CE1 3.52Å; L142-Y192 HydrophobicContact CG-CE1 4.48Å; M188-Y192 PolarHBondContact O-N 3.47Å; L189-Y192 PolarHBondContact O-N 3.39Å; L190-Y192 VanDerWaalsContact C-N 3.32Å; L190-Y192 PolarHBondContact O-N 3.38Å; Y192-Q194 VanDerWaalsContact C-N 3.32Å; Y192-Q194 PolarHBondContact O-N 2.91Å; Y192-D195 PolarHBondContact O-N 2.68Å; Y192-Y196 AromaticContact CZ-CD2 3.99Å; Y192-Y196 WeakPolarHBondContact O-CB 3.34Å; Y192-Y196 PolarHBondContact O-N 2.87Å; Y192-Y196 WeakPolarHBondContact OH-CD2 3.2Å
193	L	95.8	Very high	94.8	Very high	0 Å²	0	41.8 Å²	41.8	0%	0	19%	0.194	C	C	.	.	H	α-helix	trans	-64.9	-35.9	-178.5	-69.8	172.8	0	0	0	112.4	L140 L189 L190 T197 V327 V331 L334	L140-L193 HydrophobicContact CD2-CD2 4.34Å; L189-L193 HydrophobicContact CD1-CD1 4.03Å; L189-L193 HydrophobicContact CD1-CG 4.18Å; L189-L193 HydrophobicContact CG-CD1 3.97Å; L189-L193 HydrophobicContact CG-CG 4.48Å; L189-L193 WeakPolarHBondContact O-CB 3.43Å; L189-L193 VanDerWaalsContact O-CG 3.24Å; L189-L193 WeakPolarHBondContact O-CG 3.4Å; L189-L193 PolarHBondContact O-N 2.98Å; L190-L193 PolarHBondContact O-N 3.35Å; L193-T197 VanDerWaalsContact O-CB 3.29Å; L193-T197 WeakPolarHBondContact O-CB 3.35Å; L193-T197 PolarHBondContact O-N 3.33Å; L193-T197 PolarHBondContact O-OG1 3.32Å; L193-V327 HydrophobicContact CD1-CG1 4.05Å; L193-V331 HydrophobicContact CD1-CG2 3.82Å; L193-L334 HydrophobicContact CD2-CD1 3.85Å
194	Q	95.2	Very high	94.9	Very high	47 Å²	47	42.4 Å²	42.4	22%	0.22	20%	0.199	C	C	.	.	H	α-helix	trans	-64.2	-55.4	176.4	-81.5	-177.9	-21.7	0	0	111.3	L190 E191 Y192 T197 E198 Q206 Y330	L190-Q194 HydrophobicContact CD2-CG 4.16Å; L190-Q194 VanDerWaalsContact CD2-OE1 3.27Å; L190-Q194 HydrophobicContact CG-CG 4.4Å; L190-Q194 VanDerWaalsContact O-CB 3.3Å; L190-Q194 WeakPolarHBondContact O-CB 3.44Å; L190-Q194 VanDerWaalsContact O-CG 3.27Å; L190-Q194 WeakPolarHBondContact O-CG 3.43Å; L190-Q194 PolarHBondContact O-N 2.93Å; E191-Q194 PolarHBondContact O-N 3.12Å; Y192-Q194 VanDerWaalsContact C-N 3.32Å; Y192-Q194 PolarHBondContact O-N 2.91Å; Q194-T197 WeakPolarHBondContact O-CB 3.5Å; Q194-T197 PolarHBondContact O-N 3.29Å; Q194-T197 VanDerWaalsContact O-N 3.13Å; Q194-E198 PolarHBondContact O-N 3.08Å; Q194-Q206 PolarHBondContact O-NE2 2.79Å; Q194-Y330 HydrophobicContact CG-CD2 4.06Å; Q194-Y330 HydrophobicContact CG-CE1 3.98Å; Q194-Y330 HydrophobicContact CG-CE2 3.47Å; Q194-Y330 VanDerWaalsContact CG-CE2 3.47Å; Q194-Y330 VanDerWaalsContact CG-CZ 3.42Å; Q194-Y330 PolarHBondContact NE2-OH 2.99Å
195	D	96	Very high	94.9	Very high	72 Å²	72	39.9 Å²	39.9	39%	0.385	19%	0.192	S	C	.	.	H	α-helix	trans	-59.4	-47	179	174.6	44.1	0	0	0	111	E191 Y192 T197 E198 R199	E191-D195 VanDerWaalsContact O-CB 3.24Å; E191-D195 WeakPolarHBondContact O-CB 3.35Å; E191-D195 PolarHBondContact O-N 3.47Å; Y192-D195 PolarHBondContact O-N 2.68Å; D195-T197 VanDerWaalsContact C-N 3.32Å; D195-T197 PolarHBondContact O-N 2.99Å; D195-E198 WeakPolarHBondContact O-CB 3.48Å; D195-E198 PolarHBondContact O-N 3.29Å; D195-E198 VanDerWaalsContact O-N 3.13Å; D195-R199 WeakPolarHBondContact O-CG 3.3Å; D195-R199 PolarHBondContact O-N 2.89Å; D195-R199 IonicContact OD1-NH1 3.91Å; D195-R199 PolarHBondContact OD1-NH1 3.22Å; D195-R199 VanDerWaalsContact OD1-NH1 3.08Å; D195-R199 IonicContact OD2-CZ 2.79Å; D195-R199 IonicContact OD2-NH1 3.1Å; D195-R199 PolarHBondContact OD2-NH1 3.21Å; D195-R199 IonicContact OD2-NH2 3.86Å
196	Y	96.3	Very high	94.7	Very high	0 Å²	0	41 Å²	41	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.4	-44	173.4	-172.1	-87.4	0	0	0	112	F130 E134 G137 Y139 L140 Y192 E198 R199 V200 L334 Q337	F130-Y196 HydrophobicContact CD1-CE2 4.39Å; F130-Y196 HydrophobicContact CE1-CE2 4.19Å; E134-Y196 HydrophobicContact CB-CE2 4.15Å; E134-Y196 HydrophobicContact CG-CD2 4.42Å; E134-Y196 HydrophobicContact CG-CE2 3.93Å; E134-Y196 VanDerWaalsContact OE1-CD2 3.23Å; E134-Y196 WeakPolarHBondContact OE1-CD2 3.11Å; G137-Y196 WeakPolarHBondContact CA-OH 3.5Å; G137-Y196 PolarHBondContact O-OH 3.41Å; Y139-Y196 WeakPolarHBondContact O-CE2 3.07Å; Y139-Y196 PolarHBondContact O-OH 2.65Å; L140-Y196 HydrophobicContact CD2-CD1 3.51Å; L140-Y196 HydrophobicContact CD2-CD2 4.1Å; L140-Y196 HydrophobicContact CD2-CE1 3.49Å; L140-Y196 VanDerWaalsContact CD2-CE1 3.49Å; L140-Y196 HydrophobicContact CD2-CE2 4.07Å; L140-Y196 HydrophobicContact CD2-CG 3.82Å; L140-Y196 HydrophobicContact CG-CE1 4.28Å; Y192-Y196 AromaticContact CZ-CD2 3.99Å; Y192-Y196 WeakPolarHBondContact O-CB 3.34Å; Y192-Y196 PolarHBondContact O-N 2.87Å; Y192-Y196 WeakPolarHBondContact OH-CD2 3.2Å; Y196-E198 VanDerWaalsContact C-N 3.34Å; Y196-E198 PolarHBondContact O-N 2.96Å; Y196-R199 PolarHBondContact O-N 2.93Å; Y196-R199 VanDerWaalsContact O-N 3.15Å; Y196-V200 HydrophobicContact CD1-CG1 3.94Å; Y196-V200 HydrophobicContact CD1-CG2 3.94Å; Y196-V200 HydrophobicContact CE1-CB 4.26Å; Y196-V200 HydrophobicContact CE1-CG1 3.38Å; Y196-V200 HydrophobicContact CE1-CG2 3.84Å; Y196-V200 HydrophobicContact CE2-CG1 4.3Å; Y196-V200 WeakPolarHBondContact O-CG2 3.44Å; Y196-V200 PolarHBondContact O-N 3.2Å; Y196-L334 HydrophobicContact CD1-CD1 3.95Å; Y196-L334 HydrophobicContact CD1-CD2 3.85Å; Y196-L334 HydrophobicContact CE1-CD2 3.96Å; Y196-Q337 HydrophobicContact CE1-CG 4.22Å
197	T	95.8	Very high	94.7	Very high	1 Å²	1	47.4 Å²	47.4	1%	0.006	23%	0.232	C	C	.	.	H	α-helix	trans	-62.8	-38.8	177.4	-58.5	0	0	0	0	111.9	L193 Q194 D195 R199 K201 L204 Y330 I333 L334	L193-T197 VanDerWaalsContact O-CB 3.29Å; L193-T197 WeakPolarHBondContact O-CB 3.35Å; L193-T197 PolarHBondContact O-N 3.33Å; L193-T197 PolarHBondContact O-OG1 3.32Å; Q194-T197 WeakPolarHBondContact O-CB 3.5Å; Q194-T197 PolarHBondContact O-N 3.29Å; Q194-T197 VanDerWaalsContact O-N 3.13Å; D195-T197 VanDerWaalsContact C-N 3.32Å; D195-T197 PolarHBondContact O-N 2.99Å; T197-R199 VanDerWaalsContact C-N 3.29Å; T197-R199 PolarHBondContact O-N 3.28Å; T197-K201 CarbonylContact O-C 3.39Å; T197-K201 WeakPolarHBondContact O-CA 3.45Å; T197-K201 PolarHBondContact O-N 3.26Å; T197-L204 HydrophobicContact CG2-CD2 3.97Å; T197-Y330 HydrophobicContact CG2-CD1 4.28Å; T197-Y330 HydrophobicContact CG2-CE1 4.42Å; T197-I333 HydrophobicContact CG2-CG2 4.21Å; T197-L334 WeakPolarHBondContact OG1-CD1 3.46Å
198	E	95.1	Very high	94.6	Very high	77 Å²	77	47.5 Å²	47.5	36%	0.36	24%	0.235	S	C	.	.	H	α-helix	trans	-61	-40.3	173.3	-66	-167.2	157.4	0	0	111.8	Q194 D195 Y196 P202 Q206	Q194-E198 PolarHBondContact O-N 3.08Å; D195-E198 WeakPolarHBondContact O-CB 3.48Å; D195-E198 PolarHBondContact O-N 3.29Å; D195-E198 VanDerWaalsContact O-N 3.13Å; Y196-E198 VanDerWaalsContact C-N 3.34Å; Y196-E198 PolarHBondContact O-N 2.96Å; E198-P202 VanDerWaalsContact O-CA 3.3Å; E198-P202 WeakPolarHBondContact O-CA 3.43Å; E198-Q206 VanDerWaalsContact CG-CD 3.43Å; E198-Q206 HydrophobicContact CG-CG 3.96Å; E198-Q206 WeakPolarHBondContact OE1-CG 3.25Å; E198-Q206 PolarHBondContact OE1-OE1 2.78Å
199	R	95.3	Very high	94.5	Very high	37 Å²	37	47 Å²	47	14%	0.14	23%	0.233	C	C	.	.	H	α-helix	trans	-69.5	-45	178.6	-65.8	-161.1	-72.3	-91.2	4.3	113	H41 V128 E129 F130 E134 D195 Y196 T197	H41-R199 PolarHBondContact NE2-O 3.21Å; V128-R199 HydrophobicContact CG2-CB 3.82Å; V128-R199 HydrophobicContact CG2-CG 3.53Å; E129-R199 WeakPolarHBondContact O-CD 3.36Å; E129-R199 PolarHBondContact O-NE 3.16Å; F130-R199 HydrophobicContact CE1-CB 3.64Å; F130-R199 HydrophobicContact CE2-CB 4.33Å; F130-R199 HydrophobicContact CZ-CB 3.51Å; E134-R199 IonicContact OE1-NH2 2.79Å; E134-R199 PolarHBondContact OE1-NH2 3.13Å; E134-R199 VanDerWaalsContact OE1-NH2 3.08Å; E134-R199 IonicContact OE2-NH2 2.73Å; E134-R199 PolarHBondContact OE2-NH2 2.78Å; D195-R199 WeakPolarHBondContact O-CG 3.3Å; D195-R199 PolarHBondContact O-N 2.89Å; D195-R199 IonicContact OD1-NH1 3.91Å; D195-R199 PolarHBondContact OD1-NH1 3.22Å; D195-R199 VanDerWaalsContact OD1-NH1 3.08Å; D195-R199 IonicContact OD2-CZ 2.79Å; D195-R199 IonicContact OD2-NH1 3.1Å; D195-R199 PolarHBondContact OD2-NH1 3.21Å; D195-R199 IonicContact OD2-NH2 3.86Å; Y196-R199 PolarHBondContact O-N 2.93Å; Y196-R199 VanDerWaalsContact O-N 3.15Å; T197-R199 VanDerWaalsContact C-N 3.29Å; T197-R199 PolarHBondContact O-N 3.28Å
200	V	95.4	Very high	94.4	Very high	10 Å²	10	51.8 Å²	51.8	6%	0.061	25%	0.252	C	S	.	.	H	α-helix	trans	-83.8	-26.7	-176.1	-62.1	0	0	0	0	114.1	F130 G137 Y196 P202 L334	F130-V200 HydrophobicContact CE1-CG1 3.69Å; F130-V200 HydrophobicContact CZ-CG1 3.77Å; G137-V200 VanDerWaalsContact CA-CG1 3.49Å; Y196-V200 HydrophobicContact CD1-CG1 3.94Å; Y196-V200 HydrophobicContact CD1-CG2 3.94Å; Y196-V200 HydrophobicContact CE1-CB 4.26Å; Y196-V200 HydrophobicContact CE1-CG1 3.38Å; Y196-V200 HydrophobicContact CE1-CG2 3.84Å; Y196-V200 HydrophobicContact CE2-CG1 4.3Å; Y196-V200 WeakPolarHBondContact O-CG2 3.44Å; Y196-V200 PolarHBondContact O-N 3.2Å; V200-P202 VanDerWaalsContact C-CD 3.5Å; V200-L334 HydrophobicContact CG2-CD2 3.72Å
201	K	94.7	Very high	94.3	Very high	75 Å²	75	53 Å²	53	33%	0.326	27%	0.268	S	S	.	.			trans	-133.1	62.8	-177.2	-68.3	178.6	-178.1	-179.3	0	110.3	T197 L203 L204 I333	T197-K201 CarbonylContact O-C 3.39Å; T197-K201 WeakPolarHBondContact O-CA 3.45Å; T197-K201 PolarHBondContact O-N 3.26Å; K201-L203 PolarHBondContact O-N 3.48Å; K201-L203 VanDerWaalsContact O-N 3.07Å; K201-L204 HydrophobicContact CB-CB 4.24Å; K201-L204 VanDerWaalsContact O-CB 3.3Å; K201-L204 WeakPolarHBondContact O-CB 3.49Å; K201-L204 PolarHBondContact O-N 3.1Å; K201-I333 HydrophobicContact CD-CG2 3.95Å; K201-I333 PolarHBondContact NZ-O 2.92Å
202	P	95	Very high	94.3	Very high	1 Å²	1	52.5 Å²	52.5	1%	0.006	26%	0.263	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.4	-18.3	-174.5	26.9	-36.7	0	0	0	114.1	D40 H41 R44 E198 V200 L204	D40-P202 HydrophobicContact CB-CG 3.66Å; H41-P202 HydrophobicContact CB-CG 4.49Å; R44-P202 HydrophobicContact CB-CB 4.25Å; R44-P202 WeakPolarHBondContact CD-O 3.48Å; R44-P202 PolarHBondContact NH1-O 3.43Å; E198-P202 VanDerWaalsContact O-CA 3.3Å; E198-P202 WeakPolarHBondContact O-CA 3.43Å; V200-P202 VanDerWaalsContact C-CD 3.5Å; P202-L204 VanDerWaalsContact C-N 3.33Å
203	L	94.4	Very high	94.1	Very high	74 Å²	74	51 Å²	51	39%	0.387	26%	0.257	S	S	.	.	T	Hydrogen-bonded Turn	trans	-84.6	-5	176.8	-60.6	179.6	0	0	0	113.8	D40 T43 R44 L47 K201	D40-L203 HydrophobicContact CB-CD1 4.02Å; D40-L203 HydrophobicContact CB-CG 4.09Å; D40-L203 WeakPolarHBondContact O-CD2 3.35Å; T43-L203 HydrophobicContact CG2-CD1 4.26Å; T43-L203 HydrophobicContact CG2-CD2 3.74Å; R44-L203 HydrophobicContact CB-CD2 4.2Å; L47-L203 HydrophobicContact CD1-CD2 4.11Å; K201-L203 PolarHBondContact O-N 3.48Å; K201-L203 VanDerWaalsContact O-N 3.07Å
204	L	94	Very high	94.1	Very high	60 Å²	60	53.5 Å²	53.5	31%	0.314	27%	0.271	S	S	.	.	S	Bend	trans	-79.3	122.8	173.9	-176	64.6	0	0	0	109.7	T197 K201 P202 Q206 L209 I333	T197-L204 HydrophobicContact CG2-CD2 3.97Å; K201-L204 HydrophobicContact CB-CB 4.24Å; K201-L204 VanDerWaalsContact O-CB 3.3Å; K201-L204 WeakPolarHBondContact O-CB 3.49Å; K201-L204 PolarHBondContact O-N 3.1Å; P202-L204 VanDerWaalsContact C-N 3.33Å; L204-Q206 PolarHBondContact O-N 2.94Å; L204-Q206 VanDerWaalsContact O-N 3.12Å; L204-L209 HydrophobicContact CD2-CD2 4.17Å; L204-I333 HydrophobicContact CD2-CD1 4.22Å; L204-I333 HydrophobicContact CD2-CG2 4.28Å
205	D	92.1	Very high	94	Very high	90 Å²	90	52.5 Å²	52.5	48%	0.481	27%	0.273	S	S	.	.			trans	-74.4	103.7	175.3	-173.2	-11.5	0	0	0	110.5	N207 D208 L209	D205-N207 VanDerWaalsContact C-N 3.26Å; D205-N207 PolarHBondContact O-N 3.48Å; D205-N207 WeakPolarHBondContact OD1-CB 3.35Å; D205-N207 PolarHBondContact OD1-N 3.18Å; D205-D208 HydrophobicContact CB-CB 4.04Å; D205-D208 PolarHBondContact O-N 3.05Å; D205-D208 PolarHBondContact OD1-N 3.31Å; D205-L209 WeakPolarHBondContact O-CB 3.26Å; D205-L209 PolarHBondContact O-N 2.99Å
206	Q	87.9	Confident	93.8	Very high	28 Å²	28	53.4 Å²	53.4	13%	0.131	28%	0.275	C	S	.	.	H	α-helix	trans	-59.5	-34.4	176.7	-70.3	-108.9	-13.3	0	0	112.7	Q194 E198 L204 L209 Y210 Y330	Q194-Q206 PolarHBondContact O-NE2 2.79Å; E198-Q206 VanDerWaalsContact CG-CD 3.43Å; E198-Q206 HydrophobicContact CG-CG 3.96Å; E198-Q206 WeakPolarHBondContact OE1-CG 3.25Å; E198-Q206 PolarHBondContact OE1-OE1 2.78Å; L204-Q206 PolarHBondContact O-N 2.94Å; L204-Q206 VanDerWaalsContact O-N 3.12Å; Q206-L209 PolarHBondContact O-N 3.1Å; Q206-Y210 WeakPolarHBondContact O-CB 3.44Å; Q206-Y210 PolarHBondContact O-N 2.63Å; Q206-Y330 PolarHBondContact OE1-OH 2.85Å
207	N	91.6	Very high	93.7	Very high	134 Å²	134	53.6 Å²	53.6	72%	0.717	28%	0.276	S	S	*	.	H	α-helix	trans	-72.4	-43.4	-178.1	-62.6	-58.7	0	0	0	111	D205 L209 Y210 G211	D205-N207 VanDerWaalsContact C-N 3.26Å; D205-N207 PolarHBondContact O-N 3.48Å; D205-N207 WeakPolarHBondContact OD1-CB 3.35Å; D205-N207 PolarHBondContact OD1-N 3.18Å; N207-L209 VanDerWaalsContact C-N 3.35Å; N207-Y210 PolarHBondContact O-N 2.94Å; N207-G211 PolarHBondContact O-N 3.3Å
208	D	93.2	Very high	93.6	Very high	81 Å²	81	57.5 Å²	57.5	43%	0.433	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-41.4	174.6	-173.9	37.9	0	0	0	110.8	D205 G211 K212	D205-D208 HydrophobicContact CB-CB 4.04Å; D205-D208 PolarHBondContact O-N 3.05Å; D205-D208 PolarHBondContact OD1-N 3.31Å; D208-G211 PolarHBondContact O-N 3.38Å; D208-K212 WeakPolarHBondContact O-CG 3.34Å; D208-K212 PolarHBondContact O-N 3.11Å; D208-K212 WeakPolarHBondContact OD1-CE 3.4Å; D208-K212 IonicContact OD1-NZ 3.14Å; D208-K212 WeakPolarHBondContact OD2-CE 3.5Å; D208-K212 IonicContact OD2-NZ 2.6Å; D208-K212 PolarHBondContact OD2-NZ 3.34Å
209	L	92.9	Very high	93.4	Very high	19 Å²	19	60.4 Å²	60.4	10%	0.099	31%	0.305	C	S	.	.	H	α-helix	trans	-59.3	-51.6	173.9	179.9	62.8	0	0	0	111.3	L204 D205 Q206 N207 G211 K212 I213 Y330 I333	L204-L209 HydrophobicContact CD2-CD2 4.17Å; D205-L209 WeakPolarHBondContact O-CB 3.26Å; D205-L209 PolarHBondContact O-N 2.99Å; Q206-L209 PolarHBondContact O-N 3.1Å; N207-L209 VanDerWaalsContact C-N 3.35Å; L209-G211 VanDerWaalsContact C-N 3.3Å; L209-G211 PolarHBondContact O-N 2.97Å; L209-K212 WeakPolarHBondContact O-CB 3.36Å; L209-K212 PolarHBondContact O-N 3.36Å; L209-K212 VanDerWaalsContact O-N 3.11Å; L209-I213 HydrophobicContact CD1-CD1 4.04Å; L209-I213 HydrophobicContact CD1-CG1 4.2Å; L209-I213 HydrophobicContact CD2-CD1 4.46Å; L209-I213 HydrophobicContact CG-CD1 3.83Å; L209-I213 HydrophobicContact CG-CG1 4.37Å; L209-I213 VanDerWaalsContact O-CG1 3.28Å; L209-I213 WeakPolarHBondContact O-CG1 3.47Å; L209-I213 PolarHBondContact O-N 3.44Å; L209-Y330 HydrophobicContact CD2-CD1 4.32Å; L209-Y330 HydrophobicContact CD2-CE1 3.67Å; L209-I333 HydrophobicContact CD1-CD1 3.9Å; L209-I333 HydrophobicContact CD2-CD1 3.53Å; L209-I333 HydrophobicContact CG-CD1 4.37Å
210	Y	93	Very high	93.1	Very high	101 Å²	101	62.1 Å²	62.1	40%	0.396	31%	0.314	S	S	.	.	H	α-helix	trans	-57.1	-43.8	177.9	-179	-89.7	0	0	0	112	Q206 N207 K212 I213 L214 F322	Q206-Y210 WeakPolarHBondContact O-CB 3.44Å; Q206-Y210 PolarHBondContact O-N 2.63Å; N207-Y210 PolarHBondContact O-N 2.94Å; Y210-K212 VanDerWaalsContact C-N 3.34Å; Y210-K212 PolarHBondContact O-N 3.45Å; Y210-I213 PolarHBondContact O-N 2.97Å; Y210-L214 HydrophobicContact CE1-CD2 4.3Å; Y210-L214 WeakPolarHBondContact O-CB 3.45Å; Y210-L214 PolarHBondContact O-N 2.87Å; Y210-F322 HydrophobicContact CD2-CZ 4.44Å; Y210-F322 AromaticContact CE2-CE1 3.82Å; Y210-F322 HydrophobicContact CE2-CE1 3.82Å; Y210-F322 AromaticContact CE2-CZ 3.63Å; Y210-F322 HydrophobicContact CE2-CZ 3.63Å; Y210-F322 AromaticContact CZ-CE1 3.89Å; Y210-F322 AromaticContact CZ-CZ 3.7Å; Y210-F322 WeakPolarHBondContact OH-CE1 3.46Å
211	G	94.7	Very high	92.8	Very high	39 Å²	39	64.9 Å²	64.9	40%	0.402	32%	0.323	S	S	.	.	H	α-helix	trans	-60.3	-40.8	176.2	0	0	0	0	0	113	N207 D208 L209 G215	N207-G211 PolarHBondContact O-N 3.3Å; D208-G211 PolarHBondContact O-N 3.38Å; L209-G211 VanDerWaalsContact C-N 3.3Å; L209-G211 PolarHBondContact O-N 2.97Å; G211-G215 PolarHBondContact O-N 3.12Å
212	K	94.9	Very high	92.4	Very high	119 Å²	119	68.3 Å²	68.3	52%	0.517	34%	0.34	S	S	.	.	H	α-helix	trans	-64.6	-48.8	174.2	-72.1	169.9	-170.6	161.9	0	111.7	D208 L209 Y210 L214 G215 E216	D208-K212 WeakPolarHBondContact O-CG 3.34Å; D208-K212 PolarHBondContact O-N 3.11Å; D208-K212 WeakPolarHBondContact OD1-CE 3.4Å; D208-K212 IonicContact OD1-NZ 3.14Å; D208-K212 WeakPolarHBondContact OD2-CE 3.5Å; D208-K212 IonicContact OD2-NZ 2.6Å; D208-K212 PolarHBondContact OD2-NZ 3.34Å; L209-K212 WeakPolarHBondContact O-CB 3.36Å; L209-K212 PolarHBondContact O-N 3.36Å; L209-K212 VanDerWaalsContact O-N 3.11Å; Y210-K212 VanDerWaalsContact C-N 3.34Å; Y210-K212 PolarHBondContact O-N 3.45Å; K212-L214 VanDerWaalsContact C-N 3.32Å; K212-L214 PolarHBondContact O-N 3.23Å; K212-G215 PolarHBondContact O-N 2.86Å; K212-E216 WeakPolarHBondContact O-CG 3.46Å; K212-E216 PolarHBondContact O-N 3.5Å
213	I	93.9	Very high	91.9	Very high	5 Å²	5	74.5 Å²	74.5	3%	0.026	37%	0.371	C	S	.	.	H	α-helix	trans	-58.8	-46.9	179.4	-62.7	172	0	0	0	110.1	L209 Y210 E216 F217 F322 Q326 E329 Y330	L209-I213 HydrophobicContact CD1-CD1 4.04Å; L209-I213 HydrophobicContact CD1-CG1 4.2Å; L209-I213 HydrophobicContact CD2-CD1 4.46Å; L209-I213 HydrophobicContact CG-CD1 3.83Å; L209-I213 HydrophobicContact CG-CG1 4.37Å; L209-I213 VanDerWaalsContact O-CG1 3.28Å; L209-I213 WeakPolarHBondContact O-CG1 3.47Å; L209-I213 PolarHBondContact O-N 3.44Å; Y210-I213 PolarHBondContact O-N 2.97Å; I213-E216 PolarHBondContact O-N 2.99Å; I213-F217 WeakPolarHBondContact O-CB 3.45Å; I213-F217 PolarHBondContact O-N 3.01Å; I213-F322 HydrophobicContact CG2-CE2 4.22Å; I213-Q326 HydrophobicContact CD1-CG 4.46Å; I213-Q326 HydrophobicContact CG2-CG 3.86Å; I213-E329 HydrophobicContact CD1-CB 3.73Å; I213-E329 HydrophobicContact CD1-CG 4.15Å; I213-E329 HydrophobicContact CG1-CB 4.01Å; I213-E329 HydrophobicContact CG1-CG 3.89Å; I213-E329 HydrophobicContact CG2-CG 4.39Å; I213-Y330 HydrophobicContact CD1-CE2 4.5Å
214	L	94.2	Very high	91.4	Very high	54 Å²	54	72 Å²	72	28%	0.283	36%	0.362	S	S	.	.	H	α-helix	trans	-59.7	-49.1	177.4	-179.5	62.3	0	0	0	111.5	Y210 K212 E216 F217 E218 F322	Y210-L214 HydrophobicContact CE1-CD2 4.3Å; Y210-L214 WeakPolarHBondContact O-CB 3.45Å; Y210-L214 PolarHBondContact O-N 2.87Å; K212-L214 VanDerWaalsContact C-N 3.32Å; K212-L214 PolarHBondContact O-N 3.23Å; L214-E216 PolarHBondContact O-N 2.88Å; L214-F217 PolarHBondContact O-N 3.4Å; L214-E218 HydrophobicContact CD1-CG 4.15Å; L214-E218 WeakPolarHBondContact O-CB 3.3Å; L214-E218 WeakPolarHBondContact O-CG 3.46Å; L214-E218 PolarHBondContact O-N 2.78Å; L214-F322 HydrophobicContact CB-CE2 4.22Å; L214-F322 HydrophobicContact CB-CZ 4.36Å; L214-F322 HydrophobicContact CD1-CD2 4.48Å; L214-F322 HydrophobicContact CD1-CE2 3.87Å; L214-F322 HydrophobicContact CD1-CZ 4.05Å
215	G	93.1	Very high	91	Very high	25 Å²	25	73.2 Å²	73.2	26%	0.258	37%	0.372	S	S	.	.	H	α-helix	trans	-64.4	-36.2	-179.8	0	0	0	0	0	113.6	G211 K212 K219	G211-G215 PolarHBondContact O-N 3.12Å; K212-G215 PolarHBondContact O-N 2.86Å; G215-K219 WeakPolarHBondContact O-CD 3.45Å; G215-K219 VanDerWaalsContact O-CG 3.26Å; G215-K219 WeakPolarHBondContact O-CG 3.41Å; G215-K219 PolarHBondContact O-N 3.07Å
216	E	93.4	Very high	90.7	Very high	91 Å²	91	69.4 Å²	69.4	43%	0.425	35%	0.352	S	S	.	.	H	α-helix	trans	-71.8	-43	173.6	-72.8	-144.4	169.8	0	0	112.6	K212 I213 L214 K219 K220	K212-E216 WeakPolarHBondContact O-CG 3.46Å; K212-E216 PolarHBondContact O-N 3.5Å; I213-E216 PolarHBondContact O-N 2.99Å; L214-E216 PolarHBondContact O-N 2.88Å; E216-K219 PolarHBondContact O-N 2.88Å; E216-K220 WeakPolarHBondContact O-CB 3.3Å; E216-K220 WeakPolarHBondContact O-CG 3.45Å; E216-K220 PolarHBondContact O-N 2.91Å; E216-K220 IonicContact OE2-NZ 3.02Å; E216-K220 PolarHBondContact OE2-NZ 2.79Å
217	F	93.7	Very high	90.5	Very high	5 Å²	5	71 Å²	71	2%	0.022	36%	0.364	C	S	.	.	H	α-helix	trans	-60.3	-48	177.7	172	-103.6	0	0	0	110.9	I213 L214 K219 K220 W221 F226 K318 A321 F322	I213-F217 WeakPolarHBondContact O-CB 3.45Å; I213-F217 PolarHBondContact O-N 3.01Å; L214-F217 PolarHBondContact O-N 3.4Å; F217-K219 VanDerWaalsContact C-N 3.31Å; F217-K219 PolarHBondContact O-N 2.82Å; F217-K220 PolarHBondContact O-N 3.25Å; F217-W221 HydrophobicContact CE1-CB 4.35Å; F217-W221 HydrophobicContact CE1-CG 4.43Å; F217-W221 HydrophobicContact CE2-CB 4.44Å; F217-W221 AromaticContact CE2-CE3 4Å; 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 3.84Å; F217-W221 HydrophobicContact CZ-CE3 3.84Å; F217-W221 HydrophobicContact CZ-CG 4.2Å; F217-W221 WeakPolarHBondContact O-CB 3.04Å; F217-W221 PolarHBondContact O-N 2.82Å; F217-F226 AromaticContact CD2-CD2 3.81Å; F217-F226 HydrophobicContact CD2-CD2 3.81Å; F217-F226 AromaticContact CD2-CE2 3.67Å; F217-F226 HydrophobicContact CD2-CE2 3.67Å; F217-F226 HydrophobicContact CD2-CZ 4.24Å; F217-F226 HydrophobicContact CE2-CD1 4.46Å; F217-F226 AromaticContact CE2-CD2 4Å; F217-F226 HydrophobicContact CE2-CD2 4Å; F217-F226 HydrophobicContact CE2-CE1 4.42Å; F217-F226 AromaticContact CE2-CE2 3.97Å; F217-F226 HydrophobicContact CE2-CE2 3.97Å; F217-F226 HydrophobicContact CE2-CG 4.26Å; F217-F226 HydrophobicContact CE2-CZ 4.18Å; F217-K318 HydrophobicContact CE1-CG 4Å; F217-K318 HydrophobicContact CZ-CG 4.06Å; F217-A321 HydrophobicContact CE2-CB 3.83Å; F217-A321 HydrophobicContact CZ-CB 3.95Å; F217-F322 HydrophobicContact CB-CD2 4.11Å; F217-F322 HydrophobicContact CB-CE2 4.44Å; F217-F322 HydrophobicContact CD1-CB 4.22Å; F217-F322 AromaticContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CE2 4.39Å; F217-F322 HydrophobicContact CD1-CG 4.26Å; F217-F322 HydrophobicContact CD2-CD2 4.38Å; F217-F322 HydrophobicContact CE1-CB 3.8Å; F217-F322 HydrophobicContact CE1-CD2 4.04Å; F217-F322 HydrophobicContact CE1-CG 4.29Å; F217-F322 HydrophobicContact CE2-CB 4.34Å; F217-F322 AromaticContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CZ-CB 3.87Å
218	E	92.7	Very high	89.9	Confident	82 Å²	82	65.7 Å²	65.7	38%	0.383	34%	0.342	S	S	.	.	H	α-helix	trans	-58.1	-43.8	178.9	-74.5	-176.7	157	0	0	111.5	L214 W221 E222	L214-E218 HydrophobicContact CD1-CG 4.15Å; L214-E218 WeakPolarHBondContact O-CB 3.3Å; L214-E218 WeakPolarHBondContact O-CG 3.46Å; L214-E218 PolarHBondContact O-N 2.78Å; E218-W221 PolarHBondContact O-N 3Å; E218-E222 VanDerWaalsContact O-CB 3.31Å; E218-E222 WeakPolarHBondContact O-CB 3.25Å; E218-E222 VanDerWaalsContact O-CG 3.27Å; E218-E222 WeakPolarHBondContact O-CG 3.45Å; E218-E222 PolarHBondContact O-N 2.85Å
219	K	91.4	Very high	89.3	Confident	138 Å²	138	62.8 Å²	62.8	60%	0.6	32%	0.324	S	S	*	.	H	α-helix	trans	-61.3	-50.8	174.8	-68.9	168.8	-171.1	171	0	112	G215 E216 F217 W221 E222 M223	G215-K219 WeakPolarHBondContact O-CD 3.45Å; G215-K219 VanDerWaalsContact O-CG 3.26Å; G215-K219 WeakPolarHBondContact O-CG 3.41Å; G215-K219 PolarHBondContact O-N 3.07Å; E216-K219 PolarHBondContact O-N 2.88Å; F217-K219 VanDerWaalsContact C-N 3.31Å; F217-K219 PolarHBondContact O-N 2.82Å; K219-W221 VanDerWaalsContact C-N 3.31Å; K219-W221 PolarHBondContact O-N 2.94Å; K219-E222 PolarHBondContact O-N 3.3Å; K219-M223 WeakPolarHBondContact O-CB 3.49Å; K219-M223 WeakPolarHBondContact O-CG 3.48Å; K219-M223 PolarHBondContact O-N 2.74Å
