A0A077Z137_TRITR Loading...

Signal recognition particle 54 kDa protein

Component of the signal recognition particle (SRP) complex, a ribonucleoprotein complex that mediates the cotranslational targeting of secretory and membrane proteins to the endoplasmic reticulum (ER). As part of the SRP complex, associates with the SRP receptor (SR) component SRPRA to target secretory proteins to the endoplasmic reticulum membrane. Binds to the signal sequence of presecretory proteins when they emerge from the ribosomes. Displays basal GTPase activity, and stimulates reciprocal GTPase activation of the SR subunit SRPRA. Forms a guanosine 5'-triphosphate (GTP)-dependent complex with the SR subunit SRPRA. SR compaction and GTPase mediated rearrangement of SR drive SRP-mediated cotranslational protein translocation into the ER. Requires the presence of SRP9/SRP14 and/or SRP19 to stably interact with RNA. Plays a role in proliferation and differentiation of granulocytic cells, neutrophils migration capacity and exocrine pancreas development.

AlphaFold DB , UniProt , Accession A0A077Z137, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 498 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

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	47.1	Very low	68.2	Low	109 Å²	109	53.5 Å²	53.5	54%	0.537	25%	0.25	S	S	.	.				0	131.6	0	-73.4	174	-170.9	0	0	109.2	L3 A4 E5	M1-L3 VanDerWaalsContact C-N 3.29Å; M1-L3 PolarHBondContact O-N 3.43Å; M1-A4 HydrophobicContact CB-CB 4.37Å; M1-A4 WeakPolarHBondContact O-CA 3.46Å; M1-A4 VanDerWaalsContact O-CB 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.49Å; M1-A4 PolarHBondContact O-N 3.41Å; M1-E5 PolarHBondContact O-N 3Å
2	V	49.3	Very low	69.4	Low	21 Å²	21	57.3 Å²	57.3	13%	0.127	27%	0.274	C	S	.	.	H	α-helix	trans	-71.4	-23.8	-177.1	174.9	0	0	0	0	112.8	A4 E5 L6 H253 A254 R255	V2-A4 PolarHBondContact O-N 3.29Å; V2-E5 WeakPolarHBondContact O-CB 3.31Å; V2-E5 PolarHBondContact O-N 3.1Å; V2-L6 PolarHBondContact O-N 2.92Å; V2-H253 WeakPolarHBondContact CB-O 3.37Å; V2-H253 VanDerWaalsContact CG2-C 3.48Å; V2-H253 HydrophobicContact CG2-CB 3.81Å; V2-H253 WeakPolarHBondContact CG2-O 3.45Å; V2-A254 WeakPolarHBondContact CB-O 3.25Å; V2-R255 HydrophobicContact CB-CG 4.47Å; V2-R255 HydrophobicContact CG1-CB 4.13Å; V2-R255 HydrophobicContact CG1-CG 3.45Å; V2-R255 VanDerWaalsContact CG1-CG 3.45Å
3	L	59.6	Low	70.4	Confident	29 Å²	29	52.9 Å²	52.9	15%	0.152	25%	0.253	C	S	.	.	H	α-helix	trans	-56.8	-35.9	163.8	-73.4	173.8	0	0	0	112.9	M1 E5 G7 L250 F290 L294	M1-L3 VanDerWaalsContact C-N 3.29Å; M1-L3 PolarHBondContact O-N 3.43Å; L3-E5 VanDerWaalsContact C-N 3.35Å; L3-G7 PolarHBondContact O-N 3Å; L3-L250 HydrophobicContact CD1-CD2 4.14Å; L3-F290 HydrophobicContact CD1-CE2 4.11Å; L3-F290 HydrophobicContact CD2-CE2 4.42Å; L3-F290 HydrophobicContact CD2-CZ 4.08Å; L3-L294 HydrophobicContact CD2-CD1 4.17Å
4	A	63	Low	71	Confident	39 Å²	39	50.4 Å²	50.4	32%	0.322	24%	0.241	S	C	.	.	H	α-helix	trans	-72.5	-30.9	175.7	0	0	0	0	0	111.6	M1 V2 R8	M1-A4 HydrophobicContact CB-CB 4.37Å; M1-A4 WeakPolarHBondContact O-CA 3.46Å; M1-A4 VanDerWaalsContact O-CB 3.27Å; M1-A4 WeakPolarHBondContact O-CB 3.49Å; M1-A4 PolarHBondContact O-N 3.41Å; V2-A4 PolarHBondContact O-N 3.29Å; A4-R8 WeakPolarHBondContact O-CB 3.45Å; A4-R8 PolarHBondContact O-N 3.25Å
5	E	68.5	Low	71.4	Confident	78 Å²	78	48.6 Å²	48.6	36%	0.364	24%	0.241	S	C	.	.	H	α-helix	trans	-71.7	-47.1	174.4	-178.8	168.4	-161.9	0	0	112.1	M1 V2 L3 G7 R8 K9	M1-E5 PolarHBondContact O-N 3Å; V2-E5 WeakPolarHBondContact O-CB 3.31Å; V2-E5 PolarHBondContact O-N 3.1Å; L3-E5 VanDerWaalsContact C-N 3.35Å; E5-G7 VanDerWaalsContact C-N 3.28Å; E5-G7 PolarHBondContact O-N 3.37Å; E5-R8 WeakPolarHBondContact O-CB 3.3Å; E5-R8 PolarHBondContact O-N 2.99Å; E5-R8 IonicContact OE1-NH2 3.84Å; E5-K9 PolarHBondContact O-N 2.82Å
6	L	73.7	Confident	71.9	Confident	11 Å²	11	48.1 Å²	48.1	6%	0.058	24%	0.244	C	C	.	.	H	α-helix	trans	-55.2	-48.4	171.3	174.9	58.6	0	0	0	110	V2 R8 K9 I10 A38 L39 A42 L294	V2-L6 PolarHBondContact O-N 2.92Å; L6-R8 VanDerWaalsContact C-N 3.32Å; L6-R8 PolarHBondContact O-N 2.89Å; L6-K9 PolarHBondContact O-N 3.41Å; L6-I10 HydrophobicContact CD1-CD1 3.68Å; L6-I10 HydrophobicContact CD1-CG1 4.07Å; L6-I10 HydrophobicContact CG-CD1 3.85Å; L6-I10 WeakPolarHBondContact O-CG1 3.41Å; L6-I10 PolarHBondContact O-N 3.45Å; L6-A38 HydrophobicContact CD1-CB 3.9Å; L6-A38 VanDerWaalsContact CD1-O 3.31Å; L6-A38 WeakPolarHBondContact CD1-O 3.49Å; L6-L39 HydrophobicContact CD1-CD2 4.36Å; L6-A42 HydrophobicContact CD1-CB 3.97Å; L6-A42 HydrophobicContact CD2-CB 3.78Å; L6-A42 HydrophobicContact CG-CB 4.33Å; L6-L294 HydrophobicContact CD2-CD1 3.7Å; L6-L294 HydrophobicContact CD2-CG 4.27Å; L6-L294 HydrophobicContact CG-CD1 4.47Å
7	G	74.3	Confident	72.2	Confident	3 Å²	3	45.4 Å²	45.4	3%	0.031	23%	0.23	C	C	.	.	H	α-helix	trans	-65.7	-33.2	179.2	0	0	0	0	0	113.9	L3 E5 R11 L294	L3-G7 PolarHBondContact O-N 3Å; E5-G7 VanDerWaalsContact C-N 3.28Å; E5-G7 PolarHBondContact O-N 3.37Å; G7-R11 WeakPolarHBondContact O-CB 3.37Å; G7-R11 PolarHBondContact O-N 2.72Å; G7-L294 WeakPolarHBondContact CA-O 3.37Å
8	R	76.6	Confident	72.1	Confident	124 Å²	124	46.1 Å²	46.1	47%	0.468	24%	0.24	S	C	.	.	H	α-helix	trans	-66.4	-44.2	171.2	-178.6	-179.6	59.5	173	-1.2	111.5	A4 E5 L6 R11 N12	A4-R8 WeakPolarHBondContact O-CB 3.45Å; A4-R8 PolarHBondContact O-N 3.25Å; E5-R8 WeakPolarHBondContact O-CB 3.3Å; E5-R8 PolarHBondContact O-N 2.99Å; E5-R8 IonicContact OE1-NH2 3.84Å; L6-R8 VanDerWaalsContact C-N 3.32Å; L6-R8 PolarHBondContact O-N 2.89Å; R8-R11 PolarHBondContact O-N 3.39Å; R8-N12 WeakPolarHBondContact O-CB 3.34Å; R8-N12 PolarHBondContact O-N 2.94Å; R8-N12 PolarHBondContact O-ND2 3.39Å; R8-N12 PolarHBondContact O-OD1 3.48Å
9	K	81.1	Confident	72.3	Confident	65 Å²	65	51.8 Å²	51.8	28%	0.283	27%	0.265	S	S	.	.	H	α-helix	trans	-63.1	-46.5	177.4	-73.5	-176.1	175.8	-178.7	0	111.6	E5 L6 R11 N12 A13 A38 E41	E5-K9 PolarHBondContact O-N 2.82Å; L6-K9 PolarHBondContact O-N 3.41Å; K9-R11 PolarHBondContact O-N 2.96Å; K9-N12 PolarHBondContact O-N 3.36Å; K9-A13 WeakPolarHBondContact O-CB 3.31Å; K9-A13 PolarHBondContact O-N 3.34Å; K9-A38 HydrophobicContact CB-CB 3.73Å; K9-A38 HydrophobicContact CD-CB 4.28Å; K9-E41 VanDerWaalsContact CD-OE2 3.29Å; K9-E41 WeakPolarHBondContact CD-OE2 3.47Å; K9-E41 WeakPolarHBondContact CE-OE2 3.39Å; K9-E41 IonicContact NZ-OE1 3.34Å; K9-E41 PolarHBondContact NZ-OE1 3.34Å; K9-E41 IonicContact NZ-OE2 3.43Å; K9-E41 PolarHBondContact NZ-OE2 2.88Å
10	I	79	Confident	72.5	Confident	0 Å²	0	50.3 Å²	50.3	0%	0	26%	0.261	C	S	.	.	H	α-helix	trans	-64.1	-41.8	176	-64.4	170.8	0	0	0	110.7	L6 N12 A13 I14 V35 A38 L39 L294 L295	L6-I10 HydrophobicContact CD1-CD1 3.68Å; L6-I10 HydrophobicContact CD1-CG1 4.07Å; L6-I10 HydrophobicContact CG-CD1 3.85Å; L6-I10 WeakPolarHBondContact O-CG1 3.41Å; L6-I10 PolarHBondContact O-N 3.45Å; I10-N12 VanDerWaalsContact C-N 3.33Å; I10-N12 PolarHBondContact O-N 2.95Å; I10-A13 PolarHBondContact O-N 3.32Å; I10-I14 HydrophobicContact CG2-CD1 3.69Å; I10-I14 HydrophobicContact CG2-CG1 4.25Å; I10-I14 WeakPolarHBondContact O-CB 3.33Å; I10-I14 WeakPolarHBondContact O-CG1 3.11Å; I10-I14 PolarHBondContact O-N 3.37Å; I10-V35 HydrophobicContact CG2-CG2 4.39Å; I10-A38 HydrophobicContact CG1-CB 4.22Å; I10-L39 HydrophobicContact CD1-CD2 4.34Å; I10-L294 HydrophobicContact CD1-CD2 3.58Å; I10-L294 HydrophobicContact CD1-CG 4.5Å; I10-L295 HydrophobicContact CG2-CD2 3.42Å; I10-L295 VanDerWaalsContact CG2-CD2 3.42Å
11	R	77.8	Confident	72.6	Confident	109 Å²	109	54.5 Å²	54.5	41%	0.411	29%	0.289	S	S	.	.	H	α-helix	trans	-62.1	-40.4	176	-172.4	-169.2	-49.9	-165.2	7	112	G7 R8 K9 I14 G15	G7-R11 WeakPolarHBondContact O-CB 3.37Å; G7-R11 PolarHBondContact O-N 2.72Å; R8-R11 PolarHBondContact O-N 3.39Å; K9-R11 PolarHBondContact O-N 2.96Å; R11-I14 PolarHBondContact O-N 3.02Å; R11-G15 WeakPolarHBondContact O-CA 3.48Å; R11-G15 PolarHBondContact O-N 2.88Å
12	N	82.8	Confident	74.1	Confident	100 Å²	100	55.6 Å²	55.6	54%	0.535	30%	0.295	S	S	.	.	H	α-helix	trans	-65.4	-43.8	175.8	-69.3	-10	0	0	0	110.9	R8 K9 I10 I14 G15 S16	R8-N12 WeakPolarHBondContact O-CB 3.34Å; R8-N12 PolarHBondContact O-N 2.94Å; R8-N12 PolarHBondContact O-ND2 3.39Å; R8-N12 PolarHBondContact O-OD1 3.48Å; K9-N12 PolarHBondContact O-N 3.36Å; I10-N12 VanDerWaalsContact C-N 3.33Å; I10-N12 PolarHBondContact O-N 2.95Å; N12-I14 PolarHBondContact O-N 2.92Å; N12-G15 CarbonylContact O-C 3.54Å; N12-G15 WeakPolarHBondContact O-CA 3.35Å; N12-G15 PolarHBondContact O-N 2.98Å; N12-G15 VanDerWaalsContact O-N 3.15Å; N12-S16 PolarHBondContact O-N 3.33Å
13	A	82.8	Confident	75.5	Confident	0 Å²	0	55.5 Å²	55.5	0%	0	29%	0.294	C	S	.	.	H	α-helix	trans	-60.9	-45.7	175.7	0	0	0	0	0	111.8	K9 I10 G15 S16 M31 E34 V35	K9-A13 WeakPolarHBondContact O-CB 3.31Å; K9-A13 PolarHBondContact O-N 3.34Å; I10-A13 PolarHBondContact O-N 3.32Å; A13-G15 VanDerWaalsContact C-N 3.32Å; A13-G15 PolarHBondContact O-N 2.94Å; A13-S16 WeakPolarHBondContact O-CB 3.22Å; A13-S16 PolarHBondContact O-N 3.22Å; A13-S16 PolarHBondContact O-OG 3.08Å; A13-M31 HydrophobicContact CB-CG 4.46Å; A13-M31 VanDerWaalsContact O-CG 3.28Å; A13-M31 WeakPolarHBondContact O-CG 3.38Å; A13-E34 VanDerWaalsContact CA-OE2 3.3Å; A13-E34 WeakPolarHBondContact CA-OE2 3.25Å; A13-E34 HydrophobicContact CB-CB 3.66Å; A13-E34 WeakPolarHBondContact CB-OE2 3.06Å; A13-V35 HydrophobicContact CB-CG2 3.79Å
14	I	78.5	Confident	76.6	Confident	18 Å²	18	57.2 Å²	57.2	9%	0.092	30%	0.303	C	S	.	.	H	α-helix	trans	-67.3	-35.3	174.7	-69.9	174.5	0	0	0	111.3	I10 R11 N12 S16 L17 Q76 L295	I10-I14 HydrophobicContact CG2-CD1 3.69Å; I10-I14 HydrophobicContact CG2-CG1 4.25Å; I10-I14 WeakPolarHBondContact O-CB 3.33Å; I10-I14 WeakPolarHBondContact O-CG1 3.11Å; I10-I14 PolarHBondContact O-N 3.37Å; R11-I14 PolarHBondContact O-N 3.02Å; N12-I14 PolarHBondContact O-N 2.92Å; I14-S16 VanDerWaalsContact C-N 3.3Å; I14-S16 PolarHBondContact O-N 2.97Å; I14-L17 WeakPolarHBondContact O-CB 3.4Å; I14-L17 PolarHBondContact O-N 3.49Å; I14-Q76 HydrophobicContact CG2-CG 3.53Å; I14-L295 HydrophobicContact CD1-CD2 3.95Å
15	G	77.1	Confident	77.7	Confident	23 Å²	23	60.7 Å²	60.7	24%	0.237	31%	0.313	C	S	.	.	H	α-helix	trans	-64.5	-32.3	176.2	0	0	0	0	0	112.6	R11 N12 A13 L17 S18 H19	R11-G15 WeakPolarHBondContact O-CA 3.48Å; R11-G15 PolarHBondContact O-N 2.88Å; N12-G15 CarbonylContact O-C 3.54Å; N12-G15 WeakPolarHBondContact O-CA 3.35Å; N12-G15 PolarHBondContact O-N 2.98Å; N12-G15 VanDerWaalsContact O-N 3.15Å; A13-G15 VanDerWaalsContact C-N 3.32Å; A13-G15 PolarHBondContact O-N 2.94Å; G15-L17 PolarHBondContact O-N 2.96Å; G15-S18 WeakPolarHBondContact O-CA 3.37Å; G15-S18 VanDerWaalsContact O-CB 3.27Å; G15-S18 WeakPolarHBondContact O-CB 3.36Å; G15-S18 PolarHBondContact O-N 3.41Å; G15-S18 PolarHBondContact O-OG 2.89Å; G15-H19 PolarHBondContact O-CD2 3.48Å; G15-H19 VanDerWaalsContact O-CD2 3.28Å
16	S	78.6	Confident	78.5	Confident	41 Å²	41	62.5 Å²	62.5	29%	0.287	33%	0.325	S	S	.	.	H	α-helix	trans	-56.7	-34.8	174.3	79.7	0	0	0	0	112.3	N12 A13 I14 S18 H19 A20	N12-S16 PolarHBondContact O-N 3.33Å; A13-S16 WeakPolarHBondContact O-CB 3.22Å; A13-S16 PolarHBondContact O-N 3.22Å; A13-S16 PolarHBondContact O-OG 3.08Å; I14-S16 VanDerWaalsContact C-N 3.3Å; I14-S16 PolarHBondContact O-N 2.97Å; S16-S18 PolarHBondContact O-N 3.3Å; S16-H19 PolarHBondContact O-N 3.44Å; S16-H19 VanDerWaalsContact O-N 3.13Å; S16-A20 PolarHBondContact O-N 3.24Å
17	L	77	Confident	79.1	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	33%	0.333	C	S	.	.	H	α-helix	trans	-64.4	-25.8	175	-60.5	173.3	0	0	0	112.9	I14 G15 H19 V27 M31 R72 I75	I14-L17 WeakPolarHBondContact O-CB 3.4Å; I14-L17 PolarHBondContact O-N 3.49Å; G15-L17 PolarHBondContact O-N 2.96Å; L17-H19 VanDerWaalsContact C-N 3.34Å; L17-V27 HydrophobicContact CD2-CG1 3.6Å; L17-M31 HydrophobicContact CD1-CE 3.98Å; L17-M31 HydrophobicContact CD1-CG 4.02Å; L17-M31 HydrophobicContact CD2-CB 4.03Å; L17-M31 HydrophobicContact CD2-CG 4.19Å; L17-M31 HydrophobicContact CG-CB 4.34Å; L17-M31 HydrophobicContact CG-CG 3.96Å; L17-R72 PolarHBondContact O-NE 3.14Å; L17-I75 HydrophobicContact CD1-CB 4.36Å; L17-I75 HydrophobicContact CD1-CG2 3.78Å
18	S	71.8	Confident	79.7	Confident	58 Å²	58	63.8 Å²	63.8	41%	0.406	33%	0.332	S	S	.	.	H	α-helix	trans	-74.5	-27.7	177.7	79.5	0	0	0	0	112.4	G15 S16 R72	G15-S18 WeakPolarHBondContact O-CA 3.37Å; G15-S18 VanDerWaalsContact O-CB 3.27Å; G15-S18 WeakPolarHBondContact O-CB 3.36Å; G15-S18 PolarHBondContact O-N 3.41Å; G15-S18 PolarHBondContact O-OG 2.89Å; S16-S18 PolarHBondContact O-N 3.3Å; S18-R72 PolarHBondContact O-NH1 3.27Å; S18-R72 PolarHBondContact O-NH2 2.93Å; S18-R72 VanDerWaalsContact O-NH2 3.16Å
19	H	75.3	Confident	80.3	Confident	156 Å²	156	59.8 Å²	59.8	72%	0.722	32%	0.32	S	S	*	.	H	α-helix	trans	-84.2	-24.8	178.4	-61.3	-62.5	0	0	0	113	G15 S16 L17 T21	G15-H19 PolarHBondContact O-CD2 3.48Å; G15-H19 VanDerWaalsContact O-CD2 3.28Å; S16-H19 PolarHBondContact O-N 3.44Å; S16-H19 VanDerWaalsContact O-N 3.13Å; L17-H19 VanDerWaalsContact C-N 3.34Å; H19-T21 PolarHBondContact O-N 2.9Å
20	A	76.8	Confident	80.7	Confident	21 Å²	21	59.8 Å²	59.8	17%	0.174	33%	0.329	C	S	.	.			trans	-71.8	123.1	177.5	0	0	0	0	0	111.8	S16 V27 R72	S16-A20 PolarHBondContact O-N 3.24Å; A20-V27 HydrophobicContact CB-CG1 4.02Å; A20-V27 HydrophobicContact CB-CG2 4.35Å; A20-R72 PolarHBondContact O-NH2 3.44Å
21	T	74	Confident	81.2	Confident	139 Å²	139	59.9 Å²	59.9	85%	0.853	33%	0.329	S	S	*	.	S	Bend	trans	-68.5	-38.9	177.2	-46.4	0	0	0	0	112	H19	H19-T21 PolarHBondContact O-N 2.9Å
22	I	78	Confident	81.7	Confident	132 Å²	132	54.7 Å²	54.7	68%	0.677	31%	0.309	S	S	*	.	S	Bend	trans	-121.1	129.9	177.9	-58.6	174	0	0	0	107.5
23	I	80.1	Confident	82.1	Confident	19 Å²	19	56.9 Å²	56.9	10%	0.097	31%	0.314	C	S	.	.			trans	-102.8	102.2	178.3	-58.1	169.3	0	0	0	106.9	F62 K71 R72 I75	I23-F62 HydrophobicContact CG2-CE1 4.15Å; I23-F62 HydrophobicContact CG2-CZ 4.49Å; I23-F62 WeakPolarHBondContact O-CE1 3.31Å; I23-K71 HydrophobicContact CD1-CB 4.06Å; I23-R72 HydrophobicContact CD1-CB 4.32Å; I23-R72 HydrophobicContact CD1-CG 3.22Å; I23-I75 HydrophobicContact CG2-CD1 3.58Å
24	N	82	Confident	82.5	Confident	64 Å²	64	60.9 Å²	60.9	34%	0.342	33%	0.333	S	S	.	.			trans	-110.3	-179.7	175.1	68.8	-7.6	0	0	0	110.4	D26 V27 L28 F62	N24-D26 VanDerWaalsContact C-N 3.3Å; N24-D26 PolarHBondContact ND2-OD2 3.37Å; N24-D26 PolarHBondContact O-N 2.9Å; N24-D26 PolarHBondContact OD1-N 3.28Å; N24-V27 PolarHBondContact O-N 3.21Å; N24-V27 WeakPolarHBondContact OD1-CB 3.37Å; N24-V27 WeakPolarHBondContact OD1-CG2 3.19Å; N24-V27 PolarHBondContact OD1-N 3.45Å; N24-L28 PolarHBondContact O-N 2.85Å; N24-F62 WeakPolarHBondContact O-CZ 3.26Å
25	E	85.4	Confident	82.9	Confident	113 Å²	113	60 Å²	60	53%	0.528	33%	0.328	S	S	.	.	H	α-helix	trans	-62.9	-35.5	179.7	-157.5	-168.3	149.4	0	0	112.7	L28 N29 F62	E25-L28 WeakPolarHBondContact O-CB 3.41Å; E25-L28 PolarHBondContact O-N 3.48Å; E25-N29 WeakPolarHBondContact O-CB 3.12Å; E25-N29 VanDerWaalsContact O-CG 3.31Å; E25-N29 PolarHBondContact O-N 2.97Å; E25-N29 PolarHBondContact O-ND2 3.26Å; E25-F62 HydrophobicContact CB-CD2 4.38Å; E25-F62 HydrophobicContact CB-CE2 4.07Å; E25-F62 HydrophobicContact CG-CE2 4.2Å
26	D	86.1	Confident	83.5	Confident	115 Å²	115	59.6 Å²	59.6	62%	0.615	32%	0.322	S	S	*	.	H	α-helix	trans	-63.2	-44.4	178.5	-61.2	-42	0	0	0	112.2	N24 L28 N29 S30	N24-D26 VanDerWaalsContact C-N 3.3Å; N24-D26 PolarHBondContact ND2-OD2 3.37Å; N24-D26 PolarHBondContact O-N 2.9Å; N24-D26 PolarHBondContact OD1-N 3.28Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.27Å; D26-N29 PolarHBondContact O-N 2.95Å; D26-S30 PolarHBondContact O-N 3.35Å
27	V	86.4	Confident	84	Confident	38 Å²	38	60.8 Å²	60.8	23%	0.23	33%	0.327	C	S	.	.	H	α-helix	trans	-62.8	-41.4	176.2	169.1	0	0	0	0	110.7	L17 A20 N24 S30 M31	L17-V27 HydrophobicContact CD2-CG1 3.6Å; A20-V27 HydrophobicContact CB-CG1 4.02Å; A20-V27 HydrophobicContact CB-CG2 4.35Å; N24-V27 PolarHBondContact O-N 3.21Å; N24-V27 WeakPolarHBondContact OD1-CB 3.37Å; N24-V27 WeakPolarHBondContact OD1-CG2 3.19Å; N24-V27 PolarHBondContact OD1-N 3.45Å; V27-S30 PolarHBondContact O-N 3.37Å; V27-M31 WeakPolarHBondContact O-CB 3.48Å; V27-M31 PolarHBondContact O-N 2.87Å
28	L	87	Confident	84.4	Confident	3 Å²	3	60.9 Å²	60.9	2%	0.016	33%	0.328	C	S	.	.	H	α-helix	trans	-62.2	-46.1	174.1	176.1	64.4	0	0	0	111.4	N24 E25 D26 S30 M31 L32 I60 F62 I75	N24-L28 PolarHBondContact O-N 2.85Å; E25-L28 WeakPolarHBondContact O-CB 3.41Å; E25-L28 PolarHBondContact O-N 3.48Å; D26-L28 VanDerWaalsContact C-N 3.33Å; D26-L28 PolarHBondContact O-N 3.27Å; L28-S30 PolarHBondContact O-N 2.98Å; L28-M31 HydrophobicContact CD1-CE 3.84Å; L28-M31 PolarHBondContact O-N 2.97Å; L28-L32 HydrophobicContact CD1-CD1 4.07Å; L28-L32 HydrophobicContact CD1-CG 4.11Å; L28-L32 HydrophobicContact CG-CD1 4.01Å; L28-L32 HydrophobicContact CG-CG 4.42Å; L28-L32 WeakPolarHBondContact O-CB 3.44Å; L28-L32 WeakPolarHBondContact O-CG 3.39Å; L28-L32 PolarHBondContact O-N 2.83Å; L28-I60 HydrophobicContact CD1-CD1 3.73Å; L28-I60 HydrophobicContact CD2-CB 4.06Å; L28-I60 HydrophobicContact CD2-CD1 3.85Å; L28-I60 HydrophobicContact CD2-CG2 3.78Å; L28-I60 HydrophobicContact CG-CD1 4.46Å; L28-F62 HydrophobicContact CB-CE2 4.35Å; L28-F62 HydrophobicContact CB-CZ 4.08Å; L28-F62 HydrophobicContact CD2-CE2 3.75Å; L28-F62 HydrophobicContact CD2-CZ 4.01Å; L28-I75 HydrophobicContact CD1-CD1 4.34Å; L28-I75 HydrophobicContact CD1-CG1 4.46Å; L28-I75 HydrophobicContact CD1-CG2 3.85Å
29	N	89	Confident	85.1	Confident	41 Å²	41	58.3 Å²	58.3	22%	0.219	31%	0.31	C	S	.	.	H	α-helix	trans	-62	-41.5	179.4	-79.9	-39.4	0	0	0	112.4	E25 D26 K33 K57	E25-N29 WeakPolarHBondContact O-CB 3.12Å; E25-N29 VanDerWaalsContact O-CG 3.31Å; E25-N29 PolarHBondContact O-N 2.97Å; E25-N29 PolarHBondContact O-ND2 3.26Å; D26-N29 PolarHBondContact O-N 2.95Å; N29-K33 WeakPolarHBondContact O-CB 3.37Å; N29-K33 PolarHBondContact O-N 3.41Å; N29-K57 WeakPolarHBondContact OD1-CE 3.43Å; N29-K57 PolarHBondContact OD1-NZ 2.71Å
30	S	88.8	Confident	85.6	Confident	65 Å²	65	54.1 Å²	54.1	46%	0.455	29%	0.293	S	S	.	.	H	α-helix	trans	-64.5	-47.6	175.9	-166.4	0	0	0	0	111.4	D26 V27 L28 L32 K33 E34	D26-S30 PolarHBondContact O-N 3.35Å; V27-S30 PolarHBondContact O-N 3.37Å; L28-S30 PolarHBondContact O-N 2.98Å; S30-L32 PolarHBondContact O-N 3.34Å; S30-K33 WeakPolarHBondContact O-CB 3.24Å; S30-K33 PolarHBondContact O-N 2.97Å; S30-K33 VanDerWaalsContact O-N 3.17Å; S30-E34 PolarHBondContact O-N 2.99Å
31	M	89.1	Confident	85.9	Confident	1 Å²	1	57.3 Å²	57.3	1%	0.005	30%	0.304	C	S	.	.	H	α-helix	trans	-60.2	-46.8	177.2	-179.2	-78.7	-70.1	0	0	111.5	A13 L17 V27 L28 K33 E34 V35 I75 V79	A13-M31 HydrophobicContact CB-CG 4.46Å; A13-M31 VanDerWaalsContact O-CG 3.28Å; A13-M31 WeakPolarHBondContact O-CG 3.38Å; L17-M31 HydrophobicContact CD1-CE 3.98Å; L17-M31 HydrophobicContact CD1-CG 4.02Å; L17-M31 HydrophobicContact CD2-CB 4.03Å; L17-M31 HydrophobicContact CD2-CG 4.19Å; L17-M31 HydrophobicContact CG-CB 4.34Å; L17-M31 HydrophobicContact CG-CG 3.96Å; V27-M31 WeakPolarHBondContact O-CB 3.48Å; V27-M31 PolarHBondContact O-N 2.87Å; L28-M31 HydrophobicContact CD1-CE 3.84Å; L28-M31 PolarHBondContact O-N 2.97Å; M31-K33 VanDerWaalsContact C-N 3.27Å; M31-K33 PolarHBondContact O-N 3.25Å; M31-E34 PolarHBondContact O-N 3.01Å; M31-E34 VanDerWaalsContact O-N 3.16Å; M31-V35 WeakPolarHBondContact O-CG2 3.47Å; M31-V35 PolarHBondContact O-N 2.89Å; M31-V35 HydrophobicContact SD-CG2 3.59Å; M31-V35 VanDerWaalsContact SD-CG2 3.59Å; M31-I75 HydrophobicContact CE-CG2 3.46Å; M31-I75 VanDerWaalsContact CE-CG2 3.46Å; M31-V79 HydrophobicContact CE-CG2 4.06Å
32	L	90.1	Very high	86.1	Confident	0 Å²	0	50.8 Å²	50.8	0%	0	26%	0.264	C	S	.	.	H	α-helix	trans	-61.7	-36.3	177.2	-74	176.7	0	0	0	111.8	L28 S30 V35 C36 K53 V56 K57	L28-L32 HydrophobicContact CD1-CD1 4.07Å; L28-L32 HydrophobicContact CD1-CG 4.11Å; L28-L32 HydrophobicContact CG-CD1 4.01Å; L28-L32 HydrophobicContact CG-CG 4.42Å; L28-L32 WeakPolarHBondContact O-CB 3.44Å; L28-L32 WeakPolarHBondContact O-CG 3.39Å; L28-L32 PolarHBondContact O-N 2.83Å; S30-L32 PolarHBondContact O-N 3.34Å; L32-V35 PolarHBondContact O-N 2.91Å; L32-C36 VanDerWaalsContact O-CB 3.28Å; L32-C36 WeakPolarHBondContact O-CB 3.35Å; L32-C36 PolarHBondContact O-N 3.42Å; L32-C36 PolarHBondContact O-SG 2.82Å; L32-K53 HydrophobicContact CD1-CG 4.49Å; L32-V56 HydrophobicContact CD1-CG1 4.31Å; L32-V56 HydrophobicContact CD2-CB 4.16Å; L32-V56 HydrophobicContact CD2-CG1 3.82Å; L32-K57 HydrophobicContact CD1-CG 3.89Å
33	K	91.1	Very high	86.1	Confident	146 Å²	146	46.8 Å²	46.8	64%	0.635	24%	0.244	S	C	*	.	H	α-helix	trans	-63.5	-42.4	175.3	-172.6	179.7	179.4	-177.3	0	111.5	N29 S30 M31 C36 T37	N29-K33 WeakPolarHBondContact O-CB 3.37Å; N29-K33 PolarHBondContact O-N 3.41Å; S30-K33 WeakPolarHBondContact O-CB 3.24Å; S30-K33 PolarHBondContact O-N 2.97Å; S30-K33 VanDerWaalsContact O-N 3.17Å; M31-K33 VanDerWaalsContact C-N 3.27Å; M31-K33 PolarHBondContact O-N 3.25Å; K33-C36 PolarHBondContact O-N 2.97Å; K33-T37 WeakPolarHBondContact O-CB 3.3Å; K33-T37 PolarHBondContact O-N 3.47Å; K33-T37 PolarHBondContact O-OG1 2.74Å
34	E	89.5	Confident	86.1	Confident	84 Å²	84	45.9 Å²	45.9	39%	0.393	24%	0.24	S	C	.	.	H	α-helix	trans	-64.8	-45.5	175.2	-70.5	-180	-163.6	0	0	112.1	A13 S30 M31 C36 T37 A38	A13-E34 VanDerWaalsContact CA-OE2 3.3Å; A13-E34 WeakPolarHBondContact CA-OE2 3.25Å; A13-E34 HydrophobicContact CB-CB 3.66Å; A13-E34 WeakPolarHBondContact CB-OE2 3.06Å; S30-E34 PolarHBondContact O-N 2.99Å; M31-E34 PolarHBondContact O-N 3.01Å; M31-E34 VanDerWaalsContact O-N 3.16Å; E34-C36 PolarHBondContact O-N 3.05Å; E34-T37 PolarHBondContact O-N 3.13Å; E34-A38 PolarHBondContact O-N 2.99Å
35	V	87.6	Confident	86.1	Confident	0 Å²	0	43.5 Å²	43.5	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-60.9	-45	175.7	173.6	0	0	0	0	111.1	I10 A13 M31 L32 T37 A38 L39	I10-V35 HydrophobicContact CG2-CG2 4.39Å; A13-V35 HydrophobicContact CB-CG2 3.79Å; M31-V35 WeakPolarHBondContact O-CG2 3.47Å; M31-V35 PolarHBondContact O-N 2.89Å; M31-V35 HydrophobicContact SD-CG2 3.59Å; M31-V35 VanDerWaalsContact SD-CG2 3.59Å; L32-V35 PolarHBondContact O-N 2.91Å; V35-T37 VanDerWaalsContact C-N 3.33Å; V35-T37 PolarHBondContact O-N 2.76Å; V35-A38 PolarHBondContact O-N 2.85Å; V35-L39 HydrophobicContact CG1-CD1 4.11Å; V35-L39 HydrophobicContact CG1-CG 4.5Å; V35-L39 WeakPolarHBondContact O-CG 3.32Å; V35-L39 PolarHBondContact O-N 2.79Å
36	C	89.1	Confident	86.2	Confident	14 Å²	14	43.5 Å²	43.5	10%	0.095	23%	0.229	C	C	.	.	H	α-helix	trans	-61.1	-42.4	176.3	-70	0	0	0	0	111.6	L32 K33 E34 A38 L39 L40 V49	L32-C36 VanDerWaalsContact O-CB 3.28Å; L32-C36 WeakPolarHBondContact O-CB 3.35Å; L32-C36 PolarHBondContact O-N 3.42Å; L32-C36 PolarHBondContact O-SG 2.82Å; K33-C36 PolarHBondContact O-N 2.97Å; E34-C36 PolarHBondContact O-N 3.05Å; C36-A38 VanDerWaalsContact C-N 3.33Å; C36-A38 PolarHBondContact O-N 2.88Å; C36-L39 PolarHBondContact O-N 2.84Å; C36-L40 WeakPolarHBondContact O-CB 3.4Å; C36-L40 VanDerWaalsContact O-CG 3.26Å; C36-L40 WeakPolarHBondContact O-CG 3.49Å; C36-L40 PolarHBondContact O-N 2.97Å; C36-V49 HydrophobicContact CB-CG1 3.55Å
37	T	89.9	Confident	86.2	Confident	66 Å²	66	47 Å²	47	41%	0.405	23%	0.234	S	C	.	.	H	α-helix	trans	-62.1	-44.6	177.8	-56.4	0	0	0	0	110.3	K33 E34 V35 L39 L40 E41	K33-T37 WeakPolarHBondContact O-CB 3.3Å; K33-T37 PolarHBondContact O-N 3.47Å; K33-T37 PolarHBondContact O-OG1 2.74Å; E34-T37 PolarHBondContact O-N 3.13Å; V35-T37 VanDerWaalsContact C-N 3.33Å; V35-T37 PolarHBondContact O-N 2.76Å; T37-L39 PolarHBondContact O-N 2.87Å; T37-L40 PolarHBondContact O-N 3.25Å; T37-E41 WeakPolarHBondContact O-CB 3.24Å; T37-E41 VanDerWaalsContact O-CG 3.29Å; T37-E41 WeakPolarHBondContact O-CG 3.45Å; T37-E41 PolarHBondContact O-N 3.41Å
38	A	86.3	Confident	86.1	Confident	4 Å²	4	46 Å²	46	3%	0.033	23%	0.228	C	C	.	.	H	α-helix	trans	-61.7	-41.7	176.5	0	0	0	0	0	112.5	L6 K9 I10 E34 V35 C36 E41 A42	L6-A38 HydrophobicContact CD1-CB 3.9Å; L6-A38 VanDerWaalsContact CD1-O 3.31Å; L6-A38 WeakPolarHBondContact CD1-O 3.49Å; K9-A38 HydrophobicContact CB-CB 3.73Å; K9-A38 HydrophobicContact CD-CB 4.28Å; I10-A38 HydrophobicContact CG1-CB 4.22Å; E34-A38 PolarHBondContact O-N 2.99Å; V35-A38 PolarHBondContact O-N 2.85Å; C36-A38 VanDerWaalsContact C-N 3.33Å; C36-A38 PolarHBondContact O-N 2.88Å; A38-E41 PolarHBondContact O-N 2.8Å; A38-A42 WeakPolarHBondContact O-CB 3.2Å; A38-A42 PolarHBondContact O-N 2.82Å
39	L	85.1	Confident	86.2	Confident	3 Å²	3	46.2 Å²	46.2	2%	0.016	23%	0.229	C	C	.	.	H	α-helix	trans	-66.8	-39.6	176.2	-68.5	171.4	0	0	0	112.2	L6 I10 V35 C36 T37 A42 D43 V44 V49 L52 L83	L6-L39 HydrophobicContact CD1-CD2 4.36Å; I10-L39 HydrophobicContact CD1-CD2 4.34Å; V35-L39 HydrophobicContact CG1-CD1 4.11Å; V35-L39 HydrophobicContact CG1-CG 4.5Å; V35-L39 WeakPolarHBondContact O-CG 3.32Å; V35-L39 PolarHBondContact O-N 2.79Å; C36-L39 PolarHBondContact O-N 2.84Å; T37-L39 PolarHBondContact O-N 2.87Å; L39-A42 CarbonylContact O-C 3.55Å; L39-A42 WeakPolarHBondContact O-CA 3.29Å; L39-A42 WeakPolarHBondContact O-CB 3.43Å; L39-A42 PolarHBondContact O-N 3.39Å; L39-A42 VanDerWaalsContact O-N 3.14Å; L39-D43 PolarHBondContact O-N 2.85Å; L39-V44 HydrophobicContact CB-CB 4.18Å; L39-V44 HydrophobicContact CB-CG2 4.11Å; L39-V44 HydrophobicContact CD2-CG2 4.08Å; L39-V44 VanDerWaalsContact O-CB 3.28Å; L39-V44 WeakPolarHBondContact O-CB 3.33Å; L39-V44 VanDerWaalsContact O-CG2 3.25Å; L39-V44 WeakPolarHBondContact O-CG2 3.27Å; L39-V44 PolarHBondContact O-N 3.43Å; L39-V49 HydrophobicContact CB-CG2 3.76Å; L39-V49 HydrophobicContact CD1-CG2 4.45Å; L39-L52 HydrophobicContact CD1-CD1 4.2Å; L39-L52 HydrophobicContact CD1-CD2 4.48Å; L39-L83 HydrophobicContact CD1-CD2 4.49Å; L39-L83 HydrophobicContact CD2-CD2 4.44Å
40	L	85.5	Confident	86.2	Confident	69 Å²	69	50.7 Å²	50.7	36%	0.361	25%	0.246	S	C	.	.	H	α-helix	trans	-65.8	-42.1	175.7	-71.8	173.5	0	0	0	111.9	C36 T37 A42 D43 I46 V49	C36-L40 WeakPolarHBondContact O-CB 3.4Å; C36-L40 VanDerWaalsContact O-CG 3.26Å; C36-L40 WeakPolarHBondContact O-CG 3.49Å; C36-L40 PolarHBondContact O-N 2.97Å; T37-L40 PolarHBondContact O-N 3.25Å; L40-A42 PolarHBondContact O-N 3.34Å; L40-D43 PolarHBondContact O-N 3.26Å; L40-I46 HydrophobicContact CD2-CB 4.22Å; L40-I46 HydrophobicContact CD2-CG1 3.61Å; L40-V49 HydrophobicContact CD2-CB 4.3Å; L40-V49 HydrophobicContact CD2-CG2 4.03Å; L40-V49 HydrophobicContact CG-CG1 4.25Å; L40-V49 HydrophobicContact CG-CG2 4.3Å
41	E	83.3	Confident	86.2	Confident	87 Å²	87	52.8 Å²	52.8	41%	0.407	25%	0.249	S	C	.	.	H	α-helix	trans	-63.5	-23.5	172.6	-71.9	174.2	136.3	0	0	112.4	K9 T37 A38 R255	K9-E41 VanDerWaalsContact CD-OE2 3.29Å; K9-E41 WeakPolarHBondContact CD-OE2 3.47Å; K9-E41 WeakPolarHBondContact CE-OE2 3.39Å; K9-E41 IonicContact NZ-OE1 3.34Å; K9-E41 PolarHBondContact NZ-OE1 3.34Å; K9-E41 IonicContact NZ-OE2 3.43Å; K9-E41 PolarHBondContact NZ-OE2 2.88Å; T37-E41 WeakPolarHBondContact O-CB 3.24Å; T37-E41 VanDerWaalsContact O-CG 3.29Å; T37-E41 WeakPolarHBondContact O-CG 3.45Å; T37-E41 PolarHBondContact O-N 3.41Å; A38-E41 PolarHBondContact O-N 2.8Å; E41-R255 VanDerWaalsContact O-CD 3.25Å; E41-R255 WeakPolarHBondContact O-CD 3.42Å; E41-R255 PolarHBondContact O-NE 2.91Å; E41-R255 VanDerWaalsContact O-NE 3.14Å; E41-R255 PolarHBondContact O-NH1 3.47Å
42	A	79	Confident	86.2	Confident	3 Å²	3	52.8 Å²	52.8	3%	0.025	25%	0.249	C	C	.	.	T	Hydrogen-bonded Turn	trans	-87.3	13.4	172.4	0	0	0	0	0	113.6	L6 A38 L39 L40 V44 R255 G257	L6-A42 HydrophobicContact CD1-CB 3.97Å; L6-A42 HydrophobicContact CD2-CB 3.78Å; L6-A42 HydrophobicContact CG-CB 4.33Å; A38-A42 WeakPolarHBondContact O-CB 3.2Å; A38-A42 PolarHBondContact O-N 2.82Å; L39-A42 CarbonylContact O-C 3.55Å; L39-A42 WeakPolarHBondContact O-CA 3.29Å; L39-A42 WeakPolarHBondContact O-CB 3.43Å; L39-A42 PolarHBondContact O-N 3.39Å; L39-A42 VanDerWaalsContact O-N 3.14Å; L40-A42 PolarHBondContact O-N 3.34Å; A42-V44 HydrophobicContact CB-CG2 4.44Å; A42-V44 PolarHBondContact O-N 3.06Å; A42-R255 HydrophobicContact CB-CB 4.16Å; A42-R255 VanDerWaalsContact O-CB 3.27Å; A42-R255 WeakPolarHBondContact O-CB 3.28Å; A42-G257 WeakPolarHBondContact O-CA 3.48Å; A42-G257 PolarHBondContact O-N 2.95Å
43	D	78.5	Confident	86.2	Confident	47 Å²	47	56.3 Å²	56.3	25%	0.251	26%	0.264	S	S	.	.	T	Hydrogen-bonded Turn	trans	56	31.5	-178.9	-63.8	-58.5	0	0	0	114.4	L39 L40 G226 Q227 R255	L39-D43 PolarHBondContact O-N 2.85Å; L40-D43 PolarHBondContact O-N 3.26Å; D43-G226 VanDerWaalsContact CB-CA 3.47Å; D43-Q227 PolarHBondContact O-NE2 3.02Å; D43-Q227 VanDerWaalsContact O-NE2 3.17Å; D43-R255 IonicContact OD1-NH1 2.74Å; D43-R255 WeakPolarHBondContact OD2-CD 3.28Å; D43-R255 IonicContact OD2-CZ 2.62Å; D43-R255 IonicContact OD2-NE 3.83Å; D43-R255 IonicContact OD2-NH1 3.86Å; D43-R255 PolarHBondContact OD2-NH1 3.49Å
44	V	80.2	Confident	86.2	Confident	1 Å²	1	53.1 Å²	53.1	1%	0.006	25%	0.254	C	S	.	.			trans	-72.6	140.9	167	-175.4	0	0	0	0	109.1	L39 A42 I46 L48 V49 Q227 L260	L39-V44 HydrophobicContact CB-CB 4.18Å; L39-V44 HydrophobicContact CB-CG2 4.11Å; L39-V44 HydrophobicContact CD2-CG2 4.08Å; L39-V44 VanDerWaalsContact O-CB 3.28Å; L39-V44 WeakPolarHBondContact O-CB 3.33Å; L39-V44 VanDerWaalsContact O-CG2 3.25Å; L39-V44 WeakPolarHBondContact O-CG2 3.27Å; L39-V44 PolarHBondContact O-N 3.43Å; A42-V44 HydrophobicContact CB-CG2 4.44Å; A42-V44 PolarHBondContact O-N 3.06Å; V44-I46 PolarHBondContact O-N 3.23Å; V44-L48 HydrophobicContact CG1-CB 4.41Å; V44-V49 HydrophobicContact CB-CG2 3.92Å; V44-V49 HydrophobicContact CG1-CG2 3.8Å; V44-Q227 VanDerWaalsContact C-NE2 3.33Å; V44-Q227 PolarHBondContact O-NE2 3.36Å; V44-L260 HydrophobicContact CG1-CD1 3.95Å; V44-L260 HydrophobicContact CG2-CD1 3.84Å
45	N	81.9	Confident	86.2	Confident	13 Å²	13	50.9 Å²	50.9	7%	0.07	25%	0.247	C	C	.	.			trans	-56.1	131.4	-178.3	-166.2	-71.6	0	0	0	113.3	R47 L48 V49 Q227 E230	N45-R47 PolarHBondContact O-N 3.12Å; N45-R47 VanDerWaalsContact OD1-CB 3.26Å; N45-R47 WeakPolarHBondContact OD1-CB 3.3Å; N45-R47 PolarHBondContact OD1-N 3.43Å; N45-L48 HydrophobicContact CB-CB 4.27Å; N45-L48 HydrophobicContact CB-CD1 3.88Å; N45-L48 HydrophobicContact CB-CG 3.96Å; N45-L48 WeakPolarHBondContact O-CB 3.35Å; N45-L48 PolarHBondContact O-N 3.13Å; N45-V49 WeakPolarHBondContact O-CG2 3.38Å; N45-V49 PolarHBondContact O-N 2.74Å; N45-Q227 VanDerWaalsContact CA-OE1 3.3Å; N45-E230 PolarHBondContact ND2-OE2 3.27Å
46	I	85.8	Confident	86.3	Confident	114 Å²	114	50.9 Å²	50.9	59%	0.585	25%	0.247	S	C	*	.	H	α-helix	trans	-55.9	-36.8	-178.2	-59.9	164.6	0	0	0	111.6	L40 V44 V49 K50	L40-I46 HydrophobicContact CD2-CB 4.22Å; L40-I46 HydrophobicContact CD2-CG1 3.61Å; V44-I46 PolarHBondContact O-N 3.23Å; I46-V49 PolarHBondContact O-N 3.33Å; I46-K50 WeakPolarHBondContact O-CB 3.49Å; I46-K50 PolarHBondContact O-N 3.29Å
47	R	85.8	Confident	86.2	Confident	187 Å²	187	53.6 Å²	53.6	71%	0.706	26%	0.258	S	S	*	.	H	α-helix	trans	-65.6	-43.6	177.9	-61	177.5	179.3	173.3	-1.4	111.2	N45 K50 Q51	N45-R47 PolarHBondContact O-N 3.12Å; N45-R47 VanDerWaalsContact OD1-CB 3.26Å; N45-R47 WeakPolarHBondContact OD1-CB 3.3Å; N45-R47 PolarHBondContact OD1-N 3.43Å; R47-K50 PolarHBondContact O-N 3.13Å; R47-Q51 WeakPolarHBondContact O-CB 3.35Å; R47-Q51 PolarHBondContact O-N 3.1Å
48	L	85.5	Confident	86.1	Confident	19 Å²	19	54.6 Å²	54.6	10%	0.099	27%	0.272	C	S	.	.	H	α-helix	trans	-66.8	-40.3	177.3	-62.5	176.7	0	0	0	111.7	V44 N45 K50 Q51 L52 L86 A264	V44-L48 HydrophobicContact CG1-CB 4.41Å; N45-L48 HydrophobicContact CB-CB 4.27Å; N45-L48 HydrophobicContact CB-CD1 3.88Å; N45-L48 HydrophobicContact CB-CG 3.96Å; N45-L48 WeakPolarHBondContact O-CB 3.35Å; N45-L48 PolarHBondContact O-N 3.13Å; L48-K50 VanDerWaalsContact C-N 3.34Å; L48-Q51 PolarHBondContact O-N 3.36Å; L48-L52 WeakPolarHBondContact O-CB 3.45Å; L48-L52 PolarHBondContact O-N 2.93Å; L48-L86 HydrophobicContact CD2-CD2 4.37Å; L48-A264 HydrophobicContact CD1-CB 3.78Å; L48-A264 HydrophobicContact CD2-CB 3.79Å; L48-A264 HydrophobicContact CG-CB 4.4Å
49	V	88.5	Confident	85.9	Confident	6 Å²	6	58.4 Å²	58.4	4%	0.036	29%	0.29	C	S	.	.	H	α-helix	trans	-63.3	-42.5	175.5	177	0	0	0	0	110.9	C36 L39 L40 V44 N45 I46 L52 K53	C36-V49 HydrophobicContact CB-CG1 3.55Å; L39-V49 HydrophobicContact CB-CG2 3.76Å; L39-V49 HydrophobicContact CD1-CG2 4.45Å; L40-V49 HydrophobicContact CD2-CB 4.3Å; L40-V49 HydrophobicContact CD2-CG2 4.03Å; L40-V49 HydrophobicContact CG-CG1 4.25Å; L40-V49 HydrophobicContact CG-CG2 4.3Å; V44-V49 HydrophobicContact CB-CG2 3.92Å; V44-V49 HydrophobicContact CG1-CG2 3.8Å; N45-V49 WeakPolarHBondContact O-CG2 3.38Å; N45-V49 PolarHBondContact O-N 2.74Å; I46-V49 PolarHBondContact O-N 3.33Å; V49-L52 PolarHBondContact O-N 2.98Å; V49-K53 PolarHBondContact O-N 2.83Å
50	K	90.3	Very high	85.8	Confident	135 Å²	135	58.8 Å²	58.8	59%	0.587	29%	0.292	S	S	*	.	H	α-helix	trans	-63.4	-47	175.5	-175.2	-179.8	176.4	-174.8	0	111.4	I46 R47 L48 L52 K53 D54	I46-K50 WeakPolarHBondContact O-CB 3.49Å; I46-K50 PolarHBondContact O-N 3.29Å; R47-K50 PolarHBondContact O-N 3.13Å; L48-K50 VanDerWaalsContact C-N 3.34Å; K50-L52 VanDerWaalsContact C-N 3.32Å; K50-L52 PolarHBondContact O-N 2.97Å; K50-K53 WeakPolarHBondContact O-CB 3.45Å; K50-K53 PolarHBondContact O-N 2.86Å; K50-K53 VanDerWaalsContact O-N 3.15Å; K50-D54 PolarHBondContact O-N 2.89Å
51	Q	88.5	Confident	85.3	Confident	110 Å²	110	58.4 Å²	58.4	51%	0.514	29%	0.29	S	S	.	.	H	α-helix	trans	-57.6	-45.6	177.1	-176.4	177.9	-5.3	0	0	111.3	R47 L48 K53 D54 S55	R47-Q51 WeakPolarHBondContact O-CB 3.35Å; R47-Q51 PolarHBondContact O-N 3.1Å; L48-Q51 PolarHBondContact O-N 3.36Å; Q51-K53 VanDerWaalsContact C-N 3.35Å; Q51-K53 PolarHBondContact O-N 2.75Å; Q51-D54 PolarHBondContact O-N 3.45Å; Q51-S55 WeakPolarHBondContact O-CB 3.44Å; Q51-S55 PolarHBondContact O-N 3.25Å; Q51-S55 PolarHBondContact O-OG 2.86Å
52	L	88.6	Confident	84.9	Confident	1 Å²	1	56.3 Å²	56.3	1%	0.005	28%	0.279	C	S	.	.	H	α-helix	trans	-57.4	-47.2	175.1	179.4	146.6	0	0	0	111.8	L39 L48 V49 K50 D54 S55 V56 E82 L83 L86	L39-L52 HydrophobicContact CD1-CD1 4.2Å; L39-L52 HydrophobicContact CD1-CD2 4.48Å; L48-L52 WeakPolarHBondContact O-CB 3.45Å; L48-L52 PolarHBondContact O-N 2.93Å; V49-L52 PolarHBondContact O-N 2.98Å; K50-L52 VanDerWaalsContact C-N 3.32Å; K50-L52 PolarHBondContact O-N 2.97Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-D54 PolarHBondContact O-N 3.49Å; L52-S55 PolarHBondContact O-N 2.93Å; L52-V56 HydrophobicContact CD2-CG2 4.28Å; L52-V56 HydrophobicContact CG-CG2 4.41Å; L52-V56 WeakPolarHBondContact O-CB 3.41Å; L52-V56 VanDerWaalsContact O-CG2 3.26Å; L52-V56 WeakPolarHBondContact O-CG2 3.29Å; L52-V56 PolarHBondContact O-N 3.23Å; L52-E82 HydrophobicContact CG-CB 4.42Å; L52-L83 HydrophobicContact CD1-CD2 3.58Å; L52-L83 HydrophobicContact CD1-CG 4.05Å; L52-L86 HydrophobicContact CB-CD1 4.11Å; L52-L86 HydrophobicContact CD1-CD1 3.54Å; L52-L86 HydrophobicContact CD1-CG 4.5Å; L52-L86 HydrophobicContact CG-CD1 4.42Å
53	K	90.5	Very high	84.4	Confident	73 Å²	73	63.6 Å²	63.6	32%	0.317	32%	0.318	S	S	.	.	H	α-helix	trans	-58.8	-46.7	179.1	-177.4	-175.3	175.4	-175.7	0	111.3	L32 V49 K50 Q51 K57	L32-K53 HydrophobicContact CD1-CG 4.49Å; V49-K53 PolarHBondContact O-N 2.83Å; K50-K53 WeakPolarHBondContact O-CB 3.45Å; K50-K53 PolarHBondContact O-N 2.86Å; K50-K53 VanDerWaalsContact O-N 3.15Å; Q51-K53 VanDerWaalsContact C-N 3.35Å; Q51-K53 PolarHBondContact O-N 2.75Å; K53-K57 WeakPolarHBondContact O-CG 3.36Å; K53-K57 PolarHBondContact O-N 3.41Å; K53-K57 VanDerWaalsContact O-N 3.08Å
54	D	91.3	Very high	83.8	Confident	80 Å²	80	68.7 Å²	68.7	43%	0.428	34%	0.34	S	S	.	.	H	α-helix	trans	-69.4	-40.2	-177.2	-64.8	-18.1	0	0	0	110.9	K50 Q51 L52 K57 A58	K50-D54 PolarHBondContact O-N 2.89Å; Q51-D54 PolarHBondContact O-N 3.45Å; L52-D54 VanDerWaalsContact C-N 3.33Å; L52-D54 PolarHBondContact O-N 3.49Å; D54-K57 PolarHBondContact O-N 2.89Å; D54-A58 WeakPolarHBondContact O-CB 3.34Å; D54-A58 PolarHBondContact O-N 2.88Å
55	S	89.5	Confident	83.2	Confident	36 Å²	36	69.6 Å²	69.6	25%	0.252	35%	0.345	S	S	.	.	H	α-helix	trans	-66.4	-40.7	176.2	-63	0	0	0	0	113.1	Q51 L52 A58 Q59 E82	Q51-S55 WeakPolarHBondContact O-CB 3.44Å; Q51-S55 PolarHBondContact O-N 3.25Å; Q51-S55 PolarHBondContact O-OG 2.86Å; L52-S55 PolarHBondContact O-N 2.93Å; S55-A58 PolarHBondContact O-N 2.86Å; S55-Q59 WeakPolarHBondContact O-CG 3.41Å; S55-Q59 PolarHBondContact O-N 2.89Å; S55-E82 VanDerWaalsContact CB-OE2 3.27Å; S55-E82 WeakPolarHBondContact CB-OE2 3.28Å
56	V	88.4	Confident	82.2	Confident	0 Å²	0	71.8 Å²	71.8	0%	0	37%	0.365	C	S	.	.	H	α-helix	trans	-66	-41.1	175.4	175.5	0	0	0	0	110.9	L32 L52 Q59 I60 V79 E82	L32-V56 HydrophobicContact CD1-CG1 4.31Å; L32-V56 HydrophobicContact CD2-CB 4.16Å; L32-V56 HydrophobicContact CD2-CG1 3.82Å; L52-V56 HydrophobicContact CD2-CG2 4.28Å; L52-V56 HydrophobicContact CG-CG2 4.41Å; L52-V56 WeakPolarHBondContact O-CB 3.41Å; L52-V56 VanDerWaalsContact O-CG2 3.26Å; L52-V56 WeakPolarHBondContact O-CG2 3.29Å; L52-V56 PolarHBondContact O-N 3.23Å; V56-Q59 PolarHBondContact O-N 3.5Å; V56-I60 HydrophobicContact CG1-CD1 3.65Å; V56-I60 WeakPolarHBondContact O-CG1 3.5Å; V56-I60 PolarHBondContact O-N 3.46Å; V56-V79 HydrophobicContact CG1-CG2 4.14Å; V56-V79 HydrophobicContact CG2-CG2 4.44Å; V56-E82 HydrophobicContact CG2-CB 3.84Å; V56-E82 HydrophobicContact CG2-CG 3.63Å
57	K	87.4	Confident	80.8	Confident	72 Å²	72	71.7 Å²	71.7	31%	0.313	38%	0.381	S	S	.	.	H	α-helix	trans	-60.8	-44.1	175.1	-80.1	-177.1	168.2	-135.5	0	112.3	N29 L32 K53 D54 Q59 I60	N29-K57 WeakPolarHBondContact OD1-CE 3.43Å; N29-K57 PolarHBondContact OD1-NZ 2.71Å; L32-K57 HydrophobicContact CD1-CG 3.89Å; K53-K57 WeakPolarHBondContact O-CG 3.36Å; K53-K57 PolarHBondContact O-N 3.41Å; K53-K57 VanDerWaalsContact O-N 3.08Å; D54-K57 PolarHBondContact O-N 2.89Å; K57-Q59 PolarHBondContact O-N 2.91Å; K57-I60 PolarHBondContact O-N 2.82Å
58	A	87.2	Confident	79.7	Confident	86 Å²	86	66.7 Å²	66.7	71%	0.711	39%	0.387	S	S	*	.	H	α-helix	trans	-63.8	-27.5	179.7	0	0	0	0	0	113.2	D54 S55	D54-A58 WeakPolarHBondContact O-CB 3.34Å; D54-A58 PolarHBondContact O-N 2.88Å; S55-A58 PolarHBondContact O-N 2.86Å
59	Q	83	Confident	78.7	Confident	84 Å²	84	70.2 Å²	70.2	39%	0.393	41%	0.405	S	S	.	.	H	α-helix	trans	-82.9	-17.9	178.2	-74.3	179.9	3.7	0	0	114.3	S55 V56 K57 E82	S55-Q59 WeakPolarHBondContact O-CG 3.41Å; S55-Q59 PolarHBondContact O-N 2.89Å; V56-Q59 PolarHBondContact O-N 3.5Å; K57-Q59 PolarHBondContact O-N 2.91Å; Q59-E82 PolarHBondContact NE2-OE1 3.43Å
60	I	82.1	Confident	78.1	Confident	12 Å²	12	74.8 Å²	74.8	6%	0.062	43%	0.429	C	S	.	.			trans	-106.1	89	-175.4	-62.5	163.5	0	0	0	108.5	L28 V56 K57 F62 M65 I75 A78	L28-I60 HydrophobicContact CD1-CD1 3.73Å; L28-I60 HydrophobicContact CD2-CB 4.06Å; L28-I60 HydrophobicContact CD2-CD1 3.85Å; L28-I60 HydrophobicContact CD2-CG2 3.78Å; L28-I60 HydrophobicContact CG-CD1 4.46Å; V56-I60 HydrophobicContact CG1-CD1 3.65Å; V56-I60 WeakPolarHBondContact O-CG1 3.5Å; V56-I60 PolarHBondContact O-N 3.46Å; K57-I60 PolarHBondContact O-N 2.82Å; I60-F62 HydrophobicContact CG2-CD2 4.23Å; I60-F62 HydrophobicContact CG2-CE2 3.89Å; I60-F62 HydrophobicContact CG2-CZ 4.06Å; I60-M65 HydrophobicContact CG2-CE 3.75Å; I60-I75 HydrophobicContact CD1-CB 4.43Å; I60-I75 HydrophobicContact CD1-CG1 3.98Å; I60-I75 HydrophobicContact CD1-CG2 4.26Å; I60-A78 HydrophobicContact CD1-CB 4.39Å; I60-A78 HydrophobicContact CG1-CB 4.45Å
61	N	76.3	Confident	77.5	Confident	60 Å²	60	71.8 Å²	71.8	32%	0.321	42%	0.416	S	S	.	.			trans	-92	110.7	167	-171.4	-10	0	0	0	109.5	D63 E64 M65	N61-D63 PolarHBondContact O-N 3.47Å; N61-D63 WeakPolarHBondContact OD1-CB 3.44Å; N61-D63 PolarHBondContact OD1-N 3.24Å; N61-E64 HydrophobicContact CB-CB 4.21Å; N61-E64 HydrophobicContact CB-CG 4.36Å; N61-E64 VanDerWaalsContact ND2-CD 3.35Å; N61-E64 PolarHBondContact ND2-OE1 2.96Å; N61-E64 PolarHBondContact O-N 2.79Å; N61-M65 WeakPolarHBondContact O-CG 3.43Å; N61-M65 PolarHBondContact O-N 2.67Å
