G4VPZ1_SCHMA Loading...

Transcription elongation factor

Necessary for efficient RNA polymerase II transcription elongation past template-encoded arresting sites. The arresting sites in DNA have the property of trapping a certain fraction of elongating RNA polymerases that pass through, resulting in locked ternary complexes. Cleavage of the nascent transcript by S-II allows the resumption of elongation from the new 3'-terminus.

AlphaFold DB (A0A3Q0KC17), UniProt , Accession G4VPZ1, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 341 aa.

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(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	73.2	Confident	85.1	Confident	102 Å²	102	74.5 Å²	74.5	50%	0.502	33%	0.332	S	S	.	.				0	-60.1	0	-162.3	168.8	-68.8	0	0	110.4	E3 T4 E5 I41 K44	M1-E3 PolarHBondContact O-N 3.41Å; M1-T4 VanDerWaalsContact O-CB 3.32Å; M1-T4 WeakPolarHBondContact O-CB 3.41Å; M1-T4 PolarHBondContact O-N 2.89Å; M1-T4 PolarHBondContact O-OG1 3.26Å; M1-E5 PolarHBondContact O-N 3.33Å; M1-I41 HydrophobicContact CE-CG1 4.2Å; M1-K44 HydrophobicContact CE-CD 3.96Å; M1-K44 HydrophobicContact SD-CD 3.98Å
2	E	82.1	Confident	85.3	Confident	168 Å²	168	71.8 Å²	71.8	79%	0.785	32%	0.323	S	S	*	.	H	α-helix	trans	-51.3	-45	-178.6	-58.3	-178.7	152.1	0	0	114.8	T4 E5 H6	E2-T4 VanDerWaalsContact C-N 3.28Å; E2-T4 PolarHBondContact O-N 2.91Å; E2-E5 WeakPolarHBondContact O-CB 3.26Å; E2-E5 PolarHBondContact O-N 3.31Å; E2-H6 PolarHBondContact O-N 3.05Å
3	E	82.8	Confident	85.4	Confident	93 Å²	93	77.2 Å²	77.2	44%	0.435	34%	0.339	S	S	.	.	H	α-helix	trans	-55.9	-42.5	175.2	-74.2	-156.7	-151.8	0	0	112.9	M1 E5 H6 V7 R31 I35	M1-E3 PolarHBondContact O-N 3.41Å; E3-E5 VanDerWaalsContact C-N 3.34Å; E3-H6 PolarHBondContact O-N 3.16Å; E3-V7 WeakPolarHBondContact O-CG2 3.49Å; E3-V7 PolarHBondContact O-N 3.04Å; E3-R31 IonicContact OE1-CZ 2.66Å; E3-R31 IonicContact OE1-NH2 2.64Å; E3-R31 PolarHBondContact OE1-NH2 3.43Å; E3-R31 IonicContact OE2-CZ 2.72Å; E3-R31 IonicContact OE2-NE 3.59Å; E3-R31 PolarHBondContact OE2-NE 3.11Å; E3-R31 IonicContact OE2-NH2 2.64Å; E3-R31 PolarHBondContact OE2-NH2 2.93Å; E3-I35 HydrophobicContact CB-CD1 3.88Å
4	T	85.1	Confident	85.3	Confident	1 Å²	1	72.4 Å²	72.4	1%	0.006	32%	0.319	C	S	.	.	H	α-helix	trans	-65.8	-40.1	-179.8	-40.6	0	0	0	0	110.8	M1 E2 A8 L32 M37 I41 T45 V47	M1-T4 VanDerWaalsContact O-CB 3.32Å; M1-T4 WeakPolarHBondContact O-CB 3.41Å; M1-T4 PolarHBondContact O-N 2.89Å; M1-T4 PolarHBondContact O-OG1 3.26Å; E2-T4 VanDerWaalsContact C-N 3.28Å; E2-T4 PolarHBondContact O-N 2.91Å; T4-A8 WeakPolarHBondContact O-CB 3.48Å; T4-A8 PolarHBondContact O-N 2.89Å; T4-L32 HydrophobicContact CG2-CD2 3.86Å; T4-M37 HydrophobicContact CG2-CE 3.77Å; T4-M37 HydrophobicContact CG2-SD 4.34Å; T4-I41 HydrophobicContact CG2-CG2 3.65Å; T4-T45 HydrophobicContact CG2-CG2 4.12Å; T4-V47 HydrophobicContact CG2-CG1 4.42Å
5	E	86.2	Confident	85.2	Confident	59 Å²	59	68.6 Å²	68.6	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-65	-43.4	172.3	-75.5	-171.4	-131.6	0	0	112.6	M1 E2 E3 V7 A8 R9 T45	M1-E5 PolarHBondContact O-N 3.33Å; E2-E5 WeakPolarHBondContact O-CB 3.26Å; E2-E5 PolarHBondContact O-N 3.31Å; E3-E5 VanDerWaalsContact C-N 3.34Å; E5-V7 VanDerWaalsContact C-N 3.33Å; E5-V7 PolarHBondContact O-N 2.86Å; E5-A8 PolarHBondContact O-N 3.19Å; E5-R9 WeakPolarHBondContact O-CB 3.39Å; E5-R9 WeakPolarHBondContact O-CG 3.44Å; E5-R9 PolarHBondContact O-N 2.99Å; E5-R9 IonicContact OE2-CZ 3.62Å; E5-R9 IonicContact OE2-NE 3.73Å; E5-R9 IonicContact OE2-NH2 2.73Å; E5-R9 PolarHBondContact OE2-NH2 2.81Å; E5-T45 HydrophobicContact CG-CG2 3.81Å
6	H	87.7	Confident	85.1	Confident	127 Å²	127	73.6 Å²	73.6	59%	0.588	32%	0.324	S	S	*	.	H	α-helix	trans	-58.3	-47.7	178.4	-176.2	100.6	0	0	0	110.7	E2 E3 R10	E2-H6 PolarHBondContact O-N 3.05Å; E3-H6 PolarHBondContact O-N 3.16Å; H6-R10 WeakPolarHBondContact O-CB 3.49Å; H6-R10 PolarHBondContact O-N 3.01Å; H6-R10 VanDerWaalsContact O-N 3.08Å
7	V	88.5	Confident	84.6	Confident	8 Å²	8	75.6 Å²	75.6	5%	0.048	34%	0.339	C	S	.	.	H	α-helix	trans	-67.2	-43.3	177.6	-177.9	0	0	0	0	111.3	E3 E5 R9 R10 L11 Y28 R31 L32	E3-V7 WeakPolarHBondContact O-CG2 3.49Å; E3-V7 PolarHBondContact O-N 3.04Å; E5-V7 VanDerWaalsContact C-N 3.33Å; E5-V7 PolarHBondContact O-N 2.86Å; V7-R9 PolarHBondContact O-N 2.74Å; V7-R10 PolarHBondContact O-N 2.84Å; V7-R10 VanDerWaalsContact O-N 3.16Å; V7-L11 HydrophobicContact CG1-CD1 4.02Å; V7-L11 HydrophobicContact CG1-CG 4.1Å; V7-L11 WeakPolarHBondContact O-CB 3.46Å; V7-L11 WeakPolarHBondContact O-CG 3.42Å; V7-L11 PolarHBondContact O-N 2.87Å; V7-Y28 HydrophobicContact CG1-CD1 3.84Å; V7-Y28 HydrophobicContact CG1-CG 4Å; V7-Y28 HydrophobicContact CG2-CD1 4.27Å; V7-R31 HydrophobicContact CG2-CG 4.41Å; V7-L32 HydrophobicContact CB-CD2 4.16Å; V7-L32 HydrophobicContact CB-CG 4.23Å; V7-L32 HydrophobicContact CG1-CD1 3.75Å; V7-L32 HydrophobicContact CG1-CD2 4.2Å; V7-L32 HydrophobicContact CG1-CG 3.73Å
8	A	87.9	Confident	83.9	Confident	5 Å²	5	82 Å²	82	4%	0.041	37%	0.366	C	S	.	.	H	α-helix	trans	-58.2	-47.2	176.4	0	0	0	0	0	112.4	T4 E5 R10 L11 D12 V47 I50	T4-A8 WeakPolarHBondContact O-CB 3.48Å; T4-A8 PolarHBondContact O-N 2.89Å; E5-A8 PolarHBondContact O-N 3.19Å; A8-R10 VanDerWaalsContact C-N 3.28Å; A8-R10 PolarHBondContact O-N 3.29Å; A8-L11 PolarHBondContact O-N 2.72Å; A8-D12 WeakPolarHBondContact O-CB 3.49Å; A8-D12 PolarHBondContact O-N 3.22Å; A8-V47 HydrophobicContact CB-CB 4.48Å; A8-V47 HydrophobicContact CB-CG2 4.46Å; A8-I50 HydrophobicContact CB-CD1 3.9Å
9	R	87.6	Confident	83.2	Confident	163 Å²	163	85.6 Å²	85.6	62%	0.615	38%	0.381	S	S	*	.	H	α-helix	trans	-63.2	-30.8	176.5	-68.7	170.1	-167.8	-139.1	10.6	112.6	E5 V7 R13	E5-R9 WeakPolarHBondContact O-CB 3.39Å; E5-R9 WeakPolarHBondContact O-CG 3.44Å; E5-R9 PolarHBondContact O-N 2.99Å; E5-R9 IonicContact OE2-CZ 3.62Å; E5-R9 IonicContact OE2-NE 3.73Å; E5-R9 IonicContact OE2-NH2 2.73Å; E5-R9 PolarHBondContact OE2-NH2 2.81Å; V7-R9 PolarHBondContact O-N 2.74Å; R9-R13 WeakPolarHBondContact O-CB 3.42Å; R9-R13 PolarHBondContact O-N 2.8Å
10	R	87.9	Confident	82.6	Confident	94 Å²	94	83.3 Å²	83.3	36%	0.355	37%	0.372	S	S	.	.	H	α-helix	trans	-78.4	-40.9	177.3	-177.7	58.9	-175.4	-154.8	7.4	112	H6 V7 A8 R13 M14 Y28	H6-R10 WeakPolarHBondContact O-CB 3.49Å; H6-R10 PolarHBondContact O-N 3.01Å; H6-R10 VanDerWaalsContact O-N 3.08Å; V7-R10 PolarHBondContact O-N 2.84Å; V7-R10 VanDerWaalsContact O-N 3.16Å; A8-R10 VanDerWaalsContact C-N 3.28Å; A8-R10 PolarHBondContact O-N 3.29Å; R10-R13 WeakPolarHBondContact O-CB 3.38Å; R10-R13 PolarHBondContact O-N 2.74Å; R10-M14 PolarHBondContact O-N 3Å; R10-Y28 HydrophobicContact CG-CD2 4.22Å; R10-Y28 HydrophobicContact CG-CE1 3.94Å; R10-Y28 HydrophobicContact CG-CE2 3.51Å; R10-Y28 WeakPolarHBondContact CG-OH 3.29Å; R10-Y28 PolarHBondContact NE-OH 2.99Å
11	L	86.8	Confident	82.5	Confident	0 Å²	0	83.3 Å²	83.3	0%	0	38%	0.376	C	S	.	.	H	α-helix	trans	-64.1	-44.2	174	-75.4	-174	0	0	0	112.3	V7 A8 R13 M14 L15 Y28 L32 I50 I54	V7-L11 HydrophobicContact CG1-CD1 4.02Å; V7-L11 HydrophobicContact CG1-CG 4.1Å; V7-L11 WeakPolarHBondContact O-CB 3.46Å; V7-L11 WeakPolarHBondContact O-CG 3.42Å; V7-L11 PolarHBondContact O-N 2.87Å; A8-L11 PolarHBondContact O-N 2.72Å; L11-R13 VanDerWaalsContact C-N 3.26Å; L11-R13 PolarHBondContact O-N 3.39Å; L11-M14 HydrophobicContact CD2-SD 4.26Å; L11-M14 PolarHBondContact O-N 3.22Å; L11-M14 VanDerWaalsContact O-N 3.17Å; L11-L15 PolarHBondContact O-N 3.17Å; L11-Y28 HydrophobicContact CD2-CD2 3.82Å; L11-Y28 HydrophobicContact CD2-CG 4.01Å; L11-Y28 HydrophobicContact CG-CG 4.47Å; L11-L32 HydrophobicContact CD1-CD1 3.89Å; L11-I50 HydrophobicContact CB-CG2 3.65Å; L11-I54 HydrophobicContact CB-CD1 3.78Å; L11-I54 HydrophobicContact CD1-CD1 3.92Å; L11-I54 HydrophobicContact CD2-CD1 3.65Å; L11-I54 HydrophobicContact CG-CD1 3.97Å
12	D	87.3	Confident	82.8	Confident	42 Å²	42	80.5 Å²	80.5	23%	0.225	36%	0.363	C	S	.	.	H	α-helix	trans	-62.6	-30.9	173.8	176.7	71.8	0	0	0	112.7	A8 K16 I50	A8-D12 WeakPolarHBondContact O-CB 3.49Å; A8-D12 PolarHBondContact O-N 3.22Å; D12-K16 WeakPolarHBondContact O-CB 3.38Å; D12-K16 WeakPolarHBondContact O-CG 3.31Å; D12-K16 PolarHBondContact O-N 3.25Å; D12-K16 IonicContact OD1-NZ 3.3Å; D12-K16 WeakPolarHBondContact OD2-CE 3.41Å; D12-K16 IonicContact OD2-NZ 2.74Å; D12-K16 PolarHBondContact OD2-NZ 3.18Å; D12-I50 HydrophobicContact CB-CD1 4.27Å