220	K	89.1	Confident	88.2	Confident	74 Å²	74	67 Å²	67	32%	0.322	35%	0.353	S	S	.	.	H	α-helix	trans	-63	-37.6	180	-69.9	170.4	-171.3	162.7	0	111.2	E216 F217 G224 T225 F226	E216-K220 WeakPolarHBondContact O-CB 3.3Å; E216-K220 WeakPolarHBondContact O-CG 3.45Å; E216-K220 PolarHBondContact O-N 2.91Å; E216-K220 IonicContact OE2-NZ 3.02Å; E216-K220 PolarHBondContact OE2-NZ 2.79Å; F217-K220 PolarHBondContact O-N 3.25Å; K220-G224 PolarHBondContact O-N 3.32Å; K220-T225 PolarHBondContact O-N 2.55Å; K220-T225 PolarHBondContact O-OG1 3.49Å; K220-F226 HydrophobicContact CB-CD2 4.28Å
221	W	88.4	Confident	86.9	Confident	67 Å²	67	67.8 Å²	67.8	25%	0.254	36%	0.358	S	S	.	.	H	α-helix	trans	-70	-46.8	178.4	-173.5	-99.6	0	0	0	112.1	F217 E218 K219 M223 G224 F226 W229 K318 A321	F217-W221 HydrophobicContact CE1-CB 4.35Å; F217-W221 HydrophobicContact CE1-CG 4.43Å; F217-W221 HydrophobicContact CE2-CB 4.44Å; F217-W221 AromaticContact CE2-CE3 4Å; 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 3.84Å; F217-W221 HydrophobicContact CZ-CE3 3.84Å; F217-W221 HydrophobicContact CZ-CG 4.2Å; F217-W221 WeakPolarHBondContact O-CB 3.04Å; F217-W221 PolarHBondContact O-N 2.82Å; E218-W221 PolarHBondContact O-N 3Å; K219-W221 VanDerWaalsContact C-N 3.31Å; K219-W221 PolarHBondContact O-N 2.94Å; W221-M223 VanDerWaalsContact C-N 3.32Å; W221-M223 PolarHBondContact O-N 2.86Å; W221-G224 PolarHBondContact O-N 2.83Å; W221-F226 HydrophobicContact CE3-CB 4.29Å; W221-W229 HydrophobicContact CZ3-CB 3.86Å; 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 3.85Å; W221-K318 HydrophobicContact CZ2-CG 4.1Å; W221-A321 HydrophobicContact CE3-CB 4.08Å; W221-A321 HydrophobicContact CH2-CB 4.17Å; W221-A321 HydrophobicContact CZ3-CB 3.5Å; W221-A321 VanDerWaalsContact CZ3-CB 3.5Å
222	E	86.9	Confident	85.1	Confident	147 Å²	147	71.9 Å²	71.9	69%	0.687	37%	0.367	S	S	*	.	H	α-helix	trans	-63	-38.8	175.9	-76.6	-176.3	176	0	0	112	E218 K219 G224 K231	E218-E222 VanDerWaalsContact O-CB 3.31Å; E218-E222 WeakPolarHBondContact O-CB 3.25Å; E218-E222 VanDerWaalsContact O-CG 3.27Å; E218-E222 WeakPolarHBondContact O-CG 3.45Å; E218-E222 PolarHBondContact O-N 2.85Å; K219-E222 PolarHBondContact O-N 3.3Å; E222-G224 VanDerWaalsContact C-N 3.28Å; E222-G224 PolarHBondContact O-N 3.09Å; E222-K231 PolarHBondContact O-NZ 3.25Å
223	M	85	Confident	82.5	Confident	132 Å²	132	72.5 Å²	72.5	65%	0.65	38%	0.381	S	S	*	.	H	α-helix	trans	-70.1	-27	173.1	-68.7	173.6	64	0	0	111.9	K219 W221 T225 K231	K219-M223 WeakPolarHBondContact O-CB 3.49Å; K219-M223 WeakPolarHBondContact O-CG 3.48Å; K219-M223 PolarHBondContact O-N 2.74Å; W221-M223 VanDerWaalsContact C-N 3.32Å; W221-M223 PolarHBondContact O-N 2.86Å; M223-T225 HydrophobicContact CB-CG2 4.12Å; M223-K231 PolarHBondContact O-NZ 2.77Å
224	G	82.9	Confident	79.9	Confident	20 Å²	20	77.4 Å²	77.4	21%	0.206	42%	0.416	C	S	.	.	T	Hydrogen-bonded Turn	trans	77	26.2	-176.6	0	0	0	0	0	113.2	K220 W221 E222 K231	K220-G224 PolarHBondContact O-N 3.32Å; W221-G224 PolarHBondContact O-N 2.83Å; E222-G224 VanDerWaalsContact C-N 3.28Å; E222-G224 PolarHBondContact O-N 3.09Å; G224-K231 VanDerWaalsContact CA-CE 3.4Å
225	T	86.3	Confident	77.1	Confident	86 Å²	86	77.8 Å²	77.8	53%	0.528	42%	0.423	S	S	.	.			trans	-100.6	5.8	179.3	54.1	0	0	0	0	112.2	K220 M223 P227	K220-T225 PolarHBondContact O-N 2.55Å; K220-T225 PolarHBondContact O-OG1 3.49Å; M223-T225 HydrophobicContact CB-CG2 4.12Å; T225-P227 WeakPolarHBondContact O-CD 3.43Å
226	F	86.3	Confident	74.6	Confident	10 Å²	10	80.1 Å²	80.1	4%	0.044	44%	0.44	C	S	.	.			trans	-67.1	124.2	-178.8	-168	-96.8	0	0	0	111.3	F217 K220 W221 W229 A321 E324 Y328	F217-F226 AromaticContact CD2-CD2 3.81Å; F217-F226 HydrophobicContact CD2-CD2 3.81Å; F217-F226 AromaticContact CD2-CE2 3.67Å; F217-F226 HydrophobicContact CD2-CE2 3.67Å; F217-F226 HydrophobicContact CD2-CZ 4.24Å; F217-F226 HydrophobicContact CE2-CD1 4.46Å; F217-F226 AromaticContact CE2-CD2 4Å; F217-F226 HydrophobicContact CE2-CD2 4Å; F217-F226 HydrophobicContact CE2-CE1 4.42Å; F217-F226 AromaticContact CE2-CE2 3.97Å; F217-F226 HydrophobicContact CE2-CE2 3.97Å; F217-F226 HydrophobicContact CE2-CG 4.26Å; F217-F226 HydrophobicContact CE2-CZ 4.18Å; K220-F226 HydrophobicContact CB-CD2 4.28Å; W221-F226 HydrophobicContact CE3-CB 4.29Å; F226-W229 HydrophobicContact CD1-CB 4.13Å; F226-W229 AromaticContact CD1-CD1 3.51Å; F226-W229 HydrophobicContact CD1-CG 4.13Å; F226-W229 AromaticContact CE1-CD1 3.62Å; F226-W229 CarbonylContact O-C 3.5Å; F226-W229 PolarHBondContact O-N 3.46Å; F226-A321 HydrophobicContact CD1-CB 4.14Å; F226-A321 HydrophobicContact CE1-CB 3.92Å; F226-A321 WeakPolarHBondContact CE1-O 3.43Å; F226-A321 WeakPolarHBondContact CZ-O 3.24Å; F226-E324 HydrophobicContact CZ-CB 4.46Å; F226-Y328 HydrophobicContact CZ-CD2 4.45Å; F226-Y328 HydrophobicContact CZ-CE2 4.1Å
227	P	82.7	Confident	72	Confident	62 Å²	62	83.7 Å²	83.7	40%	0.403	46%	0.461	S	S	.	.	T	Hydrogen-bonded Turn	trans	-56.6	144.5	-178.9	-25.7	35	0	0	0	113.1	F171 T225 W229	F171-P227 HydrophobicContact CB-CB 3.9Å; T225-P227 WeakPolarHBondContact O-CD 3.43Å; P227-W229 PolarHBondContact O-N 2.94Å
228	G	79.1	Confident	69.7	Low	23 Å²	23	87.4 Å²	87.4	24%	0.237	48%	0.484	C	S	.	.	T	Hydrogen-bonded Turn	trans	71	-5.5	-179.8	0	0	0	0	0	115.6
229	W	81.8	Confident	67.4	Low	19 Å²	19	90 Å²	90	7%	0.072	50%	0.496	C	S	.	.			trans	-131.6	64.4	178.4	-63.5	88.7	0	0	0	111.7	K175 K178 W221 F226 P227 K231 N317 V320 A321 E324	K175-W229 HydrophobicContact CG-CZ3 4.25Å; K178-W229 HydrophobicContact CD-CH2 3.97Å; K178-W229 HydrophobicContact CD-CZ2 3.43Å; K178-W229 VanDerWaalsContact CD-CZ2 3.43Å; W221-W229 HydrophobicContact CZ3-CB 3.86Å; W221-W229 HydrophobicContact CZ3-CD2 4.46Å; W221-W229 HydrophobicContact CZ3-CG 4.06Å; F226-W229 HydrophobicContact CD1-CB 4.13Å; F226-W229 AromaticContact CD1-CD1 3.51Å; F226-W229 HydrophobicContact CD1-CG 4.13Å; F226-W229 AromaticContact CE1-CD1 3.62Å; F226-W229 CarbonylContact O-C 3.5Å; F226-W229 PolarHBondContact O-N 3.46Å; P227-W229 PolarHBondContact O-N 2.94Å; W229-K231 PolarHBondContact O-N 3.19Å; W229-N317 HydrophobicContact CE3-CB 4.14Å; W229-N317 HydrophobicContact CH2-CB 3.71Å; W229-N317 HydrophobicContact CZ3-CB 3.41Å; W229-N317 VanDerWaalsContact CZ3-CB 3.41Å; W229-N317 VanDerWaalsContact CZ3-CG 3.41Å; W229-V320 HydrophobicContact CZ2-CB 4.01Å; W229-V320 HydrophobicContact CZ2-CG1 3.86Å; W229-A321 HydrophobicContact CD2-CB 4.14Å; W229-A321 HydrophobicContact CG-CB 4.02Å; W229-A321 HydrophobicContact CZ2-CB 4.46Å; W229-E324 PolarHBondContact NE1-OE2 3.41Å
230	P	68.9	Low	65.3	Low	107 Å²	107	87.2 Å²	87.2	70%	0.695	50%	0.499	S	S	*	.			trans	-59.1	135.3	175	26	-32.8	0	0	0	109.3	E232	P230-E232 PolarHBondContact O-N 3.42Å; P230-E232 VanDerWaalsContact O-N 3.16Å
231	K	66.4	Low	63.8	Low	118 Å²	118	84.4 Å²	84.4	51%	0.513	49%	0.491	S	S	.	.			trans	-53.4	127.6	164.7	-84.1	-179.8	-177.9	165.8	0	106.7	E222 M223 G224 W229 T233	E222-K231 PolarHBondContact O-NZ 3.25Å; M223-K231 PolarHBondContact O-NZ 2.77Å; G224-K231 VanDerWaalsContact CA-CE 3.4Å; W229-K231 PolarHBondContact O-N 3.19Å; K231-T233 PolarHBondContact O-N 2.75Å
232	E	55	Low	62.8	Low	126 Å²	126	83.8 Å²	83.8	59%	0.589	50%	0.5	S	S	*	.			trans	-55.3	98.5	167.4	-76.2	-179	-164	0	0	105.7	K175 P230 S234 K306	K175-E232 IonicContact NZ-OE1 2.72Å; K175-E232 PolarHBondContact NZ-OE1 3.32Å; K175-E232 VanDerWaalsContact NZ-OE1 3.1Å; P230-E232 PolarHBondContact O-N 3.42Å; P230-E232 VanDerWaalsContact O-N 3.16Å; E232-S234 PolarHBondContact O-N 3.47Å; E232-K306 IonicContact OE2-NZ 3.69Å
233	T	41.8	Very low	62	Low	131 Å²	131	83.7 Å²	83.7	80%	0.804	50%	0.499	S	S	*	.			trans	-55.2	104	158	38.3	0	0	0	0	102.2	K231 S235	K231-T233 PolarHBondContact O-N 2.75Å; T233-S235 VanDerWaalsContact C-N 3.31Å; T233-S235 PolarHBondContact O-N 3.24Å
234	S	39	Very low	61.7	Low	108 Å²	108	78.5 Å²	78.5	76%	0.755	47%	0.474	S	S	*	.			trans	-48.9	108.6	177.1	-68	0	0	0	0	104.5	E232 A236	E232-S234 PolarHBondContact O-N 3.47Å; S234-A236 PolarHBondContact O-N 3.05Å
235	S	36	Very low	61.5	Low	62 Å²	62	82.2 Å²	82.2	43%	0.434	49%	0.489	S	S	.	.			trans	-61	97.9	-175.5	173.8	0	0	0	0	105.4	T233 L237 T238	T233-S235 VanDerWaalsContact C-N 3.31Å; T233-S235 PolarHBondContact O-N 3.24Å; S235-L237 PolarHBondContact O-N 3.47Å; S235-T238 PolarHBondContact O-N 2.84Å; S235-T238 PolarHBondContact O-OG1 3.44Å; S235-T238 VanDerWaalsContact O-OG1 3.08Å
236	A	38.9	Very low	61.2	Low	75 Å²	75	79 Å²	79	62%	0.62	47%	0.468	S	S	*	.	H	α-helix	trans	-57.5	-16.2	-179.4	0	0	0	0	0	110.5	S234 A240	S234-A236 PolarHBondContact O-N 3.05Å; A236-A240 WeakPolarHBondContact O-CB 3.49Å
237	L	39.8	Very low	60.8	Low	166 Å²	166	82.3 Å²	82.3	87%	0.869	49%	0.493	S	S	*	.	H	α-helix	trans	-77.8	-16.3	175.9	-91.7	82	0	0	0	115.4	S235	S235-L237 PolarHBondContact O-N 3.47Å
238	T	44.7	Very low	60.6	Low	82 Å²	82	83 Å²	83	50%	0.503	51%	0.505	S	S	.	.	H	α-helix	trans	-100.6	-14.6	-174.9	56.9	0	0	0	0	114.7	S235 M268	S235-T238 PolarHBondContact O-N 2.84Å; S235-T238 PolarHBondContact O-OG1 3.44Å; S235-T238 VanDerWaalsContact O-OG1 3.08Å; T238-M268 WeakPolarHBondContact O-CE 3.36Å
239	H	44.8	Very low	60.8	Low	136 Å²	136	83.7 Å²	83.7	63%	0.63	50%	0.501	S	S	*	.	H	α-helix	trans	-121.9	-11	-176.5	-70.2	-65	0	0	0	115.4	G241	H239-G241 PolarHBondContact O-N 3.43Å
240	A	48.3	Very low	60.9	Low	81 Å²	81	87 Å²	87	67%	0.669	53%	0.527	S	S	*	.			trans	-85.8	79.4	-179.8	0	0	0	0	0	111.1	A236	A236-A240 WeakPolarHBondContact O-CB 3.49Å
241	G	56.2	Low	61.7	Low	15 Å²	15	83.3 Å²	83.3	16%	0.155	50%	0.504	C	S	.	.	P	Polyproline II helix	trans	-59.6	150.3	157.6	0	0	0	0	0	110.7	H239 S265 A269	H239-G241 PolarHBondContact O-N 3.43Å; G241-S265 WeakPolarHBondContact CA-O 3.46Å; G241-A269 VanDerWaalsContact C-CB 3.41Å; G241-A269 VanDerWaalsContact O-CB 3.23Å; G241-A269 WeakPolarHBondContact O-CB 2.96Å
242	A	67.9	Low	62.6	Low	53 Å²	53	80.9 Å²	80.9	44%	0.438	49%	0.491	S	S	.	.	P	Polyproline II helix	trans	-81.4	127.6	177	0	0	0	0	0	110.6	L244 S265	A242-L244 PolarHBondContact O-N 2.92Å; A242-S265 PolarHBondContact N-OG 3.26Å
243	H	69.7	Low	64.1	Low	145 Å²	145	79.8 Å²	79.8	67%	0.671	49%	0.486	S	S	*	.	P	Polyproline II helix	trans	-61.9	130	176.5	-167.5	-79.4	0	0	0	110.3
244	L	79.7	Confident	66.1	Low	24 Å²	24	77.2 Å²	77.2	13%	0.126	47%	0.465	C	S	.	.			trans	-108.9	124.1	176.1	-174.4	72.9	0	0	0	108.4	A242 L246 F249 L255 L258 A266 L285	A242-L244 PolarHBondContact O-N 2.92Å; L244-L246 HydrophobicContact CD2-CD2 4.04Å; L244-L246 HydrophobicContact CG-CD2 4.37Å; L244-L246 PolarHBondContact O-N 3.39Å; L244-F249 HydrophobicContact CD1-CE2 4.48Å; L244-F249 HydrophobicContact CD2-CE2 4.44Å; L244-F249 HydrophobicContact CG-CE2 4.42Å; L244-L255 HydrophobicContact CD2-CD2 3.78Å; L244-L258 HydrophobicContact CD1-CD1 4.37Å; L244-L258 HydrophobicContact CD2-CD1 3.72Å; L244-A266 HydrophobicContact CB-CB 3.75Å; L244-A266 HydrophobicContact CD2-CB 4.27Å; L244-L285 HydrophobicContact CD2-CD2 3.88Å
245	D	78.4	Confident	68.2	Low	98 Å²	98	72 Å²	72	52%	0.524	43%	0.429	S	S	.	.			trans	-73.4	116.5	172.5	-177.3	12.2	0	0	0	110.1	S247 F249	D245-S247 VanDerWaalsContact C-N 3.34Å; D245-S247 VanDerWaalsContact OD1-CB 3.23Å; D245-S247 WeakPolarHBondContact OD1-CB 3.44Å; D245-S247 PolarHBondContact OD1-N 2.94Å; D245-S247 PolarHBondContact OD1-OG 2.99Å; D245-S247 VanDerWaalsContact OD1-OG 3.08Å; D245-S247 PolarHBondContact OD2-OG 3.13Å; D245-F249 WeakPolarHBondContact O-CD2 3.42Å; D245-F249 WeakPolarHBondContact O-CE2 3.28Å
246	L	80.4	Confident	70.5	Confident	17 Å²	17	69.9 Å²	69.9	9%	0.089	42%	0.415	C	S	.	.			trans	-85.8	-8.4	-178.9	-56	177.7	0	0	0	112.5	L244 A248 F249 L255 L285 K289	L244-L246 HydrophobicContact CD2-CD2 4.04Å; L244-L246 HydrophobicContact CG-CD2 4.37Å; L244-L246 PolarHBondContact O-N 3.39Å; L246-A248 PolarHBondContact O-N 2.83Å; L246-F249 PolarHBondContact O-N 3.41Å; L246-L255 HydrophobicContact CD2-CD1 4.13Å; L246-L255 HydrophobicContact CD2-CD2 4.03Å; L246-L285 HydrophobicContact CD1-CG 4.46Å; L246-L285 VanDerWaalsContact CD1-O 3.23Å; L246-L285 WeakPolarHBondContact CD1-O 3.49Å; L246-L285 HydrophobicContact CD2-CD1 4.5Å; L246-L285 HydrophobicContact CD2-CD2 4.14Å; L246-L285 HydrophobicContact CD2-CG 3.92Å; L246-K289 HydrophobicContact CB-CB 4.21Å; L246-K289 HydrophobicContact CB-CD 4.28Å; L246-K289 HydrophobicContact CB-CG 4.02Å; L246-K289 HydrophobicContact CD1-CB 4.21Å; L246-K289 WeakPolarHBondContact O-CD 3.41Å; L246-K289 WeakPolarHBondContact O-CE 3.45Å; L246-K289 PolarHBondContact O-NZ 2.87Å
247	S	78.1	Confident	72.6	Confident	81 Å²	81	71 Å²	71	57%	0.566	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.2	-38.7	-179.3	76.7	0	0	0	0	111.9	D245 F249 K289	D245-S247 VanDerWaalsContact C-N 3.34Å; D245-S247 VanDerWaalsContact OD1-CB 3.23Å; D245-S247 WeakPolarHBondContact OD1-CB 3.44Å; D245-S247 PolarHBondContact OD1-N 2.94Å; D245-S247 PolarHBondContact OD1-OG 2.99Å; D245-S247 VanDerWaalsContact OD1-OG 3.08Å; D245-S247 PolarHBondContact OD2-OG 3.13Å; S247-F249 VanDerWaalsContact C-N 3.3Å; S247-F249 PolarHBondContact O-N 3.26Å; S247-K289 PolarHBondContact O-NZ 2.94Å
248	A	77	Confident	74.6	Confident	77 Å²	77	66 Å²	66	64%	0.636	39%	0.392	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.9	-11	-176.7	0	0	0	0	0	115.4	L246	L246-A248 PolarHBondContact O-N 2.83Å
249	F	84.1	Confident	76.4	Confident	37 Å²	37	63.3 Å²	63.3	16%	0.162	38%	0.381	C	S	.	.			trans	-107.8	126.6	-174.6	-61.9	-85.6	0	0	0	111.3	L244 D245 L246 S247 E254 L255 L258 K289	L244-F249 HydrophobicContact CD1-CE2 4.48Å; L244-F249 HydrophobicContact CD2-CE2 4.44Å; L244-F249 HydrophobicContact CG-CE2 4.42Å; D245-F249 WeakPolarHBondContact O-CD2 3.42Å; D245-F249 WeakPolarHBondContact O-CE2 3.28Å; L246-F249 PolarHBondContact O-N 3.41Å; S247-F249 VanDerWaalsContact C-N 3.3Å; S247-F249 PolarHBondContact O-N 3.26Å; F249-E254 WeakPolarHBondContact CA-OE2 3.49Å; F249-E254 HydrophobicContact CD1-CB 3.93Å; F249-L255 HydrophobicContact CB-CD2 4.09Å; F249-L255 HydrophobicContact CB-CG 4.08Å; F249-L255 HydrophobicContact CD1-CD2 3.73Å; F249-L255 HydrophobicContact CD1-CG 4.14Å; F249-L255 HydrophobicContact CD2-CD2 3.6Å; F249-L255 HydrophobicContact CD2-CG 4.5Å; F249-L255 HydrophobicContact CE1-CD2 4.03Å; F249-L255 HydrophobicContact CE2-CD2 3.91Å; F249-L255 HydrophobicContact CG-CD2 3.51Å; F249-L255 HydrophobicContact CG-CG 3.97Å; F249-L255 HydrophobicContact CZ-CD2 4.12Å; F249-L258 HydrophobicContact CE1-CD1 3.91Å; F249-L258 HydrophobicContact CE1-CD2 4.22Å; F249-L258 HydrophobicContact CE1-CG 4.24Å; F249-L258 HydrophobicContact CE2-CD1 4.46Å; F249-L258 HydrophobicContact CZ-CD1 3.7Å; F249-L258 HydrophobicContact CZ-CD2 4.2Å; F249-L258 HydrophobicContact CZ-CG 4.37Å; F249-K289 PolarHBondContact O-NZ 3.38Å
250	S	83.1	Confident	78	Confident	89 Å²	89	60.6 Å²	60.6	62%	0.622	37%	0.37	S	S	*	.	S	Bend	trans	-89.4	-18.9	-176.1	75.6	0	0	0	0	113.4	E254	S250-E254 PolarHBondContact N-OE2 2.97Å; S250-E254 PolarHBondContact OG-OE1 3.08Å; S250-E254 PolarHBondContact OG-OE2 3.32Å
251	S	86.3	Confident	79.3	Confident	29 Å²	29	63 Å²	63	20%	0.203	37%	0.372	C	S	.	.	S	Bend	trans	-149	165.3	-175.8	69.3	0	0	0	0	111.9	E253 E254	S251-E253 VanDerWaalsContact C-N 3.31Å; S251-E253 VanDerWaalsContact CB-OE2 3.23Å; S251-E253 WeakPolarHBondContact CB-OE2 3.14Å; S251-E253 PolarHBondContact OG-OE2 3.34Å; S251-E254 WeakPolarHBondContact OG-CG 3.36Å; S251-E254 PolarHBondContact OG-N 2.95Å
252	W	85.4	Confident	80.5	Confident	67 Å²	67	69 Å²	69	25%	0.254	39%	0.39	S	S	.	.	H	α-helix	trans	-77.2	-22.8	177.9	64.6	-87.1	0	0	0	111.6	E254 L255 A256 E279 A282 Q283 F286	W252-E254 VanDerWaalsContact C-N 3.33Å; W252-L255 WeakPolarHBondContact O-CB 3.34Å; W252-L255 PolarHBondContact O-N 2.89Å; W252-A256 PolarHBondContact O-N 3.29Å; W252-E279 HydrophobicContact CH2-CB 4.36Å; W252-E279 HydrophobicContact CH2-CG 4.41Å; W252-E279 HydrophobicContact CZ3-CB 3.73Å; W252-E279 HydrophobicContact CZ3-CG 3.89Å; W252-A282 HydrophobicContact CE3-CB 4.39Å; W252-A282 WeakPolarHBondContact O-CB 3.19Å; W252-Q283 HydrophobicContact CB-CG 4.15Å; W252-Q283 HydrophobicContact CD2-CG 3.56Å; W252-Q283 HydrophobicContact CE3-CG 3.78Å; W252-Q283 HydrophobicContact CG-CG 3.71Å; W252-Q283 HydrophobicContact CZ3-CG 4.48Å; W252-F286 HydrophobicContact CB-CB 3.96Å; W252-F286 HydrophobicContact CB-CD1 4.45Å; W252-F286 HydrophobicContact CB-CG 4.14Å
253	E	85.9	Confident	81.2	Confident	102 Å²	102	66.5 Å²	66.5	48%	0.477	37%	0.369	S	S	.	.	H	α-helix	trans	-64.2	-37.1	174.5	-64.5	85.9	164.3	0	0	111.4	S251 L255 A256 S257	S251-E253 VanDerWaalsContact C-N 3.31Å; S251-E253 VanDerWaalsContact CB-OE2 3.23Å; S251-E253 WeakPolarHBondContact CB-OE2 3.14Å; S251-E253 PolarHBondContact OG-OE2 3.34Å; E253-L255 VanDerWaalsContact C-N 3.34Å; E253-A256 WeakPolarHBondContact O-CB 3.44Å; E253-A256 PolarHBondContact O-N 3.01Å; E253-S257 PolarHBondContact O-N 3.37Å
254	E	83.9	Confident	81.8	Confident	77 Å²	77	64.2 Å²	64.2	36%	0.36	36%	0.357	S	S	.	.	H	α-helix	trans	-67	-35.8	173	-70.5	172.4	-173.4	0	0	111.7	F249 S250 S251 W252 S257	F249-E254 WeakPolarHBondContact CA-OE2 3.49Å; F249-E254 HydrophobicContact CD1-CB 3.93Å; S250-E254 PolarHBondContact N-OE2 2.97Å; S250-E254 PolarHBondContact OG-OE1 3.08Å; S250-E254 PolarHBondContact OG-OE2 3.32Å; S251-E254 WeakPolarHBondContact OG-CG 3.36Å; S251-E254 PolarHBondContact OG-N 2.95Å; W252-E254 VanDerWaalsContact C-N 3.33Å; E254-S257 WeakPolarHBondContact O-CB 3.4Å; E254-S257 PolarHBondContact O-N 3.18Å; E254-S257 PolarHBondContact O-OG 3.37Å
255	L	82.8	Confident	81.9	Confident	0 Å²	0	64.9 Å²	64.9	0%	0	36%	0.364	C	S	.	.	H	α-helix	trans	-70.1	-35.3	174.6	-72.8	173.9	0	0	0	112.4	L244 L246 F249 W252 E253 S257 L258 L263 A282 F286	L244-L255 HydrophobicContact CD2-CD2 3.78Å; L246-L255 HydrophobicContact CD2-CD1 4.13Å; L246-L255 HydrophobicContact CD2-CD2 4.03Å; F249-L255 HydrophobicContact CB-CD2 4.09Å; F249-L255 HydrophobicContact CB-CG 4.08Å; F249-L255 HydrophobicContact CD1-CD2 3.73Å; F249-L255 HydrophobicContact CD1-CG 4.14Å; F249-L255 HydrophobicContact CD2-CD2 3.6Å; F249-L255 HydrophobicContact CD2-CG 4.5Å; F249-L255 HydrophobicContact CE1-CD2 4.03Å; F249-L255 HydrophobicContact CE2-CD2 3.91Å; F249-L255 HydrophobicContact CG-CD2 3.51Å; F249-L255 HydrophobicContact CG-CG 3.97Å; F249-L255 HydrophobicContact CZ-CD2 4.12Å; W252-L255 WeakPolarHBondContact O-CB 3.34Å; W252-L255 PolarHBondContact O-N 2.89Å; E253-L255 VanDerWaalsContact C-N 3.34Å; L255-S257 PolarHBondContact O-N 2.64Å; L255-L258 HydrophobicContact CD2-CD1 3.79Å; L255-L258 VanDerWaalsContact O-CB 3.32Å; L255-L258 WeakPolarHBondContact O-CB 3.4Å; L255-L258 PolarHBondContact O-N 2.9Å; L255-L258 VanDerWaalsContact O-N 3.14Å; L255-L263 HydrophobicContact CB-CD2 4.21Å; L255-A282 HydrophobicContact CB-CB 4.09Å; L255-F286 HydrophobicContact CD1-CB 3.82Å; L255-F286 HydrophobicContact CD1-CD2 3.7Å; L255-F286 HydrophobicContact CD1-CG 4.25Å
256	A	84.4	Confident	82	Confident	16 Å²	16	60.3 Å²	60.3	13%	0.132	34%	0.34	C	S	.	.	H	α-helix	trans	-58.1	-35.8	174.6	0	0	0	0	0	111.6	W252 E253 L258 G259 L278 A282	W252-A256 PolarHBondContact O-N 3.29Å; E253-A256 WeakPolarHBondContact O-CB 3.44Å; E253-A256 PolarHBondContact O-N 3.01Å; A256-L258 PolarHBondContact O-N 2.98Å; A256-L258 VanDerWaalsContact O-N 3.17Å; A256-G259 PolarHBondContact O-N 2.87Å; A256-L278 HydrophobicContact CB-CD2 3.47Å; A256-L278 VanDerWaalsContact CB-CD2 3.47Å; A256-L278 WeakPolarHBondContact O-CD2 3.44Å; A256-A282 HydrophobicContact CB-CB 4.06Å
257	S	84.2	Confident	82.2	Confident	98 Å²	98	59.5 Å²	59.5	69%	0.685	34%	0.336	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-18.8	178	80	0	0	0	0	114.6	E253 E254 L255 G259	E253-S257 PolarHBondContact O-N 3.37Å; E254-S257 WeakPolarHBondContact O-CB 3.4Å; E254-S257 PolarHBondContact O-N 3.18Å; E254-S257 PolarHBondContact O-OG 3.37Å; L255-S257 PolarHBondContact O-N 2.64Å; S257-G259 PolarHBondContact O-N 3.34Å
258	L	82.1	Confident	82.2	Confident	62 Å²	62	59.1 Å²	59.1	33%	0.325	33%	0.325	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.4	-11.6	177.9	-60.9	174.4	0	0	0	113.6	L244 F249 L255 A256 R262	L244-L258 HydrophobicContact CD1-CD1 4.37Å; L244-L258 HydrophobicContact CD2-CD1 3.72Å; F249-L258 HydrophobicContact CE1-CD1 3.91Å; F249-L258 HydrophobicContact CE1-CD2 4.22Å; F249-L258 HydrophobicContact CE1-CG 4.24Å; F249-L258 HydrophobicContact CE2-CD1 4.46Å; F249-L258 HydrophobicContact CZ-CD1 3.7Å; F249-L258 HydrophobicContact CZ-CD2 4.2Å; F249-L258 HydrophobicContact CZ-CG 4.37Å; L255-L258 HydrophobicContact CD2-CD1 3.79Å; L255-L258 VanDerWaalsContact O-CB 3.32Å; L255-L258 WeakPolarHBondContact O-CB 3.4Å; L255-L258 PolarHBondContact O-N 2.9Å; L255-L258 VanDerWaalsContact O-N 3.14Å; A256-L258 PolarHBondContact O-N 2.98Å; A256-L258 VanDerWaalsContact O-N 3.17Å; L258-R262 HydrophobicContact CB-CB 4.08Å; L258-R262 HydrophobicContact CB-CG 4.16Å; L258-R262 WeakPolarHBondContact O-CB 3.45Å
259	G	81.3	Confident	82.3	Confident	26 Å²	26	57.2 Å²	57.2	27%	0.268	31%	0.31	S	S	.	.			trans	82.4	167.8	177.2	0	0	0	0	0	114.6	A256 S257 D261 R262 L263	A256-G259 PolarHBondContact O-N 2.87Å; S257-G259 PolarHBondContact O-N 3.34Å; G259-D261 PolarHBondContact O-N 3.42Å; G259-R262 PolarHBondContact O-N 3.37Å; G259-L263 WeakPolarHBondContact O-CG 3.22Å; G259-L263 PolarHBondContact O-N 2.91Å
260	L	79	Confident	82	Confident	78 Å²	78	57 Å²	57	41%	0.408	31%	0.31	S	S	.	.	H	α-helix	trans	-68	-35.1	-165	-142	144.5	0	0	0	112.8	K264 L278	L260-K264 VanDerWaalsContact O-CB 3.28Å; L260-K264 WeakPolarHBondContact O-CB 3.18Å; L260-K264 PolarHBondContact O-N 2.7Å; L260-L278 HydrophobicContact CB-CD1 4.29Å; L260-L278 HydrophobicContact CD1-CB 4.31Å; L260-L278 HydrophobicContact CD1-CD1 4.35Å; L260-L278 HydrophobicContact CG-CD1 4.49Å
261	D	76.1	Confident	81.7	Confident	131 Å²	131	54.5 Å²	54.5	70%	0.701	30%	0.299	S	S	*	.	H	α-helix	trans	-74.5	-40	-178.9	-66.5	-44.2	0	0	0	112.8	G259 K264 S265	G259-D261 PolarHBondContact O-N 3.42Å; D261-K264 PolarHBondContact O-N 2.96Å; D261-S265 WeakPolarHBondContact O-CB 3.37Å; D261-S265 PolarHBondContact O-N 2.91Å
262	R	81.6	Confident	81.5	Confident	143 Å²	143	53.2 Å²	53.2	54%	0.54	29%	0.29	S	S	.	.	H	α-helix	trans	-66.6	-42.3	177.7	-163.5	77.5	-178.7	-164.8	2.2	111	L258 G259 S265 A266	L258-R262 HydrophobicContact CB-CB 4.08Å; L258-R262 HydrophobicContact CB-CG 4.16Å; L258-R262 WeakPolarHBondContact O-CB 3.45Å; G259-R262 PolarHBondContact O-N 3.37Å; R262-S265 PolarHBondContact O-N 2.89Å; R262-A266 WeakPolarHBondContact O-CB 3.33Å; R262-A266 PolarHBondContact O-N 2.76Å