62	F	74.2	Confident	77	Confident	43 Å²	43	70.5 Å²	70.5	19%	0.189	41%	0.406	C	S	.	.	T	Hydrogen-bonded Turn	trans	-66.4	-23.1	179.4	-77.1	-79.8	0	0	0	113.1	I23 N24 E25 L28 I60 M65	I23-F62 HydrophobicContact CG2-CE1 4.15Å; I23-F62 HydrophobicContact CG2-CZ 4.49Å; I23-F62 WeakPolarHBondContact O-CE1 3.31Å; N24-F62 WeakPolarHBondContact O-CZ 3.26Å; E25-F62 HydrophobicContact CB-CD2 4.38Å; E25-F62 HydrophobicContact CB-CE2 4.07Å; E25-F62 HydrophobicContact CG-CE2 4.2Å; L28-F62 HydrophobicContact CB-CE2 4.35Å; L28-F62 HydrophobicContact CB-CZ 4.08Å; L28-F62 HydrophobicContact CD2-CE2 3.75Å; L28-F62 HydrophobicContact CD2-CZ 4.01Å; I60-F62 HydrophobicContact CG2-CD2 4.23Å; I60-F62 HydrophobicContact CG2-CE2 3.89Å; I60-F62 HydrophobicContact CG2-CZ 4.06Å; F62-M65 HydrophobicContact CD1-SD 4.24Å
63	D	69.1	Low	76.5	Confident	156 Å²	156	79.3 Å²	79.3	83%	0.834	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-79.1	-29.7	-178.6	-60.8	-29.1	0	0	0	112.2	N61	N61-D63 PolarHBondContact O-N 3.47Å; N61-D63 WeakPolarHBondContact OD1-CB 3.44Å; N61-D63 PolarHBondContact OD1-N 3.24Å
64	E	64.9	Low	76.1	Confident	154 Å²	154	78.7 Å²	78.7	72%	0.72	44%	0.439	S	S	*	.	T	Hydrogen-bonded Turn	trans	-88.5	-10.8	178	-72.8	173.3	-155.3	0	0	113.4	N61 A66	N61-E64 HydrophobicContact CB-CB 4.21Å; N61-E64 HydrophobicContact CB-CG 4.36Å; N61-E64 VanDerWaalsContact ND2-CD 3.35Å; N61-E64 PolarHBondContact ND2-OE1 2.96Å; N61-E64 PolarHBondContact O-N 2.79Å; E64-A66 PolarHBondContact O-N 3.33Å
65	M	68	Low	75.7	Confident	20 Å²	20	74.9 Å²	74.9	10%	0.099	42%	0.419	C	S	.	.	S	Bend	trans	-72.3	102	-179.2	-82.1	-177.5	165.9	0	0	111.2	I60 N61 F62 A67 K71 L74	I60-M65 HydrophobicContact CG2-CE 3.75Å; N61-M65 WeakPolarHBondContact O-CG 3.43Å; N61-M65 PolarHBondContact O-N 2.67Å; F62-M65 HydrophobicContact CD1-SD 4.24Å; M65-A67 PolarHBondContact O-N 3.45Å; M65-K71 HydrophobicContact SD-CB 4.48Å; M65-K71 HydrophobicContact SD-CD 4.22Å; M65-K71 HydrophobicContact SD-CG 4.02Å; M65-L74 HydrophobicContact CE-CB 4.22Å; M65-L74 HydrophobicContact CE-CD2 3.32Å; M65-L74 HydrophobicContact CE-CG 3.75Å; M65-L74 HydrophobicContact CG-CD2 4.12Å; M65-L74 HydrophobicContact SD-CD2 4.36Å
66	A	61.1	Low	75.3	Confident	59 Å²	59	76.3 Å²	76.3	49%	0.488	42%	0.422	S	S	.	.			trans	-49.7	134.7	176.6	0	0	0	0	0	113.4	E64 G68 M69	E64-A66 PolarHBondContact O-N 3.33Å; A66-G68 PolarHBondContact O-N 3.32Å; A66-G68 VanDerWaalsContact O-N 3.11Å; A66-M69 HydrophobicContact CB-CE 4.04Å; A66-M69 PolarHBondContact O-N 3.23Å
67	A	56.2	Low	75.1	Confident	112 Å²	112	83.5 Å²	83.5	93%	0.926	45%	0.449	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.6	112.9	174.2	0	0	0	0	0	110	M65	M65-A67 PolarHBondContact O-N 3.45Å
68	G	62.1	Low	75	Confident	82 Å²	82	80.3 Å²	80.3	85%	0.845	44%	0.436	S	S	*	.	T	Hydrogen-bonded Turn	trans	122.4	-16.9	-178.1	0	0	0	0	0	114.4	A66	A66-G68 PolarHBondContact O-N 3.32Å; A66-G68 VanDerWaalsContact O-N 3.11Å
69	M	66	Low	75	Confident	94 Å²	94	76.2 Å²	76.2	46%	0.463	40%	0.402	S	S	.	.	S	Bend	trans	-71.4	136	169.8	-73	-162.1	-70.8	0	0	110.7	A66 K71 L74	A66-M69 HydrophobicContact CB-CE 4.04Å; A66-M69 PolarHBondContact O-N 3.23Å; M69-K71 VanDerWaalsContact C-N 3.28Å; M69-K71 PolarHBondContact O-N 3.4Å; M69-L74 HydrophobicContact CE-CD2 4.3Å
70	N	74.7	Confident	75	Confident	101 Å²	101	74.2 Å²	74.2	54%	0.54	39%	0.392	S	S	.	.			trans	-70	89.2	172.4	-171.8	-18.5	0	0	0	109.1	R72 R73 L74	N70-R72 PolarHBondContact O-N 2.92Å; N70-R72 VanDerWaalsContact OD1-CB 3.3Å; N70-R72 WeakPolarHBondContact OD1-CB 3.41Å; N70-R72 PolarHBondContact OD1-N 3.09Å; N70-R73 HydrophobicContact CB-CB 4.27Å; N70-R73 PolarHBondContact O-N 3.47Å; N70-L74 PolarHBondContact O-N 3.35Å
71	K	78.1	Confident	75.3	Confident	72 Å²	72	77.2 Å²	77.2	31%	0.313	41%	0.406	S	S	.	.	H	α-helix	trans	-48.3	-35.7	-178.8	-63.5	-172.5	179.3	-171	0	111.9	I23 M65 M69 R73 L74 I75	I23-K71 HydrophobicContact CD1-CB 4.06Å; M65-K71 HydrophobicContact SD-CB 4.48Å; M65-K71 HydrophobicContact SD-CD 4.22Å; M65-K71 HydrophobicContact SD-CG 4.02Å; M69-K71 VanDerWaalsContact C-N 3.28Å; M69-K71 PolarHBondContact O-N 3.4Å; K71-R73 PolarHBondContact O-N 2.93Å; K71-L74 PolarHBondContact O-N 3.34Å; K71-I75 VanDerWaalsContact O-CG1 3.3Å; K71-I75 WeakPolarHBondContact O-CG1 3.18Å; K71-I75 PolarHBondContact O-N 3.02Å
72	R	78.2	Confident	75.8	Confident	83 Å²	83	75 Å²	75	31%	0.313	39%	0.394	S	S	.	.	H	α-helix	trans	-58.7	-49.7	176.7	-57.9	175.2	176.1	164.9	-0.2	112.1	L17 S18 A20 I23 N70 L74 I75 Q76	L17-R72 PolarHBondContact O-NE 3.14Å; S18-R72 PolarHBondContact O-NH1 3.27Å; S18-R72 PolarHBondContact O-NH2 2.93Å; S18-R72 VanDerWaalsContact O-NH2 3.16Å; A20-R72 PolarHBondContact O-NH2 3.44Å; I23-R72 HydrophobicContact CD1-CB 4.32Å; I23-R72 HydrophobicContact CD1-CG 3.22Å; N70-R72 PolarHBondContact O-N 2.92Å; N70-R72 VanDerWaalsContact OD1-CB 3.3Å; N70-R72 WeakPolarHBondContact OD1-CB 3.41Å; N70-R72 PolarHBondContact OD1-N 3.09Å; R72-L74 VanDerWaalsContact C-N 3.3Å; R72-L74 PolarHBondContact O-N 3.24Å; R72-I75 PolarHBondContact O-N 3.01Å; R72-Q76 WeakPolarHBondContact O-CB 3.49Å; R72-Q76 VanDerWaalsContact O-CG 3.31Å; R72-Q76 WeakPolarHBondContact O-CG 3.3Å; R72-Q76 PolarHBondContact O-N 3.45Å
73	R	78.6	Confident	76.3	Confident	186 Å²	186	73.2 Å²	73.2	70%	0.702	39%	0.386	S	S	*	.	H	α-helix	trans	-66.5	-35.6	-178.8	-172.4	177.6	179.5	-176.2	0.6	111.3	N70 K71 R77	N70-R73 HydrophobicContact CB-CB 4.27Å; N70-R73 PolarHBondContact O-N 3.47Å; K71-R73 PolarHBondContact O-N 2.93Å; R73-R77 VanDerWaalsContact O-CB 3.26Å; R73-R77 WeakPolarHBondContact O-CB 3.35Å; R73-R77 PolarHBondContact O-N 3.47Å
74	L	81.9	Confident	77.1	Confident	60 Å²	60	66.9 Å²	66.9	31%	0.314	35%	0.353	S	S	.	.	H	α-helix	trans	-66.7	-45.8	177.6	-175.3	52.4	0	0	0	111.2	M65 M69 N70 K71 R72 R77 A78	M65-L74 HydrophobicContact CE-CB 4.22Å; M65-L74 HydrophobicContact CE-CD2 3.32Å; M65-L74 HydrophobicContact CE-CG 3.75Å; M65-L74 HydrophobicContact CG-CD2 4.12Å; M65-L74 HydrophobicContact SD-CD2 4.36Å; M69-L74 HydrophobicContact CE-CD2 4.3Å; N70-L74 PolarHBondContact O-N 3.35Å; K71-L74 PolarHBondContact O-N 3.34Å; R72-L74 VanDerWaalsContact C-N 3.3Å; R72-L74 PolarHBondContact O-N 3.24Å; L74-R77 PolarHBondContact O-N 3.43Å; L74-A78 PolarHBondContact O-N 3.45Å
75	I	83.1	Confident	78.1	Confident	0 Å²	0	65.4 Å²	65.4	0%	0	34%	0.344	C	S	.	.	H	α-helix	trans	-61.5	-47	175.4	-64.3	168.1	0	0	0	111.1	L17 I23 L28 M31 I60 K71 R72 R77 A78 V79	L17-I75 HydrophobicContact CD1-CB 4.36Å; L17-I75 HydrophobicContact CD1-CG2 3.78Å; I23-I75 HydrophobicContact CG2-CD1 3.58Å; L28-I75 HydrophobicContact CD1-CD1 4.34Å; L28-I75 HydrophobicContact CD1-CG1 4.46Å; L28-I75 HydrophobicContact CD1-CG2 3.85Å; M31-I75 HydrophobicContact CE-CG2 3.46Å; M31-I75 VanDerWaalsContact CE-CG2 3.46Å; I60-I75 HydrophobicContact CD1-CB 4.43Å; I60-I75 HydrophobicContact CD1-CG1 3.98Å; I60-I75 HydrophobicContact CD1-CG2 4.26Å; K71-I75 VanDerWaalsContact O-CG1 3.3Å; K71-I75 WeakPolarHBondContact O-CG1 3.18Å; K71-I75 PolarHBondContact O-N 3.02Å; R72-I75 PolarHBondContact O-N 3.01Å; I75-R77 VanDerWaalsContact C-N 3.29Å; I75-R77 PolarHBondContact O-N 2.96Å; I75-A78 PolarHBondContact O-N 3.08Å; I75-V79 WeakPolarHBondContact O-CG2 3.37Å; I75-V79 PolarHBondContact O-N 3.31Å
76	Q	80.8	Confident	78.8	Confident	66 Å²	66	65.6 Å²	65.6	31%	0.308	35%	0.346	S	S	.	.	H	α-helix	trans	-57.5	-43.6	176.7	-76.9	175.4	-8.4	0	0	112.1	I14 R72 F80	I14-Q76 HydrophobicContact CG2-CG 3.53Å; R72-Q76 WeakPolarHBondContact O-CB 3.49Å; R72-Q76 VanDerWaalsContact O-CG 3.31Å; R72-Q76 WeakPolarHBondContact O-CG 3.3Å; R72-Q76 PolarHBondContact O-N 3.45Å; Q76-F80 WeakPolarHBondContact O-CB 3.01Å; Q76-F80 PolarHBondContact O-N 2.95Å
77	R	83.8	Confident	79.7	Confident	151 Å²	151	63 Å²	63	57%	0.57	32%	0.324	S	S	*	.	H	α-helix	trans	-65.5	-41.5	177.2	177.9	178	156.8	-177.3	-8.4	111.7	R73 L74 I75 F80 Q81	R73-R77 VanDerWaalsContact O-CB 3.26Å; R73-R77 WeakPolarHBondContact O-CB 3.35Å; R73-R77 PolarHBondContact O-N 3.47Å; L74-R77 PolarHBondContact O-N 3.43Å; I75-R77 VanDerWaalsContact C-N 3.29Å; I75-R77 PolarHBondContact O-N 2.96Å; R77-F80 PolarHBondContact O-N 3.26Å; R77-Q81 HydrophobicContact CG-CG 4.32Å; R77-Q81 WeakPolarHBondContact O-CB 3.23Å; R77-Q81 VanDerWaalsContact O-CG 3.25Å; R77-Q81 WeakPolarHBondContact O-CG 3.41Å; R77-Q81 PolarHBondContact O-N 2.95Å
78	A	86.4	Confident	81.1	Confident	6 Å²	6	61.2 Å²	61.2	5%	0.05	30%	0.299	C	S	.	.	H	α-helix	trans	-61.3	-48.7	177	0	0	0	0	0	111.2	I60 L74 I75 F80 Q81 E82	I60-A78 HydrophobicContact CD1-CB 4.39Å; I60-A78 HydrophobicContact CG1-CB 4.45Å; L74-A78 PolarHBondContact O-N 3.45Å; I75-A78 PolarHBondContact O-N 3.08Å; A78-F80 PolarHBondContact O-N 3.35Å; A78-Q81 PolarHBondContact O-N 3.05Å; A78-E82 WeakPolarHBondContact O-CG 3.49Å; A78-E82 PolarHBondContact O-N 2.94Å
79	V	85.6	Confident	82	Confident	0 Å²	0	59.2 Å²	59.2	0%	0	27%	0.271	C	S	.	.	H	α-helix	trans	-59.6	-44.9	175.9	174.6	0	0	0	0	111.3	M31 V56 I75 Q81 E82 L83	M31-V79 HydrophobicContact CE-CG2 4.06Å; V56-V79 HydrophobicContact CG1-CG2 4.14Å; V56-V79 HydrophobicContact CG2-CG2 4.44Å; I75-V79 WeakPolarHBondContact O-CG2 3.37Å; I75-V79 PolarHBondContact O-N 3.31Å; V79-Q81 PolarHBondContact O-N 2.86Å; V79-E82 PolarHBondContact O-N 3.33Å; V79-L83 HydrophobicContact CG1-CD1 4.01Å; V79-L83 HydrophobicContact CG1-CG 4.5Å; V79-L83 WeakPolarHBondContact O-CB 3.19Å; V79-L83 WeakPolarHBondContact O-CG 3.25Å; V79-L83 PolarHBondContact O-N 3.28Å
80	F	84.8	Confident	82.7	Confident	42 Å²	42	58 Å²	58	18%	0.184	28%	0.282	C	S	.	.	H	α-helix	trans	-60.7	-45.4	176.9	177.9	-98.3	0	0	0	112.2	Q76 R77 A78 L83 V84 V291 Q292 L295	Q76-F80 WeakPolarHBondContact O-CB 3.01Å; Q76-F80 PolarHBondContact O-N 2.95Å; R77-F80 PolarHBondContact O-N 3.26Å; A78-F80 PolarHBondContact O-N 3.35Å; F80-L83 PolarHBondContact O-N 3.1Å; F80-V84 HydrophobicContact CD1-CG2 4.2Å; F80-V84 HydrophobicContact CE1-CG2 3.79Å; F80-V84 HydrophobicContact CE2-CG2 4.27Å; F80-V84 HydrophobicContact CZ-CG2 3.84Å; F80-V84 WeakPolarHBondContact O-CG2 3.44Å; F80-V84 PolarHBondContact O-N 3.31Å; F80-V291 HydrophobicContact CD2-CB 4.34Å; F80-V291 HydrophobicContact CD2-CG1 3.52Å; F80-V291 HydrophobicContact CE2-CB 3.84Å; F80-V291 HydrophobicContact CE2-CG1 3.54Å; F80-V291 HydrophobicContact CG-CG1 4.48Å; F80-V291 HydrophobicContact CZ-CG1 4.49Å; F80-Q292 HydrophobicContact CE2-CG 3.69Å; F80-Q292 HydrophobicContact CZ-CG 3.91Å; F80-L295 HydrophobicContact CB-CD1 3.96Å; F80-L295 HydrophobicContact CD2-CD1 3.56Å; F80-L295 HydrophobicContact CD2-CG 4.45Å; F80-L295 HydrophobicContact CG-CD1 4.24Å
81	Q	87.6	Confident	83.1	Confident	75 Å²	75	56.9 Å²	56.9	35%	0.35	28%	0.279	S	S	.	.	H	α-helix	trans	-64.9	-41.5	-179.8	-75.3	179.7	-26.3	0	0	111.9	R77 A78 V79 V84 K85	R77-Q81 HydrophobicContact CG-CG 4.32Å; R77-Q81 WeakPolarHBondContact O-CB 3.23Å; R77-Q81 VanDerWaalsContact O-CG 3.25Å; R77-Q81 WeakPolarHBondContact O-CG 3.41Å; R77-Q81 PolarHBondContact O-N 2.95Å; A78-Q81 PolarHBondContact O-N 3.05Å; V79-Q81 PolarHBondContact O-N 2.86Å; Q81-V84 PolarHBondContact O-N 2.89Å; Q81-K85 WeakPolarHBondContact O-CG 3.44Å; Q81-K85 PolarHBondContact O-N 3.38Å
82	E	87.8	Confident	83.3	Confident	12 Å²	12	61.2 Å²	61.2	6%	0.056	30%	0.298	C	S	.	.	H	α-helix	trans	-67.3	-38.4	176.1	-70	-54.1	125.2	0	0	112.3	L52 S55 V56 Q59 A78 V79 V84 K85 L86	L52-E82 HydrophobicContact CG-CB 4.42Å; S55-E82 VanDerWaalsContact CB-OE2 3.27Å; S55-E82 WeakPolarHBondContact CB-OE2 3.28Å; V56-E82 HydrophobicContact CG2-CB 3.84Å; V56-E82 HydrophobicContact CG2-CG 3.63Å; Q59-E82 PolarHBondContact NE2-OE1 3.43Å; A78-E82 WeakPolarHBondContact O-CG 3.49Å; A78-E82 PolarHBondContact O-N 2.94Å; V79-E82 PolarHBondContact O-N 3.33Å; E82-V84 VanDerWaalsContact C-N 3.35Å; E82-V84 PolarHBondContact O-N 3.4Å; E82-K85 PolarHBondContact O-N 3.38Å; E82-K85 WeakPolarHBondContact OE1-CD 3.27Å; E82-K85 WeakPolarHBondContact OE1-CE 2.94Å; E82-K85 IonicContact OE1-NZ 3.8Å; E82-K85 PolarHBondContact OE1-NZ 2.99Å; E82-L86 WeakPolarHBondContact O-CG 3.46Å; E82-L86 PolarHBondContact O-N 3.42Å; E82-L86 VanDerWaalsContact O-N 3.07Å
83	L	83.9	Confident	83.6	Confident	6 Å²	6	60.9 Å²	60.9	3%	0.031	30%	0.3	C	S	.	.	H	α-helix	trans	-62.4	-41	171.8	-74.4	170.6	0	0	0	112.2	L39 L52 V79 F80 L86 V87 V291 L294 L295	L39-L83 HydrophobicContact CD1-CD2 4.49Å; L39-L83 HydrophobicContact CD2-CD2 4.44Å; L52-L83 HydrophobicContact CD1-CD2 3.58Å; L52-L83 HydrophobicContact CD1-CG 4.05Å; V79-L83 HydrophobicContact CG1-CD1 4.01Å; V79-L83 HydrophobicContact CG1-CG 4.5Å; V79-L83 WeakPolarHBondContact O-CB 3.19Å; V79-L83 WeakPolarHBondContact O-CG 3.25Å; V79-L83 PolarHBondContact O-N 3.28Å; F80-L83 PolarHBondContact O-N 3.1Å; L83-L86 PolarHBondContact O-N 2.85Å; L83-V87 WeakPolarHBondContact O-CG2 3.46Å; L83-V87 PolarHBondContact O-N 2.88Å; L83-V291 HydrophobicContact CB-CG1 3.73Å; L83-V291 HydrophobicContact CD1-CG1 4.27Å; L83-L294 HydrophobicContact CD1-CD2 4.29Å; L83-L295 HydrophobicContact CD1-CD2 3.91Å
84	V	86.6	Confident	84	Confident	24 Å²	24	53.8 Å²	53.8	15%	0.145	27%	0.273	C	S	.	.	H	α-helix	trans	-62.2	-44.1	174.9	168.3	0	0	0	0	110.9	F80 Q81 E82 L86 V87 D88 V287 V291	F80-V84 HydrophobicContact CD1-CG2 4.2Å; F80-V84 HydrophobicContact CE1-CG2 3.79Å; F80-V84 HydrophobicContact CE2-CG2 4.27Å; F80-V84 HydrophobicContact CZ-CG2 3.84Å; F80-V84 WeakPolarHBondContact O-CG2 3.44Å; F80-V84 PolarHBondContact O-N 3.31Å; Q81-V84 PolarHBondContact O-N 2.89Å; E82-V84 VanDerWaalsContact C-N 3.35Å; E82-V84 PolarHBondContact O-N 3.4Å; V84-L86 VanDerWaalsContact C-N 3.29Å; V84-L86 PolarHBondContact O-N 2.86Å; V84-V87 PolarHBondContact O-N 2.91Å; V84-V87 VanDerWaalsContact O-N 3.1Å; V84-D88 WeakPolarHBondContact O-CB 3.44Å; V84-D88 PolarHBondContact O-N 3.16Å; V84-V287 HydrophobicContact CB-CG1 4.44Å; V84-V287 HydrophobicContact CG1-CG1 3.94Å; V84-V287 HydrophobicContact CG2-CG1 4.48Å; V84-V291 HydrophobicContact CG2-CB 4.06Å; V84-V291 HydrophobicContact CG2-CG1 4.16Å; V84-V291 HydrophobicContact CG2-CG2 3.92Å
85	K	85.7	Confident	84.3	Confident	122 Å²	122	56.5 Å²	56.5	53%	0.53	28%	0.284	S	S	.	.	H	α-helix	trans	-62.7	-31.9	178.1	-73.9	178	-172.1	170.9	0	113.7	Q81 E82 V87	Q81-K85 WeakPolarHBondContact O-CG 3.44Å; Q81-K85 PolarHBondContact O-N 3.38Å; E82-K85 PolarHBondContact O-N 3.38Å; E82-K85 WeakPolarHBondContact OE1-CD 3.27Å; E82-K85 WeakPolarHBondContact OE1-CE 2.94Å; E82-K85 IonicContact OE1-NZ 3.8Å; E82-K85 PolarHBondContact OE1-NZ 2.99Å; K85-V87 VanDerWaalsContact C-N 3.3Å
86	L	81.5	Confident	84.7	Confident	25 Å²	25	57.6 Å²	57.6	13%	0.131	29%	0.291	C	S	.	.	H	α-helix	trans	-69.6	-29.3	175	-73	-176.6	0	0	0	113	L48 L52 E82 L83 V84 L260	L48-L86 HydrophobicContact CD2-CD2 4.37Å; L52-L86 HydrophobicContact CB-CD1 4.11Å; L52-L86 HydrophobicContact CD1-CD1 3.54Å; L52-L86 HydrophobicContact CD1-CG 4.5Å; L52-L86 HydrophobicContact CG-CD1 4.42Å; E82-L86 WeakPolarHBondContact O-CG 3.46Å; E82-L86 PolarHBondContact O-N 3.42Å; E82-L86 VanDerWaalsContact O-N 3.07Å; L83-L86 PolarHBondContact O-N 2.85Å; V84-L86 VanDerWaalsContact C-N 3.29Å; V84-L86 PolarHBondContact O-N 2.86Å; L86-L260 HydrophobicContact CB-CD2 4.48Å
87	V	81.6	Confident	85.2	Confident	5 Å²	5	57.5 Å²	57.5	3%	0.03	30%	0.295	C	S	.	.	H	α-helix	trans	-92.6	-28.7	-176.8	-176.1	0	0	0	0	111.6	L83 V84 K85 P89 L260 F285 V287 V291	L83-V87 WeakPolarHBondContact O-CG2 3.46Å; L83-V87 PolarHBondContact O-N 2.88Å; V84-V87 PolarHBondContact O-N 2.91Å; V84-V87 VanDerWaalsContact O-N 3.1Å; K85-V87 VanDerWaalsContact C-N 3.3Å; V87-P89 WeakPolarHBondContact O-CD 3.3Å; V87-L260 HydrophobicContact CB-CD2 4.12Å; V87-L260 HydrophobicContact CG2-CD2 3.16Å; V87-F285 HydrophobicContact CG1-CE1 3.69Å; V87-F285 HydrophobicContact CG1-CZ 3.6Å; V87-V287 HydrophobicContact CB-CG1 3.74Å; V87-V287 HydrophobicContact CG1-CB 4.41Å; V87-V287 HydrophobicContact CG1-CG1 3.74Å; V87-V287 HydrophobicContact CG1-CG2 4.18Å; V87-V291 HydrophobicContact CG2-CG2 4.05Å
88	D	84.5	Confident	85.5	Confident	74 Å²	74	56.3 Å²	56.3	40%	0.396	29%	0.294	S	S	.	.			trans	-99.6	109.3	-175.7	-167.6	-6.7	0	0	0	110.8	V84 G90 V287	V84-D88 WeakPolarHBondContact O-CB 3.44Å; V84-D88 PolarHBondContact O-N 3.16Å; D88-G90 PolarHBondContact O-N 3.35Å; D88-G90 PolarHBondContact OD1-N 2.99Å; D88-V287 HydrophobicContact CB-CG1 4.23Å; D88-V287 HydrophobicContact CB-CG2 4.16Å
89	P	80.6	Confident	85.5	Confident	39 Å²	39	59.5 Å²	59.5	25%	0.253	33%	0.328	S	S	.	.			trans	-74.7	-5.6	175.9	31	-33.1	0	0	0	112.9	V87 V91 V263 H267 P269	V87-P89 WeakPolarHBondContact O-CD 3.3Å; P89-V91 HydrophobicContact CB-CG2 4.34Å; P89-V91 HydrophobicContact CG-CB 4.38Å; P89-V91 PolarHBondContact O-N 3.44Å; P89-V263 HydrophobicContact CB-CG1 4.08Å; P89-V263 HydrophobicContact CG-CG1 4.08Å; P89-H267 WeakPolarHBondContact CB-O 3.49Å; P89-P269 HydrophobicContact CG-CB 3.98Å
90	G	81.9	Confident	85.8	Confident	69 Å²	69	64.8 Å²	64.8	71%	0.711	35%	0.348	S	S	*	.	S	Bend	trans	73.8	7.5	-175.9	0	0	0	0	0	114.1	D88	D88-G90 PolarHBondContact O-N 3.35Å; D88-G90 PolarHBondContact OD1-N 2.99Å
91	V	81.3	Confident	86.2	Confident	77 Å²	77	65.6 Å²	65.6	47%	0.467	36%	0.357	S	S	.	.	P	Polyproline II helix	trans	-93.7	133.6	178.9	179.1	0	0	0	0	109.6	P89 Q93 P269	P89-V91 HydrophobicContact CB-CG2 4.34Å; P89-V91 HydrophobicContact CG-CB 4.38Å; P89-V91 PolarHBondContact O-N 3.44Å; V91-Q93 PolarHBondContact O-N 3.3Å; V91-P269 HydrophobicContact CG1-CG 4.5Å
92	K	82.6	Confident	86.7	Confident	163 Å²	163	62 Å²	62	71%	0.709	34%	0.34	S	S	*	.	P	Polyproline II helix	trans	-65.2	131.3	177.3	-171.1	-178.6	175.3	-172.3	0	109.8
93	Q	84.9	Confident	87.1	Confident	77 Å²	77	61.8 Å²	61.8	36%	0.36	34%	0.34	S	S	.	.	P	Polyproline II helix	trans	-58.2	142.7	174.3	-65.9	178.3	-13.1	0	0	111.1	V91 Q95 P269 I270 I271 F285	V91-Q93 PolarHBondContact O-N 3.3Å; Q93-Q95 PolarHBondContact O-N 3.21Å; Q93-P269 HydrophobicContact CG-CB 4.03Å; Q93-P269 HydrophobicContact CG-CG 4.18Å; Q93-I270 PolarHBondContact NE2-O 3.49Å; Q93-I270 VanDerWaalsContact NE2-O 3.11Å; Q93-I271 HydrophobicContact CB-CG2 3.95Å; Q93-I271 HydrophobicContact CG-CG2 3.88Å; Q93-F285 PolarHBondContact NE2-O 3.02Å
94	W	86.7	Confident	87.7	Confident	36 Å²	36	61.5 Å²	61.5	14%	0.136	34%	0.338	C	S	.	.	P	Polyproline II helix	trans	-58.9	135.7	171.5	171.5	77.9	0	0	0	110.4	P96 N102 V104 Y125 E215 C216	W94-P96 HydrophobicContact CH2-CB 3.65Å; W94-P96 HydrophobicContact CH2-CG 4.03Å; W94-P96 HydrophobicContact CZ2-CB 3.67Å; W94-P96 HydrophobicContact CZ2-CG 4.41Å; W94-P96 HydrophobicContact CZ3-CB 4.47Å; W94-P96 HydrophobicContact CZ3-CG 4.4Å; W94-N102 HydrophobicContact CZ2-CB 3.93Å; W94-V104 HydrophobicContact CH2-CG2 3.45Å; W94-V104 VanDerWaalsContact CH2-CG2 3.45Å; W94-V104 HydrophobicContact CZ2-CG2 3.84Å; W94-V104 HydrophobicContact CZ3-CG2 4.02Å; W94-Y125 HydrophobicContact CZ3-CE2 4.36Å; W94-E215 PolarHBondContact NE1-OE1 3.37Å; W94-C216 HydrophobicContact CB-CB 4.41Å; W94-C216 HydrophobicContact CD2-CB 3.75Å; W94-C216 HydrophobicContact CE3-CB 4.35Å; W94-C216 HydrophobicContact CG-CB 3.73Å
95	Q	88.5	Confident	88.1	Confident	118 Å²	118	60.3 Å²	60.3	55%	0.551	33%	0.331	S	S	*	.			trans	-129.2	122.2	178.1	-70.1	179.4	-8.5	0	0	108.2	Q93	Q93-Q95 PolarHBondContact O-N 3.21Å
96	P	91.2	Very high	88.6	Confident	22 Å²	22	54.5 Å²	54.5	14%	0.143	31%	0.306	C	S	.	.	P	Polyproline II helix	trans	-64.2	148.1	177.5	25.5	-32.5	0	0	0	111	W94 N102 Y125 W130 I186	W94-P96 HydrophobicContact CH2-CB 3.65Å; W94-P96 HydrophobicContact CH2-CG 4.03Å; W94-P96 HydrophobicContact CZ2-CB 3.67Å; W94-P96 HydrophobicContact CZ2-CG 4.41Å; W94-P96 HydrophobicContact CZ3-CB 4.47Å; W94-P96 HydrophobicContact CZ3-CG 4.4Å; P96-N102 HydrophobicContact CB-CB 4.37Å; P96-Y125 HydrophobicContact CG-CD1 4.36Å; P96-Y125 HydrophobicContact CG-CE1 3.64Å; P96-W130 HydrophobicContact CB-CH2 3.73Å; P96-W130 HydrophobicContact CB-CZ2 4.36Å; P96-W130 HydrophobicContact CB-CZ3 3.91Å; P96-W130 HydrophobicContact CG-CH2 3.85Å; P96-W130 HydrophobicContact CG-CZ2 3.96Å; P96-W130 HydrophobicContact CG-CZ3 4.35Å; P96-W130 WeakPolarHBondContact O-CH2 3.44Å; P96-I186 HydrophobicContact CB-CD1 3.43Å; P96-I186 VanDerWaalsContact CB-CD1 3.43Å; P96-I186 HydrophobicContact CG-CD1 4Å
97	T	92.4	Very high	89.1	Confident	64 Å²	64	53.3 Å²	53.3	39%	0.393	30%	0.3	S	S	.	.	P	Polyproline II helix	trans	-100.4	127.4	175.8	-56.9	0	0	0	0	109.7	R100 N102	T97-R100 HydrophobicContact CG2-CG 4.2Å; T97-R100 PolarHBondContact OG1-NH2 3.13Å; T97-N102 PolarHBondContact N-OD1 3.15Å; T97-N102 PolarHBondContact O-ND2 3.2Å
98	K	89.2	Confident	89.6	Confident	126 Å²	126	53.1 Å²	53.1	55%	0.548	30%	0.298	S	S	.	.	T	Hydrogen-bonded Turn	trans	-67.4	148.7	178	-81.9	-154	173.1	-158.6	0	111.7	R100 W130	K98-R100 VanDerWaalsContact C-N 3.28Å; K98-R100 PolarHBondContact O-N 3.32Å; K98-W130 HydrophobicContact CB-CH2 4.02Å; K98-W130 HydrophobicContact CB-CZ3 4.21Å; K98-W130 HydrophobicContact CD-CH2 4.43Å; K98-W130 HydrophobicContact CD-CZ2 4.28Å; K98-W130 HydrophobicContact CG-CD2 4.37Å; K98-W130 HydrophobicContact CG-CE3 4.13Å; K98-W130 HydrophobicContact CG-CH2 3.21Å; K98-W130 HydrophobicContact CG-CZ2 3.44Å; K98-W130 VanDerWaalsContact CG-CZ2 3.44Å; K98-W130 HydrophobicContact CG-CZ3 3.58Å
99	G	86.8	Confident	89.7	Confident	74 Å²	74	50.3 Å²	50.3	76%	0.763	28%	0.284	S	S	*	.	T	Hydrogen-bonded Turn	trans	77	5.5	176.5	0	0	0	0	0	115.7	E185	G99-E185 PolarHBondContact N-OE1 3.33Å
100	R	92	Very high	90	Very high	111 Å²	111	54.9 Å²	54.9	42%	0.419	30%	0.302	S	S	.	.	S	Bend	trans	-130.6	155.5	170.7	74.6	172.6	-167.8	-174.1	-7	110.8	T97 K98 N102 E215	T97-R100 HydrophobicContact CG2-CG 4.2Å; T97-R100 PolarHBondContact OG1-NH2 3.13Å; K98-R100 VanDerWaalsContact C-N 3.28Å; K98-R100 PolarHBondContact O-N 3.32Å; R100-N102 PolarHBondContact O-N 3.42Å; R100-N102 PolarHBondContact O-ND2 2.79Å; R100-E215 IonicContact CZ-OE1 3.74Å; R100-E215 IonicContact CZ-OE2 3.64Å; R100-E215 IonicContact NE-OE2 2.77Å; R100-E215 PolarHBondContact NE-OE2 3.49Å; R100-E215 IonicContact NH2-OE1 3.63Å; R100-E215 PolarHBondContact NH2-OE1 2.97Å; R100-E215 IonicContact NH2-OE2 3.82Å; R100-E215 PolarHBondContact NH2-OE2 3.24Å
101	P	93.8	Very high	90.2	Very high	58 Å²	58	54.2 Å²	54.2	38%	0.377	30%	0.295	S	S	.	.			trans	-71.8	118.5	173	28.8	-33.4	0	0	0	110.1	K180 I187	P101-K180 HydrophobicContact CB-CG 3.92Å; P101-K180 HydrophobicContact CG-CG 4.1Å; P101-I187 HydrophobicContact CB-CD1 4.11Å
102	N	96.3	Very high	90.6	Very high	0 Å²	0	50.7 Å²	50.7	0%	0	27%	0.273	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.5	108.7	173.4	-50.1	-97.5	0	0	0	108.3	W94 P96 T97 R100 E185 I186 I187 E215	W94-N102 HydrophobicContact CZ2-CB 3.93Å; P96-N102 HydrophobicContact CB-CB 4.37Å; T97-N102 PolarHBondContact N-OD1 3.15Å; T97-N102 PolarHBondContact O-ND2 3.2Å; R100-N102 PolarHBondContact O-N 3.42Å; R100-N102 PolarHBondContact O-ND2 2.79Å; N102-E185 WeakPolarHBondContact CB-O 3.44Å; N102-E185 PolarHBondContact N-O 3.4Å; N102-E185 PolarHBondContact ND2-O 2.87Å; N102-I186 HydrophobicContact CB-CD1 4.11Å; N102-I187 PolarHBondContact O-N 3.36Å; N102-E215 PolarHBondContact OD1-OE2 2.84Å
103	V	96.3	Very high	91	Very high	7 Å²	7	43.9 Å²	43.9	4%	0.042	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	123.6	-179.2	-177.5	0	0	0	0	109.4	V176 I187 V189 I212 P214 E215 C216	V103-V176 HydrophobicContact CG1-CG2 4.15Å; V103-V176 HydrophobicContact CG2-CG1 3.94Å; V103-I187 WeakPolarHBondContact CA-O 3.36Å; V103-I187 HydrophobicContact CG2-CB 4.39Å; V103-I187 HydrophobicContact CG2-CD1 4.3Å; V103-V189 HydrophobicContact CG1-CG2 4.5Å; V103-I212 HydrophobicContact CG1-CB 4.42Å; V103-I212 HydrophobicContact CG1-CD1 4.16Å; V103-I212 HydrophobicContact CG1-CG1 4.27Å; V103-P214 HydrophobicContact CG1-CB 4.28Å; V103-P214 CarbonylContact O-C 3.6Å; V103-E215 PolarHBondContact O-N 3.48Å; V103-C216 PolarHBondContact O-N 3Å
104	V	96.5	Very high	91.5	Very high	0 Å²	0	40.8 Å²	40.8	0%	0	24%	0.235	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	120.1	-176	-174.8	0	0	0	0	109.5	W94 F106 I187 I188 V189 C216 I218	W94-V104 HydrophobicContact CH2-CG2 3.45Å; W94-V104 VanDerWaalsContact CH2-CG2 3.45Å; W94-V104 HydrophobicContact CZ2-CG2 3.84Å; W94-V104 HydrophobicContact CZ3-CG2 4.02Å; V104-F106 HydrophobicContact CG1-CD2 4.13Å; V104-F106 HydrophobicContact CG1-CE2 3.78Å; V104-I187 PolarHBondContact N-O 2.88Å; V104-I188 HydrophobicContact CB-CG1 4.36Å; V104-I188 WeakPolarHBondContact O-CA 3.41Å; V104-V189 PolarHBondContact O-N 3.22Å; V104-C216 WeakPolarHBondContact CA-O 3.32Å; V104-I218 HydrophobicContact CG1-CD1 3.32Å; V104-I218 HydrophobicContact CG1-CG1 3.82Å
105	M	95.9	Very high	91.8	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	23%	0.231	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.4	129.3	-179.3	-170.2	175.6	77.6	0	0	110.8	V107 T191 V208 I212 P214 C216 V217 I218 V240	M105-V107 HydrophobicContact CE-CG1 3.66Å; M105-V107 HydrophobicContact CG-CG1 4.39Å; M105-T191 HydrophobicContact CG-CG2 3.8Å; M105-T191 HydrophobicContact SD-CG2 4.24Å; M105-V208 HydrophobicContact SD-CG1 4.04Å; M105-I212 HydrophobicContact CB-CD1 4.22Å; M105-I212 HydrophobicContact CG-CD1 4.24Å; M105-I212 HydrophobicContact SD-CD1 3.98Å; M105-P214 HydrophobicContact CB-CB 3.85Å; M105-P214 HydrophobicContact CB-CG 4.08Å; M105-P214 HydrophobicContact SD-CG 4.48Å; M105-C216 PolarHBondContact N-O 2.95Å; M105-V217 HydrophobicContact CB-CG2 4.39Å; M105-V217 HydrophobicContact CE-CG1 3.92Å; M105-V217 HydrophobicContact CE-CG2 3.94Å; M105-V217 CarbonylContact O-C 3.56Å; M105-V217 WeakPolarHBondContact O-CA 3.49Å; M105-I218 PolarHBondContact O-N 3.46Å; M105-V240 HydrophobicContact CE-CG1 3.71Å
106	F	95.6	Very high	92.1	Very high	0 Å²	0	36 Å²	36	0%	0	22%	0.218	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-99.8	121.3	179.5	-85.5	-121	0	0	0	110.6	V104 T117 C118 L121 I188 V189 T191 I218 V220 I246	V104-F106 HydrophobicContact CG1-CD2 4.13Å; V104-F106 HydrophobicContact CG1-CE2 3.78Å; F106-T117 HydrophobicContact CE1-CG2 3.71Å; F106-C118 WeakPolarHBondContact CD1-SG 3.43Å; F106-C118 WeakPolarHBondContact CG-SG 3.37Å; F106-L121 HydrophobicContact CE2-CD2 3.68Å; F106-L121 HydrophobicContact CZ-CB 4.07Å; F106-L121 HydrophobicContact CZ-CD2 3.49Å; F106-L121 VanDerWaalsContact CZ-CD2 3.49Å; F106-L121 HydrophobicContact CZ-CG 4.37Å; F106-I188 HydrophobicContact CD2-CG2 3.78Å; F106-I188 HydrophobicContact CE2-CG2 3.67Å; F106-I188 HydrophobicContact CZ-CG2 4.45Å; F106-V189 PolarHBondContact N-O 3.4Å; F106-T191 WeakPolarHBondContact O-CG2 3.5Å; F106-T191 PolarHBondContact O-OG1 3.32Å; F106-I218 HydrophobicContact CD2-CB 4.47Å; F106-I218 HydrophobicContact CD2-CD1 4.49Å; F106-I218 HydrophobicContact CE1-CG2 4.44Å; F106-I218 HydrophobicContact CE2-CB 4.46Å; F106-I218 HydrophobicContact CE2-CD1 3.77Å; F106-I218 HydrophobicContact CZ-CD1 3.94Å; F106-V220 HydrophobicContact CD1-CG2 3.43Å; F106-V220 VanDerWaalsContact CD1-CG2 3.43Å; F106-V220 HydrophobicContact CE1-CG2 3.88Å; F106-V220 HydrophobicContact CG-CG2 4.41Å; F106-I246 HydrophobicContact CE1-CD1 4.07Å; F106-I246 HydrophobicContact CZ-CD1 4.17Å
107	V	93	Very high	92.3	Very high	0 Å²	0	35.2 Å²	35.2	0%	0	21%	0.212	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.4	160.1	178.5	-61.8	0	0	0	0	111.4	M105 M205 V217 I218 Y219 V220 F236 V242	M105-V107 HydrophobicContact CE-CG1 3.66Å; M105-V107 HydrophobicContact CG-CG1 4.39Å; V107-M205 HydrophobicContact CB-SD 4.4Å; V107-M205 HydrophobicContact CG1-SD 4.14Å; V107-V217 HydrophobicContact CB-CG1 4.48Å; V107-V217 HydrophobicContact CG1-CG1 4Å; V107-V217 HydrophobicContact CG2-CG1 3.64Å; V107-I218 PolarHBondContact N-O 3.44Å; V107-Y219 HydrophobicContact CG2-CD2 4.38Å; V107-Y219 WeakPolarHBondContact O-CA 3.49Å; V107-V220 PolarHBondContact O-N 3.03Å; V107-F236 HydrophobicContact CB-CD1 4.14Å; V107-F236 HydrophobicContact CB-CE1 4.24Å; V107-F236 HydrophobicContact CG2-CD1 4.19Å; V107-V242 HydrophobicContact CG2-CG2 4.27Å
108	G	90.6	Very high	92.5	Very high	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.193	C	C	.	.			trans	146.2	173.2	177.3	0	0	0	0	0	112.9	K114 G193	G108-K114 PolarHBondContact O-NZ 3.08Å; G108-G193 WeakPolarHBondContact O-CA 3.3Å
109	L	86.9	Confident	92.9	Very high	16 Å²	16	26.4 Å²	26.4	8%	0.084	17%	0.169	C	C	.	.			trans	-60.7	166.6	-175.4	-62.8	177.6	0	0	0	113.7	C112 K114 R194 I225 Q232 F236	L109-C112 PolarHBondContact O-SG 3.01Å; L109-K114 PolarHBondContact O-NZ 3.38Å; L109-R194 WeakPolarHBondContact CD2-O 3.48Å; L109-I225 HydrophobicContact CD1-CD1 3.86Å; L109-Q232 HydrophobicContact CD1-CG 4.24Å; L109-Q232 HydrophobicContact CD2-CG 4.42Å; L109-F236 HydrophobicContact CD2-CE2 4Å; L109-F236 HydrophobicContact CD2-CZ 4.45Å; L109-F236 HydrophobicContact CG-CE2 4.46Å
110	Q	87	Confident	93.4	Very high	135 Å²	135	23.2 Å²	23.2	63%	0.631	13%	0.134	S	C	*	.	T	Hydrogen-bonded Turn	trans	-60.9	137.9	169.1	-160.2	177	-0.2	0	0	110.9	C112 G193	Q110-C112 PolarHBondContact O-N 3.09Å; Q110-G193 VanDerWaalsContact CB-O 3.27Å; Q110-G193 WeakPolarHBondContact CB-O 3.36Å; Q110-G193 WeakPolarHBondContact CG-O 3.34Å
111	G	87.1	Confident	93.6	Very high	55 Å²	55	18 Å²	18	57%	0.567	11%	0.114	S	C	*	.	T	Hydrogen-bonded Turn	trans	72.7	4.6	173.5	0	0	0	0	0	116.1	G113 K249	G111-G113 PolarHBondContact O-N 3.42Å; G111-K249 PolarHBondContact O-NZ 3.16Å
112	C	89.4	Confident	93.7	Very high	2 Å²	2	15.2 Å²	15.2	1%	0.014	10%	0.096	C	C	.	.	S	Bend	trans	-74.8	-6.8	176.7	70.6	0	0	0	0	114.1	L109 Q110 V220 D222 T248	L109-C112 PolarHBondContact O-SG 3.01Å; Q110-C112 PolarHBondContact O-N 3.09Å; C112-V220 PolarHBondContact SG-O 3.42Å; C112-D222 HydrophobicContact CB-CB 4.23Å; C112-T248 PolarHBondContact O-OG1 3.18Å
113	G	91.8	Very high	93.7	Very high	20 Å²	20	17.8 Å²	17.8	21%	0.206	11%	0.106	C	C	.	.	S	Bend	trans	97.9	20.9	176.4	0	0	0	0	0	115.7	G111 T116 T117	G111-G113 PolarHBondContact O-N 3.42Å; G113-T116 PolarHBondContact O-N 2.95Å; G113-T117 WeakPolarHBondContact O-CB 3.36Å; G113-T117 PolarHBondContact O-N 2.86Å; G113-T117 PolarHBondContact O-OG1 3.13Å
114	K	93.9	Very high	93.6	Very high	13 Å²	13	19.9 Å²	19.9	6%	0.057	11%	0.114	C	C	.	.	H	α-helix	trans	-48.7	-63.9	178.2	-67.2	-168.2	-61.8	-70	0	113.5	G108 L109 T116 T117 C118 D190 T191 V220	G108-K114 PolarHBondContact O-NZ 3.08Å; L109-K114 PolarHBondContact O-NZ 3.38Å; K114-T116 VanDerWaalsContact C-N 3.27Å; K114-T116 PolarHBondContact O-N 3.28Å; K114-T116 VanDerWaalsContact O-N 3.15Å; K114-T117 CarbonylContact O-C 3.59Å; K114-T117 WeakPolarHBondContact O-CA 3.37Å; K114-T117 WeakPolarHBondContact O-CB 3.37Å; K114-T117 PolarHBondContact O-N 3.03Å; K114-C118 PolarHBondContact O-N 2.86Å; K114-C118 PolarHBondContact O-SG 2.76Å; K114-D190 WeakPolarHBondContact CB-OD1 3.35Å; K114-T191 WeakPolarHBondContact CE-O 3.34Å; K114-V220 HydrophobicContact CG-CB 4Å; K114-V220 HydrophobicContact CG-CG2 4.18Å
115	T	94.1	Very high	93.5	Very high	10 Å²	10	20.6 Å²	20.6	6%	0.061	12%	0.117	C	C	.	.	H	α-helix	trans	-52.2	-42.4	-178.3	-46.5	0	0	0	0	113.6	T119 Q147 L148 D190	T115-T119 PolarHBondContact O-N 3.37Å; T115-T119 PolarHBondContact O-OG1 3.32Å; T115-T119 VanDerWaalsContact O-OG1 3.13Å; T115-Q147 HydrophobicContact CG2-CG 4.17Å; T115-L148 HydrophobicContact CG2-CB 3.89Å; T115-L148 HydrophobicContact CG2-CD1 4.43Å; T115-L148 HydrophobicContact CG2-CG 4.49Å; T115-D190 VanDerWaalsContact CA-OD2 3.25Å; T115-D190 WeakPolarHBondContact CA-OD2 3.48Å; T115-D190 WeakPolarHBondContact CB-OD2 3.45Å; T115-D190 WeakPolarHBondContact CG2-OD2 3.26Å; T115-D190 PolarHBondContact N-OD1 3.34Å; T115-D190 PolarHBondContact OG1-OD2 3.06Å
116	T	94.3	Very high	93.4	Very high	44 Å²	44	23.6 Å²	23.6	27%	0.27	13%	0.131	S	C	.	.	H	α-helix	trans	-65.9	-44.4	175.9	-54.7	0	0	0	0	111	G113 K114 T119 K120	G113-T116 PolarHBondContact O-N 2.95Å; K114-T116 VanDerWaalsContact C-N 3.27Å; K114-T116 PolarHBondContact O-N 3.28Å; K114-T116 VanDerWaalsContact O-N 3.15Å; T116-T119 PolarHBondContact O-N 3.11Å; T116-K120 HydrophobicContact CG2-CD 4.22Å; T116-K120 WeakPolarHBondContact O-CG 3.45Å; T116-K120 PolarHBondContact O-N 2.91Å
117	T	96.3	Very high	93.2	Very high	4 Å²	4	29.8 Å²	29.8	3%	0.025	16%	0.158	C	C	.	.	H	α-helix	trans	-68	-36.8	-179.6	-50.3	0	0	0	0	112.1	F106 G113 K114 T119 K120 L121 I246 T248 F282	F106-T117 HydrophobicContact CE1-CG2 3.71Å; G113-T117 WeakPolarHBondContact O-CB 3.36Å; G113-T117 PolarHBondContact O-N 2.86Å; G113-T117 PolarHBondContact O-OG1 3.13Å; K114-T117 CarbonylContact O-C 3.59Å; K114-T117 WeakPolarHBondContact O-CA 3.37Å; K114-T117 WeakPolarHBondContact O-CB 3.37Å; K114-T117 PolarHBondContact O-N 3.03Å; T117-T119 VanDerWaalsContact C-N 3.31Å; T117-T119 PolarHBondContact O-N 3.42Å; T117-K120 PolarHBondContact O-N 2.96Å; T117-L121 WeakPolarHBondContact O-CB 3.36Å; T117-L121 PolarHBondContact O-N 3.33Å; T117-I246 HydrophobicContact CG2-CB 4.36Å; T117-I246 HydrophobicContact CG2-CD1 3.73Å; T117-I246 HydrophobicContact CG2-CG2 3.66Å; T117-T248 WeakPolarHBondContact OG1-CG2 3.35Å; T117-F282 HydrophobicContact CG2-CE2 3.8Å; T117-F282 HydrophobicContact CG2-CZ 4.22Å
118	C	96.7	Very high	93.1	Very high	0 Å²	0	35 Å²	35	0%	0	18%	0.18	C	C	.	.	H	α-helix	trans	-55.3	-49.2	172.7	-64.5	0	0	0	0	110.3	F106 K114 K120 L121 A122 L134 I188 D190	F106-C118 WeakPolarHBondContact CD1-SG 3.43Å; F106-C118 WeakPolarHBondContact CG-SG 3.37Å; K114-C118 PolarHBondContact O-N 2.86Å; K114-C118 PolarHBondContact O-SG 2.76Å; C118-K120 PolarHBondContact O-N 2.96Å; C118-L121 PolarHBondContact O-N 3.5Å; C118-A122 WeakPolarHBondContact O-CB 2.8Å; C118-A122 PolarHBondContact O-N 3.35Å; C118-L134 HydrophobicContact CB-CD2 3.79Å; C118-I188 HydrophobicContact CB-CG2 3.73Å; C118-D190 HydrophobicContact CB-CB 4.49Å
119	T	96.5	Very high	93.2	Very high	5 Å²	5	37.6 Å²	37.6	3%	0.031	21%	0.207	C	C	.	.	H	α-helix	trans	-63.3	-43.6	177.9	-49.4	0	0	0	0	111.5	T115 T116 T117 A122 Y123 L134 N151 A155 I279	T115-T119 PolarHBondContact O-N 3.37Å; T115-T119 PolarHBondContact O-OG1 3.32Å; T115-T119 VanDerWaalsContact O-OG1 3.13Å; T116-T119 PolarHBondContact O-N 3.11Å; T117-T119 VanDerWaalsContact C-N 3.31Å; T117-T119 PolarHBondContact O-N 3.42Å; T119-A122 PolarHBondContact O-N 2.91Å; T119-Y123 VanDerWaalsContact O-CB 3.3Å; T119-Y123 WeakPolarHBondContact O-CB 3.3Å; T119-Y123 PolarHBondContact O-N 3.44Å; T119-L134 HydrophobicContact CG2-CD1 4.46Å; T119-N151 HydrophobicContact CG2-CB 3.84Å; T119-N151 WeakPolarHBondContact OG1-CB 3.39Å; T119-A155 HydrophobicContact CG2-CB 3.99Å; T119-I279 HydrophobicContact CG2-CD1 3.99Å; T119-I279 HydrophobicContact CG2-CG1 4.49Å
120	K	96.8	Very high	93.6	Very high	7 Å²	7	38.2 Å²	38.2	3%	0.03	21%	0.209	C	C	.	.	H	α-helix	trans	-60.3	-45.6	177.8	-73.5	175.2	169.5	-146.1	0	112.5	T116 T117 C118 Y123 Y124 G276 H278 D281 F282	T116-K120 HydrophobicContact CG2-CD 4.22Å; T116-K120 WeakPolarHBondContact O-CG 3.45Å; T116-K120 PolarHBondContact O-N 2.91Å; T117-K120 PolarHBondContact O-N 2.96Å; C118-K120 PolarHBondContact O-N 2.96Å; K120-Y123 PolarHBondContact O-N 2.62Å; K120-Y124 WeakPolarHBondContact O-CB 3.45Å; K120-Y124 PolarHBondContact O-N 3.49Å; K120-G276 PolarHBondContact NZ-O 3.06Å; K120-H278 WeakPolarHBondContact CE-O 3.29Å; K120-H278 PolarHBondContact NZ-O 3.41Å; K120-D281 PolarHBondContact NZ-O 3.19Å; K120-F282 HydrophobicContact CB-CB 3.9Å; K120-F282 HydrophobicContact CB-CD1 4Å; K120-F282 HydrophobicContact CB-CD2 3.91Å; K120-F282 HydrophobicContact CB-CE1 4.48Å; K120-F282 HydrophobicContact CB-CE2 4.41Å; K120-F282 HydrophobicContact CB-CG 3.67Å; K120-F282 HydrophobicContact CD-CB 4.06Å; K120-F282 HydrophobicContact CD-CD2 4.04Å; K120-F282 HydrophobicContact CD-CG 4.27Å; K120-F282 HydrophobicContact CG-CB 4.21Å; K120-F282 HydrophobicContact CG-CG 4.42Å
121	L	96.1	Very high	94	Very high	1 Å²	1	36.4 Å²	36.4	1%	0.005	20%	0.198	C	C	.	.	H	α-helix	trans	-64.6	-45.3	177.9	-171.4	70.7	0	0	0	111.1	F106 T117 C118 Y123 Y124 Y125 I188 I218 F272 F282	F106-L121 HydrophobicContact CE2-CD2 3.68Å; F106-L121 HydrophobicContact CZ-CB 4.07Å; F106-L121 HydrophobicContact CZ-CD2 3.49Å; F106-L121 VanDerWaalsContact CZ-CD2 3.49Å; F106-L121 HydrophobicContact CZ-CG 4.37Å; T117-L121 WeakPolarHBondContact O-CB 3.36Å; T117-L121 PolarHBondContact O-N 3.33Å; C118-L121 PolarHBondContact O-N 3.5Å; L121-Y123 VanDerWaalsContact C-N 3.29Å; L121-Y123 PolarHBondContact O-N 2.91Å; L121-Y124 PolarHBondContact O-N 2.92Å; L121-Y125 HydrophobicContact CD1-CD2 4.01Å; L121-Y125 HydrophobicContact CD1-CE2 3.53Å; L121-Y125 HydrophobicContact CD2-CE2 4.28Å; L121-Y125 HydrophobicContact CG-CD2 3.92Å; L121-Y125 HydrophobicContact CG-CE2 3.8Å; L121-Y125 WeakPolarHBondContact O-CD2 3.42Å; L121-Y125 PolarHBondContact O-N 3.26Å; L121-Y125 VanDerWaalsContact O-N 3.08Å; L121-I188 HydrophobicContact CB-CD1 4.2Å; L121-I188 HydrophobicContact CD2-CD1 4.05Å; L121-I188 HydrophobicContact CD2-CG1 4.4Å; L121-I188 HydrophobicContact CG-CD1 4.2Å; L121-I218 HydrophobicContact CD2-CD1 3.96Å; L121-F272 HydrophobicContact CD1-CD2 3.88Å; L121-F272 HydrophobicContact CD1-CE2 3.54Å; L121-F272 HydrophobicContact CD1-CZ 3.99Å; L121-F282 HydrophobicContact CB-CE1 4.16Å; L121-F282 HydrophobicContact CB-CZ 4.32Å; L121-F282 HydrophobicContact CD1-CE1 3.75Å; L121-F282 HydrophobicContact CD1-CZ 4.04Å
122	A	96.4	Very high	94.5	Very high	0 Å²	0	34 Å²	34	0%	0	17%	0.173	C	C	.	.	H	α-helix	trans	-61	-40	178	0	0	0	0	0	111.7	C118 T119 Q126 T132 L134 I157 I188	C118-A122 WeakPolarHBondContact O-CB 2.8Å; C118-A122 PolarHBondContact O-N 3.35Å; T119-A122 PolarHBondContact O-N 2.91Å; A122-Q126 VanDerWaalsContact O-CB 3.3Å; A122-Q126 WeakPolarHBondContact O-CB 3.48Å; A122-Q126 PolarHBondContact O-N 3.08Å; A122-T132 VanDerWaalsContact O-CG2 3.29Å; A122-T132 WeakPolarHBondContact O-CG2 3.42Å; A122-T132 PolarHBondContact O-OG1 3.22Å; A122-L134 HydrophobicContact CB-CD1 4.45Å; A122-L134 HydrophobicContact CB-CD2 3.93Å; A122-L134 HydrophobicContact CB-CG 4.13Å; A122-I157 HydrophobicContact CB-CD1 3.56Å; A122-I157 HydrophobicContact CB-CG2 4.12Å; A122-I188 HydrophobicContact CB-CD1 3.6Å
123	Y	95.9	Very high	94.9	Very high	54 Å²	54	34 Å²	34	21%	0.212	17%	0.173	C	C	.	.	H	α-helix	trans	-70.3	-40.4	177.2	-175.7	-113.8	0	0	0	112.7	T119 K120 L121 Y125 Q126 K127 A155 I279 D280	T119-Y123 VanDerWaalsContact O-CB 3.3Å; T119-Y123 WeakPolarHBondContact O-CB 3.3Å; T119-Y123 PolarHBondContact O-N 3.44Å; K120-Y123 PolarHBondContact O-N 2.62Å; L121-Y123 VanDerWaalsContact C-N 3.29Å; L121-Y123 PolarHBondContact O-N 2.91Å; Y123-Y125 PolarHBondContact O-N 2.7Å; Y123-Q126 WeakPolarHBondContact O-CB 3.27Å; Y123-Q126 PolarHBondContact O-N 2.67Å; Y123-K127 HydrophobicContact CE1-CD 4.05Å; Y123-K127 HydrophobicContact CE1-CG 4.49Å; Y123-K127 PolarHBondContact O-N 2.91Å; Y123-K127 WeakPolarHBondContact OH-CE 3.23Å; Y123-A155 HydrophobicContact CD2-CB 4.22Å; Y123-I279 HydrophobicContact CD1-CB 4.45Å; Y123-I279 HydrophobicContact CD1-CD1 3.85Å; Y123-I279 HydrophobicContact CD1-CG1 3.65Å; Y123-I279 HydrophobicContact CD1-CG2 4.18Å; Y123-I279 HydrophobicContact CD2-CD1 3.85Å; Y123-I279 HydrophobicContact CE1-CD1 4.38Å; Y123-I279 HydrophobicContact CE1-CG1 4.27Å; Y123-I279 HydrophobicContact CE1-CG2 3.93Å; Y123-I279 HydrophobicContact CE2-CD1 4.42Å; Y123-I279 HydrophobicContact CG-CD1 3.54Å; Y123-I279 HydrophobicContact CG-CG1 3.8Å; Y123-D280 WeakPolarHBondContact CE1-OD1 3.47Å