13	R	87.1	Confident	82.8	Confident	142 Å²	142	80.8 Å²	80.8	54%	0.536	36%	0.364	S	S	.	.	H	α-helix	trans	-68.7	-35.4	173.8	-165.6	-177.5	-58.1	-166.5	0.6	112.9	R9 R10 L11 N17	R9-R13 WeakPolarHBondContact O-CB 3.42Å; R9-R13 PolarHBondContact O-N 2.8Å; R10-R13 WeakPolarHBondContact O-CB 3.38Å; R10-R13 PolarHBondContact O-N 2.74Å; L11-R13 VanDerWaalsContact C-N 3.26Å; L11-R13 PolarHBondContact O-N 3.39Å; R13-N17 WeakPolarHBondContact O-CB 3.4Å; R13-N17 VanDerWaalsContact O-CG 3.23Å; R13-N17 PolarHBondContact O-N 2.95Å; R13-N17 VanDerWaalsContact O-N 3.13Å; R13-N17 PolarHBondContact O-OD1 2.91Å
14	M	83.4	Confident	82.9	Confident	10 Å²	10	77.9 Å²	77.9	5%	0.049	35%	0.354	C	S	.	.	H	α-helix	trans	-66.4	-45.8	176.1	-66.6	170.3	69.1	0	0	110.8	R10 L11 K16 N17 K18 D21 A25 Y28	R10-M14 PolarHBondContact O-N 3Å; L11-M14 HydrophobicContact CD2-SD 4.26Å; L11-M14 PolarHBondContact O-N 3.22Å; L11-M14 VanDerWaalsContact O-N 3.17Å; M14-K16 PolarHBondContact O-N 2.89Å; M14-N17 PolarHBondContact O-N 3.03Å; M14-K18 PolarHBondContact O-N 2.87Å; M14-D21 HydrophobicContact CE-CB 4.22Å; M14-D21 WeakPolarHBondContact CE-O 3.44Å; M14-A25 HydrophobicContact CE-CB 4.33Å; M14-Y28 HydrophobicContact SD-CD2 4.06Å; M14-Y28 HydrophobicContact SD-CE2 4.08Å
15	L	84.3	Confident	82.9	Confident	15 Å²	15	77.9 Å²	77.9	8%	0.079	35%	0.354	C	S	.	.	H	α-helix	trans	-55.7	-50.6	172.8	-66.1	173.2	0	0	0	111.8	L11 N17 K18 I20 I50 K53 I54 E57	L11-L15 PolarHBondContact O-N 3.17Å; L15-N17 PolarHBondContact O-N 3.01Å; L15-K18 PolarHBondContact O-N 2.83Å; L15-K18 VanDerWaalsContact O-N 3.14Å; L15-I20 HydrophobicContact CD2-CD1 4.33Å; L15-I50 HydrophobicContact CD1-CG2 4.04Å; L15-K53 HydrophobicContact CD1-CB 3.74Å; L15-K53 HydrophobicContact CD1-CD 3.86Å; L15-K53 HydrophobicContact CD1-CG 4.48Å; L15-K53 HydrophobicContact CD2-CB 4.1Å; L15-I54 HydrophobicContact CD1-CG1 4.15Å; L15-I54 HydrophobicContact CD2-CG1 3.71Å; L15-I54 HydrophobicContact CG-CG1 3.98Å; L15-E57 VanDerWaalsContact CD2-OE2 3.27Å; L15-E57 WeakPolarHBondContact CD2-OE2 3.46Å
16	K	83.2	Confident	83	Confident	149 Å²	149	76.2 Å²	76.2	65%	0.648	35%	0.347	S	S	*	.	H	α-helix	trans	-59.6	-32.7	179.3	-79.4	169.4	175.1	165.2	0	113.7	D12 M14	D12-K16 WeakPolarHBondContact O-CB 3.38Å; D12-K16 WeakPolarHBondContact O-CG 3.31Å; D12-K16 PolarHBondContact O-N 3.25Å; D12-K16 IonicContact OD1-NZ 3.3Å; D12-K16 WeakPolarHBondContact OD2-CE 3.41Å; D12-K16 IonicContact OD2-NZ 2.74Å; D12-K16 PolarHBondContact OD2-NZ 3.18Å; M14-K16 PolarHBondContact O-N 2.89Å
17	N	77.1	Confident	83	Confident	108 Å²	108	77.3 Å²	77.3	58%	0.578	35%	0.35	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84.4	-6	-178.7	-72.3	3.5	0	0	0	113.8	R13 M14 L15 K19	R13-N17 WeakPolarHBondContact O-CB 3.4Å; R13-N17 VanDerWaalsContact O-CG 3.23Å; R13-N17 PolarHBondContact O-N 2.95Å; R13-N17 VanDerWaalsContact O-N 3.13Å; R13-N17 PolarHBondContact O-OD1 2.91Å; M14-N17 PolarHBondContact O-N 3.03Å; L15-N17 PolarHBondContact O-N 3.01Å; N17-K19 PolarHBondContact O-N 3.11Å; N17-K19 VanDerWaalsContact O-N 3.07Å
18	K	72.1	Confident	83.1	Confident	190 Å²	190	79 Å²	79	83%	0.826	36%	0.356	S	S	*	.	T	Hydrogen-bonded Turn	trans	49.7	27.4	-170.2	-63.1	-172.1	175.9	-174.9	0	114	M14 L15	M14-K18 PolarHBondContact O-N 2.87Å; L15-K18 PolarHBondContact O-N 2.83Å; L15-K18 VanDerWaalsContact O-N 3.14Å
19	K	70.4	Confident	83.1	Confident	151 Å²	151	78.9 Å²	78.9	66%	0.657	36%	0.355	S	S	*	.			trans	-123.7	99.5	173.4	-71.2	-168.1	176.1	-169	0	107	N17	N17-K19 PolarHBondContact O-N 3.11Å; N17-K19 VanDerWaalsContact O-N 3.07Å
20	I	71	Confident	83.2	Confident	38 Å²	38	77.6 Å²	77.6	20%	0.195	35%	0.35	C	S	.	.			trans	-98.1	93.9	176.8	-62	177.1	0	0	0	105.8	L15 D22 A25 E57	L15-I20 HydrophobicContact CD2-CD1 4.33Å; I20-D22 WeakPolarHBondContact CG2-OD1 3.46Å; I20-D22 PolarHBondContact O-N 3.38Å; I20-D22 VanDerWaalsContact O-N 3.11Å; I20-A25 HydrophobicContact CG2-CB 4.5Å; I20-E57 HydrophobicContact CD1-CB 3.33Å
21	D	80.6	Confident	83.2	Confident	85 Å²	85	78.9 Å²	78.9	46%	0.455	36%	0.355	S	S	.	.			trans	-74.4	96.6	170.7	-36.7	-57.1	0	0	0	106.6	M14 E23 S24 A25	M14-D21 HydrophobicContact CE-CB 4.22Å; M14-D21 WeakPolarHBondContact CE-O 3.44Å; D21-E23 VanDerWaalsContact C-N 3.28Å; D21-E23 PolarHBondContact O-N 2.81Å; D21-S24 WeakPolarHBondContact O-CA 3.46Å; D21-S24 VanDerWaalsContact O-CB 3.31Å; D21-S24 WeakPolarHBondContact O-CB 3.45Å; D21-S24 PolarHBondContact O-N 2.96Å; D21-A25 PolarHBondContact O-N 3.2Å
22	D	79.7	Confident	83.2	Confident	43 Å²	43	79 Å²	79	23%	0.23	36%	0.355	C	S	.	.	H	α-helix	trans	-59.2	-35	-168.7	-77.9	-55.7	0	0	0	113.2	I20 S24 A25 L26 S58 D60 V63	I20-D22 WeakPolarHBondContact CG2-OD1 3.46Å; I20-D22 PolarHBondContact O-N 3.38Å; I20-D22 VanDerWaalsContact O-N 3.11Å; D22-S24 VanDerWaalsContact C-N 3.28Å; D22-S24 PolarHBondContact O-N 2.86Å; D22-A25 CarbonylContact O-C 3.46Å; D22-A25 WeakPolarHBondContact O-CB 3.33Å; D22-A25 PolarHBondContact O-N 3.23Å; D22-A25 VanDerWaalsContact O-N 3.08Å; D22-L26 WeakPolarHBondContact O-CG 3.25Å; D22-L26 PolarHBondContact O-N 2.62Å; D22-S58 VanDerWaalsContact OD1-CB 3.23Å; D22-S58 WeakPolarHBondContact OD1-CB 3.32Å; D22-D60 HydrophobicContact CB-CB 4Å; D22-V63 HydrophobicContact CB-CG2 4.44Å
23	E	82.6	Confident	83.2	Confident	173 Å²	173	85.3 Å²	85.3	81%	0.808	38%	0.376	S	S	*	.	H	α-helix	trans	-55.4	-41.4	169.8	-65.8	-167.2	146.5	0	0	112.8	D21 K27	D21-E23 VanDerWaalsContact C-N 3.28Å; D21-E23 PolarHBondContact O-N 2.81Å; E23-K27 WeakPolarHBondContact O-CB 3.38Å; E23-K27 PolarHBondContact O-N 3.07Å
24	S	84.4	Confident	83.2	Confident	32 Å²	32	82.3 Å²	82.3	22%	0.224	38%	0.377	C	S	.	.	H	α-helix	trans	-70.2	-40.5	175.8	-71.4	0	0	0	0	110.9	D21 D22 L26 K27 Y28	D21-S24 WeakPolarHBondContact O-CA 3.46Å; D21-S24 VanDerWaalsContact O-CB 3.31Å; D21-S24 WeakPolarHBondContact O-CB 3.45Å; D21-S24 PolarHBondContact O-N 2.96Å; D22-S24 VanDerWaalsContact C-N 3.28Å; D22-S24 PolarHBondContact O-N 2.86Å; S24-L26 VanDerWaalsContact C-N 3.34Å; S24-L26 PolarHBondContact O-N 3.47Å; S24-K27 WeakPolarHBondContact O-CB 3.4Å; S24-K27 PolarHBondContact O-N 3.41Å; S24-Y28 WeakPolarHBondContact O-CD2 3.36Å; S24-Y28 PolarHBondContact O-N 3.07Å
25	A	85.6	Confident	83.2	Confident	1 Å²	1	83.5 Å²	83.5	1%	0.008	38%	0.383	C	S	.	.	H	α-helix	trans	-59.5	-45.2	175.1	0	0	0	0	0	111.2	M14 I20 D21 D22 Y28 L29 I54 V63	M14-A25 HydrophobicContact CE-CB 4.33Å; I20-A25 HydrophobicContact CG2-CB 4.5Å; D21-A25 PolarHBondContact O-N 3.2Å; D22-A25 CarbonylContact O-C 3.46Å; D22-A25 WeakPolarHBondContact O-CB 3.33Å; D22-A25 PolarHBondContact O-N 3.23Å; D22-A25 VanDerWaalsContact O-N 3.08Å; A25-Y28 PolarHBondContact O-N 3.31Å; A25-L29 WeakPolarHBondContact O-CB 3.44Å; A25-L29 WeakPolarHBondContact O-CG 3.41Å; A25-L29 PolarHBondContact O-N 3.05Å; A25-I54 HydrophobicContact CB-CG2 4.47Å; A25-V63 HydrophobicContact CB-CG1 4.44Å; A25-V63 HydrophobicContact CB-CG2 4.28Å
26	L	86.8	Confident	83	Confident	24 Å²	24	91.3 Å²	91.3	13%	0.126	42%	0.419	C	S	.	.	H	α-helix	trans	-60.1	-45.5	173.4	-70.7	175.5	0	0	0	112.3	D22 S24 Y28 L29 R30 E62 V63 L66	D22-L26 WeakPolarHBondContact O-CG 3.25Å; D22-L26 PolarHBondContact O-N 2.62Å; S24-L26 VanDerWaalsContact C-N 3.34Å; S24-L26 PolarHBondContact O-N 3.47Å; L26-Y28 VanDerWaalsContact C-N 3.33Å; L26-Y28 PolarHBondContact O-N 2.72Å; L26-L29 PolarHBondContact O-N 3.18Å; L26-R30 VanDerWaalsContact O-CB 3.3Å; L26-R30 WeakPolarHBondContact O-CB 3.47Å; L26-R30 WeakPolarHBondContact O-CG 3.17Å; L26-R30 PolarHBondContact O-N 2.56Å; L26-E62 HydrophobicContact CD1-CB 4.32Å; L26-E62 HydrophobicContact CD2-CB 3.56Å; L26-V63 HydrophobicContact CD2-CB 4.36Å; L26-V63 HydrophobicContact CD2-CG2 3.53Å; L26-V63 HydrophobicContact CG-CG2 3.67Å; L26-L66 HydrophobicContact CD2-CD1 3.94Å
27	K	89.7	Confident	82.9	Confident	150 Å²	150	85.1 Å²	85.1	65%	0.652	39%	0.393	S	S	*	.	H	α-helix	trans	-58.2	-44	176.6	-174.7	174	-177.3	171.7	0	111.9	E23 S24 R31	E23-K27 WeakPolarHBondContact O-CB 3.38Å; E23-K27 PolarHBondContact O-N 3.07Å; S24-K27 WeakPolarHBondContact O-CB 3.4Å; S24-K27 PolarHBondContact O-N 3.41Å; K27-R31 PolarHBondContact O-N 3.49Å; K27-R31 VanDerWaalsContact O-N 3.1Å
28	Y	89.1	Confident	83.3	Confident	43 Å²	43	83.5 Å²	83.5	17%	0.169	39%	0.387	C	S	.	.	H	α-helix	trans	-72	-40	178.6	-70.1	-49.9	0	0	0	113.1	V7 R10 L11 M14 S24 A25 L26 R31 L32	V7-Y28 HydrophobicContact CG1-CD1 3.84Å; V7-Y28 HydrophobicContact CG1-CG 4Å; V7-Y28 HydrophobicContact CG2-CD1 4.27Å; R10-Y28 HydrophobicContact CG-CD2 4.22Å; R10-Y28 HydrophobicContact CG-CE1 3.94Å; R10-Y28 HydrophobicContact CG-CE2 3.51Å; R10-Y28 WeakPolarHBondContact CG-OH 3.29Å; R10-Y28 PolarHBondContact NE-OH 2.99Å; L11-Y28 HydrophobicContact CD2-CD2 3.82Å; L11-Y28 HydrophobicContact CD2-CG 4.01Å; L11-Y28 HydrophobicContact CG-CG 4.47Å; M14-Y28 HydrophobicContact SD-CD2 4.06Å; M14-Y28 HydrophobicContact SD-CE2 4.08Å; S24-Y28 WeakPolarHBondContact O-CD2 3.36Å; S24-Y28 PolarHBondContact O-N 3.07Å; A25-Y28 PolarHBondContact O-N 3.31Å; L26-Y28 VanDerWaalsContact C-N 3.33Å; L26-Y28 PolarHBondContact O-N 2.72Å; Y28-R31 PolarHBondContact O-N 2.86Å; Y28-L32 WeakPolarHBondContact O-CG 3.41Å; Y28-L32 PolarHBondContact O-N 3.44Å