263	L	82.4	Confident	81.5	Confident	0 Å²	0	54.4 Å²	54.4	0%	0	30%	0.297	C	S	.	.	H	α-helix	trans	-65.6	-41.2	175.7	-69.1	174.1	0	0	0	112.2	L255 G259 A266 L267 L278 R281 A282 L285	L255-L263 HydrophobicContact CB-CD2 4.21Å; G259-L263 WeakPolarHBondContact O-CG 3.22Å; G259-L263 PolarHBondContact O-N 2.91Å; L263-A266 PolarHBondContact O-N 2.85Å; L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 VanDerWaalsContact O-CG 3.27Å; L263-L267 WeakPolarHBondContact O-CG 3.4Å; L263-L267 PolarHBondContact O-N 3.36Å; L263-L278 HydrophobicContact CD1-CG 4.2Å; L263-R281 HydrophobicContact CB-CB 4.37Å; L263-R281 HydrophobicContact CD1-CB 4.4Å; L263-A282 HydrophobicContact CD1-CB 4Å; L263-A282 HydrophobicContact CD2-CB 4.33Å; L263-L285 HydrophobicContact CD2-CD2 3.7Å
264	K	81.9	Confident	81.4	Confident	96 Å²	96	51 Å²	51	42%	0.417	28%	0.284	S	S	.	.	H	α-helix	trans	-61.2	-45.8	174.8	-176	-178.9	177.3	-172	0	111	L260 D261 L267 M268 C274	L260-K264 VanDerWaalsContact O-CB 3.28Å; L260-K264 WeakPolarHBondContact O-CB 3.18Å; L260-K264 PolarHBondContact O-N 2.7Å; D261-K264 PolarHBondContact O-N 2.96Å; K264-L267 PolarHBondContact O-N 2.93Å; K264-M268 HydrophobicContact CG-SD 4.19Å; K264-M268 WeakPolarHBondContact O-CB 3.5Å; K264-M268 VanDerWaalsContact O-CG 3.25Å; K264-M268 WeakPolarHBondContact O-CG 3.2Å; K264-M268 PolarHBondContact O-N 2.9Å; K264-C274 HydrophobicContact CG-CB 4.2Å
265	S	80.3	Confident	81.1	Confident	38 Å²	38	49.5 Å²	49.5	27%	0.266	29%	0.289	S	S	.	.	H	α-helix	trans	-61.5	-46.1	177.6	-170.7	0	0	0	0	111.9	G241 A242 D261 R262 M268 A269	G241-S265 WeakPolarHBondContact CA-O 3.46Å; A242-S265 PolarHBondContact N-OG 3.26Å; D261-S265 WeakPolarHBondContact O-CB 3.37Å; D261-S265 PolarHBondContact O-N 2.91Å; R262-S265 PolarHBondContact O-N 2.89Å; S265-M268 PolarHBondContact O-N 3.38Å; S265-A269 PolarHBondContact O-N 3Å
266	A	81.1	Confident	81.1	Confident	3 Å²	3	51.3 Å²	51.3	3%	0.025	31%	0.308	C	S	.	.	H	α-helix	trans	-65.9	-39.5	178.3	0	0	0	0	0	113.3	L244 R262 L263 A269 L270 L285	L244-A266 HydrophobicContact CB-CB 3.75Å; L244-A266 HydrophobicContact CD2-CB 4.27Å; R262-A266 WeakPolarHBondContact O-CB 3.33Å; R262-A266 PolarHBondContact O-N 2.76Å; L263-A266 PolarHBondContact O-N 2.85Å; A266-A269 WeakPolarHBondContact O-CB 3.33Å; A266-A269 PolarHBondContact O-N 3.4Å; A266-L270 PolarHBondContact O-N 3.09Å; A266-L285 HydrophobicContact CB-CD1 3.95Å; A266-L285 HydrophobicContact CB-CD2 3.6Å; A266-L285 HydrophobicContact CB-CG 4.46Å
267	L	84.5	Confident	81.2	Confident	0 Å²	0	54.1 Å²	54.1	0%	0	32%	0.323	C	S	.	.	H	α-helix	trans	-66.5	-38.2	174.7	-74	169.2	0	0	0	112	L263 K264 A269 L270 G271 L272 R281 R284 L285	L263-L267 WeakPolarHBondContact O-CB 3.48Å; L263-L267 VanDerWaalsContact O-CG 3.27Å; L263-L267 WeakPolarHBondContact O-CG 3.4Å; L263-L267 PolarHBondContact O-N 3.36Å; K264-L267 PolarHBondContact O-N 2.93Å; L267-A269 VanDerWaalsContact C-N 3.34Å; L267-L270 PolarHBondContact O-N 3.27Å; L267-G271 PolarHBondContact O-N 2.73Å; L267-L272 HydrophobicContact CB-CB 4.39Å; L267-L272 HydrophobicContact CD2-CB 3.83Å; L267-L272 HydrophobicContact CD2-CD1 3.81Å; L267-L272 HydrophobicContact CD2-CG 4.5Å; L267-L272 PolarHBondContact O-N 3.08Å; L267-R281 HydrophobicContact CD1-CB 3.73Å; L267-R281 HydrophobicContact CD1-CG 3.92Å; L267-R284 HydrophobicContact CD2-CB 4.3Å; L267-R284 HydrophobicContact CD2-CG 4.14Å; L267-L285 HydrophobicContact CD2-CB 3.9Å; L267-L285 HydrophobicContact CD2-CD1 4.11Å; L267-L285 HydrophobicContact CG-CB 4.31Å; L267-L285 HydrophobicContact CG-CD1 4.4Å
268	M	79.8	Confident	81.3	Confident	72 Å²	72	52.1 Å²	52.1	36%	0.355	31%	0.305	S	S	.	.	H	α-helix	trans	-64.4	-38.9	173.4	-74.9	-179.6	62.5	0	0	111.7	T238 K264 S265 L270 G271 C274	T238-M268 WeakPolarHBondContact O-CE 3.36Å; K264-M268 HydrophobicContact CG-SD 4.19Å; K264-M268 WeakPolarHBondContact O-CB 3.5Å; K264-M268 VanDerWaalsContact O-CG 3.25Å; K264-M268 WeakPolarHBondContact O-CG 3.2Å; K264-M268 PolarHBondContact O-N 2.9Å; S265-M268 PolarHBondContact O-N 3.38Å; M268-L270 PolarHBondContact O-N 2.76Å; M268-G271 PolarHBondContact O-N 2.78Å; M268-G271 VanDerWaalsContact O-N 3.07Å; M268-C274 WeakPolarHBondContact CG-SG 3.3Å
269	A	78.8	Confident	81.5	Confident	38 Å²	38	54.5 Å²	54.5	31%	0.314	31%	0.314	S	S	.	.	H	α-helix	trans	-59.3	-31.7	177.3	0	0	0	0	0	112.4	G241 S265 A266 L267	G241-A269 VanDerWaalsContact C-CB 3.41Å; G241-A269 VanDerWaalsContact O-CB 3.23Å; G241-A269 WeakPolarHBondContact O-CB 2.96Å; S265-A269 PolarHBondContact O-N 3Å; A266-A269 WeakPolarHBondContact O-CB 3.33Å; A266-A269 PolarHBondContact O-N 3.4Å; L267-A269 VanDerWaalsContact C-N 3.34Å
270	L	77.5	Confident	81.7	Confident	31 Å²	31	57.5 Å²	57.5	16%	0.162	32%	0.321	C	S	.	.	T	Hydrogen-bonded Turn	trans	-97	2.3	179.3	-61.4	174.8	0	0	0	113.5	A266 L267 M268 L272 L285 L293	A266-L270 PolarHBondContact O-N 3.09Å; L267-L270 PolarHBondContact O-N 3.27Å; M268-L270 PolarHBondContact O-N 2.76Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 HydrophobicContact CB-CD1 3.8Å; L270-L272 HydrophobicContact CB-CG 4.02Å; L270-L272 HydrophobicContact CD1-CD1 4.08Å; L270-L272 PolarHBondContact O-N 2.85Å; L270-L285 HydrophobicContact CD1-CD1 3.68Å; L270-L293 HydrophobicContact CD2-CD2 4.24Å
271	G	76	Confident	82.1	Confident	37 Å²	37	55.4 Å²	55.4	38%	0.381	31%	0.308	S	S	.	.	T	Hydrogen-bonded Turn	trans	70.4	19.3	-178.9	0	0	0	0	0	115.1	L267 M268 A302	L267-G271 PolarHBondContact O-N 2.73Å; M268-G271 PolarHBondContact O-N 2.78Å; M268-G271 VanDerWaalsContact O-N 3.07Å; G271-A302 PolarHBondContact O-N 3.02Å
272	L	83.3	Confident	82.5	Confident	3 Å²	3	49.2 Å²	49.2	2%	0.016	28%	0.275	C	S	.	.	B	Isolated β-bridge	trans	-90.1	158.4	-175.6	-63.4	166.5	0	0	0	112.4	L267 L270 C274 T288 L300 F301	L267-L272 HydrophobicContact CB-CB 4.39Å; L267-L272 HydrophobicContact CD2-CB 3.83Å; L267-L272 HydrophobicContact CD2-CD1 3.81Å; L267-L272 HydrophobicContact CD2-CG 4.5Å; L267-L272 PolarHBondContact O-N 3.08Å; L270-L272 VanDerWaalsContact C-N 3.3Å; L270-L272 HydrophobicContact CB-CD1 3.8Å; L270-L272 HydrophobicContact CB-CG 4.02Å; L270-L272 HydrophobicContact CD1-CD1 4.08Å; L270-L272 PolarHBondContact O-N 2.85Å; L272-C274 PolarHBondContact O-N 3.18Å; L272-C274 PolarHBondContact O-SG 2.84Å; L272-T288 HydrophobicContact CD1-CG2 3.67Å; L272-L300 HydrophobicContact CD2-CB 4.03Å; L272-F301 HydrophobicContact CD2-CD1 4.13Å; L272-F301 HydrophobicContact CD2-CE1 4.14Å; L272-F301 HydrophobicContact CD2-CG 4.42Å; L272-F301 HydrophobicContact CD2-CZ 4.46Å
273	K	84.9	Confident	82.8	Confident	91 Å²	91	46.6 Å²	46.6	40%	0.396	27%	0.269	S	S	.	.			trans	-60.2	129.4	174.9	-72.6	173.3	178.7	169.3	0	111.2	R284 S299 L300 F301 A302	K273-R284 WeakPolarHBondContact O-CD 3.33Å; K273-R284 PolarHBondContact O-NH1 2.92Å; K273-S299 VanDerWaalsContact CE-O 3.23Å; K273-S299 WeakPolarHBondContact CE-O 3.47Å; K273-S299 PolarHBondContact NZ-O 2.97Å; K273-L300 PolarHBondContact N-O 3.17Å; K273-F301 VanDerWaalsContact CE-O 3.32Å; K273-F301 WeakPolarHBondContact CE-O 3.19Å; K273-A302 HydrophobicContact CG-CB 4.46Å
274	C	82.6	Confident	83	Confident	31 Å²	31	48.6 Å²	48.6	21%	0.209	28%	0.276	C	S	.	.			trans	-100.6	7.1	-179.6	-64	0	0	0	0	114.1	K264 M268 L272 R281	K264-C274 HydrophobicContact CG-CB 4.2Å; M268-C274 WeakPolarHBondContact CG-SG 3.3Å; L272-C274 PolarHBondContact O-N 3.18Å; L272-C274 PolarHBondContact O-SG 2.84Å; C274-R281 PolarHBondContact O-NE 3.31Å; C274-R281 VanDerWaalsContact O-NE 3.07Å; C274-R281 PolarHBondContact O-NH1 2.99Å; C274-R281 PolarHBondContact O-NH2 2.94Å; C274-R281 VanDerWaalsContact O-NH2 3.12Å
275	G	77.8	Confident	83.2	Confident	45 Å²	45	44.1 Å²	44.1	46%	0.464	26%	0.257	S	S	.	.			trans	-82.7	162.5	177	0	0	0	0	0	112.9	R284	G275-R284 PolarHBondContact O-NH1 2.98Å; G275-R284 PolarHBondContact O-NH2 3.38Å
276	G	83.9	Confident	83.5	Confident	39 Å²	39	45 Å²	45	40%	0.402	26%	0.256	S	S	.	.	S	Bend	trans	105.9	179.5	178.5	0	0	0	0	0	114.6	E280 R281	G276-E280 WeakPolarHBondContact CA-OE2 3.18Å; G276-R281 PolarHBondContact O-NE 3.11Å; G276-R281 VanDerWaalsContact O-NE 3.1Å; G276-R281 PolarHBondContact O-NH2 3.24Å
277	T	86.1	Confident	83.7	Confident	74 Å²	74	47 Å²	47	45%	0.454	27%	0.27	S	S	.	.			trans	-67.4	165.5	176.2	68.6	0	0	0	0	111.1	E279 E280 R281	T277-E279 PolarHBondContact O-N 3.09Å; T277-E280 PolarHBondContact N-OE2 2.99Å; T277-E280 PolarHBondContact O-N 3.33Å; T277-E280 VanDerWaalsContact OG1-CG 3.29Å; T277-E280 WeakPolarHBondContact OG1-CG 3.28Å; T277-E280 PolarHBondContact OG1-N 3.43Å; T277-R281 WeakPolarHBondContact O-CG 3.33Å; T277-R281 PolarHBondContact O-N 3.34Å; T277-R281 VanDerWaalsContact O-N 3.1Å
278	L	85.8	Confident	83.7	Confident	57 Å²	57	47.6 Å²	47.6	30%	0.298	27%	0.273	S	S	.	.	H	α-helix	trans	-59.7	-37.9	179	179.1	148.4	0	0	0	111.8	A256 L260 L263 R281 A282	A256-L278 HydrophobicContact CB-CD2 3.47Å; A256-L278 VanDerWaalsContact CB-CD2 3.47Å; A256-L278 WeakPolarHBondContact O-CD2 3.44Å; L260-L278 HydrophobicContact CB-CD1 4.29Å; L260-L278 HydrophobicContact CD1-CB 4.31Å; L260-L278 HydrophobicContact CD1-CD1 4.35Å; L260-L278 HydrophobicContact CG-CD1 4.49Å; L263-L278 HydrophobicContact CD1-CG 4.2Å; L278-R281 PolarHBondContact O-N 3.46Å; L278-A282 PolarHBondContact O-N 2.88Å
279	E	86.5	Confident	83.7	Confident	112 Å²	112	47.7 Å²	47.7	52%	0.523	27%	0.272	S	S	.	.	H	α-helix	trans	-66.3	-46.3	177.1	-58.3	174.5	174.6	0	0	111.6	W252 T277 R281 A282 Q283	W252-E279 HydrophobicContact CH2-CB 4.36Å; W252-E279 HydrophobicContact CH2-CG 4.41Å; W252-E279 HydrophobicContact CZ3-CB 3.73Å; W252-E279 HydrophobicContact CZ3-CG 3.89Å; T277-E279 PolarHBondContact O-N 3.09Å; E279-R281 VanDerWaalsContact C-N 3.27Å; E279-R281 PolarHBondContact O-N 2.87Å; E279-A282 PolarHBondContact O-N 3.14Å; E279-Q283 WeakPolarHBondContact O-CB 3.39Å; E279-Q283 WeakPolarHBondContact O-CG 3.29Å; E279-Q283 PolarHBondContact O-N 2.81Å
280	E	86.8	Confident	83.5	Confident	89 Å²	89	50 Å²	50	42%	0.416	30%	0.3	S	S	.	.	H	α-helix	trans	-61.7	-34.9	177.4	-72	170.7	173.6	0	0	112.3	G276 T277 R284	G276-E280 WeakPolarHBondContact CA-OE2 3.18Å; T277-E280 PolarHBondContact N-OE2 2.99Å; T277-E280 PolarHBondContact O-N 3.33Å; T277-E280 VanDerWaalsContact OG1-CG 3.29Å; T277-E280 WeakPolarHBondContact OG1-CG 3.28Å; T277-E280 PolarHBondContact OG1-N 3.43Å; E280-R284 WeakPolarHBondContact O-CB 3.39Å; E280-R284 PolarHBondContact O-N 3.11Å
281	R	85.6	Confident	83.7	Confident	34 Å²	34	54.6 Å²	54.6	13%	0.128	32%	0.318	C	S	.	.	H	α-helix	trans	-70.2	-43.1	175.4	-69.6	177.7	-162.1	-152.4	3.2	111.6	L263 L267 C274 G276 T277 L278 E279 R284 L285	L263-R281 HydrophobicContact CB-CB 4.37Å; L263-R281 HydrophobicContact CD1-CB 4.4Å; L267-R281 HydrophobicContact CD1-CB 3.73Å; L267-R281 HydrophobicContact CD1-CG 3.92Å; C274-R281 PolarHBondContact O-NE 3.31Å; C274-R281 VanDerWaalsContact O-NE 3.07Å; C274-R281 PolarHBondContact O-NH1 2.99Å; C274-R281 PolarHBondContact O-NH2 2.94Å; C274-R281 VanDerWaalsContact O-NH2 3.12Å; G276-R281 PolarHBondContact O-NE 3.11Å; G276-R281 VanDerWaalsContact O-NE 3.1Å; G276-R281 PolarHBondContact O-NH2 3.24Å; T277-R281 WeakPolarHBondContact O-CG 3.33Å; T277-R281 PolarHBondContact O-N 3.34Å; T277-R281 VanDerWaalsContact O-N 3.1Å; L278-R281 PolarHBondContact O-N 3.46Å; E279-R281 VanDerWaalsContact C-N 3.27Å; E279-R281 PolarHBondContact O-N 2.87Å; R281-R284 PolarHBondContact O-N 3.47Å; R281-L285 WeakPolarHBondContact O-CB 3.05Å; R281-L285 PolarHBondContact O-N 3.35Å
282	A	84.9	Confident	83.6	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	32%	0.324	C	S	.	.	H	α-helix	trans	-64.9	-43.9	177.4	0	0	0	0	0	111.6	W252 L255 A256 L263 L278 E279 L285 F286	W252-A282 HydrophobicContact CE3-CB 4.39Å; W252-A282 WeakPolarHBondContact O-CB 3.19Å; L255-A282 HydrophobicContact CB-CB 4.09Å; A256-A282 HydrophobicContact CB-CB 4.06Å; L263-A282 HydrophobicContact CD1-CB 4Å; L263-A282 HydrophobicContact CD2-CB 4.33Å; L278-A282 PolarHBondContact O-N 2.88Å; E279-A282 PolarHBondContact O-N 3.14Å; A282-L285 PolarHBondContact O-N 3.43Å; A282-F286 VanDerWaalsContact O-CB 3.31Å; A282-F286 WeakPolarHBondContact O-CB 3.46Å; A282-F286 PolarHBondContact O-N 3.12Å
283	Q	87.8	Confident	82.9	Confident	89 Å²	89	60.5 Å²	60.5	42%	0.416	35%	0.346	S	S	.	.	H	α-helix	trans	-62.6	-42.6	175	-71.7	174.5	2.2	0	0	111.9	W252 E279 F286 S287	W252-Q283 HydrophobicContact CB-CG 4.15Å; W252-Q283 HydrophobicContact CD2-CG 3.56Å; W252-Q283 HydrophobicContact CE3-CG 3.78Å; W252-Q283 HydrophobicContact CG-CG 3.71Å; W252-Q283 HydrophobicContact CZ3-CG 4.48Å; E279-Q283 WeakPolarHBondContact O-CB 3.39Å; E279-Q283 WeakPolarHBondContact O-CG 3.29Å; E279-Q283 PolarHBondContact O-N 2.81Å; Q283-F286 PolarHBondContact O-N 3.21Å; Q283-S287 WeakPolarHBondContact O-CB 3.22Å; Q283-S287 PolarHBondContact O-N 2.84Å
284	R	87.3	Confident	82.2	Confident	42 Å²	42	65 Å²	65	16%	0.158	37%	0.369	C	S	.	.	H	α-helix	trans	-62.8	-44.3	176.8	-169.5	179.1	-54.4	120.1	11.9	111.9	L267 K273 G275 E280 R281 S287 L300	L267-R284 HydrophobicContact CD2-CB 4.3Å; L267-R284 HydrophobicContact CD2-CG 4.14Å; K273-R284 WeakPolarHBondContact O-CD 3.33Å; K273-R284 PolarHBondContact O-NH1 2.92Å; G275-R284 PolarHBondContact O-NH1 2.98Å; G275-R284 PolarHBondContact O-NH2 3.38Å; E280-R284 WeakPolarHBondContact O-CB 3.39Å; E280-R284 PolarHBondContact O-N 3.11Å; R281-R284 PolarHBondContact O-N 3.47Å; R284-S287 PolarHBondContact O-N 3.24Å; R284-S287 PolarHBondContact O-OG 3.49Å; R284-L300 HydrophobicContact CG-CD2 4.46Å
285	L	85.9	Confident	81.8	Confident	1 Å²	1	66.8 Å²	66.8	1%	0.005	38%	0.381	C	S	.	.	H	α-helix	trans	-67.5	-39.9	176.2	-173.3	64.5	0	0	0	111.7	L244 L246 L263 A266 L267 L270 R281 A282 S287 T288	L244-L285 HydrophobicContact CD2-CD2 3.88Å; L246-L285 HydrophobicContact CD1-CG 4.46Å; L246-L285 VanDerWaalsContact CD1-O 3.23Å; L246-L285 WeakPolarHBondContact CD1-O 3.49Å; L246-L285 HydrophobicContact CD2-CD1 4.5Å; L246-L285 HydrophobicContact CD2-CD2 4.14Å; L246-L285 HydrophobicContact CD2-CG 3.92Å; L263-L285 HydrophobicContact CD2-CD2 3.7Å; A266-L285 HydrophobicContact CB-CD1 3.95Å; A266-L285 HydrophobicContact CB-CD2 3.6Å; A266-L285 HydrophobicContact CB-CG 4.46Å; L267-L285 HydrophobicContact CD2-CB 3.9Å; L267-L285 HydrophobicContact CD2-CD1 4.11Å; L267-L285 HydrophobicContact CG-CB 4.31Å; L267-L285 HydrophobicContact CG-CD1 4.4Å; L270-L285 HydrophobicContact CD1-CD1 3.68Å; R281-L285 WeakPolarHBondContact O-CB 3.05Å; R281-L285 PolarHBondContact O-N 3.35Å; A282-L285 PolarHBondContact O-N 3.43Å; L285-S287 VanDerWaalsContact C-N 3.3Å; L285-S287 PolarHBondContact O-N 3.29Å; L285-T288 PolarHBondContact O-N 3.31Å; L285-T288 PolarHBondContact O-OG1 3.2Å
286	F	86.4	Confident	81.8	Confident	58 Å²	58	65.2 Å²	65.2	25%	0.254	36%	0.362	S	S	.	.	H	α-helix	trans	-66	-33.7	176.9	-165.7	-105.5	0	0	0	112.3	W252 L255 A282 Q283 T288 K289	W252-F286 HydrophobicContact CB-CB 3.96Å; W252-F286 HydrophobicContact CB-CD1 4.45Å; W252-F286 HydrophobicContact CB-CG 4.14Å; L255-F286 HydrophobicContact CD1-CB 3.82Å; L255-F286 HydrophobicContact CD1-CD2 3.7Å; L255-F286 HydrophobicContact CD1-CG 4.25Å; A282-F286 VanDerWaalsContact O-CB 3.31Å; A282-F286 WeakPolarHBondContact O-CB 3.46Å; A282-F286 PolarHBondContact O-N 3.12Å; Q283-F286 PolarHBondContact O-N 3.21Å; F286-T288 PolarHBondContact O-N 3.43Å; F286-K289 HydrophobicContact CD2-CD 4.45Å; F286-K289 HydrophobicContact CE2-CD 3.92Å; F286-K289 HydrophobicContact CZ-CD 4.31Å; F286-K289 WeakPolarHBondContact O-CB 3.46Å; F286-K289 PolarHBondContact O-N 3.27Å
287	S	85.8	Confident	81.4	Confident	44 Å²	44	67.7 Å²	67.7	31%	0.308	37%	0.366	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-16	179.4	78.7	0	0	0	0	114.2	Q283 R284 L285	Q283-S287 WeakPolarHBondContact O-CB 3.22Å; Q283-S287 PolarHBondContact O-N 2.84Å; R284-S287 PolarHBondContact O-N 3.24Å; R284-S287 PolarHBondContact O-OG 3.49Å; L285-S287 VanDerWaalsContact C-N 3.3Å; L285-S287 PolarHBondContact O-N 3.29Å
288	T	83.5	Confident	81	Confident	13 Å²	13	69.4 Å²	69.4	8%	0.08	38%	0.379	C	S	.	.	T	Hydrogen-bonded Turn	trans	-91.5	-4.2	175.4	69	0	0	0	0	113.5	L272 L285 F286 G290 K291 L296	L272-T288 HydrophobicContact CD1-CG2 3.67Å; L285-T288 PolarHBondContact O-N 3.31Å; L285-T288 PolarHBondContact O-OG1 3.2Å; F286-T288 PolarHBondContact O-N 3.43Å; T288-G290 PolarHBondContact O-N 3.23Å; T288-K291 PolarHBondContact O-N 3.46Å; T288-L296 HydrophobicContact CG2-CD1 3.51Å; T288-L296 HydrophobicContact CG2-CD2 3.96Å; T288-L296 HydrophobicContact CG2-CG 4.41Å
289	K	81.8	Confident	80.6	Confident	73 Å²	73	69.6 Å²	69.6	32%	0.317	39%	0.385	S	S	.	.	T	Hydrogen-bonded Turn	trans	-62.6	120.5	177.8	-172.8	176	-179.9	170	0	110.3	L246 S247 F249 F286 K291	L246-K289 HydrophobicContact CB-CB 4.21Å; L246-K289 HydrophobicContact CB-CD 4.28Å; L246-K289 HydrophobicContact CB-CG 4.02Å; L246-K289 HydrophobicContact CD1-CB 4.21Å; L246-K289 WeakPolarHBondContact O-CD 3.41Å; L246-K289 WeakPolarHBondContact O-CE 3.45Å; L246-K289 PolarHBondContact O-NZ 2.87Å; S247-K289 PolarHBondContact O-NZ 2.94Å; F249-K289 PolarHBondContact O-NZ 3.38Å; F286-K289 HydrophobicContact CD2-CD 4.45Å; F286-K289 HydrophobicContact CE2-CD 3.92Å; F286-K289 HydrophobicContact CZ-CD 4.31Å; F286-K289 WeakPolarHBondContact O-CB 3.46Å; F286-K289 PolarHBondContact O-N 3.27Å; K289-K291 VanDerWaalsContact C-N 3.28Å; K289-K291 PolarHBondContact O-N 2.71Å
290	G	74.5	Confident	80.1	Confident	88 Å²	88	66.4 Å²	66.4	91%	0.907	37%	0.371	S	S	*	.	T	Hydrogen-bonded Turn	trans	75	9.4	177.2	0	0	0	0	0	115.4	T288	T288-G290 PolarHBondContact O-N 3.23Å
291	K	81.4	Confident	79.8	Confident	126 Å²	126	65 Å²	65	55%	0.548	36%	0.364	S	S	.	.			trans	-111.1	140.8	176.2	-68.3	-174.6	-175.2	173.1	0	110.5	T288 K289 L296	T288-K291 PolarHBondContact O-N 3.46Å; K289-K291 VanDerWaalsContact C-N 3.28Å; K289-K291 PolarHBondContact O-N 2.71Å; K291-L296 HydrophobicContact CB-CD2 4Å; K291-L296 HydrophobicContact CD-CD2 3.96Å
292	S	73.7	Confident	79.3	Confident	71 Å²	71	65.7 Å²	65.7	50%	0.497	38%	0.377	S	S	.	.			trans	-71.2	148.4	169.7	64.3	0	0	0	0	109.8	E294 S295	S292-E294 PolarHBondContact O-N 3.36Å; S292-E294 VanDerWaalsContact O-N 3.1Å; S292-S295 PolarHBondContact N-OG 2.76Å; S292-S295 PolarHBondContact O-N 2.97Å; S292-S295 PolarHBondContact O-OG 3.02Å; S292-S295 PolarHBondContact OG-OG 2.89Å
293	L	68.2	Low	78.1	Confident	93 Å²	93	74.7 Å²	74.7	49%	0.487	42%	0.416	S	S	.	.	G	3₁₀ helix	trans	-56.2	-29.1	-179.3	-72.8	170.7	0	0	0	113.1	L270 S295 L296 F301	L270-L293 HydrophobicContact CD2-CD2 4.24Å; L293-S295 VanDerWaalsContact C-N 3.32Å; L293-S295 PolarHBondContact O-N 3.46Å; L293-L296 HydrophobicContact CD2-CD1 4.02Å; L293-F301 HydrophobicContact CD2-CE1 4.47Å; L293-F301 WeakPolarHBondContact O-CZ 3.47Å
294	E	70.7	Confident	76.3	Confident	186 Å²	186	75.7 Å²	75.7	87%	0.869	42%	0.424	S	S	*	.	G	3₁₀ helix	trans	-73.1	-21.6	178.5	-63.4	168	-179	0	0	113.6	S292	S292-E294 PolarHBondContact O-N 3.36Å; S292-E294 VanDerWaalsContact O-N 3.1Å
295	S	74.3	Confident	74.3	Confident	68 Å²	68	79.7 Å²	79.7	48%	0.476	46%	0.456	S	S	.	.	G	3₁₀ helix	trans	-91.4	-1.4	-179.4	69.9	0	0	0	0	113.8	S292 L293	S292-S295 PolarHBondContact N-OG 2.76Å; S292-S295 PolarHBondContact O-N 2.97Å; S292-S295 PolarHBondContact O-OG 3.02Å; S292-S295 PolarHBondContact OG-OG 2.89Å; L293-S295 VanDerWaalsContact C-N 3.32Å; L293-S295 PolarHBondContact O-N 3.46Å
296	L	77.7	Confident	72.5	Confident	13 Å²	13	86 Å²	86	7%	0.068	48%	0.483	C	S	.	.	S	Bend	trans	-84.5	147.4	179.5	-62	176.7	0	0	0	110.9	T288 K291 L293 P298 F301	T288-L296 HydrophobicContact CG2-CD1 3.51Å; T288-L296 HydrophobicContact CG2-CD2 3.96Å; T288-L296 HydrophobicContact CG2-CG 4.41Å; K291-L296 HydrophobicContact CB-CD2 4Å; K291-L296 HydrophobicContact CD-CD2 3.96Å; L293-L296 HydrophobicContact CD2-CD1 4.02Å; L296-P298 WeakPolarHBondContact O-CD 3.24Å; L296-F301 HydrophobicContact CB-CE2 3.86Å; L296-F301 HydrophobicContact CB-CZ 4.1Å; L296-F301 HydrophobicContact CD1-CZ 4.14Å
297	D	75.7	Confident	70.3	Confident	90 Å²	90	88 Å²	88	48%	0.481	50%	0.504	S	S	.	.			trans	-59.3	122.6	176.2	177.4	-1.4	0	0	0	110.3	S299 L300	D297-S299 PolarHBondContact O-N 3.39Å; D297-S299 VanDerWaalsContact OD1-CB 3.32Å; D297-S299 WeakPolarHBondContact OD1-CB 3.45Å; D297-S299 PolarHBondContact OD1-N 3.35Å; D297-S299 PolarHBondContact OD1-OG 3.46Å; D297-S299 PolarHBondContact OD2-OG 3.42Å; D297-L300 HydrophobicContact CB-CD1 4.13Å; D297-L300 HydrophobicContact CB-CG 4.18Å; D297-L300 WeakPolarHBondContact O-CB 3.42Å; D297-L300 PolarHBondContact O-N 2.9Å
298	P	76.9	Confident	68.1	Low	110 Å²	110	95.7 Å²	95.7	71%	0.714	53%	0.532	S	S	*	.	G	3₁₀ helix	trans	-50.4	-23.7	174.8	-29.1	36.4	0	0	0	114.6	L296 L300	L296-P298 WeakPolarHBondContact O-CD 3.24Å; P298-L300 VanDerWaalsContact C-N 3.28Å; P298-L300 PolarHBondContact O-N 3.25Å
299	S	76.9	Confident	66.1	Low	61 Å²	61	96.5 Å²	96.5	43%	0.427	54%	0.543	S	S	.	.	G	3₁₀ helix	trans	-68.8	-21.6	177.4	86.9	0	0	0	0	114.1	K273 D297	K273-S299 VanDerWaalsContact CE-O 3.23Å; K273-S299 WeakPolarHBondContact CE-O 3.47Å; K273-S299 PolarHBondContact NZ-O 2.97Å; D297-S299 PolarHBondContact O-N 3.39Å; D297-S299 VanDerWaalsContact OD1-CB 3.32Å; D297-S299 WeakPolarHBondContact OD1-CB 3.45Å; D297-S299 PolarHBondContact OD1-N 3.35Å; D297-S299 PolarHBondContact OD1-OG 3.46Å; D297-S299 PolarHBondContact OD2-OG 3.42Å
300	L	75.9	Confident	64.7	Low	46 Å²	46	95.5 Å²	95.5	24%	0.241	54%	0.544	C	S	.	.	G	3₁₀ helix	trans	-82	-22.4	-178.1	-64	174	0	0	0	113	L272 K273 R284 D297 P298	L272-L300 HydrophobicContact CD2-CB 4.03Å; K273-L300 PolarHBondContact N-O 3.17Å; R284-L300 HydrophobicContact CG-CD2 4.46Å; D297-L300 HydrophobicContact CB-CD1 4.13Å; D297-L300 HydrophobicContact CB-CG 4.18Å; D297-L300 WeakPolarHBondContact O-CB 3.42Å; D297-L300 PolarHBondContact O-N 2.9Å; P298-L300 VanDerWaalsContact C-N 3.28Å; P298-L300 PolarHBondContact O-N 3.25Å
301	F	80.6	Confident	63.7	Low	58 Å²	58	99.7 Å²	99.7	25%	0.254	54%	0.537	S	S	.	.	B	Isolated β-bridge	trans	-71.5	143.2	177.1	-69.1	-84.6	0	0	0	111.2	L272 K273 L293 L296 K303	L272-F301 HydrophobicContact CD2-CD1 4.13Å; L272-F301 HydrophobicContact CD2-CE1 4.14Å; L272-F301 HydrophobicContact CD2-CG 4.42Å; L272-F301 HydrophobicContact CD2-CZ 4.46Å; K273-F301 VanDerWaalsContact CE-O 3.32Å; K273-F301 WeakPolarHBondContact CE-O 3.19Å; L293-F301 HydrophobicContact CD2-CE1 4.47Å; L293-F301 WeakPolarHBondContact O-CZ 3.47Å; L296-F301 HydrophobicContact CB-CE2 3.86Å; L296-F301 HydrophobicContact CB-CZ 4.1Å; L296-F301 HydrophobicContact CD1-CZ 4.14Å; F301-K303 PolarHBondContact O-N 2.86Å
302	A	75.9	Confident	62.8	Low	50 Å²	50	101.6 Å²	101.6	41%	0.413	55%	0.546	S	S	.	.			trans	-63.3	124.1	172.2	0	0	0	0	0	108.2	G271 K273 N304	G271-A302 PolarHBondContact O-N 3.02Å; K273-A302 HydrophobicContact CG-CB 4.46Å; A302-N304 PolarHBondContact O-N 2.71Å
303	K	59.4	Low	62.5	Low	189 Å²	189	101.6 Å²	101.6	82%	0.822	54%	0.54	S	S	*	.			trans	-61.6	110.7	169.3	-74.6	-173	177.7	-179.8	0	106.6	F301 P305	F301-K303 PolarHBondContact O-N 2.86Å; K303-P305 WeakPolarHBondContact O-CD 3.32Å