124	Y	94.7	Very high	95.2	Very high	51 Å²	51	33 Å²	33	20%	0.2	16%	0.163	C	C	.	.	H	α-helix	trans	-57.5	-46.7	174.7	176.3	-95.4	0	0	0	112	K120 L121 K128 F272	K120-Y124 WeakPolarHBondContact O-CB 3.45Å; K120-Y124 PolarHBondContact O-N 3.49Å; L121-Y124 PolarHBondContact O-N 2.92Å; Y124-K128 HydrophobicContact CE1-CD 4.02Å; Y124-K128 VanDerWaalsContact CE1-NZ 3.3Å; Y124-K128 VanDerWaalsContact CZ-NZ 3.25Å; Y124-K128 PolarHBondContact O-N 2.84Å; Y124-K128 VanDerWaalsContact OH-CE 3.23Å; Y124-K128 WeakPolarHBondContact OH-CE 3.35Å; Y124-K128 PolarHBondContact OH-NZ 3.45Å; Y124-F272 AromaticContact CD1-CE1 3.87Å; Y124-F272 HydrophobicContact CD1-CE1 3.87Å; Y124-F272 AromaticContact CD1-CZ 3.78Å; Y124-F272 HydrophobicContact CD1-CZ 3.78Å; Y124-F272 HydrophobicContact CD2-CE1 4.24Å; Y124-F272 AromaticContact CE1-CE1 3.61Å; Y124-F272 HydrophobicContact CE1-CE1 3.61Å; Y124-F272 AromaticContact CE1-CZ 3.48Å; Y124-F272 HydrophobicContact CE1-CZ 3.48Å; Y124-F272 VanDerWaalsContact CE1-CZ 3.48Å; Y124-F272 HydrophobicContact CE2-CE1 4.01Å; Y124-F272 HydrophobicContact CG-CE1 4.16Å; Y124-F272 HydrophobicContact CG-CZ 4.49Å; Y124-F272 AromaticContact CZ-CE1 3.67Å; Y124-F272 AromaticContact CZ-CZ 3.97Å
125	Y	94.9	Very high	95.3	Very high	16 Å²	16	32.4 Å²	32.4	6%	0.063	16%	0.16	C	C	.	.	H	α-helix	trans	-73.6	-33.1	176.8	-76.3	-62.8	0	0	0	112.8	W94 P96 L121 Y123 K127 K128 G129 W130 I186	W94-Y125 HydrophobicContact CZ3-CE2 4.36Å; P96-Y125 HydrophobicContact CG-CD1 4.36Å; P96-Y125 HydrophobicContact CG-CE1 3.64Å; L121-Y125 HydrophobicContact CD1-CD2 4.01Å; L121-Y125 HydrophobicContact CD1-CE2 3.53Å; L121-Y125 HydrophobicContact CD2-CE2 4.28Å; L121-Y125 HydrophobicContact CG-CD2 3.92Å; L121-Y125 HydrophobicContact CG-CE2 3.8Å; L121-Y125 WeakPolarHBondContact O-CD2 3.42Å; L121-Y125 PolarHBondContact O-N 3.26Å; L121-Y125 VanDerWaalsContact O-N 3.08Å; Y123-Y125 PolarHBondContact O-N 2.7Å; Y125-K127 VanDerWaalsContact C-N 3.32Å; Y125-K127 PolarHBondContact O-N 2.88Å; Y125-K128 HydrophobicContact CD1-CD 4.46Å; Y125-K128 CarbonylContact O-C 3.55Å; Y125-K128 WeakPolarHBondContact O-CA 3.42Å; Y125-K128 WeakPolarHBondContact O-CB 3.16Å; Y125-K128 PolarHBondContact O-N 3.46Å; Y125-G129 PolarHBondContact O-N 2.94Å; Y125-W130 HydrophobicContact CD1-CG 4.4Å; Y125-W130 WeakPolarHBondContact O-CB 3.42Å; Y125-W130 VanDerWaalsContact O-CD1 3.28Å; Y125-W130 PolarHBondContact O-N 3.32Å; Y125-W130 VanDerWaalsContact O-N 3.1Å; Y125-I186 HydrophobicContact CD2-CG2 4.42Å; Y125-I186 HydrophobicContact CG-CG1 4.49Å
126	Q	94.1	Very high	95.4	Very high	63 Å²	63	32.1 Å²	32.1	29%	0.294	16%	0.158	S	C	.	.	H	α-helix	trans	-58.6	-43.6	172.5	-173.9	-174.2	48.7	0	0	111.5	A122 Y123 K128 G129 T132 A155 R156	A122-Q126 VanDerWaalsContact O-CB 3.3Å; A122-Q126 WeakPolarHBondContact O-CB 3.48Å; A122-Q126 PolarHBondContact O-N 3.08Å; Y123-Q126 WeakPolarHBondContact O-CB 3.27Å; Y123-Q126 PolarHBondContact O-N 2.67Å; Q126-K128 PolarHBondContact O-N 3.24Å; Q126-G129 PolarHBondContact O-N 3.48Å; Q126-T132 HydrophobicContact CB-CG2 4.42Å; Q126-A155 PolarHBondContact OE1-O 3.44Å; Q126-A155 VanDerWaalsContact OE1-O 3.1Å; Q126-R156 PolarHBondContact NE2-O 2.69Å
127	K	91.3	Very high	95.4	Very high	129 Å²	129	30 Å²	30	56%	0.561	15%	0.146	S	C	*	.	H	α-helix	trans	-59	-29.7	173.6	-78.8	-176.2	171.6	171.4	0	113.3	Y123 Y125 G129 D280	Y123-K127 HydrophobicContact CE1-CD 4.05Å; Y123-K127 HydrophobicContact CE1-CG 4.49Å; Y123-K127 PolarHBondContact O-N 2.91Å; Y123-K127 WeakPolarHBondContact OH-CE 3.23Å; Y125-K127 VanDerWaalsContact C-N 3.32Å; Y125-K127 PolarHBondContact O-N 2.88Å; K127-G129 PolarHBondContact O-N 3.35Å; K127-D280 IonicContact NZ-OD1 3.85Å; K127-D280 PolarHBondContact NZ-OD1 3.16Å
128	K	91	Very high	95.2	Very high	109 Å²	109	30.6 Å²	30.6	47%	0.474	15%	0.149	S	C	.	.	T	Hydrogen-bonded Turn	trans	-83.4	6.8	174.9	-67.2	-174.8	177.2	-172	0	113.7	Y124 Y125 Q126	Y124-K128 HydrophobicContact CE1-CD 4.02Å; Y124-K128 VanDerWaalsContact CE1-NZ 3.3Å; Y124-K128 VanDerWaalsContact CZ-NZ 3.25Å; Y124-K128 PolarHBondContact O-N 2.84Å; Y124-K128 VanDerWaalsContact OH-CE 3.23Å; Y124-K128 WeakPolarHBondContact OH-CE 3.35Å; Y124-K128 PolarHBondContact OH-NZ 3.45Å; Y125-K128 HydrophobicContact CD1-CD 4.46Å; Y125-K128 CarbonylContact O-C 3.55Å; Y125-K128 WeakPolarHBondContact O-CA 3.42Å; Y125-K128 WeakPolarHBondContact O-CB 3.16Å; Y125-K128 PolarHBondContact O-N 3.46Å; Q126-K128 PolarHBondContact O-N 3.24Å
129	G	92.3	Very high	94.8	Very high	55 Å²	55	32.1 Å²	32.1	57%	0.567	16%	0.158	S	C	*	.	T	Hydrogen-bonded Turn	trans	78.9	25.8	177.7	0	0	0	0	0	114.5	Y125 Q126 K127	Y125-G129 PolarHBondContact O-N 2.94Å; Q126-G129 PolarHBondContact O-N 3.48Å; K127-G129 PolarHBondContact O-N 3.35Å
130	W	95.4	Very high	94.3	Very high	30 Å²	30	37.9 Å²	37.9	11%	0.114	18%	0.183	C	C	.	.			trans	-91.7	147.3	172.1	-63.7	73.9	0	0	0	110.8	P96 K98 Y125 T132 E185 I186	P96-W130 HydrophobicContact CB-CH2 3.73Å; P96-W130 HydrophobicContact CB-CZ2 4.36Å; P96-W130 HydrophobicContact CB-CZ3 3.91Å; P96-W130 HydrophobicContact CG-CH2 3.85Å; P96-W130 HydrophobicContact CG-CZ2 3.96Å; P96-W130 HydrophobicContact CG-CZ3 4.35Å; P96-W130 WeakPolarHBondContact O-CH2 3.44Å; K98-W130 HydrophobicContact CB-CH2 4.02Å; K98-W130 HydrophobicContact CB-CZ3 4.21Å; K98-W130 HydrophobicContact CD-CH2 4.43Å; K98-W130 HydrophobicContact CD-CZ2 4.28Å; K98-W130 HydrophobicContact CG-CD2 4.37Å; K98-W130 HydrophobicContact CG-CE3 4.13Å; K98-W130 HydrophobicContact CG-CH2 3.21Å; K98-W130 HydrophobicContact CG-CZ2 3.44Å; K98-W130 VanDerWaalsContact CG-CZ2 3.44Å; K98-W130 HydrophobicContact CG-CZ3 3.58Å; Y125-W130 HydrophobicContact CD1-CG 4.4Å; Y125-W130 WeakPolarHBondContact O-CB 3.42Å; Y125-W130 VanDerWaalsContact O-CD1 3.28Å; Y125-W130 PolarHBondContact O-N 3.32Å; Y125-W130 VanDerWaalsContact O-N 3.1Å; W130-T132 HydrophobicContact CB-CG2 4.08Å; W130-T132 PolarHBondContact O-N 3.18Å; W130-E185 HydrophobicContact CE3-CB 3.77Å; W130-E185 HydrophobicContact CE3-CG 4.49Å; W130-E185 HydrophobicContact CZ3-CB 4.29Å; W130-I186 HydrophobicContact CB-CG1 4.06Å; W130-I186 HydrophobicContact CD2-CD1 4.3Å; W130-I186 HydrophobicContact CD2-CG1 4.21Å; W130-I186 HydrophobicContact CE3-CD1 3.71Å; W130-I186 HydrophobicContact CE3-CG1 3.82Å; W130-I186 HydrophobicContact CG-CG1 4.35Å; W130-I186 HydrophobicContact CZ3-CD1 3.98Å
131	K	95.5	Very high	93.8	Very high	96 Å²	96	43.1 Å²	43.1	42%	0.417	20%	0.202	S	C	.	.			trans	-84.6	104.2	172.5	-158.9	-175.6	179.3	-174.8	0	109.8	E182 F184 E185 I186	K131-E182 PolarHBondContact NZ-O 3.14Å; K131-F184 HydrophobicContact CB-CD1 4.32Å; K131-F184 HydrophobicContact CD-CD1 4.09Å; K131-F184 HydrophobicContact CD-CD2 4.21Å; K131-F184 HydrophobicContact CD-CE1 4.19Å; K131-F184 HydrophobicContact CD-CE2 4.32Å; K131-F184 HydrophobicContact CD-CG 4.11Å; K131-F184 HydrophobicContact CD-CZ 4.32Å; K131-F184 HydrophobicContact CG-CD1 3.62Å; K131-F184 HydrophobicContact CG-CE1 3.72Å; K131-F184 HydrophobicContact CG-CG 4.11Å; K131-F184 HydrophobicContact CG-CZ 4.3Å; K131-E185 PolarHBondContact N-OE2 2.93Å; K131-E185 PolarHBondContact O-N 3.44Å; K131-I186 PolarHBondContact O-N 3.01Å; K131-I186 VanDerWaalsContact O-N 3.13Å
132	T	97.1	Very high	93.4	Very high	6 Å²	6	47.9 Å²	47.9	4%	0.037	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-109.1	145.1	-172.5	68.6	0	0	0	0	112.9	A122 Q126 W130 F184 I186	A122-T132 VanDerWaalsContact O-CG2 3.29Å; A122-T132 WeakPolarHBondContact O-CG2 3.42Å; A122-T132 PolarHBondContact O-OG1 3.22Å; Q126-T132 HydrophobicContact CB-CG2 4.42Å; W130-T132 HydrophobicContact CB-CG2 4.08Å; W130-T132 PolarHBondContact O-N 3.18Å; T132-F184 WeakPolarHBondContact O-CD1 3.4Å; T132-F184 VanDerWaalsContact O-CE1 3.24Å; T132-F184 WeakPolarHBondContact O-CE1 3.4Å; T132-I186 WeakPolarHBondContact CA-O 3.21Å; T132-I186 HydrophobicContact CG2-CB 3.91Å; T132-I186 HydrophobicContact CG2-CG1 4.18Å; T132-I186 HydrophobicContact CG2-CG2 4.41Å
133	C	97.2	Very high	93.1	Very high	0 Å²	0	49.8 Å²	49.8	0%	0	26%	0.262	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-139.7	161.2	174	59.5	0	0	0	0	112	A158 F179 F184 I186 I188	C133-A158 CarbonylContact C-O 3.57Å; C133-A158 VanDerWaalsContact CA-O 3.29Å; C133-A158 WeakPolarHBondContact CA-O 3.29Å; C133-A158 HydrophobicContact CB-CB 4.19Å; C133-F179 HydrophobicContact CB-CD1 3.8Å; C133-F179 HydrophobicContact CB-CD2 3.78Å; C133-F179 HydrophobicContact CB-CE1 3.72Å; C133-F179 HydrophobicContact CB-CE2 3.67Å; C133-F179 HydrophobicContact CB-CG 3.84Å; C133-F179 HydrophobicContact CB-CZ 3.66Å; C133-F179 WeakPolarHBondContact SG-CD2 3.47Å; C133-F179 WeakPolarHBondContact SG-CG 3.44Å; C133-F184 HydrophobicContact CB-CD1 3.55Å; C133-F184 HydrophobicContact CB-CE1 3.76Å; C133-F184 HydrophobicContact CB-CG 4.14Å; C133-F184 HydrophobicContact CB-CZ 4.49Å; C133-I186 PolarHBondContact N-O 3.17Å; C133-I188 PolarHBondContact O-N 3.41Å
134	L	97.8	Very high	92.9	Very high	0 Å²	0	47.2 Å²	47.2	0%	0	25%	0.252	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-122	136.8	-179.4	-67	164.5	0	0	0	110.2	C118 T119 A122 L148 A152 I157 A158 F159 Y160 I188	C118-L134 HydrophobicContact CB-CD2 3.79Å; T119-L134 HydrophobicContact CG2-CD1 4.46Å; A122-L134 HydrophobicContact CB-CD1 4.45Å; A122-L134 HydrophobicContact CB-CD2 3.93Å; A122-L134 HydrophobicContact CB-CG 4.13Å; L134-L148 HydrophobicContact CB-CD1 4.35Å; L134-L148 HydrophobicContact CB-CD2 3.88Å; L134-L148 HydrophobicContact CB-CG 4.41Å; L134-A152 HydrophobicContact CD1-CB 3.8Å; L134-I157 HydrophobicContact CD1-CB 4.39Å; L134-I157 HydrophobicContact CD1-CG2 3.96Å; L134-I157 HydrophobicContact CG-CG2 4.02Å; L134-A158 PolarHBondContact N-O 3.21Å; L134-F159 HydrophobicContact CB-CB 4.49Å; L134-F159 CarbonylContact O-C 3.51Å; L134-F159 WeakPolarHBondContact O-CA 3.47Å; L134-Y160 PolarHBondContact O-N 2.67Å; L134-I188 CarbonylContact C-O 3.59Å; L134-I188 WeakPolarHBondContact CA-O 3.34Å; L134-I188 HydrophobicContact CD2-CB 4Å; L134-I188 HydrophobicContact CD2-CG2 3.89Å
135	I	97.3	Very high	92.8	Very high	0 Å²	0	45.9 Å²	45.9	0%	0	25%	0.247	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-120	124.8	173.9	-60.9	166.8	0	0	0	107.7	Y160 I171 V176 F179 I187 I188 V189 D190	I135-Y160 WeakPolarHBondContact CA-O 3.34Å; I135-Y160 HydrophobicContact CG2-CD1 4.28Å; I135-I171 HydrophobicContact CG2-CG2 4.37Å; I135-V176 HydrophobicContact CD1-CB 4.42Å; I135-V176 HydrophobicContact CD1-CG2 3.66Å; I135-F179 HydrophobicContact CD1-CD2 4.03Å; I135-F179 HydrophobicContact CD1-CE2 4.42Å; I135-F179 HydrophobicContact CG1-CD2 3.86Å; I135-F179 HydrophobicContact CG1-CE2 3.75Å; I135-I187 HydrophobicContact CD1-CG2 3.45Å; I135-I187 VanDerWaalsContact CD1-CG2 3.45Å; I135-I187 HydrophobicContact CG1-CG2 4.34Å; I135-I188 PolarHBondContact N-O 2.74Å; I135-V189 HydrophobicContact CB-CG2 4.28Å; I135-V189 HydrophobicContact CD1-CG2 4.01Å; I135-D190 PolarHBondContact O-N 3.29Å
136	C	96.4	Very high	92.8	Very high	4 Å²	4	48 Å²	48	3%	0.027	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-93	100.6	174.5	-169.4	0	0	0	0	110	F145 L148 Y160 I171	C136-F145 HydrophobicContact CB-CB 4.49Å; C136-F145 HydrophobicContact CB-CD2 3.61Å; C136-F145 HydrophobicContact CB-CE2 4.36Å; C136-F145 HydrophobicContact CB-CG 4.47Å; C136-F145 VanDerWaalsContact SG-CA 3.55Å; C136-L148 HydrophobicContact CB-CB 4.38Å; C136-L148 HydrophobicContact CB-CD1 3.88Å; C136-L148 HydrophobicContact CB-CD2 4.26Å; C136-L148 HydrophobicContact CB-CG 4.4Å; C136-Y160 PolarHBondContact N-O 2.83Å; C136-I171 WeakPolarHBondContact O-CG2 3.24Å
137	A	93.9	Very high	92.8	Very high	1 Å²	1	47.6 Å²	47.6	1%	0.008	26%	0.258	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-100.7	15.5	172.8	0	0	0	0	0	112.2	T139 P168 A172 V189 D190	A137-T139 PolarHBondContact O-N 3.3Å; A137-P168 HydrophobicContact CB-CB 4.28Å; A137-P168 VanDerWaalsContact O-CB 3.3Å; A137-P168 WeakPolarHBondContact O-CB 3.29Å; A137-A172 HydrophobicContact CB-CB 4.28Å; A137-V189 HydrophobicContact CB-CG1 3.96Å; A137-D190 CarbonylContact C-O 3.53Å; A137-D190 WeakPolarHBondContact CA-O 3.33Å; A137-D190 PolarHBondContact N-O 2.91Å
138	D	92.1	Very high	93	Very high	15 Å²	15	41.5 Å²	41.5	8%	0.08	23%	0.231	C	C	.	.			trans	-85.7	92.1	169.3	-171.4	-8.4	0	0	0	110	F140 R141 A144 D190 S192	D138-F140 PolarHBondContact OD1-N 3.23Å; D138-R141 PolarHBondContact OD1-N 2.88Å; D138-R141 WeakPolarHBondContact OD2-CB 3.36Å; D138-A144 HydrophobicContact CB-CB 3.86Å; D138-D190 PolarHBondContact N-O 2.87Å; D138-S192 WeakPolarHBondContact OD1-CB 3.21Å
139	T	88.5	Confident	93.2	Very high	33 Å²	33	39.7 Å²	39.7	20%	0.202	22%	0.223	C	C	.	.			trans	-90	-7.5	176.7	59.3	0	0	0	0	113.1	A137 M166 P168 I171	A137-T139 PolarHBondContact O-N 3.3Å; T139-M166 WeakPolarHBondContact CB-O 3.42Å; T139-M166 WeakPolarHBondContact CG2-O 3.42Å; T139-M166 PolarHBondContact OG1-O 2.91Å; T139-P168 HydrophobicContact CG2-CB 4.36Å; T139-I171 HydrophobicContact CG2-CD1 3.35Å
140	F	85.3	Confident	93.4	Very high	125 Å²	125	42.4 Å²	42.4	55%	0.548	22%	0.221	S	C	.	.	S	Bend	trans	-91.5	-40.1	-174.4	-173.6	-101.5	0	0	0	112.6	D138 R194	D138-F140 PolarHBondContact OD1-N 3.23Å; F140-R194 VanDerWaalsContact CD2-NH2 3.3Å
141	R	86.8	Confident	93.4	Very high	117 Å²	117	42.6 Å²	42.6	44%	0.442	22%	0.224	S	C	.	.	S	Bend	trans	-84.6	121.9	-176.4	178.2	179	179.3	-142.8	-9.4	111.4	D138 G143 A144 Q147	D138-R141 PolarHBondContact OD1-N 2.88Å; D138-R141 WeakPolarHBondContact OD2-CB 3.36Å; R141-G143 PolarHBondContact O-N 2.84Å; R141-A144 HydrophobicContact CB-CB 4.01Å; R141-A144 HydrophobicContact CG-CB 4.27Å; R141-A144 VanDerWaalsContact O-CB 3.28Å; R141-A144 WeakPolarHBondContact O-CB 3.31Å; R141-A144 PolarHBondContact O-N 2.79Å; R141-A144 VanDerWaalsContact O-N 3.09Å; R141-Q147 VanDerWaalsContact CZ-OE1 3.27Å
142	A	87.3	Confident	93.4	Very high	101 Å²	101	38 Å²	38	84%	0.835	20%	0.204	S	C	*	.	T	Hydrogen-bonded Turn	trans	-56.2	126.6	174.2	0	0	0	0	0	111.8	A144	A142-A144 VanDerWaalsContact C-N 3.29Å; A142-A144 PolarHBondContact O-N 3.1Å
143	G	89.8	Confident	93.3	Very high	40 Å²	40	41.8 Å²	41.8	41%	0.412	23%	0.228	S	C	.	.	T	Hydrogen-bonded Turn	trans	73.1	11.1	179.9	0	0	0	0	0	115.3	R141 F145 D146 Q147	R141-G143 PolarHBondContact O-N 2.84Å; G143-F145 VanDerWaalsContact C-N 3.35Å; G143-D146 PolarHBondContact O-N 3.03Å; G143-Q147 WeakPolarHBondContact O-CB 3.4Å; G143-Q147 PolarHBondContact O-N 2.82Å
144	A	91.3	Very high	93.1	Very high	1 Å²	1	49.3 Å²	49.3	1%	0.008	26%	0.26	C	S	.	.	H	α-helix	trans	-60.6	-44.7	175.8	0	0	0	0	0	111.8	D138 R141 A142 D146 Q147 L148	D138-A144 HydrophobicContact CB-CB 3.86Å; R141-A144 HydrophobicContact CB-CB 4.01Å; R141-A144 HydrophobicContact CG-CB 4.27Å; R141-A144 VanDerWaalsContact O-CB 3.28Å; R141-A144 WeakPolarHBondContact O-CB 3.31Å; R141-A144 PolarHBondContact O-N 2.79Å; R141-A144 VanDerWaalsContact O-N 3.09Å; A142-A144 VanDerWaalsContact C-N 3.29Å; A142-A144 PolarHBondContact O-N 3.1Å; A144-D146 PolarHBondContact O-N 3.02Å; A144-Q147 WeakPolarHBondContact O-CB 2.92Å; A144-Q147 PolarHBondContact O-N 3.26Å; A144-L148 PolarHBondContact O-N 3.28Å
145	F	93.5	Very high	92.9	Very high	22 Å²	22	49.5 Å²	49.5	10%	0.096	26%	0.262	C	S	.	.	H	α-helix	trans	-62.8	-42.1	176.4	-177.4	-135.8	0	0	0	112.4	C136 G143 Q147 L148 K149 F159 G161 Y163	C136-F145 HydrophobicContact CB-CB 4.49Å; C136-F145 HydrophobicContact CB-CD2 3.61Å; C136-F145 HydrophobicContact CB-CE2 4.36Å; C136-F145 HydrophobicContact CB-CG 4.47Å; C136-F145 VanDerWaalsContact SG-CA 3.55Å; G143-F145 VanDerWaalsContact C-N 3.35Å; F145-Q147 VanDerWaalsContact C-N 3.33Å; F145-Q147 PolarHBondContact O-N 3.04Å; F145-L148 PolarHBondContact O-N 2.85Å; F145-K149 WeakPolarHBondContact O-CB 3.34Å; F145-K149 PolarHBondContact O-N 3.02Å; F145-F159 HydrophobicContact CE2-CD2 4.05Å; F145-F159 HydrophobicContact CZ-CD2 4.2Å; F145-F159 HydrophobicContact CZ-CE2 4.32Å; F145-G161 VanDerWaalsContact CE2-CA 3.4Å; F145-G161 WeakPolarHBondContact CZ-O 3.43Å; F145-Y163 AromaticContact CD1-CD1 3.89Å; F145-Y163 HydrophobicContact CD1-CD1 3.89Å; F145-Y163 HydrophobicContact CD1-CD2 4.06Å; F145-Y163 AromaticContact CD1-CE1 3.58Å; F145-Y163 HydrophobicContact CD1-CE1 3.58Å; F145-Y163 AromaticContact CD1-CE2 3.77Å; F145-Y163 HydrophobicContact CD1-CE2 3.77Å; F145-Y163 HydrophobicContact CD1-CG 4.12Å; F145-Y163 AromaticContact CD1-CZ 3.51Å; F145-Y163 HydrophobicContact CE1-CD1 4.45Å; F145-Y163 AromaticContact CE1-CD2 3.79Å; F145-Y163 HydrophobicContact CE1-CD2 3.79Å; F145-Y163 HydrophobicContact CE1-CE1 4.12Å; F145-Y163 AromaticContact CE1-CE2 3.4Å; F145-Y163 HydrophobicContact CE1-CE2 3.4Å; F145-Y163 VanDerWaalsContact CE1-CE2 3.4Å; F145-Y163 HydrophobicContact CE1-CG 4.3Å; F145-Y163 AromaticContact CE1-CZ 3.58Å
146	D	94.7	Very high	92.7	Very high	62 Å²	62	60 Å²	60	33%	0.332	30%	0.302	S	S	.	.	H	α-helix	trans	-64.9	-37.3	176	-65	-61.9	0	0	0	112.2	G143 A144 K149 Q150 Y163	G143-D146 PolarHBondContact O-N 3.03Å; A144-D146 PolarHBondContact O-N 3.02Å; D146-K149 PolarHBondContact O-N 3.05Å; D146-Q150 WeakPolarHBondContact O-CB 3.34Å; D146-Q150 VanDerWaalsContact O-CG 3.23Å; D146-Q150 WeakPolarHBondContact O-CG 3.38Å; D146-Q150 PolarHBondContact O-N 2.89Å; D146-Y163 WeakPolarHBondContact OD1-CE1 3.4Å; D146-Y163 PolarHBondContact OD1-OH 3.15Å
147	Q	94.2	Very high	92.7	Very high	54 Å²	54	60.1 Å²	60.1	25%	0.252	30%	0.302	S	S	.	.	H	α-helix	trans	-61.5	-49.9	174	-177	178.7	-1.3	0	0	111	T115 R141 G143 A144 F145 Q150 N151	T115-Q147 HydrophobicContact CG2-CG 4.17Å; R141-Q147 VanDerWaalsContact CZ-OE1 3.27Å; G143-Q147 WeakPolarHBondContact O-CB 3.4Å; G143-Q147 PolarHBondContact O-N 2.82Å; A144-Q147 WeakPolarHBondContact O-CB 2.92Å; A144-Q147 PolarHBondContact O-N 3.26Å; F145-Q147 VanDerWaalsContact C-N 3.33Å; F145-Q147 PolarHBondContact O-N 3.04Å; Q147-Q150 PolarHBondContact O-N 3.29Å; Q147-N151 WeakPolarHBondContact O-CB 3.5Å; Q147-N151 VanDerWaalsContact O-CG 3.3Å; Q147-N151 PolarHBondContact O-N 2.92Å; Q147-N151 VanDerWaalsContact O-N 3.08Å
148	L	95.6	Very high	92.8	Very high	0 Å²	0	61.8 Å²	61.8	0%	0	32%	0.316	C	S	.	.	H	α-helix	trans	-62.4	-44.6	178.1	-174.7	145.5	0	0	0	111	T115 L134 C136 A144 F145 Q150 N151 A152 F159 D190	T115-L148 HydrophobicContact CG2-CB 3.89Å; T115-L148 HydrophobicContact CG2-CD1 4.43Å; T115-L148 HydrophobicContact CG2-CG 4.49Å; L134-L148 HydrophobicContact CB-CD1 4.35Å; L134-L148 HydrophobicContact CB-CD2 3.88Å; L134-L148 HydrophobicContact CB-CG 4.41Å; C136-L148 HydrophobicContact CB-CB 4.38Å; C136-L148 HydrophobicContact CB-CD1 3.88Å; C136-L148 HydrophobicContact CB-CD2 4.26Å; C136-L148 HydrophobicContact CB-CG 4.4Å; A144-L148 PolarHBondContact O-N 3.28Å; F145-L148 PolarHBondContact O-N 2.85Å; L148-Q150 PolarHBondContact O-N 3.42Å; L148-N151 PolarHBondContact O-N 3.4Å; L148-A152 VanDerWaalsContact O-CB 3.26Å; L148-A152 WeakPolarHBondContact O-CB 3.27Å; L148-A152 PolarHBondContact O-N 3.43Å; L148-F159 HydrophobicContact CD2-CB 3.86Å; L148-D190 HydrophobicContact CD1-CB 3.78Å
149	K	95.7	Very high	93	Very high	71 Å²	71	64.4 Å²	64.4	31%	0.309	33%	0.326	S	S	.	.	H	α-helix	trans	-59	-45.1	177.4	175.4	173.9	178.1	-176.3	0	112.5	F145 D146 T153 F159 Y163	F145-K149 WeakPolarHBondContact O-CB 3.34Å; F145-K149 PolarHBondContact O-N 3.02Å; D146-K149 PolarHBondContact O-N 3.05Å; K149-T153 VanDerWaalsContact O-CB 3.3Å; K149-T153 WeakPolarHBondContact O-CB 3.23Å; K149-T153 PolarHBondContact O-N 2.65Å; K149-T153 PolarHBondContact O-OG1 3.01Å; K149-F159 HydrophobicContact CB-CD2 4.35Å; K149-F159 HydrophobicContact CB-CE2 4.23Å; K149-F159 HydrophobicContact CD-CE2 3.9Å; K149-F159 HydrophobicContact CD-CZ 4.09Å; K149-F159 HydrophobicContact CG-CD2 4.28Å; K149-F159 HydrophobicContact CG-CE1 4.2Å; K149-F159 HydrophobicContact CG-CE2 3.69Å; K149-F159 HydrophobicContact CG-CZ 3.66Å; K149-Y163 PolarHBondContact NZ-OH 3.12Å; K149-Y163 VanDerWaalsContact NZ-OH 3.13Å
150	Q	95.7	Very high	93.4	Very high	112 Å²	112	65 Å²	65	52%	0.523	33%	0.326	S	S	.	.	H	α-helix	trans	-63	-43	176.7	-74.8	176.4	36	0	0	111.6	D146 Q147 L148 T153 K154	D146-Q150 WeakPolarHBondContact O-CB 3.34Å; D146-Q150 VanDerWaalsContact O-CG 3.23Å; D146-Q150 WeakPolarHBondContact O-CG 3.38Å; D146-Q150 PolarHBondContact O-N 2.89Å; Q147-Q150 PolarHBondContact O-N 3.29Å; L148-Q150 PolarHBondContact O-N 3.42Å; Q150-T153 PolarHBondContact O-N 3.35Å; Q150-K154 VanDerWaalsContact O-CG 3.3Å; Q150-K154 WeakPolarHBondContact O-CG 3.35Å; Q150-K154 PolarHBondContact O-N 2.84Å
151	N	94.9	Very high	93.8	Very high	34 Å²	34	60 Å²	60	18%	0.182	31%	0.308	C	S	.	.	H	α-helix	trans	-66.3	-46.5	178.3	-73.4	-11.4	0	0	0	111.9	T119 Q147 L148 T153 K154 A155	T119-N151 HydrophobicContact CG2-CB 3.84Å; T119-N151 WeakPolarHBondContact OG1-CB 3.39Å; Q147-N151 WeakPolarHBondContact O-CB 3.5Å; Q147-N151 VanDerWaalsContact O-CG 3.3Å; Q147-N151 PolarHBondContact O-N 2.92Å; Q147-N151 VanDerWaalsContact O-N 3.08Å; L148-N151 PolarHBondContact O-N 3.4Å; N151-T153 VanDerWaalsContact C-N 3.33Å; N151-T153 PolarHBondContact O-N 2.65Å; N151-K154 PolarHBondContact O-N 3.06Å; N151-A155 WeakPolarHBondContact O-CB 3.43Å; N151-A155 PolarHBondContact O-N 3.38Å
152	A	95.5	Very high	93.9	Very high	0 Å²	0	56.1 Å²	56.1	0%	0	30%	0.299	C	S	.	.	H	α-helix	trans	-60.4	-41.8	176.1	0	0	0	0	0	111.7	L134 L148 A155 R156 I157 F159	L134-A152 HydrophobicContact CD1-CB 3.8Å; L148-A152 VanDerWaalsContact O-CB 3.26Å; L148-A152 WeakPolarHBondContact O-CB 3.27Å; L148-A152 PolarHBondContact O-N 3.43Å; A152-A155 CarbonylContact O-C 3.53Å; A152-A155 PolarHBondContact O-N 3.29Å; A152-R156 PolarHBondContact O-N 3.18Å; A152-I157 PolarHBondContact O-N 2.9Å; A152-F159 HydrophobicContact CB-CB 3.85Å; A152-F159 HydrophobicContact CB-CD1 3.74Å; A152-F159 HydrophobicContact CB-CG 4.11Å
153	T	95.2	Very high	94	Very high	85 Å²	85	57.7 Å²	57.7	52%	0.521	29%	0.285	S	S	.	.	H	α-helix	trans	-63.9	-45.5	176.9	-57.5	0	0	0	0	111.5	K149 Q150 N151 A155 R156	K149-T153 VanDerWaalsContact O-CB 3.3Å; K149-T153 WeakPolarHBondContact O-CB 3.23Å; K149-T153 PolarHBondContact O-N 2.65Å; K149-T153 PolarHBondContact O-OG1 3.01Å; Q150-T153 PolarHBondContact O-N 3.35Å; N151-T153 VanDerWaalsContact C-N 3.33Å; N151-T153 PolarHBondContact O-N 2.65Å; T153-A155 PolarHBondContact O-N 3.31Å; T153-R156 PolarHBondContact O-N 2.65Å; T153-R156 VanDerWaalsContact O-N 3.16Å
154	K	92.8	Very high	94	Very high	158 Å²	158	61.6 Å²	61.6	69%	0.687	30%	0.301	S	S	*	.	H	α-helix	trans	-59.7	-37.6	175.2	-73.6	171.4	-176	172.7	0	111.9	Q150 N151	Q150-K154 VanDerWaalsContact O-CG 3.3Å; Q150-K154 WeakPolarHBondContact O-CG 3.35Å; Q150-K154 PolarHBondContact O-N 2.84Å; N151-K154 PolarHBondContact O-N 3.06Å
155	A	93.4	Very high	93.9	Very high	5 Å²	5	65 Å²	65	4%	0.041	32%	0.316	C	S	.	.	H	α-helix	trans	-83.2	-9.3	179.5	0	0	0	0	0	114.2	T119 Y123 Q126 N151 A152 T153 I157 I279	T119-A155 HydrophobicContact CG2-CB 3.99Å; Y123-A155 HydrophobicContact CD2-CB 4.22Å; Q126-A155 PolarHBondContact OE1-O 3.44Å; Q126-A155 VanDerWaalsContact OE1-O 3.1Å; N151-A155 WeakPolarHBondContact O-CB 3.43Å; N151-A155 PolarHBondContact O-N 3.38Å; A152-A155 CarbonylContact O-C 3.53Å; A152-A155 PolarHBondContact O-N 3.29Å; T153-A155 PolarHBondContact O-N 3.31Å; A155-I157 HydrophobicContact CB-CB 4.42Å; A155-I157 HydrophobicContact CB-CD1 3.48Å; A155-I157 VanDerWaalsContact CB-CD1 3.48Å; A155-I157 HydrophobicContact CB-CG1 3.66Å; A155-I279 HydrophobicContact CB-CD1 3.32Å
156	R	94.4	Very high	93.7	Very high	219 Å²	219	70.2 Å²	70.2	83%	0.826	34%	0.343	S	S	*	.	T	Hydrogen-bonded Turn	trans	56.2	44.9	-170.6	-52.5	180	-177.9	-171.9	-0.1	112.9	Q126 A152 T153	Q126-R156 PolarHBondContact NE2-O 2.69Å; A152-R156 PolarHBondContact O-N 3.18Å; T153-R156 PolarHBondContact O-N 2.65Å; T153-R156 VanDerWaalsContact O-N 3.16Å
157	I	95.9	Very high	93.5	Very high	8 Å²	8	70.4 Å²	70.4	4%	0.041	34%	0.344	C	S	.	.			trans	-110	139.6	179.9	-59.1	174.7	0	0	0	108.6	A122 L134 A152 A155	A122-I157 HydrophobicContact CB-CD1 3.56Å; A122-I157 HydrophobicContact CB-CG2 4.12Å; L134-I157 HydrophobicContact CD1-CB 4.39Å; L134-I157 HydrophobicContact CD1-CG2 3.96Å; L134-I157 HydrophobicContact CG-CG2 4.02Å; A152-I157 PolarHBondContact O-N 2.9Å; A155-I157 HydrophobicContact CB-CB 4.42Å; A155-I157 HydrophobicContact CB-CD1 3.48Å; A155-I157 VanDerWaalsContact CB-CD1 3.48Å; A155-I157 HydrophobicContact CB-CG1 3.66Å
158	A	96.8	Very high	93.4	Very high	35 Å²	35	68.1 Å²	68.1	29%	0.289	33%	0.334	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-66.7	141	176.2	0	0	0	0	0	110.3	C133 L134 F179 F184	C133-A158 CarbonylContact C-O 3.57Å; C133-A158 VanDerWaalsContact CA-O 3.29Å; C133-A158 WeakPolarHBondContact CA-O 3.29Å; C133-A158 HydrophobicContact CB-CB 4.19Å; L134-A158 PolarHBondContact N-O 3.21Å; A158-F179 HydrophobicContact CB-CE1 3.98Å; A158-F179 HydrophobicContact CB-CZ 4.35Å; A158-F184 HydrophobicContact CB-CE1 3.72Å; A158-F184 HydrophobicContact CB-CZ 3.57Å
159	F	96.6	Very high	93.3	Very high	70 Å²	70	69.5 Å²	69.5	31%	0.307	34%	0.342	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-132.8	150.1	-179.3	61.7	-90.4	0	0	0	111.8	L134 F145 L148 K149 A152	L134-F159 HydrophobicContact CB-CB 4.49Å; L134-F159 CarbonylContact O-C 3.51Å; L134-F159 WeakPolarHBondContact O-CA 3.47Å; F145-F159 HydrophobicContact CE2-CD2 4.05Å; F145-F159 HydrophobicContact CZ-CD2 4.2Å; F145-F159 HydrophobicContact CZ-CE2 4.32Å; L148-F159 HydrophobicContact CD2-CB 3.86Å; K149-F159 HydrophobicContact CB-CD2 4.35Å; K149-F159 HydrophobicContact CB-CE2 4.23Å; K149-F159 HydrophobicContact CD-CE2 3.9Å; K149-F159 HydrophobicContact CD-CZ 4.09Å; K149-F159 HydrophobicContact CG-CD2 4.28Å; K149-F159 HydrophobicContact CG-CE1 4.2Å; K149-F159 HydrophobicContact CG-CE2 3.69Å; K149-F159 HydrophobicContact CG-CZ 3.66Å; A152-F159 HydrophobicContact CB-CB 3.85Å; A152-F159 HydrophobicContact CB-CD1 3.74Å; A152-F159 HydrophobicContact CB-CG 4.11Å
160	Y	96.4	Very high	93.2	Very high	47 Å²	47	68.3 Å²	68.3	18%	0.184	34%	0.34	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-131.1	149.1	172.2	-172.8	-99	0	0	0	109.9	L134 I135 C136 I171 E174 K178 F179	L134-Y160 PolarHBondContact O-N 2.67Å; I135-Y160 WeakPolarHBondContact CA-O 3.34Å; I135-Y160 HydrophobicContact CG2-CD1 4.28Å; C136-Y160 PolarHBondContact N-O 2.83Å; Y160-I171 HydrophobicContact CD1-CG2 4.21Å; Y160-I171 HydrophobicContact CE1-CG2 4.12Å; Y160-I171 WeakPolarHBondContact CE1-O 3.44Å; Y160-E174 HydrophobicContact CE1-CB 4.14Å; Y160-E174 WeakPolarHBondContact OH-CB 3.44Å; Y160-E174 PolarHBondContact OH-OE2 3.06Å; Y160-K178 HydrophobicContact CD2-CD 3.74Å; Y160-K178 HydrophobicContact CE2-CD 3.92Å; Y160-F179 VanDerWaalsContact CB-CE2 3.47Å
161	G	92.5	Very high	93.2	Very high	18 Å²	18	63 Å²	63	19%	0.186	32%	0.316	C	S	.	.			trans	169.2	167.6	176.9	0	0	0	0	0	108.9	F145	F145-G161 VanDerWaalsContact CE2-CA 3.4Å; F145-G161 WeakPolarHBondContact CZ-O 3.43Å
162	S	90.6	Very high	93.2	Very high	36 Å²	36	61.4 Å²	61.4	25%	0.252	31%	0.307	S	S	.	.			trans	-125.3	142.5	-176.9	-171.3	0	0	0	0	110.3	T164 E165	S162-T164 PolarHBondContact OG-N 3.12Å; S162-T164 PolarHBondContact OG-OG1 3.37Å; S162-E165 WeakPolarHBondContact OG-CB 3.34Å; S162-E165 PolarHBondContact OG-N 3.04Å
163	Y	88.6	Confident	93.2	Very high	134 Å²	134	63.3 Å²	63.3	53%	0.525	32%	0.323	S	S	.	.	S	Bend	trans	-88.4	-16.1	170	-69.8	-76.5	0	0	0	112.2	F145 D146 K149	F145-Y163 AromaticContact CD1-CD1 3.89Å; F145-Y163 HydrophobicContact CD1-CD1 3.89Å; F145-Y163 HydrophobicContact CD1-CD2 4.06Å; F145-Y163 AromaticContact CD1-CE1 3.58Å; F145-Y163 HydrophobicContact CD1-CE1 3.58Å; F145-Y163 AromaticContact CD1-CE2 3.77Å; F145-Y163 HydrophobicContact CD1-CE2 3.77Å; F145-Y163 HydrophobicContact CD1-CG 4.12Å; F145-Y163 AromaticContact CD1-CZ 3.51Å; F145-Y163 HydrophobicContact CE1-CD1 4.45Å; F145-Y163 AromaticContact CE1-CD2 3.79Å; F145-Y163 HydrophobicContact CE1-CD2 3.79Å; F145-Y163 HydrophobicContact CE1-CE1 4.12Å; F145-Y163 AromaticContact CE1-CE2 3.4Å; F145-Y163 HydrophobicContact CE1-CE2 3.4Å; F145-Y163 VanDerWaalsContact CE1-CE2 3.4Å; F145-Y163 HydrophobicContact CE1-CG 4.3Å; F145-Y163 AromaticContact CE1-CZ 3.58Å; D146-Y163 WeakPolarHBondContact OD1-CE1 3.4Å; D146-Y163 PolarHBondContact OD1-OH 3.15Å; K149-Y163 PolarHBondContact NZ-OH 3.12Å; K149-Y163 VanDerWaalsContact NZ-OH 3.13Å
164	T	89.3	Confident	93.2	Very high	123 Å²	123	64 Å²	64	76%	0.755	32%	0.32	S	S	*	.	S	Bend	trans	-114.8	-30.4	-171.1	53.7	0	0	0	0	113.2	S162	S162-T164 PolarHBondContact OG-N 3.12Å; S162-T164 PolarHBondContact OG-OG1 3.37Å
165	E	90.4	Very high	93.3	Very high	71 Å²	71	56.4 Å²	56.4	33%	0.332	29%	0.287	S	S	.	.			trans	-76.5	131.1	177.6	-174.3	51.5	-100.9	0	0	109.4	S162 D167 V170 I171	S162-E165 WeakPolarHBondContact OG-CB 3.34Å; S162-E165 PolarHBondContact OG-N 3.04Å; E165-D167 PolarHBondContact OE1-N 3.23Å; E165-V170 HydrophobicContact CG-CB 4.11Å; E165-V170 HydrophobicContact CG-CG1 4.08Å; E165-I171 HydrophobicContact CB-CD1 3.98Å; E165-I171 HydrophobicContact CB-CG1 3.78Å; E165-I171 HydrophobicContact CG-CD1 4.06Å; E165-I171 HydrophobicContact CG-CG1 3.56Å
166	M	87.6	Confident	93.4	Very high	133 Å²	133	56.4 Å²	56.4	66%	0.655	29%	0.286	S	S	*	.			trans	-103.3	-20.5	-177.6	-64.9	-62	-60.7	0	0	111.6	T139 P168	T139-M166 WeakPolarHBondContact CB-O 3.42Å; T139-M166 WeakPolarHBondContact CG2-O 3.42Å; T139-M166 PolarHBondContact OG1-O 2.91Å; M166-P168 WeakPolarHBondContact O-CD 3.48Å
167	D	90.6	Very high	93.5	Very high	66 Å²	66	51.3 Å²	51.3	35%	0.353	27%	0.272	S	S	.	.			trans	-82.7	112.2	178.5	-170.8	-14.1	0	0	0	111.3	E165 V169 V170 I171	E165-D167 PolarHBondContact OE1-N 3.23Å; D167-V169 PolarHBondContact O-N 3.4Å; D167-V169 VanDerWaalsContact OD1-CB 3.24Å; D167-V169 WeakPolarHBondContact OD1-CB 3.37Å; D167-V169 WeakPolarHBondContact OD1-CG2 3.43Å; D167-V169 PolarHBondContact OD1-N 2.97Å; D167-V170 HydrophobicContact CB-CB 4.22Å; D167-V170 HydrophobicContact CB-CG2 3.9Å; D167-V170 PolarHBondContact O-N 3.02Å; D167-I171 WeakPolarHBondContact O-CG1 3.39Å; D167-I171 PolarHBondContact O-N 3.31Å
168	P	92.1	Very high	93.5	Very high	6 Å²	6	55.2 Å²	55.2	4%	0.039	29%	0.289	C	S	.	.	H	α-helix	trans	-65	-24.6	178.4	29	-35.3	0	0	0	112.8	A137 T139 M166 A172 E204 V208	A137-P168 HydrophobicContact CB-CB 4.28Å; A137-P168 VanDerWaalsContact O-CB 3.3Å; A137-P168 WeakPolarHBondContact O-CB 3.29Å; T139-P168 HydrophobicContact CG2-CB 4.36Å; M166-P168 WeakPolarHBondContact O-CD 3.48Å; P168-A172 WeakPolarHBondContact O-CB 3.49Å; P168-A172 PolarHBondContact O-N 3.37Å; P168-E204 HydrophobicContact CG-CG 3.55Å; P168-V208 HydrophobicContact CB-CG2 4.15Å; P168-V208 HydrophobicContact CG-CG2 4.26Å
169	V	93.8	Very high	93.4	Very high	28 Å²	28	53.8 Å²	53.8	17%	0.17	28%	0.276	C	S	.	.	H	α-helix	trans	-67.2	-46	178.3	-175.1	0	0	0	0	110.1	D167 A172 A173 Q207 V208 A211	D167-V169 PolarHBondContact O-N 3.4Å; D167-V169 VanDerWaalsContact OD1-CB 3.24Å; D167-V169 WeakPolarHBondContact OD1-CB 3.37Å; D167-V169 WeakPolarHBondContact OD1-CG2 3.43Å; D167-V169 PolarHBondContact OD1-N 2.97Å; V169-A172 PolarHBondContact O-N 3.46Å; V169-A173 VanDerWaalsContact O-CB 3.3Å; V169-A173 WeakPolarHBondContact O-CB 3.32Å; V169-A173 PolarHBondContact O-N 2.67Å; V169-Q207 HydrophobicContact CG2-CB 3.84Å; V169-V208 HydrophobicContact CB-CG2 4.49Å; V169-V208 HydrophobicContact CG2-CG2 3.81Å; V169-A211 HydrophobicContact CG1-CB 3.59Å
170	V	94.5	Very high	93.3	Very high	46 Å²	46	54.3 Å²	54.3	28%	0.279	28%	0.278	S	S	.	.	H	α-helix	trans	-62.4	-49.4	177.7	176.8	0	0	0	0	110.3	E165 D167 A172 A173 E174	E165-V170 HydrophobicContact CG-CB 4.11Å; E165-V170 HydrophobicContact CG-CG1 4.08Å; D167-V170 HydrophobicContact CB-CB 4.22Å; D167-V170 HydrophobicContact CB-CG2 3.9Å; D167-V170 PolarHBondContact O-N 3.02Å; V170-A172 VanDerWaalsContact C-N 3.32Å; V170-A172 PolarHBondContact O-N 3.22Å; V170-A173 PolarHBondContact O-N 2.84Å; V170-E174 HydrophobicContact CG1-CG 4.26Å; V170-E174 WeakPolarHBondContact O-CB 3.32Å; V170-E174 WeakPolarHBondContact O-CG 3.16Å; V170-E174 PolarHBondContact O-N 2.96Å
171	I	94.6	Very high	93.2	Very high	2 Å²	2	57 Å²	57	1%	0.01	30%	0.299	C	S	.	.	H	α-helix	trans	-60.7	-43.1	-179.6	-60.9	171.4	0	0	0	111.3	I135 C136 T139 Y160 E165 D167 G175	I135-I171 HydrophobicContact CG2-CG2 4.37Å; C136-I171 WeakPolarHBondContact O-CG2 3.24Å; T139-I171 HydrophobicContact CG2-CD1 3.35Å; Y160-I171 HydrophobicContact CD1-CG2 4.21Å; Y160-I171 HydrophobicContact CE1-CG2 4.12Å; Y160-I171 WeakPolarHBondContact CE1-O 3.44Å; E165-I171 HydrophobicContact CB-CD1 3.98Å; E165-I171 HydrophobicContact CB-CG1 3.78Å; E165-I171 HydrophobicContact CG-CD1 4.06Å; E165-I171 HydrophobicContact CG-CG1 3.56Å; D167-I171 WeakPolarHBondContact O-CG1 3.39Å; D167-I171 PolarHBondContact O-N 3.31Å; I171-G175 PolarHBondContact O-N 2.73Å
172	A	95	Very high	93.3	Very high	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-67.5	-45.5	-179.8	0	0	0	0	0	111.6	A137 P168 V169 V170 G175 V176 V189 V208 I212	A137-A172 HydrophobicContact CB-CB 4.28Å; P168-A172 WeakPolarHBondContact O-CB 3.49Å; P168-A172 PolarHBondContact O-N 3.37Å; V169-A172 PolarHBondContact O-N 3.46Å; V170-A172 VanDerWaalsContact C-N 3.32Å; V170-A172 PolarHBondContact O-N 3.22Å; A172-G175 PolarHBondContact O-N 3.29Å; A172-V176 WeakPolarHBondContact O-CB 3.38Å; A172-V176 WeakPolarHBondContact O-CG2 3.17Å; A172-V176 PolarHBondContact O-N 3.44Å; A172-V189 HydrophobicContact CB-CG1 4.25Å; A172-V208 HydrophobicContact CB-CG1 3.88Å; A172-I212 HydrophobicContact CB-CG2 3.63Å
173	A	95.6	Very high	93.4	Very high	39 Å²	39	64.5 Å²	64.5	32%	0.322	33%	0.33	S	S	.	.	H	α-helix	trans	-63.6	-49.7	179.5	0	0	0	0	0	112.1	V169 V170 G175 V176 E177	V169-A173 VanDerWaalsContact O-CB 3.3Å; V169-A173 WeakPolarHBondContact O-CB 3.32Å; V169-A173 PolarHBondContact O-N 2.67Å; V170-A173 PolarHBondContact O-N 2.84Å; A173-G175 PolarHBondContact O-N 3.15Å; A173-V176 PolarHBondContact O-N 3.27Å; A173-E177 WeakPolarHBondContact O-CB 3.26Å; A173-E177 PolarHBondContact O-N 2.96Å
174	E	95.8	Very high	93.7	Very high	99 Å²	99	59 Å²	59	46%	0.463	31%	0.308	S	S	.	.	H	α-helix	trans	-63.3	-41.8	177.9	-70.1	-178.6	167.4	0	0	112.1	Y160 V170 E177 K178	Y160-E174 HydrophobicContact CE1-CB 4.14Å; Y160-E174 WeakPolarHBondContact OH-CB 3.44Å; Y160-E174 PolarHBondContact OH-OE2 3.06Å; V170-E174 HydrophobicContact CG1-CG 4.26Å; V170-E174 WeakPolarHBondContact O-CB 3.32Å; V170-E174 WeakPolarHBondContact O-CG 3.16Å; V170-E174 PolarHBondContact O-N 2.96Å; E174-E177 PolarHBondContact O-N 3.42Å; E174-K178 VanDerWaalsContact O-CB 3.31Å; E174-K178 WeakPolarHBondContact O-CB 3.3Å; E174-K178 PolarHBondContact O-N 2.6Å
175	G	94.9	Very high	94	Very high	0 Å²	0	54.8 Å²	54.8	0%	0	28%	0.281	C	S	.	.	H	α-helix	trans	-63	-43.9	178.5	0	0	0	0	0	112.1	I171 A172 A173 F179	I171-G175 PolarHBondContact O-N 2.73Å; A172-G175 PolarHBondContact O-N 3.29Å; A173-G175 PolarHBondContact O-N 3.15Å; G175-F179 WeakPolarHBondContact O-CD2 3.39Å; G175-F179 PolarHBondContact O-N 3.43Å; G175-F179 VanDerWaalsContact O-N 3.08Å
176	V	95.6	Very high	94.3	Very high	4 Å²	4	51.4 Å²	51.4	2%	0.024	27%	0.265	C	S	.	.	H	α-helix	trans	-64.4	-44	177.3	169.2	0	0	0	0	110.3	V103 I135 A172 A173 F179 K180 I187 V189 I212	V103-V176 HydrophobicContact CG1-CG2 4.15Å; V103-V176 HydrophobicContact CG2-CG1 3.94Å; I135-V176 HydrophobicContact CD1-CB 4.42Å; I135-V176 HydrophobicContact CD1-CG2 3.66Å; A172-V176 WeakPolarHBondContact O-CB 3.38Å; A172-V176 WeakPolarHBondContact O-CG2 3.17Å; A172-V176 PolarHBondContact O-N 3.44Å; A173-V176 PolarHBondContact O-N 3.27Å; V176-F179 PolarHBondContact O-N 3.08Å; V176-K180 HydrophobicContact CG1-CD 3.87Å; V176-K180 VanDerWaalsContact CG1-CE 3.45Å; V176-K180 HydrophobicContact CG1-CG 4.3Å; V176-K180 WeakPolarHBondContact O-CB 3.46Å; V176-K180 VanDerWaalsContact O-CG 3.25Å; V176-K180 WeakPolarHBondContact O-CG 3.44Å; V176-K180 PolarHBondContact O-N 2.97Å; V176-I187 HydrophobicContact CG2-CG2 4.03Å; V176-V189 HydrophobicContact CG2-CG2 4.23Å; V176-I212 HydrophobicContact CG2-CB 4.11Å; V176-I212 HydrophobicContact CG2-CG2 3.97Å
177	E	95.8	Very high	94.8	Very high	113 Å²	113	45.1 Å²	45.1	53%	0.528	23%	0.234	S	C	.	.	H	α-helix	trans	-65.5	-42.6	-179.9	-171.1	58.2	-161.6	0	0	112.5	A173 E174 F179 K180 T181	A173-E177 WeakPolarHBondContact O-CB 3.26Å; A173-E177 PolarHBondContact O-N 2.96Å; E174-E177 PolarHBondContact O-N 3.42Å; E177-F179 PolarHBondContact O-N 3.01Å; E177-K180 PolarHBondContact O-N 3.4Å; E177-T181 PolarHBondContact O-N 3.36Å; E177-T181 PolarHBondContact O-OG1 2.95Å
178	K	95.8	Very high	95.1	Very high	90 Å²	90	42 Å²	42	39%	0.391	22%	0.217	S	C	.	.	H	α-helix	trans	-56.6	-50.5	173.9	180	-178.3	178.5	179.1	0	111.3	Y160 E174 T181 E182	Y160-K178 HydrophobicContact CD2-CD 3.74Å; Y160-K178 HydrophobicContact CE2-CD 3.92Å; E174-K178 VanDerWaalsContact O-CB 3.31Å; E174-K178 WeakPolarHBondContact O-CB 3.3Å; E174-K178 PolarHBondContact O-N 2.6Å; K178-T181 WeakPolarHBondContact O-CB 3.26Å; K178-T181 PolarHBondContact O-N 3.37Å; K178-E182 WeakPolarHBondContact CE-OE1 3.43Å; K178-E182 WeakPolarHBondContact O-CG 3.31Å; K178-E182 PolarHBondContact O-N 3.29Å
179	F	95.7	Very high	95.4	Very high	4 Å²	4	41.7 Å²	41.7	2%	0.018	22%	0.215	C	C	.	.	H	α-helix	trans	-75.2	-27.2	-176.2	-71.2	-50.4	0	0	0	113.8	C133 I135 A158 Y160 G175 V176 E177 E182 N183 F184 I187	C133-F179 HydrophobicContact CB-CD1 3.8Å; C133-F179 HydrophobicContact CB-CD2 3.78Å; C133-F179 HydrophobicContact CB-CE1 3.72Å; C133-F179 HydrophobicContact CB-CE2 3.67Å; C133-F179 HydrophobicContact CB-CG 3.84Å; C133-F179 HydrophobicContact CB-CZ 3.66Å; C133-F179 WeakPolarHBondContact SG-CD2 3.47Å; C133-F179 WeakPolarHBondContact SG-CG 3.44Å; I135-F179 HydrophobicContact CD1-CD2 4.03Å; I135-F179 HydrophobicContact CD1-CE2 4.42Å; I135-F179 HydrophobicContact CG1-CD2 3.86Å; I135-F179 HydrophobicContact CG1-CE2 3.75Å; A158-F179 HydrophobicContact CB-CE1 3.98Å; A158-F179 HydrophobicContact CB-CZ 4.35Å; Y160-F179 VanDerWaalsContact CB-CE2 3.47Å; G175-F179 WeakPolarHBondContact O-CD2 3.39Å; G175-F179 PolarHBondContact O-N 3.43Å; G175-F179 VanDerWaalsContact O-N 3.08Å; V176-F179 PolarHBondContact O-N 3.08Å; E177-F179 PolarHBondContact O-N 3.01Å; F179-E182 PolarHBondContact O-N 3.1Å; F179-N183 PolarHBondContact O-N 3.25Å; F179-F184 HydrophobicContact CB-CB 4.11Å; F179-F184 HydrophobicContact CB-CD2 4.15Å; F179-F184 HydrophobicContact CB-CG 4.26Å; F179-F184 AromaticContact CD1-CD2 3.62Å; F179-F184 HydrophobicContact CD1-CD2 3.62Å; F179-F184 AromaticContact CD1-CE2 3.65Å; F179-F184 HydrophobicContact CD1-CE2 3.65Å; F179-F184 HydrophobicContact CD1-CG 4.09Å; F179-F184 HydrophobicContact CD1-CZ 4.16Å; F179-F184 HydrophobicContact CE1-CD2 4.5Å; F179-F184 HydrophobicContact CE1-CE2 4.14Å; F179-F184 HydrophobicContact CE1-CZ 4.26Å; F179-F184 HydrophobicContact CG-CD2 4.29Å; F179-F184 HydrophobicContact CG-CG 4.48Å; F179-F184 WeakPolarHBondContact O-CB 3.5Å; F179-F184 PolarHBondContact O-N 3.07Å; F179-I187 HydrophobicContact CB-CD1 3.96Å; F179-I187 HydrophobicContact CB-CG1 4.17Å; F179-I187 HydrophobicContact CD2-CG2 4.48Å
180	K	93.8	Very high	95.4	Very high	82 Å²	82	40.3 Å²	40.3	36%	0.357	21%	0.207	S	C	.	.	H	α-helix	trans	-60.3	-47	166.2	-79.2	174.7	176.3	173.6	0	110.8	P101 V176 E177 E182 N183 I187	P101-K180 HydrophobicContact CB-CG 3.92Å; P101-K180 HydrophobicContact CG-CG 4.1Å; V176-K180 HydrophobicContact CG1-CD 3.87Å; V176-K180 VanDerWaalsContact CG1-CE 3.45Å; V176-K180 HydrophobicContact CG1-CG 4.3Å; V176-K180 WeakPolarHBondContact O-CB 3.46Å; V176-K180 VanDerWaalsContact O-CG 3.25Å; V176-K180 WeakPolarHBondContact O-CG 3.44Å; V176-K180 PolarHBondContact O-N 2.97Å; E177-K180 PolarHBondContact O-N 3.4Å; K180-E182 VanDerWaalsContact C-N 3.31Å; K180-E182 PolarHBondContact O-N 3.38Å; K180-N183 PolarHBondContact O-N 3.25Å; K180-N183 VanDerWaalsContact O-N 3.1Å; K180-I187 HydrophobicContact CG-CD1 3.97Å
181	T	94.7	Very high	95.4	Very high	102 Å²	102	38.4 Å²	38.4	63%	0.626	20%	0.195	S	C	*	.	H	α-helix	trans	-63.3	-36.4	177.9	-55.7	0	0	0	0	112.3	E177 K178 N183	E177-T181 PolarHBondContact O-N 3.36Å; E177-T181 PolarHBondContact O-OG1 2.95Å; K178-T181 WeakPolarHBondContact O-CB 3.26Å; K178-T181 PolarHBondContact O-N 3.37Å; T181-N183 PolarHBondContact O-N 3.07Å