29	L	88	Confident	83.8	Confident	3 Å²	3	78.3 Å²	78.3	2%	0.016	37%	0.367	C	S	.	.	H	α-helix	trans	-63.1	-41	172.8	-72.8	175.7	0	0	0	111.9	A25 L26 R31 L32 R33 I51 V63 L66 M70	A25-L29 WeakPolarHBondContact O-CB 3.44Å; A25-L29 WeakPolarHBondContact O-CG 3.41Å; A25-L29 PolarHBondContact O-N 3.05Å; L26-L29 PolarHBondContact O-N 3.18Å; L29-R31 PolarHBondContact O-N 3.18Å; L29-L32 PolarHBondContact O-N 3.49Å; L29-R33 PolarHBondContact O-N 2.89Å; L29-I51 HydrophobicContact CD2-CD1 3.78Å; L29-I51 HydrophobicContact CD2-CG1 3.91Å; L29-I51 HydrophobicContact CD2-CG2 4.1Å; L29-V63 HydrophobicContact CD1-CB 4.42Å; L29-V63 HydrophobicContact CD1-CG1 3.82Å; L29-L66 HydrophobicContact CD1-CB 4.33Å; L29-M70 HydrophobicContact CB-SD 4.45Å; L29-M70 HydrophobicContact CD2-CE 4.27Å; L29-M70 HydrophobicContact CD2-SD 3.98Å
30	R	89.3	Confident	84.5	Confident	137 Å²	137	76.2 Å²	76.2	52%	0.517	36%	0.36	S	S	.	.	H	α-helix	trans	-64.3	-37.9	176.3	-71.4	169.1	-175.8	-112	4.9	111.6	L26 R33 S34 E62 L66	L26-R30 VanDerWaalsContact O-CB 3.3Å; L26-R30 WeakPolarHBondContact O-CB 3.47Å; L26-R30 WeakPolarHBondContact O-CG 3.17Å; L26-R30 PolarHBondContact O-N 2.56Å; R30-R33 PolarHBondContact O-N 3.05Å; R30-S34 PolarHBondContact O-N 2.81Å; R30-E62 IonicContact CZ-OE2 2.69Å; R30-E62 IonicContact NH2-OE1 2.64Å; R30-E62 IonicContact NH2-OE2 3.55Å; R30-E62 PolarHBondContact NH2-OE2 3.19Å; R30-L66 HydrophobicContact CG-CD1 4.41Å
31	R	89.1	Confident	85.1	Confident	121 Å²	121	75.3 Å²	75.3	46%	0.457	36%	0.355	S	S	.	.	H	α-helix	trans	-68.3	-39	171.8	-174.2	60.2	178	-167.2	2.4	113	E3 V7 K27 Y28 L29 R33 S34	E3-R31 IonicContact OE1-CZ 2.66Å; E3-R31 IonicContact OE1-NH2 2.64Å; E3-R31 PolarHBondContact OE1-NH2 3.43Å; E3-R31 IonicContact OE2-CZ 2.72Å; E3-R31 IonicContact OE2-NE 3.59Å; E3-R31 PolarHBondContact OE2-NE 3.11Å; E3-R31 IonicContact OE2-NH2 2.64Å; E3-R31 PolarHBondContact OE2-NH2 2.93Å; V7-R31 HydrophobicContact CG2-CG 4.41Å; K27-R31 PolarHBondContact O-N 3.49Å; K27-R31 VanDerWaalsContact O-N 3.1Å; Y28-R31 PolarHBondContact O-N 2.86Å; L29-R31 PolarHBondContact O-N 3.18Å; R31-R33 VanDerWaalsContact C-N 3.28Å; R31-R33 PolarHBondContact O-N 3.32Å; R31-S34 PolarHBondContact O-N 3.17Å; R31-S34 PolarHBondContact O-OG 3.25Å
32	L	87.2	Confident	85.3	Confident	1 Å²	1	72.6 Å²	72.6	1%	0.005	34%	0.341	C	S	.	.	H	α-helix	trans	-66.9	-28.2	174.8	-75.1	172	0	0	0	112.9	T4 V7 L11 Y28 L29 S34 I35 V47 I51 M70	T4-L32 HydrophobicContact CG2-CD2 3.86Å; V7-L32 HydrophobicContact CB-CD2 4.16Å; V7-L32 HydrophobicContact CB-CG 4.23Å; V7-L32 HydrophobicContact CG1-CD1 3.75Å; V7-L32 HydrophobicContact CG1-CD2 4.2Å; V7-L32 HydrophobicContact CG1-CG 3.73Å; L11-L32 HydrophobicContact CD1-CD1 3.89Å; Y28-L32 WeakPolarHBondContact O-CG 3.41Å; Y28-L32 PolarHBondContact O-N 3.44Å; L29-L32 PolarHBondContact O-N 3.49Å; L32-S34 VanDerWaalsContact C-N 3.33Å; L32-I35 PolarHBondContact O-N 3.37Å; L32-V47 HydrophobicContact CD1-CG2 3.81Å; L32-V47 HydrophobicContact CD2-CG2 4.3Å; L32-I51 HydrophobicContact CD1-CD1 4.07Å; L32-M70 HydrophobicContact CB-CE 3.48Å; L32-M70 VanDerWaalsContact CB-CE 3.48Å; L32-M70 HydrophobicContact CD1-CE 4.49Å
33	R	87.4	Confident	85.5	Confident	176 Å²	176	75.4 Å²	75.4	66%	0.664	36%	0.36	S	S	*	.	H	α-helix	trans	-69.3	-27	173.2	-177.9	176.9	172.9	-170.8	-3.6	113.2	L29 R30 R31 I35	L29-R33 PolarHBondContact O-N 2.89Å; R30-R33 PolarHBondContact O-N 3.05Å; R31-R33 VanDerWaalsContact C-N 3.28Å; R31-R33 PolarHBondContact O-N 3.32Å; R33-I35 VanDerWaalsContact C-N 3.34Å
34	S	86.2	Confident	85.7	Confident	79 Å²	79	73.1 Å²	73.1	55%	0.552	35%	0.347	S	S	*	.	T	Hydrogen-bonded Turn	trans	-84	-2.8	176	50.3	0	0	0	0	114.7	R30 R31 L32	R30-S34 PolarHBondContact O-N 2.81Å; R31-S34 PolarHBondContact O-N 3.17Å; R31-S34 PolarHBondContact O-OG 3.25Å; L32-S34 VanDerWaalsContact C-N 3.33Å
35	I	84.2	Confident	85.7	Confident	34 Å²	34	72.6 Å²	72.6	17%	0.174	34%	0.342	C	S	.	.	S	Bend	trans	-104.3	121.9	178.9	-62.9	167	0	0	0	108.5	E3 L32 R33 M37	E3-I35 HydrophobicContact CB-CD1 3.88Å; L32-I35 PolarHBondContact O-N 3.37Å; R33-I35 VanDerWaalsContact C-N 3.34Å; I35-M37 PolarHBondContact O-N 2.83Å
36	E	79.4	Confident	85.7	Confident	180 Å²	180	73.8 Å²	73.8	84%	0.841	36%	0.355	S	S	*	.			trans	-63.9	126.6	172	-63.5	-167.3	150.3	0	0	110.2
37	M	81.5	Confident	85.8	Confident	19 Å²	19	72.6 Å²	72.6	9%	0.094	35%	0.349	C	S	.	.			trans	-104.6	124.9	-170.2	-166.8	62.7	61.8	0	0	110.1	T4 I35 I41 L42 V47 W74 L77	T4-M37 HydrophobicContact CG2-CE 3.77Å; T4-M37 HydrophobicContact CG2-SD 4.34Å; I35-M37 PolarHBondContact O-N 2.83Å; M37-I41 HydrophobicContact CE-CG2 4.46Å; M37-I41 HydrophobicContact SD-CB 3.78Å; M37-I41 HydrophobicContact SD-CG2 3.47Å; M37-I41 WeakPolarHBondContact SD-CG2 3.48Å; M37-L42 HydrophobicContact CG-CD1 3.75Å; M37-L42 HydrophobicContact CG-CD2 4.29Å; M37-L42 HydrophobicContact CG-CG 3.63Å; M37-L42 HydrophobicContact SD-CG 4.16Å; M37-V47 HydrophobicContact CE-CG1 4.26Å; M37-V47 HydrophobicContact SD-CG1 4.43Å; M37-W74 HydrophobicContact CB-CZ2 4.4Å; M37-W74 VanDerWaalsContact CB-NE1 3.35Å; M37-W74 HydrophobicContact CE-CH2 3.83Å; M37-W74 HydrophobicContact CE-CZ2 3.5Å; M37-W74 VanDerWaalsContact CE-CZ2 3.5Å; M37-W74 HydrophobicContact CG-CD2 4.09Å; M37-W74 HydrophobicContact CG-CG 4.21Å; M37-W74 HydrophobicContact CG-CZ2 4.2Å; M37-L77 WeakPolarHBondContact O-CD1 3.36Å
38	T	84.2	Confident	85.7	Confident	73 Å²	73	66.6 Å²	66.6	45%	0.448	33%	0.329	S	S	.	.			trans	-107.5	161.7	174.9	68.2	0	0	0	0	111.3	E40 I41 L42	T38-E40 PolarHBondContact O-N 2.88Å; T38-I41 PolarHBondContact O-N 2.83Å; T38-I41 WeakPolarHBondContact OG1-CG1 3.37Å; T38-L42 PolarHBondContact O-N 2.83Å
39	L	83.9	Confident	85.6	Confident	81 Å²	81	70.1 Å²	70.1	42%	0.424	35%	0.349	S	S	.	.	H	α-helix	trans	-55.3	-38.4	178.1	-176.7	65.9	0	0	0	112.4	L42 T43 V78	L39-L42 PolarHBondContact O-N 3.17Å; L39-T43 WeakPolarHBondContact O-CG2 3.22Å; L39-T43 PolarHBondContact O-N 2.79Å; L39-T43 PolarHBondContact O-OG1 3.43Å; L39-V78 HydrophobicContact CD1-CG2 4.22Å
40	E	83.7	Confident	85.6	Confident	108 Å²	108	71 Å²	71	51%	0.505	35%	0.354	S	S	.	.	H	α-helix	trans	-62.3	-43	174.3	-76.6	-165.5	-133.5	0	0	113.1	T38 T43 K44	T38-E40 PolarHBondContact O-N 2.88Å; E40-T43 WeakPolarHBondContact CA-OG1 3.47Å; E40-T43 PolarHBondContact O-N 3.35Å; E40-T43 PolarHBondContact O-OG1 3.39Å; E40-T43 VanDerWaalsContact O-OG1 3.06Å; E40-K44 VanDerWaalsContact O-CB 3.24Å; E40-K44 WeakPolarHBondContact O-CB 3.38Å; E40-K44 VanDerWaalsContact O-CG 3.23Å; E40-K44 WeakPolarHBondContact O-CG 3.45Å; E40-K44 PolarHBondContact O-N 3.14Å; E40-K44 IonicContact OE2-NZ 3.84Å; E40-K44 PolarHBondContact OE2-NZ 3.43Å
41	I	84.5	Confident	85.5	Confident	18 Å²	18	64.5 Å²	64.5	9%	0.092	33%	0.329	C	S	.	.	H	α-helix	trans	-70.8	-39.3	-178.6	-59.5	167.8	0	0	0	109.5	M1 T4 M37 T38 T43 T45	M1-I41 HydrophobicContact CE-CG1 4.2Å; T4-I41 HydrophobicContact CG2-CG2 3.65Å; M37-I41 HydrophobicContact CE-CG2 4.46Å; M37-I41 HydrophobicContact SD-CB 3.78Å; M37-I41 HydrophobicContact SD-CG2 3.47Å; M37-I41 WeakPolarHBondContact SD-CG2 3.48Å; T38-I41 PolarHBondContact O-N 2.83Å; T38-I41 WeakPolarHBondContact OG1-CG1 3.37Å; I41-T43 PolarHBondContact O-N 3.4Å; I41-T45 HydrophobicContact CG2-CG2 3.87Å; I41-T45 VanDerWaalsContact O-CB 3.32Å; I41-T45 WeakPolarHBondContact O-CB 3.48Å; I41-T45 VanDerWaalsContact O-CG2 3.3Å; I41-T45 WeakPolarHBondContact O-CG2 3.11Å; I41-T45 PolarHBondContact O-N 2.91Å; I41-T45 PolarHBondContact O-OG1 3.25Å
42	L	84.6	Confident	85.5	Confident	28 Å²	28	61.5 Å²	61.5	15%	0.147	32%	0.323	C	S	.	.	H	α-helix	trans	-57.8	-45.9	173	-84.6	153.1	0	0	0	112.7	M37 T38 L39 G46 V47 W74 L77	M37-L42 HydrophobicContact CG-CD1 3.75Å; M37-L42 HydrophobicContact CG-CD2 4.29Å; M37-L42 HydrophobicContact CG-CG 3.63Å; M37-L42 HydrophobicContact SD-CG 4.16Å; T38-L42 PolarHBondContact O-N 2.83Å; L39-L42 PolarHBondContact O-N 3.17Å; L42-G46 PolarHBondContact O-N 3.07Å; L42-V47 HydrophobicContact CD2-CG1 4.49Å; L42-W74 HydrophobicContact CD1-CB 3.92Å; L42-W74 HydrophobicContact CD1-CG 4.23Å; L42-W74 HydrophobicContact CD2-CB 3.97Å; L42-W74 HydrophobicContact CD2-CD2 4Å; L42-W74 HydrophobicContact CD2-CE3 3.68Å; L42-W74 HydrophobicContact CD2-CG 4.14Å; L42-W74 HydrophobicContact CD2-CZ3 4.42Å; L42-L77 HydrophobicContact CD1-CD1 4.29Å