304	N	50.6	Low	62.9	Low	109 Å²	109	101.1 Å²	101.1	58%	0.583	54%	0.541	S	S	*	.			trans	-62.4	118.2	166.8	-107.6	-12	0	0	0	106.8	A302 K306 S307	A302-N304 PolarHBondContact O-N 2.71Å; N304-K306 PolarHBondContact O-N 2.79Å; N304-S307 PolarHBondContact O-N 2.93Å
305	P	45.6	Very low	63.4	Low	126 Å²	126	98.4 Å²	98.4	82%	0.818	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.6	-13	174.5	9.8	-9.5	0	0	0	112	K303	K303-P305 WeakPolarHBondContact O-CD 3.32Å
306	K	47.8	Very low	63.8	Low	135 Å²	135	101 Å²	101	59%	0.587	53%	0.528	S	S	*	.	T	Hydrogen-bonded Turn	trans	-91.7	20.8	-178.1	-61	-158.5	178.1	-173.7	0	115.7	E232 N304 P310	E232-K306 IonicContact OE2-NZ 3.69Å; N304-K306 PolarHBondContact O-N 2.79Å; K306-P310 WeakPolarHBondContact O-CD 3.33Å; K306-P310 WeakPolarHBondContact O-CG 3.39Å
307	S	40.6	Very low	64.1	Low	98 Å²	98	101.4 Å²	101.4	69%	0.685	53%	0.53	S	S	*	.	S	Bend	trans	-96.4	-17.1	179.8	79.5	0	0	0	0	116.4	N304	N304-S307 PolarHBondContact O-N 2.93Å
308	K	37.7	Very low	64.7	Low	206 Å²	206	101 Å²	101	90%	0.896	52%	0.524	S	S	*	.	S	Bend	trans	-111.3	-13.6	177.3	-77.8	-170.5	174.9	-174.8	0	115.7
309	G	43.4	Very low	65.4	Low	30 Å²	30	100 Å²	100	31%	0.309	51%	0.51	S	S	.	.	S	Bend	trans	-104.2	-18.7	177.1	0	0	0	0	0	118.8	K311 K312 D313	G309-K311 PolarHBondContact O-N 3.22Å; G309-K312 PolarHBondContact O-N 2.97Å; G309-D313 PolarHBondContact O-N 2.89Å; G309-D313 VanDerWaalsContact O-N 3.17Å
310	P	52	Low	66	Low	53 Å²	53	97.2 Å²	97.2	34%	0.344	49%	0.49	S	S	.	.	H	α-helix	trans	-71.1	-36.6	-163	33.2	-39.4	0	0	0	112.3	K306 D313 T314	K306-P310 WeakPolarHBondContact O-CD 3.33Å; K306-P310 WeakPolarHBondContact O-CG 3.39Å; P310-D313 PolarHBondContact O-N 3.08Å; P310-T314 WeakPolarHBondContact O-CB 3.45Å; P310-T314 VanDerWaalsContact O-CG2 3.25Å; P310-T314 WeakPolarHBondContact O-CG2 3.46Å; P310-T314 PolarHBondContact O-N 2.95Å; P310-T314 PolarHBondContact O-OG1 3.42Å
311	K	53.3	Low	66.7	Low	175 Å²	175	95 Å²	95	76%	0.761	48%	0.479	S	S	*	.	H	α-helix	trans	-65	-44.7	-179.2	-80.2	-169.9	173.4	-172.6	0	111.9	G309 T314 E315	G309-K311 PolarHBondContact O-N 3.22Å; K311-T314 VanDerWaalsContact CA-OG1 3.32Å; K311-T314 WeakPolarHBondContact CA-OG1 3.37Å; K311-T314 PolarHBondContact O-N 3.5Å; K311-T314 PolarHBondContact O-OG1 2.7Å; K311-E315 VanDerWaalsContact O-CB 3.24Å; K311-E315 WeakPolarHBondContact O-CB 3.25Å; K311-E315 PolarHBondContact O-N 2.67Å
312	K	61.4	Low	67.3	Low	167 Å²	167	93.7 Å²	93.7	73%	0.726	47%	0.473	S	S	*	.	H	α-helix	trans	-68.8	-38.5	-179.7	-169.1	175.7	-179.2	177.8	0	111.8	G309 R316	G309-K312 PolarHBondContact O-N 2.97Å; K312-R316 VanDerWaalsContact O-CB 3.26Å; K312-R316 WeakPolarHBondContact O-CB 3.4Å; K312-R316 PolarHBondContact O-N 3.45Å
313	D	68.1	Low	68.2	Low	71 Å²	71	92.4 Å²	92.4	38%	0.38	46%	0.459	S	S	.	.	H	α-helix	trans	-72	-36.4	175.6	-72	-37.3	0	0	0	112.1	G309 P310 R316 N317	G309-D313 PolarHBondContact O-N 2.89Å; G309-D313 VanDerWaalsContact O-N 3.17Å; P310-D313 PolarHBondContact O-N 3.08Å; D313-R316 IonicContact OD1-CZ 3.62Å; D313-R316 IonicContact OD1-NH1 3.48Å; D313-R316 PolarHBondContact OD1-NH1 3.05Å; D313-R316 IonicContact OD1-NH2 3.69Å; D313-N317 WeakPolarHBondContact O-CB 3.49Å; D313-N317 PolarHBondContact O-N 3.31Å; D313-N317 PolarHBondContact O-ND2 3.38Å; D313-N317 PolarHBondContact O-OD1 3.4Å
314	T	75.9	Confident	69.7	Low	83 Å²	83	83.4 Å²	83.4	51%	0.509	42%	0.42	S	S	.	.	H	α-helix	trans	-67.6	-37.4	174	49.3	0	0	0	0	112.5	P310 K311 K318	P310-T314 WeakPolarHBondContact O-CB 3.45Å; P310-T314 VanDerWaalsContact O-CG2 3.25Å; P310-T314 WeakPolarHBondContact O-CG2 3.46Å; P310-T314 PolarHBondContact O-N 2.95Å; P310-T314 PolarHBondContact O-OG1 3.42Å; K311-T314 VanDerWaalsContact CA-OG1 3.32Å; K311-T314 WeakPolarHBondContact CA-OG1 3.37Å; K311-T314 PolarHBondContact O-N 3.5Å; K311-T314 PolarHBondContact O-OG1 2.7Å; T314-K318 WeakPolarHBondContact O-CB 3.47Å; T314-K318 PolarHBondContact O-N 3.21Å
315	E	81.1	Confident	71.8	Confident	129 Å²	129	78.6 Å²	78.6	60%	0.603	40%	0.395	S	S	*	.	H	α-helix	trans	-70.2	-46.5	177.9	-168.6	161.6	-151.4	0	0	110.5	K311 N317 K318 E319	K311-E315 VanDerWaalsContact O-CB 3.24Å; K311-E315 WeakPolarHBondContact O-CB 3.25Å; K311-E315 PolarHBondContact O-N 2.67Å; E315-N317 VanDerWaalsContact C-N 3.31Å; E315-N317 PolarHBondContact O-N 2.97Å; E315-K318 WeakPolarHBondContact O-CB 3.29Å; E315-K318 PolarHBondContact O-N 3.17Å; E315-K318 VanDerWaalsContact O-N 3.12Å; E315-E319 WeakPolarHBondContact O-CG 3.33Å; E315-E319 PolarHBondContact O-N 3.18Å
316	R	82.4	Confident	74.1	Confident	121 Å²	121	73 Å²	73	46%	0.457	36%	0.358	S	S	.	.	H	α-helix	trans	-57.2	-43	171.9	-171.3	-172.1	74.8	-161.4	-0.5	112.3	K312 D313 E319 V320	K312-R316 VanDerWaalsContact O-CB 3.26Å; K312-R316 WeakPolarHBondContact O-CB 3.4Å; K312-R316 PolarHBondContact O-N 3.45Å; D313-R316 IonicContact OD1-CZ 3.62Å; D313-R316 IonicContact OD1-NH1 3.48Å; D313-R316 PolarHBondContact OD1-NH1 3.05Å; D313-R316 IonicContact OD1-NH2 3.69Å; R316-E319 WeakPolarHBondContact O-CB 3.5Å; R316-E319 PolarHBondContact O-N 2.94Å; R316-V320 WeakPolarHBondContact O-CG2 3.41Å; R316-V320 PolarHBondContact O-N 3.14Å; R316-V320 VanDerWaalsContact O-N 3.1Å
317	N	84.9	Confident	76.3	Confident	23 Å²	23	66.6 Å²	66.6	12%	0.123	33%	0.33	C	S	.	.	H	α-helix	trans	-68.4	-36.4	178.4	-71.9	-8.1	0	0	0	111.8	W229 D313 E315 E319 V320 A321	W229-N317 HydrophobicContact CE3-CB 4.14Å; W229-N317 HydrophobicContact CH2-CB 3.71Å; W229-N317 HydrophobicContact CZ3-CB 3.41Å; W229-N317 VanDerWaalsContact CZ3-CB 3.41Å; W229-N317 VanDerWaalsContact CZ3-CG 3.41Å; D313-N317 WeakPolarHBondContact O-CB 3.49Å; D313-N317 PolarHBondContact O-N 3.31Å; D313-N317 PolarHBondContact O-ND2 3.38Å; D313-N317 PolarHBondContact O-OD1 3.4Å; E315-N317 VanDerWaalsContact C-N 3.31Å; E315-N317 PolarHBondContact O-N 2.97Å; N317-E319 VanDerWaalsContact C-N 3.35Å; N317-V320 PolarHBondContact O-N 3.44Å; N317-A321 VanDerWaalsContact O-CB 3.3Å; N317-A321 WeakPolarHBondContact O-CB 3.45Å; N317-A321 PolarHBondContact O-N 3.28Å
318	K	88.6	Confident	78.8	Confident	80 Å²	80	64.1 Å²	64.1	35%	0.348	31%	0.306	S	S	.	.	H	α-helix	trans	-63.8	-41.4	174.1	-171.2	-178.1	-179.7	-170.9	0	111	F217 W221 T314 E315 A321 F322	F217-K318 HydrophobicContact CE1-CG 4Å; 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 3.85Å; W221-K318 HydrophobicContact CZ2-CG 4.1Å; T314-K318 WeakPolarHBondContact O-CB 3.47Å; T314-K318 PolarHBondContact O-N 3.21Å; E315-K318 WeakPolarHBondContact O-CB 3.29Å; E315-K318 PolarHBondContact O-N 3.17Å; E315-K318 VanDerWaalsContact O-N 3.12Å; K318-A321 PolarHBondContact O-N 3.41Å; K318-F322 WeakPolarHBondContact O-CB 2.99Å; K318-F322 PolarHBondContact O-N 2.83Å
319	E	90.5	Very high	81.4	Confident	89 Å²	89	56.6 Å²	56.6	42%	0.416	27%	0.274	S	S	.	.	H	α-helix	trans	-59.4	-48.5	174.2	-70.4	171.6	-165.7	0	0	111.8	K183 E315 R316 N317 F322 L323	K183-E319 IonicContact NZ-OE2 3.72Å; K183-E319 PolarHBondContact NZ-OE2 2.82Å; E315-E319 WeakPolarHBondContact O-CG 3.33Å; E315-E319 PolarHBondContact O-N 3.18Å; R316-E319 WeakPolarHBondContact O-CB 3.5Å; R316-E319 PolarHBondContact O-N 2.94Å; N317-E319 VanDerWaalsContact C-N 3.35Å; E319-F322 PolarHBondContact O-N 3.21Å; E319-L323 WeakPolarHBondContact O-CG 3.29Å; E319-L323 PolarHBondContact O-N 3.06Å
320	V	90.6	Very high	83.8	Confident	4 Å²	4	55.2 Å²	55.2	2%	0.024	26%	0.259	C	S	.	.	H	α-helix	trans	-64.2	-43	179	178.2	0	0	0	0	110.9	Y182 K183 W229 R316 N317 F322 L323 E324	Y182-V320 HydrophobicContact CD1-CG1 4.36Å; Y182-V320 HydrophobicContact CE1-CG1 4.27Å; K183-V320 HydrophobicContact CB-CG2 4.2Å; K183-V320 HydrophobicContact CD-CG2 4.04Å; K183-V320 HydrophobicContact CG-CG2 4.03Å; W229-V320 HydrophobicContact CZ2-CB 4.01Å; W229-V320 HydrophobicContact CZ2-CG1 3.86Å; R316-V320 WeakPolarHBondContact O-CG2 3.41Å; R316-V320 PolarHBondContact O-N 3.14Å; R316-V320 VanDerWaalsContact O-N 3.1Å; N317-V320 PolarHBondContact O-N 3.44Å; V320-F322 VanDerWaalsContact C-N 3.27Å; V320-F322 PolarHBondContact O-N 2.79Å; V320-L323 PolarHBondContact O-N 3.15Å; V320-E324 WeakPolarHBondContact O-CG 3.36Å; V320-E324 PolarHBondContact O-N 2.85Å
321	A	90.8	Very high	85.8	Confident	0 Å²	0	53 Å²	53	0%	0	25%	0.245	C	C	.	.	H	α-helix	trans	-61.1	-36.2	175.9	0	0	0	0	0	112.4	F217 W221 F226 W229 N317 K318 E324 S325	F217-A321 HydrophobicContact CE2-CB 3.83Å; F217-A321 HydrophobicContact CZ-CB 3.95Å; W221-A321 HydrophobicContact CE3-CB 4.08Å; W221-A321 HydrophobicContact CH2-CB 4.17Å; W221-A321 HydrophobicContact CZ3-CB 3.5Å; W221-A321 VanDerWaalsContact CZ3-CB 3.5Å; F226-A321 HydrophobicContact CD1-CB 4.14Å; F226-A321 HydrophobicContact CE1-CB 3.92Å; F226-A321 WeakPolarHBondContact CE1-O 3.43Å; F226-A321 WeakPolarHBondContact CZ-O 3.24Å; W229-A321 HydrophobicContact CD2-CB 4.14Å; W229-A321 HydrophobicContact CG-CB 4.02Å; W229-A321 HydrophobicContact CZ2-CB 4.46Å; N317-A321 VanDerWaalsContact O-CB 3.3Å; N317-A321 WeakPolarHBondContact O-CB 3.45Å; N317-A321 PolarHBondContact O-N 3.28Å; K318-A321 PolarHBondContact O-N 3.41Å; A321-E324 PolarHBondContact O-N 3.42Å; A321-S325 PolarHBondContact O-N 2.83Å
322	F	93.2	Very high	87.7	Confident	29 Å²	29	51.7 Å²	51.7	13%	0.127	24%	0.241	C	C	.	.	H	α-helix	trans	-71.6	-34.5	176.5	-178	-119.3	0	0	0	112.9	Y210 I213 L214 F217 K318 E319 V320 S325 Q326	Y210-F322 HydrophobicContact CD2-CZ 4.44Å; Y210-F322 AromaticContact CE2-CE1 3.82Å; Y210-F322 HydrophobicContact CE2-CE1 3.82Å; Y210-F322 AromaticContact CE2-CZ 3.63Å; Y210-F322 HydrophobicContact CE2-CZ 3.63Å; Y210-F322 AromaticContact CZ-CE1 3.89Å; Y210-F322 AromaticContact CZ-CZ 3.7Å; Y210-F322 WeakPolarHBondContact OH-CE1 3.46Å; I213-F322 HydrophobicContact CG2-CE2 4.22Å; L214-F322 HydrophobicContact CB-CE2 4.22Å; L214-F322 HydrophobicContact CB-CZ 4.36Å; L214-F322 HydrophobicContact CD1-CD2 4.48Å; L214-F322 HydrophobicContact CD1-CE2 3.87Å; L214-F322 HydrophobicContact CD1-CZ 4.05Å; F217-F322 HydrophobicContact CB-CD2 4.11Å; F217-F322 HydrophobicContact CB-CE2 4.44Å; F217-F322 HydrophobicContact CD1-CB 4.22Å; F217-F322 AromaticContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CD2 3.56Å; F217-F322 HydrophobicContact CD1-CE2 4.39Å; F217-F322 HydrophobicContact CD1-CG 4.26Å; F217-F322 HydrophobicContact CD2-CD2 4.38Å; F217-F322 HydrophobicContact CE1-CB 3.8Å; F217-F322 HydrophobicContact CE1-CD2 4.04Å; F217-F322 HydrophobicContact CE1-CG 4.29Å; F217-F322 HydrophobicContact CE2-CB 4.34Å; F217-F322 AromaticContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CG-CD2 3.75Å; F217-F322 HydrophobicContact CZ-CB 3.87Å; K318-F322 WeakPolarHBondContact O-CB 2.99Å; K318-F322 PolarHBondContact O-N 2.83Å; E319-F322 PolarHBondContact O-N 3.21Å; V320-F322 VanDerWaalsContact C-N 3.27Å; V320-F322 PolarHBondContact O-N 2.79Å; F322-S325 WeakPolarHBondContact CA-OG 3.42Å; F322-S325 WeakPolarHBondContact CD2-OG 3.34Å; F322-S325 PolarHBondContact O-N 2.61Å; F322-S325 PolarHBondContact O-OG 3.29Å; F322-Q326 HydrophobicContact CE2-CG 4.38Å; F322-Q326 HydrophobicContact CZ-CG 4.25Å; F322-Q326 WeakPolarHBondContact O-CG 3.24Å; F322-Q326 PolarHBondContact O-N 3.11Å; F322-Q326 VanDerWaalsContact O-N 3.16Å; F322-Q326 PolarHBondContact O-NE2 2.74Å; F322-Q326 VanDerWaalsContact O-NE2 3.13Å
323	L	93.8	Very high	89.3	Confident	24 Å²	24	45.7 Å²	45.7	13%	0.126	22%	0.217	C	C	.	.	H	α-helix	trans	-64.2	-44	170.2	-67.9	170.2	0	0	0	110.5	K183 L186 E187 L190 E319 V320 S325 Q326 V327	K183-L323 HydrophobicContact CG-CD1 3.95Å; L186-L323 HydrophobicContact CD2-CB 3.63Å; E187-L323 HydrophobicContact CG-CD1 3.79Å; E187-L323 HydrophobicContact CG-CD2 4.45Å; L190-L323 HydrophobicContact CD1-CD2 3.97Å; E319-L323 WeakPolarHBondContact O-CG 3.29Å; E319-L323 PolarHBondContact O-N 3.06Å; V320-L323 PolarHBondContact O-N 3.15Å; L323-S325 VanDerWaalsContact C-N 3.32Å; L323-S325 PolarHBondContact O-N 2.94Å; L323-Q326 PolarHBondContact O-N 3.39Å; L323-V327 WeakPolarHBondContact O-CG2 3.49Å; L323-V327 PolarHBondContact O-N 3.41Å
324	E	92.2	Very high	90.6	Very high	0 Å²	0	42.4 Å²	42.4	0%	0	20%	0.199	C	C	.	.	H	α-helix	trans	-60.6	-41.1	175.8	-69.8	171.9	-173.2	0	0	111.9	L170 K178 Y182 L186 F226 W229 V320 A321 Q326 V327 Y328	L170-E324 HydrophobicContact CB-CG 4.31Å; L170-E324 HydrophobicContact CD1-CB 4.18Å; L170-E324 HydrophobicContact CD1-CG 4Å; K178-E324 VanDerWaalsContact CD-OE1 3.27Å; K178-E324 WeakPolarHBondContact CD-OE1 3.27Å; K178-E324 WeakPolarHBondContact CE-OE1 3.33Å; K178-E324 IonicContact NZ-OE1 3.75Å; K178-E324 PolarHBondContact NZ-OE1 3.13Å; K178-E324 IonicContact NZ-OE2 2.96Å; K178-E324 PolarHBondContact NZ-OE2 3.2Å; Y182-E324 WeakPolarHBondContact CE1-OE1 3.35Å; L186-E324 HydrophobicContact CD1-CG 3.95Å; L186-E324 HydrophobicContact CD2-CB 4.43Å; L186-E324 HydrophobicContact CD2-CG 3.84Å; F226-E324 HydrophobicContact CZ-CB 4.46Å; W229-E324 PolarHBondContact NE1-OE2 3.41Å; V320-E324 WeakPolarHBondContact O-CG 3.36Å; V320-E324 PolarHBondContact O-N 2.85Å; A321-E324 PolarHBondContact O-N 3.42Å; E324-Q326 VanDerWaalsContact C-N 3.3Å; E324-Q326 PolarHBondContact O-N 3.21Å; E324-V327 PolarHBondContact O-N 2.8Å; E324-Y328 HydrophobicContact CB-CE2 4.3Å; E324-Y328 WeakPolarHBondContact O-CD2 3.45Å; E324-Y328 PolarHBondContact O-N 3.46Å
325	S	93	Very high	91.4	Very high	8 Å²	8	39.5 Å²	39.5	6%	0.056	19%	0.186	C	C	.	.	H	α-helix	trans	-61.6	-40.2	176.9	66.7	0	0	0	0	112.4	A321 F322 L323 Y328 E329	A321-S325 PolarHBondContact O-N 2.83Å; F322-S325 WeakPolarHBondContact CA-OG 3.42Å; F322-S325 WeakPolarHBondContact CD2-OG 3.34Å; F322-S325 PolarHBondContact O-N 2.61Å; F322-S325 PolarHBondContact O-OG 3.29Å; L323-S325 VanDerWaalsContact C-N 3.32Å; L323-S325 PolarHBondContact O-N 2.94Å; S325-Y328 PolarHBondContact O-N 2.81Å; S325-E329 WeakPolarHBondContact O-CG 3.34Å; S325-E329 PolarHBondContact O-N 2.96Å
326	Q	94.2	Very high	92	Very high	9 Å²	9	39.9 Å²	39.9	4%	0.042	19%	0.188	C	C	.	.	H	α-helix	trans	-66	-44.6	176.6	-74.9	171.2	90.1	0	0	111	L190 I213 F322 L323 E324 Y328 E329 Y330	L190-Q326 HydrophobicContact CD1-CB 3.33Å; L190-Q326 HydrophobicContact CD1-CG 4.22Å; L190-Q326 HydrophobicContact CG-CB 4.44Å; I213-Q326 HydrophobicContact CD1-CG 4.46Å; I213-Q326 HydrophobicContact CG2-CG 3.86Å; F322-Q326 HydrophobicContact CE2-CG 4.38Å; F322-Q326 HydrophobicContact CZ-CG 4.25Å; F322-Q326 WeakPolarHBondContact O-CG 3.24Å; F322-Q326 PolarHBondContact O-N 3.11Å; F322-Q326 VanDerWaalsContact O-N 3.16Å; F322-Q326 PolarHBondContact O-NE2 2.74Å; F322-Q326 VanDerWaalsContact O-NE2 3.13Å; L323-Q326 PolarHBondContact O-N 3.39Å; E324-Q326 VanDerWaalsContact C-N 3.3Å; E324-Q326 PolarHBondContact O-N 3.21Å; Q326-Y328 VanDerWaalsContact C-N 3.32Å; Q326-Y328 PolarHBondContact O-N 3.19Å; Q326-E329 PolarHBondContact O-N 3Å; Q326-Y330 HydrophobicContact CB-CD2 4.37Å; Q326-Y330 HydrophobicContact CB-CE2 4.27Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.28Å; Q326-Y330 PolarHBondContact O-N 3.16Å
327	V	94.2	Very high	92.5	Very high	0 Å²	0	35 Å²	35	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-57.9	-44.3	177.4	174.9	0	0	0	0	111.4	L170 L186 L189 L190 L193 L323 E324 E329 Y330 V331	L170-V327 HydrophobicContact CD1-CB 3.91Å; L170-V327 HydrophobicContact CD1-CG1 3.8Å; L170-V327 HydrophobicContact CD1-CG2 4.48Å; L186-V327 HydrophobicContact CD2-CG2 3.76Å; L189-V327 HydrophobicContact CD2-CG1 4.05Å; L190-V327 HydrophobicContact CB-CG2 3.95Å; L190-V327 HydrophobicContact CD1-CG2 4.13Å; L193-V327 HydrophobicContact CD1-CG1 4.05Å; L323-V327 WeakPolarHBondContact O-CG2 3.49Å; L323-V327 PolarHBondContact O-N 3.41Å; E324-V327 PolarHBondContact O-N 2.8Å; V327-E329 VanDerWaalsContact C-N 3.3Å; V327-E329 PolarHBondContact O-N 2.88Å; V327-Y330 PolarHBondContact O-N 3.31Å; V327-V331 HydrophobicContact CG1-CG2 4.04Å; V327-V331 WeakPolarHBondContact O-CB 3.22Å; V327-V331 WeakPolarHBondContact O-CG2 3.24Å; V327-V331 PolarHBondContact O-N 2.89Å
328	Y	92.8	Very high	92.9	Very high	46 Å²	46	37.4 Å²	37.4	18%	0.18	18%	0.177	C	C	.	.	H	α-helix	trans	-57.2	-44.3	177.7	-63.3	-41.9	0	0	0	112.5	D168 L170 F171 F226 E324 S325 Q326 V331 E332	D168-Y328 WeakPolarHBondContact O-CD1 3.46Å; D168-Y328 WeakPolarHBondContact O-CE1 3.4Å; L170-Y328 HydrophobicContact CB-CE1 3.81Å; L170-Y328 WeakPolarHBondContact CB-OH 3.39Å; L170-Y328 HydrophobicContact CD1-CE1 4.09Å; L170-Y328 HydrophobicContact CG-CE1 4.06Å; F171-Y328 HydrophobicContact CD1-CE1 4.29Å; F171-Y328 PolarHBondContact N-OH 3.44Å; F226-Y328 HydrophobicContact CZ-CD2 4.45Å; F226-Y328 HydrophobicContact CZ-CE2 4.1Å; E324-Y328 HydrophobicContact CB-CE2 4.3Å; E324-Y328 WeakPolarHBondContact O-CD2 3.45Å; E324-Y328 PolarHBondContact O-N 3.46Å; S325-Y328 PolarHBondContact O-N 2.81Å; Q326-Y328 VanDerWaalsContact C-N 3.32Å; Q326-Y328 PolarHBondContact O-N 3.19Å; Y328-V331 PolarHBondContact O-N 3.42Å; Y328-E332 WeakPolarHBondContact O-CB 3.29Å; Y328-E332 PolarHBondContact O-N 3.2Å
329	E	93.3	Very high	93.1	Very high	47 Å²	47	38.1 Å²	38.1	22%	0.22	18%	0.182	C	C	.	.	H	α-helix	trans	-71.1	-43.1	-176.5	-63.2	-78.8	167	0	0	111.4	I213 S325 Q326 V327 V331 E332 I333	I213-E329 HydrophobicContact CD1-CB 3.73Å; I213-E329 HydrophobicContact CD1-CG 4.15Å; I213-E329 HydrophobicContact CG1-CB 4.01Å; I213-E329 HydrophobicContact CG1-CG 3.89Å; I213-E329 HydrophobicContact CG2-CG 4.39Å; S325-E329 WeakPolarHBondContact O-CG 3.34Å; S325-E329 PolarHBondContact O-N 2.96Å; Q326-E329 PolarHBondContact O-N 3Å; V327-E329 VanDerWaalsContact C-N 3.3Å; V327-E329 PolarHBondContact O-N 2.88Å; E329-V331 VanDerWaalsContact C-N 3.35Å; E329-V331 PolarHBondContact O-N 3.16Å; E329-E332 PolarHBondContact O-N 2.86Å; E329-I333 VanDerWaalsContact O-CG1 3.31Å; E329-I333 WeakPolarHBondContact O-CG1 3.36Å; E329-I333 PolarHBondContact O-N 3.11Å
330	Y	94.1	Very high	93.3	Very high	2 Å²	2	36.2 Å²	36.2	1%	0.008	18%	0.175	C	C	.	.	H	α-helix	trans	-65.1	-38.8	174.6	-74.6	-69.5	0	0	0	112.2	Q194 T197 Q206 L209 I213 Q326 V327 E332 I333 L334	Q194-Y330 HydrophobicContact CG-CD2 4.06Å; Q194-Y330 HydrophobicContact CG-CE1 3.98Å; Q194-Y330 HydrophobicContact CG-CE2 3.47Å; Q194-Y330 VanDerWaalsContact CG-CE2 3.47Å; Q194-Y330 VanDerWaalsContact CG-CZ 3.42Å; Q194-Y330 PolarHBondContact NE2-OH 2.99Å; T197-Y330 HydrophobicContact CG2-CD1 4.28Å; T197-Y330 HydrophobicContact CG2-CE1 4.42Å; Q206-Y330 PolarHBondContact OE1-OH 2.85Å; L209-Y330 HydrophobicContact CD2-CD1 4.32Å; L209-Y330 HydrophobicContact CD2-CE1 3.67Å; I213-Y330 HydrophobicContact CD1-CE2 4.5Å; Q326-Y330 HydrophobicContact CB-CD2 4.37Å; Q326-Y330 HydrophobicContact CB-CE2 4.27Å; Q326-Y330 WeakPolarHBondContact O-CD2 3.28Å; Q326-Y330 PolarHBondContact O-N 3.16Å; V327-Y330 PolarHBondContact O-N 3.31Å; Y330-E332 VanDerWaalsContact C-N 3.33Å; Y330-I333 PolarHBondContact O-N 3.28Å; Y330-L334 WeakPolarHBondContact O-CB 3.22Å; Y330-L334 WeakPolarHBondContact O-CG 3.32Å; Y330-L334 PolarHBondContact O-N 2.88Å
331	V	93.4	Very high	93.4	Very high	5 Å²	5	36.3 Å²	36.3	3%	0.03	18%	0.175	C	C	.	.	H	α-helix	trans	-66.4	-36.3	175.6	171	0	0	0	0	111.6	F167 D168 L193 V327 Y328 E329 L334 G335	F167-V331 HydrophobicContact CE2-CG2 3.65Å; F167-V331 HydrophobicContact CZ-CG1 4.38Å; F167-V331 HydrophobicContact CZ-CG2 4.13Å; D168-V331 HydrophobicContact CB-CB 4.45Å; D168-V331 HydrophobicContact CB-CG1 3.74Å; D168-V331 HydrophobicContact CB-CG2 4.44Å; L193-V331 HydrophobicContact CD1-CG2 3.82Å; V327-V331 HydrophobicContact CG1-CG2 4.04Å; V327-V331 WeakPolarHBondContact O-CB 3.22Å; V327-V331 WeakPolarHBondContact O-CG2 3.24Å; V327-V331 PolarHBondContact O-N 2.89Å; Y328-V331 PolarHBondContact O-N 3.42Å; E329-V331 VanDerWaalsContact C-N 3.35Å; E329-V331 PolarHBondContact O-N 3.16Å; V331-L334 CarbonylContact O-C 3.59Å; V331-L334 PolarHBondContact O-N 3.46Å; V331-G335 WeakPolarHBondContact O-CA 3.44Å; V331-G335 PolarHBondContact O-N 2.94Å
332	E	93.1	Very high	93.5	Very high	149 Å²	149	38 Å²	38	70%	0.696	18%	0.183	S	C	*	.	H	α-helix	trans	-63.9	-44.3	173.5	-174.6	170.8	172.9	0	0	111.1	Y328 E329 Y330 L334 G335	Y328-E332 WeakPolarHBondContact O-CB 3.29Å; Y328-E332 PolarHBondContact O-N 3.2Å; E329-E332 PolarHBondContact O-N 2.86Å; Y330-E332 VanDerWaalsContact C-N 3.33Å; E332-L334 VanDerWaalsContact C-N 3.27Å; E332-L334 PolarHBondContact O-N 3.02Å; E332-G335 PolarHBondContact O-N 3.01Å
333	I	94.4	Very high	93.5	Very high	40 Å²	40	40.7 Å²	40.7	21%	0.205	20%	0.196	C	C	.	.	H	α-helix	trans	-61.2	-35.7	175.2	-68.8	164.2	0	0	0	111.9	T197 K201 L204 L209 E329 Y330	T197-I333 HydrophobicContact CG2-CG2 4.21Å; K201-I333 HydrophobicContact CD-CG2 3.95Å; K201-I333 PolarHBondContact NZ-O 2.92Å; L204-I333 HydrophobicContact CD2-CD1 4.22Å; L204-I333 HydrophobicContact CD2-CG2 4.28Å; L209-I333 HydrophobicContact CD1-CD1 3.9Å; L209-I333 HydrophobicContact CD2-CD1 3.53Å; L209-I333 HydrophobicContact CG-CD1 4.37Å; E329-I333 VanDerWaalsContact O-CG1 3.31Å; E329-I333 WeakPolarHBondContact O-CG1 3.36Å; E329-I333 PolarHBondContact O-N 3.11Å; Y330-I333 PolarHBondContact O-N 3.28Å
334	L	95.2	Very high	93.4	Very high	2 Å²	2	40 Å²	40	1%	0.01	19%	0.193	C	C	.	.	T	Hydrogen-bonded Turn	trans	-97.8	18.9	-178.8	-63.1	172.9	0	0	0	113.1	L140 L193 Y196 T197 V200 Y330 V331 E332 E336 Q337 R338	L140-L334 HydrophobicContact CD2-CD1 4.17Å; L193-L334 HydrophobicContact CD2-CD1 3.85Å; Y196-L334 HydrophobicContact CD1-CD1 3.95Å; Y196-L334 HydrophobicContact CD1-CD2 3.85Å; Y196-L334 HydrophobicContact CE1-CD2 3.96Å; T197-L334 WeakPolarHBondContact OG1-CD1 3.46Å; V200-L334 HydrophobicContact CG2-CD2 3.72Å; Y330-L334 WeakPolarHBondContact O-CB 3.22Å; Y330-L334 WeakPolarHBondContact O-CG 3.32Å; Y330-L334 PolarHBondContact O-N 2.88Å; V331-L334 CarbonylContact O-C 3.59Å; V331-L334 PolarHBondContact O-N 3.46Å; E332-L334 VanDerWaalsContact C-N 3.27Å; E332-L334 PolarHBondContact O-N 3.02Å; L334-E336 VanDerWaalsContact C-N 3.25Å; L334-E336 PolarHBondContact O-N 3.49Å; L334-Q337 PolarHBondContact O-N 3.22Å; L334-R338 WeakPolarHBondContact O-CB 3.38Å; L334-R338 PolarHBondContact O-N 3.18Å
335	G	93.6	Very high	93.3	Very high	23 Å²	23	41.3 Å²	41.3	24%	0.237	20%	0.2	C	C	.	.	H	α-helix	trans	-59.7	-33	-173.6	0	0	0	0	0	114.2	V331 E332 Q339	V331-G335 WeakPolarHBondContact O-CA 3.44Å; V331-G335 PolarHBondContact O-N 2.94Å; E332-G335 PolarHBondContact O-N 3.01Å; G335-Q339 PolarHBondContact O-N 3.27Å; G335-Q339 VanDerWaalsContact O-N 3.13Å
336	E	92.9	Very high	93.2	Very high	137 Å²	137	46 Å²	46	64%	0.64	22%	0.221	S	C	*	.	H	α-helix	trans	-67.5	-53	175.5	-178.1	176.7	-169.8	0	0	111.5	L334 R338 Q339 L340	L334-E336 VanDerWaalsContact C-N 3.25Å; L334-E336 PolarHBondContact O-N 3.49Å; E336-R338 PolarHBondContact O-N 3.42Å; E336-Q339 PolarHBondContact O-N 2.93Å; E336-Q339 VanDerWaalsContact O-N 3.1Å; E336-L340 HydrophobicContact CG-CD1 4.1Å; E336-L340 WeakPolarHBondContact O-CG 3.49Å; E336-L340 PolarHBondContact O-N 3.15Å