182	E	94.5	Very high	95	Very high	83 Å²	83	38.5 Å²	38.5	39%	0.388	20%	0.196	S	C	.	.	T	Hydrogen-bonded Turn	trans	-81.1	10.4	176.6	-67.2	179.6	-160.9	0	0	113.7	K131 K178 F179 K180 F184	K131-E182 PolarHBondContact NZ-O 3.14Å; K178-E182 WeakPolarHBondContact CE-OE1 3.43Å; K178-E182 WeakPolarHBondContact O-CG 3.31Å; K178-E182 PolarHBondContact O-N 3.29Å; F179-E182 PolarHBondContact O-N 3.1Å; K180-E182 VanDerWaalsContact C-N 3.31Å; K180-E182 PolarHBondContact O-N 3.38Å; E182-F184 HydrophobicContact CB-CD2 3.67Å; E182-F184 HydrophobicContact CB-CE2 3.64Å; E182-F184 PolarHBondContact O-N 2.9Å; E182-F184 VanDerWaalsContact OE2-CE2 3.31Å; E182-F184 WeakPolarHBondContact OE2-CE2 3.38Å
183	N	93.2	Very high	94.3	Very high	130 Å²	130	38.9 Å²	38.9	70%	0.695	20%	0.2	S	C	*	.	T	Hydrogen-bonded Turn	trans	56.6	40.4	178.9	-61.6	-38.7	0	0	0	114	F179 K180 T181	F179-N183 PolarHBondContact O-N 3.25Å; K180-N183 PolarHBondContact O-N 3.25Å; K180-N183 VanDerWaalsContact O-N 3.1Å; T181-N183 PolarHBondContact O-N 3.07Å
184	F	95.3	Very high	93.1	Very high	17 Å²	17	38.6 Å²	38.6	8%	0.075	19%	0.191	C	C	.	.			trans	-76.3	140.7	169.1	-77.2	-102.7	0	0	0	110.8	K131 T132 C133 A158 F179 E182 I187	K131-F184 HydrophobicContact CB-CD1 4.32Å; K131-F184 HydrophobicContact CD-CD1 4.09Å; K131-F184 HydrophobicContact CD-CD2 4.21Å; K131-F184 HydrophobicContact CD-CE1 4.19Å; K131-F184 HydrophobicContact CD-CE2 4.32Å; K131-F184 HydrophobicContact CD-CG 4.11Å; K131-F184 HydrophobicContact CD-CZ 4.32Å; K131-F184 HydrophobicContact CG-CD1 3.62Å; K131-F184 HydrophobicContact CG-CE1 3.72Å; K131-F184 HydrophobicContact CG-CG 4.11Å; K131-F184 HydrophobicContact CG-CZ 4.3Å; T132-F184 WeakPolarHBondContact O-CD1 3.4Å; T132-F184 VanDerWaalsContact O-CE1 3.24Å; T132-F184 WeakPolarHBondContact O-CE1 3.4Å; C133-F184 HydrophobicContact CB-CD1 3.55Å; C133-F184 HydrophobicContact CB-CE1 3.76Å; C133-F184 HydrophobicContact CB-CG 4.14Å; C133-F184 HydrophobicContact CB-CZ 4.49Å; A158-F184 HydrophobicContact CB-CE1 3.72Å; A158-F184 HydrophobicContact CB-CZ 3.57Å; F179-F184 HydrophobicContact CB-CB 4.11Å; F179-F184 HydrophobicContact CB-CD2 4.15Å; F179-F184 HydrophobicContact CB-CG 4.26Å; F179-F184 AromaticContact CD1-CD2 3.62Å; F179-F184 HydrophobicContact CD1-CD2 3.62Å; F179-F184 AromaticContact CD1-CE2 3.65Å; F179-F184 HydrophobicContact CD1-CE2 3.65Å; F179-F184 HydrophobicContact CD1-CG 4.09Å; F179-F184 HydrophobicContact CD1-CZ 4.16Å; F179-F184 HydrophobicContact CE1-CD2 4.5Å; F179-F184 HydrophobicContact CE1-CE2 4.14Å; F179-F184 HydrophobicContact CE1-CZ 4.26Å; F179-F184 HydrophobicContact CG-CD2 4.29Å; F179-F184 HydrophobicContact CG-CG 4.48Å; F179-F184 WeakPolarHBondContact O-CB 3.5Å; F179-F184 PolarHBondContact O-N 3.07Å; E182-F184 HydrophobicContact CB-CD2 3.67Å; E182-F184 HydrophobicContact CB-CE2 3.64Å; E182-F184 PolarHBondContact O-N 2.9Å; E182-F184 VanDerWaalsContact OE2-CE2 3.31Å; E182-F184 WeakPolarHBondContact OE2-CE2 3.38Å; F184-I187 HydrophobicContact CB-CG1 4.33Å
185	E	95.3	Very high	91.8	Very high	36 Å²	36	38.1 Å²	38.1	17%	0.168	19%	0.188	C	C	.	.	S	Bend	trans	-95	-31.7	-177.1	-62.1	-179.7	115.3	0	0	112	G99 N102 W130 K131	G99-E185 PolarHBondContact N-OE1 3.33Å; N102-E185 WeakPolarHBondContact CB-O 3.44Å; N102-E185 PolarHBondContact N-O 3.4Å; N102-E185 PolarHBondContact ND2-O 2.87Å; W130-E185 HydrophobicContact CE3-CB 3.77Å; W130-E185 HydrophobicContact CE3-CG 4.49Å; W130-E185 HydrophobicContact CZ3-CB 4.29Å; K131-E185 PolarHBondContact N-OE2 2.93Å; K131-E185 PolarHBondContact O-N 3.44Å
186	I	96.8	Very high	90.3	Very high	0 Å²	0	41.3 Å²	41.3	0%	0	20%	0.202	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-123.3	111.1	179.9	-53.8	-65.4	0	0	0	108.5	P96 N102 Y125 W130 K131 T132 C133 I188	P96-I186 HydrophobicContact CB-CD1 3.43Å; P96-I186 VanDerWaalsContact CB-CD1 3.43Å; P96-I186 HydrophobicContact CG-CD1 4Å; N102-I186 HydrophobicContact CB-CD1 4.11Å; Y125-I186 HydrophobicContact CD2-CG2 4.42Å; Y125-I186 HydrophobicContact CG-CG1 4.49Å; W130-I186 HydrophobicContact CB-CG1 4.06Å; W130-I186 HydrophobicContact CD2-CD1 4.3Å; W130-I186 HydrophobicContact CD2-CG1 4.21Å; W130-I186 HydrophobicContact CE3-CD1 3.71Å; W130-I186 HydrophobicContact CE3-CG1 3.82Å; W130-I186 HydrophobicContact CG-CG1 4.35Å; W130-I186 HydrophobicContact CZ3-CD1 3.98Å; K131-I186 PolarHBondContact O-N 3.01Å; K131-I186 VanDerWaalsContact O-N 3.13Å; T132-I186 WeakPolarHBondContact CA-O 3.21Å; T132-I186 HydrophobicContact CG2-CB 3.91Å; T132-I186 HydrophobicContact CG2-CG1 4.18Å; T132-I186 HydrophobicContact CG2-CG2 4.41Å; C133-I186 PolarHBondContact N-O 3.17Å; I186-I188 HydrophobicContact CG2-CD1 3.87Å; I186-I188 HydrophobicContact CG2-CG1 3.94Å
187	I	97.6	Very high	88.7	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	109.9	-178.5	-52.9	176.5	0	0	0	108.2	P101 N102 V103 V104 I135 V176 F179 K180 F184	P101-I187 HydrophobicContact CB-CD1 4.11Å; N102-I187 PolarHBondContact O-N 3.36Å; V103-I187 WeakPolarHBondContact CA-O 3.36Å; V103-I187 HydrophobicContact CG2-CB 4.39Å; V103-I187 HydrophobicContact CG2-CD1 4.3Å; V104-I187 PolarHBondContact N-O 2.88Å; I135-I187 HydrophobicContact CD1-CG2 3.45Å; I135-I187 VanDerWaalsContact CD1-CG2 3.45Å; I135-I187 HydrophobicContact CG1-CG2 4.34Å; V176-I187 HydrophobicContact CG2-CG2 4.03Å; F179-I187 HydrophobicContact CB-CD1 3.96Å; F179-I187 HydrophobicContact CB-CG1 4.17Å; F179-I187 HydrophobicContact CD2-CG2 4.48Å; K180-I187 HydrophobicContact CG-CD1 3.97Å; F184-I187 HydrophobicContact CB-CG1 4.33Å
188	I	97.6	Very high	87.5	Confident	0 Å²	0	46.6 Å²	46.6	0%	0	23%	0.227	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.4	123	-175.9	-68.5	157.4	0	0	0	110	V104 F106 C118 L121 A122 C133 L134 I135 I186	V104-I188 HydrophobicContact CB-CG1 4.36Å; V104-I188 WeakPolarHBondContact O-CA 3.41Å; F106-I188 HydrophobicContact CD2-CG2 3.78Å; F106-I188 HydrophobicContact CE2-CG2 3.67Å; F106-I188 HydrophobicContact CZ-CG2 4.45Å; C118-I188 HydrophobicContact CB-CG2 3.73Å; L121-I188 HydrophobicContact CB-CD1 4.2Å; L121-I188 HydrophobicContact CD2-CD1 4.05Å; L121-I188 HydrophobicContact CD2-CG1 4.4Å; L121-I188 HydrophobicContact CG-CD1 4.2Å; A122-I188 HydrophobicContact CB-CD1 3.6Å; C133-I188 PolarHBondContact O-N 3.41Å; L134-I188 CarbonylContact C-O 3.59Å; L134-I188 WeakPolarHBondContact CA-O 3.34Å; L134-I188 HydrophobicContact CD2-CB 4Å; L134-I188 HydrophobicContact CD2-CG2 3.89Å; I135-I188 PolarHBondContact N-O 2.74Å; I186-I188 HydrophobicContact CG2-CD1 3.87Å; I186-I188 HydrophobicContact CG2-CG1 3.94Å
189	V	96.9	Very high	86.7	Confident	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.236	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.6	115.6	179.2	-174.3	0	0	0	0	110	V103 V104 F106 I135 A137 A172 V176 T191 I212	V103-V189 HydrophobicContact CG1-CG2 4.5Å; V104-V189 PolarHBondContact O-N 3.22Å; F106-V189 PolarHBondContact N-O 3.4Å; I135-V189 HydrophobicContact CB-CG2 4.28Å; I135-V189 HydrophobicContact CD1-CG2 4.01Å; A137-V189 HydrophobicContact CB-CG1 3.96Å; A172-V189 HydrophobicContact CB-CG1 4.25Å; V176-V189 HydrophobicContact CG2-CG2 4.23Å; V189-T191 HydrophobicContact CG1-CG2 4.5Å; V189-I212 HydrophobicContact CB-CD1 4.27Å; V189-I212 HydrophobicContact CG1-CD1 4.37Å; V189-I212 HydrophobicContact CG2-CD1 3.88Å
190	D	95.4	Very high	85.9	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	26%	0.26	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.3	112.4	173.6	-171.6	33.9	0	0	0	109.6	K114 T115 C118 I135 A137 D138 L148	K114-D190 WeakPolarHBondContact CB-OD1 3.35Å; T115-D190 VanDerWaalsContact CA-OD2 3.25Å; T115-D190 WeakPolarHBondContact CA-OD2 3.48Å; T115-D190 WeakPolarHBondContact CB-OD2 3.45Å; T115-D190 WeakPolarHBondContact CG2-OD2 3.26Å; T115-D190 PolarHBondContact N-OD1 3.34Å; T115-D190 PolarHBondContact OG1-OD2 3.06Å; C118-D190 HydrophobicContact CB-CB 4.49Å; I135-D190 PolarHBondContact O-N 3.29Å; A137-D190 CarbonylContact C-O 3.53Å; A137-D190 WeakPolarHBondContact CA-O 3.33Å; A137-D190 PolarHBondContact N-O 2.91Å; D138-D190 PolarHBondContact N-O 2.87Å; L148-D190 HydrophobicContact CD1-CB 3.78Å
191	T	92.8	Very high	85.1	Confident	6 Å²	6	47 Å²	47	4%	0.037	24%	0.243	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-93.2	165.8	178.7	76.2	0	0	0	0	111.7	M105 F106 K114 V189	M105-T191 HydrophobicContact CG-CG2 3.8Å; M105-T191 HydrophobicContact SD-CG2 4.24Å; F106-T191 WeakPolarHBondContact O-CG2 3.5Å; F106-T191 PolarHBondContact O-OG1 3.32Å; K114-T191 WeakPolarHBondContact CE-O 3.34Å; V189-T191 HydrophobicContact CG1-CG2 4.5Å
192	S	87	Confident	84.6	Confident	3 Å²	3	42.5 Å²	42.5	2%	0.021	22%	0.215	C	C	.	.			trans	-59.4	153	169.3	74.1	0	0	0	0	111.5	D138 L201 E204	D138-S192 WeakPolarHBondContact OD1-CB 3.21Å; S192-L201 VanDerWaalsContact OG-CD1 3.27Å; S192-L201 WeakPolarHBondContact OG-CD1 3.47Å; S192-E204 PolarHBondContact OG-OE1 2.84Å
193	G	79.2	Confident	84.2	Confident	9 Å²	9	44.3 Å²	44.3	9%	0.093	22%	0.223	C	C	.	.			trans	-113.9	120.5	171.8	0	0	0	0	0	111.2	G108 Q110	G108-G193 WeakPolarHBondContact O-CA 3.3Å; Q110-G193 VanDerWaalsContact CB-O 3.27Å; Q110-G193 WeakPolarHBondContact CB-O 3.36Å; Q110-G193 WeakPolarHBondContact CG-O 3.34Å
194	R	70.8	Confident	83.8	Confident	33 Å²	33	40 Å²	40	13%	0.125	20%	0.199	C	C	.	.			trans	-135	176.3	172.4	-38.6	-174	-169.7	-166.5	2.9	111.7	L109 F140 E198 L201 E204	L109-R194 WeakPolarHBondContact CD2-O 3.48Å; F140-R194 VanDerWaalsContact CD2-NH2 3.3Å; R194-E198 WeakPolarHBondContact CD-OE2 3.37Å; R194-E198 IonicContact CZ-OE2 3.43Å; R194-E198 IonicContact NE-OE2 2.97Å; R194-E198 IonicContact NH1-OE2 3.47Å; R194-E198 PolarHBondContact NH1-OE2 3.41Å; R194-L201 HydrophobicContact CB-CB 4.37Å; R194-L201 HydrophobicContact CB-CD1 4.37Å; R194-L201 HydrophobicContact CB-CD2 3.36Å; R194-L201 HydrophobicContact CB-CG 4.18Å; R194-L201 HydrophobicContact CG-CB 4.45Å; R194-L201 HydrophobicContact CG-CD1 3.76Å; R194-L201 HydrophobicContact CG-CD2 3.7Å; R194-L201 HydrophobicContact CG-CG 4.12Å; R194-E204 IonicContact NH2-OE2 2.76Å
195	H	69.6	Low	83.4	Confident	88 Å²	88	39.3 Å²	39.3	41%	0.407	20%	0.196	S	C	.	.			trans	-80.8	148.8	-176.4	-159.3	-98.4	0	0	0	110.8	Q197 E198	H195-Q197 PolarHBondContact O-N 3.17Å; H195-E198 PolarHBondContact O-N 3.22Å; H195-E198 VanDerWaalsContact O-N 3.14Å
196	K	62.1	Low	83.1	Confident	68 Å²	68	40.9 Å²	40.9	30%	0.296	21%	0.205	S	C	.	.	T	Hydrogen-bonded Turn	trans	-60.6	-4.7	-177.8	65.7	167.5	179.4	179.9	0	115.9	F202 Q232	K196-F202 HydrophobicContact CB-CE2 4.24Å; K196-F202 HydrophobicContact CB-CZ 4.25Å; K196-Q232 HydrophobicContact CD-CG 3.86Å; K196-Q232 HydrophobicContact CG-CG 4.37Å
197	Q	62.7	Low	82.9	Confident	156 Å²	156	46.1 Å²	46.1	73%	0.729	23%	0.23	S	C	*	.	T	Hydrogen-bonded Turn	trans	-91.4	-5	-179.2	-74	174.1	-30.4	0	0	112.3	H195	H195-Q197 PolarHBondContact O-N 3.17Å
198	E	70.5	Confident	82.6	Confident	72 Å²	72	46.3 Å²	46.3	34%	0.336	23%	0.231	S	C	.	.			trans	-94.4	95.8	175.3	-71.3	-178.7	-141.4	0	0	109.9	R194 H195 S200 L201	R194-E198 WeakPolarHBondContact CD-OE2 3.37Å; R194-E198 IonicContact CZ-OE2 3.43Å; R194-E198 IonicContact NE-OE2 2.97Å; R194-E198 IonicContact NH1-OE2 3.47Å; R194-E198 PolarHBondContact NH1-OE2 3.41Å; H195-E198 PolarHBondContact O-N 3.22Å; H195-E198 VanDerWaalsContact O-N 3.14Å; E198-S200 PolarHBondContact O-N 3.17Å; E198-L201 HydrophobicContact CB-CB 4.12Å; E198-L201 PolarHBondContact O-N 2.85Å; E198-L201 VanDerWaalsContact O-N 3.13Å
199	D	78.9	Confident	82.4	Confident	111 Å²	111	47.1 Å²	47.1	59%	0.594	24%	0.236	S	C	*	.	H	α-helix	trans	-57.2	-35	174	-71.2	-32.6	0	0	0	111.7	L201 F202 E203	D199-L201 VanDerWaalsContact C-N 3.29Å; D199-L201 PolarHBondContact O-N 3.36Å; D199-F202 PolarHBondContact O-N 3.17Å; D199-F202 VanDerWaalsContact O-N 3.12Å; D199-E203 PolarHBondContact O-N 3.33Å
200	S	80.1	Confident	82.3	Confident	73 Å²	73	52.1 Å²	52.1	51%	0.51	26%	0.263	S	S	.	.	H	α-helix	trans	-60	-35	176.6	54.4	0	0	0	0	113.3	E198 E204	E198-S200 PolarHBondContact O-N 3.17Å; S200-E204 WeakPolarHBondContact O-CB 3.48Å; S200-E204 PolarHBondContact O-N 3.28Å
201	L	76.7	Confident	82.2	Confident	1 Å²	1	54.4 Å²	54.4	1%	0.005	28%	0.282	C	S	.	.	H	α-helix	trans	-67.2	-43.8	175.1	178.4	68.4	0	0	0	110.9	S192 R194 E198 D199 E203 E204 M205	S192-L201 VanDerWaalsContact OG-CD1 3.27Å; S192-L201 WeakPolarHBondContact OG-CD1 3.47Å; R194-L201 HydrophobicContact CB-CB 4.37Å; R194-L201 HydrophobicContact CB-CD1 4.37Å; R194-L201 HydrophobicContact CB-CD2 3.36Å; R194-L201 HydrophobicContact CB-CG 4.18Å; R194-L201 HydrophobicContact CG-CB 4.45Å; R194-L201 HydrophobicContact CG-CD1 3.76Å; R194-L201 HydrophobicContact CG-CD2 3.7Å; R194-L201 HydrophobicContact CG-CG 4.12Å; E198-L201 HydrophobicContact CB-CB 4.12Å; E198-L201 PolarHBondContact O-N 2.85Å; E198-L201 VanDerWaalsContact O-N 3.13Å; D199-L201 VanDerWaalsContact C-N 3.29Å; D199-L201 PolarHBondContact O-N 3.36Å; L201-E203 VanDerWaalsContact C-N 3.27Å; L201-E203 PolarHBondContact O-N 3.09Å; L201-E204 PolarHBondContact O-N 3.27Å; L201-M205 HydrophobicContact CD1-CG 4.21Å; L201-M205 HydrophobicContact CD2-CE 4.32Å; L201-M205 HydrophobicContact CD2-SD 4.29Å; L201-M205 HydrophobicContact CG-CE 4.22Å; L201-M205 HydrophobicContact CG-CG 4.23Å; L201-M205 HydrophobicContact CG-SD 4.24Å; L201-M205 WeakPolarHBondContact O-CB 3.37Å; L201-M205 WeakPolarHBondContact O-CG 3.31Å; L201-M205 PolarHBondContact O-N 3.17Å
202	F	82.6	Confident	82.3	Confident	7 Å²	7	54.4 Å²	54.4	3%	0.031	28%	0.281	C	S	.	.	H	α-helix	trans	-64.8	-36.1	-179.1	-75.9	-71.8	0	0	0	111.8	K196 D199 M205 L206 A235 F236 K239	K196-F202 HydrophobicContact CB-CE2 4.24Å; K196-F202 HydrophobicContact CB-CZ 4.25Å; D199-F202 PolarHBondContact O-N 3.17Å; D199-F202 VanDerWaalsContact O-N 3.12Å; F202-M205 HydrophobicContact CB-CE 4.45Å; F202-M205 HydrophobicContact CD1-CE 3.24Å; F202-M205 HydrophobicContact CE1-CE 3.62Å; F202-M205 HydrophobicContact CG-CE 4Å; F202-L206 VanDerWaalsContact O-CB 3.27Å; F202-L206 WeakPolarHBondContact O-CB 3.3Å; F202-L206 PolarHBondContact O-N 3.13Å; F202-A235 HydrophobicContact CZ-CB 4.1Å; F202-F236 AromaticContact CE1-CD1 3.83Å; F202-F236 HydrophobicContact CE1-CD1 3.83Å; F202-F236 HydrophobicContact CE1-CD2 4.42Å; F202-F236 HydrophobicContact CE1-CE1 4.05Å; F202-F236 HydrophobicContact CE1-CG 4.03Å; F202-F236 HydrophobicContact CE1-CZ 4.4Å; F202-F236 HydrophobicContact CZ-CE2 4.45Å; F202-F236 HydrophobicContact CZ-CZ 4.47Å; F202-K239 HydrophobicContact CB-CB 4.33Å; F202-K239 HydrophobicContact CB-CD 4.2Å; F202-K239 HydrophobicContact CB-CG 3.98Å; F202-K239 HydrophobicContact CD1-CB 3.63Å; F202-K239 HydrophobicContact CD1-CG 3.61Å; F202-K239 HydrophobicContact CE1-CB 4.33Å; F202-K239 HydrophobicContact CE1-CG 4.26Å; F202-K239 HydrophobicContact CG-CB 4.28Å; F202-K239 HydrophobicContact CG-CG 3.87Å
203	E	86.3	Confident	82.5	Confident	120 Å²	120	61.9 Å²	61.9	56%	0.561	32%	0.316	S	S	*	.	H	α-helix	trans	-64.1	-47	171.7	-70.7	179.8	-175.4	0	0	111.8	D199 L201 M205 L206 Q207	D199-E203 PolarHBondContact O-N 3.33Å; L201-E203 VanDerWaalsContact C-N 3.27Å; L201-E203 PolarHBondContact O-N 3.09Å; E203-M205 PolarHBondContact O-N 2.84Å; E203-L206 PolarHBondContact O-N 3.15Å; E203-Q207 VanDerWaalsContact O-CG 3.3Å; E203-Q207 WeakPolarHBondContact O-CG 3.39Å; E203-Q207 PolarHBondContact O-N 3.38Å
204	E	84.7	Confident	83.3	Confident	40 Å²	40	62.6 Å²	62.6	19%	0.187	32%	0.319	C	S	.	.	H	α-helix	trans	-58	-48.3	175.8	-177.5	-174.6	91.1	0	0	111.6	P168 S192 R194 S200 L201 L206 Q207 V208	P168-E204 HydrophobicContact CG-CG 3.55Å; S192-E204 PolarHBondContact OG-OE1 2.84Å; R194-E204 IonicContact NH2-OE2 2.76Å; S200-E204 WeakPolarHBondContact O-CB 3.48Å; S200-E204 PolarHBondContact O-N 3.28Å; L201-E204 PolarHBondContact O-N 3.27Å; E204-L206 VanDerWaalsContact C-N 3.33Å; E204-L206 PolarHBondContact O-N 3.04Å; E204-Q207 WeakPolarHBondContact O-CB 3.25Å; E204-Q207 PolarHBondContact O-N 3.42Å; E204-V208 WeakPolarHBondContact O-CG2 3.47Å; E204-V208 PolarHBondContact O-N 2.67Å
205	M	87.1	Confident	84.3	Confident	3 Å²	3	64.4 Å²	64.4	2%	0.015	33%	0.329	C	S	.	.	H	α-helix	trans	-63	-38.6	177.6	-71.8	-171.4	-51.9	0	0	112.5	V107 L201 F202 E203 V208 S209 F236 V240	V107-M205 HydrophobicContact CB-SD 4.4Å; V107-M205 HydrophobicContact CG1-SD 4.14Å; L201-M205 HydrophobicContact CD1-CG 4.21Å; L201-M205 HydrophobicContact CD2-CE 4.32Å; L201-M205 HydrophobicContact CD2-SD 4.29Å; L201-M205 HydrophobicContact CG-CE 4.22Å; L201-M205 HydrophobicContact CG-CG 4.23Å; L201-M205 HydrophobicContact CG-SD 4.24Å; L201-M205 WeakPolarHBondContact O-CB 3.37Å; L201-M205 WeakPolarHBondContact O-CG 3.31Å; L201-M205 PolarHBondContact O-N 3.17Å; F202-M205 HydrophobicContact CB-CE 4.45Å; F202-M205 HydrophobicContact CD1-CE 3.24Å; F202-M205 HydrophobicContact CE1-CE 3.62Å; F202-M205 HydrophobicContact CG-CE 4Å; E203-M205 PolarHBondContact O-N 2.84Å; M205-V208 PolarHBondContact O-N 3.34Å; M205-S209 WeakPolarHBondContact O-CB 3.45Å; M205-S209 PolarHBondContact O-N 2.93Å; M205-F236 HydrophobicContact CE-CD1 3.85Å; M205-F236 HydrophobicContact CE-CE1 3.53Å; M205-F236 HydrophobicContact SD-CD1 4.33Å; M205-F236 HydrophobicContact SD-CE1 3.74Å; M205-V240 HydrophobicContact CB-CG2 4.4Å
206	L	90.2	Very high	85.4	Confident	69 Å²	69	60.2 Å²	60.2	36%	0.361	31%	0.31	S	S	.	.	H	α-helix	trans	-65.3	-41.4	175.9	179.7	61.2	0	0	0	110.7	F202 E203 E204 S209 N210	F202-L206 VanDerWaalsContact O-CB 3.27Å; F202-L206 WeakPolarHBondContact O-CB 3.3Å; F202-L206 PolarHBondContact O-N 3.13Å; E203-L206 PolarHBondContact O-N 3.15Å; E204-L206 VanDerWaalsContact C-N 3.33Å; E204-L206 PolarHBondContact O-N 3.04Å; L206-S209 PolarHBondContact O-N 3.38Å; L206-N210 WeakPolarHBondContact O-CB 3.2Å; L206-N210 PolarHBondContact O-N 3.15Å; L206-N210 PolarHBondContact O-ND2 3.33Å
207	Q	91.5	Very high	87	Confident	110 Å²	110	57.3 Å²	57.3	51%	0.514	30%	0.298	S	S	.	.	H	α-helix	trans	-62.2	-45.8	174.5	-71.2	175	0.5	0	0	111.7	V169 E203 E204 S209 N210 A211	V169-Q207 HydrophobicContact CG2-CB 3.84Å; E203-Q207 VanDerWaalsContact O-CG 3.3Å; E203-Q207 WeakPolarHBondContact O-CG 3.39Å; E203-Q207 PolarHBondContact O-N 3.38Å; E204-Q207 WeakPolarHBondContact O-CB 3.25Å; E204-Q207 PolarHBondContact O-N 3.42Å; Q207-S209 PolarHBondContact O-N 3.49Å; Q207-N210 PolarHBondContact O-N 2.86Å; Q207-A211 WeakPolarHBondContact O-CB 3.43Å; Q207-A211 PolarHBondContact O-N 3.32Å
208	V	92.2	Very high	88.5	Confident	4 Å²	4	49.9 Å²	49.9	2%	0.024	26%	0.263	C	S	.	.	H	α-helix	trans	-59.2	-47.6	174.8	173.5	0	0	0	0	110.6	M105 P168 V169 A172 E204 M205 N210 A211 I212	M105-V208 HydrophobicContact SD-CG1 4.04Å; P168-V208 HydrophobicContact CB-CG2 4.15Å; P168-V208 HydrophobicContact CG-CG2 4.26Å; V169-V208 HydrophobicContact CB-CG2 4.49Å; V169-V208 HydrophobicContact CG2-CG2 3.81Å; A172-V208 HydrophobicContact CB-CG1 3.88Å; E204-V208 WeakPolarHBondContact O-CG2 3.47Å; E204-V208 PolarHBondContact O-N 2.67Å; M205-V208 PolarHBondContact O-N 3.34Å; V208-N210 VanDerWaalsContact C-N 3.33Å; V208-N210 PolarHBondContact O-N 2.84Å; V208-A211 PolarHBondContact O-N 3.24Å; V208-I212 HydrophobicContact CG1-CD1 4.18Å; V208-I212 WeakPolarHBondContact O-CG1 3.3Å; V208-I212 PolarHBondContact O-N 3.3Å
209	S	93.4	Very high	89.6	Confident	17 Å²	17	46.5 Å²	46.5	12%	0.119	25%	0.247	C	C	.	.	H	α-helix	trans	-58.8	-43.8	178	-166.9	0	0	0	0	112.1	M205 L206 Q207 A211 Q213 P214	M205-S209 WeakPolarHBondContact O-CB 3.45Å; M205-S209 PolarHBondContact O-N 2.93Å; L206-S209 PolarHBondContact O-N 3.38Å; Q207-S209 PolarHBondContact O-N 3.49Å; S209-A211 VanDerWaalsContact C-N 3.34Å; S209-Q213 WeakPolarHBondContact O-CA 3.42Å; S209-Q213 PolarHBondContact O-N 2.93Å; S209-P214 WeakPolarHBondContact O-CD 3.38Å
210	N	93.7	Very high	90.3	Very high	104 Å²	104	41.2 Å²	41.2	56%	0.556	22%	0.219	S	C	*	.	H	α-helix	trans	-67.5	-35.4	179.2	-71.2	-21.2	0	0	0	112.2	L206 Q207 V208	L206-N210 WeakPolarHBondContact O-CB 3.2Å; L206-N210 PolarHBondContact O-N 3.15Å; L206-N210 PolarHBondContact O-ND2 3.33Å; Q207-N210 PolarHBondContact O-N 2.86Å; V208-N210 VanDerWaalsContact C-N 3.33Å; V208-N210 PolarHBondContact O-N 2.84Å
211	A	94.1	Very high	90.8	Very high	48 Å²	48	37.8 Å²	37.8	40%	0.397	20%	0.195	S	C	.	.	H	α-helix	trans	-72.4	-43	179.6	0	0	0	0	0	112.8	V169 Q207 V208 S209	V169-A211 HydrophobicContact CG1-CB 3.59Å; Q207-A211 WeakPolarHBondContact O-CB 3.43Å; Q207-A211 PolarHBondContact O-N 3.32Å; V208-A211 PolarHBondContact O-N 3.24Å; S209-A211 VanDerWaalsContact C-N 3.34Å
212	I	93.9	Very high	91.4	Very high	6 Å²	6	38.4 Å²	38.4	3%	0.031	20%	0.198	C	C	.	.	H	α-helix	trans	-91.2	-19.3	-176.3	72.6	-176.2	0	0	0	114.2	V103 M105 A172 V176 V189 V208 P214	V103-I212 HydrophobicContact CG1-CB 4.42Å; V103-I212 HydrophobicContact CG1-CD1 4.16Å; V103-I212 HydrophobicContact CG1-CG1 4.27Å; M105-I212 HydrophobicContact CB-CD1 4.22Å; M105-I212 HydrophobicContact CG-CD1 4.24Å; M105-I212 HydrophobicContact SD-CD1 3.98Å; A172-I212 HydrophobicContact CB-CG2 3.63Å; V176-I212 HydrophobicContact CG2-CB 4.11Å; V176-I212 HydrophobicContact CG2-CG2 3.97Å; V189-I212 HydrophobicContact CB-CD1 4.27Å; V189-I212 HydrophobicContact CG1-CD1 4.37Å; V189-I212 HydrophobicContact CG2-CD1 3.88Å; V208-I212 HydrophobicContact CG1-CD1 4.18Å; V208-I212 WeakPolarHBondContact O-CG1 3.3Å; V208-I212 PolarHBondContact O-N 3.3Å; I212-P214 HydrophobicContact CD1-CB 4.37Å; I212-P214 HydrophobicContact CG1-CB 4.34Å; I212-P214 HydrophobicContact CG1-CG 4.29Å
213	Q	93	Very high	91.5	Very high	160 Å²	160	38.1 Å²	38.1	75%	0.748	20%	0.197	S	C	*	.			trans	49.3	67.1	-175.7	-60.2	-178.9	-18.5	0	0	112.2	S209	S209-Q213 WeakPolarHBondContact O-CA 3.42Å; S209-Q213 PolarHBondContact O-N 2.93Å
214	P	94.3	Very high	91.2	Very high	24 Å²	24	35.9 Å²	35.9	16%	0.156	19%	0.194	C	C	.	.			trans	-67.2	138.2	-175.4	29.9	-32.4	0	0	0	110.8	V103 M105 S209 I212 C216 V217	V103-P214 HydrophobicContact CG1-CB 4.28Å; V103-P214 CarbonylContact O-C 3.6Å; M105-P214 HydrophobicContact CB-CB 3.85Å; M105-P214 HydrophobicContact CB-CG 4.08Å; M105-P214 HydrophobicContact SD-CG 4.48Å; S209-P214 WeakPolarHBondContact O-CD 3.38Å; I212-P214 HydrophobicContact CD1-CB 4.37Å; I212-P214 HydrophobicContact CG1-CB 4.34Å; I212-P214 HydrophobicContact CG1-CG 4.29Å; P214-C216 VanDerWaalsContact C-N 3.3Å; P214-V217 HydrophobicContact CB-CG2 4.28Å; P214-V217 HydrophobicContact CG-CG2 3.67Å
215	E	92.6	Very high	91	Very high	71 Å²	71	35.3 Å²	35.3	33%	0.332	19%	0.193	S	C	.	.	S	Bend	trans	-71.6	-30.9	174	-173.6	-176.9	147.6	0	0	111.2	W94 R100 N102 V103	W94-E215 PolarHBondContact NE1-OE1 3.37Å; R100-E215 IonicContact CZ-OE1 3.74Å; R100-E215 IonicContact CZ-OE2 3.64Å; R100-E215 IonicContact NE-OE2 2.77Å; R100-E215 PolarHBondContact NE-OE2 3.49Å; R100-E215 IonicContact NH2-OE1 3.63Å; R100-E215 PolarHBondContact NH2-OE1 2.97Å; R100-E215 IonicContact NH2-OE2 3.82Å; R100-E215 PolarHBondContact NH2-OE2 3.24Å; N102-E215 PolarHBondContact OD1-OE2 2.84Å; V103-E215 PolarHBondContact O-N 3.48Å
216	C	93.2	Very high	90.4	Very high	1 Å²	1	35.9 Å²	35.9	1%	0.007	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-140.8	126.7	178.7	-175.5	0	0	0	0	110.3	W94 V103 V104 M105 P214	W94-C216 HydrophobicContact CB-CB 4.41Å; W94-C216 HydrophobicContact CD2-CB 3.75Å; W94-C216 HydrophobicContact CE3-CB 4.35Å; W94-C216 HydrophobicContact CG-CB 3.73Å; V103-C216 PolarHBondContact O-N 3Å; V104-C216 WeakPolarHBondContact CA-O 3.32Å; M105-C216 PolarHBondContact N-O 2.95Å; P214-C216 VanDerWaalsContact C-N 3.3Å
217	V	94.7	Very high	89.7	Confident	7 Å²	7	35.9 Å²	35.9	4%	0.042	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-101	121.2	168.2	-177.3	0	0	0	0	108.8	M105 V107 P214 V240 E241 V242 A243 S244	M105-V217 HydrophobicContact CB-CG2 4.39Å; M105-V217 HydrophobicContact CE-CG1 3.92Å; M105-V217 HydrophobicContact CE-CG2 3.94Å; M105-V217 CarbonylContact O-C 3.56Å; M105-V217 WeakPolarHBondContact O-CA 3.49Å; V107-V217 HydrophobicContact CB-CG1 4.48Å; V107-V217 HydrophobicContact CG1-CG1 4Å; V107-V217 HydrophobicContact CG2-CG1 3.64Å; P214-V217 HydrophobicContact CB-CG2 4.28Å; P214-V217 HydrophobicContact CG-CG2 3.67Å; V217-V240 HydrophobicContact CB-CG1 4.21Å; V217-V240 HydrophobicContact CG1-CG1 3.79Å; V217-V240 HydrophobicContact CG2-CG1 3.78Å; V217-E241 WeakPolarHBondContact CB-O 3.27Å; V217-V242 HydrophobicContact CG1-CG2 4.39Å; V217-A243 PolarHBondContact O-N 3.41Å; V217-S244 PolarHBondContact O-N 3.45Å
218	I	95.1	Very high	89.2	Confident	0 Å²	0	33.1 Å²	33.1	0%	0	19%	0.193	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-104.4	118.8	-178.6	-62.3	175.5	0	0	0	109.4	V104 M105 F106 V107 L121 V220 S244 I246 I271	V104-I218 HydrophobicContact CG1-CD1 3.32Å; V104-I218 HydrophobicContact CG1-CG1 3.82Å; M105-I218 PolarHBondContact O-N 3.46Å; F106-I218 HydrophobicContact CD2-CB 4.47Å; F106-I218 HydrophobicContact CD2-CD1 4.49Å; F106-I218 HydrophobicContact CE1-CG2 4.44Å; F106-I218 HydrophobicContact CE2-CB 4.46Å; F106-I218 HydrophobicContact CE2-CD1 3.77Å; F106-I218 HydrophobicContact CZ-CD1 3.94Å; V107-I218 PolarHBondContact N-O 3.44Å; L121-I218 HydrophobicContact CD2-CD1 3.96Å; I218-V220 HydrophobicContact CG2-CG2 4.37Å; I218-S244 CarbonylContact C-O 3.47Å; I218-S244 WeakPolarHBondContact CA-O 3.44Å; I218-I246 HydrophobicContact CD1-CD1 4.36Å; I218-I246 HydrophobicContact CG2-CB 4.24Å; I218-I246 HydrophobicContact CG2-CD1 3.6Å; I218-I246 HydrophobicContact CG2-CG1 3.59Å; I218-I271 HydrophobicContact CD1-CD1 3.71Å; I218-I271 HydrophobicContact CG1-CD1 4.1Å; I218-I271 HydrophobicContact CG2-CD1 4.49Å
219	Y	93.5	Very high	88.8	Confident	1 Å²	1	32.9 Å²	32.9	0%	0.004	19%	0.192	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-84.8	114.2	170.2	177.4	-117.4	0	0	0	110.5	V107 M221 A233 F236 S244 V245 I246 A262	V107-Y219 HydrophobicContact CG2-CD2 4.38Å; V107-Y219 WeakPolarHBondContact O-CA 3.49Å; Y219-M221 HydrophobicContact CD1-CB 4.31Å; Y219-M221 HydrophobicContact CE1-CB 3.77Å; Y219-A233 HydrophobicContact CD1-CB 4.37Å; Y219-A233 HydrophobicContact CE1-CB 3.75Å; Y219-F236 HydrophobicContact CD2-CB 4.32Å; Y219-F236 HydrophobicContact CD2-CD2 4.14Å; Y219-F236 HydrophobicContact CD2-CG 4.13Å; Y219-F236 HydrophobicContact CE2-CB 4.45Å; Y219-F236 AromaticContact CE2-CD2 3.55Å; Y219-F236 HydrophobicContact CE2-CD2 3.55Å; Y219-F236 AromaticContact CE2-CE2 3.94Å; Y219-F236 HydrophobicContact CE2-CE2 3.94Å; Y219-F236 HydrophobicContact CE2-CG 4.01Å; Y219-S244 PolarHBondContact N-O 3.37Å; Y219-V245 HydrophobicContact CD1-CG1 4.3Å; Y219-V245 HydrophobicContact CD1-CG2 4.41Å; Y219-V245 CarbonylContact O-C 3.52Å; Y219-V245 WeakPolarHBondContact O-CA 3.43Å; Y219-I246 PolarHBondContact O-N 2.89Å; Y219-A262 HydrophobicContact CE1-CB 4.46Å
220	V	93.6	Very high	88.4	Confident	0 Å²	0	34.8 Å²	34.8	0%	0	20%	0.199	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.8	124.3	174.9	-174.1	0	0	0	0	109.4	F106 V107 C112 K114 I218 I246 T248	F106-V220 HydrophobicContact CD1-CG2 3.43Å; F106-V220 VanDerWaalsContact CD1-CG2 3.43Å; F106-V220 HydrophobicContact CE1-CG2 3.88Å; F106-V220 HydrophobicContact CG-CG2 4.41Å; V107-V220 PolarHBondContact O-N 3.03Å; C112-V220 PolarHBondContact SG-O 3.42Å; K114-V220 HydrophobicContact CG-CB 4Å; K114-V220 HydrophobicContact CG-CG2 4.18Å; I218-V220 HydrophobicContact CG2-CG2 4.37Å; V220-I246 WeakPolarHBondContact CA-O 3.4Å; V220-T248 HydrophobicContact CG1-CG2 3.51Å
221	M	90.3	Very high	88	Confident	0 Å²	0	32.1 Å²	32.1	0%	0	19%	0.191	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	147.6	178.5	68	164.7	-74	0	0	112	Y219 C229 V245 I246 V247 T248 A259 A262	Y219-M221 HydrophobicContact CD1-CB 4.31Å; Y219-M221 HydrophobicContact CE1-CB 3.77Å; M221-C229 VanDerWaalsContact CE-SG 3.51Å; M221-V245 HydrophobicContact CG-CG1 3.97Å; M221-V245 HydrophobicContact SD-CG1 4.08Å; M221-I246 PolarHBondContact N-O 3.25Å; M221-V247 HydrophobicContact CG-CB 4.42Å; M221-V247 HydrophobicContact CG-CG2 4Å; M221-V247 WeakPolarHBondContact O-CA 3.49Å; M221-V247 HydrophobicContact SD-CG2 4.1Å; M221-T248 PolarHBondContact O-N 3.47Å; M221-T248 PolarHBondContact O-OG1 2.94Å; M221-A259 HydrophobicContact CE-CB 4.28Å; M221-A259 HydrophobicContact SD-CB 4.28Å; M221-A262 HydrophobicContact SD-CB 3.43Å; M221-A262 WeakPolarHBondContact SD-CB 3.45Å
222	D	89.1	Confident	87.6	Confident	15 Å²	15	30.4 Å²	30.4	8%	0.08	18%	0.175	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-86.6	129.8	173.4	-178.6	-24.5	0	0	0	109.4	C112 S224 I225 K249	C112-D222 HydrophobicContact CB-CB 4.23Å; D222-S224 PolarHBondContact O-N 3.42Å; D222-S224 VanDerWaalsContact O-N 3.12Å; D222-S224 VanDerWaalsContact OD1-CB 3.31Å; D222-S224 WeakPolarHBondContact OD1-CB 3.49Å; D222-S224 PolarHBondContact OD1-N 2.86Å; D222-S224 PolarHBondContact OD1-OG 2.97Å; D222-S224 PolarHBondContact OD2-OG 3.39Å; D222-I225 HydrophobicContact CB-CD1 3.92Å; D222-I225 HydrophobicContact CB-CG1 3.99Å; D222-I225 WeakPolarHBondContact O-CB 3.35Å; D222-I225 WeakPolarHBondContact O-CG1 3.41Å; D222-I225 PolarHBondContact O-N 3.31Å; D222-K249 VanDerWaalsContact OD2-CD 3.3Å; D222-K249 WeakPolarHBondContact OD2-CD 3.49Å; D222-K249 VanDerWaalsContact OD2-CE 3.26Å; D222-K249 WeakPolarHBondContact OD2-CE 3.38Å; D222-K249 IonicContact OD2-NZ 3.95Å; D222-K249 PolarHBondContact OD2-NZ 2.86Å
223	A	85	Confident	87.2	Confident	1 Å²	1	30.1 Å²	30.1	1%	0.008	17%	0.173	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.3	-15.8	179.4	0	0	0	0	0	114.6	I225 V247 T248 L250 A254 G256	A223-I225 VanDerWaalsContact C-N 3.35Å; A223-V247 HydrophobicContact CB-CG1 3.79Å; A223-T248 WeakPolarHBondContact CB-O 3.15Å; A223-T248 PolarHBondContact N-O 2.77Å; A223-L250 HydrophobicContact CB-CD2 3.45Å; A223-L250 VanDerWaalsContact CB-CD2 3.45Å; A223-L250 HydrophobicContact CB-CG 4.25Å; A223-A254 HydrophobicContact CB-CB 3.48Å; A223-A254 VanDerWaalsContact CB-CB 3.48Å; A223-G256 PolarHBondContact O-N 3.05Å
224	S	81.3	Confident	87	Confident	72 Å²	72	27.7 Å²	27.7	50%	0.503	16%	0.16	S	C	.	.	T	Hydrogen-bonded Turn	trans	-80	-14.8	175.3	66.1	0	0	0	0	113.5	D222 G226	D222-S224 PolarHBondContact O-N 3.42Å; D222-S224 VanDerWaalsContact O-N 3.12Å; D222-S224 VanDerWaalsContact OD1-CB 3.31Å; D222-S224 WeakPolarHBondContact OD1-CB 3.49Å; D222-S224 PolarHBondContact OD1-N 2.86Å; D222-S224 PolarHBondContact OD1-OG 2.97Å; D222-S224 PolarHBondContact OD2-OG 3.39Å; S224-G226 PolarHBondContact O-N 2.82Å; S224-G226 VanDerWaalsContact O-N 3.17Å
225	I	80.4	Confident	86.8	Confident	29 Å²	29	27.5 Å²	27.5	15%	0.149	16%	0.161	C	C	.	.			trans	-70	114.8	176.7	-59	170.2	0	0	0	107.9	L109 D222 A223 C229 G258	L109-I225 HydrophobicContact CD1-CD1 3.86Å; D222-I225 HydrophobicContact CB-CD1 3.92Å; D222-I225 HydrophobicContact CB-CG1 3.99Å; D222-I225 WeakPolarHBondContact O-CB 3.35Å; D222-I225 WeakPolarHBondContact O-CG1 3.41Å; D222-I225 PolarHBondContact O-N 3.31Å; A223-I225 VanDerWaalsContact C-N 3.35Å; I225-C229 HydrophobicContact CB-CB 4.46Å; I225-C229 HydrophobicContact CG2-CB 3.69Å; I225-G258 WeakPolarHBondContact O-CA 3.44Å
226	G	74.6	Confident	86.6	Confident	14 Å²	14	24.2 Å²	24.2	14%	0.144	15%	0.145	C	C	.	.			trans	-83.6	-126.3	177.9	0	0	0	0	0	113	D43 S224 A228 C229	D43-G226 VanDerWaalsContact CB-CA 3.47Å; S224-G226 PolarHBondContact O-N 2.82Å; S224-G226 VanDerWaalsContact O-N 3.17Å; G226-A228 PolarHBondContact O-N 2.71Å; G226-A228 VanDerWaalsContact O-N 3.12Å; G226-C229 WeakPolarHBondContact O-CB 3.47Å; G226-C229 PolarHBondContact O-N 3.06Å
227	Q	74.5	Confident	86.3	Confident	70 Å²	70	27.2 Å²	27.2	33%	0.327	16%	0.159	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-29.9	-173.1	-59.8	-63.9	-34.4	0	0	114.8	D43 V44 N45 C229	D43-Q227 PolarHBondContact O-NE2 3.02Å; D43-Q227 VanDerWaalsContact O-NE2 3.17Å; V44-Q227 VanDerWaalsContact C-NE2 3.33Å; V44-Q227 PolarHBondContact O-NE2 3.36Å; N45-Q227 VanDerWaalsContact CA-OE1 3.3Å; Q227-C229 PolarHBondContact O-N 2.91Å; Q227-C229 VanDerWaalsContact O-N 3.15Å
228	A	81.3	Confident	86.1	Confident	51 Å²	51	33.1 Å²	33.1	42%	0.421	19%	0.186	S	C	.	.	H	α-helix	trans	-66.3	-14.4	179.3	0	0	0	0	0	113.5	G226 E230 A231 Q232	G226-A228 PolarHBondContact O-N 2.71Å; G226-A228 VanDerWaalsContact O-N 3.12Å; A228-E230 PolarHBondContact O-N 3.43Å; A228-A231 PolarHBondContact O-N 3.22Å; A228-Q232 WeakPolarHBondContact O-CG 3.49Å; A228-Q232 PolarHBondContact O-N 2.87Å
229	C	83.8	Confident	85.7	Confident	0 Å²	0	38.1 Å²	38.1	0%	0	21%	0.208	C	C	.	.	H	α-helix	trans	-60.1	-43	-176.8	-165.4	0	0	0	0	112.5	M221 I225 G226 Q227 A231 Q232 A233 G258	M221-C229 VanDerWaalsContact CE-SG 3.51Å; I225-C229 HydrophobicContact CB-CB 4.46Å; I225-C229 HydrophobicContact CG2-CB 3.69Å; G226-C229 WeakPolarHBondContact O-CB 3.47Å; G226-C229 PolarHBondContact O-N 3.06Å; Q227-C229 PolarHBondContact O-N 2.91Å; Q227-C229 VanDerWaalsContact O-N 3.15Å; C229-A231 PolarHBondContact O-N 2.94Å; C229-Q232 PolarHBondContact O-N 3.35Å; C229-A233 VanDerWaalsContact O-CB 3.27Å; C229-A233 WeakPolarHBondContact O-CB 3.29Å; C229-A233 PolarHBondContact O-N 3.32Å; C229-G258 PolarHBondContact SG-O 3.16Å
230	E	83.9	Confident	85.4	Confident	57 Å²	57	38.2 Å²	38.2	27%	0.266	21%	0.209	S	C	.	.	H	α-helix	trans	-57.8	-51.9	-178.5	-171.9	-169.1	-177.7	0	0	111	N45 A228 Q232 A233 K234 A265	N45-E230 PolarHBondContact ND2-OE2 3.27Å; A228-E230 PolarHBondContact O-N 3.43Å; E230-Q232 VanDerWaalsContact C-N 3.29Å; E230-Q232 PolarHBondContact O-N 3.49Å; E230-A233 PolarHBondContact O-N 3.01Å; E230-K234 VanDerWaalsContact O-CB 3.23Å; E230-K234 WeakPolarHBondContact O-CB 3.48Å; E230-K234 PolarHBondContact O-N 3.11Å; E230-A265 HydrophobicContact CG-CB 3.99Å
231	A	85.3	Confident	85.1	Confident	47 Å²	47	46.1 Å²	46.1	39%	0.388	25%	0.246	S	C	.	.	H	α-helix	trans	-67.3	-29.3	-178	0	0	0	0	0	112.9	A228 C229 A235	A228-A231 PolarHBondContact O-N 3.22Å; C229-A231 PolarHBondContact O-N 2.94Å; A231-A235 WeakPolarHBondContact O-CB 3.48Å; A231-A235 PolarHBondContact O-N 3.39Å
232	Q	85.6	Confident	85.1	Confident	13 Å²	13	46.2 Å²	46.2	6%	0.061	25%	0.246	C	C	.	.	H	α-helix	trans	-75.5	-51.7	176	-71.5	163.3	-7.9	0	0	110.8	L109 K196 A228 C229 E230 K234 A235 F236	L109-Q232 HydrophobicContact CD1-CG 4.24Å; L109-Q232 HydrophobicContact CD2-CG 4.42Å; K196-Q232 HydrophobicContact CD-CG 3.86Å; K196-Q232 HydrophobicContact CG-CG 4.37Å; A228-Q232 WeakPolarHBondContact O-CG 3.49Å; A228-Q232 PolarHBondContact O-N 2.87Å; C229-Q232 PolarHBondContact O-N 3.35Å; E230-Q232 VanDerWaalsContact C-N 3.29Å; E230-Q232 PolarHBondContact O-N 3.49Å; Q232-K234 VanDerWaalsContact C-N 3.26Å; Q232-K234 PolarHBondContact O-N 3.39Å; Q232-A235 PolarHBondContact O-N 2.88Å; Q232-A235 VanDerWaalsContact O-N 3.09Å; Q232-F236 VanDerWaalsContact O-CD2 3.29Å; Q232-F236 WeakPolarHBondContact O-CD2 3.33Å; Q232-F236 PolarHBondContact O-N 3.34Å
233	A	87.2	Confident	85.2	Confident	0 Å²	0	47.4 Å²	47.4	0%	0	26%	0.258	C	S	.	.	H	α-helix	trans	-59.2	-40.2	-179.8	0	0	0	0	0	111.2	Y219 C229 E230 F236 H237 A262 A265 T266	Y219-A233 HydrophobicContact CD1-CB 4.37Å; Y219-A233 HydrophobicContact CE1-CB 3.75Å; C229-A233 VanDerWaalsContact O-CB 3.27Å; C229-A233 WeakPolarHBondContact O-CB 3.29Å; C229-A233 PolarHBondContact O-N 3.32Å; E230-A233 PolarHBondContact O-N 3.01Å; A233-F236 PolarHBondContact O-N 3.29Å; A233-H237 WeakPolarHBondContact O-CB 3.35Å; A233-H237 PolarHBondContact O-N 3.41Å; A233-A262 HydrophobicContact CB-CB 4.09Å; A233-A265 HydrophobicContact CB-CB 4.17Å; A233-T266 HydrophobicContact CB-CG2 3.71Å
234	K	88.7	Confident	85.6	Confident	108 Å²	108	47.3 Å²	47.3	47%	0.47	26%	0.258	S	S	.	.	H	α-helix	trans	-60.7	-47.6	172.7	-176.5	169	174	171.3	0	112.7	E230 Q232 F236 H237 E238 A265	E230-K234 VanDerWaalsContact O-CB 3.23Å; E230-K234 WeakPolarHBondContact O-CB 3.48Å; E230-K234 PolarHBondContact O-N 3.11Å; Q232-K234 VanDerWaalsContact C-N 3.26Å; Q232-K234 PolarHBondContact O-N 3.39Å; K234-F236 VanDerWaalsContact C-N 3.34Å; K234-F236 PolarHBondContact O-N 2.92Å; K234-H237 PolarHBondContact O-N 2.84Å; K234-E238 WeakPolarHBondContact CE-OE1 3.35Å; K234-E238 HydrophobicContact CG-CG 4.33Å; K234-E238 IonicContact NZ-OE1 3.7Å; K234-E238 WeakPolarHBondContact O-CB 3.28Å; K234-E238 WeakPolarHBondContact O-CG 3.47Å; K234-E238 PolarHBondContact O-N 3.44Å; K234-A265 HydrophobicContact CB-CB 4.31Å
235	A	88.3	Confident	86.2	Confident	21 Å²	21	43.9 Å²	43.9	17%	0.174	23%	0.234	C	C	.	.	H	α-helix	trans	-62.5	-39	179.6	0	0	0	0	0	112.8	F202 A231 Q232 K239	F202-A235 HydrophobicContact CZ-CB 4.1Å; A231-A235 WeakPolarHBondContact O-CB 3.48Å; A231-A235 PolarHBondContact O-N 3.39Å; Q232-A235 PolarHBondContact O-N 2.88Å; Q232-A235 VanDerWaalsContact O-N 3.09Å; A235-K239 WeakPolarHBondContact O-CG 3.44Å; A235-K239 PolarHBondContact O-N 2.97Å
236	F	88.5	Confident	86.8	Confident	1 Å²	1	42.5 Å²	42.5	0%	0.004	23%	0.227	C	C	.	.	H	α-helix	trans	-64.2	-46.6	173	-82.4	-82.6	0	0	0	111.7	V107 L109 F202 M205 Y219 Q232 A233 K234 E238 K239 V240 V242	V107-F236 HydrophobicContact CB-CD1 4.14Å; V107-F236 HydrophobicContact CB-CE1 4.24Å; V107-F236 HydrophobicContact CG2-CD1 4.19Å; L109-F236 HydrophobicContact CD2-CE2 4Å; L109-F236 HydrophobicContact CD2-CZ 4.45Å; L109-F236 HydrophobicContact CG-CE2 4.46Å; F202-F236 AromaticContact CE1-CD1 3.83Å; F202-F236 HydrophobicContact CE1-CD1 3.83Å; F202-F236 HydrophobicContact CE1-CD2 4.42Å; F202-F236 HydrophobicContact CE1-CE1 4.05Å; F202-F236 HydrophobicContact CE1-CG 4.03Å; F202-F236 HydrophobicContact CE1-CZ 4.4Å; F202-F236 HydrophobicContact CZ-CE2 4.45Å; F202-F236 HydrophobicContact CZ-CZ 4.47Å; M205-F236 HydrophobicContact CE-CD1 3.85Å; M205-F236 HydrophobicContact CE-CE1 3.53Å; M205-F236 HydrophobicContact SD-CD1 4.33Å; M205-F236 HydrophobicContact SD-CE1 3.74Å; Y219-F236 HydrophobicContact CD2-CB 4.32Å; Y219-F236 HydrophobicContact CD2-CD2 4.14Å; Y219-F236 HydrophobicContact CD2-CG 4.13Å; Y219-F236 HydrophobicContact CE2-CB 4.45Å; Y219-F236 AromaticContact CE2-CD2 3.55Å; Y219-F236 HydrophobicContact CE2-CD2 3.55Å; Y219-F236 AromaticContact CE2-CE2 3.94Å; Y219-F236 HydrophobicContact CE2-CE2 3.94Å; Y219-F236 HydrophobicContact CE2-CG 4.01Å; Q232-F236 VanDerWaalsContact O-CD2 3.29Å; Q232-F236 WeakPolarHBondContact O-CD2 3.33Å; Q232-F236 PolarHBondContact O-N 3.34Å; A233-F236 PolarHBondContact O-N 3.29Å; K234-F236 VanDerWaalsContact C-N 3.34Å; K234-F236 PolarHBondContact O-N 2.92Å; F236-E238 VanDerWaalsContact C-N 3.35Å; F236-E238 PolarHBondContact O-N 3.28Å; F236-K239 PolarHBondContact O-N 3.27Å; F236-V240 PolarHBondContact O-N 3.42Å; F236-V242 HydrophobicContact CB-CG2 4.29Å
237	H	88.7	Confident	87.6	Confident	64 Å²	64	42 Å²	42	30%	0.296	22%	0.22	S	C	.	.	H	α-helix	trans	-66.4	-32.8	-178.8	-172.2	72.8	0	0	0	113.4	A233 K234 K239 V240 V242 T266	A233-H237 WeakPolarHBondContact O-CB 3.35Å; A233-H237 PolarHBondContact O-N 3.41Å; K234-H237 PolarHBondContact O-N 2.84Å; H237-K239 VanDerWaalsContact C-N 3.31Å; H237-K239 PolarHBondContact O-N 2.85Å; H237-V240 CarbonylContact C-O 3.42Å; H237-V240 VanDerWaalsContact CA-O 3.31Å; H237-V240 WeakPolarHBondContact CA-O 3.46Å; H237-V242 HydrophobicContact CB-CB 4.49Å; H237-V242 PolarHBondContact ND1-O 3.05Å; H237-T266 HydrophobicContact CB-CG2 4.15Å; H237-T266 PolarHBondContact CE1-O 3.28Å
238	E	88.9	Confident	88.4	Confident	131 Å²	131	39 Å²	39	61%	0.612	21%	0.207	S	C	*	.	H	α-helix	trans	-69.5	-27.1	175.3	-76.4	176.2	175.5	0	0	113.2	K234 F236	K234-E238 WeakPolarHBondContact CE-OE1 3.35Å; K234-E238 HydrophobicContact CG-CG 4.33Å; K234-E238 IonicContact NZ-OE1 3.7Å; K234-E238 WeakPolarHBondContact O-CB 3.28Å; K234-E238 WeakPolarHBondContact O-CG 3.47Å; K234-E238 PolarHBondContact O-N 3.44Å; F236-E238 VanDerWaalsContact C-N 3.35Å; F236-E238 PolarHBondContact O-N 3.28Å