43	T	84.1	Confident	85.5	Confident	103 Å²	103	66.1 Å²	66.1	63%	0.632	34%	0.343	S	S	*	.	H	α-helix	trans	-74	-41.5	-179.2	48.1	0	0	0	0	112.8	L39 E40 I41	L39-T43 WeakPolarHBondContact O-CG2 3.22Å; L39-T43 PolarHBondContact O-N 2.79Å; L39-T43 PolarHBondContact O-OG1 3.43Å; E40-T43 WeakPolarHBondContact CA-OG1 3.47Å; E40-T43 PolarHBondContact O-N 3.35Å; E40-T43 PolarHBondContact O-OG1 3.39Å; E40-T43 VanDerWaalsContact O-OG1 3.06Å; I41-T43 PolarHBondContact O-N 3.4Å
44	K	85.9	Confident	85.4	Confident	125 Å²	125	57.9 Å²	57.9	54%	0.543	31%	0.312	S	S	.	.	H	α-helix	trans	-71.5	-37.1	179.9	-70.2	168.4	177.2	173.1	0	113.5	M1 E40	M1-K44 HydrophobicContact CE-CD 3.96Å; M1-K44 HydrophobicContact SD-CD 3.98Å; E40-K44 VanDerWaalsContact O-CB 3.24Å; E40-K44 WeakPolarHBondContact O-CB 3.38Å; E40-K44 VanDerWaalsContact O-CG 3.23Å; E40-K44 WeakPolarHBondContact O-CG 3.45Å; E40-K44 PolarHBondContact O-N 3.14Å; E40-K44 IonicContact OE2-NZ 3.84Å; E40-K44 PolarHBondContact OE2-NZ 3.43Å
45	T	85.9	Confident	85.3	Confident	20 Å²	20	58.5 Å²	58.5	12%	0.123	30%	0.302	C	S	.	.	H	α-helix	trans	-94.7	-19.9	-173.7	66.4	0	0	0	0	114.9	T4 E5 I41 V47	T4-T45 HydrophobicContact CG2-CG2 4.12Å; E5-T45 HydrophobicContact CG-CG2 3.81Å; I41-T45 HydrophobicContact CG2-CG2 3.87Å; I41-T45 VanDerWaalsContact O-CB 3.32Å; I41-T45 WeakPolarHBondContact O-CB 3.48Å; I41-T45 VanDerWaalsContact O-CG2 3.3Å; I41-T45 WeakPolarHBondContact O-CG2 3.11Å; I41-T45 PolarHBondContact O-N 2.91Å; I41-T45 PolarHBondContact O-OG1 3.25Å; T45-V47 PolarHBondContact O-N 2.86Å; T45-V47 VanDerWaalsContact O-N 3.11Å; T45-V47 WeakPolarHBondContact OG1-CB 3.25Å; T45-V47 WeakPolarHBondContact OG1-CG1 3.43Å; T45-V47 PolarHBondContact OG1-N 3.32Å
46	G	86	Confident	85.4	Confident	26 Å²	26	64.4 Å²	64.4	27%	0.268	33%	0.327	S	S	.	.			trans	63.5	10.9	-174.3	0	0	0	0	0	114.8	L42 G48 I49	L42-G46 PolarHBondContact O-N 3.07Å; G46-G48 PolarHBondContact O-N 3.17Å; G46-G48 VanDerWaalsContact O-N 3.09Å; G46-I49 WeakPolarHBondContact O-CB 3.5Å; G46-I49 PolarHBondContact O-N 2.79Å
47	V	88.1	Confident	85.5	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	31%	0.308	C	S	.	.	H	α-helix	trans	-56.7	-32	-168.6	65.6	0	0	0	0	114	T4 A8 L32 M37 L42 T45 I49 I50 I51 W74	T4-V47 HydrophobicContact CG2-CG1 4.42Å; A8-V47 HydrophobicContact CB-CB 4.48Å; A8-V47 HydrophobicContact CB-CG2 4.46Å; L32-V47 HydrophobicContact CD1-CG2 3.81Å; L32-V47 HydrophobicContact CD2-CG2 4.3Å; M37-V47 HydrophobicContact CE-CG1 4.26Å; M37-V47 HydrophobicContact SD-CG1 4.43Å; L42-V47 HydrophobicContact CD2-CG1 4.49Å; T45-V47 PolarHBondContact O-N 2.86Å; T45-V47 VanDerWaalsContact O-N 3.11Å; T45-V47 WeakPolarHBondContact OG1-CB 3.25Å; T45-V47 WeakPolarHBondContact OG1-CG1 3.43Å; T45-V47 PolarHBondContact OG1-N 3.32Å; V47-I49 VanDerWaalsContact C-N 3.28Å; V47-I49 PolarHBondContact O-N 2.88Å; V47-I50 PolarHBondContact O-N 2.95Å; V47-I51 HydrophobicContact CG2-CD1 4.26Å; V47-I51 HydrophobicContact CG2-CG1 4.37Å; V47-I51 WeakPolarHBondContact O-CG1 3.45Å; V47-I51 PolarHBondContact O-N 3.1Å; V47-W74 HydrophobicContact CG1-CH2 4.06Å; V47-W74 HydrophobicContact CG1-CZ3 3.79Å; V47-W74 HydrophobicContact CG2-CH2 4.36Å; V47-W74 HydrophobicContact CG2-CZ3 4.42Å
48	G	87	Confident	85.4	Confident	23 Å²	23	60 Å²	60	24%	0.237	31%	0.307	C	S	.	.	H	α-helix	trans	-62.6	-30.4	175.3	0	0	0	0	0	114.2	G46 N52	G46-G48 PolarHBondContact O-N 3.17Å; G46-G48 VanDerWaalsContact O-N 3.09Å; G48-N52 WeakPolarHBondContact O-CB 3.48Å; G48-N52 PolarHBondContact O-N 2.97Å
49	I	87	Confident	85.1	Confident	117 Å²	117	65.8 Å²	65.8	60%	0.6	33%	0.329	S	S	*	.	H	α-helix	trans	-72.2	-43.1	174.8	-56.4	176	0	0	0	109.7	G46 V47 N52 K53	G46-I49 WeakPolarHBondContact O-CB 3.5Å; G46-I49 PolarHBondContact O-N 2.79Å; V47-I49 VanDerWaalsContact C-N 3.28Å; V47-I49 PolarHBondContact O-N 2.88Å; I49-N52 PolarHBondContact O-N 2.92Å; I49-K53 PolarHBondContact O-N 3.02Å
50	I	88.3	Confident	85.1	Confident	21 Å²	21	64.4 Å²	64.4	11%	0.108	32%	0.322	C	S	.	.	H	α-helix	trans	-64.2	-47.5	-178.3	-59.7	169.8	0	0	0	110.4	A8 L11 D12 L15 V47 N52 K53 I54	A8-I50 HydrophobicContact CB-CD1 3.9Å; L11-I50 HydrophobicContact CB-CG2 3.65Å; D12-I50 HydrophobicContact CB-CD1 4.27Å; L15-I50 HydrophobicContact CD1-CG2 4.04Å; V47-I50 PolarHBondContact O-N 2.95Å; I50-N52 VanDerWaalsContact C-N 3.3Å; I50-N52 PolarHBondContact O-N 3.45Å; I50-K53 WeakPolarHBondContact O-CB 3.29Å; I50-K53 PolarHBondContact O-N 3.09Å; I50-K53 VanDerWaalsContact O-N 3.15Å; I50-I54 HydrophobicContact CG2-CD1 4.12Å; I50-I54 PolarHBondContact O-N 2.91Å
51	I	88.3	Confident	85.2	Confident	1 Å²	1	63.8 Å²	63.8	1%	0.005	33%	0.327	C	S	.	.	H	α-helix	trans	-61.3	-39.4	175.2	-64.4	-179.2	0	0	0	111.1	L29 L32 V47 K53 I54 R55 M70 I71 W74	L29-I51 HydrophobicContact CD2-CD1 3.78Å; L29-I51 HydrophobicContact CD2-CG1 3.91Å; L29-I51 HydrophobicContact CD2-CG2 4.1Å; L32-I51 HydrophobicContact CD1-CD1 4.07Å; V47-I51 HydrophobicContact CG2-CD1 4.26Å; V47-I51 HydrophobicContact CG2-CG1 4.37Å; V47-I51 WeakPolarHBondContact O-CG1 3.45Å; V47-I51 PolarHBondContact O-N 3.1Å; I51-K53 VanDerWaalsContact C-N 3.26Å; I51-K53 PolarHBondContact O-N 3.24Å; I51-I54 PolarHBondContact O-N 3.15Å; I51-R55 VanDerWaalsContact O-CB 3.25Å; I51-R55 WeakPolarHBondContact O-CB 3.14Å; I51-R55 PolarHBondContact O-N 3.19Å; I51-M70 HydrophobicContact CD1-CE 3.65Å; I51-M70 HydrophobicContact CD1-SD 4.46Å; I51-I71 HydrophobicContact CG2-CD1 4.08Å; I51-I71 HydrophobicContact CG2-CG1 4.34Å; I51-W74 HydrophobicContact CD1-CH2 3.58Å; I51-W74 HydrophobicContact CD1-CZ3 3.58Å
52	N	88	Confident	85.2	Confident	59 Å²	59	67.2 Å²	67.2	32%	0.316	34%	0.343	S	S	.	.	H	α-helix	trans	-73.5	-14.6	179.2	-165.8	55.2	0	0	0	114	G48 I49 I50 R55 I71	G48-N52 WeakPolarHBondContact O-CB 3.48Å; G48-N52 PolarHBondContact O-N 2.97Å; I49-N52 PolarHBondContact O-N 2.92Å; I50-N52 VanDerWaalsContact C-N 3.3Å; I50-N52 PolarHBondContact O-N 3.45Å; N52-R55 PolarHBondContact OD1-NH1 2.66Å; N52-I71 HydrophobicContact CB-CD1 3.83Å
53	K	87.8	Confident	85.3	Confident	97 Å²	97	65.9 Å²	65.9	42%	0.422	34%	0.336	S	S	.	.	H	α-helix	trans	-79.2	-53.2	164.3	-71.6	-179.3	179.4	-177.7	0	111	L15 I49 I50 I51 R55 K56 E57	L15-K53 HydrophobicContact CD1-CB 3.74Å; L15-K53 HydrophobicContact CD1-CD 3.86Å; L15-K53 HydrophobicContact CD1-CG 4.48Å; L15-K53 HydrophobicContact CD2-CB 4.1Å; I49-K53 PolarHBondContact O-N 3.02Å; I50-K53 WeakPolarHBondContact O-CB 3.29Å; I50-K53 PolarHBondContact O-N 3.09Å; I50-K53 VanDerWaalsContact O-N 3.15Å; I51-K53 VanDerWaalsContact C-N 3.26Å; I51-K53 PolarHBondContact O-N 3.24Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 3.48Å; K53-K56 WeakPolarHBondContact O-CA 3.44Å; K53-K56 WeakPolarHBondContact O-CB 3.32Å; K53-K56 PolarHBondContact O-N 2.64Å; K53-E57 PolarHBondContact O-N 3.31Å
54	I	85.9	Confident	85.4	Confident	4 Å²	4	61.9 Å²	61.9	2%	0.021	31%	0.313	C	S	.	.	H	α-helix	trans	-51.7	-48	179.2	-68.9	167.2	0	0	0	110.9	L11 L15 A25 I50 I51 K56 E57 S58 V63	L11-I54 HydrophobicContact CB-CD1 3.78Å; L11-I54 HydrophobicContact CD1-CD1 3.92Å; L11-I54 HydrophobicContact CD2-CD1 3.65Å; L11-I54 HydrophobicContact CG-CD1 3.97Å; L15-I54 HydrophobicContact CD1-CG1 4.15Å; L15-I54 HydrophobicContact CD2-CG1 3.71Å; L15-I54 HydrophobicContact CG-CG1 3.98Å; A25-I54 HydrophobicContact CB-CG2 4.47Å; I50-I54 HydrophobicContact CG2-CD1 4.12Å; I50-I54 PolarHBondContact O-N 2.91Å; I51-I54 PolarHBondContact O-N 3.15Å; I54-K56 PolarHBondContact O-N 2.84Å; I54-E57 PolarHBondContact O-N 3.12Å; I54-S58 WeakPolarHBondContact O-CB 3.37Å; I54-S58 PolarHBondContact O-N 3.04Å; I54-S58 PolarHBondContact O-OG 2.8Å; I54-V63 HydrophobicContact CG2-CG1 3.62Å
55	R	83.5	Confident	85.5	Confident	91 Å²	91	59.2 Å²	59.2	34%	0.343	31%	0.308	S	S	.	.	H	α-helix	trans	-56.7	-9	176.1	-161.3	-148.5	104.7	-167.9	12	115.7	I51 N52 K53	I51-R55 VanDerWaalsContact O-CB 3.25Å; I51-R55 WeakPolarHBondContact O-CB 3.14Å; I51-R55 PolarHBondContact O-N 3.19Å; N52-R55 PolarHBondContact OD1-NH1 2.66Å; K53-R55 VanDerWaalsContact C-N 3.27Å; K53-R55 PolarHBondContact O-N 3.48Å
56	K	85	Confident	85.6	Confident	159 Å²	159	59.6 Å²	59.6	69%	0.691	31%	0.309	S	S	*	.	H	α-helix	trans	-108.6	-18.9	174.3	-65.4	179.9	173.8	-168.5	0	113.4	K53 I54	K53-K56 WeakPolarHBondContact O-CA 3.44Å; K53-K56 WeakPolarHBondContact O-CB 3.32Å; K53-K56 PolarHBondContact O-N 2.64Å; I54-K56 PolarHBondContact O-N 2.84Å
57	E	82.8	Confident	85.8	Confident	95 Å²	95	58.4 Å²	58.4	44%	0.444	30%	0.297	S	S	.	.	H	α-helix	trans	-111.2	-21.2	-172.1	-63	174	-139.3	0	0	111.9	L15 I20 K53 I54	L15-E57 VanDerWaalsContact CD2-OE2 3.27Å; L15-E57 WeakPolarHBondContact CD2-OE2 3.46Å; I20-E57 HydrophobicContact CD1-CB 3.33Å; K53-E57 PolarHBondContact O-N 3.31Å; I54-E57 PolarHBondContact O-N 3.12Å