337	Q	94.1	Very high	93	Very high	18 Å²	18	50 Å²	50	8%	0.084	24%	0.236	C	C	.	.	H	α-helix	trans	-58.4	-38.7	177.7	-69.6	74.8	13.5	0	0	111.1	G137 L140 Y196 L334 L340 T341	G137-Q337 WeakPolarHBondContact O-CG 3.17Å; L140-Q337 HydrophobicContact CD1-CB 4.1Å; L140-Q337 HydrophobicContact CG-CB 4.15Å; Y196-Q337 HydrophobicContact CE1-CG 4.22Å; L334-Q337 PolarHBondContact O-N 3.22Å; Q337-L340 PolarHBondContact O-N 3.05Å; Q337-T341 WeakPolarHBondContact O-CB 3.47Å; Q337-T341 PolarHBondContact O-N 3.35Å; Q337-T341 PolarHBondContact O-OG1 3.09Å
338	R	93.1	Very high	92.7	Very high	73 Å²	73	52 Å²	52	28%	0.275	25%	0.245	S	C	.	.	H	α-helix	trans	-59.7	-48.9	174.6	-175.5	-173.9	71.8	-179.2	12.4	112.2	L140 F167 D168 L334 E336 T341 H342	L140-R338 HydrophobicContact CD1-CB 4.15Å; F167-R338 HydrophobicContact CE1-CG 3.88Å; F167-R338 HydrophobicContact CZ-CG 4.05Å; D168-R338 IonicContact OD2-CZ 2.64Å; D168-R338 IonicContact OD2-NH1 3.96Å; D168-R338 PolarHBondContact OD2-NH1 3.3Å; L334-R338 WeakPolarHBondContact O-CB 3.38Å; L334-R338 PolarHBondContact O-N 3.18Å; E336-R338 PolarHBondContact O-N 3.42Å; R338-T341 PolarHBondContact O-N 3.12Å; R338-H342 PolarHBondContact O-N 3.01Å
339	Q	92.6	Very high	92.4	Very high	95 Å²	95	56.8 Å²	56.8	44%	0.444	27%	0.269	S	S	.	.	H	α-helix	trans	-63	-45	179.2	-177.1	59.9	28.3	0	0	111.1	G335 E336 T341 H342 E343	G335-Q339 PolarHBondContact O-N 3.27Å; G335-Q339 VanDerWaalsContact O-N 3.13Å; E336-Q339 PolarHBondContact O-N 2.93Å; E336-Q339 VanDerWaalsContact O-N 3.1Å; Q339-T341 VanDerWaalsContact C-N 3.31Å; Q339-T341 PolarHBondContact O-N 2.98Å; Q339-H342 PolarHBondContact O-N 3.12Å; Q339-E343 PolarHBondContact NE2-OE1 2.98Å; Q339-E343 WeakPolarHBondContact O-CG 3.46Å; Q339-E343 PolarHBondContact O-N 3.28Å
340	L	93.9	Very high	92.2	Very high	50 Å²	50	58.8 Å²	58.8	26%	0.262	29%	0.293	S	S	.	.	H	α-helix	trans	-59.7	-41.3	176.6	-70.2	174.3	0	0	0	112.1	Y139 E336 Q337 E343 N344	Y139-L340 HydrophobicContact CD1-CB 4.05Å; Y139-L340 HydrophobicContact CE1-CB 3.99Å; E336-L340 HydrophobicContact CG-CD1 4.1Å; E336-L340 WeakPolarHBondContact O-CG 3.49Å; E336-L340 PolarHBondContact O-N 3.15Å; Q337-L340 PolarHBondContact O-N 3.05Å; L340-E343 PolarHBondContact O-N 3.17Å; L340-N344 VanDerWaalsContact O-CB 3.28Å; L340-N344 WeakPolarHBondContact O-CB 3.11Å; L340-N344 PolarHBondContact O-N 3.3Å
341	T	93.9	Very high	91.9	Very high	5 Å²	5	62 Å²	62	3%	0.031	31%	0.305	C	S	.	.	H	α-helix	trans	-64.2	-45.3	177.1	-54.6	0	0	0	0	111.1	Y139 L140 L164 Q337 R338 Q339 E343 N344 V345	Y139-T341 WeakPolarHBondContact CA-OG1 3.49Å; L140-T341 HydrophobicContact CB-CG2 4.42Å; L140-T341 PolarHBondContact N-OG1 2.96Å; L140-T341 VanDerWaalsContact O-CG2 3.28Å; L140-T341 WeakPolarHBondContact O-CG2 3.42Å; L164-T341 HydrophobicContact CD1-CG2 4.29Å; Q337-T341 WeakPolarHBondContact O-CB 3.47Å; Q337-T341 PolarHBondContact O-N 3.35Å; Q337-T341 PolarHBondContact O-OG1 3.09Å; R338-T341 PolarHBondContact O-N 3.12Å; Q339-T341 VanDerWaalsContact C-N 3.31Å; Q339-T341 PolarHBondContact O-N 2.98Å; T341-E343 PolarHBondContact O-N 3.34Å; T341-N344 PolarHBondContact O-N 3.23Å; T341-V345 HydrophobicContact CG2-CG2 4.5Å; T341-V345 VanDerWaalsContact O-CG2 3.3Å; T341-V345 WeakPolarHBondContact O-CG2 3.45Å; T341-V345 PolarHBondContact O-N 3Å
342	H	92.9	Very high	91.6	Very high	36 Å²	36	65.4 Å²	65.4	17%	0.167	33%	0.326	C	S	.	.	H	α-helix	trans	-60.6	-45.9	177.7	-176.1	-74.2	0	0	0	111.7	S165 R338 Q339 V345 Q346	S165-H342 PolarHBondContact OG-NE2 2.94Å; S165-H342 VanDerWaalsContact OG-NE2 3.11Å; R338-H342 PolarHBondContact O-N 3.01Å; Q339-H342 PolarHBondContact O-N 3.12Å; H342-V345 PolarHBondContact O-N 3.15Å; H342-Q346 WeakPolarHBondContact O-CB 3.44Å; H342-Q346 PolarHBondContact O-N 3.02Å
343	E	92.3	Very high	91.3	Very high	86 Å²	86	60.3 Å²	60.3	40%	0.402	31%	0.314	S	S	.	.	H	α-helix	trans	-63.6	-40.5	176.4	-72	175.5	-167.6	0	0	112.3	Q339 L340 T341 Q346 R347	Q339-E343 PolarHBondContact NE2-OE1 2.98Å; Q339-E343 WeakPolarHBondContact O-CG 3.46Å; Q339-E343 PolarHBondContact O-N 3.28Å; L340-E343 PolarHBondContact O-N 3.17Å; T341-E343 PolarHBondContact O-N 3.34Å; E343-Q346 PolarHBondContact O-N 3.12Å; E343-R347 WeakPolarHBondContact O-CB 3.34Å; E343-R347 PolarHBondContact O-N 3.34Å
344	N	91.6	Very high	90.8	Very high	10 Å²	10	65.6 Å²	65.6	5%	0.053	34%	0.337	C	S	.	.	H	α-helix	trans	-61.4	-48.3	177	-167.8	52.2	0	0	0	111.6	Y139 L340 T341 Q346 R347 K348	Y139-N344 HydrophobicContact CD1-CB 4.04Å; Y139-N344 HydrophobicContact CE1-CB 3.68Å; Y139-N344 HydrophobicContact CE2-CB 4.49Å; L340-N344 VanDerWaalsContact O-CB 3.28Å; L340-N344 WeakPolarHBondContact O-CB 3.11Å; L340-N344 PolarHBondContact O-N 3.3Å; T341-N344 PolarHBondContact O-N 3.23Å; N344-Q346 PolarHBondContact O-N 3.37Å; N344-R347 WeakPolarHBondContact O-CB 3.25Å; N344-R347 PolarHBondContact O-N 3.44Å; N344-R347 PolarHBondContact OD1-NH1 3.4Å; N344-K348 WeakPolarHBondContact O-CB 2.97Å; N344-K348 PolarHBondContact O-N 2.9Å
345	V	91.4	Very high	90.3	Very high	26 Å²	26	69.7 Å²	69.7	16%	0.158	36%	0.357	C	S	.	.	H	α-helix	trans	-63.1	-42.7	178.3	170.5	0	0	0	0	111.2	Y160 I161 L164 T341 H342 R347 K348 Q349	Y160-V345 HydrophobicContact CD1-CG1 3.8Å; Y160-V345 HydrophobicContact CD1-CG2 4.2Å; Y160-V345 HydrophobicContact CE1-CG1 4.18Å; Y160-V345 HydrophobicContact CE1-CG2 3.71Å; I161-V345 HydrophobicContact CB-CG1 4.5Å; L164-V345 HydrophobicContact CD1-CB 4.1Å; L164-V345 HydrophobicContact CD1-CG1 4.26Å; L164-V345 HydrophobicContact CD1-CG2 3.79Å; T341-V345 HydrophobicContact CG2-CG2 4.5Å; T341-V345 VanDerWaalsContact O-CG2 3.3Å; T341-V345 WeakPolarHBondContact O-CG2 3.45Å; T341-V345 PolarHBondContact O-N 3Å; H342-V345 PolarHBondContact O-N 3.15Å; V345-R347 VanDerWaalsContact C-N 3.32Å; V345-R347 PolarHBondContact O-N 3.38Å; V345-K348 PolarHBondContact O-N 2.96Å; V345-Q349 VanDerWaalsContact O-CB 3.27Å; V345-Q349 WeakPolarHBondContact O-CB 3.18Å; V345-Q349 PolarHBondContact O-N 3.49Å
346	Q	91.1	Very high	89.8	Confident	107 Å²	107	72.1 Å²	72.1	50%	0.5	36%	0.359	S	S	.	.	H	α-helix	trans	-62.3	-40.5	176.5	-171.2	175.1	-1.1	0	0	111.9	I161 H342 E343 N344 A350	I161-Q346 HydrophobicContact CD1-CB 3.87Å; I161-Q346 HydrophobicContact CD1-CG 4.06Å; H342-Q346 WeakPolarHBondContact O-CB 3.44Å; H342-Q346 PolarHBondContact O-N 3.02Å; E343-Q346 PolarHBondContact O-N 3.12Å; N344-Q346 PolarHBondContact O-N 3.37Å; Q346-A350 PolarHBondContact O-N 3.43Å; Q346-A350 VanDerWaalsContact O-N 3.17Å
347	R	89.4	Confident	89.3	Confident	92 Å²	92	71.8 Å²	71.8	35%	0.347	36%	0.357	S	S	.	.	H	α-helix	trans	-64.5	-50	175.5	-158.7	-166.5	-43.2	111.7	11.1	111.1	E343 N344 V345 Q349 A350 R351 E359	E343-R347 WeakPolarHBondContact O-CB 3.34Å; E343-R347 PolarHBondContact O-N 3.34Å; N344-R347 WeakPolarHBondContact O-CB 3.25Å; N344-R347 PolarHBondContact O-N 3.44Å; N344-R347 PolarHBondContact OD1-NH1 3.4Å; V345-R347 VanDerWaalsContact C-N 3.32Å; V345-R347 PolarHBondContact O-N 3.38Å; R347-Q349 PolarHBondContact O-N 2.9Å; R347-A350 PolarHBondContact O-N 3.2Å; R347-A350 VanDerWaalsContact O-N 3.11Å; R347-R351 WeakPolarHBondContact O-CG 3.4Å; R347-R351 PolarHBondContact O-N 3.29Å; R347-E359 IonicContact NH1-OE1 3.36Å; R347-E359 PolarHBondContact NH1-OE1 3.22Å
348	K	87.9	Confident	88.8	Confident	43 Å²	43	77.1 Å²	77.1	19%	0.187	38%	0.382	C	S	.	.	H	α-helix	trans	-61.4	-32.4	179.2	-165.2	172.3	-175.4	175.6	0	112.1	E133 N344 V345 R356 E360	E133-K348 IonicContact OE1-NZ 3.5Å; N344-K348 WeakPolarHBondContact O-CB 2.97Å; N344-K348 PolarHBondContact O-N 2.9Å; V345-K348 PolarHBondContact O-N 2.96Å; K348-R356 HydrophobicContact CG-CG 4.15Å; K348-R356 PolarHBondContact O-NE 3.28Å; K348-R356 PolarHBondContact O-NH2 2.99Å; K348-E360 WeakPolarHBondContact CE-OE1 3.42Å; K348-E360 IonicContact NZ-OE1 3.95Å; K348-E360 PolarHBondContact NZ-OE1 3.42Å
349	Q	86.7	Confident	88.2	Confident	147 Å²	147	74.2 Å²	74.2	69%	0.687	37%	0.372	S	S	*	.	H	α-helix	trans	-73.6	-32.2	176.4	-169.7	64.9	33.2	0	0	113.2	V345 R347	V345-Q349 VanDerWaalsContact O-CB 3.27Å; V345-Q349 WeakPolarHBondContact O-CB 3.18Å; V345-Q349 PolarHBondContact O-N 3.49Å; R347-Q349 PolarHBondContact O-N 2.9Å
350	A	87.7	Confident	87.4	Confident	88 Å²	88	73.4 Å²	73.4	73%	0.727	37%	0.368	S	S	*	.	H	α-helix	trans	-79.8	-17.7	-178.9	0	0	0	0	0	113.8	Q346 R347	Q346-A350 PolarHBondContact O-N 3.43Å; Q346-A350 VanDerWaalsContact O-N 3.17Å; R347-A350 PolarHBondContact O-N 3.2Å; R347-A350 VanDerWaalsContact O-N 3.11Å
351	R	87.9	Confident	86.6	Confident	70 Å²	70	77.8 Å²	77.8	26%	0.264	39%	0.387	S	S	.	.	S	Bend	trans	-76.6	151.4	-177.4	-74.4	174.7	-174.3	-128.3	11.6	113.8	R347 E355 R356 E359	R347-R351 WeakPolarHBondContact O-CG 3.4Å; R347-R351 PolarHBondContact O-N 3.29Å; R351-E355 HydrophobicContact CB-CB 4Å; R351-E355 HydrophobicContact CG-CB 4.14Å; R351-E355 PolarHBondContact NH1-O 3.14Å; R351-R356 PolarHBondContact O-NH2 3.25Å; R351-R356 VanDerWaalsContact O-NH2 3.14Å; R351-E359 VanDerWaalsContact CD-OE2 3.22Å; R351-E359 WeakPolarHBondContact CD-OE2 3.46Å; R351-E359 IonicContact CZ-OE1 2.78Å; R351-E359 VanDerWaalsContact CZ-OE1 3.32Å; R351-E359 IonicContact CZ-OE2 3.26Å; R351-E359 IonicContact NE-OE1 2.71Å; R351-E359 IonicContact NE-OE2 2.76Å; R351-E359 PolarHBondContact NE-OE2 3.35Å; R351-E359 IonicContact NH1-OE2 2.96Å; R351-E359 PolarHBondContact NH1-OE2 3.24Å; R351-E359 IonicContact NH2-OE1 3.91Å; R351-E359 PolarHBondContact NH2-OE1 2.88Å; R351-E359 IonicContact NH2-OE2 2.7Å; R351-E359 PolarHBondContact NH2-OE2 3.44Å
352	T	88.5	Confident	85.5	Confident	76 Å²	76	83.5 Å²	83.5	47%	0.466	41%	0.413	S	S	.	.			trans	-71.4	175.4	168.7	64.1	0	0	0	0	111.4	E355 R356	T352-E355 WeakPolarHBondContact CB-OE2 3.33Å; T352-E355 PolarHBondContact N-OE2 3.27Å; T352-E355 VanDerWaalsContact OG1-CG 3.27Å; T352-E355 WeakPolarHBondContact OG1-CG 3.48Å; T352-E355 PolarHBondContact OG1-OE2 3.32Å; T352-R356 PolarHBondContact O-N 3.42Å
353	G	86.3	Confident	84.3	Confident	43 Å²	43	84 Å²	84	44%	0.443	42%	0.416	S	S	.	.	H	α-helix	trans	-62.2	-50.6	-178.9	0	0	0	0	0	112.7	R356 E357	G353-R356 WeakPolarHBondContact O-CB 3.27Å; G353-R356 PolarHBondContact O-N 2.87Å; G353-E357 PolarHBondContact O-N 3.44Å
354	E	83.2	Confident	82.8	Confident	150 Å²	150	84.5 Å²	84.5	70%	0.701	42%	0.421	S	S	*	.	H	α-helix	trans	-62.6	-45.9	-179.5	-65	172.3	175.9	0	0	111.3	R356 E357 E358	E354-R356 PolarHBondContact O-N 3.49Å; E354-R356 VanDerWaalsContact O-N 3.16Å; E354-E357 PolarHBondContact O-N 3.41Å; E354-E358 WeakPolarHBondContact O-CG 3.12Å; E354-E358 PolarHBondContact O-N 3.35Å
355	E	85.8	Confident	81.2	Confident	88 Å²	88	86.7 Å²	86.7	41%	0.411	44%	0.436	S	S	.	.	H	α-helix	trans	-64.3	-19.8	177.7	-68.2	167.8	157.3	0	0	114.2	R351 T352	R351-E355 HydrophobicContact CB-CB 4Å; R351-E355 HydrophobicContact CG-CB 4.14Å; R351-E355 PolarHBondContact NH1-O 3.14Å; T352-E355 WeakPolarHBondContact CB-OE2 3.33Å; T352-E355 PolarHBondContact N-OE2 3.27Å; T352-E355 VanDerWaalsContact OG1-CG 3.27Å; T352-E355 WeakPolarHBondContact OG1-CG 3.48Å; T352-E355 PolarHBondContact OG1-OE2 3.32Å
356	R	83.1	Confident	79.4	Confident	75 Å²	75	90.1 Å²	90.1	28%	0.283	45%	0.451	S	S	.	.	H	α-helix	trans	-83.8	-41.5	175.6	-176	-179.7	-62.8	108.7	9.3	111.1	K348 R351 T352 G353 E354 E358 E359 E360	K348-R356 HydrophobicContact CG-CG 4.15Å; K348-R356 PolarHBondContact O-NE 3.28Å; K348-R356 PolarHBondContact O-NH2 2.99Å; R351-R356 PolarHBondContact O-NH2 3.25Å; R351-R356 VanDerWaalsContact O-NH2 3.14Å; T352-R356 PolarHBondContact O-N 3.42Å; G353-R356 WeakPolarHBondContact O-CB 3.27Å; G353-R356 PolarHBondContact O-N 2.87Å; E354-R356 PolarHBondContact O-N 3.49Å; E354-R356 VanDerWaalsContact O-N 3.16Å; R356-E358 VanDerWaalsContact C-N 3.34Å; R356-E359 PolarHBondContact O-N 2.94Å; R356-E360 PolarHBondContact O-N 3.05Å
357	E	82.7	Confident	77.4	Confident	129 Å²	129	87.8 Å²	87.8	60%	0.603	45%	0.446	S	S	*	.	H	α-helix	trans	-63.1	-42.7	175.8	-69.7	173.8	-172.7	0	0	110.5	G353 E354 E359 E360 E361	G353-E357 PolarHBondContact O-N 3.44Å; E354-E357 PolarHBondContact O-N 3.41Å; E357-E359 PolarHBondContact O-N 3.05Å; E357-E360 PolarHBondContact O-N 3.49Å; E357-E361 PolarHBondContact O-N 3.24Å
358	E	83	Confident	75.2	Confident	130 Å²	130	91.1 Å²	91.1	61%	0.607	47%	0.466	S	S	*	.	H	α-helix	trans	-62.1	-39	175.3	-70.9	178.7	174.9	0	0	112.9	E354 R356 E362	E354-E358 WeakPolarHBondContact O-CG 3.12Å; E354-E358 PolarHBondContact O-N 3.35Å; R356-E358 VanDerWaalsContact C-N 3.34Å; E358-E362 WeakPolarHBondContact O-CB 3.38Å; E358-E362 PolarHBondContact O-N 3.42Å
359	E	79.6	Confident	72.9	Confident	13 Å²	13	92.6 Å²	92.6	6%	0.061	48%	0.482	C	S	.	.	H	α-helix	trans	-71.6	-35.1	177.7	-165.3	175.1	-152.5	0	0	112.5	R347 R351 R356 E357 E362 Q363	R347-E359 IonicContact NH1-OE1 3.36Å; R347-E359 PolarHBondContact NH1-OE1 3.22Å; R351-E359 VanDerWaalsContact CD-OE2 3.22Å; R351-E359 WeakPolarHBondContact CD-OE2 3.46Å; R351-E359 IonicContact CZ-OE1 2.78Å; R351-E359 VanDerWaalsContact CZ-OE1 3.32Å; R351-E359 IonicContact CZ-OE2 3.26Å; R351-E359 IonicContact NE-OE1 2.71Å; R351-E359 IonicContact NE-OE2 2.76Å; R351-E359 PolarHBondContact NE-OE2 3.35Å; R351-E359 IonicContact NH1-OE2 2.96Å; R351-E359 PolarHBondContact NH1-OE2 3.24Å; R351-E359 IonicContact NH2-OE1 3.91Å; R351-E359 PolarHBondContact NH2-OE1 2.88Å; R351-E359 IonicContact NH2-OE2 2.7Å; R351-E359 PolarHBondContact NH2-OE2 3.44Å; R356-E359 PolarHBondContact O-N 2.94Å; E357-E359 PolarHBondContact O-N 3.05Å; E359-E362 PolarHBondContact O-N 3.33Å; E359-Q363 WeakPolarHBondContact O-CB 3.3Å; E359-Q363 VanDerWaalsContact O-CG 3.31Å; E359-Q363 WeakPolarHBondContact O-CG 3.39Å; E359-Q363 PolarHBondContact O-N 3.21Å
360	E	77.1	Confident	70.8	Confident	77 Å²	77	89.9 Å²	89.9	36%	0.36	47%	0.469	S	S	.	.	H	α-helix	trans	-65.8	-43.9	174	-78	177.4	177.6	0	0	110.5	K348 R356 E357 Q363 L364	K348-E360 WeakPolarHBondContact CE-OE1 3.42Å; K348-E360 IonicContact NZ-OE1 3.95Å; K348-E360 PolarHBondContact NZ-OE1 3.42Å; R356-E360 PolarHBondContact O-N 3.05Å; E357-E360 PolarHBondContact O-N 3.49Å; E360-Q363 PolarHBondContact O-N 2.94Å; E360-L364 WeakPolarHBondContact O-CB 3.38Å; E360-L364 WeakPolarHBondContact O-CD1 3.29Å; E360-L364 PolarHBondContact O-N 3.31Å
361	E	76.3	Confident	68.5	Low	143 Å²	143	92 Å²	92	67%	0.668	47%	0.468	S	S	*	.	H	α-helix	trans	-63.2	-40.1	173.1	-75.9	-171.2	171.8	0	0	112.3	E357 L364 S365	E357-E361 PolarHBondContact O-N 3.24Å; E361-L364 PolarHBondContact O-N 2.83Å; E361-S365 WeakPolarHBondContact O-CB 3.43Å; E361-S365 PolarHBondContact O-N 2.72Å; E361-S365 PolarHBondContact O-OG 2.89Å
362	E	71.3	Confident	66.5	Low	124 Å²	124	94.7 Å²	94.7	58%	0.579	48%	0.484	S	S	*	.	H	α-helix	trans	-65.1	-44.1	177.9	-165.6	172.4	-158	0	0	111.2	E358 E359 L364 S365 E366	E358-E362 WeakPolarHBondContact O-CB 3.38Å; E358-E362 PolarHBondContact O-N 3.42Å; E359-E362 PolarHBondContact O-N 3.33Å; E362-L364 PolarHBondContact O-N 3.47Å; E362-S365 WeakPolarHBondContact CA-OG 3.34Å; E362-S365 CarbonylContact O-C 3.58Å; E362-S365 PolarHBondContact O-N 2.92Å; E362-S365 VanDerWaalsContact O-N 3.15Å; E362-S365 PolarHBondContact O-OG 3.05Å; E362-E366 WeakPolarHBondContact O-CB 3.45Å; E362-E366 PolarHBondContact O-N 3.46Å
363	Q	66.9	Low	64.3	Low	48 Å²	48	98 Å²	98	22%	0.224	50%	0.499	C	S	.	.	H	α-helix	trans	-64	-39.7	176.1	-76.4	177.1	-0.9	0	0	113	E359 E360 S365 S367	E359-Q363 WeakPolarHBondContact O-CB 3.3Å; E359-Q363 VanDerWaalsContact O-CG 3.31Å; E359-Q363 WeakPolarHBondContact O-CG 3.39Å; E359-Q363 PolarHBondContact O-N 3.21Å; E360-Q363 PolarHBondContact O-N 2.94Å; Q363-S365 VanDerWaalsContact C-N 3.34Å; Q363-S367 WeakPolarHBondContact O-CB 3.47Å; Q363-S367 PolarHBondContact O-N 3.24Å; Q363-S367 VanDerWaalsContact O-N 3.1Å; Q363-S367 PolarHBondContact O-OG 3.46Å
364	L	61.9	Low	62.1	Low	96 Å²	96	103.5 Å²	103.5	50%	0.503	52%	0.517	S	S	.	.	H	α-helix	trans	-64.2	-39.1	172	-87.6	149.1	0	0	0	111.4	E360 E361 E362 S367 E368	E360-L364 WeakPolarHBondContact O-CB 3.38Å; E360-L364 WeakPolarHBondContact O-CD1 3.29Å; E360-L364 PolarHBondContact O-N 3.31Å; E361-L364 PolarHBondContact O-N 2.83Å; E362-L364 PolarHBondContact O-N 3.47Å; L364-S367 WeakPolarHBondContact CA-OG 3.27Å; L364-S367 PolarHBondContact O-OG 3.31Å; L364-E368 PolarHBondContact O-N 2.92Å
365	S	57.7	Low	60.3	Low	55 Å²	55	104 Å²	104	39%	0.385	52%	0.52	S	S	.	.	H	α-helix	trans	-73.7	-37.6	178.2	75.6	0	0	0	0	113.3	E361 E362 Q363 S367 E368 S369	E361-S365 WeakPolarHBondContact O-CB 3.43Å; E361-S365 PolarHBondContact O-N 2.72Å; E361-S365 PolarHBondContact O-OG 2.89Å; E362-S365 WeakPolarHBondContact CA-OG 3.34Å; E362-S365 CarbonylContact O-C 3.58Å; E362-S365 PolarHBondContact O-N 2.92Å; E362-S365 VanDerWaalsContact O-N 3.15Å; E362-S365 PolarHBondContact O-OG 3.05Å; Q363-S365 VanDerWaalsContact C-N 3.34Å; S365-S367 VanDerWaalsContact C-N 3.3Å; S365-S367 PolarHBondContact O-N 2.92Å; S365-E368 CarbonylContact O-C 3.4Å; S365-E368 PolarHBondContact O-N 2.9Å; S365-S369 WeakPolarHBondContact O-CA 3.24Å; S365-S369 WeakPolarHBondContact O-CB 3.29Å; S365-S369 PolarHBondContact O-N 2.97Å; S365-S369 PolarHBondContact O-OG 3.31Å
366	E	52.6	Low	58.5	Low	99 Å²	99	107.6 Å²	107.6	46%	0.463	54%	0.54	S	S	.	.	H	α-helix	trans	-69.1	-32.5	178.3	-162.2	175	-155.1	0	0	110.4	E362 E370	E362-E366 WeakPolarHBondContact O-CB 3.45Å; E362-E366 PolarHBondContact O-N 3.46Å; E366-E370 HydrophobicContact CG-CG 4.04Å; E366-E370 WeakPolarHBondContact CG-OE1 3.37Å; E366-E370 WeakPolarHBondContact O-CG 3.47Å
367	S	50.3	Low	57	Low	57 Å²	57	108.2 Å²	108.2	40%	0.399	55%	0.548	S	S	.	.	H	α-helix	trans	-71	-28.4	171.9	53.6	0	0	0	0	113.8	R34 Q363 L364 S365	R34-S367 PolarHBondContact NH1-O 2.95Å; Q363-S367 WeakPolarHBondContact O-CB 3.47Å; Q363-S367 PolarHBondContact O-N 3.24Å; Q363-S367 VanDerWaalsContact O-N 3.1Å; Q363-S367 PolarHBondContact O-OG 3.46Å; L364-S367 WeakPolarHBondContact CA-OG 3.27Å; L364-S367 PolarHBondContact O-OG 3.31Å; S365-S367 VanDerWaalsContact C-N 3.3Å; S365-S367 PolarHBondContact O-N 2.92Å
368	E	43.3	Very low	55.6	Low	163 Å²	163	111.7 Å²	111.7	76%	0.762	56%	0.557	S	S	*	*	H	α-helix	trans	-98.3	-16.2	178.6	-68.3	-155.7	162.4	0	0	115.5	L364 S365	L364-E368 PolarHBondContact O-N 2.92Å; S365-E368 CarbonylContact O-C 3.4Å; S365-E368 PolarHBondContact O-N 2.9Å
369	S	39.1	Very low	54.7	Low	74 Å²	74	107.3 Å²	107.3	52%	0.517	54%	0.538	S	S	.	.			trans	-145.9	42.1	-167.5	65.5	0	0	0	0	115.8	S365 D371	S365-S369 WeakPolarHBondContact O-CA 3.24Å; S365-S369 WeakPolarHBondContact O-CB 3.29Å; S365-S369 PolarHBondContact O-N 2.97Å; S365-S369 PolarHBondContact O-OG 3.31Å; S369-D371 PolarHBondContact O-N 3.21Å
370	E	42.5	Very low	53.9	Low	90 Å²	90	110.9 Å²	110.9	42%	0.421	56%	0.562	S	S	.	*			trans	-78.3	46.8	159.2	-79.4	-176.2	172.5	0	0	111.6	E366 E372	E366-E370 HydrophobicContact CG-CG 4.04Å; E366-E370 WeakPolarHBondContact CG-OE1 3.37Å; E366-E370 WeakPolarHBondContact O-CG 3.47Å; E370-E372 PolarHBondContact O-N 3.45Å
371	D	38.5	Very low	53.2	Low	131 Å²	131	114.1 Å²	114.1	70%	0.701	58%	0.575	S	S	*	*			trans	-71.9	110.7	162.9	-85.2	-30.2	0	0	0	107.7	S369 D373	S369-D371 PolarHBondContact O-N 3.21Å; D371-D373 PolarHBondContact O-N 2.91Å
372	E	46.9	Very low	52.7	Low	128 Å²	128	113.1 Å²	113.1	60%	0.598	57%	0.574	S	S	*	*			trans	-64.5	61.4	171	-72.5	-176.3	164	0	0	111.6	T31 E370 N374	T31-E372 PolarHBondContact OG1-OE1 3.29Å; T31-E372 VanDerWaalsContact OG1-OE1 3.13Å; E370-E372 PolarHBondContact O-N 3.45Å; E372-N374 VanDerWaalsContact C-N 3.33Å
373	D	42.1	Very low	52.9	Low	146 Å²	146	108 Å²	108	78%	0.781	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-97.9	27.2	177.3	-105.1	2.6	0	0	0	112.7	D371	D371-D373 PolarHBondContact O-N 2.91Å
374	N	40.5	Very low	53	Low	157 Å²	157	107.7 Å²	107.7	84%	0.84	55%	0.553	S	S	*	*	T	Hydrogen-bonded Turn	trans	-125.6	21.8	173.6	-79	-50.1	0	0	0	114.3	E372 I376	E372-N374 VanDerWaalsContact C-N 3.33Å; N374-I376 PolarHBondContact O-N 3.33Å; N374-I376 VanDerWaalsContact O-N 3.16Å
375	E	45	Very low	53.8	Low	160 Å²	160	107.8 Å²	107.8	75%	0.748	55%	0.554	S	S	*	*			trans	-72.9	103.8	155.9	-74	-154.3	154.3	0	0	108.6	I377	E375-I377 VanDerWaalsContact C-N 3.27Å; E375-I377 PolarHBondContact O-N 3.5Å
376	I	47.8	Very low	54.4	Low	164 Å²	164	106.2 Å²	106.2	84%	0.841	55%	0.546	S	S	*	.			trans	-59.5	94.1	169	-60.8	171.9	0	0	0	107.6	N374 Y378	N374-I376 PolarHBondContact O-N 3.33Å; N374-I376 VanDerWaalsContact O-N 3.16Å; I376-Y378 PolarHBondContact O-N 3.46Å
377	I	51	Low	55	Low	88 Å²	88	113.7 Å²	113.7	45%	0.451	57%	0.57	S	S	.	*			trans	-57.6	114.1	179.6	-59.4	177.1	0	0	0	107.9	E375 N379 G389 P391	E375-I377 VanDerWaalsContact C-N 3.27Å; E375-I377 PolarHBondContact O-N 3.5Å; I377-N379 PolarHBondContact O-N 3.06Å; I377-G389 WeakPolarHBondContact CD1-O 3.33Å; I377-P391 HydrophobicContact CG2-CG 4.17Å
378	Y	53.9	Low	55.6	Low	202 Å²	202	115 Å²	115	79%	0.792	57%	0.573	S	S	*	*			trans	-63.6	92.2	-178.2	-175.6	-107.6	0	0	0	110.5	I376 P380	I376-Y378 PolarHBondContact O-N 3.46Å; Y378-P380 HydrophobicContact CD1-CG 3.94Å; Y378-P380 HydrophobicContact CE1-CB 4.19Å; Y378-P380 HydrophobicContact CE1-CG 3.52Å; Y378-P380 HydrophobicContact CE2-CB 4.49Å; Y378-P380 WeakPolarHBondContact O-CD 3.38Å
379	N	64.3	Low	56.6	Low	38 Å²	38	108.9 Å²	108.9	20%	0.203	55%	0.553	C	S	.	*			trans	-112.8	66.1	179.2	-170.4	5.5	0	0	0	111.7	I377 K381 N382 L383 P391	I377-N379 PolarHBondContact O-N 3.06Å; N379-K381 PolarHBondContact O-N 3.31Å; N379-N382 PolarHBondContact O-N 3.32Å; N379-N382 WeakPolarHBondContact OD1-CA 3.49Å; N379-N382 PolarHBondContact OD1-N 3.25Å; N379-N382 VanDerWaalsContact OD1-N 3.12Å; N379-L383 PolarHBondContact ND2-N 3.24Å; N379-L383 PolarHBondContact ND2-O 2.84Å; N379-L383 PolarHBondContact OD1-N 3Å; N379-P391 HydrophobicContact CB-CG 3.9Å
380	P	62.4	Low	58.5	Low	88 Å²	88	111.7 Å²	111.7	57%	0.571	56%	0.556	S	S	*	*	T	Hydrogen-bonded Turn	trans	-64.9	-13.3	-175.1	29.1	-38.6	0	0	0	113.8	Y378	Y378-P380 HydrophobicContact CD1-CG 3.94Å; Y378-P380 HydrophobicContact CE1-CB 4.19Å; Y378-P380 HydrophobicContact CE1-CG 3.52Å; Y378-P380 HydrophobicContact CE2-CB 4.49Å; Y378-P380 WeakPolarHBondContact O-CD 3.38Å
381	K	63.6	Low	60.2	Low	146 Å²	146	109.3 Å²	109.3	64%	0.635	55%	0.548	S	S	*	.	T	Hydrogen-bonded Turn	trans	-105	4.1	177.9	-68	-175.4	179.9	176.1	0	113.5	N379 L383	N379-K381 PolarHBondContact O-N 3.31Å; K381-L383 HydrophobicContact CB-CD1 4.03Å; K381-L383 HydrophobicContact CB-CG 3.95Å; K381-L383 PolarHBondContact O-N 3.18Å; K381-L383 VanDerWaalsContact O-N 3.12Å
382	N	64.4	Low	62.1	Low	121 Å²	121	104.2 Å²	104.2	65%	0.647	52%	0.521	S	S	*	.			trans	44.7	43.7	-179.1	-149.3	1.9	0	0	0	112.7	N379	N379-N382 PolarHBondContact O-N 3.32Å; N379-N382 WeakPolarHBondContact OD1-CA 3.49Å; N379-N382 PolarHBondContact OD1-N 3.25Å; N379-N382 VanDerWaalsContact OD1-N 3.12Å