239	K	87.1	Confident	88.6	Confident	105 Å²	105	40.7 Å²	40.7	46%	0.457	21%	0.205	S	C	.	.	H	α-helix	trans	-97.9	-37.5	-176.8	-67.5	-69.8	-174.5	173.1	0	112.9	F202 A235 F236 H237	F202-K239 HydrophobicContact CB-CB 4.33Å; F202-K239 HydrophobicContact CB-CD 4.2Å; F202-K239 HydrophobicContact CB-CG 3.98Å; F202-K239 HydrophobicContact CD1-CB 3.63Å; F202-K239 HydrophobicContact CD1-CG 3.61Å; F202-K239 HydrophobicContact CE1-CB 4.33Å; F202-K239 HydrophobicContact CE1-CG 4.26Å; F202-K239 HydrophobicContact CG-CB 4.28Å; F202-K239 HydrophobicContact CG-CG 3.87Å; A235-K239 WeakPolarHBondContact O-CG 3.44Å; A235-K239 PolarHBondContact O-N 2.97Å; F236-K239 PolarHBondContact O-N 3.27Å; H237-K239 VanDerWaalsContact C-N 3.31Å; H237-K239 PolarHBondContact O-N 2.85Å
240	V	86.6	Confident	88.5	Confident	4 Å²	4	41.4 Å²	41.4	2%	0.024	21%	0.208	C	C	.	.	S	Bend	trans	-133.8	132.2	178.4	-177.3	0	0	0	0	107.4	M105 M205 V217 F236 H237 V242	M105-V240 HydrophobicContact CE-CG1 3.71Å; M205-V240 HydrophobicContact CB-CG2 4.4Å; V217-V240 HydrophobicContact CB-CG1 4.21Å; V217-V240 HydrophobicContact CG1-CG1 3.79Å; V217-V240 HydrophobicContact CG2-CG1 3.78Å; F236-V240 PolarHBondContact O-N 3.42Å; H237-V240 CarbonylContact C-O 3.42Å; H237-V240 VanDerWaalsContact CA-O 3.31Å; H237-V240 WeakPolarHBondContact CA-O 3.46Å; V240-V242 VanDerWaalsContact C-N 3.29Å; V240-V242 PolarHBondContact O-N 3.15Å
241	E	88.2	Confident	88.2	Confident	165 Å²	165	42 Å²	42	77%	0.771	21%	0.213	S	C	*	.			trans	-67.3	86.3	-179.4	-168.9	178.1	175.6	0	0	111	V217 A243	V217-E241 WeakPolarHBondContact CB-O 3.27Å; E241-A243 PolarHBondContact O-N 2.89Å
242	V	90.7	Very high	87.4	Confident	2 Å²	2	41 Å²	41	1%	0.012	21%	0.208	C	C	.	.			trans	-66.1	123.4	173.8	174.8	0	0	0	0	108	V107 V217 F236 H237 V240 S268	V107-V242 HydrophobicContact CG2-CG2 4.27Å; V217-V242 HydrophobicContact CG1-CG2 4.39Å; F236-V242 HydrophobicContact CB-CG2 4.29Å; H237-V242 HydrophobicContact CB-CB 4.49Å; H237-V242 PolarHBondContact ND1-O 3.05Å; V240-V242 VanDerWaalsContact C-N 3.29Å; V240-V242 PolarHBondContact O-N 3.15Å; V242-S268 PolarHBondContact O-OG 2.76Å
243	A	91.4	Very high	86.4	Confident	40 Å²	40	48.2 Å²	48.2	33%	0.331	24%	0.241	S	C	.	.			trans	-107	-15.7	-178.7	0	0	0	0	0	113	V217 E241	V217-A243 PolarHBondContact O-N 3.41Å; E241-A243 PolarHBondContact O-N 2.89Å
244	S	93.1	Very high	85.2	Confident	0 Å²	0	48.6 Å²	48.6	0%	0	25%	0.245	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-155.4	153.2	-176.6	-72.7	0	0	0	0	111.9	V217 I218 Y219	V217-S244 PolarHBondContact O-N 3.45Å; I218-S244 CarbonylContact C-O 3.47Å; I218-S244 WeakPolarHBondContact CA-O 3.44Å; Y219-S244 PolarHBondContact N-O 3.37Å
245	V	92.6	Very high	84	Confident	0 Å²	0	48.7 Å²	48.7	0%	0	24%	0.242	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	140.2	180	-178.6	0	0	0	0	110.6	Y219 M221 V247 P269 I270 I271	Y219-V245 HydrophobicContact CD1-CG1 4.3Å; Y219-V245 HydrophobicContact CD1-CG2 4.41Å; Y219-V245 CarbonylContact O-C 3.52Å; Y219-V245 WeakPolarHBondContact O-CA 3.43Å; M221-V245 HydrophobicContact CG-CG1 3.97Å; M221-V245 HydrophobicContact SD-CG1 4.08Å; V245-V247 HydrophobicContact CG1-CG2 4.41Å; V245-P269 PolarHBondContact N-O 3.43Å; V245-I270 HydrophobicContact CB-CG1 4.13Å; V245-I270 HydrophobicContact CG1-CG1 4.29Å; V245-I270 VanDerWaalsContact O-CA 3.29Å; V245-I270 WeakPolarHBondContact O-CA 3.07Å; V245-I271 WeakPolarHBondContact O-CG1 3.25Å; V245-I271 PolarHBondContact O-N 3.19Å
246	I	93.5	Very high	83	Confident	0 Å²	0	48 Å²	48	0%	0	24%	0.237	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-119.4	132	167.6	-64.4	178.1	0	0	0	109.2	F106 T117 I218 Y219 V220 M221 T248 I271 F272 F282	F106-I246 HydrophobicContact CE1-CD1 4.07Å; F106-I246 HydrophobicContact CZ-CD1 4.17Å; T117-I246 HydrophobicContact CG2-CB 4.36Å; T117-I246 HydrophobicContact CG2-CD1 3.73Å; T117-I246 HydrophobicContact CG2-CG2 3.66Å; I218-I246 HydrophobicContact CD1-CD1 4.36Å; I218-I246 HydrophobicContact CG2-CB 4.24Å; I218-I246 HydrophobicContact CG2-CD1 3.6Å; I218-I246 HydrophobicContact CG2-CG1 3.59Å; Y219-I246 PolarHBondContact O-N 2.89Å; V220-I246 WeakPolarHBondContact CA-O 3.4Å; M221-I246 PolarHBondContact N-O 3.25Å; I246-T248 HydrophobicContact CG2-CG2 4.32Å; I246-I271 HydrophobicContact CD1-CD1 4.21Å; I246-I271 HydrophobicContact CD1-CG1 4.42Å; I246-I271 HydrophobicContact CG1-CD1 4.05Å; I246-I271 HydrophobicContact CG1-CG1 3.78Å; I246-F272 HydrophobicContact CD1-CB 4.26Å; I246-F272 HydrophobicContact CD1-CD2 4.47Å; I246-F272 HydrophobicContact CG1-CB 4.09Å; I246-F272 HydrophobicContact CG2-CB 4.32Å; I246-F282 HydrophobicContact CD1-CE2 4.41Å; I246-F282 HydrophobicContact CD1-CZ 4.02Å; I246-F282 HydrophobicContact CG2-CE2 4.08Å
247	V	90.8	Very high	82	Confident	2 Å²	2	48 Å²	48	1%	0.012	24%	0.238	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-105.6	119.3	178.9	-174.4	0	0	0	0	109.6	M221 A223 V245 L250 A259 I270 F272 I273 G274	M221-V247 HydrophobicContact CG-CB 4.42Å; M221-V247 HydrophobicContact CG-CG2 4Å; M221-V247 WeakPolarHBondContact O-CA 3.49Å; M221-V247 HydrophobicContact SD-CG2 4.1Å; A223-V247 HydrophobicContact CB-CG1 3.79Å; V245-V247 HydrophobicContact CG1-CG2 4.41Å; V247-L250 HydrophobicContact CG1-CD1 4.39Å; V247-L250 HydrophobicContact CG1-CD2 3.96Å; V247-L250 HydrophobicContact CG1-CG 4.11Å; V247-A259 HydrophobicContact CG1-CB 4.26Å; V247-A259 HydrophobicContact CG2-CB 3.68Å; V247-I270 HydrophobicContact CG2-CD1 4.03Å; V247-I270 HydrophobicContact CG2-CG1 4.32Å; V247-I270 HydrophobicContact CG2-CG2 4.02Å; V247-F272 PolarHBondContact N-O 3.37Å; V247-I273 HydrophobicContact CB-CG2 4.31Å; V247-I273 CarbonylContact O-C 3.57Å; V247-I273 VanDerWaalsContact O-CA 3.29Å; V247-I273 WeakPolarHBondContact O-CA 3.32Å; V247-G274 PolarHBondContact O-N 2.89Å
248	T	91.3	Very high	81.4	Confident	7 Å²	7	45 Å²	45	4%	0.043	22%	0.224	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-103.7	169.2	-178.3	68.6	0	0	0	0	111.9	C112 T117 V220 M221 A223 I246 L250	C112-T248 PolarHBondContact O-OG1 3.18Å; T117-T248 WeakPolarHBondContact OG1-CG2 3.35Å; V220-T248 HydrophobicContact CG1-CG2 3.51Å; M221-T248 PolarHBondContact O-N 3.47Å; M221-T248 PolarHBondContact O-OG1 2.94Å; A223-T248 WeakPolarHBondContact CB-O 3.15Å; A223-T248 PolarHBondContact N-O 2.77Å; I246-T248 HydrophobicContact CG2-CG2 4.32Å; T248-L250 VanDerWaalsContact C-N 3.31Å; T248-L250 PolarHBondContact O-N 3.24Å
249	K	87.1	Confident	81	Confident	88 Å²	88	39 Å²	39	38%	0.383	20%	0.197	S	C	.	.			trans	60.1	34.1	175.1	-50.6	-172.4	-163.5	165.1	0	114.3	G111 D222 D251 G252 A254 G274	G111-K249 PolarHBondContact O-NZ 3.16Å; D222-K249 VanDerWaalsContact OD2-CD 3.3Å; D222-K249 WeakPolarHBondContact OD2-CD 3.49Å; D222-K249 VanDerWaalsContact OD2-CE 3.26Å; D222-K249 WeakPolarHBondContact OD2-CE 3.38Å; D222-K249 IonicContact OD2-NZ 3.95Å; D222-K249 PolarHBondContact OD2-NZ 2.86Å; K249-D251 VanDerWaalsContact C-OD1 3.31Å; K249-D251 VanDerWaalsContact CA-OD1 3.32Å; K249-D251 WeakPolarHBondContact CA-OD1 3.47Å; K249-D251 PolarHBondContact O-N 3.21Å; K249-G252 PolarHBondContact O-N 2.97Å; K249-A254 WeakPolarHBondContact O-CB 3.34Å; K249-G274 PolarHBondContact N-O 3.28Å
250	L	81	Confident	80.5	Confident	14 Å²	14	34.8 Å²	34.8	7%	0.073	18%	0.179	C	C	.	.	T	Hydrogen-bonded Turn	trans	-74.2	-11.8	176.6	-73.5	-175.8	0	0	0	113.9	L3 A223 V247 T248 G252 I273 G274	L3-L250 HydrophobicContact CD1-CD2 4.14Å; A223-L250 HydrophobicContact CB-CD2 3.45Å; A223-L250 VanDerWaalsContact CB-CD2 3.45Å; A223-L250 HydrophobicContact CB-CG 4.25Å; V247-L250 HydrophobicContact CG1-CD1 4.39Å; V247-L250 HydrophobicContact CG1-CD2 3.96Å; V247-L250 HydrophobicContact CG1-CG 4.11Å; T248-L250 VanDerWaalsContact C-N 3.31Å; T248-L250 PolarHBondContact O-N 3.24Å; L250-G252 VanDerWaalsContact C-N 3.31Å; L250-I273 HydrophobicContact CD1-CB 3.64Å; L250-I273 HydrophobicContact CD1-CD1 4.12Å; L250-I273 HydrophobicContact CD1-CG1 4.47Å; L250-I273 HydrophobicContact CD1-CG2 3.49Å; L250-I273 VanDerWaalsContact CD1-CG2 3.49Å; L250-G274 PolarHBondContact N-O 3.09Å
251	D	77	Confident	80.1	Confident	69 Å²	69	34.7 Å²	34.7	37%	0.369	18%	0.178	S	C	.	.	T	Hydrogen-bonded Turn	trans	-71.2	-24.8	170.8	53.8	-51.7	0	0	0	113.7	K249 T275 G276	K249-D251 VanDerWaalsContact C-OD1 3.31Å; K249-D251 VanDerWaalsContact CA-OD1 3.32Å; K249-D251 WeakPolarHBondContact CA-OD1 3.47Å; K249-D251 PolarHBondContact O-N 3.21Å; D251-T275 WeakPolarHBondContact CB-O 3.07Å; D251-G276 PolarHBondContact OD1-N 3.44Å
252	G	69.9	Low	79.8	Confident	27 Å²	27	26.8 Å²	26.8	28%	0.278	14%	0.142	S	C	.	.	S	Bend	trans	-76.2	-165.9	-175.9	0	0	0	0	0	115	K249 L250 A254	K249-G252 PolarHBondContact O-N 2.97Å; L250-G252 VanDerWaalsContact C-N 3.31Å; G252-A254 PolarHBondContact O-N 2.86Å; G252-A254 VanDerWaalsContact O-N 3.17Å
253	H	63.5	Low	79.5	Confident	164 Å²	164	26.9 Å²	26.9	76%	0.759	14%	0.142	S	C	*	.	S	Bend	trans	-80.8	25	168.8	-66.3	-82.5	0	0	0	112.4	V2	V2-H253 WeakPolarHBondContact CB-O 3.37Å; V2-H253 VanDerWaalsContact CG2-C 3.48Å; V2-H253 HydrophobicContact CG2-CB 3.81Å; V2-H253 WeakPolarHBondContact CG2-O 3.45Å
254	A	62	Low	78.9	Confident	9 Å²	9	26.6 Å²	26.6	7%	0.074	14%	0.14	C	C	.	.			trans	-72.6	134.3	-178.1	0	0	0	0	0	111.2	V2 A223 K249 G252 G256	V2-A254 WeakPolarHBondContact CB-O 3.25Å; A223-A254 HydrophobicContact CB-CB 3.48Å; A223-A254 VanDerWaalsContact CB-CB 3.48Å; K249-A254 WeakPolarHBondContact O-CB 3.34Å; G252-A254 PolarHBondContact O-N 2.86Å; G252-A254 VanDerWaalsContact O-N 3.17Å; A254-G256 VanDerWaalsContact C-N 3.33Å
255	R	63.1	Low	78.5	Confident	109 Å²	109	27.4 Å²	27.4	41%	0.411	15%	0.146	S	C	.	.			trans	-75.4	-21.9	-177.3	-72.8	164.7	176.2	-167.5	-4.7	113.2	V2 E41 A42 D43 G257	V2-R255 HydrophobicContact CB-CG 4.47Å; V2-R255 HydrophobicContact CG1-CB 4.13Å; V2-R255 HydrophobicContact CG1-CG 3.45Å; V2-R255 VanDerWaalsContact CG1-CG 3.45Å; E41-R255 VanDerWaalsContact O-CD 3.25Å; E41-R255 WeakPolarHBondContact O-CD 3.42Å; E41-R255 PolarHBondContact O-NE 2.91Å; E41-R255 VanDerWaalsContact O-NE 3.14Å; E41-R255 PolarHBondContact O-NH1 3.47Å; A42-R255 HydrophobicContact CB-CB 4.16Å; A42-R255 VanDerWaalsContact O-CB 3.27Å; A42-R255 WeakPolarHBondContact O-CB 3.28Å; D43-R255 IonicContact OD1-NH1 2.74Å; D43-R255 WeakPolarHBondContact OD2-CD 3.28Å; D43-R255 IonicContact OD2-CZ 2.62Å; D43-R255 IonicContact OD2-NE 3.83Å; D43-R255 IonicContact OD2-NH1 3.86Å; D43-R255 PolarHBondContact OD2-NH1 3.49Å; R255-G257 PolarHBondContact O-N 3.47Å
256	G	67.3	Low	78.1	Confident	6 Å²	6	27.4 Å²	27.4	6%	0.062	15%	0.147	C	C	.	.			trans	71.3	-7.8	176.3	0	0	0	0	0	115	A223 A254 G258 A259	A223-G256 PolarHBondContact O-N 3.05Å; A254-G256 VanDerWaalsContact C-N 3.33Å; G256-G258 PolarHBondContact O-N 2.9Å; G256-A259 WeakPolarHBondContact O-CB 3.5Å; G256-A259 PolarHBondContact O-N 3.21Å; G256-A259 VanDerWaalsContact O-N 3.07Å
257	G	69.2	Low	77.8	Confident	2 Å²	2	33.5 Å²	33.5	2%	0.021	18%	0.175	C	C	.	.	H	α-helix	trans	-65.4	-22	-179.7	0	0	0	0	0	114.6	A42 R255 A259 L260 S261	A42-G257 WeakPolarHBondContact O-CA 3.48Å; A42-G257 PolarHBondContact O-N 2.95Å; R255-G257 PolarHBondContact O-N 3.47Å; G257-A259 VanDerWaalsContact C-N 3.26Å; G257-A259 PolarHBondContact O-N 3.25Å; G257-L260 PolarHBondContact O-N 3.46Å; G257-S261 PolarHBondContact O-N 2.81Å; G257-S261 PolarHBondContact O-OG 2.92Å
258	G	75.7	Confident	77.8	Confident	1 Å²	1	33.8 Å²	33.8	1%	0.01	18%	0.176	C	C	.	.	H	α-helix	trans	-59.5	-36	170.4	0	0	0	0	0	113	I225 C229 G256 L260 S261 A262	I225-G258 WeakPolarHBondContact O-CA 3.44Å; C229-G258 PolarHBondContact SG-O 3.16Å; G256-G258 PolarHBondContact O-N 2.9Å; G258-L260 VanDerWaalsContact C-N 3.33Å; G258-L260 PolarHBondContact O-N 2.96Å; G258-S261 CarbonylContact O-C 3.52Å; G258-S261 WeakPolarHBondContact O-CA 3.48Å; G258-S261 WeakPolarHBondContact O-CB 3.42Å; G258-S261 PolarHBondContact O-N 2.95Å; G258-A262 PolarHBondContact O-N 2.92Å
259	A	79	Confident	77.8	Confident	5 Å²	5	33.7 Å²	33.7	4%	0.041	18%	0.176	C	C	.	.	H	α-helix	trans	-62.7	-41.3	-177.2	0	0	0	0	0	112.1	M221 V247 G256 G257 S261 A262 V263 I270	M221-A259 HydrophobicContact CE-CB 4.28Å; M221-A259 HydrophobicContact SD-CB 4.28Å; V247-A259 HydrophobicContact CG1-CB 4.26Å; V247-A259 HydrophobicContact CG2-CB 3.68Å; G256-A259 WeakPolarHBondContact O-CB 3.5Å; G256-A259 PolarHBondContact O-N 3.21Å; G256-A259 VanDerWaalsContact O-N 3.07Å; G257-A259 VanDerWaalsContact C-N 3.26Å; G257-A259 PolarHBondContact O-N 3.25Å; A259-S261 VanDerWaalsContact C-N 3.26Å; A259-S261 PolarHBondContact O-N 3.22Å; A259-A262 PolarHBondContact O-N 3.41Å; A259-V263 WeakPolarHBondContact O-CG2 3.49Å; A259-V263 PolarHBondContact O-N 2.97Å; A259-I270 HydrophobicContact CB-CD1 4.07Å
260	L	76.8	Confident	78	Confident	17 Å²	17	29.8 Å²	29.8	9%	0.089	16%	0.16	C	C	.	.	H	α-helix	trans	-59.7	-41.1	173.2	-61.9	177.2	0	0	0	111.3	V44 L86 V87 G257 G258 A264	V44-L260 HydrophobicContact CG1-CD1 3.95Å; V44-L260 HydrophobicContact CG2-CD1 3.84Å; L86-L260 HydrophobicContact CB-CD2 4.48Å; V87-L260 HydrophobicContact CB-CD2 4.12Å; V87-L260 HydrophobicContact CG2-CD2 3.16Å; G257-L260 PolarHBondContact O-N 3.46Å; G258-L260 VanDerWaalsContact C-N 3.33Å; G258-L260 PolarHBondContact O-N 2.96Å; L260-A264 WeakPolarHBondContact O-CB 3.47Å; L260-A264 PolarHBondContact O-N 2.76Å
261	S	79.3	Confident	78.5	Confident	1 Å²	1	29.4 Å²	29.4	1%	0.007	16%	0.158	C	C	.	.	H	α-helix	trans	-70.4	-34.5	-179.7	-51.5	0	0	0	0	112	G257 G258 A259 A265	G257-S261 PolarHBondContact O-N 2.81Å; G257-S261 PolarHBondContact O-OG 2.92Å; G258-S261 CarbonylContact O-C 3.52Å; G258-S261 WeakPolarHBondContact O-CA 3.48Å; G258-S261 WeakPolarHBondContact O-CB 3.42Å; G258-S261 PolarHBondContact O-N 2.95Å; A259-S261 VanDerWaalsContact C-N 3.26Å; A259-S261 PolarHBondContact O-N 3.22Å; S261-A265 VanDerWaalsContact O-CB 3.31Å; S261-A265 WeakPolarHBondContact O-CB 3.45Å; S261-A265 PolarHBondContact O-N 3.22Å; S261-A265 VanDerWaalsContact O-N 3.08Å
262	A	82	Confident	79.3	Confident	0 Å²	0	26.6 Å²	26.6	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-68.6	-44.4	175.1	0	0	0	0	0	112.1	Y219 M221 A233 G258 A259 A264 A265 T266	Y219-A262 HydrophobicContact CE1-CB 4.46Å; M221-A262 HydrophobicContact SD-CB 3.43Å; M221-A262 WeakPolarHBondContact SD-CB 3.45Å; A233-A262 HydrophobicContact CB-CB 4.09Å; G258-A262 PolarHBondContact O-N 2.92Å; A259-A262 PolarHBondContact O-N 3.41Å; A262-A264 VanDerWaalsContact C-N 3.33Å; A262-A264 PolarHBondContact O-N 3.24Å; A262-A265 PolarHBondContact O-N 3.03Å; A262-T266 WeakPolarHBondContact O-CB 3.47Å; A262-T266 WeakPolarHBondContact O-CG2 3.44Å; A262-T266 PolarHBondContact O-N 3.41Å; A262-T266 PolarHBondContact O-OG1 2.92Å
263	V	83.4	Confident	80.3	Confident	4 Å²	4	26.2 Å²	26.2	2%	0.024	13%	0.133	C	C	.	.	H	α-helix	trans	-61.6	-44.7	176	174.5	0	0	0	0	110.5	P89 A259 A265 T266 H267 I270	P89-V263 HydrophobicContact CB-CG1 4.08Å; P89-V263 HydrophobicContact CG-CG1 4.08Å; A259-V263 WeakPolarHBondContact O-CG2 3.49Å; A259-V263 PolarHBondContact O-N 2.97Å; V263-A265 VanDerWaalsContact C-N 3.28Å; V263-A265 PolarHBondContact O-N 3.14Å; V263-T266 PolarHBondContact O-N 3.06Å; V263-H267 WeakPolarHBondContact O-CA 3.27Å; V263-H267 PolarHBondContact O-N 3.28Å; V263-I270 HydrophobicContact CG2-CD1 3.58Å; V263-I270 HydrophobicContact CG2-CG1 3.53Å
264	A	80	Confident	81.5	Confident	34 Å²	34	18.6 Å²	18.6	28%	0.281	10%	0.099	S	C	.	.	H	α-helix	trans	-62.4	-33.9	178	0	0	0	0	0	113.1	L48 L260 A262 H267	L48-A264 HydrophobicContact CD1-CB 3.78Å; L48-A264 HydrophobicContact CD2-CB 3.79Å; L48-A264 HydrophobicContact CG-CB 4.4Å; L260-A264 WeakPolarHBondContact O-CB 3.47Å; L260-A264 PolarHBondContact O-N 2.76Å; A262-A264 VanDerWaalsContact C-N 3.33Å; A262-A264 PolarHBondContact O-N 3.24Å; A264-H267 PolarHBondContact O-CE1 3.17Å
265	A	83.7	Confident	82.6	Confident	16 Å²	16	19.9 Å²	19.9	13%	0.132	11%	0.106	C	C	.	.	H	α-helix	trans	-83.1	-32.9	-178.9	0	0	0	0	0	114.3	E230 A233 K234 S261 A262 V263	E230-A265 HydrophobicContact CG-CB 3.99Å; A233-A265 HydrophobicContact CB-CB 4.17Å; K234-A265 HydrophobicContact CB-CB 4.31Å; S261-A265 VanDerWaalsContact O-CB 3.31Å; S261-A265 WeakPolarHBondContact O-CB 3.45Å; S261-A265 PolarHBondContact O-N 3.22Å; S261-A265 VanDerWaalsContact O-N 3.08Å; A262-A265 PolarHBondContact O-N 3.03Å; V263-A265 VanDerWaalsContact C-N 3.28Å; V263-A265 PolarHBondContact O-N 3.14Å
266	T	85.1	Confident	83.7	Confident	1 Å²	1	15.4 Å²	15.4	1%	0.006	9%	0.093	C	C	.	.	H	α-helix	trans	-101.9	-12.7	-173.9	59.2	0	0	0	0	113.5	A233 H237 A262 V263 S268	A233-T266 HydrophobicContact CB-CG2 3.71Å; H237-T266 HydrophobicContact CB-CG2 4.15Å; H237-T266 PolarHBondContact CE1-O 3.28Å; A262-T266 WeakPolarHBondContact O-CB 3.47Å; A262-T266 WeakPolarHBondContact O-CG2 3.44Å; A262-T266 PolarHBondContact O-N 3.41Å; A262-T266 PolarHBondContact O-OG1 2.92Å; V263-T266 PolarHBondContact O-N 3.06Å; T266-S268 PolarHBondContact O-N 3.43Å; T266-S268 PolarHBondContact O-OG 3.03Å; T266-S268 VanDerWaalsContact O-OG 3.05Å; T266-S268 WeakPolarHBondContact OG1-CB 3.45Å; T266-S268 PolarHBondContact OG1-N 3.14Å
267	H	87	Confident	84.7	Confident	128 Å²	128	23.3 Å²	23.3	59%	0.593	13%	0.129	S	C	*	.			trans	50.4	22	-169.7	-58.5	-63.4	0	0	0	113.9	P89 V263 A264	P89-H267 WeakPolarHBondContact CB-O 3.49Å; V263-H267 WeakPolarHBondContact O-CA 3.27Å; V263-H267 PolarHBondContact O-N 3.28Å; A264-H267 PolarHBondContact O-CE1 3.17Å
268	S	89.6	Confident	85.6	Confident	7 Å²	7	29.8 Å²	29.8	5%	0.049	16%	0.158	C	C	.	.			trans	-106.2	139.9	-173.8	-67.5	0	0	0	0	111	V242 T266	V242-S268 PolarHBondContact O-OG 2.76Å; T266-S268 PolarHBondContact O-N 3.43Å; T266-S268 PolarHBondContact O-OG 3.03Å; T266-S268 VanDerWaalsContact O-OG 3.05Å; T266-S268 WeakPolarHBondContact OG1-CB 3.45Å; T266-S268 PolarHBondContact OG1-N 3.14Å
269	P	91.8	Very high	86.2	Confident	6 Å²	6	32 Å²	32	4%	0.039	17%	0.17	C	C	.	.			trans	-72.3	144.7	-178.3	29.7	-34.1	0	0	0	111.1	P89 V91 Q93 V245	P89-P269 HydrophobicContact CG-CB 3.98Å; V91-P269 HydrophobicContact CG1-CG 4.5Å; Q93-P269 HydrophobicContact CG-CB 4.03Å; Q93-P269 HydrophobicContact CG-CG 4.18Å; V245-P269 PolarHBondContact N-O 3.43Å
270	I	91.1	Very high	86.6	Confident	6 Å²	6	36.1 Å²	36.1	3%	0.031	19%	0.19	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	126	165.8	-57.6	165.3	0	0	0	107.6	Q93 V245 V247 A259 V263 F285	Q93-I270 PolarHBondContact NE2-O 3.49Å; Q93-I270 VanDerWaalsContact NE2-O 3.11Å; V245-I270 HydrophobicContact CB-CG1 4.13Å; V245-I270 HydrophobicContact CG1-CG1 4.29Å; V245-I270 VanDerWaalsContact O-CA 3.29Å; V245-I270 WeakPolarHBondContact O-CA 3.07Å; V247-I270 HydrophobicContact CG2-CD1 4.03Å; V247-I270 HydrophobicContact CG2-CG1 4.32Å; V247-I270 HydrophobicContact CG2-CG2 4.02Å; A259-I270 HydrophobicContact CB-CD1 4.07Å; V263-I270 HydrophobicContact CG2-CD1 3.58Å; V263-I270 HydrophobicContact CG2-CG1 3.53Å; I270-F285 HydrophobicContact CB-CB 4.39Å; I270-F285 HydrophobicContact CB-CD1 3.52Å; I270-F285 HydrophobicContact CB-CE1 3.79Å; I270-F285 HydrophobicContact CB-CG 3.94Å; I270-F285 HydrophobicContact CB-CZ 4.42Å; I270-F285 HydrophobicContact CD1-CE1 4.03Å; I270-F285 HydrophobicContact CD1-CZ 4Å; I270-F285 HydrophobicContact CG1-CE1 4.45Å; I270-F285 HydrophobicContact CG2-CB 3.73Å; I270-F285 HydrophobicContact CG2-CD1 3.68Å; I270-F285 HydrophobicContact CG2-CD2 3.97Å; I270-F285 HydrophobicContact CG2-CE1 4.19Å; I270-F285 HydrophobicContact CG2-CE2 4.43Å; I270-F285 HydrophobicContact CG2-CG 3.52Å; I270-F285 WeakPolarHBondContact O-CD1 3.06Å
271	I	92.5	Very high	87.1	Confident	6 Å²	6	37.3 Å²	37.3	3%	0.031	20%	0.197	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-102.4	-35.9	-176.3	52.1	166.5	0	0	0	112.7	Q93 I218 V245 I246 F285	Q93-I271 HydrophobicContact CB-CG2 3.95Å; Q93-I271 HydrophobicContact CG-CG2 3.88Å; I218-I271 HydrophobicContact CD1-CD1 3.71Å; I218-I271 HydrophobicContact CG1-CD1 4.1Å; I218-I271 HydrophobicContact CG2-CD1 4.49Å; V245-I271 WeakPolarHBondContact O-CG1 3.25Å; V245-I271 PolarHBondContact O-N 3.19Å; I246-I271 HydrophobicContact CD1-CD1 4.21Å; I246-I271 HydrophobicContact CD1-CG1 4.42Å; I246-I271 HydrophobicContact CG1-CD1 4.05Å; I246-I271 HydrophobicContact CG1-CG1 3.78Å; I271-F285 PolarHBondContact O-N 3Å
272	F	93.1	Very high	87.7	Confident	10 Å²	10	38 Å²	38	4%	0.044	20%	0.2	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-143.9	160	-178.2	-70.7	-88.9	0	0	0	111.8	L121 Y124 I246 V247 F282 E283 P284	L121-F272 HydrophobicContact CD1-CD2 3.88Å; L121-F272 HydrophobicContact CD1-CE2 3.54Å; L121-F272 HydrophobicContact CD1-CZ 3.99Å; Y124-F272 AromaticContact CD1-CE1 3.87Å; Y124-F272 HydrophobicContact CD1-CE1 3.87Å; Y124-F272 AromaticContact CD1-CZ 3.78Å; Y124-F272 HydrophobicContact CD1-CZ 3.78Å; Y124-F272 HydrophobicContact CD2-CE1 4.24Å; Y124-F272 AromaticContact CE1-CE1 3.61Å; Y124-F272 HydrophobicContact CE1-CE1 3.61Å; Y124-F272 AromaticContact CE1-CZ 3.48Å; Y124-F272 HydrophobicContact CE1-CZ 3.48Å; Y124-F272 VanDerWaalsContact CE1-CZ 3.48Å; Y124-F272 HydrophobicContact CE2-CE1 4.01Å; Y124-F272 HydrophobicContact CG-CE1 4.16Å; Y124-F272 HydrophobicContact CG-CZ 4.49Å; Y124-F272 AromaticContact CZ-CE1 3.67Å; Y124-F272 AromaticContact CZ-CZ 3.97Å; I246-F272 HydrophobicContact CD1-CB 4.26Å; I246-F272 HydrophobicContact CD1-CD2 4.47Å; I246-F272 HydrophobicContact CG1-CB 4.09Å; I246-F272 HydrophobicContact CG2-CB 4.32Å; V247-F272 PolarHBondContact N-O 3.37Å; F272-F282 HydrophobicContact CB-CD2 4.35Å; F272-F282 HydrophobicContact CB-CE1 3.89Å; F272-F282 HydrophobicContact CB-CE2 3.49Å; F272-F282 VanDerWaalsContact CB-CE2 3.49Å; F272-F282 HydrophobicContact CB-CZ 3.22Å; F272-F282 AromaticContact CD1-CD1 3.81Å; F272-F282 HydrophobicContact CD1-CD1 3.81Å; F272-F282 AromaticContact CD1-CE1 3.28Å; F272-F282 HydrophobicContact CD1-CE1 3.28Å; F272-F282 HydrophobicContact CD1-CE2 4.35Å; F272-F282 AromaticContact CD1-CZ 3.61Å; F272-F282 HydrophobicContact CD1-CZ 3.61Å; F272-F282 HydrophobicContact CD2-CE1 4.06Å; F272-F282 AromaticContact CD2-CZ 3.89Å; F272-F282 HydrophobicContact CD2-CZ 3.89Å; F272-F282 HydrophobicContact CE1-CD1 4.25Å; F272-F282 AromaticContact CE1-CE1 3.75Å; F272-F282 HydrophobicContact CE1-CE1 3.75Å; F272-F282 HydrophobicContact CE1-CZ 4.44Å; F272-F282 HydrophobicContact CE2-CE1 4.47Å; F272-F282 HydrophobicContact CG-CD1 4.37Å; F272-F282 AromaticContact CG-CE1 3.48Å; F272-F282 HydrophobicContact CG-CE1 3.48Å; F272-F282 VanDerWaalsContact CG-CE1 3.48Å; F272-F282 HydrophobicContact CG-CE2 4.07Å; F272-F282 AromaticContact CG-CZ 3.31Å; F272-F282 HydrophobicContact CG-CZ 3.31Å; F272-F282 HydrophobicContact CZ-CE1 4.33Å; F272-E283 WeakPolarHBondContact CA-O 3.24Å; F272-P284 HydrophobicContact CD1-CB 4.33Å; F272-P284 HydrophobicContact CE1-CB 4.13Å
273	I	90.3	Very high	88	Confident	19 Å²	19	40.4 Å²	40.4	10%	0.097	21%	0.211	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-126.8	136.7	171.7	52.9	169.9	0	0	0	111.6	V247 L250 T275 E283 F285	V247-I273 HydrophobicContact CB-CG2 4.31Å; V247-I273 CarbonylContact O-C 3.57Å; V247-I273 VanDerWaalsContact O-CA 3.29Å; V247-I273 WeakPolarHBondContact O-CA 3.32Å; L250-I273 HydrophobicContact CD1-CB 3.64Å; L250-I273 HydrophobicContact CD1-CD1 4.12Å; L250-I273 HydrophobicContact CD1-CG1 4.47Å; L250-I273 HydrophobicContact CD1-CG2 3.49Å; L250-I273 VanDerWaalsContact CD1-CG2 3.49Å; I273-T275 HydrophobicContact CD1-CG2 3.96Å; I273-T275 HydrophobicContact CG1-CG2 4.2Å; I273-E283 HydrophobicContact CD1-CB 4.42Å; I273-E283 HydrophobicContact CG1-CB 4.04Å; I273-E283 WeakPolarHBondContact CG1-O 3.4Å; I273-E283 PolarHBondContact N-O 3.22Å; I273-E283 PolarHBondContact O-N 3.37Å; I273-F285 HydrophobicContact CG2-CB 4.25Å; I273-F285 HydrophobicContact CG2-CD2 3.48Å; I273-F285 VanDerWaalsContact CG2-CD2 3.48Å; I273-F285 HydrophobicContact CG2-CE2 4.22Å; I273-F285 HydrophobicContact CG2-CG 4.26Å
274	G	89.8	Confident	88.3	Confident	3 Å²	3	43.1 Å²	43.1	3%	0.031	23%	0.229	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-91.7	114.9	170.1	0	0	0	0	0	110.4	V247 K249 L250	V247-G274 PolarHBondContact O-N 2.89Å; K249-G274 PolarHBondContact N-O 3.28Å; L250-G274 PolarHBondContact N-O 3.09Å
275	T	85.7	Confident	88.6	Confident	37 Å²	37	42 Å²	42	23%	0.227	22%	0.218	C	C	.	.			trans	-107.8	21.8	-173.9	51.3	0	0	0	0	112.9	D251 I273 D281	D251-T275 WeakPolarHBondContact CB-O 3.07Å; I273-T275 HydrophobicContact CD1-CG2 3.96Å; I273-T275 HydrophobicContact CG1-CG2 4.2Å; T275-D281 PolarHBondContact N-O 3.38Å; T275-D281 VanDerWaalsContact N-O 3.1Å
276	G	86.3	Confident	88.6	Confident	14 Å²	14	45.3 Å²	45.3	14%	0.144	23%	0.229	C	C	.	.	S	Bend	trans	162	-174.1	-178.1	0	0	0	0	0	112.5	K120 D251 D281	K120-G276 PolarHBondContact NZ-O 3.06Å; D251-G276 PolarHBondContact OD1-N 3.44Å; G276-D281 VanDerWaalsContact CA-OD2 3.32Å; G276-D281 WeakPolarHBondContact CA-OD2 3.4Å
277	E	88.2	Confident	88.6	Confident	172 Å²	172	46.4 Å²	46.4	80%	0.804	24%	0.236	S	C	*	.	S	Bend	trans	-93	-23.5	-179.5	-63.9	-169.3	160.1	0	0	113.1	D281	E277-D281 PolarHBondContact N-OD2 2.88Å
278	H	87.8	Confident	88.3	Confident	139 Å²	139	46.4 Å²	46.4	64%	0.644	23%	0.234	S	C	*	.	S	Bend	trans	-71.3	156.1	-178.1	-58.7	-65.6	0	0	0	111.3	K120 D280 D281	K120-H278 WeakPolarHBondContact CE-O 3.29Å; K120-H278 PolarHBondContact NZ-O 3.41Å; H278-D280 PolarHBondContact O-N 2.9Å; H278-D281 WeakPolarHBondContact CA-OD2 3.23Å; H278-D281 VanDerWaalsContact CB-OD2 3.24Å; H278-D281 WeakPolarHBondContact CB-OD2 3.26Å; H278-D281 IonicContact CD2-OD2 3.14Å; H278-D281 PolarHBondContact CD2-OD2 3.29Å; H278-D281 IonicContact CG-OD2 2.74Å; H278-D281 PolarHBondContact N-OD2 2.95Å; H278-D281 WeakPolarHBondContact O-CB 3.44Å; H278-D281 PolarHBondContact O-N 2.9Å
279	I	88.7	Confident	87.7	Confident	48 Å²	48	46.6 Å²	46.6	25%	0.246	24%	0.235	C	C	.	.	T	Hydrogen-bonded Turn	trans	-62.4	-28.5	-176.4	-160.7	172.1	0	0	0	113	T119 Y123 A155	T119-I279 HydrophobicContact CG2-CD1 3.99Å; T119-I279 HydrophobicContact CG2-CG1 4.49Å; Y123-I279 HydrophobicContact CD1-CB 4.45Å; Y123-I279 HydrophobicContact CD1-CD1 3.85Å; Y123-I279 HydrophobicContact CD1-CG1 3.65Å; Y123-I279 HydrophobicContact CD1-CG2 4.18Å; Y123-I279 HydrophobicContact CD2-CD1 3.85Å; Y123-I279 HydrophobicContact CE1-CD1 4.38Å; Y123-I279 HydrophobicContact CE1-CG1 4.27Å; Y123-I279 HydrophobicContact CE1-CG2 3.93Å; Y123-I279 HydrophobicContact CE2-CD1 4.42Å; Y123-I279 HydrophobicContact CG-CD1 3.54Å; Y123-I279 HydrophobicContact CG-CG1 3.8Å; A155-I279 HydrophobicContact CB-CD1 3.32Å
280	D	86.1	Confident	87.1	Confident	90 Å²	90	47.8 Å²	47.8	48%	0.481	24%	0.24	S	C	.	.	T	Hydrogen-bonded Turn	trans	-82.8	-12.7	177.7	-65.3	-64.3	0	0	0	113.4	Y123 K127 H278 F282	Y123-D280 WeakPolarHBondContact CE1-OD1 3.47Å; K127-D280 IonicContact NZ-OD1 3.85Å; K127-D280 PolarHBondContact NZ-OD1 3.16Å; H278-D280 PolarHBondContact O-N 2.9Å; D280-F282 PolarHBondContact O-N 3.37Å
281	D	88.5	Confident	86.5	Confident	43 Å²	43	47.6 Å²	47.6	23%	0.23	24%	0.239	C	C	.	.			trans	-80.9	58.6	-178.2	-55.7	-25.5	0	0	0	110.7	K120 T275 G276 E277 H278	K120-D281 PolarHBondContact NZ-O 3.19Å; T275-D281 PolarHBondContact N-O 3.38Å; T275-D281 VanDerWaalsContact N-O 3.1Å; G276-D281 VanDerWaalsContact CA-OD2 3.32Å; G276-D281 WeakPolarHBondContact CA-OD2 3.4Å; E277-D281 PolarHBondContact N-OD2 2.88Å; H278-D281 WeakPolarHBondContact CA-OD2 3.23Å; H278-D281 VanDerWaalsContact CB-OD2 3.24Å; H278-D281 WeakPolarHBondContact CB-OD2 3.26Å; H278-D281 IonicContact CD2-OD2 3.14Å; H278-D281 PolarHBondContact CD2-OD2 3.29Å; H278-D281 IonicContact CG-OD2 2.74Å; H278-D281 PolarHBondContact N-OD2 2.95Å; H278-D281 WeakPolarHBondContact O-CB 3.44Å; H278-D281 PolarHBondContact O-N 2.9Å
282	F	91.5	Very high	85.7	Confident	14 Å²	14	49.9 Å²	49.9	6%	0.061	25%	0.249	C	C	.	.	E	Extended strand (participates in β ladder)	trans	-145.7	109.8	-175	-165.7	-117.9	0	0	0	110.6	T117 K120 L121 I246 F272 D280	T117-F282 HydrophobicContact CG2-CE2 3.8Å; T117-F282 HydrophobicContact CG2-CZ 4.22Å; K120-F282 HydrophobicContact CB-CB 3.9Å; K120-F282 HydrophobicContact CB-CD1 4Å; K120-F282 HydrophobicContact CB-CD2 3.91Å; K120-F282 HydrophobicContact CB-CE1 4.48Å; K120-F282 HydrophobicContact CB-CE2 4.41Å; K120-F282 HydrophobicContact CB-CG 3.67Å; K120-F282 HydrophobicContact CD-CB 4.06Å; K120-F282 HydrophobicContact CD-CD2 4.04Å; K120-F282 HydrophobicContact CD-CG 4.27Å; K120-F282 HydrophobicContact CG-CB 4.21Å; K120-F282 HydrophobicContact CG-CG 4.42Å; L121-F282 HydrophobicContact CB-CE1 4.16Å; L121-F282 HydrophobicContact CB-CZ 4.32Å; L121-F282 HydrophobicContact CD1-CE1 3.75Å; L121-F282 HydrophobicContact CD1-CZ 4.04Å; I246-F282 HydrophobicContact CD1-CE2 4.41Å; I246-F282 HydrophobicContact CD1-CZ 4.02Å; I246-F282 HydrophobicContact CG2-CE2 4.08Å; F272-F282 HydrophobicContact CB-CD2 4.35Å; F272-F282 HydrophobicContact CB-CE1 3.89Å; F272-F282 HydrophobicContact CB-CE2 3.49Å; F272-F282 VanDerWaalsContact CB-CE2 3.49Å; F272-F282 HydrophobicContact CB-CZ 3.22Å; F272-F282 AromaticContact CD1-CD1 3.81Å; F272-F282 HydrophobicContact CD1-CD1 3.81Å; F272-F282 AromaticContact CD1-CE1 3.28Å; F272-F282 HydrophobicContact CD1-CE1 3.28Å; F272-F282 HydrophobicContact CD1-CE2 4.35Å; F272-F282 AromaticContact CD1-CZ 3.61Å; F272-F282 HydrophobicContact CD1-CZ 3.61Å; F272-F282 HydrophobicContact CD2-CE1 4.06Å; F272-F282 AromaticContact CD2-CZ 3.89Å; F272-F282 HydrophobicContact CD2-CZ 3.89Å; F272-F282 HydrophobicContact CE1-CD1 4.25Å; F272-F282 AromaticContact CE1-CE1 3.75Å; F272-F282 HydrophobicContact CE1-CE1 3.75Å; F272-F282 HydrophobicContact CE1-CZ 4.44Å; F272-F282 HydrophobicContact CE2-CE1 4.47Å; F272-F282 HydrophobicContact CG-CD1 4.37Å; F272-F282 AromaticContact CG-CE1 3.48Å; F272-F282 HydrophobicContact CG-CE1 3.48Å; F272-F282 VanDerWaalsContact CG-CE1 3.48Å; F272-F282 HydrophobicContact CG-CE2 4.07Å; F272-F282 AromaticContact CG-CZ 3.31Å; F272-F282 HydrophobicContact CG-CZ 3.31Å; F272-F282 HydrophobicContact CZ-CE1 4.33Å; D280-F282 PolarHBondContact O-N 3.37Å
283	E	87.5	Confident	84.5	Confident	52 Å²	52	53.6 Å²	53.6	24%	0.243	27%	0.266	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.7	142.7	-171.6	-61.5	176.5	-177	0	0	110.3	F272 I273 Q347	F272-E283 WeakPolarHBondContact CA-O 3.24Å; I273-E283 HydrophobicContact CD1-CB 4.42Å; I273-E283 HydrophobicContact CG1-CB 4.04Å; I273-E283 WeakPolarHBondContact CG1-O 3.4Å; I273-E283 PolarHBondContact N-O 3.22Å; I273-E283 PolarHBondContact O-N 3.37Å; E283-Q347 PolarHBondContact OE1-NE2 3.3Å
284	P	89.9	Confident	83.5	Confident	61 Å²	61	53.5 Å²	53.5	40%	0.396	27%	0.265	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-63.9	137.1	172.9	27.6	-33.6	0	0	0	110.4	F272	F272-P284 HydrophobicContact CD1-CB 4.33Å; F272-P284 HydrophobicContact CE1-CB 4.13Å
285	F	87.3	Confident	82.4	Confident	9 Å²	9	53.8 Å²	53.8	4%	0.039	27%	0.266	C	S	.	.			trans	-83.4	122.6	-179.5	-175.6	-101.4	0	0	0	111.1	V87 Q93 I270 I271 I273 V287 F290	V87-F285 HydrophobicContact CG1-CE1 3.69Å; V87-F285 HydrophobicContact CG1-CZ 3.6Å; Q93-F285 PolarHBondContact NE2-O 3.02Å; I270-F285 HydrophobicContact CB-CB 4.39Å; I270-F285 HydrophobicContact CB-CD1 3.52Å; I270-F285 HydrophobicContact CB-CE1 3.79Å; I270-F285 HydrophobicContact CB-CG 3.94Å; I270-F285 HydrophobicContact CB-CZ 4.42Å; I270-F285 HydrophobicContact CD1-CE1 4.03Å; I270-F285 HydrophobicContact CD1-CZ 4Å; I270-F285 HydrophobicContact CG1-CE1 4.45Å; I270-F285 HydrophobicContact CG2-CB 3.73Å; I270-F285 HydrophobicContact CG2-CD1 3.68Å; I270-F285 HydrophobicContact CG2-CD2 3.97Å; I270-F285 HydrophobicContact CG2-CE1 4.19Å; I270-F285 HydrophobicContact CG2-CE2 4.43Å; I270-F285 HydrophobicContact CG2-CG 3.52Å; I270-F285 WeakPolarHBondContact O-CD1 3.06Å; I271-F285 PolarHBondContact O-N 3Å; I273-F285 HydrophobicContact CG2-CB 4.25Å; I273-F285 HydrophobicContact CG2-CD2 3.48Å; I273-F285 VanDerWaalsContact CG2-CD2 3.48Å; I273-F285 HydrophobicContact CG2-CE2 4.22Å; I273-F285 HydrophobicContact CG2-CG 4.26Å; F285-V287 HydrophobicContact CD1-CG2 4.44Å; F285-V287 HydrophobicContact CE1-CG2 3.91Å; F285-F290 HydrophobicContact CD2-CB 4.47Å; F285-F290 HydrophobicContact CD2-CD2 4.48Å; F285-F290 HydrophobicContact CE2-CB 3.65Å; F285-F290 AromaticContact CE2-CD1 3.92Å; F285-F290 HydrophobicContact CE2-CD1 3.92Å; F285-F290 AromaticContact CE2-CD2 3.61Å; F285-F290 HydrophobicContact CE2-CD2 3.61Å; F285-F290 HydrophobicContact CE2-CE1 4.48Å; F285-F290 HydrophobicContact CE2-CE2 4.2Å; F285-F290 AromaticContact CE2-CG 3.43Å; F285-F290 HydrophobicContact CE2-CG 3.43Å; F285-F290 VanDerWaalsContact CE2-CG 3.43Å; F285-F290 HydrophobicContact CZ-CB 3.88Å; F285-F290 AromaticContact CZ-CD1 3.87Å; F285-F290 HydrophobicContact CZ-CD1 3.87Å; F285-F290 HydrophobicContact CZ-CD2 4.38Å; F285-F290 AromaticContact CZ-CG 3.78Å; F285-F290 HydrophobicContact CZ-CG 3.78Å
286	K	83.1	Confident	81.3	Confident	86 Å²	86	53 Å²	53	37%	0.374	27%	0.265	S	S	.	.			trans	-116.7	122	170.9	-60.3	-176.4	-175.1	176.9	0	109.1	K288 P289 F290 D305	K286-K288 PolarHBondContact O-N 2.68Å; K286-P289 HydrophobicContact CB-CB 4.23Å; K286-P289 HydrophobicContact CB-CG 3.67Å; K286-P289 HydrophobicContact CD-CG 4.12Å; K286-F290 WeakPolarHBondContact O-CB 3.43Å; K286-F290 PolarHBondContact O-N 3.25Å; K286-F290 VanDerWaalsContact O-N 3.08Å; K286-D305 IonicContact NZ-OD2 3.55Å; K286-D305 PolarHBondContact NZ-OD2 2.86Å
287	V	84.2	Confident	80.2	Confident	25 Å²	25	57.4 Å²	57.4	15%	0.152	28%	0.283	C	S	.	.	H	α-helix	trans	-58.2	-50.8	-174.7	-179.4	0	0	0	0	111.9	V84 V87 D88 F285 F290 V291	V84-V287 HydrophobicContact CB-CG1 4.44Å; V84-V287 HydrophobicContact CG1-CG1 3.94Å; V84-V287 HydrophobicContact CG2-CG1 4.48Å; V87-V287 HydrophobicContact CB-CG1 3.74Å; V87-V287 HydrophobicContact CG1-CB 4.41Å; V87-V287 HydrophobicContact CG1-CG1 3.74Å; V87-V287 HydrophobicContact CG1-CG2 4.18Å; D88-V287 HydrophobicContact CB-CG1 4.23Å; D88-V287 HydrophobicContact CB-CG2 4.16Å; F285-V287 HydrophobicContact CD1-CG2 4.44Å; F285-V287 HydrophobicContact CE1-CG2 3.91Å; V287-F290 PolarHBondContact O-N 3.29Å; V287-V291 HydrophobicContact CG1-CG2 4.34Å; V287-V291 WeakPolarHBondContact O-CG2 3.37Å; V287-V291 PolarHBondContact O-N 2.79Å
288	K	82.4	Confident	78.8	Confident	127 Å²	127	49.5 Å²	49.5	55%	0.552	25%	0.248	S	C	*	.	H	α-helix	trans	-61.6	-54.1	-176	-73.9	179	-173.6	173.7	0	112.2	K286 F290 V291 Q292	K286-K288 PolarHBondContact O-N 2.68Å; K288-F290 VanDerWaalsContact C-N 3.28Å; K288-F290 PolarHBondContact O-N 3.09Å; K288-V291 PolarHBondContact O-N 3.49Å; K288-Q292 WeakPolarHBondContact O-CB 3.47Å; K288-Q292 VanDerWaalsContact O-CG 3.3Å; K288-Q292 WeakPolarHBondContact O-CG 3.43Å; K288-Q292 PolarHBondContact O-N 3.44Å
289	P	76.6	Confident	77.8	Confident	12 Å²	12	43.8 Å²	43.8	8%	0.078	22%	0.222	C	C	.	.	H	α-helix	trans	-51.8	-42.4	171.6	-35.2	40	0	0	0	114.2	K286 Q292 K293	K286-P289 HydrophobicContact CB-CB 4.23Å; K286-P289 HydrophobicContact CB-CG 3.67Å; K286-P289 HydrophobicContact CD-CG 4.12Å; P289-Q292 PolarHBondContact O-N 2.96Å; P289-K293 VanDerWaalsContact O-CB 3.28Å; P289-K293 WeakPolarHBondContact O-CB 3.26Å; P289-K293 PolarHBondContact O-N 2.96Å
290	F	78	Confident	76.5	Confident	31 Å²	31	46.2 Å²	46.2	14%	0.136	24%	0.235	C	C	.	.	H	α-helix	trans	-62.5	-47.5	179	-178.2	-100.6	0	0	0	111.9	L3 F285 K286 V287 K288 K293 L294	L3-F290 HydrophobicContact CD1-CE2 4.11Å; L3-F290 HydrophobicContact CD2-CE2 4.42Å; L3-F290 HydrophobicContact CD2-CZ 4.08Å; F285-F290 HydrophobicContact CD2-CB 4.47Å; F285-F290 HydrophobicContact CD2-CD2 4.48Å; F285-F290 HydrophobicContact CE2-CB 3.65Å; F285-F290 AromaticContact CE2-CD1 3.92Å; F285-F290 HydrophobicContact CE2-CD1 3.92Å; F285-F290 AromaticContact CE2-CD2 3.61Å; F285-F290 HydrophobicContact CE2-CD2 3.61Å; F285-F290 HydrophobicContact CE2-CE1 4.48Å; F285-F290 HydrophobicContact CE2-CE2 4.2Å; F285-F290 AromaticContact CE2-CG 3.43Å; F285-F290 HydrophobicContact CE2-CG 3.43Å; F285-F290 VanDerWaalsContact CE2-CG 3.43Å; F285-F290 HydrophobicContact CZ-CB 3.88Å; F285-F290 AromaticContact CZ-CD1 3.87Å; F285-F290 HydrophobicContact CZ-CD1 3.87Å; F285-F290 HydrophobicContact CZ-CD2 4.38Å; F285-F290 AromaticContact CZ-CG 3.78Å; F285-F290 HydrophobicContact CZ-CG 3.78Å; K286-F290 WeakPolarHBondContact O-CB 3.43Å; K286-F290 PolarHBondContact O-N 3.25Å; K286-F290 VanDerWaalsContact O-N 3.08Å; V287-F290 PolarHBondContact O-N 3.29Å; K288-F290 VanDerWaalsContact C-N 3.28Å; K288-F290 PolarHBondContact O-N 3.09Å; F290-K293 PolarHBondContact O-N 3.41Å; F290-L294 HydrophobicContact CE1-CD1 4.36Å; F290-L294 WeakPolarHBondContact O-CB 3.38Å; F290-L294 PolarHBondContact O-N 3.08Å
291	V	79.3	Confident	75.4	Confident	2 Å²	2	46.7 Å²	46.7	1%	0.012	23%	0.234	C	C	.	.	H	α-helix	trans	-67.9	-36.4	177.2	-177.7	0	0	0	0	111.2	F80 L83 V84 V87 V287 K288 L294 L295	F80-V291 HydrophobicContact CD2-CB 4.34Å; F80-V291 HydrophobicContact CD2-CG1 3.52Å; F80-V291 HydrophobicContact CE2-CB 3.84Å; F80-V291 HydrophobicContact CE2-CG1 3.54Å; F80-V291 HydrophobicContact CG-CG1 4.48Å; F80-V291 HydrophobicContact CZ-CG1 4.49Å; L83-V291 HydrophobicContact CB-CG1 3.73Å; L83-V291 HydrophobicContact CD1-CG1 4.27Å; V84-V291 HydrophobicContact CG2-CB 4.06Å; V84-V291 HydrophobicContact CG2-CG1 4.16Å; V84-V291 HydrophobicContact CG2-CG2 3.92Å; V87-V291 HydrophobicContact CG2-CG2 4.05Å; V287-V291 HydrophobicContact CG1-CG2 4.34Å; V287-V291 WeakPolarHBondContact O-CG2 3.37Å; V287-V291 PolarHBondContact O-N 2.79Å; K288-V291 PolarHBondContact O-N 3.49Å; V291-L294 CarbonylContact O-C 3.49Å; V291-L294 WeakPolarHBondContact O-CB 3.48Å; V291-L294 PolarHBondContact O-N 2.92Å; V291-L295 WeakPolarHBondContact O-CG 3.33Å; V291-L295 PolarHBondContact O-N 2.9Å
292	Q	75.9	Confident	74.4	Confident	53 Å²	53	45.2 Å²	45.2	25%	0.248	23%	0.229	C	C	.	.	H	α-helix	trans	-63.8	-43.6	175.4	-76.3	174.9	-31.4	0	0	112	F80 K288 P289 L294 L295 G296 M297	F80-Q292 HydrophobicContact CE2-CG 3.69Å; F80-Q292 HydrophobicContact CZ-CG 3.91Å; K288-Q292 WeakPolarHBondContact O-CB 3.47Å; K288-Q292 VanDerWaalsContact O-CG 3.3Å; K288-Q292 WeakPolarHBondContact O-CG 3.43Å; K288-Q292 PolarHBondContact O-N 3.44Å; P289-Q292 PolarHBondContact O-N 2.96Å; Q292-L294 VanDerWaalsContact C-N 3.31Å; Q292-L295 CarbonylContact O-C 3.51Å; Q292-L295 PolarHBondContact O-N 3.47Å; Q292-G296 PolarHBondContact O-N 3.39Å; Q292-M297 PolarHBondContact O-N 2.86Å
293	K	67.6	Low	73.1	Confident	88 Å²	88	46.4 Å²	46.4	38%	0.383	24%	0.236	S	C	.	.	H	α-helix	trans	-62.4	-40.8	173.9	-170.6	175	-175.5	177.3	0	110.9	P289 F290 L295 G296	P289-K293 VanDerWaalsContact O-CB 3.28Å; P289-K293 WeakPolarHBondContact O-CB 3.26Å; P289-K293 PolarHBondContact O-N 2.96Å; F290-K293 PolarHBondContact O-N 3.41Å; K293-L295 VanDerWaalsContact C-N 3.35Å; K293-L295 PolarHBondContact O-N 2.97Å; K293-G296 PolarHBondContact O-N 3.45Å; K293-G296 VanDerWaalsContact O-N 3.08Å
294	L	69.4	Low	72.2	Confident	17 Å²	17	48.8 Å²	48.8	9%	0.089	25%	0.249	C	C	.	.	H	α-helix	trans	-63.8	-36.4	174.2	-169.6	131.8	0	0	0	112.1	L3 L6 G7 I10 L83 F290 V291 Q292 G296	L3-L294 HydrophobicContact CD2-CD1 4.17Å; L6-L294 HydrophobicContact CD2-CD1 3.7Å; L6-L294 HydrophobicContact CD2-CG 4.27Å; L6-L294 HydrophobicContact CG-CD1 4.47Å; G7-L294 WeakPolarHBondContact CA-O 3.37Å; I10-L294 HydrophobicContact CD1-CD2 3.58Å; I10-L294 HydrophobicContact CD1-CG 4.5Å; L83-L294 HydrophobicContact CD1-CD2 4.29Å; F290-L294 HydrophobicContact CE1-CD1 4.36Å; F290-L294 WeakPolarHBondContact O-CB 3.38Å; F290-L294 PolarHBondContact O-N 3.08Å; V291-L294 CarbonylContact O-C 3.49Å; V291-L294 WeakPolarHBondContact O-CB 3.48Å; V291-L294 PolarHBondContact O-N 2.92Å; Q292-L294 VanDerWaalsContact C-N 3.31Å; L294-G296 VanDerWaalsContact C-N 3.3Å