58	S	78.8	Confident	85.7	Confident	12 Å²	12	63 Å²	63	8%	0.084	32%	0.316	C	S	.	.			trans	-78.8	131.2	167.3	61.5	0	0	0	0	111.1	D22 I54 D60 V63	D22-S58 VanDerWaalsContact OD1-CB 3.23Å; D22-S58 WeakPolarHBondContact OD1-CB 3.32Å; I54-S58 WeakPolarHBondContact O-CB 3.37Å; I54-S58 PolarHBondContact O-N 3.04Å; I54-S58 PolarHBondContact O-OG 2.8Å; S58-D60 VanDerWaalsContact C-N 3.3Å; S58-V63 VanDerWaalsContact OG-CG1 3.31Å; S58-V63 WeakPolarHBondContact OG-CG1 3.28Å
59	E	78.2	Confident	85.9	Confident	194 Å²	194	66 Å²	66	91%	0.907	33%	0.327	S	S	*	.			trans	-77.7	-20.8	172.9	-60.3	-173.4	171.8	0	0	111.9
60	D	84.1	Confident	85.9	Confident	52 Å²	52	60.6 Å²	60.6	28%	0.278	30%	0.299	S	S	.	.			trans	-76.5	125.7	-166.3	-161.4	38.1	0	0	0	114.1	D22 S58 E62 V63 A64	D22-D60 HydrophobicContact CB-CB 4Å; S58-D60 VanDerWaalsContact C-N 3.3Å; D60-E62 VanDerWaalsContact C-N 3.35Å; D60-E62 PolarHBondContact O-N 3.49Å; D60-V63 HydrophobicContact CB-CB 4.44Å; D60-V63 HydrophobicContact CB-CG2 4.01Å; D60-V63 PolarHBondContact O-N 2.91Å; D60-A64 PolarHBondContact O-N 3.5Å; D60-A64 VanDerWaalsContact O-N 3.17Å
61	P	84.6	Confident	85.9	Confident	94 Å²	94	61 Å²	61	61%	0.61	30%	0.301	S	S	*	.	H	α-helix	trans	-69.5	-25.9	-172.7	25.9	-35.3	0	0	0	114.2	T65	P61-T65 WeakPolarHBondContact O-CB 3.44Å; P61-T65 WeakPolarHBondContact O-CG2 3.37Å; P61-T65 PolarHBondContact O-N 3.47Å; P61-T65 PolarHBondContact O-OG1 3.45Å
62	E	85.2	Confident	85.8	Confident	90 Å²	90	67.8 Å²	67.8	42%	0.421	33%	0.331	S	S	.	.	H	α-helix	trans	-65.8	-45.6	172.9	-78.7	-150.8	-176.3	0	0	111.5	L26 R30 D60 A64 T65 L66	L26-E62 HydrophobicContact CD1-CB 4.32Å; L26-E62 HydrophobicContact CD2-CB 3.56Å; R30-E62 IonicContact CZ-OE2 2.69Å; R30-E62 IonicContact NH2-OE1 2.64Å; R30-E62 IonicContact NH2-OE2 3.55Å; R30-E62 PolarHBondContact NH2-OE2 3.19Å; D60-E62 VanDerWaalsContact C-N 3.35Å; D60-E62 PolarHBondContact O-N 3.49Å; E62-A64 VanDerWaalsContact C-N 3.31Å; E62-A64 PolarHBondContact O-N 3.06Å; E62-T65 PolarHBondContact O-N 3.11Å; E62-T65 PolarHBondContact O-OG1 2.98Å; E62-T65 VanDerWaalsContact O-OG1 3.1Å; E62-L66 WeakPolarHBondContact O-CB 3.35Å; E62-L66 WeakPolarHBondContact O-CG 3.47Å; E62-L66 PolarHBondContact O-N 3.01Å
63	V	86.5	Confident	85.8	Confident	1 Å²	1	70.4 Å²	70.4	1%	0.006	34%	0.341	C	S	.	.	H	α-helix	trans	-58.8	-47.1	176.6	-179.8	0	0	0	0	109.8	D22 A25 L26 L29 I54 S58 D60 T65 G67	D22-V63 HydrophobicContact CB-CG2 4.44Å; A25-V63 HydrophobicContact CB-CG1 4.44Å; A25-V63 HydrophobicContact CB-CG2 4.28Å; L26-V63 HydrophobicContact CD2-CB 4.36Å; L26-V63 HydrophobicContact CD2-CG2 3.53Å; L26-V63 HydrophobicContact CG-CG2 3.67Å; L29-V63 HydrophobicContact CD1-CB 4.42Å; L29-V63 HydrophobicContact CD1-CG1 3.82Å; I54-V63 HydrophobicContact CG2-CG1 3.62Å; S58-V63 VanDerWaalsContact OG-CG1 3.31Å; S58-V63 WeakPolarHBondContact OG-CG1 3.28Å; D60-V63 HydrophobicContact CB-CB 4.44Å; D60-V63 HydrophobicContact CB-CG2 4.01Å; D60-V63 PolarHBondContact O-N 2.91Å; V63-T65 PolarHBondContact O-N 2.64Å; V63-G67 PolarHBondContact O-N 3.18Å
64	A	86.3	Confident	85.8	Confident	18 Å²	18	66.8 Å²	66.8	15%	0.149	33%	0.325	C	S	.	.	H	α-helix	trans	-65.5	-34.8	-179.8	0	0	0	0	0	113.6	D60 E62 K68	D60-A64 PolarHBondContact O-N 3.5Å; D60-A64 VanDerWaalsContact O-N 3.17Å; E62-A64 VanDerWaalsContact C-N 3.31Å; E62-A64 PolarHBondContact O-N 3.06Å; A64-K68 WeakPolarHBondContact O-CB 3.38Å; A64-K68 VanDerWaalsContact O-CD 3.29Å; A64-K68 WeakPolarHBondContact O-CD 3.29Å; A64-K68 WeakPolarHBondContact O-CG 3.49Å; A64-K68 PolarHBondContact O-N 2.95Å
65	T	88.8	Confident	85.7	Confident	70 Å²	70	74 Å²	74	43%	0.429	36%	0.356	S	S	.	.	H	α-helix	trans	-80.5	-43.9	179.7	49.6	0	0	0	0	112.7	P61 E62 V63 K68 N69	P61-T65 WeakPolarHBondContact O-CB 3.44Å; P61-T65 WeakPolarHBondContact O-CG2 3.37Å; P61-T65 PolarHBondContact O-N 3.47Å; P61-T65 PolarHBondContact O-OG1 3.45Å; E62-T65 PolarHBondContact O-N 3.11Å; E62-T65 PolarHBondContact O-OG1 2.98Å; E62-T65 VanDerWaalsContact O-OG1 3.1Å; V63-T65 PolarHBondContact O-N 2.64Å; T65-K68 PolarHBondContact O-N 3Å; T65-N69 PolarHBondContact O-N 3.05Å; T65-N69 PolarHBondContact O-ND2 3.37Å
66	L	88.4	Confident	85.7	Confident	28 Å²	28	78.7 Å²	78.7	15%	0.147	38%	0.379	C	S	.	.	H	α-helix	trans	-58.9	-48.1	173.1	-72.8	171.4	0	0	0	111	L26 L29 R30 E62 K68 N69 M70	L26-L66 HydrophobicContact CD2-CD1 3.94Å; L29-L66 HydrophobicContact CD1-CB 4.33Å; R30-L66 HydrophobicContact CG-CD1 4.41Å; E62-L66 WeakPolarHBondContact O-CB 3.35Å; E62-L66 WeakPolarHBondContact O-CG 3.47Å; E62-L66 PolarHBondContact O-N 3.01Å; L66-K68 PolarHBondContact O-N 3.14Å; L66-N69 PolarHBondContact O-N 3.29Å; L66-N69 VanDerWaalsContact O-N 3.13Å; L66-M70 WeakPolarHBondContact O-CG 3.42Å; L66-M70 PolarHBondContact O-N 3.36Å
67	G	88.4	Confident	85.3	Confident	1 Å²	1	74.8 Å²	74.8	1%	0.01	37%	0.365	C	S	.	.	H	α-helix	trans	-60	-42.2	177.5	0	0	0	0	0	113.4	V63 N69 I71	V63-G67 PolarHBondContact O-N 3.18Å; G67-N69 VanDerWaalsContact C-N 3.34Å; G67-N69 PolarHBondContact O-N 3.37Å; G67-I71 WeakPolarHBondContact O-CB 3.32Å; G67-I71 WeakPolarHBondContact O-CD1 3.34Å; G67-I71 VanDerWaalsContact O-CG1 3.25Å; G67-I71 WeakPolarHBondContact O-CG1 3.43Å; G67-I71 PolarHBondContact O-N 2.86Å; G67-I71 VanDerWaalsContact O-N 3.08Å
68	K	87.9	Confident	85	Confident	96 Å²	96	73.8 Å²	73.8	42%	0.417	37%	0.365	S	S	.	.	H	α-helix	trans	-59.3	-42.6	173.4	-77.9	166.4	-169.8	168.8	0	111.9	A64 T65 L66 K72	A64-K68 WeakPolarHBondContact O-CB 3.38Å; A64-K68 VanDerWaalsContact O-CD 3.29Å; A64-K68 WeakPolarHBondContact O-CD 3.29Å; A64-K68 WeakPolarHBondContact O-CG 3.49Å; A64-K68 PolarHBondContact O-N 2.95Å; T65-K68 PolarHBondContact O-N 3Å; L66-K68 PolarHBondContact O-N 3.14Å; K68-K72 WeakPolarHBondContact O-CG 3.37Å; K68-K72 PolarHBondContact O-N 2.91Å
69	N	89.4	Confident	84.7	Confident	85 Å²	85	77.7 Å²	77.7	46%	0.455	39%	0.391	S	S	.	.	H	α-helix	trans	-71.5	-42.2	-176.7	-71.8	-19.9	0	0	0	112.2	T65 L66 G67 K72 Q73	T65-N69 PolarHBondContact O-N 3.05Å; T65-N69 PolarHBondContact O-ND2 3.37Å; L66-N69 PolarHBondContact O-N 3.29Å; L66-N69 VanDerWaalsContact O-N 3.13Å; G67-N69 VanDerWaalsContact C-N 3.34Å; G67-N69 PolarHBondContact O-N 3.37Å; N69-K72 WeakPolarHBondContact O-CB 3.28Å; N69-K72 PolarHBondContact O-N 3.22Å; N69-Q73 WeakPolarHBondContact O-CG 3.36Å; N69-Q73 PolarHBondContact O-N 3.03Å
70	M	87.7	Confident	83.8	Confident	4 Å²	4	75.1 Å²	75.1	2%	0.02	38%	0.383	C	S	.	.	H	α-helix	trans	-62.7	-44.4	175.2	-66.5	165.7	68.3	0	0	111.6	L29 L32 I51 L66 K72 Q73 W74	L29-M70 HydrophobicContact CB-SD 4.45Å; L29-M70 HydrophobicContact CD2-CE 4.27Å; L29-M70 HydrophobicContact CD2-SD 3.98Å; L32-M70 HydrophobicContact CB-CE 3.48Å; L32-M70 VanDerWaalsContact CB-CE 3.48Å; L32-M70 HydrophobicContact CD1-CE 4.49Å; I51-M70 HydrophobicContact CD1-CE 3.65Å; I51-M70 HydrophobicContact CD1-SD 4.46Å; L66-M70 WeakPolarHBondContact O-CG 3.42Å; L66-M70 PolarHBondContact O-N 3.36Å; M70-K72 VanDerWaalsContact C-N 3.33Å; M70-K72 PolarHBondContact O-N 2.94Å; M70-Q73 PolarHBondContact O-N 3.44Å; M70-W74 HydrophobicContact CB-CZ2 4.36Å; M70-W74 HydrophobicContact CE-CH2 3.59Å; M70-W74 HydrophobicContact CE-CZ2 3.63Å; M70-W74 VanDerWaalsContact O-CG 3.28Å; M70-W74 PolarHBondContact O-N 3.35Å
71	I	87.7	Confident	82.3	Confident	30 Å²	30	83.2 Å²	83.2	15%	0.154	42%	0.416	C	S	.	.	H	α-helix	trans	-62	-39.2	175.4	-67.7	166.4	0	0	0	111.3	I51 N52 G67 K75	I51-I71 HydrophobicContact CG2-CD1 4.08Å; I51-I71 HydrophobicContact CG2-CG1 4.34Å; N52-I71 HydrophobicContact CB-CD1 3.83Å; G67-I71 WeakPolarHBondContact O-CB 3.32Å; G67-I71 WeakPolarHBondContact O-CD1 3.34Å; G67-I71 VanDerWaalsContact O-CG1 3.25Å; G67-I71 WeakPolarHBondContact O-CG1 3.43Å; G67-I71 PolarHBondContact O-N 2.86Å; G67-I71 VanDerWaalsContact O-N 3.08Å; I71-K75 HydrophobicContact CG2-CG 4.47Å; I71-K75 WeakPolarHBondContact O-CB 3.46Å; I71-K75 WeakPolarHBondContact O-CG 3.49Å; I71-K75 PolarHBondContact O-N 2.89Å
72	K	87.7	Confident	80.2	Confident	144 Å²	144	82.6 Å²	82.6	63%	0.626	41%	0.414	S	S	*	.	H	α-helix	trans	-63.4	-40.6	174.2	-79.1	175.7	176.3	-176.9	0	112.7	K68 N69 M70	K68-K72 WeakPolarHBondContact O-CG 3.37Å; K68-K72 PolarHBondContact O-N 2.91Å; N69-K72 WeakPolarHBondContact O-CB 3.28Å; N69-K72 PolarHBondContact O-N 3.22Å; M70-K72 VanDerWaalsContact C-N 3.33Å; M70-K72 PolarHBondContact O-N 2.94Å
73	Q	87.2	Confident	78.1	Confident	114 Å²	114	87.3 Å²	87.3	53%	0.533	44%	0.436	S	S	.	.	H	α-helix	trans	-66.4	-49.3	177.2	-72.8	173.7	-54.1	0	0	111	N69 M70 K75 K76	N69-Q73 WeakPolarHBondContact O-CG 3.36Å; N69-Q73 PolarHBondContact O-N 3.03Å; M70-Q73 PolarHBondContact O-N 3.44Å; Q73-K75 PolarHBondContact O-N 3.35Å; Q73-K76 WeakPolarHBondContact O-CB 3.43Å; Q73-K76 PolarHBondContact O-N 2.97Å