383	L	75.6	Confident	63.8	Low	18 Å²	18	101.2 Å²	101.2	9%	0.094	51%	0.512	C	S	.	.	P	Polyproline II helix	trans	-73.5	144.1	179.1	-72.9	163.2	0	0	0	108.9	N379 K381 L385 P391 Y394 Y397	N379-L383 PolarHBondContact ND2-N 3.24Å; N379-L383 PolarHBondContact ND2-O 2.84Å; N379-L383 PolarHBondContact OD1-N 3Å; K381-L383 HydrophobicContact CB-CD1 4.03Å; K381-L383 HydrophobicContact CB-CG 3.95Å; K381-L383 PolarHBondContact O-N 3.18Å; K381-L383 VanDerWaalsContact O-N 3.12Å; L383-L385 PolarHBondContact O-N 3.26Å; L383-P391 HydrophobicContact CB-CB 4.1Å; L383-Y394 HydrophobicContact CD2-CD2 4.33Å; L383-Y397 HydrophobicContact CD2-CD1 3.53Å; L383-Y397 HydrophobicContact CD2-CD2 3.86Å; L383-Y397 HydrophobicContact CD2-CE1 3.82Å; L383-Y397 HydrophobicContact CD2-CE2 4.16Å; L383-Y397 HydrophobicContact CD2-CG 3.54Å
384	P	70	Confident	65.4	Low	40 Å²	40	99.7 Å²	99.7	26%	0.26	50%	0.496	S	S	.	.	P	Polyproline II helix	trans	-54.5	139.8	174.1	-21.3	31.5	0	0	0	110.8	I392 Y397	P384-I392 HydrophobicContact CB-CD1 4.06Å; P384-I392 HydrophobicContact CG-CD1 4.15Å; P384-I392 WeakPolarHBondContact O-CG1 3.4Å; P384-I392 WeakPolarHBondContact O-CG2 3.44Å; P384-I392 PolarHBondContact O-N 3.06Å; P384-Y397 HydrophobicContact CG-CD2 4.28Å; P384-Y397 HydrophobicContact CG-CE2 4.08Å
385	L	77.4	Confident	67.4	Low	99 Å²	99	100.3 Å²	100.3	52%	0.518	49%	0.487	S	S	.	.	B	Isolated β-bridge	trans	-76.7	142	176	-56.6	178.3	0	0	0	109.6	L383 G389 K390 P391	L383-L385 PolarHBondContact O-N 3.26Å; L385-G389 WeakPolarHBondContact CD2-O 3.49Å; L385-K390 CarbonylContact C-O 3.51Å; L385-K390 WeakPolarHBondContact CA-O 3.26Å; L385-P391 HydrophobicContact CD2-CB 4.39Å; L385-P391 HydrophobicContact CD2-CG 3.98Å
386	G	70.7	Confident	69.1	Low	22 Å²	22	95 Å²	95	23%	0.227	46%	0.463	C	S	.	.			trans	-74.3	-176.7	172.1	0	0	0	0	0	111.6	D388 G389 K390	G386-D388 VanDerWaalsContact CA-OD1 3.26Å; G386-D388 WeakPolarHBondContact CA-OD1 3.39Å; G386-D388 PolarHBondContact O-N 2.98Å; G386-G389 PolarHBondContact O-N 3.11Å; G386-K390 PolarHBondContact N-O 2.99Å
387	W	66.1	Low	70.5	Confident	256 Å²	256	88.4 Å²	88.4	97%	0.97	43%	0.428	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.6	-10.8	170.8	62.5	-85.3	0	0	0	112.5
388	D	62	Low	71.8	Confident	85 Å²	85	89.6 Å²	89.6	46%	0.455	43%	0.43	S	S	.	.	T	Hydrogen-bonded Turn	trans	-94.3	7.2	177.1	63.3	-19.2	0	0	0	113.1	G386 K390	G386-D388 VanDerWaalsContact CA-OD1 3.26Å; G386-D388 WeakPolarHBondContact CA-OD1 3.39Å; G386-D388 PolarHBondContact O-N 2.98Å; D388-K390 PolarHBondContact O-N 3.24Å; D388-K390 PolarHBondContact OD1-N 3.06Å
389	G	65.5	Low	73.1	Confident	33 Å²	33	85.8 Å²	85.8	34%	0.34	42%	0.423	S	S	.	.	S	Bend	trans	69.4	-4.2	-178.3	0	0	0	0	0	114.7	I377 L385 G386	I377-G389 WeakPolarHBondContact CD1-O 3.33Å; L385-G389 WeakPolarHBondContact CD2-O 3.49Å; G386-G389 PolarHBondContact O-N 3.11Å
390	K	78.4	Confident	73.8	Confident	134 Å²	134	89.6 Å²	89.6	58%	0.583	44%	0.439	S	S	*	.	S	Bend	trans	-96.3	151.5	-178.6	-67.7	174.9	-177.9	173	0	111.2	L385 G386 D388 I392	L385-K390 CarbonylContact C-O 3.51Å; L385-K390 WeakPolarHBondContact CA-O 3.26Å; G386-K390 PolarHBondContact N-O 2.99Å; D388-K390 PolarHBondContact O-N 3.24Å; D388-K390 PolarHBondContact OD1-N 3.06Å; K390-I392 PolarHBondContact O-N 3.45Å
391	P	78.1	Confident	74.7	Confident	39 Å²	39	85.9 Å²	85.9	25%	0.253	42%	0.417	S	S	.	.	B	Isolated β-bridge	trans	-60.5	126.2	176.5	-21.2	32.3	0	0	0	110.8	I377 N379 L383 L385	I377-P391 HydrophobicContact CG2-CG 4.17Å; N379-P391 HydrophobicContact CB-CG 3.9Å; L383-P391 HydrophobicContact CB-CB 4.1Å; L385-P391 HydrophobicContact CD2-CB 4.39Å; L385-P391 HydrophobicContact CD2-CG 3.98Å
392	I	78.6	Confident	75.5	Confident	25 Å²	25	81 Å²	81	13%	0.128	40%	0.397	C	S	.	.	P	Polyproline II helix	trans	-59.1	143.4	-177.7	62.3	-175.5	0	0	0	111.5	P384 K390 Y394 Y397 L402	P384-I392 HydrophobicContact CB-CD1 4.06Å; P384-I392 HydrophobicContact CG-CD1 4.15Å; P384-I392 WeakPolarHBondContact O-CG1 3.4Å; P384-I392 WeakPolarHBondContact O-CG2 3.44Å; P384-I392 PolarHBondContact O-N 3.06Å; K390-I392 PolarHBondContact O-N 3.45Å; I392-Y394 PolarHBondContact O-N 3.48Å; I392-Y397 HydrophobicContact CD1-CD2 4.1Å; I392-L402 HydrophobicContact CD1-CD1 3.57Å
393	P	81.6	Confident	76.1	Confident	65 Å²	65	78.6 Å²	78.6	42%	0.422	39%	0.385	S	S	.	.	P	Polyproline II helix	trans	-53.6	137.3	178.2	-28.4	35.1	0	0	0	113	W395 L396 Y397	P393-W395 VanDerWaalsContact C-N 3.27Å; P393-W395 PolarHBondContact O-N 3.28Å; P393-L396 HydrophobicContact CB-CB 4.32Å; P393-L396 WeakPolarHBondContact O-CA 3.44Å; P393-L396 WeakPolarHBondContact O-CB 3.38Å; P393-L396 PolarHBondContact O-N 3.41Å; P393-Y397 PolarHBondContact O-N 3.12Å
394	Y	76.7	Confident	76.4	Confident	114 Å²	114	81.4 Å²	81.4	45%	0.447	40%	0.399	S	S	.	.	H	α-helix	trans	-59.8	-32.8	-173.8	-175.5	-108.4	0	0	0	114.2	L383 I392 L396 Y397 K398	L383-Y394 HydrophobicContact CD2-CD2 4.33Å; I392-Y394 PolarHBondContact O-N 3.48Å; Y394-L396 VanDerWaalsContact C-N 3.35Å; Y394-Y397 HydrophobicContact CD2-CD1 4.31Å; Y394-Y397 HydrophobicContact CE2-CD1 4.35Å; Y394-Y397 WeakPolarHBondContact O-CB 3.1Å; Y394-K398 HydrophobicContact CE1-CD 4.15Å; Y394-K398 VanDerWaalsContact CE1-CE 3.5Å; Y394-K398 HydrophobicContact CE1-CG 4.41Å; Y394-K398 VanDerWaalsContact CZ-CE 3.44Å; Y394-K398 PolarHBondContact O-N 2.94Å; Y394-K398 VanDerWaalsContact O-N 3.09Å; Y394-K398 WeakPolarHBondContact OH-CE 3.42Å
395	W	81.6	Confident	77.2	Confident	170 Å²	170	84 Å²	84	64%	0.644	41%	0.411	S	S	*	.	H	α-helix	trans	-68.6	-35.8	175.7	66.2	-94.4	0	0	0	111.6	P393 K398 L399	P393-W395 VanDerWaalsContact C-N 3.27Å; P393-W395 PolarHBondContact O-N 3.28Å; W395-K398 PolarHBondContact O-N 3.22Å; W395-L399 HydrophobicContact CE3-CD2 4.39Å; W395-L399 HydrophobicContact CZ3-CD2 3.97Å; W395-L399 VanDerWaalsContact O-CB 3.29Å; W395-L399 WeakPolarHBondContact O-CB 3.4Å; W395-L399 PolarHBondContact O-N 2.91Å
396	L	80.4	Confident	77.7	Confident	47 Å²	47	83.3 Å²	83.3	25%	0.246	40%	0.402	C	S	.	.	H	α-helix	trans	-71.5	-39.2	178	-171.9	64.5	0	0	0	110.7	P393 Y394 K398 L399 H400	P393-L396 HydrophobicContact CB-CB 4.32Å; P393-L396 WeakPolarHBondContact O-CA 3.44Å; P393-L396 WeakPolarHBondContact O-CB 3.38Å; P393-L396 PolarHBondContact O-N 3.41Å; Y394-L396 VanDerWaalsContact C-N 3.35Å; L396-K398 VanDerWaalsContact C-N 3.32Å; L396-K398 PolarHBondContact O-N 2.8Å; L396-L399 HydrophobicContact CD1-CD2 4.37Å; L396-L399 PolarHBondContact O-N 3.02Å; L396-H400 VanDerWaalsContact CD1-CD2 3.43Å; L396-H400 WeakPolarHBondContact CD1-CD2 3.45Å; L396-H400 WeakPolarHBondContact CD1-NE2 3.45Å; L396-H400 PolarHBondContact O-N 3.38Å
397	Y	77.8	Confident	78.7	Confident	27 Å²	27	86.1 Å²	86.1	11%	0.106	41%	0.411	C	S	.	.	H	α-helix	trans	-56.8	-43	170.4	179.5	-112.1	0	0	0	112.2	L383 P384 I392 P393 Y394 G401 L402 N403	L383-Y397 HydrophobicContact CD2-CD1 3.53Å; L383-Y397 HydrophobicContact CD2-CD2 3.86Å; L383-Y397 HydrophobicContact CD2-CE1 3.82Å; L383-Y397 HydrophobicContact CD2-CE2 4.16Å; L383-Y397 HydrophobicContact CD2-CG 3.54Å; P384-Y397 HydrophobicContact CG-CD2 4.28Å; P384-Y397 HydrophobicContact CG-CE2 4.08Å; I392-Y397 HydrophobicContact CD1-CD2 4.1Å; P393-Y397 PolarHBondContact O-N 3.12Å; Y394-Y397 HydrophobicContact CD2-CD1 4.31Å; Y394-Y397 HydrophobicContact CE2-CD1 4.35Å; Y394-Y397 WeakPolarHBondContact O-CB 3.1Å; Y397-G401 PolarHBondContact O-N 2.77Å; Y397-L402 HydrophobicContact CD2-CB 3.29Å; Y397-L402 HydrophobicContact CD2-CD1 4.1Å; Y397-L402 HydrophobicContact CD2-CG 4.34Å; Y397-L402 VanDerWaalsContact CE2-C 3.43Å; Y397-L402 HydrophobicContact CE2-CB 3.4Å; Y397-L402 WeakPolarHBondContact CE2-O 3.27Å; Y397-L402 HydrophobicContact CG-CB 4.21Å; Y397-L402 PolarHBondContact O-N 2.93Å; Y397-L402 PolarHBondContact OH-O 3.33Å; Y397-N403 HydrophobicContact CD1-CB 3.92Å; Y397-N403 HydrophobicContact CE1-CB 3.37Å; Y397-N403 VanDerWaalsContact CZ-CA 3.48Å; Y397-N403 WeakPolarHBondContact OH-CA 3.35Å
398	K	78.5	Confident	80	Confident	112 Å²	112	73.9 Å²	73.9	49%	0.487	37%	0.365	S	S	.	.	H	α-helix	trans	-72.6	-40.2	174.1	-76.8	-157	177.3	-177.2	0	113.5	Y394 W395 L396 H400 G401	Y394-K398 HydrophobicContact CE1-CD 4.15Å; Y394-K398 VanDerWaalsContact CE1-CE 3.5Å; Y394-K398 HydrophobicContact CE1-CG 4.41Å; Y394-K398 VanDerWaalsContact CZ-CE 3.44Å; Y394-K398 PolarHBondContact O-N 2.94Å; Y394-K398 VanDerWaalsContact O-N 3.09Å; Y394-K398 WeakPolarHBondContact OH-CE 3.42Å; W395-K398 PolarHBondContact O-N 3.22Å; L396-K398 VanDerWaalsContact C-N 3.32Å; L396-K398 PolarHBondContact O-N 2.8Å; K398-H400 VanDerWaalsContact C-N 3.35Å; K398-H400 PolarHBondContact O-N 3.14Å; K398-G401 PolarHBondContact O-N 2.92Å; K398-G401 VanDerWaalsContact O-N 3.11Å
399	L	81.7	Confident	81.5	Confident	123 Å²	123	73.9 Å²	73.9	64%	0.644	36%	0.363	S	S	*	.	H	α-helix	trans	-61.6	-43.4	-178.4	-178.4	67.3	0	0	0	111.5	W395 L396 G401	W395-L399 HydrophobicContact CE3-CD2 4.39Å; W395-L399 HydrophobicContact CZ3-CD2 3.97Å; W395-L399 VanDerWaalsContact O-CB 3.29Å; W395-L399 WeakPolarHBondContact O-CB 3.4Å; W395-L399 PolarHBondContact O-N 2.91Å; L396-L399 HydrophobicContact CD1-CD2 4.37Å; L396-L399 PolarHBondContact O-N 3.02Å; L399-G401 PolarHBondContact O-N 3.48Å
400	H	78.8	Confident	82.7	Confident	117 Å²	117	73 Å²	73	54%	0.542	35%	0.35	S	S	.	.	T	Hydrogen-bonded Turn	trans	-83.3	3.4	177.3	-71.2	-58.9	0	0	0	114	L396 K398 L402	L396-H400 VanDerWaalsContact CD1-CD2 3.43Å; L396-H400 WeakPolarHBondContact CD1-CD2 3.45Å; L396-H400 WeakPolarHBondContact CD1-NE2 3.45Å; L396-H400 PolarHBondContact O-N 3.38Å; K398-H400 VanDerWaalsContact C-N 3.35Å; K398-H400 PolarHBondContact O-N 3.14Å; H400-L402 HydrophobicContact CB-CD1 4.3Å; H400-L402 HydrophobicContact CB-CG 4.16Å; H400-L402 PolarHBondContact O-N 2.93Å
401	G	81.2	Confident	83.3	Confident	10 Å²	10	67.3 Å²	67.3	10%	0.103	33%	0.327	C	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	20	177.8	0	0	0	0	0	114.1	Y397 K398 L399 N403 I404 G418	Y397-G401 PolarHBondContact O-N 2.77Å; K398-G401 PolarHBondContact O-N 2.92Å; K398-G401 VanDerWaalsContact O-N 3.11Å; L399-G401 PolarHBondContact O-N 3.48Å; G401-N403 PolarHBondContact O-N 3.28Å; G401-I404 WeakPolarHBondContact O-CB 3.49Å; G401-I404 PolarHBondContact O-N 2.92Å; G401-G418 WeakPolarHBondContact O-CA 3.4Å
402	L	80.3	Confident	83.8	Confident	44 Å²	44	68.8 Å²	68.8	23%	0.23	35%	0.349	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.3	-15.3	-179.8	-69	168.4	0	0	0	112.4	I392 Y397 H400 I404	I392-L402 HydrophobicContact CD1-CD1 3.57Å; Y397-L402 HydrophobicContact CD2-CB 3.29Å; Y397-L402 HydrophobicContact CD2-CD1 4.1Å; Y397-L402 HydrophobicContact CD2-CG 4.34Å; Y397-L402 VanDerWaalsContact CE2-C 3.43Å; Y397-L402 HydrophobicContact CE2-CB 3.4Å; Y397-L402 WeakPolarHBondContact CE2-O 3.27Å; Y397-L402 HydrophobicContact CG-CB 4.21Å; Y397-L402 PolarHBondContact O-N 2.93Å; Y397-L402 PolarHBondContact OH-O 3.33Å; H400-L402 HydrophobicContact CB-CD1 4.3Å; H400-L402 HydrophobicContact CB-CG 4.16Å; H400-L402 PolarHBondContact O-N 2.93Å; L402-I404 PolarHBondContact O-N 3.45Å
403	N	77.2	Confident	84.3	Confident	71 Å²	71	72.6 Å²	72.6	38%	0.38	37%	0.369	S	S	.	.	T	Hydrogen-bonded Turn	trans	-76.4	-5.3	171.9	68.8	-59.8	0	0	0	114.4	Y397 G401	Y397-N403 HydrophobicContact CD1-CB 3.92Å; Y397-N403 HydrophobicContact CE1-CB 3.37Å; Y397-N403 VanDerWaalsContact CZ-CA 3.48Å; Y397-N403 WeakPolarHBondContact OH-CA 3.35Å; G401-N403 PolarHBondContact O-N 3.28Å
404	I	82.1	Confident	84.7	Confident	77 Å²	77	74.9 Å²	74.9	40%	0.395	37%	0.37	S	S	.	.	S	Bend	trans	-104.6	119.6	-179.6	-53.4	174.8	0	0	0	108	G401 L402 Y406 G418	G401-I404 WeakPolarHBondContact O-CB 3.49Å; G401-I404 PolarHBondContact O-N 2.92Å; L402-I404 PolarHBondContact O-N 3.45Å; I404-Y406 HydrophobicContact CB-CE2 4.07Å; I404-Y406 HydrophobicContact CG2-CD2 4.23Å; I404-Y406 HydrophobicContact CG2-CE2 3.54Å; I404-G418 WeakPolarHBondContact O-CA 3.49Å; I404-G418 PolarHBondContact O-N 2.84Å
405	N	85.8	Confident	85.3	Confident	95 Å²	95	72.4 Å²	72.4	51%	0.508	37%	0.368	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	131	179	-70	-20	0	0	0	109.9	T415	N405-T415 HydrophobicContact CB-CG2 3.67Å
406	Y	89.4	Confident	85.6	Confident	83 Å²	83	65.2 Å²	65.2	33%	0.325	34%	0.34	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-117.6	133.5	172.9	-67.6	-91	0	0	0	109.4	I404 T415 Y416 P419 F422	I404-Y406 HydrophobicContact CB-CE2 4.07Å; I404-Y406 HydrophobicContact CG2-CD2 4.23Å; I404-Y406 HydrophobicContact CG2-CE2 3.54Å; Y406-T415 CarbonylContact O-C 3.54Å; Y406-T415 WeakPolarHBondContact O-CA 3.43Å; Y406-Y416 PolarHBondContact N-O 2.93Å; Y406-Y416 PolarHBondContact O-N 3.45Å; Y406-P419 HydrophobicContact CE2-CB 4.3Å; Y406-P419 HydrophobicContact CE2-CG 3.89Å; Y406-F422 HydrophobicContact CD1-CD1 4.15Å; Y406-F422 HydrophobicContact CD1-CE1 4.29Å; Y406-F422 HydrophobicContact CD1-CG 4.44Å; Y406-F422 HydrophobicContact CD2-CB 4.26Å; Y406-F422 HydrophobicContact CD2-CG 4.49Å; Y406-F422 HydrophobicContact CG-CB 4.2Å; Y406-F422 HydrophobicContact CG-CD1 4.12Å; Y406-F422 HydrophobicContact CG-CD2 4.27Å; Y406-F422 AromaticContact CG-CG 3.94Å; Y406-F422 HydrophobicContact CG-CG 3.94Å
407	N	90.8	Very high	85.9	Confident	81 Å²	81	68.1 Å²	68.1	43%	0.433	35%	0.348	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-105.8	141.7	179.2	-61.7	-25.9	0	0	0	110.5	T415	N407-T415 WeakPolarHBondContact OD1-CA 3.44Å; N407-T415 WeakPolarHBondContact OD1-CB 3.46Å; N407-T415 WeakPolarHBondContact OD1-CG2 3.47Å; N407-T415 PolarHBondContact OD1-OG1 3.47Å
408	C	93.2	Very high	86.4	Confident	0 Å²	0	67 Å²	67	0%	0	34%	0.344	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.9	114	173.3	-175.8	0	0	0	0	110.1	C411 N413 Y414 Y416 F422 H425	C408-C411 HydrophobicContact CB-CB 4.09Å; C408-C411 PolarHBondContact O-N 3.49Å; C408-C411 VanDerWaalsContact SG-SG 3.68Å; C408-N413 WeakPolarHBondContact O-CA 3.17Å; C408-N413 PolarHBondContact O-N 3.5Å; C408-Y414 PolarHBondContact N-O 2.95Å; C408-Y414 PolarHBondContact O-N 3.01Å; C408-Y416 HydrophobicContact CB-CD2 4.42Å; C408-Y416 HydrophobicContact CB-CE2 4.04Å; C408-F422 HydrophobicContact CB-CE2 4.09Å; C408-H425 PolarHBondContact SG-NE2 2.98Å
409	E	93.6	Very high	86.8	Confident	85 Å²	85	63.8 Å²	63.8	40%	0.397	34%	0.335	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.4	-41	-177.1	-164.1	-172.1	165.6	0	0	111.5	C411 G412 N413 T450 Q451 I452	E409-C411 PolarHBondContact O-N 3.43Å; E409-C411 VanDerWaalsContact O-N 3.12Å; E409-G412 PolarHBondContact O-N 2.84Å; E409-N413 PolarHBondContact O-N 3.46Å; E409-T450 VanDerWaalsContact CB-O 3.26Å; E409-T450 WeakPolarHBondContact CB-O 3.09Å; E409-T450 PolarHBondContact N-O 3.26Å; E409-T450 VanDerWaalsContact N-O 3.15Å; E409-Q451 WeakPolarHBondContact OE2-CA 3.47Å; E409-I452 HydrophobicContact CG-CD1 4.14Å; E409-I452 HydrophobicContact CG-CG1 4.23Å
410	I	90.7	Very high	87.1	Confident	13 Å²	13	66.2 Å²	66.2	7%	0.067	34%	0.34	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.6	-27.7	176.2	-63.3	161.3	0	0	0	112.1	G412 M435 L438 V449 T450 I452 A455	I410-G412 VanDerWaalsContact C-N 3.33Å; I410-M435 HydrophobicContact CD1-SD 4.01Å; I410-M435 HydrophobicContact CG2-CG 4.14Å; I410-M435 HydrophobicContact CG2-SD 4.03Å; I410-L438 HydrophobicContact CG1-CD1 4.29Å; I410-L438 HydrophobicContact CG2-CD1 4.2Å; I410-V449 WeakPolarHBondContact CD1-O 3.47Å; I410-T450 WeakPolarHBondContact CG1-O 3.37Å; I410-T450 PolarHBondContact N-O 3.22Å; I410-I452 HydrophobicContact CG1-CG1 3.9Å; I410-A455 HydrophobicContact CD1-CB 4.2Å
411	C	91	Very high	87.5	Confident	16 Å²	16	62.1 Å²	62.1	11%	0.108	33%	0.326	C	S	.	.	T	Hydrogen-bonded Turn	trans	-89.9	15.8	176.6	-68	0	0	0	0	113.9	C408 E409 R430 H431	C408-C411 HydrophobicContact CB-CB 4.09Å; C408-C411 PolarHBondContact O-N 3.49Å; C408-C411 VanDerWaalsContact SG-SG 3.68Å; E409-C411 PolarHBondContact O-N 3.43Å; E409-C411 VanDerWaalsContact O-N 3.12Å; C411-R430 HydrophobicContact CB-CG 4.39Å; C411-H431 PolarHBondContact SG-ND1 3.43Å; C411-H431 VanDerWaalsContact SG-ND1 3.45Å
412	G	88.2	Confident	88	Confident	69 Å²	69	62.9 Å²	62.9	71%	0.711	33%	0.327	S	S	*	.	T	Hydrogen-bonded Turn	trans	79.1	37.1	-175	0	0	0	0	0	113.1	E409 I410 Y414	E409-G412 PolarHBondContact O-N 2.84Å; I410-G412 VanDerWaalsContact C-N 3.33Å; G412-Y414 PolarHBondContact O-N 3.31Å
413	N	89.9	Confident	88.4	Confident	105 Å²	105	67.1 Å²	67.1	56%	0.561	35%	0.345	S	S	*	.	S	Bend	trans	56.5	33.8	-176.2	-154.9	20.2	0	0	0	113.8	C408 E409	C408-N413 WeakPolarHBondContact O-CA 3.17Å; C408-N413 PolarHBondContact O-N 3.5Å; E409-N413 PolarHBondContact O-N 3.46Å
414	Y	89.6	Confident	89	Confident	113 Å²	113	71.7 Å²	71.7	44%	0.443	36%	0.358	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-71.2	136.6	179.8	-171.4	-102.6	0	0	0	111	C408 G412 Y416 R430	C408-Y414 PolarHBondContact N-O 2.95Å; C408-Y414 PolarHBondContact O-N 3.01Å; G412-Y414 PolarHBondContact O-N 3.31Å; Y414-Y416 HydrophobicContact CD1-CD1 4.23Å; Y414-Y416 HydrophobicContact CD1-CD2 4.03Å; Y414-Y416 AromaticContact CD1-CE1 3.85Å; Y414-Y416 HydrophobicContact CD1-CE1 3.85Å; Y414-Y416 AromaticContact CD1-CE2 3.64Å; Y414-Y416 HydrophobicContact CD1-CE2 3.64Å; Y414-Y416 HydrophobicContact CD1-CG 4.32Å; Y414-Y416 AromaticContact CD1-CZ 3.53Å; Y414-Y416 HydrophobicContact CE1-CD1 4.15Å; Y414-Y416 AromaticContact CE1-CE1 3.87Å; Y414-Y416 HydrophobicContact CE1-CE1 3.87Å; Y414-Y416 HydrophobicContact CE1-CE2 4.46Å; Y414-R430 VanDerWaalsContact CG-NH1 3.31Å
415	T	89.8	Confident	89.6	Confident	63 Å²	63	68 Å²	68	39%	0.387	34%	0.339	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.5	124.1	-179.1	-56.9	0	0	0	0	111.4	N405 Y406 N407	N405-T415 HydrophobicContact CB-CG2 3.67Å; Y406-T415 CarbonylContact O-C 3.54Å; Y406-T415 WeakPolarHBondContact O-CA 3.43Å; N407-T415 WeakPolarHBondContact OD1-CA 3.44Å; N407-T415 WeakPolarHBondContact OD1-CB 3.46Å; N407-T415 WeakPolarHBondContact OD1-CG2 3.47Å; N407-T415 PolarHBondContact OD1-OG1 3.47Å
416	Y	88.4	Confident	89.8	Confident	19 Å²	19	64.4 Å²	64.4	8%	0.075	32%	0.319	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.6	135.3	173.1	-66.4	-86.3	0	0	0	110.3	Y406 C408 Y414 F422 H425	Y406-Y416 PolarHBondContact N-O 2.93Å; Y406-Y416 PolarHBondContact O-N 3.45Å; C408-Y416 HydrophobicContact CB-CD2 4.42Å; C408-Y416 HydrophobicContact CB-CE2 4.04Å; Y414-Y416 HydrophobicContact CD1-CD1 4.23Å; Y414-Y416 HydrophobicContact CD1-CD2 4.03Å; Y414-Y416 AromaticContact CD1-CE1 3.85Å; Y414-Y416 HydrophobicContact CD1-CE1 3.85Å; Y414-Y416 AromaticContact CD1-CE2 3.64Å; Y414-Y416 HydrophobicContact CD1-CE2 3.64Å; Y414-Y416 HydrophobicContact CD1-CG 4.32Å; Y414-Y416 AromaticContact CD1-CZ 3.53Å; Y414-Y416 HydrophobicContact CE1-CD1 4.15Å; Y414-Y416 AromaticContact CE1-CE1 3.87Å; Y414-Y416 HydrophobicContact CE1-CE1 3.87Å; Y414-Y416 HydrophobicContact CE1-CE2 4.46Å; Y416-F422 AromaticContact CD2-CD2 3.81Å; Y416-F422 HydrophobicContact CD2-CD2 3.81Å; Y416-F422 HydrophobicContact CD2-CE2 4.21Å; Y416-F422 HydrophobicContact CG-CD2 4.1Å; Y416-H425 HydrophobicContact CD1-CB 3.99Å; Y416-H425 HydrophobicContact CE1-CB 3.37Å; Y416-H425 AromaticContact CE1-CG 3.93Å; Y416-H425 HydrophobicContact CE2-CB 4Å; Y416-H425 AromaticContact CE2-CD2 3.45Å; Y416-H425 VanDerWaalsContact CE2-CD2 3.45Å; Y416-H425 WeakPolarHBondContact CE2-CD2 3.39Å; Y416-H425 AromaticContact CE2-CG 3.59Å; Y416-H425 AromaticContact CE2-NE2 3.98Å; Y416-H425 AromaticContact CZ-CD2 3.54Å; Y416-H425 AromaticContact CZ-CG 3.49Å; Y416-H425 VanDerWaalsContact CZ-CG 3.49Å; Y416-H425 PolarHBondContact OH-CD2 3.27Å
417	R	86.7	Confident	89.8	Confident	108 Å²	108	64.8 Å²	64.8	41%	0.408	34%	0.338	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-90.4	110.2	176.8	-78	178.4	157.5	-170.4	-7.1	110.3	A421	R417-A421 WeakPolarHBondContact O-CB 3.48Å
418	G	88	Confident	89.9	Confident	2 Å²	2	63.9 Å²	63.9	2%	0.021	33%	0.332	C	S	.	.	S	Bend	trans	88.2	155.1	172.6	0	0	0	0	0	116	G401 I404 K420 A421 F422	G401-G418 WeakPolarHBondContact O-CA 3.4Å; I404-G418 WeakPolarHBondContact O-CA 3.49Å; I404-G418 PolarHBondContact O-N 2.84Å; G418-K420 PolarHBondContact O-N 3.07Å; G418-A421 PolarHBondContact O-N 2.92Å; G418-F422 WeakPolarHBondContact O-CB 3.49Å; G418-F422 PolarHBondContact O-N 3.03Å; G418-F422 VanDerWaalsContact O-N 3.12Å
419	P	86.9	Confident	89.7	Confident	45 Å²	45	72.8 Å²	72.8	29%	0.292	37%	0.365	S	S	.	.	H	α-helix	trans	-65.1	-36.7	-170.9	-20.9	31.5	0	0	0	113.7	Y406 F422 Q423	Y406-P419 HydrophobicContact CE2-CB 4.3Å; Y406-P419 HydrophobicContact CE2-CG 3.89Å; P419-F422 CarbonylContact O-C 3.57Å; P419-F422 PolarHBondContact O-N 3.39Å; P419-Q423 WeakPolarHBondContact O-CG 3.36Å; P419-Q423 PolarHBondContact O-N 3.29Å
420	K	86.9	Confident	89.6	Confident	175 Å²	175	74.3 Å²	74.3	76%	0.761	37%	0.368	S	S	*	.	H	α-helix	trans	-68.7	-43.2	-177.3	-171.6	178.6	-179.8	-179	0	112	G418 F422 Q423 R424	G418-K420 PolarHBondContact O-N 3.07Å; K420-F422 VanDerWaalsContact C-N 3.29Å; K420-Q423 PolarHBondContact O-N 3.5Å; K420-R424 PolarHBondContact O-N 3.26Å; K420-R424 VanDerWaalsContact O-N 3.09Å
421	A	87.5	Confident	89.6	Confident	30 Å²	30	73.7 Å²	73.7	25%	0.248	37%	0.365	C	S	.	.	H	α-helix	trans	-63.2	-41.4	174	0	0	0	0	0	110.4	R417 G418 Q423 R424 H425	R417-A421 WeakPolarHBondContact O-CB 3.48Å; G418-A421 PolarHBondContact O-N 2.92Å; A421-Q423 VanDerWaalsContact C-N 3.32Å; A421-Q423 PolarHBondContact O-N 3.31Å; A421-R424 PolarHBondContact O-N 3.12Å; A421-H425 PolarHBondContact O-N 3.39Å
422	F	91.3	Very high	89.6	Confident	26 Å²	26	74.2 Å²	74.2	11%	0.114	37%	0.37	C	S	.	.	H	α-helix	trans	-67.6	-24.6	175.1	-168.4	-107.5	0	0	0	114.1	Y406 C408 Y416 G418 P419 K420 H425 F426 T450	Y406-F422 HydrophobicContact CD1-CD1 4.15Å; Y406-F422 HydrophobicContact CD1-CE1 4.29Å; Y406-F422 HydrophobicContact CD1-CG 4.44Å; Y406-F422 HydrophobicContact CD2-CB 4.26Å; Y406-F422 HydrophobicContact CD2-CG 4.49Å; Y406-F422 HydrophobicContact CG-CB 4.2Å; Y406-F422 HydrophobicContact CG-CD1 4.12Å; Y406-F422 HydrophobicContact CG-CD2 4.27Å; Y406-F422 AromaticContact CG-CG 3.94Å; Y406-F422 HydrophobicContact CG-CG 3.94Å; C408-F422 HydrophobicContact CB-CE2 4.09Å; Y416-F422 AromaticContact CD2-CD2 3.81Å; Y416-F422 HydrophobicContact CD2-CD2 3.81Å; Y416-F422 HydrophobicContact CD2-CE2 4.21Å; Y416-F422 HydrophobicContact CG-CD2 4.1Å; G418-F422 WeakPolarHBondContact O-CB 3.49Å; G418-F422 PolarHBondContact O-N 3.03Å; G418-F422 VanDerWaalsContact O-N 3.12Å; P419-F422 CarbonylContact O-C 3.57Å; P419-F422 PolarHBondContact O-N 3.39Å; K420-F422 VanDerWaalsContact C-N 3.29Å; F422-H425 AromaticContact CD2-CE1 3.49Å; F422-H425 VanDerWaalsContact CD2-CE1 3.49Å; F422-H425 WeakPolarHBondContact CD2-CE1 3.37Å; F422-H425 AromaticContact CD2-ND1 3.6Å; F422-H425 AromaticContact CE2-CE1 3.41Å; F422-H425 VanDerWaalsContact CE2-CE1 3.41Å; F422-H425 WeakPolarHBondContact CE2-CE1 3.26Å; F422-H425 AromaticContact CG-ND1 3.98Å; F422-H425 AromaticContact CZ-CE1 3.87Å; F422-H425 PolarHBondContact O-CE1 3.06Å; F422-H425 PolarHBondContact O-ND1 3.29Å; F422-F426 HydrophobicContact CD1-CE2 4.36Å; F422-F426 HydrophobicContact CE1-CE2 4.19Å; F422-F426 HydrophobicContact CE1-CZ 4.16Å; F422-F426 HydrophobicContact CZ-CZ 4.36Å; F422-F426 WeakPolarHBondContact O-CD2 3.45Å; F422-F426 WeakPolarHBondContact O-CE2 3.32Å; F422-T450 HydrophobicContact CE1-CG2 4.07Å; F422-T450 HydrophobicContact CE2-CG2 4.45Å; F422-T450 HydrophobicContact CZ-CG2 3.45Å; F422-T450 VanDerWaalsContact CZ-CG2 3.45Å