295	L	67.2	Low	71.2	Confident	10 Å²	10	49 Å²	49	5%	0.052	25%	0.247	C	C	.	.	H	α-helix	trans	-81.5	-8.1	172.8	-66.2	-169.1	0	0	0	113.7	I10 I14 F80 L83 V291 Q292 K293 M297	I10-L295 HydrophobicContact CG2-CD2 3.42Å; I10-L295 VanDerWaalsContact CG2-CD2 3.42Å; I14-L295 HydrophobicContact CD1-CD2 3.95Å; F80-L295 HydrophobicContact CB-CD1 3.96Å; F80-L295 HydrophobicContact CD2-CD1 3.56Å; F80-L295 HydrophobicContact CD2-CG 4.45Å; F80-L295 HydrophobicContact CG-CD1 4.24Å; L83-L295 HydrophobicContact CD1-CD2 3.91Å; V291-L295 WeakPolarHBondContact O-CG 3.33Å; V291-L295 PolarHBondContact O-N 2.9Å; Q292-L295 CarbonylContact O-C 3.51Å; Q292-L295 PolarHBondContact O-N 3.47Å; K293-L295 VanDerWaalsContact C-N 3.35Å; K293-L295 PolarHBondContact O-N 2.97Å; L295-M297 VanDerWaalsContact C-N 3.29Å; L295-M297 HydrophobicContact CB-CG 3.94Å; L295-M297 HydrophobicContact CB-SD 4.25Å; L295-M297 HydrophobicContact CD1-SD 4.1Å; L295-M297 PolarHBondContact O-N 3.19Å
296	G	62.1	Low	70.2	Confident	20 Å²	20	50.8 Å²	50.8	21%	0.206	26%	0.255	C	S	.	.	T	Hydrogen-bonded Turn	trans	70.8	22.3	-177.1	0	0	0	0	0	114.6	Q292 K293 L294 G298	Q292-G296 PolarHBondContact O-N 3.39Å; K293-G296 PolarHBondContact O-N 3.45Å; K293-G296 VanDerWaalsContact O-N 3.08Å; L294-G296 VanDerWaalsContact C-N 3.3Å; G296-G298 PolarHBondContact O-N 2.96Å
297	M	63	Low	69.3	Low	107 Å²	107	50.1 Å²	50.1	53%	0.527	26%	0.257	S	S	.	.	S	Bend	trans	-81.3	-1	179.6	-61.7	-176.2	86.8	0	0	112.9	Q292 L295 P353	Q292-M297 PolarHBondContact O-N 2.86Å; L295-M297 VanDerWaalsContact C-N 3.29Å; L295-M297 HydrophobicContact CB-CG 3.94Å; L295-M297 HydrophobicContact CB-SD 4.25Å; L295-M297 HydrophobicContact CD1-SD 4.1Å; L295-M297 PolarHBondContact O-N 3.19Å; M297-P353 WeakPolarHBondContact O-CB 3.33Å; M297-P353 WeakPolarHBondContact O-CG 3.36Å
298	G	59.3	Low	68.3	Low	6 Å²	6	52.5 Å²	52.5	6%	0.062	28%	0.275	C	S	.	.			trans	79.3	161.7	-172.6	0	0	0	0	0	112	G296 M351	G296-G298 PolarHBondContact O-N 2.96Å; G298-M351 CarbonylContact C-O 3.48Å; G298-M351 WeakPolarHBondContact CA-O 3.31Å
299	D	66.8	Low	67.5	Low	19 Å²	19	53.9 Å²	53.9	10%	0.102	28%	0.284	C	S	.	.			trans	-124.1	83.8	178.4	176.6	16.8	0	0	0	108.3	E301 G302 L303 M351	D299-E301 VanDerWaalsContact C-N 3.28Å; D299-E301 PolarHBondContact O-N 3.45Å; D299-E301 PolarHBondContact OD1-N 3.22Å; D299-G302 PolarHBondContact OD1-N 3.46Å; D299-G302 WeakPolarHBondContact OD2-CA 3.28Å; D299-L303 PolarHBondContact O-N 3.45Å; D299-L303 VanDerWaalsContact O-N 3.15Å; D299-M351 CarbonylContact C-O 3.45Å; D299-M351 HydrophobicContact CB-CG 4.34Å; D299-M351 PolarHBondContact N-O 3.4Å
300	I	60.8	Low	66.6	Low	98 Å²	98	56 Å²	56	50%	0.503	29%	0.294	S	S	.	.	H	α-helix	trans	-66	-35.8	-179.4	-56.9	176.5	0	0	0	110.2	L303 I304 P353	I300-L303 PolarHBondContact O-N 3.14Å; I300-I304 HydrophobicContact CG2-CD1 3.99Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.46Å; I300-I304 PolarHBondContact O-N 3.07Å; I300-P353 HydrophobicContact CD1-CG 3.89Å; I300-P353 HydrophobicContact CG1-CG 3.74Å
301	E	63.8	Low	65.8	Low	100 Å²	100	60.3 Å²	60.3	47%	0.467	31%	0.313	S	S	.	.	H	α-helix	trans	-65.2	-48.4	-180	-69.5	-178.7	-175.5	0	0	111	D299 L303 I304 D305	D299-E301 VanDerWaalsContact C-N 3.28Å; D299-E301 PolarHBondContact O-N 3.45Å; D299-E301 PolarHBondContact OD1-N 3.22Å; E301-L303 VanDerWaalsContact C-N 3.29Å; E301-L303 PolarHBondContact O-N 3.29Å; E301-I304 PolarHBondContact O-N 3.3Å; E301-I304 VanDerWaalsContact O-N 3.15Å; E301-D305 PolarHBondContact O-N 3.35Å
302	G	66	Low	64.5	Low	12 Å²	12	64.1 Å²	64.1	12%	0.124	33%	0.333	C	S	.	.	H	α-helix	trans	-63.6	-32.2	176.2	0	0	0	0	0	113.5	D299 K306	D299-G302 PolarHBondContact OD1-N 3.46Å; D299-G302 WeakPolarHBondContact OD2-CA 3.28Å; G302-K306 PolarHBondContact O-N 3.47Å
303	L	65.8	Low	63.4	Low	40 Å²	40	68.4 Å²	68.4	21%	0.209	36%	0.357	C	S	.	.	H	α-helix	trans	-64.1	-45.3	171.9	-177.6	64.5	0	0	0	111.4	D299 I300 E301 D305 K306 V307 I348 M351 I352	D299-L303 PolarHBondContact O-N 3.45Å; D299-L303 VanDerWaalsContact O-N 3.15Å; I300-L303 PolarHBondContact O-N 3.14Å; E301-L303 VanDerWaalsContact C-N 3.29Å; E301-L303 PolarHBondContact O-N 3.29Å; L303-D305 VanDerWaalsContact C-N 3.34Å; L303-K306 PolarHBondContact O-N 2.94Å; L303-V307 HydrophobicContact CD1-CG2 4.31Å; L303-V307 HydrophobicContact CG-CG2 4.45Å; L303-V307 WeakPolarHBondContact O-CB 3.49Å; L303-V307 WeakPolarHBondContact O-CG2 3.36Å; L303-V307 PolarHBondContact O-N 3.31Å; L303-I348 HydrophobicContact CD1-CG2 3.74Å; L303-M351 HydrophobicContact CB-CB 4.09Å; L303-M351 HydrophobicContact CB-SD 4.43Å; L303-I352 HydrophobicContact CD2-CG1 4.05Å
304	I	66.9	Low	62.7	Low	102 Å²	102	70.4 Å²	70.4	52%	0.523	37%	0.368	S	S	.	.	H	α-helix	trans	-61.8	-45	177.7	-68.1	164.5	0	0	0	110.1	I300 E301 V307 S308	I300-I304 HydrophobicContact CG2-CD1 3.99Å; I300-I304 VanDerWaalsContact O-CG1 3.3Å; I300-I304 WeakPolarHBondContact O-CG1 3.46Å; I300-I304 PolarHBondContact O-N 3.07Å; E301-I304 PolarHBondContact O-N 3.3Å; E301-I304 VanDerWaalsContact O-N 3.15Å; I304-V307 PolarHBondContact O-N 3.27Å; I304-S308 WeakPolarHBondContact O-CB 3.26Å; I304-S308 PolarHBondContact O-N 3.38Å; I304-S308 PolarHBondContact O-OG 3.21Å
305	D	69.8	Low	62.2	Low	65 Å²	65	72.6 Å²	72.6	35%	0.348	38%	0.38	S	S	.	.	H	α-helix	trans	-59.3	-49.6	178.1	-72.7	-12.6	0	0	0	111	K286 E301 L303 V307 S308 E309	K286-D305 IonicContact NZ-OD2 3.55Å; K286-D305 PolarHBondContact NZ-OD2 2.86Å; E301-D305 PolarHBondContact O-N 3.35Å; L303-D305 VanDerWaalsContact C-N 3.34Å; D305-V307 VanDerWaalsContact C-N 3.35Å; D305-V307 PolarHBondContact O-N 3.36Å; D305-S308 PolarHBondContact O-N 3.08Å; D305-S308 VanDerWaalsContact O-N 3.15Å; D305-S308 PolarHBondContact O-OG 2.91Å; D305-E309 PolarHBondContact O-N 3.46Å
306	K	65.6	Low	62	Low	47 Å²	47	79.2 Å²	79.2	20%	0.204	41%	0.41	C	S	.	.	H	α-helix	trans	-60.8	-41.1	176.4	-80.3	-162.1	174.3	-156	0	113	G302 L303 S308 E309 L310 Q347 M351	G302-K306 PolarHBondContact O-N 3.47Å; L303-K306 PolarHBondContact O-N 2.94Å; K306-S308 VanDerWaalsContact C-N 3.3Å; K306-E309 PolarHBondContact O-N 2.87Å; K306-L310 WeakPolarHBondContact O-CD1 3.23Å; K306-L310 VanDerWaalsContact O-CG 3.26Å; K306-L310 WeakPolarHBondContact O-CG 2.84Å; K306-L310 PolarHBondContact O-N 3.38Å; K306-Q347 VanDerWaalsContact NZ-NE2 3.18Å; K306-M351 HydrophobicContact CD-CE 4.06Å; K306-M351 HydrophobicContact CD-SD 4.21Å
307	V	65.4	Low	62.1	Low	71 Å²	71	85.1 Å²	85.1	43%	0.43	43%	0.433	S	S	.	.	H	α-helix	trans	-64.8	-37.8	176.9	168.6	0	0	0	0	111	L303 I304 D305 L310 L312	L303-V307 HydrophobicContact CD1-CG2 4.31Å; L303-V307 HydrophobicContact CG-CG2 4.45Å; L303-V307 WeakPolarHBondContact O-CB 3.49Å; L303-V307 WeakPolarHBondContact O-CG2 3.36Å; L303-V307 PolarHBondContact O-N 3.31Å; I304-V307 PolarHBondContact O-N 3.27Å; D305-V307 VanDerWaalsContact C-N 3.35Å; D305-V307 PolarHBondContact O-N 3.36Å; V307-L310 PolarHBondContact O-N 2.72Å; V307-L312 HydrophobicContact CG1-CD1 4.21Å
308	S	63.2	Low	62.1	Low	75 Å²	75	80.8 Å²	80.8	52%	0.524	41%	0.411	S	S	.	.	H	α-helix	trans	-69.2	-38.6	177.5	75.8	0	0	0	0	112.7	I304 D305 K306 L310 K311	I304-S308 WeakPolarHBondContact O-CB 3.26Å; I304-S308 PolarHBondContact O-N 3.38Å; I304-S308 PolarHBondContact O-OG 3.21Å; D305-S308 PolarHBondContact O-N 3.08Å; D305-S308 VanDerWaalsContact O-N 3.15Å; D305-S308 PolarHBondContact O-OG 2.91Å; K306-S308 VanDerWaalsContact C-N 3.3Å; S308-L310 PolarHBondContact O-N 2.91Å; S308-K311 PolarHBondContact O-N 3.49Å
309	E	64.8	Low	62.4	Low	156 Å²	156	83.9 Å²	83.9	73%	0.729	43%	0.426	S	S	*	.	H	α-helix	trans	-63.5	-28.9	175.4	-75.4	-176.3	170.6	0	0	112.5	D305 K306 K311	D305-E309 PolarHBondContact O-N 3.46Å; K306-E309 PolarHBondContact O-N 2.87Å; E309-K311 PolarHBondContact O-N 2.9Å
310	L	58.3	Low	62.4	Low	57 Å²	57	88 Å²	88	30%	0.298	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	-73.5	-9.1	-179.7	-70.9	163.9	0	0	0	113.6	K306 V307 S308 L312 M342	K306-L310 WeakPolarHBondContact O-CD1 3.23Å; K306-L310 VanDerWaalsContact O-CG 3.26Å; K306-L310 WeakPolarHBondContact O-CG 2.84Å; K306-L310 PolarHBondContact O-N 3.38Å; V307-L310 PolarHBondContact O-N 2.72Å; S308-L310 PolarHBondContact O-N 2.91Å; L310-L312 HydrophobicContact CB-CD1 4.22Å; L310-L312 HydrophobicContact CB-CD2 4.23Å; L310-L312 HydrophobicContact CB-CG 3.76Å; L310-L312 HydrophobicContact CD1-CD1 4.34Å; L310-L312 PolarHBondContact O-N 3.07Å; L310-M342 HydrophobicContact CD1-CG 3.59Å; L310-M342 HydrophobicContact CD1-SD 3.8Å; L310-M342 HydrophobicContact CD2-CG 3.84Å; L310-M342 HydrophobicContact CG-CG 4.39Å
311	K	60.2	Low	62.6	Low	121 Å²	121	86.6 Å²	86.6	53%	0.526	44%	0.435	S	S	.	.	T	Hydrogen-bonded Turn	trans	43.1	43.7	-179.1	-65.7	170.9	145.2	-139.7	0	111.7	S308 E309 D313 E314	S308-K311 PolarHBondContact O-N 3.49Å; E309-K311 PolarHBondContact O-N 2.9Å; K311-D313 PolarHBondContact O-N 2.57Å; K311-E314 HydrophobicContact CB-CG 4.15Å; K311-E314 WeakPolarHBondContact CD-OE1 3.14Å; K311-E314 WeakPolarHBondContact CE-OE1 3.48Å; K311-E314 IonicContact NZ-OE1 2.63Å; K311-E314 PolarHBondContact NZ-OE1 3.39Å; K311-E314 IonicContact NZ-OE2 2.67Å; K311-E314 WeakPolarHBondContact O-CB 3.41Å; K311-E314 PolarHBondContact O-N 2.88Å
312	L	52.2	Low	62.7	Low	82 Å²	82	83.7 Å²	83.7	43%	0.429	42%	0.422	S	S	.	.	G	3₁₀ helix	trans	-59.9	-18.7	-173.3	-72	166.7	0	0	0	112.7	V307 L310 E314	V307-L312 HydrophobicContact CG1-CD1 4.21Å; L310-L312 HydrophobicContact CB-CD1 4.22Å; L310-L312 HydrophobicContact CB-CD2 4.23Å; L310-L312 HydrophobicContact CB-CG 3.76Å; L310-L312 HydrophobicContact CD1-CD1 4.34Å; L310-L312 PolarHBondContact O-N 3.07Å; L312-E314 VanDerWaalsContact C-N 3.25Å; L312-E314 PolarHBondContact O-N 3.44Å
313	D	53.1	Low	62.6	Low	143 Å²	143	88.9 Å²	88.9	77%	0.765	44%	0.441	S	S	*	.	G	3₁₀ helix	trans	-69.1	-15.7	174.3	-62.8	-25.9	0	0	0	113.7	K311 N315	K311-D313 PolarHBondContact O-N 2.57Å; D313-N315 VanDerWaalsContact C-N 3.29Å; D313-N315 PolarHBondContact O-N 2.89Å
314	E	52.8	Low	62.7	Low	130 Å²	130	93.4 Å²	93.4	61%	0.607	46%	0.461	S	S	*	.	G	3₁₀ helix	trans	-77.1	-9	-178.8	-72.7	-179	177.3	0	0	113.9	K311 L312 E316	K311-E314 HydrophobicContact CB-CG 4.15Å; K311-E314 WeakPolarHBondContact CD-OE1 3.14Å; K311-E314 WeakPolarHBondContact CE-OE1 3.48Å; K311-E314 IonicContact NZ-OE1 2.63Å; K311-E314 PolarHBondContact NZ-OE1 3.39Å; K311-E314 IonicContact NZ-OE2 2.67Å; K311-E314 WeakPolarHBondContact O-CB 3.41Å; K311-E314 PolarHBondContact O-N 2.88Å; L312-E314 VanDerWaalsContact C-N 3.25Å; L312-E314 PolarHBondContact O-N 3.44Å; E314-E316 VanDerWaalsContact C-N 3.33Å; E314-E316 PolarHBondContact O-N 3.18Å
315	N	58.5	Low	62.7	Low	63 Å²	63	90 Å²	90	34%	0.337	45%	0.451	S	S	.	.			trans	-92.6	52.8	177.7	-80.3	-25.1	0	0	0	112.7	D313 E317 L318 I319	D313-N315 VanDerWaalsContact C-N 3.29Å; D313-N315 PolarHBondContact O-N 2.89Å; N315-E317 PolarHBondContact O-N 3.48Å; N315-L318 HydrophobicContact CB-CB 3.97Å; N315-L318 PolarHBondContact O-N 3.28Å; N315-L318 VanDerWaalsContact O-N 3.09Å; N315-I319 PolarHBondContact O-N 3.45Å; N315-I319 VanDerWaalsContact O-N 3.13Å
316	E	63.5	Low	62.8	Low	149 Å²	149	91.3 Å²	91.3	70%	0.696	46%	0.455	S	S	*	.	H	α-helix	trans	-53.5	-40.6	173.4	-72.5	-168.5	153.9	0	0	111.5	E314 L318 I319 E320	E314-E316 VanDerWaalsContact C-N 3.33Å; E314-E316 PolarHBondContact O-N 3.18Å; E316-L318 VanDerWaalsContact C-N 3.3Å; E316-L318 PolarHBondContact O-N 3.45Å; E316-I319 CarbonylContact O-C 3.6Å; E316-I319 WeakPolarHBondContact O-CB 3.42Å; E316-I319 PolarHBondContact O-N 3.3Å; E316-I319 VanDerWaalsContact O-N 3.17Å; E316-E320 WeakPolarHBondContact O-CG 3.38Å; E316-E320 PolarHBondContact O-N 2.95Å
317	E	65.1	Low	63.5	Low	145 Å²	145	89.3 Å²	89.3	68%	0.678	45%	0.447	S	S	*	.	H	α-helix	trans	-58.7	-39.7	177.7	-67	-170.9	176.3	0	0	112.7	N315 E320 K321	N315-E317 PolarHBondContact O-N 3.48Å; E317-E320 PolarHBondContact O-N 3.49Å; E317-K321 WeakPolarHBondContact O-CB 2.88Å; E317-K321 VanDerWaalsContact O-CG 3.31Å; E317-K321 WeakPolarHBondContact O-CG 3.48Å; E317-K321 PolarHBondContact O-N 2.84Å
318	L	62.5	Low	64.6	Low	15 Å²	15	86.6 Å²	86.6	8%	0.079	43%	0.43	C	S	.	.	H	α-helix	trans	-72.2	-39.2	-179.9	-154.2	139.8	0	0	0	110	N315 E316 E320 K321 L322	N315-L318 HydrophobicContact CB-CB 3.97Å; N315-L318 PolarHBondContact O-N 3.28Å; N315-L318 VanDerWaalsContact O-N 3.09Å; E316-L318 VanDerWaalsContact C-N 3.3Å; E316-L318 PolarHBondContact O-N 3.45Å; L318-E320 VanDerWaalsContact C-N 3.28Å; L318-E320 PolarHBondContact O-N 2.67Å; L318-K321 PolarHBondContact O-N 3.14Å; L318-L322 HydrophobicContact CD2-CD1 3.51Å; L318-L322 HydrophobicContact CD2-CG 3.92Å; L318-L322 VanDerWaalsContact O-CB 3.23Å; L318-L322 WeakPolarHBondContact O-CB 3.31Å; L318-L322 WeakPolarHBondContact O-CG 3.28Å; L318-L322 PolarHBondContact O-N 2.95Å
319	I	64.4	Low	65.9	Low	71 Å²	71	83 Å²	83	36%	0.364	41%	0.405	S	S	.	.	H	α-helix	trans	-60.6	-40.1	171.8	-63.7	175.3	0	0	0	110.3	N315 E316 K323	N315-I319 PolarHBondContact O-N 3.45Å; N315-I319 VanDerWaalsContact O-N 3.13Å; E316-I319 CarbonylContact O-C 3.6Å; E316-I319 WeakPolarHBondContact O-CB 3.42Å; E316-I319 PolarHBondContact O-N 3.3Å; E316-I319 VanDerWaalsContact O-N 3.17Å; I319-K323 VanDerWaalsContact O-CG 3.24Å; I319-K323 WeakPolarHBondContact O-CG 3.2Å; I319-K323 PolarHBondContact O-N 3.03Å
320	E	67.1	Low	67	Low	106 Å²	106	79 Å²	79	50%	0.495	38%	0.383	S	S	.	.	H	α-helix	trans	-67.7	-47.1	176.4	-68.1	-144.3	136.5	0	0	113.5	E316 E317 L318 L322 K323 H324	E316-E320 WeakPolarHBondContact O-CG 3.38Å; E316-E320 PolarHBondContact O-N 2.95Å; E317-E320 PolarHBondContact O-N 3.49Å; L318-E320 VanDerWaalsContact C-N 3.28Å; L318-E320 PolarHBondContact O-N 2.67Å; E320-L322 VanDerWaalsContact C-N 3.29Å; E320-L322 PolarHBondContact O-N 3.23Å; E320-K323 VanDerWaalsContact O-CB 3.32Å; E320-K323 WeakPolarHBondContact O-CB 3.34Å; E320-K323 PolarHBondContact O-N 2.63Å; E320-K323 IonicContact OE1-NZ 2.7Å; E320-H324 PolarHBondContact O-CD2 3.49Å; E320-H324 PolarHBondContact O-N 3.07Å; E320-H324 VanDerWaalsContact O-N 3.08Å
321	K	66.4	Low	68.4	Low	69 Å²	69	76.4 Å²	76.4	30%	0.3	37%	0.37	S	S	.	.	H	α-helix	trans	-59.1	-42.4	175	-72.5	172.7	178.9	174.4	0	111.5	E317 L318 H324 G325 Q326 D331	E317-K321 WeakPolarHBondContact O-CB 2.88Å; E317-K321 VanDerWaalsContact O-CG 3.31Å; E317-K321 WeakPolarHBondContact O-CG 3.48Å; E317-K321 PolarHBondContact O-N 2.84Å; L318-K321 PolarHBondContact O-N 3.14Å; K321-H324 PolarHBondContact O-N 2.98Å; K321-G325 PolarHBondContact O-N 3.02Å; K321-Q326 CarbonylContact C-O 3.52Å; K321-Q326 PolarHBondContact O-N 2.7Å; K321-Q326 VanDerWaalsContact O-N 3.09Å; K321-Q326 VanDerWaalsContact O-O 3.11Å; K321-D331 WeakPolarHBondContact CD-OD1 3.37Å; K321-D331 IonicContact NZ-OD1 3.82Å; K321-D331 PolarHBondContact NZ-OD1 3.09Å
322	L	65.2	Low	69.7	Low	39 Å²	39	70.7 Å²	70.7	20%	0.204	35%	0.345	C	S	.	.	H	α-helix	trans	-63.3	-39.2	173.5	-70.1	175.9	0	0	0	112.3	L318 E320 H324 G325 F327 V431	L318-L322 HydrophobicContact CD2-CD1 3.51Å; L318-L322 HydrophobicContact CD2-CG 3.92Å; L318-L322 VanDerWaalsContact O-CB 3.23Å; L318-L322 WeakPolarHBondContact O-CB 3.31Å; L318-L322 WeakPolarHBondContact O-CG 3.28Å; L318-L322 PolarHBondContact O-N 2.95Å; E320-L322 VanDerWaalsContact C-N 3.29Å; E320-L322 PolarHBondContact O-N 3.23Å; L322-H324 PolarHBondContact O-N 3.31Å; L322-G325 PolarHBondContact O-N 2.92Å; L322-F327 HydrophobicContact CD2-CD2 4.15Å; L322-V431 HydrophobicContact CD2-CB 4.32Å; L322-V431 HydrophobicContact CD2-CG1 3.2Å; L322-V431 HydrophobicContact CD2-CG2 4.22Å
323	K	63.7	Low	71.4	Confident	120 Å²	120	69.1 Å²	69.1	52%	0.522	33%	0.333	S	S	.	.	H	α-helix	trans	-58.5	-38.5	174.3	-76.5	169.2	-168.9	160	0	111	I319 E320 G325	I319-K323 VanDerWaalsContact O-CG 3.24Å; I319-K323 WeakPolarHBondContact O-CG 3.2Å; I319-K323 PolarHBondContact O-N 3.03Å; E320-K323 VanDerWaalsContact O-CB 3.32Å; E320-K323 WeakPolarHBondContact O-CB 3.34Å; E320-K323 PolarHBondContact O-N 2.63Å; E320-K323 IonicContact OE1-NZ 2.7Å; K323-G325 PolarHBondContact O-N 3.3Å
324	H	67.5	Low	73	Confident	136 Å²	136	65.1 Å²	65.1	63%	0.63	31%	0.31	S	S	*	.	T	Hydrogen-bonded Turn	trans	-81.6	2.6	178.2	-67.9	-62.4	0	0	0	114	E320 K321 L322 Q326	E320-H324 PolarHBondContact O-CD2 3.49Å; E320-H324 PolarHBondContact O-N 3.07Å; E320-H324 VanDerWaalsContact O-N 3.08Å; K321-H324 PolarHBondContact O-N 2.98Å; L322-H324 PolarHBondContact O-N 3.31Å; H324-Q326 HydrophobicContact CB-CG 4.17Å; H324-Q326 PolarHBondContact O-N 3.47Å
325	G	67.5	Low	74.4	Confident	30 Å²	30	61.2 Å²	61.2	31%	0.309	29%	0.292	S	S	.	.	T	Hydrogen-bonded Turn	trans	65.6	17.7	-179	0	0	0	0	0	113.5	K321 L322 K323	K321-G325 PolarHBondContact O-N 3.02Å; L322-G325 PolarHBondContact O-N 2.92Å; K323-G325 PolarHBondContact O-N 3.3Å
326	Q	71.8	Confident	75.6	Confident	92 Å²	92	59.1 Å²	59.1	43%	0.43	28%	0.28	S	S	.	.			trans	-95.4	117.8	177.8	-61.8	-175.6	13.3	0	0	107.5	K321 H324 L390	K321-Q326 CarbonylContact C-O 3.52Å; K321-Q326 PolarHBondContact O-N 2.7Å; K321-Q326 VanDerWaalsContact O-N 3.09Å; K321-Q326 VanDerWaalsContact O-O 3.11Å; H324-Q326 HydrophobicContact CB-CG 4.17Å; H324-Q326 PolarHBondContact O-N 3.47Å; Q326-L390 HydrophobicContact CB-CD2 3.7Å; Q326-L390 HydrophobicContact CG-CD2 3.73Å
327	F	81.3	Confident	76.6	Confident	6 Å²	6	55.3 Å²	55.3	3%	0.026	26%	0.262	C	S	.	.			trans	-135.7	111.9	177.3	-174.9	-99.3	0	0	0	107.9	L322 D331 M332 Y424 F427 A428 V431	L322-F327 HydrophobicContact CD2-CD2 4.15Å; F327-D331 HydrophobicContact CD2-CB 3.87Å; F327-D331 HydrophobicContact CE2-CB 3.75Å; F327-D331 HydrophobicContact CZ-CB 4.43Å; F327-M332 HydrophobicContact CE1-CB 3.81Å; F327-M332 HydrophobicContact CE1-CG 4.32Å; F327-M332 HydrophobicContact CZ-CB 3.66Å; F327-M332 HydrophobicContact CZ-CG 4.2Å; F327-Y424 HydrophobicContact CD1-CD2 4.29Å; F327-Y424 AromaticContact CD1-CE2 3.72Å; F327-Y424 HydrophobicContact CD1-CE2 3.72Å; F327-Y424 HydrophobicContact CE1-CD2 4.11Å; F327-Y424 AromaticContact CE1-CE2 3.98Å; F327-Y424 HydrophobicContact CE1-CE2 3.98Å; F327-Y424 PolarHBondContact O-OH 3.4Å; F327-F427 HydrophobicContact CD1-CD1 4.28Å; F327-F427 AromaticContact CE1-CD1 3.39Å; F327-F427 HydrophobicContact CE1-CD1 3.39Å; F327-F427 AromaticContact CE1-CE1 3.99Å; F327-F427 HydrophobicContact CE1-CE1 3.99Å; F327-F427 HydrophobicContact CE1-CG 4.33Å; F327-F427 HydrophobicContact CE2-CD1 4.07Å; F327-F427 AromaticContact CE2-CE1 3.83Å; F327-F427 HydrophobicContact CE2-CE1 3.83Å; F327-F427 AromaticContact CZ-CD1 3.25Å; F327-F427 HydrophobicContact CZ-CD1 3.25Å; F327-F427 AromaticContact CZ-CE1 3.33Å; F327-F427 HydrophobicContact CZ-CE1 3.33Å; F327-F427 HydrophobicContact CZ-CG 4.41Å; F327-A428 HydrophobicContact CD1-CB 3.96Å; F327-V431 HydrophobicContact CB-CG1 3.93Å; F327-V431 HydrophobicContact CD2-CG1 4.1Å; F327-V431 HydrophobicContact CD2-CG2 4.1Å; F327-V431 HydrophobicContact CE2-CG2 4.23Å; F327-V431 HydrophobicContact CG-CB 4.42Å; F327-V431 HydrophobicContact CG-CG1 4.11Å; F327-V431 HydrophobicContact CG-CG2 4.35Å
328	T	88	Confident	77.2	Confident	14 Å²	14	49.9 Å²	49.9	9%	0.086	24%	0.238	C	C	.	.			trans	-98.8	171.7	-175.4	66	0	0	0	0	110.8	R330 D331 M332 L387 L390	T328-R330 PolarHBondContact OG1-N 3.36Å; T328-D331 WeakPolarHBondContact CB-OD2 3.5Å; T328-D331 PolarHBondContact N-OD2 3.35Å; T328-D331 PolarHBondContact O-N 3.31Å; T328-D331 PolarHBondContact OG1-N 3Å; T328-D331 VanDerWaalsContact OG1-N 3.14Å; T328-D331 PolarHBondContact OG1-OD2 3.33Å; T328-M332 PolarHBondContact O-N 3.05Å; T328-L387 WeakPolarHBondContact CB-O 3.38Å; T328-L390 HydrophobicContact CG2-CD2 4.39Å
329	L	89.8	Confident	77.8	Confident	0 Å²	0	51.7 Å²	51.7	0%	0	25%	0.247	C	C	.	.	H	α-helix	trans	-68.5	-29.2	171.6	-83.9	166.3	0	0	0	111.2	M332 Y333 M379 M382 L387 P392 M421 Y424	L329-M332 HydrophobicContact CD2-CE 3.52Å; L329-M332 HydrophobicContact CD2-SD 4.45Å; L329-M332 WeakPolarHBondContact O-CB 3.45Å; L329-M332 PolarHBondContact O-N 2.96Å; L329-Y333 WeakPolarHBondContact O-CB 3.44Å; L329-Y333 PolarHBondContact O-N 3.16Å; L329-M379 HydrophobicContact CD2-SD 4.19Å; L329-M382 HydrophobicContact CD1-SD 3.71Å; L329-L387 HydrophobicContact CB-CD2 3.95Å; L329-L387 PolarHBondContact N-O 3Å; L329-P392 HydrophobicContact CD1-CB 3.45Å; L329-P392 VanDerWaalsContact CD1-CB 3.45Å; L329-P392 HydrophobicContact CD1-CG 3.71Å; L329-P392 HydrophobicContact CG-CB 4.1Å; L329-P392 HydrophobicContact CG-CG 3.78Å; L329-M421 HydrophobicContact CD1-CE 3.81Å; L329-M421 HydrophobicContact CD1-SD 4.22Å; L329-Y424 HydrophobicContact CD2-CD2 3.61Å; L329-Y424 HydrophobicContact CD2-CE2 4.39Å; L329-Y424 HydrophobicContact CD2-CG 3.77Å; L329-Y424 HydrophobicContact CG-CD2 3.95Å; L329-Y424 HydrophobicContact CG-CE2 4.25Å; L329-Y424 HydrophobicContact CG-CG 4.28Å
330	R	89.3	Confident	78.3	Confident	72 Å²	72	51.4 Å²	51.4	27%	0.272	25%	0.245	S	C	.	.	H	α-helix	trans	-63	-44.6	173	-169.3	175.5	-57	-86.8	1.9	111.8	T328 M332 Y333 E334 D384 L387 D388	T328-R330 PolarHBondContact OG1-N 3.36Å; R330-M332 VanDerWaalsContact C-N 3.28Å; R330-M332 PolarHBondContact O-N 3.48Å; R330-Y333 WeakPolarHBondContact O-CA 3.35Å; R330-Y333 VanDerWaalsContact O-CB 3.29Å; R330-Y333 WeakPolarHBondContact O-CB 3.34Å; R330-Y333 PolarHBondContact O-N 3.49Å; R330-E334 WeakPolarHBondContact O-CG 3.46Å; R330-E334 PolarHBondContact O-N 3.12Å; R330-D384 IonicContact CZ-OD1 2.93Å; R330-D384 IonicContact NH2-OD1 3.01Å; R330-D384 PolarHBondContact NH2-OD1 3.17Å; R330-L387 HydrophobicContact CB-CB 4.42Å; R330-L387 PolarHBondContact N-O 3.43Å; R330-D388 WeakPolarHBondContact CB-OD1 3.45Å; R330-D388 WeakPolarHBondContact CD-OD1 3.29Å; R330-D388 IonicContact CZ-OD1 3.86Å; R330-D388 IonicContact CZ-OD2 3.35Å; R330-D388 IonicContact NE-OD1 3.67Å; R330-D388 PolarHBondContact NE-OD1 3.18Å; R330-D388 IonicContact NE-OD2 3.64Å; R330-D388 PolarHBondContact NE-OD2 2.97Å; R330-D388 IonicContact NH2-OD1 2.59Å; R330-D388 IonicContact NH2-OD2 3.49Å; R330-D388 PolarHBondContact NH2-OD2 3.46Å
331	D	86.7	Confident	78.5	Confident	2 Å²	2	53.3 Å²	53.3	1%	0.011	25%	0.252	C	S	.	.	H	α-helix	trans	-61.9	-40.3	176	-53.1	-49.6	0	0	0	110.3	K321 F327 T328 Y333 E334 Q335	K321-D331 WeakPolarHBondContact CD-OD1 3.37Å; K321-D331 IonicContact NZ-OD1 3.82Å; K321-D331 PolarHBondContact NZ-OD1 3.09Å; F327-D331 HydrophobicContact CD2-CB 3.87Å; F327-D331 HydrophobicContact CE2-CB 3.75Å; F327-D331 HydrophobicContact CZ-CB 4.43Å; T328-D331 WeakPolarHBondContact CB-OD2 3.5Å; T328-D331 PolarHBondContact N-OD2 3.35Å; T328-D331 PolarHBondContact O-N 3.31Å; T328-D331 PolarHBondContact OG1-N 3Å; T328-D331 VanDerWaalsContact OG1-N 3.14Å; T328-D331 PolarHBondContact OG1-OD2 3.33Å; D331-Y333 VanDerWaalsContact C-N 3.33Å; D331-Y333 PolarHBondContact O-N 3.16Å; D331-E334 PolarHBondContact O-N 3.49Å; D331-Q335 VanDerWaalsContact O-CG 3.28Å; D331-Q335 WeakPolarHBondContact O-CG 3.49Å; D331-Q335 PolarHBondContact O-N 3.06Å
332	M	87.3	Confident	78.4	Confident	1 Å²	1	52.7 Å²	52.7	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-62.3	-39.2	173.6	-167	-179.7	75.1	0	0	112.6	F327 T328 L329 R330 Q335 F336 M379 L420 Y424	F327-M332 HydrophobicContact CE1-CB 3.81Å; F327-M332 HydrophobicContact CE1-CG 4.32Å; F327-M332 HydrophobicContact CZ-CB 3.66Å; F327-M332 HydrophobicContact CZ-CG 4.2Å; T328-M332 PolarHBondContact O-N 3.05Å; L329-M332 HydrophobicContact CD2-CE 3.52Å; L329-M332 HydrophobicContact CD2-SD 4.45Å; L329-M332 WeakPolarHBondContact O-CB 3.45Å; L329-M332 PolarHBondContact O-N 2.96Å; R330-M332 VanDerWaalsContact C-N 3.28Å; R330-M332 PolarHBondContact O-N 3.48Å; M332-Q335 PolarHBondContact O-N 3.26Å; M332-F336 HydrophobicContact CE-CE2 3.9Å; M332-F336 HydrophobicContact CE-CZ 4.15Å; M332-F336 HydrophobicContact CG-CD1 4.49Å; M332-F336 HydrophobicContact CG-CE1 4.02Å; M332-F336 HydrophobicContact CG-CE2 4.18Å; M332-F336 HydrophobicContact CG-CZ 3.84Å; M332-F336 WeakPolarHBondContact O-CG 3.48Å; M332-F336 PolarHBondContact O-N 2.87Å; M332-F336 HydrophobicContact SD-CE2 4.31Å; M332-F336 HydrophobicContact SD-CZ 3.96Å; M332-M379 HydrophobicContact CE-CE 3.9Å; M332-M379 HydrophobicContact CE-SD 3.48Å; M332-M379 WeakPolarHBondContact CE-SD 3.46Å; M332-L420 HydrophobicContact CE-CD1 3.63Å; M332-Y424 HydrophobicContact SD-CD2 4.07Å; M332-Y424 HydrophobicContact SD-CG 4.49Å
333	Y	88.9	Confident	78.4	Confident	48 Å²	48	52 Å²	52	19%	0.188	25%	0.252	C	S	.	.	H	α-helix	trans	-62.6	-47.5	176.3	-173.9	-88.2	0	0	0	111.5	L329 R330 D331 Q335 F336 Q337 M376 M379 D380	L329-Y333 WeakPolarHBondContact O-CB 3.44Å; L329-Y333 PolarHBondContact O-N 3.16Å; R330-Y333 WeakPolarHBondContact O-CA 3.35Å; R330-Y333 VanDerWaalsContact O-CB 3.29Å; R330-Y333 WeakPolarHBondContact O-CB 3.34Å; R330-Y333 PolarHBondContact O-N 3.49Å; D331-Y333 VanDerWaalsContact C-N 3.33Å; D331-Y333 PolarHBondContact O-N 3.16Å; Y333-Q335 VanDerWaalsContact C-N 3.31Å; Y333-Q335 PolarHBondContact O-N 2.89Å; Y333-F336 PolarHBondContact O-N 3.32Å; Y333-F336 VanDerWaalsContact O-N 3.16Å; Y333-Q337 HydrophobicContact CD1-CG 4.11Å; Y333-Q337 VanDerWaalsContact CE1-CD 3.49Å; Y333-Q337 HydrophobicContact CE1-CG 3.92Å; Y333-Q337 PolarHBondContact O-N 2.86Å; Y333-M376 HydrophobicContact CD2-CB 4.31Å; Y333-M376 HydrophobicContact CD2-CG 4.17Å; Y333-M376 HydrophobicContact CE1-CE 4.1Å; Y333-M376 HydrophobicContact CE2-CB 3.77Å; Y333-M376 HydrophobicContact CE2-CE 3.9Å; Y333-M376 HydrophobicContact CE2-CG 3.99Å; Y333-M379 HydrophobicContact CD2-CB 3.77Å; Y333-M379 HydrophobicContact CD2-CE 3.73Å; Y333-M379 HydrophobicContact CD2-SD 4.09Å; Y333-M379 HydrophobicContact CE2-CB 4.26Å; Y333-M379 HydrophobicContact CG-CE 4.36Å; Y333-D380 WeakPolarHBondContact CE2-OD1 3.44Å; Y333-D380 VanDerWaalsContact CZ-OD1 3.29Å; Y333-D380 PolarHBondContact OH-OD1 3.33Å
334	E	85.6	Confident	78.5	Confident	59 Å²	59	48.4 Å²	48.4	28%	0.276	24%	0.241	S	C	.	.	H	α-helix	trans	-60	-41.8	174.7	-70.8	171.3	-166.6	0	0	111.3	R330 D331 F336 Q337 N338	R330-E334 WeakPolarHBondContact O-CG 3.46Å; R330-E334 PolarHBondContact O-N 3.12Å; D331-E334 PolarHBondContact O-N 3.49Å; E334-F336 PolarHBondContact O-N 2.9Å; E334-Q337 WeakPolarHBondContact O-CB 3.39Å; E334-Q337 PolarHBondContact O-N 3.28Å; E334-N338 WeakPolarHBondContact O-CB 3.45Å; E334-N338 PolarHBondContact O-N 2.9Å; E334-N338 PolarHBondContact O-ND2 3.5Å
335	Q	82.2	Confident	78.3	Confident	49 Å²	49	47.4 Å²	47.4	23%	0.229	24%	0.235	C	C	.	.	H	α-helix	trans	-63.3	-41.2	174.6	-68.4	-47.8	-71.4	0	0	112.2	D331 M332 Y333 N338 I339	D331-Q335 VanDerWaalsContact O-CG 3.28Å; D331-Q335 WeakPolarHBondContact O-CG 3.49Å; D331-Q335 PolarHBondContact O-N 3.06Å; M332-Q335 PolarHBondContact O-N 3.26Å; Y333-Q335 VanDerWaalsContact C-N 3.31Å; Y333-Q335 PolarHBondContact O-N 2.89Å; Q335-N338 PolarHBondContact O-N 2.75Å; Q335-I339 WeakPolarHBondContact O-CB 3.27Å; Q335-I339 VanDerWaalsContact O-CG1 3.23Å; Q335-I339 WeakPolarHBondContact O-CG1 3.26Å; Q335-I339 PolarHBondContact O-N 2.86Å
336	F	84.8	Confident	78.2	Confident	18 Å²	18	46.6 Å²	46.6	8%	0.079	23%	0.225	C	C	.	.	H	α-helix	trans	-64.9	-39.8	174.6	-72.3	-3.7	0	0	0	112	M332 Y333 E334 I339 M340 L372 L375 M376 M379	M332-F336 HydrophobicContact CE-CE2 3.9Å; M332-F336 HydrophobicContact CE-CZ 4.15Å; M332-F336 HydrophobicContact CG-CD1 4.49Å; M332-F336 HydrophobicContact CG-CE1 4.02Å; M332-F336 HydrophobicContact CG-CE2 4.18Å; M332-F336 HydrophobicContact CG-CZ 3.84Å; M332-F336 WeakPolarHBondContact O-CG 3.48Å; M332-F336 PolarHBondContact O-N 2.87Å; M332-F336 HydrophobicContact SD-CE2 4.31Å; M332-F336 HydrophobicContact SD-CZ 3.96Å; Y333-F336 PolarHBondContact O-N 3.32Å; Y333-F336 VanDerWaalsContact O-N 3.16Å; E334-F336 PolarHBondContact O-N 2.9Å; F336-I339 HydrophobicContact CD1-CD1 4.42Å; F336-I339 PolarHBondContact O-N 3.36Å; F336-M340 WeakPolarHBondContact O-CB 3.46Å; F336-M340 WeakPolarHBondContact O-CG 3.29Å; F336-M340 PolarHBondContact O-N 2.91Å; F336-L372 HydrophobicContact CD1-CD2 4.04Å; F336-L372 HydrophobicContact CD2-CD2 4.27Å; F336-L372 HydrophobicContact CE1-CD2 4.13Å; F336-L372 HydrophobicContact CE2-CD2 4.37Å; F336-L372 HydrophobicContact CG-CD2 4.12Å; F336-L372 HydrophobicContact CZ-CD2 4.3Å; F336-L375 HydrophobicContact CD2-CB 4.28Å; F336-L375 HydrophobicContact CE2-CB 3.88Å; F336-L375 HydrophobicContact CE2-CD1 3.57Å; F336-L375 HydrophobicContact CE2-CG 4.39Å; F336-L375 HydrophobicContact CZ-CD1 3.92Å; F336-M376 HydrophobicContact CB-CG 4.16Å; F336-M376 HydrophobicContact CB-SD 4.16Å; F336-M376 HydrophobicContact CD2-CG 4.35Å; F336-M379 HydrophobicContact CD2-CE 3.51Å; F336-M379 HydrophobicContact CE2-CE 3.82Å
337	Q	83	Confident	77.8	Confident	69 Å²	69	44 Å²	44	32%	0.322	21%	0.213	S	C	.	.	H	α-helix	trans	-60.4	-45.1	173	-76.8	-168.8	-21.3	0	0	111.8	Y333 E334 M340 K341 M376	Y333-Q337 HydrophobicContact CD1-CG 4.11Å; Y333-Q337 VanDerWaalsContact CE1-CD 3.49Å; Y333-Q337 HydrophobicContact CE1-CG 3.92Å; Y333-Q337 PolarHBondContact O-N 2.86Å; E334-Q337 WeakPolarHBondContact O-CB 3.39Å; E334-Q337 PolarHBondContact O-N 3.28Å; Q337-M340 PolarHBondContact O-N 3.28Å; Q337-K341 WeakPolarHBondContact O-CG 3.45Å; Q337-K341 PolarHBondContact O-N 2.94Å; Q337-M376 HydrophobicContact CG-CE 3.41Å; Q337-M376 VanDerWaalsContact CG-CE 3.41Å; Q337-M376 HydrophobicContact CG-SD 4.38Å
338	N	78.5	Confident	77.1	Confident	31 Å²	31	45 Å²	45	17%	0.166	22%	0.218	C	C	.	.	H	α-helix	trans	-63.8	-43.1	177.9	-67	-24.4	0	0	0	110.9	E334 Q335 M340 K341 M342	E334-N338 WeakPolarHBondContact O-CB 3.45Å; E334-N338 PolarHBondContact O-N 2.9Å; E334-N338 PolarHBondContact O-ND2 3.5Å; Q335-N338 PolarHBondContact O-N 2.75Å; N338-M340 VanDerWaalsContact C-N 3.31Å; N338-M340 PolarHBondContact O-N 3.24Å; N338-K341 WeakPolarHBondContact O-CB 3.4Å; N338-K341 PolarHBondContact O-N 2.95Å; N338-K341 VanDerWaalsContact O-N 3.11Å; N338-M342 WeakPolarHBondContact O-CG 3.39Å; N338-M342 PolarHBondContact O-N 3.27Å
339	I	76.1	Confident	76.1	Confident	54 Å²	54	45.9 Å²	45.9	28%	0.277	22%	0.221	S	C	.	.	H	α-helix	trans	-60.1	-40.7	173.8	-68.1	164.1	0	0	0	111.5	Q335 F336 K341 M342 L372	Q335-I339 WeakPolarHBondContact O-CB 3.27Å; Q335-I339 VanDerWaalsContact O-CG1 3.23Å; Q335-I339 WeakPolarHBondContact O-CG1 3.26Å; Q335-I339 PolarHBondContact O-N 2.86Å; F336-I339 HydrophobicContact CD1-CD1 4.42Å; F336-I339 PolarHBondContact O-N 3.36Å; I339-K341 VanDerWaalsContact C-N 3.33Å; I339-K341 PolarHBondContact O-N 3.46Å; I339-M342 HydrophobicContact CB-CE 4.15Å; I339-M342 HydrophobicContact CG1-CE 3.66Å; I339-M342 PolarHBondContact O-N 3.28Å; I339-L372 HydrophobicContact CG2-CD1 3.86Å
340	M	74.3	Confident	74.9	Confident	65 Å²	65	47.4 Å²	47.4	32%	0.32	23%	0.232	S	C	.	.	H	α-helix	trans	-66.6	-33.7	175.7	-74	-171.4	66.8	0	0	112.6	F336 Q337 N338 G343 L369 L372 K373 M376	F336-M340 WeakPolarHBondContact O-CB 3.46Å; F336-M340 WeakPolarHBondContact O-CG 3.29Å; F336-M340 PolarHBondContact O-N 2.91Å; Q337-M340 PolarHBondContact O-N 3.28Å; N338-M340 VanDerWaalsContact C-N 3.31Å; N338-M340 PolarHBondContact O-N 3.24Å; M340-G343 PolarHBondContact O-N 2.98Å; M340-L369 HydrophobicContact CG-CD2 4.42Å; M340-L372 HydrophobicContact CG-CB 4.5Å; M340-L372 HydrophobicContact CG-CD1 4.48Å; M340-L372 HydrophobicContact SD-CB 4.47Å; M340-K373 HydrophobicContact CE-CB 4.35Å; M340-M376 HydrophobicContact SD-SD 3.41Å
341	K	70.7	Confident	73.7	Confident	146 Å²	146	44.5 Å²	44.5	64%	0.635	22%	0.222	S	C	*	.	H	α-helix	trans	-69.1	-30.6	174.1	-71.1	172.6	-175.2	172.5	0	112.7	Q337 N338 I339 G343	Q337-K341 WeakPolarHBondContact O-CG 3.45Å; Q337-K341 PolarHBondContact O-N 2.94Å; N338-K341 WeakPolarHBondContact O-CB 3.4Å; N338-K341 PolarHBondContact O-N 2.95Å; N338-K341 VanDerWaalsContact O-N 3.11Å; I339-K341 VanDerWaalsContact C-N 3.33Å; I339-K341 PolarHBondContact O-N 3.46Å; K341-G343 PolarHBondContact O-N 2.96Å; K341-G343 VanDerWaalsContact O-N 3.14Å
342	M	64.6	Low	72.6	Confident	56 Å²	56	47.1 Å²	47.1	28%	0.276	24%	0.235	S	C	.	.	T	Hydrogen-bonded Turn	trans	-67.1	-10.4	178.7	-66.7	-165.6	-83.4	0	0	113.6	L310 N338 I339 I348	L310-M342 HydrophobicContact CD1-CG 3.59Å; L310-M342 HydrophobicContact CD1-SD 3.8Å; L310-M342 HydrophobicContact CD2-CG 3.84Å; L310-M342 HydrophobicContact CG-CG 4.39Å; N338-M342 WeakPolarHBondContact O-CG 3.39Å; N338-M342 PolarHBondContact O-N 3.27Å; I339-M342 HydrophobicContact CB-CE 4.15Å; I339-M342 HydrophobicContact CG1-CE 3.66Å; I339-M342 PolarHBondContact O-N 3.28Å; M342-I348 HydrophobicContact CB-CD1 3.81Å; M342-I348 HydrophobicContact SD-CD1 4.19Å
343	G	64.9	Low	71.3	Confident	23 Å²	23	50 Å²	50	24%	0.237	25%	0.254	C	S	.	.			trans	79.9	-164.7	-178.1	0	0	0	0	0	112.7	M340 K341 F345	M340-G343 PolarHBondContact O-N 2.98Å; K341-G343 PolarHBondContact O-N 2.96Å; K341-G343 VanDerWaalsContact O-N 3.14Å; G343-F345 PolarHBondContact O-N 3.31Å
344	P	65.5	Low	70.1	Confident	45 Å²	45	51.4 Å²	51.4	29%	0.292	28%	0.284	S	S	.	.			trans	-61.9	121.4	-177.2	-22	33.5	0	0	0	111.6	S346 Q347 E365	P344-S346 PolarHBondContact O-N 3.24Å; P344-Q347 WeakPolarHBondContact O-CB 3.35Å; P344-Q347 PolarHBondContact O-N 3.05Å; P344-E365 WeakPolarHBondContact CB-OE2 3.21Å
345	F	64.8	Low	68.9	Low	116 Å²	116	53.2 Å²	53.2	51%	0.509	29%	0.291	S	S	.	.	H	α-helix	trans	-54.8	-29	-179.1	-171	-103.9	0	0	0	113.1	G343 Q347 I348 M349 L360	G343-F345 PolarHBondContact O-N 3.31Å; F345-Q347 VanDerWaalsContact C-N 3.28Å; F345-Q347 PolarHBondContact O-N 3.03Å; F345-I348 PolarHBondContact O-N 3.43Å; F345-M349 HydrophobicContact CD1-CG 3.56Å; F345-M349 HydrophobicContact CD1-SD 4.43Å; F345-M349 HydrophobicContact CE1-CE 4.4Å; F345-M349 HydrophobicContact CE1-CG 3.27Å; F345-M349 HydrophobicContact CE1-SD 3.57Å; F345-M349 VanDerWaalsContact CE1-SD 3.57Å; F345-M349 HydrophobicContact CG-CG 4.36Å; F345-M349 HydrophobicContact CZ-CG 3.86Å; F345-M349 HydrophobicContact CZ-SD 3.67Å; F345-M349 WeakPolarHBondContact O-CG 3.44Å; F345-M349 PolarHBondContact O-N 3.19Å; F345-L360 HydrophobicContact CD1-CD2 4.44Å
346	S	63.4	Low	67.6	Low	12 Å²	12	51.9 Å²	51.9	8%	0.084	29%	0.29	C	S	.	.	H	α-helix	trans	-60.4	-35	174.7	64.4	0	0	0	0	113.4	P344 M349 S350 E365	P344-S346 PolarHBondContact O-N 3.24Å; S346-M349 PolarHBondContact O-N 3.05Å; S346-S350 VanDerWaalsContact O-CB 3.26Å; S346-S350 WeakPolarHBondContact O-CB 3.3Å; S346-S350 PolarHBondContact O-N 2.83Å; S346-S350 PolarHBondContact O-OG 3.04Å; S346-E365 VanDerWaalsContact CB-CD 3.42Å; S346-E365 WeakPolarHBondContact CB-OE1 3.23Å; S346-E365 PolarHBondContact OG-OE1 3.34Å; S346-E365 PolarHBondContact OG-OE2 2.77Å; S346-E365 VanDerWaalsContact OG-OE2 3.07Å
347	Q	64.4	Low	66.2	Low	38 Å²	38	55.7 Å²	55.7	18%	0.178	31%	0.308	C	S	.	.	H	α-helix	trans	-66.8	-44.2	179.8	-165.6	-178.9	5.7	0	0	109.1	E283 K306 P344 F345 S350 M351	E283-Q347 PolarHBondContact OE1-NE2 3.3Å; K306-Q347 VanDerWaalsContact NZ-NE2 3.18Å; P344-Q347 WeakPolarHBondContact O-CB 3.35Å; P344-Q347 PolarHBondContact O-N 3.05Å; F345-Q347 VanDerWaalsContact C-N 3.28Å; F345-Q347 PolarHBondContact O-N 3.03Å; Q347-S350 PolarHBondContact O-N 3.2Å; Q347-S350 PolarHBondContact O-OG 3.37Å; Q347-M351 HydrophobicContact CG-CE 4.48Å; Q347-M351 WeakPolarHBondContact O-CG 3.49Å; Q347-M351 PolarHBondContact O-N 3.37Å
348	I	67.1	Low	65	Low	27 Å²	27	59.6 Å²	59.6	14%	0.138	33%	0.331	C	S	.	.	H	α-helix	trans	-64.4	-47.4	176.4	-55	173.7	0	0	0	110.5	L303 M342 F345 S350 M351 I352	L303-I348 HydrophobicContact CD1-CG2 3.74Å; M342-I348 HydrophobicContact CB-CD1 3.81Å; M342-I348 HydrophobicContact SD-CD1 4.19Å; F345-I348 PolarHBondContact O-N 3.43Å; I348-S350 VanDerWaalsContact C-N 3.28Å; I348-S350 PolarHBondContact O-N 3.05Å; I348-M351 WeakPolarHBondContact O-CB 3.3Å; I348-M351 PolarHBondContact O-N 3.19Å; I348-M351 VanDerWaalsContact O-N 3.07Å; I348-I352 PolarHBondContact O-N 3.44Å
349	M	66	Low	63.6	Low	32 Å²	32	66.1 Å²	66.1	16%	0.158	36%	0.358	C	S	.	.	H	α-helix	trans	-62.3	-37	178.6	-69.2	-64	-72.7	0	0	111.9	F345 S346 M351 I352 F355	F345-M349 HydrophobicContact CD1-CG 3.56Å; F345-M349 HydrophobicContact CD1-SD 4.43Å; F345-M349 HydrophobicContact CE1-CE 4.4Å; F345-M349 HydrophobicContact CE1-CG 3.27Å; F345-M349 HydrophobicContact CE1-SD 3.57Å; F345-M349 VanDerWaalsContact CE1-SD 3.57Å; F345-M349 HydrophobicContact CG-CG 4.36Å; F345-M349 HydrophobicContact CZ-CG 3.86Å; F345-M349 HydrophobicContact CZ-SD 3.67Å; F345-M349 WeakPolarHBondContact O-CG 3.44Å; F345-M349 PolarHBondContact O-N 3.19Å; S346-M349 PolarHBondContact O-N 3.05Å; M349-M351 PolarHBondContact O-N 3.08Å; M349-I352 PolarHBondContact O-N 3.33Å; M349-I352 VanDerWaalsContact O-N 3.09Å; M349-I352 HydrophobicContact SD-CD1 4.21Å; M349-F355 HydrophobicContact CE-CB 4.07Å; M349-F355 HydrophobicContact CE-CD1 3.29Å; M349-F355 HydrophobicContact CE-CE1 3.92Å; M349-F355 HydrophobicContact CE-CG 3.88Å
350	S	64.2	Low	62.5	Low	33 Å²	33	67.2 Å²	67.2	23%	0.231	36%	0.364	C	S	.	.	H	α-helix	trans	-67.1	-19.1	176.7	76.5	0	0	0	0	113.9	S346 Q347 I348	S346-S350 VanDerWaalsContact O-CB 3.26Å; S346-S350 WeakPolarHBondContact O-CB 3.3Å; S346-S350 PolarHBondContact O-N 2.83Å; S346-S350 PolarHBondContact O-OG 3.04Å; Q347-S350 PolarHBondContact O-N 3.2Å; Q347-S350 PolarHBondContact O-OG 3.37Å; I348-S350 VanDerWaalsContact C-N 3.28Å; I348-S350 PolarHBondContact O-N 3.05Å
351	M	64.1	Low	61.4	Low	11 Å²	11	69.3 Å²	69.3	5%	0.054	39%	0.385	C	S	.	.	H	α-helix	trans	-81.1	-21.9	174.2	-68	168.2	162	0	0	111.9	G298 D299 L303 K306 Q347 I348 M349 P353	G298-M351 CarbonylContact C-O 3.48Å; G298-M351 WeakPolarHBondContact CA-O 3.31Å; D299-M351 CarbonylContact C-O 3.45Å; D299-M351 HydrophobicContact CB-CG 4.34Å; D299-M351 PolarHBondContact N-O 3.4Å; L303-M351 HydrophobicContact CB-CB 4.09Å; L303-M351 HydrophobicContact CB-SD 4.43Å; K306-M351 HydrophobicContact CD-CE 4.06Å; K306-M351 HydrophobicContact CD-SD 4.21Å; Q347-M351 HydrophobicContact CG-CE 4.48Å; Q347-M351 WeakPolarHBondContact O-CG 3.49Å; Q347-M351 PolarHBondContact O-N 3.37Å; I348-M351 WeakPolarHBondContact O-CB 3.3Å; I348-M351 PolarHBondContact O-N 3.19Å; I348-M351 VanDerWaalsContact O-N 3.07Å; M349-M351 PolarHBondContact O-N 3.08Å; M351-P353 WeakPolarHBondContact O-CD 3.48Å
352	I	65.3	Low	60.4	Low	56 Å²	56	72.9 Å²	72.9	29%	0.287	40%	0.401	S	S	.	.	S	Bend	trans	-82	119.4	-179.5	-59.3	174.5	0	0	0	110.2	L303 I348 M349 G354 F355	L303-I352 HydrophobicContact CD2-CG1 4.05Å; I348-I352 PolarHBondContact O-N 3.44Å; M349-I352 PolarHBondContact O-N 3.33Å; M349-I352 VanDerWaalsContact O-N 3.09Å; M349-I352 HydrophobicContact SD-CD1 4.21Å; I352-G354 PolarHBondContact O-N 3.22Å; I352-F355 HydrophobicContact CB-CB 4.35Å; I352-F355 HydrophobicContact CG2-CB 4.37Å; I352-F355 HydrophobicContact CG2-CD2 3.84Å; I352-F355 HydrophobicContact CG2-CG 4.45Å; I352-F355 PolarHBondContact O-N 3.43Å
353	P	59.1	Low	59.9	Low	61 Å²	61	72.2 Å²	72.2	40%	0.396	41%	0.408	S	S	.	.	T	Hydrogen-bonded Turn	trans	-57.2	134.7	176.6	-22	31.4	0	0	0	112.3	M297 I300 M351 F355	M297-P353 WeakPolarHBondContact O-CB 3.33Å; M297-P353 WeakPolarHBondContact O-CG 3.36Å; I300-P353 HydrophobicContact CD1-CG 3.89Å; I300-P353 HydrophobicContact CG1-CG 3.74Å; M351-P353 WeakPolarHBondContact O-CD 3.48Å; P353-F355 VanDerWaalsContact C-N 3.27Å; P353-F355 PolarHBondContact O-N 2.99Å
354	G	62.5	Low	59.8	Low	79 Å²	79	74.4 Å²	74.4	81%	0.814	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	84.1	-16.2	177.3	0	0	0	0	0	115.4	I352 G356	I352-G354 PolarHBondContact O-N 3.22Å; G354-G356 PolarHBondContact O-N 3.05Å
355	F	61.6	Low	59.7	Low	97 Å²	97	76.2 Å²	76.2	43%	0.425	43%	0.425	S	S	.	.			trans	-90.7	88.2	169.4	-84.8	-93.9	0	0	0	109.7	M349 I352 P353	M349-F355 HydrophobicContact CE-CB 4.07Å; M349-F355 HydrophobicContact CE-CD1 3.29Å; M349-F355 HydrophobicContact CE-CE1 3.92Å; M349-F355 HydrophobicContact CE-CG 3.88Å; I352-F355 HydrophobicContact CB-CB 4.35Å; I352-F355 HydrophobicContact CG2-CB 4.37Å; I352-F355 HydrophobicContact CG2-CD2 3.84Å; I352-F355 HydrophobicContact CG2-CG 4.45Å; I352-F355 PolarHBondContact O-N 3.43Å; P353-F355 VanDerWaalsContact C-N 3.27Å; P353-F355 PolarHBondContact O-N 2.99Å
356	G	55.5	Low	60	Low	21 Å²	21	77.2 Å²	77.2	22%	0.216	43%	0.431	C	S	.	.			trans	-67.9	159.8	172.4	0	0	0	0	0	112.3	G354 D358 F359	G354-G356 PolarHBondContact O-N 3.05Å; G356-D358 PolarHBondContact O-N 2.97Å; G356-F359 PolarHBondContact O-N 3.45Å