74	W	88	Confident	75.8	Confident	21 Å²	21	90.9 Å²	90.9	8%	0.08	47%	0.465	C	S	.	.	H	α-helix	trans	-71	-27.5	-177	-60.1	-17.4	0	0	0	113.8	M37 L42 V47 I51 M70 K76 L77	M37-W74 HydrophobicContact CB-CZ2 4.4Å; M37-W74 VanDerWaalsContact CB-NE1 3.35Å; M37-W74 HydrophobicContact CE-CH2 3.83Å; M37-W74 HydrophobicContact CE-CZ2 3.5Å; M37-W74 VanDerWaalsContact CE-CZ2 3.5Å; M37-W74 HydrophobicContact CG-CD2 4.09Å; M37-W74 HydrophobicContact CG-CG 4.21Å; M37-W74 HydrophobicContact CG-CZ2 4.2Å; L42-W74 HydrophobicContact CD1-CB 3.92Å; L42-W74 HydrophobicContact CD1-CG 4.23Å; L42-W74 HydrophobicContact CD2-CB 3.97Å; L42-W74 HydrophobicContact CD2-CD2 4Å; L42-W74 HydrophobicContact CD2-CE3 3.68Å; L42-W74 HydrophobicContact CD2-CG 4.14Å; L42-W74 HydrophobicContact CD2-CZ3 4.42Å; V47-W74 HydrophobicContact CG1-CH2 4.06Å; V47-W74 HydrophobicContact CG1-CZ3 3.79Å; V47-W74 HydrophobicContact CG2-CH2 4.36Å; V47-W74 HydrophobicContact CG2-CZ3 4.42Å; I51-W74 HydrophobicContact CD1-CH2 3.58Å; I51-W74 HydrophobicContact CD1-CZ3 3.58Å; M70-W74 HydrophobicContact CB-CZ2 4.36Å; M70-W74 HydrophobicContact CE-CH2 3.59Å; M70-W74 HydrophobicContact CE-CZ2 3.63Å; M70-W74 VanDerWaalsContact O-CG 3.28Å; M70-W74 PolarHBondContact O-N 3.35Å; W74-K76 PolarHBondContact O-N 3.4Å; W74-L77 WeakPolarHBondContact O-CB 3.4Å; W74-L77 PolarHBondContact O-N 3.12Å
75	K	84	Confident	73.3	Confident	156 Å²	156	96.6 Å²	96.6	68%	0.678	50%	0.501	S	S	*	.	H	α-helix	trans	-59.8	-32.4	170.8	-86.8	-168.5	168.6	-147.3	0	113	I71 Q73 L77 V78	I71-K75 HydrophobicContact CG2-CG 4.47Å; I71-K75 WeakPolarHBondContact O-CB 3.46Å; I71-K75 WeakPolarHBondContact O-CG 3.49Å; I71-K75 PolarHBondContact O-N 2.89Å; Q73-K75 PolarHBondContact O-N 3.35Å; K75-L77 PolarHBondContact O-N 2.91Å; K75-V78 PolarHBondContact O-N 3.24Å
76	K	83.9	Confident	70.9	Confident	188 Å²	188	99.7 Å²	99.7	82%	0.817	52%	0.519	S	S	*	.	T	Hydrogen-bonded Turn	trans	-69.5	-10.6	175	-64.4	-173.8	174.5	-164.3	0	114	Q73 W74	Q73-K76 WeakPolarHBondContact O-CB 3.43Å; Q73-K76 PolarHBondContact O-N 2.97Å; W74-K76 PolarHBondContact O-N 3.4Å
77	L	75.7	Confident	68.3	Low	77 Å²	77	103.9 Å²	103.9	40%	0.403	55%	0.551	S	S	.	*	T	Hydrogen-bonded Turn	trans	-95.9	-6.3	178.4	-54.3	176.6	0	0	0	112.6	M37 L42 W74 K75	M37-L77 WeakPolarHBondContact O-CD1 3.36Å; L42-L77 HydrophobicContact CD1-CD1 4.29Å; W74-L77 WeakPolarHBondContact O-CB 3.4Å; W74-L77 PolarHBondContact O-N 3.12Å; K75-L77 PolarHBondContact O-N 2.91Å
78	V	75.8	Confident	65.5	Low	74 Å²	74	108.7 Å²	108.7	45%	0.448	58%	0.583	S	S	.	*	S	Bend	trans	-95.9	115.1	172.9	-178.2	0	0	0	0	107.2	L39 K75 D80	L39-V78 HydrophobicContact CD1-CG2 4.22Å; K75-V78 PolarHBondContact O-N 3.24Å; V78-D80 PolarHBondContact O-N 3.12Å
79	P	73	Confident	62.7	Low	95 Å²	95	110 Å²	110	62%	0.617	60%	0.6	S	S	*	*			trans	-67.2	125.2	170.6	27.8	-32.3	0	0	0	108.9
80	D	59.6	Low	60	Low	140 Å²	140	113 Å²	113	75%	0.749	62%	0.616	S	S	*	*			trans	-61.9	137.4	172.3	-77.4	-51.7	0	0	0	109.4	V78 S82	V78-D80 PolarHBondContact O-N 3.12Å; D80-S82 PolarHBondContact O-N 2.67Å
81	K	52	Low	57.6	Low	222 Å²	222	119.1 Å²	119.1	97%	0.965	65%	0.654	S	S	*	*	S	Bend	trans	-80.1	34.6	-177.3	-73.4	-168	170.7	-171	0	113.3
82	S	41.5	Very low	55.4	Low	81 Å²	81	123.7 Å²	123.7	57%	0.566	68%	0.683	S	S	*	*			trans	-156.5	121.3	176.1	49.5	0	0	0	0	104.6	D80	D80-S82 PolarHBondContact O-N 2.67Å
83	E	40	Very low	53.2	Low	188 Å²	188	120.4 Å²	120.4	88%	0.879	69%	0.689	S	S	*	*			cis	-127.6	150.3	26.2	-69.9	133.9	-169.5	0	0	113.5
84	A	38.6	Very low	50.6	Low	76 Å²	76	121 Å²	121	63%	0.628	70%	0.696	S	S	*	*			trans	-85.6	148.6	160.3	0	0	0	0	0	109.1	V86	A84-V86 PolarHBondContact O-N 2.96Å
85	P	33.4	Very low	48	Very low	138 Å²	138	125.5 Å²	125.5	90%	0.896	72%	0.722	S	S	*	*			trans	-70.5	99.1	-176.4	28.7	-34.8	0	0	0	111.1
86	V	39.8	Very low	45.4	Very low	135 Å²	135	125 Å²	125	82%	0.818	73%	0.726	S	S	*	*			trans	-96.9	135.1	173.5	-75.1	0	0	0	0	111.2	A84	A84-V86 PolarHBondContact O-N 2.96Å
87	S	32.8	Very low	43	Very low	117 Å²	117	121.2 Å²	121.2	82%	0.818	72%	0.724	S	S	*	*			trans	-67.2	164.7	179.5	-163.3	0	0	0	0	112.5
88	C	29.8	Very low	40.9	Very low	101 Å²	101	123.7 Å²	123.7	68%	0.682	74%	0.738	S	S	*	*			trans	-85.7	177.4	-173.5	55.1	0	0	0	0	114.3
89	T	30.1	Very low	38.8	Very low	124 Å²	124	126.9 Å²	126.9	76%	0.761	75%	0.752	S	S	*	*			trans	76.4	147	179.8	78.6	0	0	0	0	114.6
90	N	31.6	Very low	36.8	Very low	148 Å²	148	124.9 Å²	124.9	79%	0.791	75%	0.749	S	S	*	*			cis	-155.3	166.4	6.5	-124.2	-15.2	0	0	0	111
91	T	36.9	Very low	35.6	Very low	133 Å²	133	122 Å²	122	82%	0.816	73%	0.734	S	S	*	*			trans	144.9	136.9	152.1	-70.5	0	0	0	0	112.4
92	V	41.6	Very low	34.7	Very low	126 Å²	126	114.4 Å²	114.4	76%	0.764	70%	0.703	S	S	*	*			cis	-157.1	148.3	-24.6	141.2	0	0	0	0	105.4	N94	V92-N94 HydrophobicContact CG1-CB 4.31Å
93	G	41.9	Very low	34.5	Very low	74 Å²	74	116 Å²	116	76%	0.763	71%	0.706	S	S	*	*			trans	150.7	49.3	172.4	0	0	0	0	0	114.9
94	N	32.8	Very low	34.4	Very low	126 Å²	126	113 Å²	113	67%	0.674	70%	0.695	S	S	*	*				105.2	137.7	54.7	-168.6	47.1	0	0	0	111	V92	V92-N94 HydrophobicContact CG1-CB 4.31Å
95	N	32.4	Very low	34.4	Very low	116 Å²	116	115.4 Å²	115.4	62%	0.62	70%	0.698	S	S	*	*			trans	74.5	101.9	176.3	-57	-22.2	0	0	0	119.4
96	N	30.8	Very low	34.5	Very low	145 Å²	145	116.7 Å²	116.7	78%	0.775	69%	0.69	S	S	*	*				62.7	139.5	125.7	-48.2	-9.4	0	0	0	119.9
97	S	33.1	Very low	34.4	Very low	110 Å²	110	117.6 Å²	117.6	77%	0.769	68%	0.684	S	S	*	*			cis	-171.6	165.7	-10.1	-90.1	0	0	0	0	106.2
98	D	30.4	Very low	34.7	Very low	129 Å²	129	116.4 Å²	116.4	69%	0.69	68%	0.676	S	S	*	*			cis	159.6	143	-18.7	179.4	32	0	0	0	105.9
99	N	32.3	Very low	35.1	Very low	140 Å²	140	115.9 Å²	115.9	75%	0.749	67%	0.671	S	S	*	*			trans	66.7	150.6	-174.5	-48.1	-81.1	0	0	0	116.2
100	G	32.3	Very low	35.2	Very low	54 Å²	54	118.2 Å²	118.2	56%	0.557	67%	0.674	S	S	*	*			cis	-166.2	-143.9	2.4	0	0	0	0	0	111.4	A116	G100-A116 CarbonylContact C-O 3.58Å
101	N	33.5	Very low	35.4	Very low	80 Å²	80	115.9 Å²	115.9	43%	0.428	67%	0.669	S	S	.	*				-176	170.1	-69.4	-175.3	27.4	0	0	0	114	Y114 N115 A116	N101-Y114 VanDerWaalsContact CB-O 3.31Å; N101-Y114 WeakPolarHBondContact CB-O 3.38Å; N101-Y114 VanDerWaalsContact ND2-C 3.29Å; N101-Y114 PolarHBondContact ND2-O 2.7Å; N101-N115 PolarHBondContact N-O 3.08Å; N101-N115 CarbonylContact O-C 3.6Å; N101-N115 WeakPolarHBondContact O-CA 3.36Å; N101-A116 PolarHBondContact N-O 3.06Å; N101-A116 VanDerWaalsContact O-CA 3.24Å; N101-A116 WeakPolarHBondContact O-CA 3.47Å; N101-A116 PolarHBondContact O-N 3.43Å
102	N	34	Very low	35.4	Very low	61 Å²	61	117.1 Å²	117.1	33%	0.326	67%	0.671	S	S	.	*			trans	84.5	132.5	158	-91.7	20.9	0	0	0	125.7	Y114	N102-Y114 PolarHBondContact ND2-N 2.72Å
103	N	36.1	Very low	35.1	Very low	116 Å²	116	113.7 Å²	113.7	62%	0.62	65%	0.652	S	S	*	*			trans	67.9	153.4	140.6	-68.5	40	0	0	0	120.9
104	D	37.9	Very low	35	Very low	123 Å²	123	118.6 Å²	118.6	66%	0.658	65%	0.649	S	S	*	*			cis	-154.5	137.8	-9	-109.3	-34.8	0	0	0	107.2
105	N	38.2	Very low	35.3	Very low	128 Å²	128	117.7 Å²	117.7	68%	0.684	64%	0.644	S	S	*	*				165.8	148.4	89.1	-113	-66.3	0	0	0	104.6
106	K	36.2	Very low	35.6	Very low	165 Å²	165	114.7 Å²	114.7	72%	0.717	64%	0.636	S	S	*	*			cis	-170.2	138.5	13	-170.4	170.9	-175.6	173	0	104.3
107	H	36.6	Very low	36	Very low	153 Å²	153	112.9 Å²	112.9	71%	0.708	63%	0.633	S	S	*	*			cis	-160.1	-177	10.2	-111.6	-8.5	0	0	0	105.2
108	S	40	Very low	36.3	Very low	92 Å²	92	114.8 Å²	114.8	64%	0.643	64%	0.635	S	S	*	*			cis	168.9	151.1	-17.5	-177.6	0	0	0	0	105
109	P	37.4	Very low	36.6	Very low	90 Å²	90	116.2 Å²	116.2	58%	0.584	64%	0.642	S	S	*	*			cis	-125.2	-179.8	14.2	43.1	-29.2	0	0	0	115.4
110	E	33.6	Very low	36.8	Very low	174 Å²	174	112.4 Å²	112.4	81%	0.813	64%	0.636	S	S	*	*			trans	65.1	124.8	159.3	-69.4	149.3	-162.9	0	0	118.2
111	S	35.4	Very low	37.2	Very low	98 Å²	98	115.1 Å²	115.1	69%	0.685	64%	0.644	S	S	*	*			cis	-170.1	135.5	-9.5	50.4	0	0	0	0	113.1
112	N	35.9	Very low	37.6	Very low	160 Å²	160	120.7 Å²	120.7	86%	0.856	67%	0.667	S	S	*	*			trans	69	148.4	161.2	-56.6	-12.4	0	0	0	120.6
113	S	35.9	Very low	37.6	Very low	54 Å²	54	125.3 Å²	125.3	38%	0.378	69%	0.687	S	S	.	*			cis	-173.8	158.5	-26.6	-164	0	0	0	0	114.4
114	Y	39.3	Very low	37.7	Very low	177 Å²	177	123.6 Å²	123.6	69%	0.694	69%	0.689	S	S	*	*			trans	94.1	91.8	154.4	-52	-57.8	0	0	0	123.2	N101 N102	N101-Y114 VanDerWaalsContact CB-O 3.31Å; N101-Y114 WeakPolarHBondContact CB-O 3.38Å; N101-Y114 VanDerWaalsContact ND2-C 3.29Å; N101-Y114 PolarHBondContact ND2-O 2.7Å; N102-Y114 PolarHBondContact ND2-N 2.72Å
115	N	39.2	Very low	37.8	Very low	106 Å²	106	126 Å²	126	57%	0.567	69%	0.693	S	S	*	*			trans	40.6	156.1	134.1	-66.3	53.1	0	0	0	123.3	N101	N101-N115 PolarHBondContact N-O 3.08Å; N101-N115 CarbonylContact O-C 3.6Å; N101-N115 WeakPolarHBondContact O-CA 3.36Å