423	Q	90.3	Very high	89.7	Confident	133 Å²	133	74.7 Å²	74.7	62%	0.621	35%	0.353	S	S	*	.	H	α-helix	trans	-79.2	-36.9	171.9	-76.2	176.5	-7.5	0	0	111.6	P419 K420 A421 H425	P419-Q423 WeakPolarHBondContact O-CG 3.36Å; P419-Q423 PolarHBondContact O-N 3.29Å; K420-Q423 PolarHBondContact O-N 3.5Å; A421-Q423 VanDerWaalsContact C-N 3.32Å; A421-Q423 PolarHBondContact O-N 3.31Å; Q423-H425 VanDerWaalsContact C-N 3.32Å; Q423-H425 PolarHBondContact O-N 3.49Å
424	R	89.8	Confident	89.8	Confident	168 Å²	168	70.3 Å²	70.3	63%	0.634	33%	0.333	S	S	*	.	H	α-helix	trans	-66.7	-34.1	179.6	-167.6	173.4	66.1	-164.1	-2.7	112.4	K420 A421 F426 A427 E428	K420-R424 PolarHBondContact O-N 3.26Å; K420-R424 VanDerWaalsContact O-N 3.09Å; A421-R424 PolarHBondContact O-N 3.12Å; R424-F426 PolarHBondContact O-N 2.92Å; R424-F426 VanDerWaalsContact O-N 3.11Å; R424-A427 PolarHBondContact O-N 3.49Å; R424-E428 IonicContact NE-OE1 3.61Å; R424-E428 PolarHBondContact NE-OE1 3.46Å; R424-E428 IonicContact NH2-OE1 2.65Å
425	H	93.3	Very high	89.9	Confident	0 Å²	0	65 Å²	65	0%	0	31%	0.312	C	S	.	.	G	3₁₀ helix	trans	-60.6	-25.1	-175	94.1	-78.9	0	0	0	114.7	C408 Y416 A421 F422 Q423 A427 E428 H431	C408-H425 PolarHBondContact SG-NE2 2.98Å; Y416-H425 HydrophobicContact CD1-CB 3.99Å; Y416-H425 HydrophobicContact CE1-CB 3.37Å; Y416-H425 AromaticContact CE1-CG 3.93Å; Y416-H425 HydrophobicContact CE2-CB 4Å; Y416-H425 AromaticContact CE2-CD2 3.45Å; Y416-H425 VanDerWaalsContact CE2-CD2 3.45Å; Y416-H425 WeakPolarHBondContact CE2-CD2 3.39Å; Y416-H425 AromaticContact CE2-CG 3.59Å; Y416-H425 AromaticContact CE2-NE2 3.98Å; Y416-H425 AromaticContact CZ-CD2 3.54Å; Y416-H425 AromaticContact CZ-CG 3.49Å; Y416-H425 VanDerWaalsContact CZ-CG 3.49Å; Y416-H425 PolarHBondContact OH-CD2 3.27Å; A421-H425 PolarHBondContact O-N 3.39Å; F422-H425 AromaticContact CD2-CE1 3.49Å; F422-H425 VanDerWaalsContact CD2-CE1 3.49Å; F422-H425 WeakPolarHBondContact CD2-CE1 3.37Å; F422-H425 AromaticContact CD2-ND1 3.6Å; F422-H425 AromaticContact CE2-CE1 3.41Å; F422-H425 VanDerWaalsContact CE2-CE1 3.41Å; F422-H425 WeakPolarHBondContact CE2-CE1 3.26Å; F422-H425 AromaticContact CG-ND1 3.98Å; F422-H425 AromaticContact CZ-CE1 3.87Å; F422-H425 PolarHBondContact O-CE1 3.06Å; F422-H425 PolarHBondContact O-ND1 3.29Å; Q423-H425 VanDerWaalsContact C-N 3.32Å; Q423-H425 PolarHBondContact O-N 3.49Å; H425-A427 PolarHBondContact O-N 3.38Å; H425-E428 WeakPolarHBondContact O-CB 3.4Å; H425-E428 PolarHBondContact O-N 2.93Å; H425-H431 AromaticContact CD2-ND1 3.71Å; H425-H431 AromaticContact NE2-ND1 3.51Å; H425-H431 WeakPolarHBondContact O-CB 3.16Å
426	F	91.6	Very high	90	Very high	19 Å²	19	70.4 Å²	70.4	8%	0.083	33%	0.326	C	S	.	.	G	3₁₀ helix	trans	-61	-28.4	176.6	-70.7	-71	0	0	0	113.1	F422 R424 H431 N442 V449 T450	F422-F426 HydrophobicContact CD1-CE2 4.36Å; F422-F426 HydrophobicContact CE1-CE2 4.19Å; F422-F426 HydrophobicContact CE1-CZ 4.16Å; F422-F426 HydrophobicContact CZ-CZ 4.36Å; F422-F426 WeakPolarHBondContact O-CD2 3.45Å; F422-F426 WeakPolarHBondContact O-CE2 3.32Å; R424-F426 PolarHBondContact O-N 2.92Å; R424-F426 VanDerWaalsContact O-N 3.11Å; F426-H431 AromaticContact CD1-CD2 3.96Å; F426-H431 AromaticContact CD1-CE1 3.65Å; F426-H431 AromaticContact CD1-NE2 3.45Å; F426-H431 WeakPolarHBondContact CD1-NE2 3.35Å; F426-H431 AromaticContact CE1-CE1 3.78Å; F426-H431 AromaticContact CE1-NE2 3.98Å; F426-N442 PolarHBondContact O-ND2 3.09Å; F426-V449 WeakPolarHBondContact CE1-O 3.47Å; F426-T450 HydrophobicContact CE1-CG2 4.47Å; F426-T450 HydrophobicContact CZ-CG2 4.05Å
427	A	89.4	Confident	90.1	Very high	90 Å²	90	74 Å²	74	74%	0.744	35%	0.353	S	S	*	.	G	3₁₀ helix	trans	-95.4	-5.1	175.7	0	0	0	0	0	113.1	R424 H425	R424-A427 PolarHBondContact O-N 3.49Å; H425-A427 PolarHBondContact O-N 3.38Å
428	E	91.1	Very high	90.3	Very high	63 Å²	63	71.8 Å²	71.8	29%	0.294	35%	0.348	S	S	.	.	S	Bend	trans	-79.1	153.6	-179.4	-69.8	173	-176.1	0	0	111.3	R424 H425 R430 H431 A432	R424-E428 IonicContact NE-OE1 3.61Å; R424-E428 PolarHBondContact NE-OE1 3.46Å; R424-E428 IonicContact NH2-OE1 2.65Å; H425-E428 WeakPolarHBondContact O-CB 3.4Å; H425-E428 PolarHBondContact O-N 2.93Å; E428-R430 VanDerWaalsContact C-N 3.26Å; E428-R430 PolarHBondContact O-N 3.46Å; E428-H431 PolarHBondContact O-N 2.86Å; E428-A432 PolarHBondContact O-N 3.23Å; E428-A432 VanDerWaalsContact O-N 3.11Å
429	W	90.6	Very high	90.3	Very high	186 Å²	186	74.3 Å²	74.3	71%	0.705	37%	0.374	S	S	*	.	H	α-helix	trans	-56	-38.6	-175.1	178.6	92.6	0	0	0	113.1	H431 A432 H433	W429-H431 PolarHBondContact O-N 3.08Å; W429-A432 PolarHBondContact O-N 2.91Å; W429-H433 HydrophobicContact CD2-CB 4.48Å; W429-H433 HydrophobicContact CE3-CB 4.48Å; W429-H433 HydrophobicContact CH2-CB 4.34Å; W429-H433 HydrophobicContact CZ2-CB 4.35Å; W429-H433 HydrophobicContact CZ3-CB 4.4Å; W429-H433 VanDerWaalsContact O-CB 3.28Å; W429-H433 WeakPolarHBondContact O-CB 3.29Å; W429-H433 PolarHBondContact O-N 3.02Å
430	R	89.7	Confident	90.5	Very high	117 Å²	117	72.3 Å²	72.3	44%	0.442	36%	0.361	S	S	.	.	H	α-helix	trans	-61.4	-44.9	-178.5	-179	178.8	-80.7	-170.1	-5	111.9	C411 Y414 E428 H433 G434	C411-R430 HydrophobicContact CB-CG 4.39Å; Y414-R430 VanDerWaalsContact CG-NH1 3.31Å; E428-R430 VanDerWaalsContact C-N 3.26Å; E428-R430 PolarHBondContact O-N 3.46Å; R430-H433 PolarHBondContact O-N 2.99Å; R430-G434 PolarHBondContact O-N 3.26Å
431	H	91.5	Very high	90.6	Very high	1 Å²	1	66.7 Å²	66.7	1%	0.005	34%	0.343	C	S	.	.	H	α-helix	trans	-70.3	-42	178.6	-169.6	83.9	0	0	0	111.3	C411 H425 F426 E428 W429 H433 G434 M435	C411-H431 PolarHBondContact SG-ND1 3.43Å; C411-H431 VanDerWaalsContact SG-ND1 3.45Å; H425-H431 AromaticContact CD2-ND1 3.71Å; H425-H431 AromaticContact NE2-ND1 3.51Å; H425-H431 WeakPolarHBondContact O-CB 3.16Å; F426-H431 AromaticContact CD1-CD2 3.96Å; F426-H431 AromaticContact CD1-CE1 3.65Å; F426-H431 AromaticContact CD1-NE2 3.45Å; F426-H431 WeakPolarHBondContact CD1-NE2 3.35Å; F426-H431 AromaticContact CE1-CE1 3.78Å; F426-H431 AromaticContact CE1-NE2 3.98Å; E428-H431 PolarHBondContact O-N 2.86Å; W429-H431 PolarHBondContact O-N 3.08Å; H431-H433 VanDerWaalsContact C-N 3.26Å; H431-H433 PolarHBondContact O-N 3.23Å; H431-G434 PolarHBondContact O-N 3.47Å; H431-M435 WeakPolarHBondContact O-CG 3.26Å; H431-M435 PolarHBondContact O-N 3.04Å
432	A	90.8	Very high	90.6	Very high	26 Å²	26	68.6 Å²	68.6	22%	0.215	35%	0.349	C	S	.	.	H	α-helix	trans	-59.8	-37.6	174.8	0	0	0	0	0	112.4	E428 W429 R436 N442	E428-A432 PolarHBondContact O-N 3.23Å; E428-A432 VanDerWaalsContact O-N 3.11Å; W429-A432 PolarHBondContact O-N 2.91Å; A432-R436 WeakPolarHBondContact O-CB 3.28Å; A432-R436 PolarHBondContact O-N 2.85Å; A432-N442 WeakPolarHBondContact CB-ND2 3.43Å
433	H	91.8	Very high	90.4	Very high	79 Å²	79	70.1 Å²	70.1	37%	0.366	36%	0.36	S	S	.	.	H	α-helix	trans	-68.3	-44.5	175.3	-172	75	0	0	0	111.6	W429 R430 H431 M435 R436 C437	W429-H433 HydrophobicContact CD2-CB 4.48Å; W429-H433 HydrophobicContact CE3-CB 4.48Å; W429-H433 HydrophobicContact CH2-CB 4.34Å; W429-H433 HydrophobicContact CZ2-CB 4.35Å; W429-H433 HydrophobicContact CZ3-CB 4.4Å; W429-H433 VanDerWaalsContact O-CB 3.28Å; W429-H433 WeakPolarHBondContact O-CB 3.29Å; W429-H433 PolarHBondContact O-N 3.02Å; R430-H433 PolarHBondContact O-N 2.99Å; H431-H433 VanDerWaalsContact C-N 3.26Å; H431-H433 PolarHBondContact O-N 3.23Å; H433-M435 VanDerWaalsContact C-N 3.34Å; H433-M435 PolarHBondContact O-N 2.88Å; H433-R436 WeakPolarHBondContact O-CB 3.48Å; H433-R436 PolarHBondContact O-N 3.43Å; H433-R436 VanDerWaalsContact O-N 3.12Å; H433-C437 PolarHBondContact O-N 3.49Å; H433-C437 PolarHBondContact O-SG 2.79Å; H433-C437 VanDerWaalsContact O-SG 3.35Å
434	G	92	Very high	90.3	Very high	13 Å²	13	68.2 Å²	68.2	13%	0.134	37%	0.367	C	S	.	.	H	α-helix	trans	-56.5	-46.6	173.7	0	0	0	0	0	112.4	R430 H431 R436 C437 L438	R430-G434 PolarHBondContact O-N 3.26Å; H431-G434 PolarHBondContact O-N 3.47Å; G434-R436 VanDerWaalsContact C-N 3.33Å; G434-R436 PolarHBondContact O-N 3.3Å; G434-C437 PolarHBondContact O-N 3.14Å; G434-L438 WeakPolarHBondContact O-CG 3.32Å; G434-L438 PolarHBondContact O-N 2.93Å
435	M	91.4	Very high	90.1	Very high	1 Å²	1	66 Å²	66	1%	0.005	36%	0.364	C	S	.	.	H	α-helix	trans	-61.6	-39.3	174.8	-70.1	-65.3	-78.7	0	0	112.7	I410 H431 H433 L438 G439 I440 N442 F446	I410-M435 HydrophobicContact CD1-SD 4.01Å; I410-M435 HydrophobicContact CG2-CG 4.14Å; I410-M435 HydrophobicContact CG2-SD 4.03Å; H431-M435 WeakPolarHBondContact O-CG 3.26Å; H431-M435 PolarHBondContact O-N 3.04Å; H433-M435 VanDerWaalsContact C-N 3.34Å; H433-M435 PolarHBondContact O-N 2.88Å; M435-L438 PolarHBondContact O-N 3.48Å; M435-G439 PolarHBondContact O-N 3.01Å; M435-I440 CarbonylContact C-O 3.59Å; M435-I440 HydrophobicContact CE-CB 3.92Å; M435-I440 HydrophobicContact CE-CG2 3.51Å; M435-I440 PolarHBondContact O-N 2.87Å; M435-I440 VanDerWaalsContact O-O 3.11Å; M435-N442 HydrophobicContact CB-CB 4.41Å; M435-F446 HydrophobicContact CE-CB 3.67Å; M435-F446 HydrophobicContact CE-CD1 3.85Å; M435-F446 HydrophobicContact CE-CD2 4.02Å; M435-F446 HydrophobicContact CE-CG 3.57Å
436	R	91.3	Very high	89.9	Confident	178 Å²	178	66.1 Å²	66.1	67%	0.672	36%	0.364	S	S	*	.	H	α-helix	trans	-65.1	-39.7	176	-175.4	-179.7	-71.7	155.1	-1.6	112.1	A432 H433 G434 L438 G439	A432-R436 WeakPolarHBondContact O-CB 3.28Å; A432-R436 PolarHBondContact O-N 2.85Å; H433-R436 WeakPolarHBondContact O-CB 3.48Å; H433-R436 PolarHBondContact O-N 3.43Å; H433-R436 VanDerWaalsContact O-N 3.12Å; G434-R436 VanDerWaalsContact C-N 3.33Å; G434-R436 PolarHBondContact O-N 3.3Å; R436-L438 PolarHBondContact O-N 3.45Å; R436-G439 PolarHBondContact O-N 3.06Å
437	C	91.2	Very high	89.6	Confident	95 Å²	95	67.8 Å²	67.8	64%	0.642	38%	0.381	S	S	*	.	H	α-helix	trans	-63.8	-29.6	175.1	-68.4	0	0	0	0	112.4	H433 G434 G439	H433-C437 PolarHBondContact O-N 3.49Å; H433-C437 PolarHBondContact O-SG 2.79Å; H433-C437 VanDerWaalsContact O-SG 3.35Å; G434-C437 PolarHBondContact O-N 3.14Å; C437-G439 VanDerWaalsContact C-N 3.26Å; C437-G439 PolarHBondContact O-N 3.12Å
438	L	90.1	Very high	89.6	Confident	60 Å²	60	68.9 Å²	68.9	31%	0.314	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-79.3	-5.2	172.5	-62.9	171.2	0	0	0	113.4	I410 G434 M435 R436 I440 I452	I410-L438 HydrophobicContact CG1-CD1 4.29Å; I410-L438 HydrophobicContact CG2-CD1 4.2Å; G434-L438 WeakPolarHBondContact O-CG 3.32Å; G434-L438 PolarHBondContact O-N 2.93Å; M435-L438 PolarHBondContact O-N 3.48Å; R436-L438 PolarHBondContact O-N 3.45Å; L438-I440 VanDerWaalsContact C-N 3.28Å; L438-I440 HydrophobicContact CB-CD1 4.15Å; L438-I440 HydrophobicContact CB-CG1 4.14Å; L438-I440 PolarHBondContact O-N 2.85Å; L438-I452 HydrophobicContact CD1-CG1 4.39Å; L438-I452 HydrophobicContact CD1-CG2 4.08Å; L438-I452 HydrophobicContact CD2-CG2 3.65Å
439	G	88.8	Confident	89.5	Confident	55 Å²	55	67 Å²	67	57%	0.567	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	71.9	19.4	-176.2	0	0	0	0	0	114.1	M435 R436 C437	M435-G439 PolarHBondContact O-N 3.01Å; R436-G439 PolarHBondContact O-N 3.06Å; C437-G439 VanDerWaalsContact C-N 3.26Å; C437-G439 PolarHBondContact O-N 3.12Å
440	I	90.7	Very high	89.5	Confident	4 Å²	4	59.9 Å²	59.9	2%	0.021	34%	0.344	C	S	.	.			trans	-104.3	129.4	-178.9	-55.3	175.7	0	0	0	109.2	M435 L438 N442 F446 A455 V456 W459	M435-I440 CarbonylContact C-O 3.59Å; M435-I440 HydrophobicContact CE-CB 3.92Å; M435-I440 HydrophobicContact CE-CG2 3.51Å; M435-I440 PolarHBondContact O-N 2.87Å; M435-I440 VanDerWaalsContact O-O 3.11Å; L438-I440 VanDerWaalsContact C-N 3.28Å; L438-I440 HydrophobicContact CB-CD1 4.15Å; L438-I440 HydrophobicContact CB-CG1 4.14Å; L438-I440 PolarHBondContact O-N 2.85Å; I440-N442 PolarHBondContact O-N 2.89Å; I440-F446 HydrophobicContact CG2-CD1 4.21Å; I440-F446 HydrophobicContact CG2-CD2 4.07Å; I440-F446 HydrophobicContact CG2-CE1 3.68Å; I440-F446 HydrophobicContact CG2-CE2 3.52Å; I440-F446 HydrophobicContact CG2-CG 4.39Å; I440-F446 HydrophobicContact CG2-CZ 3.3Å; I440-A455 HydrophobicContact CD1-CB 3.91Å; I440-V456 HydrophobicContact CD1-CG2 4.21Å; I440-W459 HydrophobicContact CD1-CB 4.08Å; I440-W459 HydrophobicContact CG1-CB 4.1Å; I440-W459 HydrophobicContact CG1-CG 4.02Å; I440-W459 HydrophobicContact CG2-CB 4.2Å; I440-W459 HydrophobicContact CG2-CD2 4.32Å; I440-W459 HydrophobicContact CG2-CG 4.19Å
441	P	88.1	Confident	89.6	Confident	57 Å²	57	58.6 Å²	58.6	37%	0.37	34%	0.343	S	S	.	.			trans	-69.7	127.7	175.8	28.2	-33.2	0	0	0	111	T443 F446 W459	P441-T443 HydrophobicContact CB-CG2 4.32Å; P441-T443 PolarHBondContact O-N 2.94Å; P441-F446 WeakPolarHBondContact O-CD2 3.36Å; P441-F446 WeakPolarHBondContact O-CE2 3.33Å; P441-W459 HydrophobicContact CG-CE3 4.36Å; P441-W459 HydrophobicContact CG-CH2 3.58Å; P441-W459 HydrophobicContact CG-CZ2 4.23Å; P441-W459 HydrophobicContact CG-CZ3 3.65Å
442	N	87.7	Confident	89.6	Confident	70 Å²	70	61.2 Å²	61.2	37%	0.374	36%	0.357	S	S	.	.			trans	-71.9	93.6	178.7	-168.5	16.5	0	0	0	110.7	F426 A432 M435 I440	F426-N442 PolarHBondContact O-ND2 3.09Å; A432-N442 WeakPolarHBondContact CB-ND2 3.43Å; M435-N442 HydrophobicContact CB-CB 4.41Å; I440-N442 PolarHBondContact O-N 2.89Å
443	T	88	Confident	89.7	Confident	58 Å²	58	67 Å²	67	36%	0.356	38%	0.379	S	S	.	.			trans	-124.7	162.6	-178.8	59.3	0	0	0	0	110	P441 H445 F446	P441-T443 HydrophobicContact CB-CG2 4.32Å; P441-T443 PolarHBondContact O-N 2.94Å; T443-H445 PolarHBondContact O-N 3.16Å; T443-F446 PolarHBondContact O-N 2.95Å; T443-F446 WeakPolarHBondContact OG1-CD2 3.43Å
444	A	86.9	Confident	89.7	Confident	92 Å²	92	67.4 Å²	67.4	76%	0.76	38%	0.384	S	S	*	.	G	3₁₀ helix	trans	-57.6	-19.8	-178	0	0	0	0	0	114.4	F446 A447	A444-F446 PolarHBondContact O-N 3.33Å; A444-A447 WeakPolarHBondContact O-CB 3.48Å; A444-A447 PolarHBondContact O-N 2.69Å
445	H	86.5	Confident	89.6	Confident	123 Å²	123	66.8 Å²	66.8	57%	0.569	38%	0.378	S	S	*	.	G	3₁₀ helix	trans	-62.4	-23.2	174.4	-62.3	-68.9	0	0	0	113.7	T443 L462	T443-H445 PolarHBondContact O-N 3.16Å; H445-L462 HydrophobicContact CB-CD1 4.11Å
446	F	88.9	Confident	89.6	Confident	2 Å²	2	69.8 Å²	69.8	1%	0.009	40%	0.396	C	S	.	.	G	3₁₀ helix	trans	-99.6	10.3	-179.7	-59.9	-79.4	0	0	0	112.9	M435 I440 P441 T443 A444 N448 V449 L458 W459 L462	M435-F446 HydrophobicContact CE-CB 3.67Å; M435-F446 HydrophobicContact CE-CD1 3.85Å; M435-F446 HydrophobicContact CE-CD2 4.02Å; M435-F446 HydrophobicContact CE-CG 3.57Å; I440-F446 HydrophobicContact CG2-CD1 4.21Å; I440-F446 HydrophobicContact CG2-CD2 4.07Å; I440-F446 HydrophobicContact CG2-CE1 3.68Å; I440-F446 HydrophobicContact CG2-CE2 3.52Å; I440-F446 HydrophobicContact CG2-CG 4.39Å; I440-F446 HydrophobicContact CG2-CZ 3.3Å; P441-F446 WeakPolarHBondContact O-CD2 3.36Å; P441-F446 WeakPolarHBondContact O-CE2 3.33Å; T443-F446 PolarHBondContact O-N 2.95Å; T443-F446 WeakPolarHBondContact OG1-CD2 3.43Å; A444-F446 PolarHBondContact O-N 3.33Å; F446-N448 PolarHBondContact O-N 3.25Å; F446-V449 PolarHBondContact O-N 3.37Å; F446-L458 HydrophobicContact CD1-CD2 3.83Å; F446-L458 HydrophobicContact CD1-CG 4.46Å; F446-L458 HydrophobicContact CE1-CB 4.18Å; F446-L458 HydrophobicContact CE1-CD2 3.91Å; F446-L458 HydrophobicContact CE1-CG 4.05Å; F446-W459 HydrophobicContact CE1-CB 4.17Å; F446-W459 HydrophobicContact CE2-CE3 4.42Å; F446-W459 HydrophobicContact CZ-CB 4.03Å; F446-W459 HydrophobicContact CZ-CD2 4.49Å; F446-W459 AromaticContact CZ-CE3 3.91Å; F446-W459 HydrophobicContact CZ-CE3 3.91Å; F446-L462 HydrophobicContact CE2-CD1 4.4Å; F446-L462 HydrophobicContact CZ-CD1 3.95Å
447	A	86	Confident	89.7	Confident	53 Å²	53	64.1 Å²	64.1	44%	0.438	38%	0.384	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.9	135.8	173.4	0	0	0	0	0	110.4	A444 V449	A444-A447 WeakPolarHBondContact O-CB 3.48Å; A444-A447 PolarHBondContact O-N 2.69Å; A447-V449 VanDerWaalsContact C-N 3.25Å; A447-V449 PolarHBondContact O-N 3.09Å
448	N	88.3	Confident	89.6	Confident	114 Å²	114	62.3 Å²	62.3	61%	0.61	37%	0.367	S	S	*	.	T	Hydrogen-bonded Turn	trans	69.8	6.3	-176.5	-51.7	-41.6	0	0	0	116.2	F446	F446-N448 PolarHBondContact O-N 3.25Å
449	V	89.8	Confident	89.7	Confident	23 Å²	23	62.7 Å²	62.7	14%	0.139	37%	0.365	C	S	.	.			trans	-88.1	118.8	173.7	-174.1	0	0	0	0	109.4	I410 F426 F446 A447 D454 A455 L458	I410-V449 WeakPolarHBondContact CD1-O 3.47Å; F426-V449 WeakPolarHBondContact CE1-O 3.47Å; F446-V449 PolarHBondContact O-N 3.37Å; A447-V449 VanDerWaalsContact C-N 3.25Å; A447-V449 PolarHBondContact O-N 3.09Å; V449-D454 HydrophobicContact CG1-CB 3.96Å; V449-A455 HydrophobicContact CG1-CB 3.79Å; V449-L458 HydrophobicContact CG2-CD2 4.2Å
450	T	90.1	Very high	89.7	Confident	36 Å²	36	63.3 Å²	63.3	22%	0.221	36%	0.36	C	S	.	.			trans	-115.6	-28.8	-171.8	59	0	0	0	0	113	E409 I410 F422 F426	E409-T450 VanDerWaalsContact CB-O 3.26Å; E409-T450 WeakPolarHBondContact CB-O 3.09Å; E409-T450 PolarHBondContact N-O 3.26Å; E409-T450 VanDerWaalsContact N-O 3.15Å; I410-T450 WeakPolarHBondContact CG1-O 3.37Å; I410-T450 PolarHBondContact N-O 3.22Å; F422-T450 HydrophobicContact CE1-CG2 4.07Å; F422-T450 HydrophobicContact CE2-CG2 4.45Å; F422-T450 HydrophobicContact CZ-CG2 3.45Å; F422-T450 VanDerWaalsContact CZ-CG2 3.45Å; F426-T450 HydrophobicContact CE1-CG2 4.47Å; F426-T450 HydrophobicContact CZ-CG2 4.05Å
451	Q	92.8	Very high	89.7	Confident	91 Å²	91	69.6 Å²	69.6	43%	0.425	39%	0.387	S	S	.	.	S	Bend	trans	-85.6	141.8	177.2	-63.4	-173.8	14.3	0	0	110.7	E409 D454 A455	E409-Q451 WeakPolarHBondContact OE2-CA 3.47Å; Q451-D454 HydrophobicContact CB-CB 4.28Å; Q451-A455 PolarHBondContact O-N 3.22Å
452	I	90.8	Very high	89.7	Confident	55 Å²	55	68.2 Å²	68.2	28%	0.282	38%	0.377	S	S	.	.	H	α-helix	trans	-68.5	-40.9	-178.4	-64.3	172.5	0	0	0	110.4	E409 I410 L438 D454 A455 V456	E409-I452 HydrophobicContact CG-CD1 4.14Å; E409-I452 HydrophobicContact CG-CG1 4.23Å; I410-I452 HydrophobicContact CG1-CG1 3.9Å; L438-I452 HydrophobicContact CD1-CG1 4.39Å; L438-I452 HydrophobicContact CD1-CG2 4.08Å; L438-I452 HydrophobicContact CD2-CG2 3.65Å; I452-D454 PolarHBondContact O-N 3Å; I452-A455 PolarHBondContact O-N 3.44Å; I452-V456 HydrophobicContact CG2-CG2 4.43Å; I452-V456 WeakPolarHBondContact O-CG2 3.41Å; I452-V456 PolarHBondContact O-N 3.22Å; I452-V456 VanDerWaalsContact O-N 3.07Å
453	E	92.3	Very high	89.7	Confident	148 Å²	148	71.4 Å²	71.4	69%	0.692	39%	0.387	S	S	*	.	H	α-helix	trans	-60.5	-45.3	-179	-60.6	-177.3	177.4	0	0	112	V456 S457	E453-V456 PolarHBondContact O-N 2.59Å; E453-S457 WeakPolarHBondContact O-CB 3.49Å; E453-S457 PolarHBondContact O-N 3.12Å
454	D	91.7	Very high	89.6	Confident	87 Å²	87	72.4 Å²	72.4	47%	0.465	40%	0.397	S	S	.	.	H	α-helix	trans	-64.1	-41.6	178.2	-72.8	-22.5	0	0	0	112	V449 Q451 I452 S457 L458	V449-D454 HydrophobicContact CG1-CB 3.96Å; Q451-D454 HydrophobicContact CB-CB 4.28Å; I452-D454 PolarHBondContact O-N 3Å; D454-S457 PolarHBondContact O-N 3.36Å; D454-L458 VanDerWaalsContact O-CB 3.28Å; D454-L458 WeakPolarHBondContact O-CB 3.44Å; D454-L458 PolarHBondContact O-N 3.48Å
455	A	91.1	Very high	89.5	Confident	0 Å²	0	73.4 Å²	73.4	0%	0	39%	0.386	C	S	.	.	H	α-helix	trans	-62.6	-44.3	178	0	0	0	0	0	111.6	I410 I440 V449 Q451 I452 L458 W459	I410-A455 HydrophobicContact CD1-CB 4.2Å; I440-A455 HydrophobicContact CD1-CB 3.91Å; V449-A455 HydrophobicContact CG1-CB 3.79Å; Q451-A455 PolarHBondContact O-N 3.22Å; I452-A455 PolarHBondContact O-N 3.44Å; A455-L458 PolarHBondContact O-N 2.84Å; A455-W459 WeakPolarHBondContact O-CB 3.28Å; A455-W459 PolarHBondContact O-N 2.85Å
456	V	91.2	Very high	89.3	Confident	64 Å²	64	73.8 Å²	73.8	39%	0.388	39%	0.386	S	S	.	.	H	α-helix	trans	-67.7	-40.5	178.7	174.5	0	0	0	0	111.5	I440 I452 E453 W459 S460	I440-V456 HydrophobicContact CD1-CG2 4.21Å; I452-V456 HydrophobicContact CG2-CG2 4.43Å; I452-V456 WeakPolarHBondContact O-CG2 3.41Å; I452-V456 PolarHBondContact O-N 3.22Å; I452-V456 VanDerWaalsContact O-N 3.07Å; E453-V456 PolarHBondContact O-N 2.59Å; V456-W459 PolarHBondContact O-N 2.9Å; V456-S460 WeakPolarHBondContact O-CB 3.36Å; V456-S460 PolarHBondContact O-N 3.12Å; V456-S460 PolarHBondContact O-OG 3.32Å
457	S	92.1	Very high	88.8	Confident	60 Å²	60	76 Å²	76	42%	0.42	41%	0.405	S	S	.	.	H	α-helix	trans	-62.8	-46.5	175.9	-178	0	0	0	0	111.7	E453 D454 S460 K461	E453-S457 WeakPolarHBondContact O-CB 3.49Å; E453-S457 PolarHBondContact O-N 3.12Å; D454-S457 PolarHBondContact O-N 3.36Å; S457-S460 PolarHBondContact O-N 2.98Å; S457-K461 PolarHBondContact O-N 3.28Å
458	L	90.7	Very high	88.4	Confident	56 Å²	56	77.8 Å²	77.8	29%	0.293	41%	0.414	S	S	.	.	H	α-helix	trans	-63.7	-43.1	177.6	-176.1	62.4	0	0	0	111.5	F446 V449 D454 A455 S460 K461 L462	F446-L458 HydrophobicContact CD1-CD2 3.83Å; F446-L458 HydrophobicContact CD1-CG 4.46Å; F446-L458 HydrophobicContact CE1-CB 4.18Å; F446-L458 HydrophobicContact CE1-CD2 3.91Å; F446-L458 HydrophobicContact CE1-CG 4.05Å; V449-L458 HydrophobicContact CG2-CD2 4.2Å; D454-L458 VanDerWaalsContact O-CB 3.28Å; D454-L458 WeakPolarHBondContact O-CB 3.44Å; D454-L458 PolarHBondContact O-N 3.48Å; A455-L458 PolarHBondContact O-N 2.84Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-S460 PolarHBondContact O-N 3.12Å; L458-K461 PolarHBondContact O-N 3.23Å; L458-L462 HydrophobicContact CG-CD1 4.18Å; L458-L462 WeakPolarHBondContact O-CG 3.38Å; L458-L462 PolarHBondContact O-N 2.88Å
459	W	90.9	Very high	87.8	Confident	69 Å²	69	79.8 Å²	79.8	26%	0.261	42%	0.42	S	S	.	.	H	α-helix	trans	-62.3	-41.3	176.4	177.8	-128.5	0	0	0	112.3	I440 P441 F446 A455 V456 K461 L462 K463	I440-W459 HydrophobicContact CD1-CB 4.08Å; I440-W459 HydrophobicContact CG1-CB 4.1Å; I440-W459 HydrophobicContact CG1-CG 4.02Å; I440-W459 HydrophobicContact CG2-CB 4.2Å; I440-W459 HydrophobicContact CG2-CD2 4.32Å; I440-W459 HydrophobicContact CG2-CG 4.19Å; P441-W459 HydrophobicContact CG-CE3 4.36Å; P441-W459 HydrophobicContact CG-CH2 3.58Å; P441-W459 HydrophobicContact CG-CZ2 4.23Å; P441-W459 HydrophobicContact CG-CZ3 3.65Å; F446-W459 HydrophobicContact CE1-CB 4.17Å; F446-W459 HydrophobicContact CE2-CE3 4.42Å; F446-W459 HydrophobicContact CZ-CB 4.03Å; F446-W459 HydrophobicContact CZ-CD2 4.49Å; F446-W459 AromaticContact CZ-CE3 3.91Å; F446-W459 HydrophobicContact CZ-CE3 3.91Å; A455-W459 WeakPolarHBondContact O-CB 3.28Å; A455-W459 PolarHBondContact O-N 2.85Å; V456-W459 PolarHBondContact O-N 2.9Å; W459-K461 VanDerWaalsContact C-N 3.34Å; W459-K461 PolarHBondContact O-N 3.33Å; W459-L462 HydrophobicContact CE3-CB 4.39Å; W459-L462 PolarHBondContact O-N 2.76Å; W459-K463 VanDerWaalsContact O-CB 3.27Å; W459-K463 WeakPolarHBondContact O-CB 3.26Å; W459-K463 PolarHBondContact O-N 3.03Å