357	Q	55.4	Low	60.5	Low	98 Å²	98	80.2 Å²	80.2	46%	0.458	44%	0.444	S	S	.	.	G	3₁₀ helix	trans	-55.8	-21.4	172.3	-74.2	-172.5	-13.9	0	0	112.8	F359 L360	Q357-F359 PolarHBondContact O-N 3.3Å; Q357-L360 PolarHBondContact O-N 3.4Å
358	D	56	Low	61	Low	150 Å²	150	81.5 Å²	81.5	80%	0.802	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-67.3	-15.4	-178.5	-57.1	-40	0	0	0	114.2	G356 L360	G356-D358 PolarHBondContact O-N 2.97Å; D358-L360 VanDerWaalsContact C-N 3.28Å
359	F	51.1	Low	61.7	Low	168 Å²	168	82.9 Å²	82.9	74%	0.737	46%	0.464	S	S	*	.	G	3₁₀ helix	trans	-78.8	-12.8	177.3	-131.5	-93.6	0	0	0	113.2	G356 Q357	G356-F359 PolarHBondContact O-N 3.45Å; Q357-F359 PolarHBondContact O-N 3.3Å
360	L	51.8	Low	62.6	Low	77 Å²	77	88 Å²	88	40%	0.403	49%	0.486	S	S	.	.	S	Bend	trans	-88.7	112.4	175.5	-70	167.9	0	0	0	109.3	F345 Q357 D358	F345-L360 HydrophobicContact CD1-CD2 4.44Å; Q357-L360 PolarHBondContact O-N 3.4Å; D358-L360 VanDerWaalsContact C-N 3.28Å
361	S	50.6	Low	63.5	Low	109 Å²	109	94 Å²	94	76%	0.762	50%	0.503	S	S	*	.			trans	-46.8	143.6	165.5	55	0	0	0	0	110.5	G363	S361-G363 PolarHBondContact O-N 3.01Å
362	K	50.4	Low	64.6	Low	221 Å²	221	95.1 Å²	95.1	96%	0.961	51%	0.509	S	S	*	.	S	Bend	trans	-43.1	12.6	-173.5	-61.1	-179.8	175.5	179.8	0	120.1
363	G	54.8	Low	65.7	Low	42 Å²	42	98.7 Å²	98.7	43%	0.433	52%	0.523	S	S	.	.			trans	-75.8	132.7	174.4	0	0	0	0	0	111.6	S361	S361-G363 PolarHBondContact O-N 3.01Å
364	S	61.8	Low	67.2	Low	69 Å²	69	100.9 Å²	100.9	48%	0.483	52%	0.523	S	S	.	.			trans	-65.7	141.8	172.8	66.3	0	0	0	0	110.6	Q366 E367 S368	S364-Q366 PolarHBondContact O-N 3.31Å; S364-E367 VanDerWaalsContact O-CB 3.3Å; S364-E367 WeakPolarHBondContact O-CB 3.5Å; S364-E367 PolarHBondContact O-N 3.17Å; S364-E367 VanDerWaalsContact OG-CB 3.3Å; S364-E367 WeakPolarHBondContact OG-CB 3.41Å; S364-E367 PolarHBondContact OG-N 3.17Å; S364-S368 PolarHBondContact O-N 3.16Å
365	E	64.9	Low	68.5	Low	84 Å²	84	98.5 Å²	98.5	39%	0.393	49%	0.491	S	S	.	.	H	α-helix	trans	-56.9	-38.9	180	-66.9	164.9	-163.8	0	0	112.5	P344 S346 E367 S368 L369	P344-E365 WeakPolarHBondContact CB-OE2 3.21Å; S346-E365 VanDerWaalsContact CB-CD 3.42Å; S346-E365 WeakPolarHBondContact CB-OE1 3.23Å; S346-E365 PolarHBondContact OG-OE1 3.34Å; S346-E365 PolarHBondContact OG-OE2 2.77Å; S346-E365 VanDerWaalsContact OG-OE2 3.07Å; E365-E367 VanDerWaalsContact C-N 3.25Å; E365-E367 PolarHBondContact O-N 3.41Å; E365-S368 WeakPolarHBondContact O-CB 3.47Å; E365-S368 PolarHBondContact O-N 3.33Å; E365-S368 VanDerWaalsContact O-N 3.16Å; E365-L369 PolarHBondContact O-N 3.36Å; E365-L369 VanDerWaalsContact O-N 3.12Å
366	Q	69.1	Low	70	Confident	136 Å²	136	94.8 Å²	94.8	64%	0.636	48%	0.476	S	S	*	.	H	α-helix	trans	-61.4	-34.7	175.1	-74.3	-167.8	0.3	0	0	112.4	S364 S368 L369 K370	S364-Q366 PolarHBondContact O-N 3.31Å; Q366-S368 VanDerWaalsContact C-N 3.34Å; Q366-L369 PolarHBondContact O-N 3.35Å; Q366-K370 WeakPolarHBondContact O-CB 3.48Å; Q366-K370 WeakPolarHBondContact O-CG 3.4Å; Q366-K370 PolarHBondContact O-N 3.49Å
367	E	75	Confident	71.8	Confident	76 Å²	76	96.2 Å²	96.2	36%	0.355	48%	0.48	S	S	.	.	H	α-helix	trans	-68	-37.7	177.1	-166.7	-175.2	166.7	0	0	111.2	S364 E365 K370 R371	S364-E367 VanDerWaalsContact O-CB 3.3Å; S364-E367 WeakPolarHBondContact O-CB 3.5Å; S364-E367 PolarHBondContact O-N 3.17Å; S364-E367 VanDerWaalsContact OG-CB 3.3Å; S364-E367 WeakPolarHBondContact OG-CB 3.41Å; S364-E367 PolarHBondContact OG-N 3.17Å; E365-E367 VanDerWaalsContact C-N 3.25Å; E365-E367 PolarHBondContact O-N 3.41Å; E367-K370 PolarHBondContact O-N 2.83Å; E367-R371 WeakPolarHBondContact O-CB 3.4Å; E367-R371 VanDerWaalsContact O-CG 3.23Å; E367-R371 WeakPolarHBondContact O-CG 3.31Å; E367-R371 PolarHBondContact O-N 3.49Å; E367-R371 IonicContact OE1-CZ 2.82Å; E367-R371 IonicContact OE1-NE 3.31Å; E367-R371 PolarHBondContact OE1-NE 3.28Å; E367-R371 IonicContact OE1-NH2 3.49Å; E367-R371 PolarHBondContact OE1-NH2 3.45Å
368	S	75.7	Confident	73.6	Confident	65 Å²	65	91.6 Å²	91.6	46%	0.455	46%	0.459	S	S	.	.	H	α-helix	trans	-63.5	-44.8	175.4	-60.7	0	0	0	0	111.8	S364 E365 Q366 R371 L372	S364-S368 PolarHBondContact O-N 3.16Å; E365-S368 WeakPolarHBondContact O-CB 3.47Å; E365-S368 PolarHBondContact O-N 3.33Å; E365-S368 VanDerWaalsContact O-N 3.16Å; Q366-S368 VanDerWaalsContact C-N 3.34Å; S368-R371 PolarHBondContact O-N 2.62Å; S368-L372 PolarHBondContact O-N 3.46Å
369	L	80.2	Confident	75.4	Confident	55 Å²	55	84.5 Å²	84.5	29%	0.288	42%	0.421	S	S	.	.	H	α-helix	trans	-65.2	-40.4	175.1	-69.5	174.9	0	0	0	112.3	M340 E365 Q366 R371 L372 K373	M340-L369 HydrophobicContact CG-CD2 4.42Å; E365-L369 PolarHBondContact O-N 3.36Å; E365-L369 VanDerWaalsContact O-N 3.12Å; Q366-L369 PolarHBondContact O-N 3.35Å; L369-R371 VanDerWaalsContact C-N 3.34Å; L369-R371 PolarHBondContact O-N 2.86Å; L369-L372 PolarHBondContact O-N 2.87Å; L369-K373 WeakPolarHBondContact O-CB 3.3Å; L369-K373 PolarHBondContact O-N 3.16Å
370	K	84.6	Confident	77.5	Confident	141 Å²	141	81 Å²	81	61%	0.613	41%	0.409	S	S	*	.	H	α-helix	trans	-61.8	-41	174.3	-76.5	172.7	-176.7	177.1	0	111.7	Q366 E367 K373 R374	Q366-K370 WeakPolarHBondContact O-CB 3.48Å; Q366-K370 WeakPolarHBondContact O-CG 3.4Å; Q366-K370 PolarHBondContact O-N 3.49Å; E367-K370 PolarHBondContact O-N 2.83Å; K370-K373 PolarHBondContact O-N 3.34Å; K370-R374 WeakPolarHBondContact O-CB 3.25Å; K370-R374 PolarHBondContact O-N 3.48Å
371	R	84.8	Confident	79.5	Confident	157 Å²	157	78.6 Å²	78.6	59%	0.592	40%	0.399	S	S	*	.	H	α-helix	trans	-62.7	-47.6	175.4	-73.9	172.3	-174.6	-157.4	3.8	111.2	E367 S368 L369 K373 R374 L375	E367-R371 WeakPolarHBondContact O-CB 3.4Å; E367-R371 VanDerWaalsContact O-CG 3.23Å; E367-R371 WeakPolarHBondContact O-CG 3.31Å; E367-R371 PolarHBondContact O-N 3.49Å; E367-R371 IonicContact OE1-CZ 2.82Å; E367-R371 IonicContact OE1-NE 3.31Å; E367-R371 PolarHBondContact OE1-NE 3.28Å; E367-R371 IonicContact OE1-NH2 3.49Å; E367-R371 PolarHBondContact OE1-NH2 3.45Å; S368-R371 PolarHBondContact O-N 2.62Å; L369-R371 VanDerWaalsContact C-N 3.34Å; L369-R371 PolarHBondContact O-N 2.86Å; R371-K373 PolarHBondContact O-N 2.98Å; R371-R374 WeakPolarHBondContact O-CB 3.47Å; R371-R374 PolarHBondContact O-N 3.49Å; R371-R374 VanDerWaalsContact O-N 3.16Å; R371-L375 WeakPolarHBondContact O-CG 3.35Å; R371-L375 PolarHBondContact O-N 3.36Å
372	L	86	Confident	81.6	Confident	35 Å²	35	74.2 Å²	74.2	18%	0.183	37%	0.367	C	S	.	.	H	α-helix	trans	-59.6	-46.6	176.2	-72.6	177	0	0	0	112.1	F336 I339 M340 S368 L369 R374 L375 M376	F336-L372 HydrophobicContact CD1-CD2 4.04Å; F336-L372 HydrophobicContact CD2-CD2 4.27Å; F336-L372 HydrophobicContact CE1-CD2 4.13Å; F336-L372 HydrophobicContact CE2-CD2 4.37Å; F336-L372 HydrophobicContact CG-CD2 4.12Å; F336-L372 HydrophobicContact CZ-CD2 4.3Å; I339-L372 HydrophobicContact CG2-CD1 3.86Å; M340-L372 HydrophobicContact CG-CB 4.5Å; M340-L372 HydrophobicContact CG-CD1 4.48Å; M340-L372 HydrophobicContact SD-CB 4.47Å; S368-L372 PolarHBondContact O-N 3.46Å; L369-L372 PolarHBondContact O-N 2.87Å; L372-R374 VanDerWaalsContact C-N 3.26Å; L372-R374 PolarHBondContact O-N 2.94Å; L372-L375 WeakPolarHBondContact O-CB 3.36Å; L372-L375 PolarHBondContact O-N 2.7Å; L372-M376 WeakPolarHBondContact O-CG 3.4Å; L372-M376 PolarHBondContact O-N 3.34Å
373	K	88.1	Confident	83.7	Confident	132 Å²	132	66.8 Å²	66.8	57%	0.574	34%	0.338	S	S	*	.	H	α-helix	trans	-58.3	-39.4	175.5	-170.7	174	-177.2	175.9	0	111.7	M340 L369 K370 R371 M376 T377	M340-K373 HydrophobicContact CE-CB 4.35Å; L369-K373 WeakPolarHBondContact O-CB 3.3Å; L369-K373 PolarHBondContact O-N 3.16Å; K370-K373 PolarHBondContact O-N 3.34Å; R371-K373 PolarHBondContact O-N 2.98Å; K373-M376 WeakPolarHBondContact O-CB 3.34Å; K373-M376 PolarHBondContact O-N 2.98Å; K373-T377 WeakPolarHBondContact O-CG2 3.46Å; K373-T377 PolarHBondContact O-N 3.23Å; K373-T377 PolarHBondContact O-OG1 3.24Å
374	R	90.5	Very high	85.5	Confident	106 Å²	106	69.8 Å²	69.8	40%	0.4	34%	0.344	S	S	.	.	H	α-helix	trans	-65.4	-36.4	175.6	-165	176.9	-166.1	-156.7	-7.2	112.9	K370 R371 L372 T377 M378 T412 E416	K370-R374 WeakPolarHBondContact O-CB 3.25Å; K370-R374 PolarHBondContact O-N 3.48Å; R371-R374 WeakPolarHBondContact O-CB 3.47Å; R371-R374 PolarHBondContact O-N 3.49Å; R371-R374 VanDerWaalsContact O-N 3.16Å; L372-R374 VanDerWaalsContact C-N 3.26Å; L372-R374 PolarHBondContact O-N 2.94Å; R374-T377 WeakPolarHBondContact CA-OG1 3.28Å; R374-T377 PolarHBondContact O-OG1 3.21Å; R374-M378 WeakPolarHBondContact O-CG 3.38Å; R374-M378 PolarHBondContact O-N 3.04Å; R374-T412 HydrophobicContact CG-CG2 4.06Å; R374-E416 IonicContact CZ-OE1 2.8Å; R374-E416 IonicContact CZ-OE2 2.69Å; R374-E416 IonicContact NE-OE2 2.72Å; R374-E416 PolarHBondContact NE-OE2 3.22Å; R374-E416 VanDerWaalsContact NE-OE2 3.15Å; R374-E416 IonicContact NH1-OE1 3.43Å; R374-E416 PolarHBondContact NH1-OE1 2.71Å; R374-E416 IonicContact NH1-OE2 3.03Å; R374-E416 PolarHBondContact NH1-OE2 3.02Å; R374-E416 IonicContact NH2-OE1 2.93Å; R374-E416 PolarHBondContact NH2-OE1 3.46Å; R374-E416 IonicContact NH2-OE2 3.41Å; R374-E416 PolarHBondContact NH2-OE2 3.38Å
375	L	91.5	Very high	87	Confident	29 Å²	29	71.5 Å²	71.5	15%	0.152	34%	0.344	C	S	.	.	H	α-helix	trans	-65.8	-40.7	172.2	-61.1	-174.7	0	0	0	111.2	F336 R371 L372 M378 M379 L420	F336-L375 HydrophobicContact CD2-CB 4.28Å; F336-L375 HydrophobicContact CE2-CB 3.88Å; F336-L375 HydrophobicContact CE2-CD1 3.57Å; F336-L375 HydrophobicContact CE2-CG 4.39Å; F336-L375 HydrophobicContact CZ-CD1 3.92Å; R371-L375 WeakPolarHBondContact O-CG 3.35Å; R371-L375 PolarHBondContact O-N 3.36Å; L372-L375 WeakPolarHBondContact O-CB 3.36Å; L372-L375 PolarHBondContact O-N 2.7Å; L375-M378 HydrophobicContact CB-CE 4.5Å; L375-M378 HydrophobicContact CD2-CE 3.35Å; L375-M378 HydrophobicContact CG-CE 4.43Å; L375-M378 WeakPolarHBondContact O-CB 3.42Å; L375-M378 PolarHBondContact O-N 3.16Å; L375-M379 PolarHBondContact O-N 3.23Å; L375-M379 VanDerWaalsContact O-N 3.09Å; L375-L420 HydrophobicContact CB-CD1 4.09Å; L375-L420 HydrophobicContact CD1-CD1 4.44Å; L375-L420 HydrophobicContact CD2-CB 4.4Å; L375-L420 HydrophobicContact CD2-CD1 4.02Å; L375-L420 HydrophobicContact CG-CD1 4.38Å
376	M	91.5	Very high	88.3	Confident	20 Å²	20	67.5 Å²	67.5	10%	0.099	33%	0.325	C	S	.	.	H	α-helix	trans	-63.6	-45	176.1	-69.4	174.9	62.2	0	0	112.2	Y333 F336 Q337 M340 L372 K373 M378 M379 D380	Y333-M376 HydrophobicContact CD2-CB 4.31Å; Y333-M376 HydrophobicContact CD2-CG 4.17Å; Y333-M376 HydrophobicContact CE1-CE 4.1Å; Y333-M376 HydrophobicContact CE2-CB 3.77Å; Y333-M376 HydrophobicContact CE2-CE 3.9Å; Y333-M376 HydrophobicContact CE2-CG 3.99Å; F336-M376 HydrophobicContact CB-CG 4.16Å; F336-M376 HydrophobicContact CB-SD 4.16Å; F336-M376 HydrophobicContact CD2-CG 4.35Å; Q337-M376 HydrophobicContact CG-CE 3.41Å; Q337-M376 VanDerWaalsContact CG-CE 3.41Å; Q337-M376 HydrophobicContact CG-SD 4.38Å; M340-M376 HydrophobicContact SD-SD 3.41Å; L372-M376 WeakPolarHBondContact O-CG 3.4Å; L372-M376 PolarHBondContact O-N 3.34Å; K373-M376 WeakPolarHBondContact O-CB 3.34Å; K373-M376 PolarHBondContact O-N 2.98Å; M376-M378 PolarHBondContact O-N 2.85Å; M376-M379 HydrophobicContact CG-CE 4.2Å; M376-M379 CarbonylContact O-C 3.44Å; M376-M379 WeakPolarHBondContact O-CA 3.07Å; M376-M379 WeakPolarHBondContact O-CB 3.32Å; M376-M379 PolarHBondContact O-N 3.44Å; M376-D380 VanDerWaalsContact O-CG 3.22Å; M376-D380 PolarHBondContact O-N 2.89Å
377	T	94	Very high	89.4	Confident	50 Å²	50	61.9 Å²	61.9	31%	0.307	30%	0.3	S	S	.	.	H	α-helix	trans	-62.6	-28.9	176.8	55.4	0	0	0	0	112.9	K373 R374 D380 S381	K373-T377 WeakPolarHBondContact O-CG2 3.46Å; K373-T377 PolarHBondContact O-N 3.23Å; K373-T377 PolarHBondContact O-OG1 3.24Å; R374-T377 WeakPolarHBondContact CA-OG1 3.28Å; R374-T377 PolarHBondContact O-OG1 3.21Å; T377-D380 WeakPolarHBondContact CA-OD2 3.28Å; T377-S381 PolarHBondContact O-N 3.47Å; T377-S381 PolarHBondContact O-OG 2.93Å
378	M	94.1	Very high	90.1	Very high	2 Å²	2	61.7 Å²	61.7	1%	0.01	30%	0.301	C	S	.	.	H	α-helix	trans	-68.8	-40.8	170.4	-73.3	-171.2	-73.8	0	0	112.2	R374 L375 M376 S381 V406 T412 E416 V417 L420	R374-M378 WeakPolarHBondContact O-CG 3.38Å; R374-M378 PolarHBondContact O-N 3.04Å; L375-M378 HydrophobicContact CB-CE 4.5Å; L375-M378 HydrophobicContact CD2-CE 3.35Å; L375-M378 HydrophobicContact CG-CE 4.43Å; L375-M378 WeakPolarHBondContact O-CB 3.42Å; L375-M378 PolarHBondContact O-N 3.16Å; M376-M378 PolarHBondContact O-N 2.85Å; M378-S381 WeakPolarHBondContact O-CB 3.34Å; M378-S381 PolarHBondContact O-N 2.85Å; M378-V406 HydrophobicContact CB-CG1 4.28Å; M378-V406 WeakPolarHBondContact O-CG1 3.42Å; M378-T412 HydrophobicContact CG-CG2 4.06Å; M378-T412 HydrophobicContact SD-CG2 4.16Å; M378-T412 PolarHBondContact SD-OG1 3.4Å; M378-T412 VanDerWaalsContact SD-OG1 3.36Å; M378-E416 HydrophobicContact SD-CB 4.23Å; M378-V417 HydrophobicContact SD-CB 4.46Å; M378-V417 HydrophobicContact SD-CG2 3.86Å; M378-L420 HydrophobicContact CB-CD2 3.74Å; M378-L420 HydrophobicContact CE-CB 4.14Å; M378-L420 HydrophobicContact CE-CD2 4.33Å
379	M	92.9	Very high	90.7	Very high	1 Å²	1	61.6 Å²	61.6	1%	0.005	29%	0.293	C	S	.	.	H	α-helix	trans	-67.9	-34.4	174.6	-69.7	-173.3	-79.5	0	0	112.2	L329 M332 Y333 F336 L375 M376 S381 M382 L387 L420	L329-M379 HydrophobicContact CD2-SD 4.19Å; M332-M379 HydrophobicContact CE-CE 3.9Å; M332-M379 HydrophobicContact CE-SD 3.48Å; M332-M379 WeakPolarHBondContact CE-SD 3.46Å; Y333-M379 HydrophobicContact CD2-CB 3.77Å; Y333-M379 HydrophobicContact CD2-CE 3.73Å; Y333-M379 HydrophobicContact CD2-SD 4.09Å; Y333-M379 HydrophobicContact CE2-CB 4.26Å; Y333-M379 HydrophobicContact CG-CE 4.36Å; F336-M379 HydrophobicContact CD2-CE 3.51Å; F336-M379 HydrophobicContact CE2-CE 3.82Å; L375-M379 PolarHBondContact O-N 3.23Å; L375-M379 VanDerWaalsContact O-N 3.09Å; M376-M379 HydrophobicContact CG-CE 4.2Å; M376-M379 CarbonylContact O-C 3.44Å; M376-M379 WeakPolarHBondContact O-CA 3.07Å; M376-M379 WeakPolarHBondContact O-CB 3.32Å; M376-M379 PolarHBondContact O-N 3.44Å; M379-S381 PolarHBondContact O-N 3.2Å; M379-S381 VanDerWaalsContact O-N 3.16Å; M379-M382 HydrophobicContact CG-CE 4.48Å; M379-M382 VanDerWaalsContact O-CB 3.28Å; M379-M382 WeakPolarHBondContact O-CB 2.89Å; M379-M382 PolarHBondContact O-N 2.85Å; M379-L387 HydrophobicContact CB-CD2 4.14Å; M379-L420 HydrophobicContact CG-CD2 4.06Å
380	D	94.4	Very high	90.8	Very high	93 Å²	93	63.2 Å²	63.2	50%	0.497	30%	0.302	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.9	-21.2	173.6	-61.7	-27.2	0	0	0	112.2	Y333 M376 T377 M382	Y333-D380 WeakPolarHBondContact CE2-OD1 3.44Å; Y333-D380 VanDerWaalsContact CZ-OD1 3.29Å; Y333-D380 PolarHBondContact OH-OD1 3.33Å; M376-D380 VanDerWaalsContact O-CG 3.22Å; M376-D380 PolarHBondContact O-N 2.89Å; T377-D380 WeakPolarHBondContact CA-OD2 3.28Å; D380-M382 VanDerWaalsContact C-N 3.31Å
381	S	94.6	Very high	90.8	Very high	27 Å²	27	61.3 Å²	61.3	19%	0.189	29%	0.294	C	S	.	.	T	Hydrogen-bonded Turn	trans	-88.4	4.9	175.2	-60.8	0	0	0	0	113.8	T377 M378 M379 R405 S410	T377-S381 PolarHBondContact O-N 3.47Å; T377-S381 PolarHBondContact O-OG 2.93Å; M378-S381 WeakPolarHBondContact O-CB 3.34Å; M378-S381 PolarHBondContact O-N 2.85Å; M379-S381 PolarHBondContact O-N 3.2Å; M379-S381 VanDerWaalsContact O-N 3.16Å; S381-R405 PolarHBondContact O-NH2 3.2Å; S381-S410 PolarHBondContact OG-N 3.29Å
382	M	95	Very high	90.9	Very high	17 Å²	17	53.9 Å²	53.9	8%	0.084	27%	0.265	C	S	.	.	S	Bend	trans	-97.8	154.2	175.1	-58.4	-176.5	-168	0	0	110.7	L329 M379 D380 E386 L387 F396 V406 L420 M421	L329-M382 HydrophobicContact CD1-SD 3.71Å; M379-M382 HydrophobicContact CG-CE 4.48Å; M379-M382 VanDerWaalsContact O-CB 3.28Å; M379-M382 WeakPolarHBondContact O-CB 2.89Å; M379-M382 PolarHBondContact O-N 2.85Å; D380-M382 VanDerWaalsContact C-N 3.31Å; M382-E386 WeakPolarHBondContact CA-OE2 3.38Å; M382-E386 HydrophobicContact CB-CB 4.07Å; M382-E386 WeakPolarHBondContact CB-OE2 3.39Å; M382-L387 HydrophobicContact CB-CD2 3.93Å; M382-L387 HydrophobicContact CB-CG 3.93Å; M382-L387 HydrophobicContact SD-CD2 4.17Å; M382-F396 HydrophobicContact CE-CE1 4.5Å; M382-F396 HydrophobicContact CE-CZ 4.09Å; M382-F396 HydrophobicContact CG-CZ 4.11Å; M382-F396 HydrophobicContact SD-CE2 4.35Å; M382-F396 HydrophobicContact SD-CZ 3.86Å; M382-V406 HydrophobicContact CE-CG1 4.12Å; M382-V406 HydrophobicContact CE-CG2 4.34Å; M382-V406 HydrophobicContact CG-CG2 3.76Å; M382-L420 HydrophobicContact CE-CD2 3.63Å; M382-M421 HydrophobicContact CE-CE 3.25Å; M382-M421 HydrophobicContact SD-CE 3.84Å
383	N	94.1	Very high	90.8	Very high	66 Å²	66	55.6 Å²	55.6	35%	0.353	27%	0.27	S	S	.	.			trans	-90.6	166.2	173	59.6	39.1	0	0	0	111.5	H385 E386 L387	N383-H385 VanDerWaalsContact C-N 3.26Å; N383-H385 PolarHBondContact O-N 2.59Å; N383-H385 PolarHBondContact OD1-N 3.01Å; N383-E386 PolarHBondContact N-OE2 3.44Å; N383-E386 WeakPolarHBondContact O-CA 3.2Å; N383-E386 WeakPolarHBondContact O-CB 3.4Å; N383-E386 PolarHBondContact O-N 2.92Å; N383-E386 WeakPolarHBondContact OD1-CB 3.49Å; N383-E386 VanDerWaalsContact OD1-CD 3.28Å; N383-E386 WeakPolarHBondContact OD1-CG 3.49Å; N383-E386 PolarHBondContact OD1-N 3.25Å; N383-E386 PolarHBondContact OD1-OE2 3.04Å; N383-L387 PolarHBondContact O-N 3.23Å
384	D	93.6	Very high	90.8	Very high	104 Å²	104	53.6 Å²	53.6	56%	0.556	26%	0.263	S	S	*	.	H	α-helix	trans	-56.6	-40.8	-178.5	-62.8	-43.1	0	0	0	112.3	R330 E386 L387 D388	R330-D384 IonicContact CZ-OD1 2.93Å; R330-D384 IonicContact NH2-OD1 3.01Å; R330-D384 PolarHBondContact NH2-OD1 3.17Å; D384-E386 PolarHBondContact O-N 2.7Å; D384-L387 PolarHBondContact O-N 2.91Å; D384-D388 WeakPolarHBondContact O-CB 3.36Å; D384-D388 PolarHBondContact O-N 3.29Å; D384-D388 VanDerWaalsContact O-OD2 3.14Å
385	H	92.3	Very high	90.8	Very high	105 Å²	105	49.5 Å²	49.5	49%	0.486	25%	0.249	S	C	.	.	H	α-helix	trans	-59.1	-35.2	175.9	177.9	-75.1	0	0	0	112.7	N383 H389	N383-H385 VanDerWaalsContact C-N 3.26Å; N383-H385 PolarHBondContact O-N 2.59Å; N383-H385 PolarHBondContact OD1-N 3.01Å; H385-H389 AromaticContact CE1-CD2 3.71Å; H385-H389 WeakPolarHBondContact O-CB 3.2Å; H385-H389 PolarHBondContact O-N 3.32Å
386	E	92.7	Very high	90.7	Very high	0 Å²	0	48.1 Å²	48.1	0%	0	24%	0.241	C	C	.	.	H	α-helix	trans	-76.9	-39.2	176.4	-74.4	160.5	173.5	0	0	112.5	M382 N383 D384 L395 F396 R402 R405	M382-E386 WeakPolarHBondContact CA-OE2 3.38Å; M382-E386 HydrophobicContact CB-CB 4.07Å; M382-E386 WeakPolarHBondContact CB-OE2 3.39Å; N383-E386 PolarHBondContact N-OE2 3.44Å; N383-E386 WeakPolarHBondContact O-CA 3.2Å; N383-E386 WeakPolarHBondContact O-CB 3.4Å; N383-E386 PolarHBondContact O-N 2.92Å; N383-E386 WeakPolarHBondContact OD1-CB 3.49Å; N383-E386 VanDerWaalsContact OD1-CD 3.28Å; N383-E386 WeakPolarHBondContact OD1-CG 3.49Å; N383-E386 PolarHBondContact OD1-N 3.25Å; N383-E386 PolarHBondContact OD1-OE2 3.04Å; D384-E386 PolarHBondContact O-N 2.7Å; E386-L395 HydrophobicContact CB-CD2 4.4Å; E386-L395 HydrophobicContact CG-CD2 3.8Å; E386-F396 HydrophobicContact CB-CE2 3.93Å; E386-F396 HydrophobicContact CB-CZ 4.37Å; E386-F396 HydrophobicContact CG-CE2 3.75Å; E386-F396 HydrophobicContact CG-CZ 4.15Å; E386-R402 VanDerWaalsContact CG-NH1 3.34Å; E386-R402 WeakPolarHBondContact OE1-CD 3.45Å; E386-R402 IonicContact OE1-CZ 2.95Å; E386-R402 IonicContact OE1-NE 3.15Å; E386-R402 IonicContact OE1-NH1 3.65Å; E386-R402 PolarHBondContact OE1-NH1 3.04Å; E386-R405 VanDerWaalsContact CD-NH2 3.28Å; E386-R405 IonicContact OE1-CZ 2.98Å; E386-R405 IonicContact OE1-NH1 2.6Å; E386-R405 PolarHBondContact OE1-NH1 3.48Å; E386-R405 IonicContact OE1-NH2 2.69Å; E386-R405 PolarHBondContact OE1-NH2 3.11Å; E386-R405 VanDerWaalsContact OE1-NH2 3.14Å; E386-R405 IonicContact OE2-CZ 2.75Å; E386-R405 IonicContact OE2-NH1 2.73Å; E386-R405 IonicContact OE2-NH2 3.42Å; E386-R405 PolarHBondContact OE2-NH2 3.44Å
387	L	91.3	Very high	90.6	Very high	18 Å²	18	51.6 Å²	51.6	9%	0.094	26%	0.257	C	S	.	.	H	α-helix	trans	-69.1	-40.8	-178.7	-71.4	174.4	0	0	0	112	T328 L329 R330 M379 M382 N383 D384	T328-L387 WeakPolarHBondContact CB-O 3.38Å; L329-L387 HydrophobicContact CB-CD2 3.95Å; L329-L387 PolarHBondContact N-O 3Å; R330-L387 HydrophobicContact CB-CB 4.42Å; R330-L387 PolarHBondContact N-O 3.43Å; M379-L387 HydrophobicContact CB-CD2 4.14Å; M382-L387 HydrophobicContact CB-CD2 3.93Å; M382-L387 HydrophobicContact CB-CG 3.93Å; M382-L387 HydrophobicContact SD-CD2 4.17Å; N383-L387 PolarHBondContact O-N 3.23Å; D384-L387 PolarHBondContact O-N 2.91Å
388	D	90	Very high	90.5	Very high	72 Å²	72	57.3 Å²	57.3	39%	0.385	28%	0.278	S	S	.	.	S	Bend	trans	-93.3	-0.9	-174.7	-60.6	-44.5	0	0	0	113.1	R330 D384 L390	R330-D388 WeakPolarHBondContact CB-OD1 3.45Å; R330-D388 WeakPolarHBondContact CD-OD1 3.29Å; R330-D388 IonicContact CZ-OD1 3.86Å; R330-D388 IonicContact CZ-OD2 3.35Å; R330-D388 IonicContact NE-OD1 3.67Å; R330-D388 PolarHBondContact NE-OD1 3.18Å; R330-D388 IonicContact NE-OD2 3.64Å; R330-D388 PolarHBondContact NE-OD2 2.97Å; R330-D388 IonicContact NH2-OD1 2.59Å; R330-D388 IonicContact NH2-OD2 3.49Å; R330-D388 PolarHBondContact NH2-OD2 3.46Å; D384-D388 WeakPolarHBondContact O-CB 3.36Å; D384-D388 PolarHBondContact O-N 3.29Å; D384-D388 VanDerWaalsContact O-OD2 3.14Å; D388-L390 PolarHBondContact O-N 3.06Å
389	H	87.8	Confident	90.3	Very high	64 Å²	64	61.4 Å²	61.4	30%	0.296	30%	0.297	S	S	.	.			trans	-65.5	134.5	175.8	-153.6	-95.4	0	0	0	110.6	H385 K391 P392 L395	H385-H389 AromaticContact CE1-CD2 3.71Å; H385-H389 WeakPolarHBondContact O-CB 3.2Å; H385-H389 PolarHBondContact O-N 3.32Å; H389-K391 VanDerWaalsContact ND1-C 3.28Å; H389-K391 PolarHBondContact ND1-N 3.36Å; H389-K391 VanDerWaalsContact ND1-N 3.17Å; H389-K391 PolarHBondContact ND1-O 3.48Å; H389-K391 VanDerWaalsContact ND1-O 3.16Å; H389-K391 PolarHBondContact O-N 3.48Å; H389-P392 WeakPolarHBondContact O-CD 3.39Å; H389-L395 HydrophobicContact CB-CD2 4.32Å
390	L	83.2	Confident	90.3	Very high	88 Å²	88	65.3 Å²	65.3	46%	0.461	32%	0.323	S	S	.	.	S	Bend	trans	-67	-17	176.6	-66.3	176.1	0	0	0	113.9	Q326 T328 D388	Q326-L390 HydrophobicContact CB-CD2 3.7Å; Q326-L390 HydrophobicContact CG-CD2 3.73Å; T328-L390 HydrophobicContact CG2-CD2 4.39Å; D388-L390 PolarHBondContact O-N 3.06Å
391	K	85.4	Confident	90.2	Very high	102 Å²	102	65 Å²	65	44%	0.443	33%	0.328	S	S	.	.			trans	-141.2	64.9	-177.8	-60.1	-165.1	-177.6	-175.9	0	112	H389 Y393 E394 L395	H389-K391 VanDerWaalsContact ND1-C 3.28Å; H389-K391 PolarHBondContact ND1-N 3.36Å; H389-K391 VanDerWaalsContact ND1-N 3.17Å; H389-K391 PolarHBondContact ND1-O 3.48Å; H389-K391 VanDerWaalsContact ND1-O 3.16Å; H389-K391 PolarHBondContact O-N 3.48Å; K391-Y393 VanDerWaalsContact C-N 3.27Å; K391-Y393 PolarHBondContact O-N 2.98Å; K391-E394 HydrophobicContact CB-CB 4.28Å; K391-E394 HydrophobicContact CB-CG 4.33Å; K391-E394 HydrophobicContact CD-CG 4.33Å; K391-E394 WeakPolarHBondContact CD-OE1 3.46Å; K391-E394 VanDerWaalsContact CD-OE2 3.27Å; K391-E394 WeakPolarHBondContact CD-OE2 3.41Å; K391-E394 IonicContact NZ-OE1 3.62Å; K391-E394 PolarHBondContact NZ-OE1 2.69Å; K391-E394 IonicContact NZ-OE2 2.71Å; K391-E394 PolarHBondContact NZ-OE2 3.41Å; K391-E394 PolarHBondContact O-N 2.95Å; K391-L395 PolarHBondContact O-N 3.15Å
392	P	85.1	Confident	90.1	Very high	0 Å²	0	65.7 Å²	65.7	0%	0	33%	0.326	C	S	.	.	H	α-helix	trans	-64.7	-33.5	-173	25.9	-31.4	0	0	0	111.6	L329 H389 E394 L395 F396 M421 Y424	L329-P392 HydrophobicContact CD1-CB 3.45Å; L329-P392 VanDerWaalsContact CD1-CB 3.45Å; L329-P392 HydrophobicContact CD1-CG 3.71Å; L329-P392 HydrophobicContact CG-CB 4.1Å; L329-P392 HydrophobicContact CG-CG 3.78Å; H389-P392 WeakPolarHBondContact O-CD 3.39Å; P392-E394 VanDerWaalsContact C-N 3.33Å; P392-E394 PolarHBondContact O-N 3.06Å; P392-L395 WeakPolarHBondContact O-CB 3.49Å; P392-L395 PolarHBondContact O-N 2.72Å; P392-L395 VanDerWaalsContact O-N 3.16Å; P392-F396 VanDerWaalsContact O-CD2 3.28Å; P392-F396 WeakPolarHBondContact O-CD2 3.24Å; P392-F396 PolarHBondContact O-N 2.8Å; P392-M421 HydrophobicContact CB-SD 4.47Å; P392-Y424 VanDerWaalsContact CD-CZ 3.5Å; P392-Y424 VanDerWaalsContact CD-OH 3.25Å; P392-Y424 WeakPolarHBondContact CD-OH 3.37Å; P392-Y424 HydrophobicContact CG-CD1 3.72Å; P392-Y424 HydrophobicContact CG-CE1 3.23Å; P392-Y424 HydrophobicContact CG-CE2 4.09Å; P392-Y424 HydrophobicContact CG-CG 4.35Å; P392-Y424 VanDerWaalsContact CG-CZ 3.42Å
393	Y	85.5	Confident	90.1	Very high	72 Å²	72	65.2 Å²	65.2	28%	0.282	32%	0.324	S	S	.	.	H	α-helix	trans	-55.1	-46.3	173.8	-172.9	-88.9	0	0	0	112.2	K391 Q397 M421	K391-Y393 VanDerWaalsContact C-N 3.27Å; K391-Y393 PolarHBondContact O-N 2.98Å; Y393-Q397 HydrophobicContact CD1-CG 3.99Å; Y393-Q397 HydrophobicContact CE1-CG 3.68Å; Y393-Q397 WeakPolarHBondContact O-CB 3.33Å; Y393-Q397 WeakPolarHBondContact O-CG 3.28Å; Y393-Q397 PolarHBondContact O-N 2.78Å; Y393-Q397 PolarHBondContact OH-NE2 3.45Å; Y393-M421 HydrophobicContact CD2-CB 3.84Å; Y393-M421 HydrophobicContact CE2-CB 4.35Å
394	E	87.5	Confident	90	Very high	90 Å²	90	63.7 Å²	63.7	42%	0.421	32%	0.32	S	S	.	.	H	α-helix	trans	-67.8	-37.8	179.1	-66.5	-179.3	-165	0	0	111.7	K391 P392 Q397 K398	K391-E394 HydrophobicContact CB-CB 4.28Å; K391-E394 HydrophobicContact CB-CG 4.33Å; K391-E394 HydrophobicContact CD-CG 4.33Å; K391-E394 WeakPolarHBondContact CD-OE1 3.46Å; K391-E394 VanDerWaalsContact CD-OE2 3.27Å; K391-E394 WeakPolarHBondContact CD-OE2 3.41Å; K391-E394 IonicContact NZ-OE1 3.62Å; K391-E394 PolarHBondContact NZ-OE1 2.69Å; K391-E394 IonicContact NZ-OE2 2.71Å; K391-E394 PolarHBondContact NZ-OE2 3.41Å; K391-E394 PolarHBondContact O-N 2.95Å; P392-E394 VanDerWaalsContact C-N 3.33Å; P392-E394 PolarHBondContact O-N 3.06Å; E394-Q397 PolarHBondContact O-N 3.14Å; E394-K398 WeakPolarHBondContact O-CG 3.47Å; E394-K398 PolarHBondContact O-N 3.12Å
395	L	89.5	Confident	90.1	Very high	19 Å²	19	62.5 Å²	62.5	10%	0.099	31%	0.308	C	S	.	.	H	α-helix	trans	-61.1	-46.4	177.1	-179.2	67.6	0	0	0	111.7	E386 H389 K391 P392 K398 Q399	E386-L395 HydrophobicContact CB-CD2 4.4Å; E386-L395 HydrophobicContact CG-CD2 3.8Å; H389-L395 HydrophobicContact CB-CD2 4.32Å; K391-L395 PolarHBondContact O-N 3.15Å; P392-L395 WeakPolarHBondContact O-CB 3.49Å; P392-L395 PolarHBondContact O-N 2.72Å; P392-L395 VanDerWaalsContact O-N 3.16Å; L395-K398 PolarHBondContact O-N 3.35Å; L395-Q399 PolarHBondContact O-N 3.44Å; L395-Q399 VanDerWaalsContact O-N 3.09Å
396	F	91.3	Very high	90.3	Very high	0 Å²	0	57.5 Å²	57.5	0%	0	29%	0.285	C	S	.	.	H	α-helix	trans	-69.9	-31.6	178.5	-84.7	-110.9	0	0	0	112.6	M382 E386 P392 Q399 P400 R402 F403 V406 M421	M382-F396 HydrophobicContact CE-CE1 4.5Å; M382-F396 HydrophobicContact CE-CZ 4.09Å; M382-F396 HydrophobicContact CG-CZ 4.11Å; M382-F396 HydrophobicContact SD-CE2 4.35Å; M382-F396 HydrophobicContact SD-CZ 3.86Å; E386-F396 HydrophobicContact CB-CE2 3.93Å; E386-F396 HydrophobicContact CB-CZ 4.37Å; E386-F396 HydrophobicContact CG-CE2 3.75Å; E386-F396 HydrophobicContact CG-CZ 4.15Å; P392-F396 VanDerWaalsContact O-CD2 3.28Å; P392-F396 WeakPolarHBondContact O-CD2 3.24Å; P392-F396 PolarHBondContact O-N 2.8Å; F396-Q399 CarbonylContact O-C 3.19Å; F396-P400 WeakPolarHBondContact O-CA 3.43Å; F396-R402 HydrophobicContact CD1-CB 3.72Å; F396-R402 HydrophobicContact CE1-CB 3.73Å; F396-R402 HydrophobicContact CG-CB 4.22Å; F396-R402 HydrophobicContact CZ-CB 4.24Å; F396-F403 HydrophobicContact CB-CD2 4.27Å; F396-F403 HydrophobicContact CB-CE1 4.16Å; F396-F403 HydrophobicContact CB-CE2 3.66Å; F396-F403 HydrophobicContact CB-CZ 3.58Å; F396-F403 AromaticContact CD1-CD1 3.86Å; F396-F403 HydrophobicContact CD1-CD1 3.86Å; F396-F403 HydrophobicContact CD1-CD2 4.31Å; F396-F403 AromaticContact CD1-CE1 3.91Å; F396-F403 HydrophobicContact CD1-CE1 3.91Å; F396-F403 HydrophobicContact CD1-CE2 4.38Å; F396-F403 HydrophobicContact CD1-CG 4.05Å; F396-F403 HydrophobicContact CD1-CZ 4.18Å; F396-F403 HydrophobicContact CG-CE1 4.43Å; F396-F403 HydrophobicContact CG-CZ 4.33Å; F396-F403 WeakPolarHBondContact O-CE2 3.47Å; F396-V406 HydrophobicContact CE1-CG2 3.85Å; F396-V406 HydrophobicContact CZ-CG2 4.08Å; F396-M421 HydrophobicContact CD1-CE 4.04Å; F396-M421 HydrophobicContact CD2-CE 3.94Å; F396-M421 HydrophobicContact CD2-SD 4.35Å; F396-M421 HydrophobicContact CE1-CE 3.82Å; F396-M421 HydrophobicContact CE2-CE 3.7Å; F396-M421 HydrophobicContact CG-CE 4.09Å; F396-M421 HydrophobicContact CG-SD 4.43Å; F396-M421 HydrophobicContact CZ-CE 3.65Å
397	Q	89	Confident	90.4	Very high	93 Å²	93	57.9 Å²	57.9	44%	0.435	29%	0.288	S	S	.	.	H	α-helix	trans	-69.3	-40.4	172.9	-71.5	-67.7	-14.8	0	0	112.2	Y393 E394 Q399	Y393-Q397 HydrophobicContact CD1-CG 3.99Å; Y393-Q397 HydrophobicContact CE1-CG 3.68Å; Y393-Q397 WeakPolarHBondContact O-CB 3.33Å; Y393-Q397 WeakPolarHBondContact O-CG 3.28Å; Y393-Q397 PolarHBondContact O-N 2.78Å; Y393-Q397 PolarHBondContact OH-NE2 3.45Å; E394-Q397 PolarHBondContact O-N 3.14Å; Q397-Q399 VanDerWaalsContact C-N 3.29Å; Q397-Q399 PolarHBondContact O-N 2.84Å
398	K	90.9	Very high	90.6	Very high	170 Å²	170	66.5 Å²	66.5	74%	0.739	32%	0.319	S	S	*	.	H	α-helix	trans	-65.3	-33.2	175.4	-74.6	179.6	-178.4	-177.5	0	112.5	E394 L395	E394-K398 WeakPolarHBondContact O-CG 3.47Å; E394-K398 PolarHBondContact O-N 3.12Å; L395-K398 PolarHBondContact O-N 3.35Å
399	Q	91.3	Very high	90.8	Very high	89 Å²	89	65.8 Å²	65.8	42%	0.416	33%	0.329	S	S	.	.			trans	-128.8	80.8	179.9	-70.2	-179.8	-34.7	0	0	111.1	L395 F396 Q397 S401 R402	L395-Q399 PolarHBondContact O-N 3.44Å; L395-Q399 VanDerWaalsContact O-N 3.09Å; F396-Q399 CarbonylContact O-C 3.19Å; Q397-Q399 VanDerWaalsContact C-N 3.29Å; Q397-Q399 PolarHBondContact O-N 2.84Å; Q399-S401 PolarHBondContact O-N 3.36Å; Q399-R402 HydrophobicContact CB-CG 4.14Å; Q399-R402 WeakPolarHBondContact O-CB 3.3Å; Q399-R402 WeakPolarHBondContact O-CG 3.48Å; Q399-R402 PolarHBondContact O-N 2.96Å
400	P	91	Very high	91.1	Very high	83 Å²	83	63.8 Å²	63.8	54%	0.539	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-60.5	-20.2	-176.8	-25.7	35.3	0	0	0	114.6	F396 R402 F403	F396-P400 WeakPolarHBondContact O-CA 3.43Å; P400-R402 PolarHBondContact O-N 3.48Å; P400-F403 WeakPolarHBondContact O-CB 3.44Å; P400-F403 PolarHBondContact O-N 3.17Å
401	S	93.1	Very high	91.6	Very high	87 Å²	87	63 Å²	63	61%	0.608	34%	0.335	S	S	*	.	H	α-helix	trans	-57.3	-26.9	173.2	57	0	0	0	0	112.8	Q399 A404 R405	Q399-S401 PolarHBondContact O-N 3.36Å; S401-A404 PolarHBondContact O-N 3.49Å; S401-R405 PolarHBondContact O-N 3.45Å
402	R	93.5	Very high	92	Very high	40 Å²	40	58.6 Å²	58.6	15%	0.151	32%	0.317	C	S	.	.	H	α-helix	trans	-62.9	-39.8	174.7	-63.2	178.3	-177.8	-96.7	5.5	111.9	E386 F396 Q399 P400 A404 R405 V406	E386-R402 VanDerWaalsContact CG-NH1 3.34Å; E386-R402 WeakPolarHBondContact OE1-CD 3.45Å; E386-R402 IonicContact OE1-CZ 2.95Å; E386-R402 IonicContact OE1-NE 3.15Å; E386-R402 IonicContact OE1-NH1 3.65Å; E386-R402 PolarHBondContact OE1-NH1 3.04Å; F396-R402 HydrophobicContact CD1-CB 3.72Å; F396-R402 HydrophobicContact CE1-CB 3.73Å; F396-R402 HydrophobicContact CG-CB 4.22Å; F396-R402 HydrophobicContact CZ-CB 4.24Å; Q399-R402 HydrophobicContact CB-CG 4.14Å; Q399-R402 WeakPolarHBondContact O-CB 3.3Å; Q399-R402 WeakPolarHBondContact O-CG 3.48Å; Q399-R402 PolarHBondContact O-N 2.96Å; P400-R402 PolarHBondContact O-N 3.48Å; R402-A404 VanDerWaalsContact C-N 3.34Å; R402-A404 PolarHBondContact O-N 3.01Å; R402-R405 PolarHBondContact O-N 2.7Å; R402-V406 WeakPolarHBondContact O-CG2 3.3Å; R402-V406 PolarHBondContact O-N 3.4Å
403	F	93.6	Very high	92.4	Very high	7 Å²	7	61.7 Å²	61.7	3%	0.031	34%	0.337	C	S	.	.	H	α-helix	trans	-59.6	-44.8	174.9	-74.1	-70.4	0	0	0	111.8	F396 P400 R405 A407 I414 V417 K418 M421	F396-F403 HydrophobicContact CB-CD2 4.27Å; F396-F403 HydrophobicContact CB-CE1 4.16Å; F396-F403 HydrophobicContact CB-CE2 3.66Å; F396-F403 HydrophobicContact CB-CZ 3.58Å; F396-F403 AromaticContact CD1-CD1 3.86Å; F396-F403 HydrophobicContact CD1-CD1 3.86Å; F396-F403 HydrophobicContact CD1-CD2 4.31Å; F396-F403 AromaticContact CD1-CE1 3.91Å; F396-F403 HydrophobicContact CD1-CE1 3.91Å; F396-F403 HydrophobicContact CD1-CE2 4.38Å; F396-F403 HydrophobicContact CD1-CG 4.05Å; F396-F403 HydrophobicContact CD1-CZ 4.18Å; F396-F403 HydrophobicContact CG-CE1 4.43Å; F396-F403 HydrophobicContact CG-CZ 4.33Å; F396-F403 WeakPolarHBondContact O-CE2 3.47Å; P400-F403 WeakPolarHBondContact O-CB 3.44Å; P400-F403 PolarHBondContact O-N 3.17Å; F403-R405 VanDerWaalsContact C-N 3.35Å; F403-A407 WeakPolarHBondContact O-CB 3.47Å; F403-A407 PolarHBondContact O-N 2.96Å; F403-I414 HydrophobicContact CB-CG2 4.15Å; F403-V417 HydrophobicContact CD1-CB 4.1Å; F403-V417 HydrophobicContact CD1-CG1 3.71Å; F403-V417 HydrophobicContact CE1-CG1 4.3Å; F403-K418 HydrophobicContact CD1-CG 3.86Å; F403-K418 HydrophobicContact CE1-CB 4.34Å; F403-K418 HydrophobicContact CE1-CG 3.66Å; F403-K418 HydrophobicContact CG-CG 4.43Å; F403-K418 HydrophobicContact CZ-CG 4.04Å; F403-M421 HydrophobicContact CE1-CB 4.45Å; F403-M421 HydrophobicContact CE1-CG 3.8Å; F403-M421 HydrophobicContact CZ-CG 4.31Å
404	A	93.5	Very high	92.7	Very high	34 Å²	34	62 Å²	62	28%	0.281	34%	0.342	S	S	.	.	H	α-helix	trans	-69.6	-31.5	179.4	0	0	0	0	0	112.7	S401 R402 R408 I414	S401-A404 PolarHBondContact O-N 3.49Å; R402-A404 VanDerWaalsContact C-N 3.34Å; R402-A404 PolarHBondContact O-N 3.01Å; A404-R408 WeakPolarHBondContact O-CB 3.32Å; A404-R408 VanDerWaalsContact O-CG 3.31Å; A404-R408 WeakPolarHBondContact O-CG 3.48Å; A404-R408 PolarHBondContact O-N 2.96Å; A404-R408 PolarHBondContact O-NE 2.93Å; A404-I414 HydrophobicContact CB-CD1 4.23Å
405	R	95.4	Very high	93	Very high	80 Å²	80	63.2 Å²	63.2	30%	0.302	35%	0.351	S	S	.	.	H	α-helix	trans	-68.3	-50.7	173.8	-169.2	-156.7	70.4	-129.1	-10	111.2	S381 E386 S401 R402 F403 R408 G409	S381-R405 PolarHBondContact O-NH2 3.2Å; E386-R405 VanDerWaalsContact CD-NH2 3.28Å; E386-R405 IonicContact OE1-CZ 2.98Å; E386-R405 IonicContact OE1-NH1 2.6Å; E386-R405 PolarHBondContact OE1-NH1 3.48Å; E386-R405 IonicContact OE1-NH2 2.69Å; E386-R405 PolarHBondContact OE1-NH2 3.11Å; E386-R405 VanDerWaalsContact OE1-NH2 3.14Å; E386-R405 IonicContact OE2-CZ 2.75Å; E386-R405 IonicContact OE2-NH1 2.73Å; E386-R405 IonicContact OE2-NH2 3.42Å; E386-R405 PolarHBondContact OE2-NH2 3.44Å; S401-R405 PolarHBondContact O-N 3.45Å; R402-R405 PolarHBondContact O-N 2.7Å; F403-R405 VanDerWaalsContact C-N 3.35Å; R405-R408 PolarHBondContact O-N 2.95Å; R405-G409 PolarHBondContact O-N 3.04Å
406	V	95.4	Very high	93.2	Very high	0 Å²	0	64.1 Å²	64.1	0%	0	36%	0.355	C	S	.	.	H	α-helix	trans	-58.8	-50.6	178.9	171.7	0	0	0	0	110.3	M378 M382 F396 R402 R408 G409 S410 V417	M378-V406 HydrophobicContact CB-CG1 4.28Å; M378-V406 WeakPolarHBondContact O-CG1 3.42Å; M382-V406 HydrophobicContact CE-CG1 4.12Å; M382-V406 HydrophobicContact CE-CG2 4.34Å; M382-V406 HydrophobicContact CG-CG2 3.76Å; F396-V406 HydrophobicContact CE1-CG2 3.85Å; F396-V406 HydrophobicContact CZ-CG2 4.08Å; R402-V406 WeakPolarHBondContact O-CG2 3.3Å; R402-V406 PolarHBondContact O-N 3.4Å; V406-R408 VanDerWaalsContact C-N 3.3Å; V406-R408 PolarHBondContact O-N 3.34Å; V406-G409 PolarHBondContact O-N 3.41Å; V406-S410 PolarHBondContact O-N 3.47Å; V406-S410 PolarHBondContact O-OG 3.1Å; V406-V417 HydrophobicContact CB-CG1 3.99Å; V406-V417 HydrophobicContact CB-CG2 4.42Å; V406-V417 HydrophobicContact CG1-CB 4.46Å; V406-V417 HydrophobicContact CG1-CG1 3.63Å; V406-V417 HydrophobicContact CG1-CG2 3.89Å
407	A	95.3	Very high	93.3	Very high	7 Å²	7	64.1 Å²	64.1	6%	0.058	36%	0.355	C	S	.	.	H	α-helix	trans	-54	-43	178.4	0	0	0	0	0	113.3	F403 G411 T412 I414 V417	F403-A407 WeakPolarHBondContact O-CB 3.47Å; F403-A407 PolarHBondContact O-N 2.96Å; A407-G411 WeakPolarHBondContact O-CA 3.32Å; A407-G411 PolarHBondContact O-N 3.42Å; A407-T412 CarbonylContact C-O 3.52Å; A407-T412 WeakPolarHBondContact CA-O 3.44Å; A407-T412 VanDerWaalsContact CB-O 3.24Å; A407-T412 WeakPolarHBondContact CB-O 3.44Å; A407-T412 PolarHBondContact O-N 3.33Å; A407-T412 VanDerWaalsContact O-O 3.12Å; A407-I414 HydrophobicContact CB-CB 4.47Å; A407-I414 HydrophobicContact CB-CG1 3.66Å; A407-V417 HydrophobicContact CB-CG2 3.95Å
408	R	95.1	Very high	93.4	Very high	199 Å²	199	64.3 Å²	64.3	75%	0.751	35%	0.354	S	S	*	.	H	α-helix	trans	-68.2	-41.5	176.2	-75.4	-174.2	-64.7	154.5	-1.3	112.5	A404 R405 V406	A404-R408 WeakPolarHBondContact O-CB 3.32Å; A404-R408 VanDerWaalsContact O-CG 3.31Å; A404-R408 WeakPolarHBondContact O-CG 3.48Å; A404-R408 PolarHBondContact O-N 2.96Å; A404-R408 PolarHBondContact O-NE 2.93Å; R405-R408 PolarHBondContact O-N 2.95Å; V406-R408 VanDerWaalsContact C-N 3.3Å; V406-R408 PolarHBondContact O-N 3.34Å
409	G	94.5	Very high	93.5	Very high	57 Å²	57	59.9 Å²	59.9	59%	0.588	34%	0.336	S	S	*	.	H	α-helix	trans	-67.2	-36.5	179.3	0	0	0	0	0	113.1	R405 V406	R405-G409 PolarHBondContact O-N 3.04Å; V406-G409 PolarHBondContact O-N 3.41Å
410	S	93.8	Very high	93.5	Very high	23 Å²	23	55.7 Å²	55.7	16%	0.161	32%	0.317	C	S	.	.	H	α-helix	trans	-92.1	-6.9	-179.2	58.5	0	0	0	0	114.4	S381 V406 T412	S381-S410 PolarHBondContact OG-N 3.29Å; V406-S410 PolarHBondContact O-N 3.47Å; V406-S410 PolarHBondContact O-OG 3.1Å; S410-T412 PolarHBondContact O-N 2.82Å; S410-T412 PolarHBondContact OG-OG1 3.22Å
411	G	93.9	Very high	93.5	Very high	70 Å²	70	51.7 Å²	51.7	72%	0.722	29%	0.291	S	S	*	.	T	Hydrogen-bonded Turn	trans	64.2	25.5	-174.3	0	0	0	0	0	113.6	A407	A407-G411 WeakPolarHBondContact O-CA 3.32Å; A407-G411 PolarHBondContact O-N 3.42Å
412	T	93.3	Very high	93.3	Very high	11 Å²	11	52 Å²	52	7%	0.067	28%	0.283	C	S	.	.			trans	-109.8	153.2	-179.1	59.1	0	0	0	0	111.1	R374 M378 A407 S410	R374-T412 HydrophobicContact CG-CG2 4.06Å; M378-T412 HydrophobicContact CG-CG2 4.06Å; M378-T412 HydrophobicContact SD-CG2 4.16Å; M378-T412 PolarHBondContact SD-OG1 3.4Å; M378-T412 VanDerWaalsContact SD-OG1 3.36Å; A407-T412 CarbonylContact C-O 3.52Å; A407-T412 WeakPolarHBondContact CA-O 3.44Å; A407-T412 VanDerWaalsContact CB-O 3.24Å; A407-T412 WeakPolarHBondContact CB-O 3.44Å; A407-T412 PolarHBondContact O-N 3.33Å; A407-T412 VanDerWaalsContact O-O 3.12Å; S410-T412 PolarHBondContact O-N 2.82Å; S410-T412 PolarHBondContact OG-OG1 3.22Å
413	P	94	Very high	93	Very high	65 Å²	65	54 Å²	54	42%	0.422	29%	0.294	S	S	.	.			trans	-66.2	148.7	174.4	27.9	-34.4	0	0	0	110.8	L415 E416 V417	P413-L415 PolarHBondContact O-N 2.83Å; P413-E416 WeakPolarHBondContact CD-OE1 3.27Å; P413-E416 HydrophobicContact CG-CB 4.16Å; P413-E416 HydrophobicContact CG-CG 3.73Å; P413-E416 VanDerWaalsContact CG-OE1 3.28Å; P413-E416 WeakPolarHBondContact CG-OE1 3.37Å; P413-E416 PolarHBondContact O-N 3.49Å; P413-V417 PolarHBondContact O-N 3.49Å
414	I	93.1	Very high	92.8	Very high	78 Å²	78	54.2 Å²	54.2	40%	0.4	29%	0.294	S	S	.	.	H	α-helix	trans	-54.4	-32	178.9	-67.7	171.8	0	0	0	112	F403 A404 A407 E416 V417 K418	F403-I414 HydrophobicContact CB-CG2 4.15Å; A404-I414 HydrophobicContact CB-CD1 4.23Å; A407-I414 HydrophobicContact CB-CB 4.47Å; A407-I414 HydrophobicContact CB-CG1 3.66Å; I414-E416 VanDerWaalsContact C-N 3.34Å; I414-E416 PolarHBondContact O-N 3.17Å; I414-V417 PolarHBondContact O-N 3.31Å; I414-K418 HydrophobicContact CG2-CD 4.5Å; I414-K418 PolarHBondContact O-N 3.42Å; I414-K418 VanDerWaalsContact O-N 3.09Å
415	L	93.5	Very high	92.5	Very high	115 Å²	115	57.5 Å²	57.5	60%	0.602	30%	0.302	S	S	*	.	H	α-helix	trans	-60.8	-41.7	177.5	-172.2	66.1	0	0	0	112	P413 V417 K418 E419	P413-L415 PolarHBondContact O-N 2.83Å; L415-V417 VanDerWaalsContact C-N 3.34Å; L415-V417 PolarHBondContact O-N 2.89Å; L415-K418 WeakPolarHBondContact O-CB 3.42Å; L415-K418 PolarHBondContact O-N 3.48Å; L415-K418 VanDerWaalsContact O-N 3.14Å; L415-E419 WeakPolarHBondContact O-CG 3.19Å; L415-E419 PolarHBondContact O-N 2.88Å