116	A	40.5	Very low	37.8	Very low	54 Å²	54	131.2 Å²	131.2	45%	0.446	70%	0.703	S	S	.	*			cis	-144.1	-152.4	-10.8	0	0	0	0	0	108.3	G100 N101	G100-A116 CarbonylContact C-O 3.58Å; N101-A116 PolarHBondContact N-O 3.06Å; N101-A116 VanDerWaalsContact O-CA 3.24Å; N101-A116 WeakPolarHBondContact O-CA 3.47Å; N101-A116 PolarHBondContact O-N 3.43Å
117	C	38.1	Very low	38	Very low	107 Å²	107	128.1 Å²	128.1	72%	0.723	70%	0.702	S	S	*	*			cis	-160.4	165.2	1.5	43.7	0	0	0	0	107.3
118	D	40.1	Very low	38.1	Very low	150 Å²	150	132.4 Å²	132.4	80%	0.802	71%	0.713	S	S	*	*			cis	75.7	130.7	36.6	-45.8	-56.1	0	0	0	115.2
119	D	36.5	Very low	37.9	Very low	159 Å²	159	132.9 Å²	132.9	85%	0.85	71%	0.713	S	S	*	*			cis	-164.4	176.6	-13.4	-169.4	40.6	0	0	0	107.5
120	G	37.1	Very low	37.9	Very low	59 Å²	59	134 Å²	134	61%	0.608	72%	0.723	S	S	*	*			cis	-176.4	-175.3	5.2	0	0	0	0	0	115.3
121	P	40.5	Very low	38.1	Very low	112 Å²	112	134.7 Å²	134.7	73%	0.727	73%	0.726	S	S	*	*			trans	-131.2	179.8	-164	43.3	-29.3	0	0	0	117.3
122	Q	40.6	Very low	38.2	Very low	197 Å²	197	139.2 Å²	139.2	92%	0.921	73%	0.734	S	S	*	*			trans	-157.9	165.9	155	-125.1	162.7	68	0	0	117.3
123	E	34.8	Very low	38.5	Very low	157 Å²	157	140.5 Å²	140.5	73%	0.734	73%	0.732	S	S	*	*			trans	-80.5	162.7	-165.5	-36	179.5	134.4	0	0	116.4	K125	E123-K125 IonicContact OE2-NZ 3.41Å; E123-K125 PolarHBondContact OE2-NZ 2.78Å
124	A	38.5	Very low	38.6	Very low	80 Å²	80	146.4 Å²	146.4	66%	0.661	75%	0.753	S	S	*	*				172.8	121	105.4	0	0	0	0	0	116.5
125	K	39.3	Very low	38.7	Very low	174 Å²	174	143.1 Å²	143.1	76%	0.757	76%	0.756	S	S	*	*				54.9	132.5	129.9	-63.1	154.2	-176.6	136.6	0	122.2	E123	E123-K125 IonicContact OE2-NZ 3.41Å; E123-K125 PolarHBondContact OE2-NZ 2.78Å
126	R	39	Very low	38.7	Very low	237 Å²	237	144.7 Å²	144.7	89%	0.894	77%	0.77	S	S	*	*				107.9	115.7	129.7	-107.5	-176.7	-179.5	-163.3	-1.2	122.5
127	S	40.4	Very low	38.5	Very low	100 Å²	100	150.5 Å²	150.5	70%	0.699	79%	0.788	S	S	*	*			trans	57.9	103.6	134.2	55	0	0	0	0	122.9
128	R	38.1	Very low	38.8	Very low	244 Å²	244	153.7 Å²	153.7	92%	0.921	80%	0.796	S	S	*	*				12.4	159.4	118.3	-98.2	-149.2	162	-159.9	-2.4	121.2
129	P	36.1	Very low	38.8	Very low	101 Å²	101	152.2 Å²	152.2	66%	0.656	80%	0.797	S	S	*	*				-133.4	176.7	-123.4	44.8	-29.8	0	0	0	115.7
130	S	36.2	Very low	38.8	Very low	113 Å²	113	148.2 Å²	148.2	79%	0.79	79%	0.794	S	S	*	*			trans	151.3	138.5	137.6	-69.9	0	0	0	0	111.3
131	E	39.6	Very low	38.8	Very low	189 Å²	189	152.8 Å²	152.8	88%	0.883	80%	0.804	S	S	*	*			trans	-166.7	166.5	134.1	-115.6	177.3	-155.4	0	0	112
132	K	36.3	Very low	38.8	Very low	194 Å²	194	151.6 Å²	151.6	84%	0.843	80%	0.804	S	S	*	*			trans	-125	145.7	-177	-67.2	-179.9	178.2	-179.6	0	111.7
133	K	42.4	Very low	38.8	Very low	187 Å²	187	147.7 Å²	147.7	81%	0.813	80%	0.798	S	S	*	*			trans	-167.7	126	144.7	-93.9	135.5	-174.9	171.9	0	106.6
134	E	37.9	Very low	39.3	Very low	177 Å²	177	152 Å²	152	83%	0.827	81%	0.808	S	S	*	*			cis	98.6	154	40.7	-172.8	163.7	-146.1	0	0	112.2
135	S	40.7	Very low	39.4	Very low	109 Å²	109	152.1 Å²	152.1	76%	0.762	82%	0.817	S	S	*	*			trans	78.1	135.6	-164.8	74.1	0	0	0	0	115.7
136	T	40.1	Very low	39.2	Very low	138 Å²	138	152.5 Å²	152.5	85%	0.847	82%	0.819	S	S	*	*			cis	-151.6	157.9	-16.2	-78.3	0	0	0	0	109.7
137	E	37	Very low	39.6	Very low	176 Å²	176	150.2 Å²	150.2	82%	0.822	82%	0.816	S	S	*	*			trans	-76.2	153.6	-175.7	-46.9	178.7	145.2	0	0	115.7
138	I	43.7	Very low	39.8	Very low	175 Å²	175	148.7 Å²	148.7	90%	0.897	80%	0.804	S	S	*	*			trans	-139.2	140.7	141.1	-62.2	-172.5	0	0	0	108.4
139	S	40.1	Very low	40.4	Very low	118 Å²	118	140.4 Å²	140.4	83%	0.825	78%	0.78	S	S	*	*			trans	-85.8	154.5	-173.4	-174.8	0	0	0	0	114.5
140	G	36.4	Very low	40.9	Very low	76 Å²	76	143.2 Å²	143.2	78%	0.784	78%	0.784	S	S	*	*			trans	-170	34.6	-171.6	0	0	0	0	0	119.4
141	N	36.8	Very low	41.6	Very low	154 Å²	154	143.3 Å²	143.3	82%	0.824	78%	0.78	S	S	*	*			trans	30.6	115.8	162.5	-103.6	-5.1	0	0	0	123
142	A	39.9	Very low	42.7	Very low	87 Å²	87	135.5 Å²	135.5	72%	0.719	74%	0.744	S	S	*	*				75.5	103.2	124.3	0	0	0	0	0	123.4
143	S	41.7	Very low	44.3	Very low	115 Å²	115	130.8 Å²	130.8	80%	0.804	73%	0.732	S	S	*	*				77.1	92.9	124.5	-158.5	0	0	0	0	121.4
144	R	44.9	Very low	46.1	Very low	248 Å²	248	123.1 Å²	123.1	94%	0.936	70%	0.701	S	S	*	*	S	Bend	trans	-171.9	135.3	130.5	-101.3	165.1	-145.8	168.6	7.4	110.9
145	G	40.2	Very low	48.3	Very low	83 Å²	83	121.1 Å²	121.1	86%	0.856	70%	0.701	S	S	*	*			trans	62.1	87.4	163	0	0	0	0	0	117.8
146	F	35.9	Very low	50.7	Low	182 Å²	182	118.3 Å²	118.3	80%	0.798	68%	0.677	S	S	*	*			trans	-94.6	101.5	-179.5	-173	-95.2	0	0	0	113.6
147	F	47.6	Very low	53.1	Low	188 Å²	188	118.6 Å²	118.6	83%	0.825	67%	0.669	S	S	*	*			trans	-130.7	130.6	150.4	-79.4	-76.5	0	0	0	108.3	V149	F147-V149 PolarHBondContact O-N 3.38Å
148	P	43.6	Very low	55.7	Low	69 Å²	69	113 Å²	113	45%	0.448	65%	0.646	S	S	.	*			trans	-80.5	79.8	-169.2	31.4	-36.2	0	0	0	113.5	H150 T151	P148-H150 PolarHBondContact O-N 3.31Å; P148-H150 VanDerWaalsContact O-N 3.11Å; P148-T151 PolarHBondContact O-N 3.36Å; P148-T151 VanDerWaalsContact O-N 3.16Å; P148-T151 PolarHBondContact O-OG1 3.11Å
149	V	50.4	Low	58.1	Low	70 Å²	70	106 Å²	106	42%	0.424	61%	0.609	S	S	.	*	G	3₁₀ helix	trans	-57.4	-21.9	173.9	-179.4	0	0	0	0	112.7	F147 T151 L152	F147-V149 PolarHBondContact O-N 3.38Å; V149-T151 PolarHBondContact O-N 2.95Å; V149-L152 PolarHBondContact O-N 2.96Å
150	H	47.3	Very low	60.6	Low	159 Å²	159	103.7 Å²	103.7	74%	0.736	59%	0.587	S	S	*	*	G	3₁₀ helix	trans	-59	-13.6	173.5	-64.4	-48.6	0	0	0	115.2	P148 L152 T153	P148-H150 PolarHBondContact O-N 3.31Å; P148-H150 VanDerWaalsContact O-N 3.11Å; H150-L152 PolarHBondContact O-N 2.9Å; H150-T153 PolarHBondContact O-OG1 3.29Å; H150-T153 VanDerWaalsContact O-OG1 3.05Å
151	T	52.1	Low	63.4	Low	115 Å²	115	105 Å²	105	71%	0.706	57%	0.571	S	S	*	*	G	3₁₀ helix	trans	-69.1	-13.3	168.6	51.8	0	0	0	0	113.4	P148 V149	P148-T151 PolarHBondContact O-N 3.36Å; P148-T151 VanDerWaalsContact O-N 3.16Å; P148-T151 PolarHBondContact O-OG1 3.11Å; V149-T151 PolarHBondContact O-N 2.95Å
152	L	61.6	Low	66.1	Low	25 Å²	25	98 Å²	98	13%	0.131	53%	0.534	C	S	.	.	S	Bend	trans	-116.6	-3.8	-174.6	-57.2	166.6	0	0	0	113.2	V149 H150 T154 R163 F184 I187 R188	V149-L152 PolarHBondContact O-N 2.96Å; H150-L152 PolarHBondContact O-N 2.9Å; L152-T154 PolarHBondContact O-N 3.5Å; L152-R163 VanDerWaalsContact O-CZ 3.23Å; L152-R163 PolarHBondContact O-NH1 3.27Å; L152-R163 PolarHBondContact O-NH2 2.6Å; L152-F184 HydrophobicContact CD1-CE2 4.49Å; L152-I187 HydrophobicContact CB-CG2 3.45Å; L152-I187 VanDerWaalsContact CB-CG2 3.45Å; L152-I187 HydrophobicContact CD1-CG2 3.83Å; L152-I187 HydrophobicContact CG-CG2 4.15Å; L152-R188 HydrophobicContact CD1-CG 4.26Å
153	T	70.1	Confident	68.8	Low	96 Å²	96	94.8 Å²	94.8	59%	0.589	50%	0.504	S	S	*	.			trans	-69.4	116.6	179.2	43.9	0	0	0	0	111.2	H150	H150-T153 PolarHBondContact O-OG1 3.29Å; H150-T153 VanDerWaalsContact O-OG1 3.05Å
154	T	80.7	Confident	71.3	Confident	26 Å²	26	94.2 Å²	94.2	16%	0.16	49%	0.488	C	S	.	.			trans	-109.2	147.1	178.9	-167.7	0	0	0	0	111.1	L152 R159 L160	L152-T154 PolarHBondContact O-N 3.5Å; T154-R159 HydrophobicContact CG2-CB 3.67Å; T154-L160 HydrophobicContact CG2-CD2 3.9Å; T154-L160 HydrophobicContact CG2-CG 4.12Å
155	T	84.2	Confident	73.7	Confident	134 Å²	134	85.8 Å²	85.8	82%	0.822	46%	0.46	S	S	*	.			trans	-100.6	-9.7	177.9	49.2	0	0	0	0	113.5	Q157	T155-Q157 PolarHBondContact O-N 3.29Å
156	D	89.8	Confident	76.4	Confident	50 Å²	50	81.9 Å²	81.9	27%	0.267	42%	0.42	S	S	.	.			trans	-72.2	116.5	176.7	179.2	-2.6	0	0	0	110.1	V158 R159 L160 T200	D156-V158 PolarHBondContact O-N 3.24Å; D156-V158 WeakPolarHBondContact OD1-CB 3.43Å; D156-V158 PolarHBondContact OD1-N 3.37Å; D156-R159 HydrophobicContact CB-CB 4.09Å; D156-R159 HydrophobicContact CB-CG 3.85Å; D156-R159 PolarHBondContact O-N 3.44Å; D156-L160 WeakPolarHBondContact O-CG 3.21Å; D156-L160 PolarHBondContact O-N 3.41Å; D156-T200 PolarHBondContact OD2-OG1 3.13Å
157	Q	90.7	Very high	79.2	Confident	145 Å²	145	75.7 Å²	75.7	68%	0.678	39%	0.393	S	S	*	.	H	α-helix	trans	-53.7	-33.6	177.1	-64.9	-63.5	-31.2	0	0	113	T155 K161	T155-Q157 PolarHBondContact O-N 3.29Å; Q157-K161 WeakPolarHBondContact O-CB 3.48Å; Q157-K161 PolarHBondContact O-N 3.32Å
158	V	92.3	Very high	81.4	Confident	57 Å²	57	69.6 Å²	69.6	35%	0.345	37%	0.374	S	S	.	.	H	α-helix	trans	-72.9	-37.5	178.6	-174.5	0	0	0	0	111.1	D156 K161 A162 T200	D156-V158 PolarHBondContact O-N 3.24Å; D156-V158 WeakPolarHBondContact OD1-CB 3.43Å; D156-V158 PolarHBondContact OD1-N 3.37Å; V158-K161 PolarHBondContact O-N 2.89Å; V158-A162 WeakPolarHBondContact O-CB 3.41Å; V158-A162 PolarHBondContact O-N 3.21Å; V158-T200 HydrophobicContact CB-CG2 3.65Å; V158-T200 HydrophobicContact CG1-CG2 3.43Å; V158-T200 VanDerWaalsContact CG1-CG2 3.43Å; V158-T200 HydrophobicContact CG2-CG2 4.32Å