460	S	89.8	Confident	87.3	Confident	68 Å²	68	87.8 Å²	87.8	48%	0.476	45%	0.447	S	S	.	.	H	α-helix	trans	-62.2	-42	177	-60.4	0	0	0	0	111.8	V456 S457 L458 K463 S464	V456-S460 WeakPolarHBondContact O-CB 3.36Å; V456-S460 PolarHBondContact O-N 3.12Å; V456-S460 PolarHBondContact O-OG 3.32Å; S457-S460 PolarHBondContact O-N 2.98Å; L458-S460 VanDerWaalsContact C-N 3.34Å; L458-S460 PolarHBondContact O-N 3.12Å; S460-K463 PolarHBondContact O-N 3.02Å; S460-S464 WeakPolarHBondContact O-CB 3.34Å; S460-S464 PolarHBondContact O-N 3.05Å
461	K	90.6	Very high	86.5	Confident	135 Å²	135	93.1 Å²	93.1	59%	0.587	46%	0.464	S	S	*	.	H	α-helix	trans	-63.2	-48	174.2	-72.8	179.3	-177.6	176.2	0	112.1	S457 L458 W459 K463 S464 Q465	S457-K461 PolarHBondContact O-N 3.28Å; L458-K461 PolarHBondContact O-N 3.23Å; W459-K461 VanDerWaalsContact C-N 3.34Å; W459-K461 PolarHBondContact O-N 3.33Å; K461-K463 VanDerWaalsContact C-N 3.32Å; K461-K463 PolarHBondContact O-N 3.3Å; K461-S464 PolarHBondContact O-N 2.9Å; K461-Q465 PolarHBondContact O-N 3.41Å
462	L	87.6	Confident	85.6	Confident	29 Å²	29	93.6 Å²	93.6	15%	0.152	47%	0.466	C	S	.	.	H	α-helix	trans	-63.3	-38.1	178.8	-74.3	172.7	0	0	0	112.1	H445 F446 L458 W459 K466	H445-L462 HydrophobicContact CB-CD1 4.11Å; F446-L462 HydrophobicContact CE2-CD1 4.4Å; F446-L462 HydrophobicContact CZ-CD1 3.95Å; L458-L462 HydrophobicContact CG-CD1 4.18Å; L458-L462 WeakPolarHBondContact O-CG 3.38Å; L458-L462 PolarHBondContact O-N 2.88Å; W459-L462 HydrophobicContact CE3-CB 4.39Å; W459-L462 PolarHBondContact O-N 2.76Å; L462-K466 WeakPolarHBondContact O-CB 3.39Å; L462-K466 WeakPolarHBondContact O-CG 3.37Å; L462-K466 PolarHBondContact O-N 3.3Å
463	K	86.9	Confident	84.7	Confident	136 Å²	136	93 Å²	93	59%	0.591	47%	0.466	S	S	*	.	H	α-helix	trans	-66	-40.2	175.9	-169.6	178.2	-178.5	-177.1	0	111.3	W459 S460 K461 A467	W459-K463 VanDerWaalsContact O-CB 3.27Å; W459-K463 WeakPolarHBondContact O-CB 3.26Å; W459-K463 PolarHBondContact O-N 3.03Å; S460-K463 PolarHBondContact O-N 3.02Å; K461-K463 VanDerWaalsContact C-N 3.32Å; K461-K463 PolarHBondContact O-N 3.3Å; K463-A467 WeakPolarHBondContact O-CB 3.35Å; K463-A467 PolarHBondContact O-N 2.71Å
464	S	86.3	Confident	83.6	Confident	80 Å²	80	90.3 Å²	90.3	56%	0.559	46%	0.456	S	S	*	.	H	α-helix	trans	-65.1	-47.3	175.2	-166.6	0	0	0	0	111.8	S460 K461 K466 A467 S468	S460-S464 WeakPolarHBondContact O-CB 3.34Å; S460-S464 PolarHBondContact O-N 3.05Å; K461-S464 PolarHBondContact O-N 2.9Å; S464-K466 PolarHBondContact O-N 3.15Å; S464-A467 PolarHBondContact O-N 2.96Å; S464-A467 VanDerWaalsContact O-N 3.14Å; S464-S468 PolarHBondContact O-N 3.25Å; S464-S468 PolarHBondContact O-OG 3.44Å
465	Q	85.9	Confident	82.7	Confident	112 Å²	112	89.5 Å²	89.5	52%	0.523	45%	0.454	S	S	.	.	H	α-helix	trans	-60.2	-46.8	176.5	-77.1	179.5	-29	0	0	112.3	K461 A467 S468 E469	K461-Q465 PolarHBondContact O-N 3.41Å; Q465-A467 VanDerWaalsContact C-N 3.28Å; Q465-A467 PolarHBondContact O-N 3.18Å; Q465-S468 WeakPolarHBondContact CA-OG 3.49Å; Q465-S468 PolarHBondContact O-N 3Å; Q465-S468 PolarHBondContact O-OG 3.28Å; Q465-E469 WeakPolarHBondContact O-CG 3.17Å; Q465-E469 PolarHBondContact O-N 3.27Å
466	K	82.4	Confident	81.8	Confident	131 Å²	131	94.2 Å²	94.2	57%	0.57	48%	0.476	S	S	*	.	H	α-helix	trans	-65.2	-31.5	175.5	-76.9	-172.6	176.6	-175.8	0	112.8	L462 S464 R470	L462-K466 WeakPolarHBondContact O-CB 3.39Å; L462-K466 WeakPolarHBondContact O-CG 3.37Å; L462-K466 PolarHBondContact O-N 3.3Å; S464-K466 PolarHBondContact O-N 3.15Å; K466-R470 VanDerWaalsContact O-CB 3.24Å; K466-R470 WeakPolarHBondContact O-CB 3.49Å; K466-R470 PolarHBondContact O-N 3.4Å; K466-R470 VanDerWaalsContact O-N 3.12Å
467	A	78.8	Confident	81.1	Confident	50 Å²	50	93.7 Å²	93.7	41%	0.413	47%	0.47	S	S	.	.	H	α-helix	trans	-71.7	-34.4	175.4	0	0	0	0	0	112.1	K463 S464 Q465	K463-A467 WeakPolarHBondContact O-CB 3.35Å; K463-A467 PolarHBondContact O-N 2.71Å; S464-A467 PolarHBondContact O-N 2.96Å; S464-A467 VanDerWaalsContact O-N 3.14Å; Q465-A467 VanDerWaalsContact C-N 3.28Å; Q465-A467 PolarHBondContact O-N 3.18Å
468	S	76.5	Confident	80.6	Confident	90 Å²	90	98 Å²	98	63%	0.629	48%	0.483	S	S	*	.	H	α-helix	trans	-75.1	-30.3	174.1	55.2	0	0	0	0	113.7	S464 Q465 R470	S464-S468 PolarHBondContact O-N 3.25Å; S464-S468 PolarHBondContact O-OG 3.44Å; Q465-S468 WeakPolarHBondContact CA-OG 3.49Å; Q465-S468 PolarHBondContact O-N 3Å; Q465-S468 PolarHBondContact O-OG 3.28Å; S468-R470 VanDerWaalsContact C-N 3.34Å
469	E	76.7	Confident	80	Confident	156 Å²	156	99.1 Å²	99.1	73%	0.729	48%	0.484	S	S	*	.	H	α-helix	trans	-82	-15.8	176.2	-71.7	173.8	177.9	0	0	112.7	Q465 W471	Q465-E469 WeakPolarHBondContact O-CG 3.17Å; Q465-E469 PolarHBondContact O-N 3.27Å; E469-W471 PolarHBondContact O-N 2.89Å
470	R	77.3	Confident	79.5	Confident	191 Å²	191	102.1 Å²	102.1	72%	0.721	50%	0.501	S	S	*	.	S	Bend	trans	-78.7	105.6	-179.7	-175.4	177	-174.9	-178.9	0.9	109.3	K466 S468 Q472	K466-R470 VanDerWaalsContact O-CB 3.24Å; K466-R470 WeakPolarHBondContact O-CB 3.49Å; K466-R470 PolarHBondContact O-N 3.4Å; K466-R470 VanDerWaalsContact O-N 3.12Å; S468-R470 VanDerWaalsContact C-N 3.34Å; R470-Q472 WeakPolarHBondContact O-CG 3.32Å; R470-Q472 PolarHBondContact O-N 2.96Å
471	W	74	Confident	78.9	Confident	148 Å²	148	100.1 Å²	100.1	56%	0.561	49%	0.485	S	S	*	.			trans	-47.1	124.6	173.7	-177.4	71.3	0	0	0	111.6	E469 P473 E476 E477	E469-W471 PolarHBondContact O-N 2.89Å; W471-P473 HydrophobicContact CE3-CB 4.26Å; W471-P473 HydrophobicContact CE3-CG 3.8Å; W471-P473 HydrophobicContact CH2-CB 3.44Å; W471-P473 VanDerWaalsContact CH2-CB 3.44Å; W471-P473 HydrophobicContact CH2-CG 3.85Å; W471-P473 HydrophobicContact CZ2-CB 4.04Å; W471-P473 HydrophobicContact CZ3-CB 3.57Å; W471-P473 HydrophobicContact CZ3-CG 3.38Å; W471-P473 VanDerWaalsContact O-CD 3.3Å; W471-P473 WeakPolarHBondContact O-CD 3.46Å; W471-E476 WeakPolarHBondContact CA-OE2 3.43Å; W471-E477 HydrophobicContact CZ2-CB 4.05Å; W471-E477 HydrophobicContact CZ2-CG 4.25Å
472	Q	73.8	Confident	78.2	Confident	101 Å²	101	98.5 Å²	98.5	47%	0.472	49%	0.491	S	S	.	.			trans	-108.9	96.3	-179.4	-65.9	-169.1	16.9	0	0	110.2	R470 D474 T475 E476	R470-Q472 WeakPolarHBondContact O-CG 3.32Å; R470-Q472 PolarHBondContact O-N 2.96Å; Q472-D474 PolarHBondContact O-N 3.25Å; Q472-D474 VanDerWaalsContact O-N 3.11Å; Q472-T475 VanDerWaalsContact CB-OG1 3.28Å; Q472-T475 WeakPolarHBondContact CB-OG1 3.48Å; Q472-T475 PolarHBondContact O-N 3.23Å; Q472-T475 VanDerWaalsContact O-N 3.11Å; Q472-T475 PolarHBondContact O-OG1 3.46Å; Q472-E476 PolarHBondContact N-OE2 3.22Å; Q472-E476 VanDerWaalsContact N-OE2 3.16Å; Q472-E476 WeakPolarHBondContact O-CB 3.33Å; Q472-E476 PolarHBondContact O-N 3.47Å
473	P	71.6	Confident	77.6	Confident	43 Å²	43	101.8 Å²	101.8	28%	0.279	52%	0.516	S	S	.	.	H	α-helix	trans	-53.4	-36.9	-176.3	-4.7	-3.2	0	0	0	113.8	W471 T475 E477	W471-P473 HydrophobicContact CE3-CB 4.26Å; W471-P473 HydrophobicContact CE3-CG 3.8Å; W471-P473 HydrophobicContact CH2-CB 3.44Å; W471-P473 VanDerWaalsContact CH2-CB 3.44Å; W471-P473 HydrophobicContact CH2-CG 3.85Å; W471-P473 HydrophobicContact CZ2-CB 4.04Å; W471-P473 HydrophobicContact CZ3-CB 3.57Å; W471-P473 HydrophobicContact CZ3-CG 3.38Å; W471-P473 VanDerWaalsContact O-CD 3.3Å; W471-P473 WeakPolarHBondContact O-CD 3.46Å; P473-T475 PolarHBondContact O-N 3.01Å; P473-E477 WeakPolarHBondContact O-CB 3.37Å; P473-E477 PolarHBondContact O-N 3.07Å; P473-E477 VanDerWaalsContact O-N 3.09Å
474	D	69.8	Low	77.1	Confident	90 Å²	90	97 Å²	97	48%	0.481	51%	0.506	S	S	.	.	H	α-helix	trans	-65	-27.4	-175.8	-68.4	-15.2	0	0	0	113.6	Q472 K490	Q472-D474 PolarHBondContact O-N 3.25Å; Q472-D474 VanDerWaalsContact O-N 3.11Å; D474-K490 HydrophobicContact CB-CB 4.26Å; D474-K490 VanDerWaalsContact O-CB 3.29Å; D474-K490 WeakPolarHBondContact O-CB 3.18Å; D474-K490 PolarHBondContact O-N 3.44Å; D474-K490 VanDerWaalsContact O-N 3.11Å
475	T	72.1	Confident	76.9	Confident	71 Å²	71	97.6 Å²	97.6	44%	0.436	50%	0.502	S	S	.	.	H	α-helix	trans	-113.3	-27.5	-176.1	36.5	0	0	0	0	113.8	Q472 P473	Q472-T475 VanDerWaalsContact CB-OG1 3.28Å; Q472-T475 WeakPolarHBondContact CB-OG1 3.48Å; Q472-T475 PolarHBondContact O-N 3.23Å; Q472-T475 VanDerWaalsContact O-N 3.11Å; Q472-T475 PolarHBondContact O-OG1 3.46Å; P473-T475 PolarHBondContact O-N 3.01Å
476	E	72.6	Confident	76.7	Confident	98 Å²	98	96.4 Å²	96.4	46%	0.458	50%	0.503	S	S	.	.	H	α-helix	trans	-106.5	-11.8	-173.6	-61.7	174.1	-172.7	0	0	112.9	W471 Q472	W471-E476 WeakPolarHBondContact CA-OE2 3.43Å; Q472-E476 PolarHBondContact N-OE2 3.22Å; Q472-E476 VanDerWaalsContact N-OE2 3.16Å; Q472-E476 WeakPolarHBondContact O-CB 3.33Å; Q472-E476 PolarHBondContact O-N 3.47Å
477	E	76.8	Confident	76.7	Confident	54 Å²	54	91.6 Å²	91.6	25%	0.252	48%	0.484	S	S	.	.			trans	-90	118.7	172.1	-157.3	-176.1	164.2	0	0	109.2	W471 P473 Y479 N488 K489	W471-E477 HydrophobicContact CZ2-CB 4.05Å; W471-E477 HydrophobicContact CZ2-CG 4.25Å; P473-E477 WeakPolarHBondContact O-CB 3.37Å; P473-E477 PolarHBondContact O-N 3.07Å; P473-E477 VanDerWaalsContact O-N 3.09Å; E477-Y479 HydrophobicContact CB-CE2 4.29Å; E477-Y479 HydrophobicContact CG-CE2 3.77Å; E477-Y479 PolarHBondContact OE1-OH 3.4Å; E477-N488 CarbonylContact O-C 3.58Å; E477-N488 WeakPolarHBondContact O-CA 3.5Å; E477-K489 HydrophobicContact CB-CB 4.3Å; E477-K489 PolarHBondContact O-N 3.01Å; E477-K489 IonicContact OE1-NZ 2.95Å; E477-K489 WeakPolarHBondContact OE2-CD 3.36Å; E477-K489 IonicContact OE2-NZ 2.79Å; E477-K489 PolarHBondContact OE2-NZ 2.87Å
478	E	82.8	Confident	77	Confident	150 Å²	150	91.7 Å²	91.7	70%	0.701	48%	0.478	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-97.4	132.8	-176.7	-69.7	-178	170.2	0	0	111.1	V486	E478-V486 HydrophobicContact CB-CG1 3.64Å; E478-V486 HydrophobicContact CG-CG1 3.96Å
479	Y	77.4	Confident	77.3	Confident	79 Å²	79	89.3 Å²	89.3	31%	0.31	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.3	142.6	176.5	-76	-103.9	0	0	0	109.3	E477 V487 K489 Y492	E477-Y479 HydrophobicContact CB-CE2 4.29Å; E477-Y479 HydrophobicContact CG-CE2 3.77Å; E477-Y479 PolarHBondContact OE1-OH 3.4Å; Y479-V487 PolarHBondContact N-O 3.47Å; Y479-V487 PolarHBondContact O-N 3.11Å; Y479-K489 HydrophobicContact CD2-CB 3.7Å; Y479-K489 HydrophobicContact CD2-CG 3.98Å; Y479-K489 HydrophobicContact CE2-CB 3.6Å; Y479-K489 HydrophobicContact CE2-CD 3.92Å; Y479-K489 HydrophobicContact CE2-CG 3.51Å; Y479-Y492 HydrophobicContact CD1-CD1 4.26Å; Y479-Y492 HydrophobicContact CD1-CE1 4.38Å; Y479-Y492 HydrophobicContact CG-CD1 4.32Å; Y479-Y492 HydrophobicContact CG-CG 4.26Å
480	E	79.6	Confident	77.6	Confident	133 Å²	133	87.4 Å²	87.4	62%	0.621	45%	0.445	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-98.4	130.4	177.8	-165	177.8	171.8	0	0	109.9	G484 N485	E480-G484 WeakPolarHBondContact OE1-CA 3.38Å; E480-N485 WeakPolarHBondContact CA-O 3.49Å
481	D	76.9	Confident	77.8	Confident	25 Å²	25	81.1 Å²	81.1	13%	0.134	43%	0.428	C	S	.	.			trans	-77.4	170	173.2	75.2	16.3	0	0	0	112.2	S483 G484 N485 L501	D481-S483 PolarHBondContact O-N 3.5Å; D481-S483 VanDerWaalsContact O-N 3.08Å; D481-S483 VanDerWaalsContact OD1-CA 3.24Å; D481-S483 WeakPolarHBondContact OD1-CA 3.35Å; D481-S483 WeakPolarHBondContact OD1-CB 3.41Å; D481-S483 PolarHBondContact OD1-N 2.89Å; D481-G484 PolarHBondContact O-N 2.91Å; D481-G484 PolarHBondContact OD1-N 2.99Å; D481-N485 PolarHBondContact N-O 3.25Å; D481-N485 PolarHBondContact OD1-N 3.35Å; D481-N485 PolarHBondContact OD1-ND2 2.97Å; D481-N485 WeakPolarHBondContact OD2-CB 3.43Å; D481-N485 PolarHBondContact OD2-ND2 3.42Å; D481-L501 HydrophobicContact CB-CD2 3.62Å
482	S	77.1	Confident	78.2	Confident	102 Å²	102	76.8 Å²	76.8	71%	0.713	41%	0.412	S	S	*	.	T	Hydrogen-bonded Turn	trans	-66.9	-7.4	178.9	53.1	0	0	0	0	114.4	L501	S482-L501 PolarHBondContact OG-OXT 3.37Å
483	S	75.3	Confident	78.7	Confident	97 Å²	97	75.6 Å²	75.6	68%	0.678	41%	0.406	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.8	1.2	174.1	-56.1	0	0	0	0	112.5	D481	D481-S483 PolarHBondContact O-N 3.5Å; D481-S483 VanDerWaalsContact O-N 3.08Å; D481-S483 VanDerWaalsContact OD1-CA 3.24Å; D481-S483 WeakPolarHBondContact OD1-CA 3.35Å; D481-S483 WeakPolarHBondContact OD1-CB 3.41Å; D481-S483 PolarHBondContact OD1-N 2.89Å
484	G	76.4	Confident	79.3	Confident	37 Å²	37	76.6 Å²	76.6	38%	0.381	41%	0.41	S	S	.	.	S	Bend	trans	82.5	14	179.2	0	0	0	0	0	114.9	E480 D481	E480-G484 WeakPolarHBondContact OE1-CA 3.38Å; D481-G484 PolarHBondContact O-N 2.91Å; D481-G484 PolarHBondContact OD1-N 2.99Å
485	N	80.6	Confident	79.8	Confident	91 Å²	91	74.6 Å²	74.6	49%	0.487	40%	0.399	S	S	.	.			trans	-86.9	135.5	175.7	-49.4	-62.4	0	0	0	110.5	E480 D481	E480-N485 WeakPolarHBondContact CA-O 3.49Å; D481-N485 PolarHBondContact N-O 3.25Å; D481-N485 PolarHBondContact OD1-N 3.35Å; D481-N485 PolarHBondContact OD1-ND2 2.97Å; D481-N485 WeakPolarHBondContact OD2-CB 3.43Å; D481-N485 PolarHBondContact OD2-ND2 3.42Å
486	V	82.6	Confident	80.3	Confident	87 Å²	87	77.8 Å²	77.8	53%	0.527	41%	0.406	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.1	120.5	178.1	-175.4	0	0	0	0	109.6	E478	E478-V486 HydrophobicContact CB-CG1 3.64Å; E478-V486 HydrophobicContact CG-CG1 3.96Å
487	V	82.6	Confident	80.9	Confident	30 Å²	30	82.1 Å²	82.1	18%	0.182	42%	0.419	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.3	149.2	177.6	-70.5	0	0	0	0	109.8	Y479 T491 Y492	Y479-V487 PolarHBondContact N-O 3.47Å; Y479-V487 PolarHBondContact O-N 3.11Å; V487-T491 HydrophobicContact CB-CG2 4.4Å; V487-T491 HydrophobicContact CG1-CG2 4.49Å; V487-Y492 HydrophobicContact CG2-CD2 3.85Å; V487-Y492 HydrophobicContact CG2-CG 4.36Å
488	N	84.8	Confident	81.2	Confident	52 Å²	52	86 Å²	86	28%	0.278	44%	0.436	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-65.7	156.3	174.5	68.1	34.2	0	0	0	110.8	E477 K490 T491 Y492	E477-N488 CarbonylContact O-C 3.58Å; E477-N488 WeakPolarHBondContact O-CA 3.5Å; N488-K490 VanDerWaalsContact C-N 3.27Å; N488-K490 PolarHBondContact O-N 3.25Å; N488-K490 PolarHBondContact OD1-N 3.29Å; N488-T491 PolarHBondContact O-N 3.47Å; N488-T491 VanDerWaalsContact O-N 3.14Å; N488-T491 WeakPolarHBondContact OD1-CB 3.47Å; N488-T491 PolarHBondContact OD1-N 3.41Å; N488-T491 PolarHBondContact OD1-OG1 3.01Å; N488-Y492 PolarHBondContact O-N 2.96Å
489	K	82.7	Confident	81	Confident	40 Å²	40	81.8 Å²	81.8	17%	0.174	43%	0.434	C	S	.	.	H	α-helix	trans	-51.3	-43.6	-177.3	-174.9	-177.8	-159.3	162.1	0	113.5	E477 Y479 Y492 E493	E477-K489 HydrophobicContact CB-CB 4.3Å; E477-K489 PolarHBondContact O-N 3.01Å; E477-K489 IonicContact OE1-NZ 2.95Å; E477-K489 WeakPolarHBondContact OE2-CD 3.36Å; E477-K489 IonicContact OE2-NZ 2.79Å; E477-K489 PolarHBondContact OE2-NZ 2.87Å; Y479-K489 HydrophobicContact CD2-CB 3.7Å; Y479-K489 HydrophobicContact CD2-CG 3.98Å; Y479-K489 HydrophobicContact CE2-CB 3.6Å; Y479-K489 HydrophobicContact CE2-CD 3.92Å; Y479-K489 HydrophobicContact CE2-CG 3.51Å; K489-Y492 PolarHBondContact O-N 3.17Å; K489-E493 HydrophobicContact CG-CG 4.49Å; K489-E493 WeakPolarHBondContact O-CB 3.41Å; K489-E493 WeakPolarHBondContact O-CG 3.42Å; K489-E493 PolarHBondContact O-N 3.33Å
490	K	83.3	Confident	80.6	Confident	117 Å²	117	83.7 Å²	83.7	51%	0.509	45%	0.448	S	S	.	.	H	α-helix	trans	-63.2	-46.5	-179.3	-174.4	177.3	180	-179.8	0	111.8	D474 N488 Y492 E493 D494	D474-K490 HydrophobicContact CB-CB 4.26Å; D474-K490 VanDerWaalsContact O-CB 3.29Å; D474-K490 WeakPolarHBondContact O-CB 3.18Å; D474-K490 PolarHBondContact O-N 3.44Å; D474-K490 VanDerWaalsContact O-N 3.11Å; N488-K490 VanDerWaalsContact C-N 3.27Å; N488-K490 PolarHBondContact O-N 3.25Å; N488-K490 PolarHBondContact OD1-N 3.29Å; K490-Y492 VanDerWaalsContact C-N 3.34Å; K490-E493 PolarHBondContact O-N 3.03Å; K490-D494 WeakPolarHBondContact O-CB 3.39Å; K490-D494 PolarHBondContact O-N 3.03Å
491	T	82.3	Confident	80	Confident	58 Å²	58	80.9 Å²	80.9	36%	0.356	44%	0.437	S	S	.	.	H	α-helix	trans	-66.2	-38.4	176.9	-60.2	0	0	0	0	111	V487 N488 D494 L495	V487-T491 HydrophobicContact CB-CG2 4.4Å; V487-T491 HydrophobicContact CG1-CG2 4.49Å; N488-T491 PolarHBondContact O-N 3.47Å; N488-T491 VanDerWaalsContact O-N 3.14Å; N488-T491 WeakPolarHBondContact OD1-CB 3.47Å; N488-T491 PolarHBondContact OD1-N 3.41Å; N488-T491 PolarHBondContact OD1-OG1 3.01Å; T491-D494 PolarHBondContact O-N 3.1Å; T491-L495 HydrophobicContact CG2-CD1 3.81Å; T491-L495 HydrophobicContact CG2-CG 4.2Å; T491-L495 WeakPolarHBondContact O-CB 3.44Å; T491-L495 WeakPolarHBondContact O-CG 2.87Å; T491-L495 PolarHBondContact O-N 3.18Å
492	Y	82.7	Confident	80.1	Confident	58 Å²	58	83.7 Å²	83.7	23%	0.227	45%	0.452	C	S	.	.	H	α-helix	trans	-61.1	-49	173.5	-172.7	-93.2	0	0	0	111.7	Y479 V487 N488 K489 K490 D494 L495 K496 L501	Y479-Y492 HydrophobicContact CD1-CD1 4.26Å; Y479-Y492 HydrophobicContact CD1-CE1 4.38Å; Y479-Y492 HydrophobicContact CG-CD1 4.32Å; Y479-Y492 HydrophobicContact CG-CG 4.26Å; V487-Y492 HydrophobicContact CG2-CD2 3.85Å; V487-Y492 HydrophobicContact CG2-CG 4.36Å; N488-Y492 PolarHBondContact O-N 2.96Å; K489-Y492 PolarHBondContact O-N 3.17Å; K490-Y492 VanDerWaalsContact C-N 3.34Å; Y492-D494 VanDerWaalsContact C-N 3.35Å; Y492-D494 PolarHBondContact O-N 3.02Å; Y492-L495 PolarHBondContact O-N 3.47Å; Y492-K496 HydrophobicContact CE1-CD 4.38Å; Y492-K496 VanDerWaalsContact O-CB 3.25Å; Y492-K496 WeakPolarHBondContact O-CB 3.36Å; Y492-K496 PolarHBondContact O-N 3.42Å; Y492-L501 HydrophobicContact CD1-CD1 4.15Å; Y492-L501 HydrophobicContact CD2-CD1 3.47Å; Y492-L501 VanDerWaalsContact CD2-CD1 3.47Å; Y492-L501 HydrophobicContact CD2-CD2 4.37Å; Y492-L501 HydrophobicContact CE1-CD1 4.21Å; Y492-L501 HydrophobicContact CE2-CD1 3.55Å; Y492-L501 HydrophobicContact CE2-CD2 4.43Å; Y492-L501 HydrophobicContact CG-CD1 3.78Å; Y492-L501 WeakPolarHBondContact O-CD1 3.08Å
493	E	82.8	Confident	80.3	Confident	75 Å²	75	82.7 Å²	82.7	35%	0.35	44%	0.439	S	S	.	.	H	α-helix	trans	-64.3	-38.2	178.4	-73.9	-171.6	-168.3	0	0	112.7	K489 K490 K496 R497	K489-E493 HydrophobicContact CG-CG 4.49Å; K489-E493 WeakPolarHBondContact O-CB 3.41Å; K489-E493 WeakPolarHBondContact O-CG 3.42Å; K489-E493 PolarHBondContact O-N 3.33Å; K490-E493 PolarHBondContact O-N 3.03Å; E493-K496 PolarHBondContact O-N 2.94Å; E493-R497 WeakPolarHBondContact O-CB 2.97Å; E493-R497 VanDerWaalsContact O-CG 3.25Å; E493-R497 WeakPolarHBondContact O-CG 3.29Å; E493-R497 PolarHBondContact O-N 3.47Å; E493-R497 IonicContact OE2-NH2 2.73Å
494	D	84.3	Confident	80.6	Confident	65 Å²	65	81.9 Å²	81.9	35%	0.348	43%	0.425	S	S	.	.	H	α-helix	trans	-68.4	-43.4	177	-77.2	-19.6	0	0	0	111.7	K490 T491 Y492 K496 R497 Q498	K490-D494 WeakPolarHBondContact O-CB 3.39Å; K490-D494 PolarHBondContact O-N 3.03Å; T491-D494 PolarHBondContact O-N 3.1Å; Y492-D494 VanDerWaalsContact C-N 3.35Å; Y492-D494 PolarHBondContact O-N 3.02Å; D494-K496 VanDerWaalsContact C-N 3.33Å; D494-R497 PolarHBondContact O-N 3.09Å; D494-Q498 VanDerWaalsContact O-CG 3.28Å; D494-Q498 WeakPolarHBondContact O-CG 3.49Å; D494-Q498 PolarHBondContact O-N 3.19Å
495	L	81.4	Confident	80.8	Confident	47 Å²	47	84.5 Å²	84.5	25%	0.246	43%	0.428	C	S	.	.	H	α-helix	trans	-66	-37.1	175	-68.6	169.7	0	0	0	111.4	T491 Y492 Q498 G499 L500 L501	T491-L495 HydrophobicContact CG2-CD1 3.81Å; T491-L495 HydrophobicContact CG2-CG 4.2Å; T491-L495 WeakPolarHBondContact O-CB 3.44Å; T491-L495 WeakPolarHBondContact O-CG 2.87Å; T491-L495 PolarHBondContact O-N 3.18Å; Y492-L495 PolarHBondContact O-N 3.47Å; L495-Q498 CarbonylContact O-C 3.46Å; L495-Q498 PolarHBondContact O-N 2.8Å; L495-G499 PolarHBondContact O-N 3.34Å; L495-L500 HydrophobicContact CD2-CB 4.15Å; L495-L500 HydrophobicContact CD2-CD1 4.15Å; L495-L500 PolarHBondContact O-N 3.09Å; L495-L501 HydrophobicContact CB-CD1 3.78Å; L495-L501 HydrophobicContact CB-CD2 3.98Å; L495-L501 HydrophobicContact CB-CG 3.54Å; L495-L501 HydrophobicContact CD1-CD2 4.06Å
496	K	81.1	Confident	80.8	Confident	138 Å²	138	84.1 Å²	84.1	60%	0.6	42%	0.424	S	S	*	.	H	α-helix	trans	-61.2	-44.5	173.4	-169.5	174	179.5	177.3	0	111.3	Y492 E493 D494 Q498 G499 L501	Y492-K496 HydrophobicContact CE1-CD 4.38Å; Y492-K496 VanDerWaalsContact O-CB 3.25Å; Y492-K496 WeakPolarHBondContact O-CB 3.36Å; Y492-K496 PolarHBondContact O-N 3.42Å; E493-K496 PolarHBondContact O-N 2.94Å; D494-K496 VanDerWaalsContact C-N 3.33Å; K496-Q498 VanDerWaalsContact C-N 3.3Å; K496-Q498 PolarHBondContact O-N 3.42Å; K496-G499 PolarHBondContact O-N 3.2Å; K496-L501 HydrophobicContact CB-CD1 3.92Å
497	R	85.1	Confident	80.7	Confident	190 Å²	190	83.9 Å²	83.9	72%	0.717	42%	0.418	S	S	*	.	H	α-helix	trans	-67.9	-29.9	178.1	-74.7	173.6	-170	173	9.6	112.6	E493 D494 G499	E493-R497 WeakPolarHBondContact O-CB 2.97Å; E493-R497 VanDerWaalsContact O-CG 3.25Å; E493-R497 WeakPolarHBondContact O-CG 3.29Å; E493-R497 PolarHBondContact O-N 3.47Å; E493-R497 IonicContact OE2-NH2 2.73Å; D494-R497 PolarHBondContact O-N 3.09Å; R497-G499 VanDerWaalsContact C-N 3.3Å
498	Q	83.5	Confident	80.6	Confident	134 Å²	134	87.8 Å²	87.8	63%	0.626	43%	0.434	S	S	*	.	H	α-helix	trans	-81.6	-7.7	174.5	-68.1	173	34.2	0	0	113.3	D494 L495 K496 L500	D494-Q498 VanDerWaalsContact O-CG 3.28Å; D494-Q498 WeakPolarHBondContact O-CG 3.49Å; D494-Q498 PolarHBondContact O-N 3.19Å; L495-Q498 CarbonylContact O-C 3.46Å; L495-Q498 PolarHBondContact O-N 2.8Å; K496-Q498 VanDerWaalsContact C-N 3.3Å; K496-Q498 PolarHBondContact O-N 3.42Å; Q498-L500 HydrophobicContact CB-CD1 3.9Å; Q498-L500 HydrophobicContact CB-CG 4.08Å
499	G	78.8	Confident	80.3	Confident	62 Å²	62	90.5 Å²	90.5	64%	0.639	45%	0.446	S	S	*	.	T	Hydrogen-bonded Turn	trans	74	25.3	-179.5	0	0	0	0	0	114	L495 K496 R497	L495-G499 PolarHBondContact O-N 3.34Å; K496-G499 PolarHBondContact O-N 3.2Å; R497-G499 VanDerWaalsContact C-N 3.3Å
500	L	69.4	Low	80.1	Confident	119 Å²	119	94.8 Å²	94.8	62%	0.623	47%	0.469	S	S	*	.			trans	-103.2	7.2	-174.3	-65.3	172.5	0	0	0	113.6	L495 Q498	L495-L500 HydrophobicContact CD2-CB 4.15Å; L495-L500 HydrophobicContact CD2-CD1 4.15Å; L495-L500 PolarHBondContact O-N 3.09Å; Q498-L500 HydrophobicContact CB-CD1 3.9Å; Q498-L500 HydrophobicContact CB-CG 4.08Å
501	L	66.3	Low	79.8	Confident	74 Å²	74	92.7 Å²	92.7	39%	0.387	47%	0.465	S	S	.	.			trans	-112.2	0	176.2	-69.2	175.4	0	0	0	111.9	D481 S482 Y492 L495 K496	D481-L501 HydrophobicContact CB-CD2 3.62Å; S482-L501 PolarHBondContact OG-OXT 3.37Å; Y492-L501 HydrophobicContact CD1-CD1 4.15Å; Y492-L501 HydrophobicContact CD2-CD1 3.47Å; Y492-L501 VanDerWaalsContact CD2-CD1 3.47Å; Y492-L501 HydrophobicContact CD2-CD2 4.37Å; Y492-L501 HydrophobicContact CE1-CD1 4.21Å; Y492-L501 HydrophobicContact CE2-CD1 3.55Å; Y492-L501 HydrophobicContact CE2-CD2 4.43Å; Y492-L501 HydrophobicContact CG-CD1 3.78Å; Y492-L501 WeakPolarHBondContact O-CD1 3.08Å; L495-L501 HydrophobicContact CB-CD1 3.78Å; L495-L501 HydrophobicContact CB-CD2 3.98Å; L495-L501 HydrophobicContact CB-CG 3.54Å; L495-L501 HydrophobicContact CD1-CD2 4.06Å; K496-L501 HydrophobicContact CB-CD1 3.92Å

Retrieved 501 of 501 residues in 2671.1 ms (Link to these results)

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