416	E	92.5	Very high	92	Very high	39 Å²	39	60 Å²	60	18%	0.182	32%	0.315	C	S	.	.	H	α-helix	trans	-68.5	-34.2	179	-76.7	-179.7	-143.9	0	0	112.3	R374 M378 P413 I414 K418 E419 L420	R374-E416 IonicContact CZ-OE1 2.8Å; R374-E416 IonicContact CZ-OE2 2.69Å; R374-E416 IonicContact NE-OE2 2.72Å; R374-E416 PolarHBondContact NE-OE2 3.22Å; R374-E416 VanDerWaalsContact NE-OE2 3.15Å; R374-E416 IonicContact NH1-OE1 3.43Å; R374-E416 PolarHBondContact NH1-OE1 2.71Å; R374-E416 IonicContact NH1-OE2 3.03Å; R374-E416 PolarHBondContact NH1-OE2 3.02Å; R374-E416 IonicContact NH2-OE1 2.93Å; R374-E416 PolarHBondContact NH2-OE1 3.46Å; R374-E416 IonicContact NH2-OE2 3.41Å; R374-E416 PolarHBondContact NH2-OE2 3.38Å; M378-E416 HydrophobicContact SD-CB 4.23Å; P413-E416 WeakPolarHBondContact CD-OE1 3.27Å; P413-E416 HydrophobicContact CG-CB 4.16Å; P413-E416 HydrophobicContact CG-CG 3.73Å; P413-E416 VanDerWaalsContact CG-OE1 3.28Å; P413-E416 WeakPolarHBondContact CG-OE1 3.37Å; P413-E416 PolarHBondContact O-N 3.49Å; I414-E416 VanDerWaalsContact C-N 3.34Å; I414-E416 PolarHBondContact O-N 3.17Å; E416-K418 VanDerWaalsContact C-N 3.29Å; E416-K418 PolarHBondContact O-N 2.88Å; E416-E419 WeakPolarHBondContact O-CB 3.32Å; E416-E419 PolarHBondContact O-N 3.17Å; E416-L420 PolarHBondContact O-N 3.07Å
417	V	93.1	Very high	91.4	Very high	0 Å²	0	63.2 Å²	63.2	0%	0	33%	0.329	C	S	.	.	H	α-helix	trans	-65.9	-36.9	173.2	-171.2	0	0	0	0	110.5	M378 F403 V406 A407 P413 I414 L415 L420 M421	M378-V417 HydrophobicContact SD-CB 4.46Å; M378-V417 HydrophobicContact SD-CG2 3.86Å; F403-V417 HydrophobicContact CD1-CB 4.1Å; F403-V417 HydrophobicContact CD1-CG1 3.71Å; F403-V417 HydrophobicContact CE1-CG1 4.3Å; V406-V417 HydrophobicContact CB-CG1 3.99Å; V406-V417 HydrophobicContact CB-CG2 4.42Å; V406-V417 HydrophobicContact CG1-CB 4.46Å; V406-V417 HydrophobicContact CG1-CG1 3.63Å; V406-V417 HydrophobicContact CG1-CG2 3.89Å; A407-V417 HydrophobicContact CB-CG2 3.95Å; P413-V417 PolarHBondContact O-N 3.49Å; I414-V417 PolarHBondContact O-N 3.31Å; L415-V417 VanDerWaalsContact C-N 3.34Å; L415-V417 PolarHBondContact O-N 2.89Å; V417-L420 PolarHBondContact O-N 3.27Å; V417-M421 WeakPolarHBondContact O-CG 3.47Å; V417-M421 PolarHBondContact O-N 3.48Å; V417-M421 VanDerWaalsContact O-N 3.17Å
418	K	92.5	Very high	90.8	Very high	96 Å²	96	63.1 Å²	63.1	42%	0.417	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-39.2	172.6	-70.4	177.6	177.9	-178.3	0	111.7	F403 I414 L415 E416 M421 Q422	F403-K418 HydrophobicContact CD1-CG 3.86Å; F403-K418 HydrophobicContact CE1-CB 4.34Å; F403-K418 HydrophobicContact CE1-CG 3.66Å; F403-K418 HydrophobicContact CG-CG 4.43Å; F403-K418 HydrophobicContact CZ-CG 4.04Å; I414-K418 HydrophobicContact CG2-CD 4.5Å; I414-K418 PolarHBondContact O-N 3.42Å; I414-K418 VanDerWaalsContact O-N 3.09Å; L415-K418 WeakPolarHBondContact O-CB 3.42Å; L415-K418 PolarHBondContact O-N 3.48Å; L415-K418 VanDerWaalsContact O-N 3.14Å; E416-K418 VanDerWaalsContact C-N 3.29Å; E416-K418 PolarHBondContact O-N 2.88Å; K418-M421 PolarHBondContact O-N 2.84Å; K418-Q422 WeakPolarHBondContact O-CG 3.4Å; K418-Q422 PolarHBondContact O-N 3.41Å
419	E	91.8	Very high	90.1	Very high	78 Å²	78	57 Å²	57	36%	0.364	31%	0.311	S	S	.	.	H	α-helix	trans	-63.7	-43.3	174.2	-71.9	173.9	-179.4	0	0	111.9	L415 E416 M421 Q422 H423	L415-E419 WeakPolarHBondContact O-CG 3.19Å; L415-E419 PolarHBondContact O-N 2.88Å; E416-E419 WeakPolarHBondContact O-CB 3.32Å; E416-E419 PolarHBondContact O-N 3.17Å; E419-M421 VanDerWaalsContact C-N 3.27Å; E419-M421 PolarHBondContact O-N 3.18Å; E419-Q422 CarbonylContact O-C 3.56Å; E419-Q422 WeakPolarHBondContact O-CA 3.3Å; E419-Q422 WeakPolarHBondContact O-CB 3.4Å; E419-Q422 PolarHBondContact O-N 3.42Å; E419-H423 VanDerWaalsContact O-CG 3.24Å; E419-H423 PolarHBondContact O-N 3.42Å; E419-H423 PolarHBondContact O-ND1 3.25Å
420	L	92	Very high	89.4	Confident	0 Å²	0	60.5 Å²	60.5	0%	0	31%	0.313	C	S	.	.	H	α-helix	trans	-53.5	-46.2	172.5	171.1	66.6	0	0	0	111.1	M332 L375 M378 M379 M382 E416 V417 Q422 H423 Y424	M332-L420 HydrophobicContact CE-CD1 3.63Å; L375-L420 HydrophobicContact CB-CD1 4.09Å; L375-L420 HydrophobicContact CD1-CD1 4.44Å; L375-L420 HydrophobicContact CD2-CB 4.4Å; L375-L420 HydrophobicContact CD2-CD1 4.02Å; L375-L420 HydrophobicContact CG-CD1 4.38Å; M378-L420 HydrophobicContact CB-CD2 3.74Å; M378-L420 HydrophobicContact CE-CB 4.14Å; M378-L420 HydrophobicContact CE-CD2 4.33Å; M379-L420 HydrophobicContact CG-CD2 4.06Å; M382-L420 HydrophobicContact CE-CD2 3.63Å; E416-L420 PolarHBondContact O-N 3.07Å; V417-L420 PolarHBondContact O-N 3.27Å; L420-Q422 VanDerWaalsContact C-N 3.32Å; L420-Q422 PolarHBondContact O-N 3.47Å; L420-H423 PolarHBondContact O-N 3.27Å; L420-Y424 PolarHBondContact O-N 3.2Å
421	M	90.3	Very high	88.5	Confident	0 Å²	0	60 Å²	60	0%	0	31%	0.309	C	S	.	.	H	α-helix	trans	-66	-34.4	178.4	-68.5	-65.7	157.9	0	0	112.6	L329 M382 P392 Y393 F396 F403 V417 K418 E419 K425	L329-M421 HydrophobicContact CD1-CE 3.81Å; L329-M421 HydrophobicContact CD1-SD 4.22Å; M382-M421 HydrophobicContact CE-CE 3.25Å; M382-M421 HydrophobicContact SD-CE 3.84Å; P392-M421 HydrophobicContact CB-SD 4.47Å; Y393-M421 HydrophobicContact CD2-CB 3.84Å; Y393-M421 HydrophobicContact CE2-CB 4.35Å; F396-M421 HydrophobicContact CD1-CE 4.04Å; F396-M421 HydrophobicContact CD2-CE 3.94Å; F396-M421 HydrophobicContact CD2-SD 4.35Å; F396-M421 HydrophobicContact CE1-CE 3.82Å; F396-M421 HydrophobicContact CE2-CE 3.7Å; F396-M421 HydrophobicContact CG-CE 4.09Å; F396-M421 HydrophobicContact CG-SD 4.43Å; F396-M421 HydrophobicContact CZ-CE 3.65Å; F403-M421 HydrophobicContact CE1-CB 4.45Å; F403-M421 HydrophobicContact CE1-CG 3.8Å; F403-M421 HydrophobicContact CZ-CG 4.31Å; V417-M421 WeakPolarHBondContact O-CG 3.47Å; V417-M421 PolarHBondContact O-N 3.48Å; V417-M421 VanDerWaalsContact O-N 3.17Å; K418-M421 PolarHBondContact O-N 2.84Å; E419-M421 VanDerWaalsContact C-N 3.27Å; E419-M421 PolarHBondContact O-N 3.18Å; M421-K425 PolarHBondContact O-N 3.43Å
422	Q	89.3	Confident	87.6	Confident	93 Å²	93	61.6 Å²	61.6	44%	0.435	30%	0.296	S	S	.	.	H	α-helix	trans	-69.5	-40	172.6	-69.6	178.4	9	0	0	112	K418 E419 L420 K425 K426	K418-Q422 WeakPolarHBondContact O-CG 3.4Å; K418-Q422 PolarHBondContact O-N 3.41Å; E419-Q422 CarbonylContact O-C 3.56Å; E419-Q422 WeakPolarHBondContact O-CA 3.3Å; E419-Q422 WeakPolarHBondContact O-CB 3.4Å; E419-Q422 PolarHBondContact O-N 3.42Å; L420-Q422 VanDerWaalsContact C-N 3.32Å; L420-Q422 PolarHBondContact O-N 3.47Å; Q422-K425 PolarHBondContact O-N 3.43Å; Q422-K426 WeakPolarHBondContact O-CG 3.44Å; Q422-K426 PolarHBondContact O-N 2.9Å
423	H	87	Confident	86.8	Confident	83 Å²	83	67.6 Å²	67.6	38%	0.384	32%	0.322	S	S	.	.	H	α-helix	trans	-62.4	-47.2	174.9	-65.9	159.5	0	0	0	110.9	E419 L420 K425 K426 F427	E419-H423 VanDerWaalsContact O-CG 3.24Å; E419-H423 PolarHBondContact O-N 3.42Å; E419-H423 PolarHBondContact O-ND1 3.25Å; L420-H423 PolarHBondContact O-N 3.27Å; H423-K425 VanDerWaalsContact C-N 3.33Å; H423-K425 PolarHBondContact O-N 2.77Å; H423-K426 PolarHBondContact O-N 3.25Å; H423-F427 WeakPolarHBondContact O-CB 3.49Å; H423-F427 PolarHBondContact O-N 3.03Å
424	Y	89.2	Confident	85.6	Confident	11 Å²	11	70.2 Å²	70.2	4%	0.043	33%	0.329	C	S	.	.	H	α-helix	trans	-55.3	-47.2	172.7	164.6	-93.2	0	0	0	111.4	F327 L329 M332 P392 L420 K426 F427 A428	F327-Y424 HydrophobicContact CD1-CD2 4.29Å; F327-Y424 AromaticContact CD1-CE2 3.72Å; F327-Y424 HydrophobicContact CD1-CE2 3.72Å; F327-Y424 HydrophobicContact CE1-CD2 4.11Å; F327-Y424 AromaticContact CE1-CE2 3.98Å; F327-Y424 HydrophobicContact CE1-CE2 3.98Å; F327-Y424 PolarHBondContact O-OH 3.4Å; L329-Y424 HydrophobicContact CD2-CD2 3.61Å; L329-Y424 HydrophobicContact CD2-CE2 4.39Å; L329-Y424 HydrophobicContact CD2-CG 3.77Å; L329-Y424 HydrophobicContact CG-CD2 3.95Å; L329-Y424 HydrophobicContact CG-CE2 4.25Å; L329-Y424 HydrophobicContact CG-CG 4.28Å; M332-Y424 HydrophobicContact SD-CD2 4.07Å; M332-Y424 HydrophobicContact SD-CG 4.49Å; P392-Y424 VanDerWaalsContact CD-CZ 3.5Å; P392-Y424 VanDerWaalsContact CD-OH 3.25Å; P392-Y424 WeakPolarHBondContact CD-OH 3.37Å; P392-Y424 HydrophobicContact CG-CD1 3.72Å; P392-Y424 HydrophobicContact CG-CE1 3.23Å; P392-Y424 HydrophobicContact CG-CE2 4.09Å; P392-Y424 HydrophobicContact CG-CG 4.35Å; P392-Y424 VanDerWaalsContact CG-CZ 3.42Å; L420-Y424 PolarHBondContact O-N 3.2Å; Y424-K426 PolarHBondContact O-N 3.18Å; Y424-F427 PolarHBondContact O-N 3.33Å; Y424-F427 VanDerWaalsContact O-N 3.14Å; Y424-A428 HydrophobicContact CE1-CB 4.28Å; Y424-A428 HydrophobicContact CE2-CB 4.33Å; Y424-A428 VanDerWaalsContact O-CB 3.32Å; Y424-A428 WeakPolarHBondContact O-CB 3.49Å; Y424-A428 PolarHBondContact O-N 2.93Å
425	K	86.8	Confident	84.3	Confident	102 Å²	102	68.2 Å²	68.2	44%	0.443	33%	0.328	S	S	.	.	H	α-helix	trans	-58.8	-46.7	179.4	-175.6	178.5	178.6	179.7	0	111.8	M421 Q422 H423 F427 A428 D429	M421-K425 PolarHBondContact O-N 3.43Å; Q422-K425 PolarHBondContact O-N 3.43Å; H423-K425 VanDerWaalsContact C-N 3.33Å; H423-K425 PolarHBondContact O-N 2.77Å; K425-F427 VanDerWaalsContact C-N 3.31Å; K425-F427 PolarHBondContact O-N 3.14Å; K425-A428 PolarHBondContact O-N 3.4Å; K425-D429 WeakPolarHBondContact O-CB 3.2Å; K425-D429 PolarHBondContact O-N 3.33Å
426	K	85.3	Confident	82.7	Confident	134 Å²	134	67.2 Å²	67.2	58%	0.583	33%	0.331	S	S	*	.	H	α-helix	trans	-60.6	-41.4	176.4	-69.9	173.6	-177.3	176.2	0	111.6	Q422 H423 Y424 M430	Q422-K426 WeakPolarHBondContact O-CG 3.44Å; Q422-K426 PolarHBondContact O-N 2.9Å; H423-K426 PolarHBondContact O-N 3.25Å; Y424-K426 PolarHBondContact O-N 3.18Å; K426-M430 PolarHBondContact O-N 3.49Å
427	F	82.8	Confident	81	Confident	66 Å²	66	69.1 Å²	69.1	29%	0.289	34%	0.341	S	S	.	.	H	α-helix	trans	-68.3	-46.2	179.5	-159.7	-80.9	0	0	0	111.6	F327 H423 Y424 K425 D429 M430 V431	F327-F427 HydrophobicContact CD1-CD1 4.28Å; F327-F427 AromaticContact CE1-CD1 3.39Å; F327-F427 HydrophobicContact CE1-CD1 3.39Å; F327-F427 AromaticContact CE1-CE1 3.99Å; F327-F427 HydrophobicContact CE1-CE1 3.99Å; F327-F427 HydrophobicContact CE1-CG 4.33Å; F327-F427 HydrophobicContact CE2-CD1 4.07Å; F327-F427 AromaticContact CE2-CE1 3.83Å; F327-F427 HydrophobicContact CE2-CE1 3.83Å; F327-F427 AromaticContact CZ-CD1 3.25Å; F327-F427 HydrophobicContact CZ-CD1 3.25Å; F327-F427 AromaticContact CZ-CE1 3.33Å; F327-F427 HydrophobicContact CZ-CE1 3.33Å; F327-F427 HydrophobicContact CZ-CG 4.41Å; H423-F427 WeakPolarHBondContact O-CB 3.49Å; H423-F427 PolarHBondContact O-N 3.03Å; Y424-F427 PolarHBondContact O-N 3.33Å; Y424-F427 VanDerWaalsContact O-N 3.14Å; K425-F427 VanDerWaalsContact C-N 3.31Å; K425-F427 PolarHBondContact O-N 3.14Å; F427-D429 VanDerWaalsContact C-N 3.32Å; F427-D429 PolarHBondContact O-N 2.88Å; F427-M430 WeakPolarHBondContact O-CB 3.47Å; F427-M430 PolarHBondContact O-N 3.15Å; F427-M430 VanDerWaalsContact O-N 3.17Å; F427-V431 HydrophobicContact CD1-CG2 3.79Å; F427-V431 HydrophobicContact CE1-CG2 3.69Å; F427-V431 WeakPolarHBondContact O-CB 3.35Å; F427-V431 WeakPolarHBondContact O-CG2 3.39Å; F427-V431 PolarHBondContact O-N 2.61Å
428	A	82.6	Confident	78.8	Confident	5 Å²	5	74 Å²	74	4%	0.041	36%	0.362	C	S	.	.	H	α-helix	trans	-60.3	-39.9	175.5	0	0	0	0	0	111.9	F327 Y424 K425 V431 K432	F327-A428 HydrophobicContact CD1-CB 3.96Å; Y424-A428 HydrophobicContact CE1-CB 4.28Å; Y424-A428 HydrophobicContact CE2-CB 4.33Å; Y424-A428 VanDerWaalsContact O-CB 3.32Å; Y424-A428 WeakPolarHBondContact O-CB 3.49Å; Y424-A428 PolarHBondContact O-N 2.93Å; K425-A428 PolarHBondContact O-N 3.4Å; A428-V431 PolarHBondContact O-N 2.72Å; A428-K432 WeakPolarHBondContact O-CB 3.4Å; A428-K432 VanDerWaalsContact O-CG 3.3Å; A428-K432 WeakPolarHBondContact O-CG 3.43Å; A428-K432 PolarHBondContact O-N 3.22Å
429	D	82	Confident	76.7	Confident	71 Å²	71	73 Å²	73	38%	0.38	38%	0.379	S	S	.	.	H	α-helix	trans	-65.8	-38.9	175.8	-72.5	-20.1	0	0	0	111.8	K425 F427 K433	K425-D429 WeakPolarHBondContact O-CB 3.2Å; K425-D429 PolarHBondContact O-N 3.33Å; F427-D429 VanDerWaalsContact C-N 3.32Å; F427-D429 PolarHBondContact O-N 2.88Å; D429-K433 VanDerWaalsContact O-CG 3.32Å; D429-K433 WeakPolarHBondContact O-CG 3.4Å; D429-K433 PolarHBondContact O-N 2.89Å
430	M	78.7	Confident	74.4	Confident	130 Å²	130	74.4 Å²	74.4	64%	0.64	39%	0.388	S	S	*	.	H	α-helix	trans	-65.1	-45.9	174.5	-172.9	-175.9	-60.2	0	0	111.4	K426 F427 K432 K433 M434	K426-M430 PolarHBondContact O-N 3.49Å; F427-M430 WeakPolarHBondContact O-CB 3.47Å; F427-M430 PolarHBondContact O-N 3.15Å; F427-M430 VanDerWaalsContact O-N 3.17Å; M430-K432 PolarHBondContact O-N 3.03Å; M430-K433 WeakPolarHBondContact O-CB 3.37Å; M430-K433 PolarHBondContact O-N 3.25Å; M430-M434 PolarHBondContact O-N 3.05Å
431	V	74.5	Confident	72.1	Confident	13 Å²	13	81.8 Å²	81.8	8%	0.079	42%	0.42	C	S	.	.	H	α-helix	trans	-59.2	-45.6	176	159.6	0	0	0	0	111.4	L322 F327 F427 A428 K433 M434 G435	L322-V431 HydrophobicContact CD2-CB 4.32Å; L322-V431 HydrophobicContact CD2-CG1 3.2Å; L322-V431 HydrophobicContact CD2-CG2 4.22Å; F327-V431 HydrophobicContact CB-CG1 3.93Å; F327-V431 HydrophobicContact CD2-CG1 4.1Å; F327-V431 HydrophobicContact CD2-CG2 4.1Å; F327-V431 HydrophobicContact CE2-CG2 4.23Å; F327-V431 HydrophobicContact CG-CB 4.42Å; F327-V431 HydrophobicContact CG-CG1 4.11Å; F327-V431 HydrophobicContact CG-CG2 4.35Å; F427-V431 HydrophobicContact CD1-CG2 3.79Å; F427-V431 HydrophobicContact CE1-CG2 3.69Å; F427-V431 WeakPolarHBondContact O-CB 3.35Å; F427-V431 WeakPolarHBondContact O-CG2 3.39Å; F427-V431 PolarHBondContact O-N 2.61Å; A428-V431 PolarHBondContact O-N 2.72Å; V431-K433 VanDerWaalsContact C-N 3.35Å; V431-K433 PolarHBondContact O-N 2.93Å; V431-M434 PolarHBondContact O-N 3.03Å; V431-G435 PolarHBondContact O-N 3.3Å
432	K	75.7	Confident	69.6	Low	103 Å²	103	90.1 Å²	90.1	45%	0.448	46%	0.457	S	S	.	.	H	α-helix	trans	-61.3	-42.4	175.6	-76.4	174.4	-178	176.4	0	112.1	A428 M430 M434 G435 S436	A428-K432 WeakPolarHBondContact O-CB 3.4Å; A428-K432 VanDerWaalsContact O-CG 3.3Å; A428-K432 WeakPolarHBondContact O-CG 3.43Å; A428-K432 PolarHBondContact O-N 3.22Å; M430-K432 PolarHBondContact O-N 3.03Å; K432-M434 VanDerWaalsContact C-N 3.33Å; K432-M434 PolarHBondContact O-N 3.4Å; K432-G435 PolarHBondContact O-N 2.79Å; K432-S436 PolarHBondContact O-N 3.45Å; K432-S436 PolarHBondContact O-OG 3.5Å
433	K	76.9	Confident	67.1	Low	138 Å²	138	89.5 Å²	89.5	60%	0.6	48%	0.475	S	S	*	.	H	α-helix	trans	-61.6	-41.6	174.2	-75.3	176.2	-178.6	-178.6	0	111.4	D429 M430 V431 S436 M437	D429-K433 VanDerWaalsContact O-CG 3.32Å; D429-K433 WeakPolarHBondContact O-CG 3.4Å; D429-K433 PolarHBondContact O-N 2.89Å; M430-K433 WeakPolarHBondContact O-CB 3.37Å; M430-K433 PolarHBondContact O-N 3.25Å; V431-K433 VanDerWaalsContact C-N 3.35Å; V431-K433 PolarHBondContact O-N 2.93Å; K433-S436 WeakPolarHBondContact CA-OG 3.41Å; K433-S436 PolarHBondContact O-N 3.09Å; K433-S436 PolarHBondContact O-OG 3.34Å; K433-M437 HydrophobicContact CB-CE 4.32Å; K433-M437 PolarHBondContact O-N 3Å
434	M	68.8	Low	64.5	Low	119 Å²	119	89 Å²	89	59%	0.586	49%	0.493	S	S	*	.	H	α-helix	trans	-67	-42.3	177.5	-165	170.8	75.3	0	0	112.3	M430 V431 K432 S436 M437 K438	M430-M434 PolarHBondContact O-N 3.05Å; V431-M434 PolarHBondContact O-N 3.03Å; K432-M434 VanDerWaalsContact C-N 3.33Å; K432-M434 PolarHBondContact O-N 3.4Å; M434-S436 VanDerWaalsContact C-N 3.31Å; M434-S436 PolarHBondContact O-N 3.05Å; M434-M437 WeakPolarHBondContact O-CB 3.43Å; M434-M437 PolarHBondContact O-N 3.39Å; M434-M437 VanDerWaalsContact O-N 3.1Å; M434-K438 PolarHBondContact O-N 3.05Å
435	G	65.6	Low	61.8	Low	36 Å²	36	95.2 Å²	95.2	37%	0.371	53%	0.527	S	S	.	.	H	α-helix	trans	-58.6	-41.6	172.5	0	0	0	0	0	112.2	V431 K432 M437 K438	V431-G435 PolarHBondContact O-N 3.3Å; K432-G435 PolarHBondContact O-N 2.79Å; G435-M437 VanDerWaalsContact C-N 3.33Å; G435-M437 PolarHBondContact O-N 3.02Å; G435-K438 WeakPolarHBondContact O-CB 3.47Å; G435-K438 PolarHBondContact O-N 3.31Å
436	S	59.4	Low	59.5	Low	94 Å²	94	97.3 Å²	97.3	66%	0.657	54%	0.542	S	S	*	.	H	α-helix	trans	-70.2	-25.8	175	71	0	0	0	0	114	K432 K433 M434 K438	K432-S436 PolarHBondContact O-N 3.45Å; K432-S436 PolarHBondContact O-OG 3.5Å; K433-S436 WeakPolarHBondContact CA-OG 3.41Å; K433-S436 PolarHBondContact O-N 3.09Å; K433-S436 PolarHBondContact O-OG 3.34Å; M434-S436 VanDerWaalsContact C-N 3.31Å; M434-S436 PolarHBondContact O-N 3.05Å; S436-K438 VanDerWaalsContact C-N 3.26Å; S436-K438 PolarHBondContact O-N 3.17Å
437	M	56.2	Low	57	Low	80 Å²	80	94.8 Å²	94.8	39%	0.394	54%	0.541	S	S	.	.	H	α-helix	trans	-74.7	-11.1	175.9	-100	-179	-81.9	0	0	113.4	K433 M434 G435 G439 L440 F441	K433-M437 HydrophobicContact CB-CE 4.32Å; K433-M437 PolarHBondContact O-N 3Å; M434-M437 WeakPolarHBondContact O-CB 3.43Å; M434-M437 PolarHBondContact O-N 3.39Å; M434-M437 VanDerWaalsContact O-N 3.1Å; G435-M437 VanDerWaalsContact C-N 3.33Å; G435-M437 PolarHBondContact O-N 3.02Å; M437-G439 PolarHBondContact O-N 2.85Å; M437-G439 VanDerWaalsContact O-N 3.12Å; M437-L440 WeakPolarHBondContact O-CA 3.27Å; M437-L440 WeakPolarHBondContact O-CB 3.47Å; M437-L440 PolarHBondContact O-N 2.89Å; M437-F441 HydrophobicContact CB-CD2 4.47Å; M437-F441 PolarHBondContact O-N 3.23Å
438	K	48.3	Very low	55	Low	103 Å²	103	97.4 Å²	97.4	45%	0.448	57%	0.567	S	S	.	*	H	α-helix	trans	-68.3	-9.9	179.9	-141.5	175	-173.6	174.5	0	113.8	M434 G435 S436 L440 F441 K442	M434-K438 PolarHBondContact O-N 3.05Å; G435-K438 WeakPolarHBondContact O-CB 3.47Å; G435-K438 PolarHBondContact O-N 3.31Å; S436-K438 VanDerWaalsContact C-N 3.26Å; S436-K438 PolarHBondContact O-N 3.17Å; K438-L440 PolarHBondContact O-N 3.32Å; K438-F441 PolarHBondContact O-N 3.45Å; K438-K442 PolarHBondContact O-N 3.49Å
439	G	47.2	Very low	53	Low	75 Å²	75	106.3 Å²	106.3	77%	0.773	61%	0.605	S	S	*	*	H	α-helix	trans	-63	-21.7	162.7	0	0	0	0	0	113.7	M437	M437-G439 PolarHBondContact O-N 2.85Å; M437-G439 VanDerWaalsContact O-N 3.12Å
440	L	44.6	Very low	51	Low	106 Å²	106	108 Å²	108	56%	0.555	62%	0.623	S	S	*	*	H	α-helix	trans	-103.5	-15.2	177.3	-93	124.5	0	0	0	114.2	M437 K438 L459	M437-L440 WeakPolarHBondContact O-CA 3.27Å; M437-L440 WeakPolarHBondContact O-CB 3.47Å; M437-L440 PolarHBondContact O-N 2.89Å; K438-L440 PolarHBondContact O-N 3.32Å; L440-L459 HydrophobicContact CD1-CD1 4.43Å; L440-L459 HydrophobicContact CD2-CD1 3.43Å; L440-L459 VanDerWaalsContact CD2-CD1 3.43Å
441	F	42.2	Very low	49.8	Very low	155 Å²	155	106 Å²	106	68%	0.68	62%	0.618	S	S	*	*	H	α-helix	trans	-113.8	13.9	-178.6	-72.2	-79.8	0	0	0	113.8	M437 K438 G443	M437-F441 HydrophobicContact CB-CD2 4.47Å; M437-F441 PolarHBondContact O-N 3.23Å; K438-F441 PolarHBondContact O-N 3.45Å; F441-G443 PolarHBondContact O-N 2.66Å
442	K	39.5	Very low	49	Very low	176 Å²	176	110 Å²	110	77%	0.765	64%	0.638	S	S	*	*			trans	-67.5	90	164.8	-130.4	-176.5	-177.7	-175.7	0	107.5	K438 G444	K438-K442 PolarHBondContact O-N 3.49Å; K442-G444 PolarHBondContact O-N 3.14Å
443	G	35.1	Very low	48.4	Very low	79 Å²	79	109.8 Å²	109.8	81%	0.814	65%	0.648	S	S	*	*	T	Hydrogen-bonded Turn	trans	-67	53.7	179.7	0	0	0	0	0	113.9	F441	F441-G443 PolarHBondContact O-N 2.66Å
444	G	33.4	Very low	48.1	Very low	73 Å²	73	107.8 Å²	107.8	75%	0.753	65%	0.647	S	S	*	*	T	Hydrogen-bonded Turn	trans	-130.3	-7.9	172.4	0	0	0	0	0	114.1	K442	K442-G444 PolarHBondContact O-N 3.14Å
445	D	33.2	Very low	47.9	Very low	142 Å²	142	108.4 Å²	108.4	76%	0.759	65%	0.648	S	S	*	*			trans	-126.9	14.7	-174.1	-121.9	-12.7	0	0	0	114.7	S447	D445-S447 PolarHBondContact O-N 3.09Å; D445-S447 VanDerWaalsContact O-N 3.14Å
446	L	37.3	Very low	47.7	Very low	146 Å²	146	109.8 Å²	109.8	76%	0.764	65%	0.647	S	S	*	*			trans	-86.1	41.2	169	-80.5	157.6	0	0	0	111.3
447	S	33.7	Very low	48.3	Very low	80 Å²	80	107.8 Å²	107.8	56%	0.559	64%	0.636	S	S	*	*			trans	-71.8	132.4	159.5	78.7	0	0	0	0	108.7	D445 K449	D445-S447 PolarHBondContact O-N 3.09Å; D445-S447 VanDerWaalsContact O-N 3.14Å; S447-K449 PolarHBondContact O-N 3.48Å
448	S	40	Very low	49	Very low	121 Å²	121	110.6 Å²	110.6	85%	0.846	65%	0.646	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.2	35	-171	47.9	0	0	0	0	116.8
449	K	39.7	Very low	50	Low	192 Å²	192	108.1 Å²	108.1	84%	0.835	64%	0.637	S	S	*	*	T	Hydrogen-bonded Turn	trans	-133.9	1	-170.3	-77	-168.4	175.1	-179	0	120	S447	S447-K449 PolarHBondContact O-N 3.48Å
450	S	40.6	Very low	51	Low	108 Å²	108	105.3 Å²	105.3	76%	0.755	61%	0.605	S	S	*	*			trans	-162.4	65.4	173.1	56	0	0	0	0	114.2	N452	S450-N452 PolarHBondContact O-N 2.97Å
451	V	53.7	Low	52.3	Low	88 Å²	88	106.1 Å²	106.1	53%	0.533	61%	0.606	S	S	.	*			trans	-86.8	105.9	168.6	-169.9	0	0	0	0	109.1	L456	V451-L456 HydrophobicContact CG1-CB 4.37Å; V451-L456 HydrophobicContact CG1-CD1 3.4Å
452	N	58.1	Low	53.7	Low	95 Å²	95	104.2 Å²	104.2	51%	0.508	60%	0.599	S	S	.	*			trans	-63.6	122.3	179.7	-145.6	-13.6	0	0	0	109.3	S450 V454 Q455 L456	S450-N452 PolarHBondContact O-N 2.97Å; N452-V454 PolarHBondContact O-N 3.38Å; N452-Q455 HydrophobicContact CB-CG 4.4Å; N452-Q455 PolarHBondContact O-N 3.31Å; N452-L456 PolarHBondContact O-N 3.04Å
453	P	62.4	Low	54.7	Low	100 Å²	100	98.5 Å²	98.5	65%	0.649	58%	0.576	S	S	*	*	H	α-helix	trans	-57.5	-27.3	-172.5	16.1	-28.8	0	0	0	113.6	A457	P453-A457 WeakPolarHBondContact O-CB 3.21Å; P453-A457 PolarHBondContact O-N 3.04Å
454	V	71.7	Confident	56.3	Low	95 Å²	95	96 Å²	96	58%	0.576	55%	0.548	S	S	*	.	H	α-helix	trans	-68.4	-36.5	177.3	-177.8	0	0	0	0	112.5	N452 K458	N452-V454 PolarHBondContact O-N 3.38Å; V454-K458 PolarHBondContact O-N 3.49Å; V454-K458 VanDerWaalsContact O-N 3.09Å
455	Q	64.6	Low	58.2	Low	133 Å²	133	102.4 Å²	102.4	62%	0.621	55%	0.549	S	S	*	.	H	α-helix	trans	-73.5	-38.3	178.6	-71.4	179.5	-5.7	0	0	111	N452 A457 K458 L459	N452-Q455 HydrophobicContact CB-CG 4.4Å; N452-Q455 PolarHBondContact O-N 3.31Å; Q455-A457 VanDerWaalsContact C-N 3.33Å; Q455-A457 PolarHBondContact O-N 3.4Å; Q455-K458 PolarHBondContact O-N 3.46Å; Q455-L459 WeakPolarHBondContact O-CB 3.47Å; Q455-L459 PolarHBondContact O-N 3.45Å
456	L	61.9	Low	59.7	Low	64 Å²	64	102.2 Å²	102.2	34%	0.335	55%	0.545	S	S	.	.	H	α-helix	trans	-65.1	-38.4	175.5	-148	106	0	0	0	111.6	V451 N452 L459 N460	V451-L456 HydrophobicContact CG1-CB 4.37Å; V451-L456 HydrophobicContact CG1-CD1 3.4Å; N452-L456 PolarHBondContact O-N 3.04Å; L456-L459 PolarHBondContact O-N 3.05Å; L456-N460 WeakPolarHBondContact O-CB 3.42Å; L456-N460 VanDerWaalsContact O-CG 3.31Å; L456-N460 PolarHBondContact O-N 3.23Å; L456-N460 PolarHBondContact O-ND2 3.08Å
457	A	70	Confident	60.9	Low	53 Å²	53	97.9 Å²	97.9	44%	0.438	52%	0.522	S	S	.	.	H	α-helix	trans	-65.5	-42.3	174.7	0	0	0	0	0	112.5	P453 Q455 N460 Q461	P453-A457 WeakPolarHBondContact O-CB 3.21Å; P453-A457 PolarHBondContact O-N 3.04Å; Q455-A457 VanDerWaalsContact C-N 3.33Å; Q455-A457 PolarHBondContact O-N 3.4Å; A457-N460 PolarHBondContact O-N 3.47Å; A457-Q461 PolarHBondContact O-N 2.99Å
458	K	72.3	Confident	62.8	Low	139 Å²	139	98.4 Å²	98.4	60%	0.604	52%	0.518	S	S	*	.	H	α-helix	trans	-63.1	-41.7	174.3	-84.3	-175.3	176	179.5	0	112.2	V454 Q455 Q461 Q462	V454-K458 PolarHBondContact O-N 3.49Å; V454-K458 VanDerWaalsContact O-N 3.09Å; Q455-K458 PolarHBondContact O-N 3.46Å; K458-Q461 PolarHBondContact O-N 3.16Å; K458-Q462 PolarHBondContact O-N 2.8Å
459	L	69.8	Low	64.1	Low	50 Å²	50	97.4 Å²	97.4	26%	0.262	51%	0.509	S	S	.	.	H	α-helix	trans	-63.7	-44.3	177.4	-163.8	79.9	0	0	0	111.5	L440 Q455 L456 Q461 Q462 M463 M485	L440-L459 HydrophobicContact CD1-CD1 4.43Å; L440-L459 HydrophobicContact CD2-CD1 3.43Å; L440-L459 VanDerWaalsContact CD2-CD1 3.43Å; Q455-L459 WeakPolarHBondContact O-CB 3.47Å; Q455-L459 PolarHBondContact O-N 3.45Å; L456-L459 PolarHBondContact O-N 3.05Å; L459-Q461 PolarHBondContact O-N 2.93Å; L459-Q462 PolarHBondContact O-N 3.43Å; L459-M463 HydrophobicContact CD2-CE 3.69Å; L459-M463 HydrophobicContact CG-CE 3.81Å; L459-M463 PolarHBondContact O-N 3.13Å; L459-M485 HydrophobicContact CD2-CE 4.32Å
460	N	68.2	Low	65.7	Low	17 Å²	17	97.5 Å²	97.5	9%	0.091	50%	0.504	C	S	.	.	H	α-helix	trans	-60.8	-43.7	175.6	-79.5	-23.1	0	0	0	112.2	L456 A457 A464 M485	L456-N460 WeakPolarHBondContact O-CB 3.42Å; L456-N460 VanDerWaalsContact O-CG 3.31Å; L456-N460 PolarHBondContact O-N 3.23Å; L456-N460 PolarHBondContact O-ND2 3.08Å; A457-N460 PolarHBondContact O-N 3.47Å; N460-A464 VanDerWaalsContact O-CB 3.32Å; N460-A464 WeakPolarHBondContact O-CB 3.41Å; N460-A464 PolarHBondContact O-N 2.62Å; N460-M485 WeakPolarHBondContact OD1-CE 3.32Å
461	Q	71.1	Confident	67.2	Low	123 Å²	123	95.3 Å²	95.3	58%	0.575	49%	0.486	S	S	*	.	H	α-helix	trans	-66.6	-38.2	176.7	-85.4	-173.3	-11.2	0	0	112.8	A457 K458 L459 R465	A457-Q461 PolarHBondContact O-N 2.99Å; K458-Q461 PolarHBondContact O-N 3.16Å; L459-Q461 PolarHBondContact O-N 2.93Å; Q461-R465 WeakPolarHBondContact O-CG 3.44Å; Q461-R465 PolarHBondContact O-N 2.97Å
462	Q	71.7	Confident	67.9	Low	115 Å²	115	92.6 Å²	92.6	54%	0.537	47%	0.468	S	S	.	.	H	α-helix	trans	-69.2	-41.1	176.9	-82.2	-175.7	-24.4	0	0	112.1	K458 L459 R465 M466	K458-Q462 PolarHBondContact O-N 2.8Å; L459-Q462 PolarHBondContact O-N 3.43Å; Q462-R465 PolarHBondContact O-N 3.28Å; Q462-M466 HydrophobicContact CB-CE 4.36Å; Q462-M466 PolarHBondContact O-N 3.38Å
463	M	61.2	Low	68.6	Low	55 Å²	55	95.8 Å²	95.8	27%	0.271	48%	0.48	S	S	.	.	H	α-helix	trans	-64.1	-41.9	174	-82.5	-160.3	-100.6	0	0	111.9	L459 R465 M466 M467 M485	L459-M463 HydrophobicContact CD2-CE 3.69Å; L459-M463 HydrophobicContact CG-CE 3.81Å; L459-M463 PolarHBondContact O-N 3.13Å; M463-R465 PolarHBondContact O-N 3.26Å; M463-M466 PolarHBondContact O-N 3.28Å; M463-M467 WeakPolarHBondContact O-CG 3.44Å; M463-M467 PolarHBondContact O-N 2.89Å; M463-M467 VanDerWaalsContact O-N 3.1Å; M463-M485 HydrophobicContact CE-CE 3.34Å; M463-M485 HydrophobicContact CE-SD 3.67Å
464	A	67.4	Low	68.8	Low	28 Å²	28	99.3 Å²	99.3	23%	0.231	49%	0.488	C	S	.	.	H	α-helix	trans	-61.9	-27.6	176.6	0	0	0	0	0	113.4	N460 L472 L478	N460-A464 VanDerWaalsContact O-CB 3.32Å; N460-A464 WeakPolarHBondContact O-CB 3.41Å; N460-A464 PolarHBondContact O-N 2.62Å; A464-L472 HydrophobicContact CB-CD1 4.05Å; A464-L478 HydrophobicContact CB-CD2 3.89Å
465	R	73.2	Confident	68.4	Low	207 Å²	207	97.6 Å²	97.6	78%	0.781	48%	0.475	S	S	*	.	H	α-helix	trans	-81.4	-20.8	174.8	-73	178.3	179.6	175.5	1.2	114	Q461 Q462 M463	Q461-R465 WeakPolarHBondContact O-CG 3.44Å; Q461-R465 PolarHBondContact O-N 2.97Å; Q462-R465 PolarHBondContact O-N 3.28Å; M463-R465 PolarHBondContact O-N 3.26Å
466	M	65.5	Low	68.9	Low	138 Å²	138	93.5 Å²	93.5	68%	0.68	47%	0.467	S	S	*	.	H	α-helix	trans	-92.8	-16.5	179.3	-76	-170.9	-84.8	0	0	113.3	Q462 M463	Q462-M466 HydrophobicContact CB-CE 4.36Å; Q462-M466 PolarHBondContact O-N 3.38Å; M463-M466 PolarHBondContact O-N 3.28Å
467	M	63.3	Low	69.7	Low	54 Å²	54	91.4 Å²	91.4	27%	0.266	46%	0.462	S	S	.	.	S	Bend	trans	-90.3	135.7	178.6	-67.1	-177.4	78.9	0	0	110.8	M463 V471 L472 M475 L481	M463-M467 WeakPolarHBondContact O-CG 3.44Å; M463-M467 PolarHBondContact O-N 2.89Å; M463-M467 VanDerWaalsContact O-N 3.1Å; M467-V471 HydrophobicContact CE-CG1 3.63Å; M467-L472 HydrophobicContact CB-CD1 3.93Å; M467-M475 HydrophobicContact CE-SD 3.47Å; M467-M475 WeakPolarHBondContact CE-SD 2.79Å; M467-L481 HydrophobicContact SD-CD1 3.76Å; M467-L481 HydrophobicContact SD-CD2 4.46Å; M467-L481 HydrophobicContact SD-CG 4.3Å
468	D	72.2	Confident	69.6	Low	92 Å²	92	93.6 Å²	93.6	49%	0.492	47%	0.466	S	S	.	.			trans	-55.5	132.6	173.5	-171.5	-48	0	0	0	109.5	R470 V471 L472	D468-R470 PolarHBondContact O-N 3.23Å; D468-R470 PolarHBondContact OD1-N 2.96Å; D468-V471 HydrophobicContact CB-CG2 4.05Å; D468-V471 WeakPolarHBondContact O-CB 3.44Å; D468-V471 PolarHBondContact O-N 3.38Å; D468-L472 PolarHBondContact O-N 2.94Å; D468-L472 VanDerWaalsContact O-N 3.08Å
469	P	68.1	Low	69.8	Low	100 Å²	100	91.5 Å²	91.5	65%	0.649	46%	0.464	S	S	*	.	H	α-helix	trans	-50.1	-30.8	179.9	-28.1	33.7	0	0	0	114.3	L472 Q473	P469-L472 PolarHBondContact O-N 2.96Å; P469-Q473 PolarHBondContact O-N 3.37Å; P469-Q473 VanDerWaalsContact O-N 3.08Å
470	R	73.8	Confident	70	Confident	194 Å²	194	89.8 Å²	89.8	73%	0.732	46%	0.459	S	S	*	.	H	α-helix	trans	-70.3	-39.1	177.8	-65.3	179.2	176.1	-175.4	-0.3	112.6	D468 L472 Q473 Q474	D468-R470 PolarHBondContact O-N 3.23Å; D468-R470 PolarHBondContact OD1-N 2.96Å; R470-L472 VanDerWaalsContact C-N 3.33Å; R470-Q473 PolarHBondContact O-N 3.33Å; R470-Q474 PolarHBondContact O-N 3.49Å
471	V	71	Confident	70.1	Confident	61 Å²	61	89.4 Å²	89.4	37%	0.37	46%	0.457	S	S	.	.	H	α-helix	trans	-68.5	-38.6	176	-179.3	0	0	0	0	109.7	M467 D468 Q473 Q474 M475	M467-V471 HydrophobicContact CE-CG1 3.63Å; D468-V471 HydrophobicContact CB-CG2 4.05Å; D468-V471 WeakPolarHBondContact O-CB 3.44Å; D468-V471 PolarHBondContact O-N 3.38Å; V471-Q473 VanDerWaalsContact C-N 3.33Å; V471-Q473 PolarHBondContact O-N 3.02Å; V471-Q474 PolarHBondContact O-N 3.44Å; V471-M475 HydrophobicContact CG1-SD 4.27Å; V471-M475 WeakPolarHBondContact O-CB 3.12Å; V471-M475 WeakPolarHBondContact O-CG 3.38Å; V471-M475 PolarHBondContact O-N 3.45Å
472	L	68	Low	70.2	Confident	32 Å²	32	88.3 Å²	88.3	17%	0.168	45%	0.452	C	S	.	.	H	α-helix	trans	-64.8	-37.4	177.6	-143	118.5	0	0	0	112.1	A464 M467 D468 P469 R470 G477 L481	A464-L472 HydrophobicContact CB-CD1 4.05Å; M467-L472 HydrophobicContact CB-CD1 3.93Å; D468-L472 PolarHBondContact O-N 2.94Å; D468-L472 VanDerWaalsContact O-N 3.08Å; P469-L472 PolarHBondContact O-N 2.96Å; R470-L472 VanDerWaalsContact C-N 3.33Å; L472-G477 VanDerWaalsContact O-CA 3.28Å; L472-G477 WeakPolarHBondContact O-CA 3.47Å; L472-G477 PolarHBondContact O-N 2.94Å; L472-L481 HydrophobicContact CD1-CD1 3.94Å; L472-L481 HydrophobicContact CG-CD1 4.38Å
473	Q	72.8	Confident	70.4	Confident	162 Å²	162	87.4 Å²	87.4	76%	0.757	45%	0.451	S	S	*	.	H	α-helix	trans	-67	-44.3	172.2	-94.5	-177.2	-21.1	0	0	112.7	P469 R470 V471 M475 G476	P469-Q473 PolarHBondContact O-N 3.37Å; P469-Q473 VanDerWaalsContact O-N 3.08Å; R470-Q473 PolarHBondContact O-N 3.33Å; V471-Q473 VanDerWaalsContact C-N 3.33Å; V471-Q473 PolarHBondContact O-N 3.02Å; Q473-M475 PolarHBondContact O-N 2.9Å; Q473-G476 PolarHBondContact O-N 3.31Å; Q473-G476 VanDerWaalsContact O-N 3.08Å
474	Q	68.1	Low	70.9	Confident	173 Å²	173	87.5 Å²	87.5	81%	0.808	45%	0.454	S	S	*	.	H	α-helix	trans	-63.7	-31.1	177.2	-84.1	-174.2	-21.7	0	0	113	R470 V471 G476	R470-Q474 PolarHBondContact O-N 3.49Å; V471-Q474 PolarHBondContact O-N 3.44Å; Q474-G476 PolarHBondContact O-N 3.49Å
475	M	62	Low	70.9	Confident	60 Å²	60	88 Å²	88	30%	0.296	45%	0.452	S	S	.	.	T	Hydrogen-bonded Turn	trans	-81.9	7.6	175.2	-71.4	-171.7	76	0	0	113.7	M467 V471 Q473 G480 V484	M467-M475 HydrophobicContact CE-SD 3.47Å; M467-M475 WeakPolarHBondContact CE-SD 2.79Å; V471-M475 HydrophobicContact CG1-SD 4.27Å; V471-M475 WeakPolarHBondContact O-CB 3.12Å; V471-M475 WeakPolarHBondContact O-CG 3.38Å; V471-M475 PolarHBondContact O-N 3.45Å; Q473-M475 PolarHBondContact O-N 2.9Å; M475-G480 CarbonylContact O-C 3.51Å; M475-G480 WeakPolarHBondContact O-CA 3.43Å; M475-V484 HydrophobicContact CE-CB 3.99Å; M475-V484 HydrophobicContact CE-CG1 4.06Å; M475-V484 HydrophobicContact CE-CG2 3.62Å
476	G	75.5	Confident	71	Confident	46 Å²	46	85.2 Å²	85.2	47%	0.474	45%	0.445	S	S	.	.	T	Hydrogen-bonded Turn	trans	76.7	28.7	178.8	0	0	0	0	0	114	Q473 Q474 T479 G480	Q473-G476 PolarHBondContact O-N 3.31Å; Q473-G476 VanDerWaalsContact O-N 3.08Å; Q474-G476 PolarHBondContact O-N 3.49Å; G476-T479 PolarHBondContact O-OG1 3.18Å; G476-G480 PolarHBondContact O-N 3.17Å
477	G	77.8	Confident	71.3	Confident	21 Å²	21	85.1 Å²	85.1	22%	0.216	44%	0.444	C	S	.	.	H	α-helix	trans	70	-160	179.2	0	0	0	0	0	113.6	L472 T479 G480 L481	L472-G477 VanDerWaalsContact O-CA 3.28Å; L472-G477 WeakPolarHBondContact O-CA 3.47Å; L472-G477 PolarHBondContact O-N 2.94Å; G477-T479 PolarHBondContact O-N 3.38Å; G477-G480 PolarHBondContact O-N 3.45Å; G477-L481 PolarHBondContact O-N 3.13Å
478	L	69.7	Low	71.5	Confident	99 Å²	99	88 Å²	88	52%	0.518	46%	0.46	S	S	.	.	H	α-helix	trans	-58.2	-32.5	178.8	-77.8	161.5	0	0	0	112.9	A464 Q482	A464-L478 HydrophobicContact CB-CD2 3.89Å; L478-Q482 WeakPolarHBondContact O-CG 3.43Å; L478-Q482 PolarHBondContact O-N 3.31Å; L478-Q482 VanDerWaalsContact O-N 3.13Å
479	T	74.6	Confident	71.2	Confident	94 Å²	94	89 Å²	89	58%	0.577	46%	0.461	S	S	*	.	H	α-helix	trans	-68.8	-42.7	179	33.8	0	0	0	0	112.3	G476 G477 Q482 N483	G476-T479 PolarHBondContact O-OG1 3.18Å; G477-T479 PolarHBondContact O-N 3.38Å; T479-Q482 WeakPolarHBondContact O-CB 3.48Å; T479-Q482 PolarHBondContact O-N 3.17Å; T479-N483 PolarHBondContact O-N 3.21Å; T479-N483 VanDerWaalsContact O-N 3.17Å
480	G	74.6	Confident	71.1	Confident	14 Å²	14	87.4 Å²	87.4	14%	0.144	45%	0.452	C	S	.	.	H	α-helix	trans	-75.1	-27.9	177.3	0	0	0	0	0	113.4	M475 G476 G477 Q482 N483 V484	M475-G480 CarbonylContact O-C 3.51Å; M475-G480 WeakPolarHBondContact O-CA 3.43Å; G476-G480 PolarHBondContact O-N 3.17Å; G477-G480 PolarHBondContact O-N 3.45Å; G480-Q482 VanDerWaalsContact C-N 3.32Å; G480-Q482 PolarHBondContact O-N 3.04Å; G480-N483 PolarHBondContact O-N 3.1Å; G480-V484 WeakPolarHBondContact O-CG2 3.47Å; G480-V484 PolarHBondContact O-N 3.26Å
481	L	71	Confident	70.1	Confident	10 Å²	10	80.5 Å²	80.5	5%	0.052	44%	0.437	C	S	.	.	H	α-helix	trans	-59.8	-41	167.5	-130.2	161.2	0	0	0	111.7	M467 L472 G477 V484 M485	M467-L481 HydrophobicContact SD-CD1 3.76Å; M467-L481 HydrophobicContact SD-CD2 4.46Å; M467-L481 HydrophobicContact SD-CG 4.3Å; L472-L481 HydrophobicContact CD1-CD1 3.94Å; L472-L481 HydrophobicContact CG-CD1 4.38Å; G477-L481 PolarHBondContact O-N 3.13Å; L481-V484 PolarHBondContact O-N 2.94Å; L481-M485 PolarHBondContact O-N 3.35Å; L481-M485 VanDerWaalsContact O-N 3.08Å
482	Q	72.1	Confident	69.2	Low	100 Å²	100	80.9 Å²	80.9	47%	0.467	45%	0.446	S	S	.	.	H	α-helix	trans	-64	-38.5	173.6	-75.6	178.7	-6	0	0	112.8	L478 T479 G480 M485 K486	L478-Q482 WeakPolarHBondContact O-CG 3.43Å; L478-Q482 PolarHBondContact O-N 3.31Å; L478-Q482 VanDerWaalsContact O-N 3.13Å; T479-Q482 WeakPolarHBondContact O-CB 3.48Å; T479-Q482 PolarHBondContact O-N 3.17Å; G480-Q482 VanDerWaalsContact C-N 3.32Å; G480-Q482 PolarHBondContact O-N 3.04Å; Q482-M485 PolarHBondContact O-N 3.21Å; Q482-K486 PolarHBondContact O-N 3.28Å
483	N	75.7	Confident	68.3	Low	96 Å²	96	81.8 Å²	81.8	51%	0.513	46%	0.463	S	S	.	.	H	α-helix	trans	-67.8	-40.3	178.2	-72.4	-20.9	0	0	0	112.1	T479 G480 K486 Q487	T479-N483 PolarHBondContact O-N 3.21Å; T479-N483 VanDerWaalsContact O-N 3.17Å; G480-N483 PolarHBondContact O-N 3.1Å; N483-K486 PolarHBondContact O-N 3.45Å; N483-Q487 PolarHBondContact O-N 3.09Å
484	V	72.1	Confident	67.1	Low	56 Å²	56	81.4 Å²	81.4	34%	0.339	46%	0.461	S	S	.	.	H	α-helix	trans	-64.9	-40.6	176	171.4	0	0	0	0	111.1	M475 G480 L481 K486 Q487 L488	M475-V484 HydrophobicContact CE-CB 3.99Å; M475-V484 HydrophobicContact CE-CG1 4.06Å; M475-V484 HydrophobicContact CE-CG2 3.62Å; G480-V484 WeakPolarHBondContact O-CG2 3.47Å; G480-V484 PolarHBondContact O-N 3.26Å; L481-V484 PolarHBondContact O-N 2.94Å; V484-K486 PolarHBondContact O-N 3.43Å; V484-Q487 PolarHBondContact O-N 3.04Å; V484-L488 HydrophobicContact CG1-CD1 4.15Å; V484-L488 PolarHBondContact O-N 2.98Å
485	M	67.9	Low	66	Low	38 Å²	38	81 Å²	81	19%	0.187	46%	0.461	C	S	.	.	H	α-helix	trans	-63.6	-40	174.4	-82.4	-125.7	-99.5	0	0	113.2	L459 N460 M463 L481 Q482 Q487 L488 Q489	L459-M485 HydrophobicContact CD2-CE 4.32Å; N460-M485 WeakPolarHBondContact OD1-CE 3.32Å; M463-M485 HydrophobicContact CE-CE 3.34Å; M463-M485 HydrophobicContact CE-SD 3.67Å; L481-M485 PolarHBondContact O-N 3.35Å; L481-M485 VanDerWaalsContact O-N 3.08Å; Q482-M485 PolarHBondContact O-N 3.21Å; M485-Q487 VanDerWaalsContact C-N 3.32Å; M485-Q487 PolarHBondContact O-N 3.47Å; M485-L488 PolarHBondContact O-N 3.08Å; M485-Q489 WeakPolarHBondContact O-CG 3.38Å; M485-Q489 PolarHBondContact O-N 3.42Å
486	K	74.6	Confident	65.2	Low	149 Å²	149	81.4 Å²	81.4	65%	0.648	48%	0.481	S	S	*	.	H	α-helix	trans	-61.2	-40.8	173	-81.2	-177.4	176.7	177.3	0	112	Q482 N483 V484 Q489 S490	Q482-K486 PolarHBondContact O-N 3.28Å; N483-K486 PolarHBondContact O-N 3.45Å; V484-K486 PolarHBondContact O-N 3.43Å; K486-Q489 PolarHBondContact O-N 2.94Å; K486-S490 PolarHBondContact O-N 3.33Å; K486-S490 PolarHBondContact O-OG 3.2Å
487	Q	72.1	Confident	63.5	Low	137 Å²	137	87.9 Å²	87.9	64%	0.64	50%	0.497	S	S	*	.	H	α-helix	trans	-65.8	-44.2	177.3	-78.2	-176.4	-10.4	0	0	112.2	N483 V484 M485 Q489 S490 A491	N483-Q487 PolarHBondContact O-N 3.09Å; V484-Q487 PolarHBondContact O-N 3.04Å; M485-Q487 VanDerWaalsContact C-N 3.32Å; M485-Q487 PolarHBondContact O-N 3.47Å; Q487-Q489 VanDerWaalsContact C-N 3.35Å; Q487-Q489 PolarHBondContact O-N 3.24Å; Q487-S490 WeakPolarHBondContact CA-OG 3.28Å; Q487-S490 PolarHBondContact O-N 3.27Å; Q487-S490 VanDerWaalsContact O-N 3.17Å; Q487-S490 PolarHBondContact O-OG 2.81Å; Q487-A491 PolarHBondContact O-N 3.08Å
488	L	67.3	Low	61.3	Low	115 Å²	115	101.7 Å²	101.7	60%	0.602	54%	0.542	S	S	*	.	H	α-helix	trans	-61.3	-41.7	176.3	-77.1	167.7	0	0	0	112.3	V484 M485 S490 A491 A492	V484-L488 HydrophobicContact CG1-CD1 4.15Å; V484-L488 PolarHBondContact O-N 2.98Å; M485-L488 PolarHBondContact O-N 3.08Å; L488-S490 VanDerWaalsContact C-N 3.34Å; L488-S490 PolarHBondContact O-N 2.95Å; L488-A491 PolarHBondContact O-N 3.38Å; L488-A492 PolarHBondContact O-N 3.01Å
489	Q	65.8	Low	60.9	Low	111 Å²	111	101.8 Å²	101.8	52%	0.519	54%	0.543	S	S	.	.	H	α-helix	trans	-62.6	-40.5	174.3	-75.5	-179.9	-10.2	0	0	112.1	M485 K486 Q487 G493	M485-Q489 WeakPolarHBondContact O-CG 3.38Å; M485-Q489 PolarHBondContact O-N 3.42Å; K486-Q489 PolarHBondContact O-N 2.94Å; Q487-Q489 VanDerWaalsContact C-N 3.35Å; Q487-Q489 PolarHBondContact O-N 3.24Å; Q489-G493 PolarHBondContact O-N 2.93Å
490	S	66.9	Low	60.2	Low	67 Å²	67	102.2 Å²	102.2	47%	0.469	54%	0.541	S	S	.	.	H	α-helix	trans	-68.5	-33.2	178.4	71.4	0	0	0	0	113.5	K486 Q487 L488 H494	K486-S490 PolarHBondContact O-N 3.33Å; K486-S490 PolarHBondContact O-OG 3.2Å; Q487-S490 WeakPolarHBondContact CA-OG 3.28Å; Q487-S490 PolarHBondContact O-N 3.27Å; Q487-S490 VanDerWaalsContact O-N 3.17Å; Q487-S490 PolarHBondContact O-OG 2.81Å; L488-S490 VanDerWaalsContact C-N 3.34Å; L488-S490 PolarHBondContact O-N 2.95Å; S490-H494 PolarHBondContact O-ND1 3.44Å
491	A	51.7	Low	59.4	Low	50 Å²	50	107.1 Å²	107.1	41%	0.413	56%	0.563	S	S	.	*	H	α-helix	trans	-73.9	-38.2	177.8	0	0	0	0	0	112.2	Q487 L488 G493 H494	Q487-A491 PolarHBondContact O-N 3.08Å; L488-A491 PolarHBondContact O-N 3.38Å; A491-G493 VanDerWaalsContact C-N 3.35Å; A491-H494 PolarHBondContact O-N 3.07Å
492	A	53.2	Low	58.7	Low	68 Å²	68	112.8 Å²	112.8	56%	0.562	59%	0.593	S	S	*	*	H	α-helix	trans	-67.3	-34.1	175	0	0	0	0	0	112.5	L488 H494 M495	L488-A492 PolarHBondContact O-N 3.01Å; A492-H494 VanDerWaalsContact C-N 3.3Å; A492-H494 PolarHBondContact O-N 3.08Å; A492-M495 PolarHBondContact O-N 3.03Å
493	G	48.1	Very low	57.9	Low	51 Å²	51	113.6 Å²	113.6	53%	0.526	60%	0.601	S	S	.	*	H	α-helix	trans	-69.1	-20.7	177.8	0	0	0	0	0	115.2	Q489 A491	Q489-G493 PolarHBondContact O-N 2.93Å; A491-G493 VanDerWaalsContact C-N 3.35Å
494	H	48.3	Very low	56.7	Low	155 Å²	155	114.8 Å²	114.8	72%	0.718	61%	0.607	S	S	*	*	H	α-helix	trans	-90.3	-11.5	178.8	-81.3	77	0	0	0	113.9	S490 A491 A492	S490-H494 PolarHBondContact O-ND1 3.44Å; A491-H494 PolarHBondContact O-N 3.07Å; A492-H494 VanDerWaalsContact C-N 3.3Å; A492-H494 PolarHBondContact O-N 3.08Å
495	M	45.7	Very low	55.6	Low	163 Å²	163	119 Å²	119	80%	0.803	63%	0.626	S	S	*	*	S	Bend	trans	-88.8	-8.6	175.1	-76.8	-169.9	-101.5	0	0	113.8	A492	A492-M495 PolarHBondContact O-N 3.03Å
496	G	44.7	Very low	54.6	Low	70 Å²	70	125.2 Å²	125.2	72%	0.722	66%	0.66	S	S	*	*	S	Bend	trans	-94.6	6	176	0	0	0	0	0	115.2
497	K	38.7	Very low	53	Low	182 Å²	182	123.3 Å²	123.3	79%	0.791	66%	0.661	S	S	*	*			trans	-142	63.6	-178.8	-71	-172.9	177	-177.4	0	110.6
498	R	33.3	Very low	51.2	Low	310 Å²	310	122 Å²	122	100%	1.17	66%	0.663	S	S	*	*			trans	-167.2	0	158.4	-111	169.1	-168.3	-163.2	1.9	111.2

Retrieved 498 of 498 residues in 811.6 ms (Link to these results)

U.S. Privacy Notice - Disclaimer / Registrations / Copyright Statement - Linking Policy - Notice of Privacy Practices (HIPAA) - Notice of Non‑Discrimination
© Copyright 2026 St. Jude Children's Research Hospital, a not-for-profit, section 501(c)(3).