159	R	93.7	Very high	83.8	Confident	29 Å²	29	66.3 Å²	66.3	11%	0.109	35%	0.353	C	S	.	.	H	α-helix	trans	-71.1	-38.2	175.1	-63.6	-174.3	63.8	-174.5	-6.4	111.7	T154 D156 A162 R163 E190 Y194	T154-R159 HydrophobicContact CG2-CB 3.67Å; D156-R159 HydrophobicContact CB-CB 4.09Å; D156-R159 HydrophobicContact CB-CG 3.85Å; D156-R159 PolarHBondContact O-N 3.44Å; R159-A162 WeakPolarHBondContact O-CB 3.4Å; R159-A162 PolarHBondContact O-N 3.31Å; R159-R163 WeakPolarHBondContact O-CG 3.24Å; R159-R163 PolarHBondContact O-N 3.15Å; R159-R163 VanDerWaalsContact O-N 3.07Å; R159-E190 IonicContact CZ-OE1 3.38Å; R159-E190 IonicContact CZ-OE2 3.61Å; R159-E190 IonicContact NE-OE1 3.16Å; R159-E190 PolarHBondContact NE-OE1 3.45Å; R159-E190 IonicContact NE-OE2 3.8Å; R159-E190 PolarHBondContact NE-OE2 3.33Å; R159-E190 IonicContact NH2-OE1 3.19Å; R159-E190 PolarHBondContact NH2-OE1 3.32Å; R159-E190 IonicContact NH2-OE2 2.87Å; R159-E190 PolarHBondContact NH2-OE2 2.86Å; R159-Y194 HydrophobicContact CG-CD2 4.37Å; R159-Y194 VanDerWaalsContact NH1-CD1 3.35Å
160	L	93.3	Very high	85.9	Confident	69 Å²	69	63 Å²	63	36%	0.361	33%	0.333	S	S	.	.	H	α-helix	trans	-59.9	-46.7	170.6	-68.3	174.3	0	0	0	111.1	T154 D156 A162 R163 E164	T154-L160 HydrophobicContact CG2-CD2 3.9Å; T154-L160 HydrophobicContact CG2-CG 4.12Å; D156-L160 WeakPolarHBondContact O-CG 3.21Å; D156-L160 PolarHBondContact O-N 3.41Å; L160-A162 VanDerWaalsContact C-N 3.33Å; L160-A162 PolarHBondContact O-N 2.9Å; L160-R163 WeakPolarHBondContact O-CB 3.31Å; L160-R163 PolarHBondContact O-N 3.45Å; L160-E164 PolarHBondContact O-N 2.84Å
161	K	94.5	Very high	88	Confident	104 Å²	104	59.7 Å²	59.7	45%	0.452	32%	0.318	S	S	.	.	H	α-helix	trans	-66	-33	176.5	-165.2	52.8	157.6	-177.1	0	113.1	Q157 V158 R163 E164 M165	Q157-K161 WeakPolarHBondContact O-CB 3.48Å; Q157-K161 PolarHBondContact O-N 3.32Å; V158-K161 PolarHBondContact O-N 2.89Å; K161-R163 VanDerWaalsContact C-N 3.35Å; K161-E164 HydrophobicContact CD-CB 4.39Å; K161-E164 WeakPolarHBondContact CD-OE2 3.37Å; K161-E164 WeakPolarHBondContact CE-OE2 2.75Å; K161-E164 IonicContact NZ-OE1 3.79Å; K161-E164 PolarHBondContact NZ-OE1 3.29Å; K161-E164 IonicContact NZ-OE2 3.94Å; K161-E164 PolarHBondContact NZ-OE2 2.93Å; K161-E164 PolarHBondContact O-N 2.62Å; K161-M165 VanDerWaalsContact O-CG 3.29Å; K161-M165 WeakPolarHBondContact O-CG 3.46Å; K161-M165 PolarHBondContact O-N 3.46Å
162	A	94.7	Very high	89.6	Confident	6 Å²	6	56.6 Å²	56.6	5%	0.05	30%	0.301	C	S	.	.	H	α-helix	trans	-62.3	-40	172.5	0	0	0	0	0	112.3	V158 R159 L160 M165 L166 E190 Y204 V208	V158-A162 WeakPolarHBondContact O-CB 3.41Å; V158-A162 PolarHBondContact O-N 3.21Å; R159-A162 WeakPolarHBondContact O-CB 3.4Å; R159-A162 PolarHBondContact O-N 3.31Å; L160-A162 VanDerWaalsContact C-N 3.33Å; L160-A162 PolarHBondContact O-N 2.9Å; A162-M165 PolarHBondContact O-N 3.36Å; A162-L166 WeakPolarHBondContact O-CG 3.46Å; A162-L166 PolarHBondContact O-N 3.25Å; A162-E190 HydrophobicContact CB-CG 4Å; A162-Y204 WeakPolarHBondContact CB-OH 3.43Å; A162-V208 HydrophobicContact CB-CG1 3.86Å; A162-V208 HydrophobicContact CB-CG2 4.1Å
163	R	95	Very high	90.7	Very high	21 Å²	21	57.1 Å²	57.1	8%	0.079	31%	0.312	C	S	.	.	H	α-helix	trans	-65.3	-48.4	175.1	-67.4	162.9	-177.7	-151.6	-3.1	111.8	L152 R159 L160 K161 M165 L166 Q167 E190	L152-R163 VanDerWaalsContact O-CZ 3.23Å; L152-R163 PolarHBondContact O-NH1 3.27Å; L152-R163 PolarHBondContact O-NH2 2.6Å; R159-R163 WeakPolarHBondContact O-CG 3.24Å; R159-R163 PolarHBondContact O-N 3.15Å; R159-R163 VanDerWaalsContact O-N 3.07Å; L160-R163 WeakPolarHBondContact O-CB 3.31Å; L160-R163 PolarHBondContact O-N 3.45Å; K161-R163 VanDerWaalsContact C-N 3.35Å; R163-M165 VanDerWaalsContact C-N 3.28Å; R163-M165 PolarHBondContact O-N 3.08Å; R163-L166 PolarHBondContact O-N 2.96Å; R163-Q167 WeakPolarHBondContact O-CB 3.35Å; R163-Q167 PolarHBondContact O-N 3.04Å; R163-E190 HydrophobicContact CG-CB 3.61Å; R163-E190 HydrophobicContact CG-CG 3.77Å; R163-E190 IonicContact CZ-OE2 3.25Å; R163-E190 VanDerWaalsContact CZ-OE2 3.25Å; R163-E190 IonicContact NE-OE2 2.84Å; R163-E190 PolarHBondContact NE-OE2 3.19Å; R163-E190 IonicContact NH2-OE2 2.81Å; R163-E190 PolarHBondContact NH2-OE2 3.17Å
164	E	95.2	Very high	91.3	Very high	103 Å²	103	59.6 Å²	59.6	48%	0.481	32%	0.322	S	S	.	.	H	α-helix	trans	-55.3	-44	176.4	-168.9	-153	118.9	0	0	111.6	L160 K161 L166 Q167 S168	L160-E164 PolarHBondContact O-N 2.84Å; K161-E164 HydrophobicContact CD-CB 4.39Å; K161-E164 WeakPolarHBondContact CD-OE2 3.37Å; K161-E164 WeakPolarHBondContact CE-OE2 2.75Å; K161-E164 IonicContact NZ-OE1 3.79Å; K161-E164 PolarHBondContact NZ-OE1 3.29Å; K161-E164 IonicContact NZ-OE2 3.94Å; K161-E164 PolarHBondContact NZ-OE2 2.93Å; K161-E164 PolarHBondContact O-N 2.62Å; E164-L166 PolarHBondContact O-N 3.34Å; E164-Q167 PolarHBondContact O-N 3.24Å; E164-S168 VanDerWaalsContact O-CB 3.32Å; E164-S168 WeakPolarHBondContact O-CB 3.48Å; E164-S168 PolarHBondContact O-N 3.23Å
165	M	95.7	Very high	91.4	Very high	71 Å²	71	61.9 Å²	61.9	35%	0.35	33%	0.332	S	S	.	.	H	α-helix	trans	-65.7	-35.6	176.2	-70.9	178.9	64.5	0	0	113.4	K161 A162 R163 A169 V212	K161-M165 VanDerWaalsContact O-CG 3.29Å; K161-M165 WeakPolarHBondContact O-CG 3.46Å; K161-M165 PolarHBondContact O-N 3.46Å; A162-M165 PolarHBondContact O-N 3.36Å; R163-M165 VanDerWaalsContact C-N 3.28Å; R163-M165 PolarHBondContact O-N 3.08Å; M165-A169 WeakPolarHBondContact O-CB 3.2Å; M165-A169 PolarHBondContact O-N 3.25Å; M165-V212 HydrophobicContact CB-CG2 3.89Å; M165-V212 HydrophobicContact CE-CG1 4.32Å; M165-V212 HydrophobicContact CE-CG2 4.49Å
166	L	95.7	Very high	91.2	Very high	0 Å²	0	57.4 Å²	57.4	0%	0	31%	0.306	C	S	.	.	H	α-helix	trans	-73.1	-40.8	176.4	-74.9	165.5	0	0	0	111.9	A162 R163 E164 A169 L170 A186 I189 E190 V208 R211 V212 L215	A162-L166 WeakPolarHBondContact O-CG 3.46Å; A162-L166 PolarHBondContact O-N 3.25Å; R163-L166 PolarHBondContact O-N 2.96Å; E164-L166 PolarHBondContact O-N 3.34Å; L166-A169 WeakPolarHBondContact O-CB 3.31Å; L166-A169 PolarHBondContact O-N 3.49Å; L166-L170 WeakPolarHBondContact O-CG 3.22Å; L166-L170 PolarHBondContact O-N 3.25Å; L166-A186 HydrophobicContact CB-CB 3.86Å; L166-I189 HydrophobicContact CD1-CB 4.36Å; L166-I189 HydrophobicContact CD1-CG2 3.97Å; L166-I189 HydrophobicContact CD2-CG2 4.13Å; L166-E190 HydrophobicContact CD1-CB 3.98Å; L166-V208 HydrophobicContact CG-CG1 4.44Å; L166-R211 HydrophobicContact CD2-CB 3.94Å; L166-V212 HydrophobicContact CD2-CG2 3.85Å; L166-V212 HydrophobicContact CG-CG2 4.11Å; L166-L215 HydrophobicContact CD2-CD1 4.3Å
167	Q	94.6	Very high	90.6	Very high	52 Å²	52	61.5 Å²	61.5	24%	0.243	34%	0.338	C	S	.	.	H	α-helix	trans	-61.2	-50.9	174.7	177.6	174.5	-0.6	0	0	110.7	R163 E164 A169 L170 E171 A186	R163-Q167 WeakPolarHBondContact O-CB 3.35Å; R163-Q167 PolarHBondContact O-N 3.04Å; E164-Q167 PolarHBondContact O-N 3.24Å; Q167-A169 PolarHBondContact O-N 3Å; Q167-A169 VanDerWaalsContact O-N 3.14Å; Q167-L170 PolarHBondContact O-N 3.09Å; Q167-E171 HydrophobicContact CG-CG 4.39Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.42Å; Q167-E171 PolarHBondContact NE2-OE1 3.32Å; Q167-E171 WeakPolarHBondContact O-CG 3.41Å; Q167-E171 PolarHBondContact O-N 3.34Å; Q167-A186 HydrophobicContact CB-CB 3.86Å
168	S	94.9	Very high	90.2	Very high	61 Å²	61	57.7 Å²	57.7	43%	0.427	34%	0.337	S	S	.	.	H	α-helix	trans	-58.7	-27.5	174.9	-178	0	0	0	0	113	E164 S172	E164-S168 VanDerWaalsContact O-CB 3.32Å; E164-S168 WeakPolarHBondContact O-CB 3.48Å; E164-S168 PolarHBondContact O-N 3.23Å; S168-S172 PolarHBondContact O-N 2.9Å
169	A	94.7	Very high	89.9	Confident	0 Å²	0	56.2 Å²	56.2	0%	0	33%	0.331	C	S	.	.	H	α-helix	trans	-74.1	-40.3	172.6	0	0	0	0	0	112.8	M165 L166 Q167 S172 V212 L215 R216 R224	M165-A169 WeakPolarHBondContact O-CB 3.2Å; M165-A169 PolarHBondContact O-N 3.25Å; L166-A169 WeakPolarHBondContact O-CB 3.31Å; L166-A169 PolarHBondContact O-N 3.49Å; Q167-A169 PolarHBondContact O-N 3Å; Q167-A169 VanDerWaalsContact O-N 3.14Å; A169-S172 WeakPolarHBondContact O-CB 3.33Å; A169-S172 PolarHBondContact O-N 3.06Å; A169-S172 PolarHBondContact O-OG 3.06Å; A169-V212 HydrophobicContact CB-CG1 4.29Å; A169-L215 HydrophobicContact CB-CB 3.8Å; A169-L215 HydrophobicContact CB-CD1 4.32Å; A169-R216 HydrophobicContact CB-CG 3.78Å; A169-R224 WeakPolarHBondContact O-CD 3.17Å
170	L	92.8	Very high	89.5	Confident	0 Å²	0	61.2 Å²	61.2	0%	0	35%	0.351	C	S	.	.	H	α-helix	trans	-68.6	-36.1	175.7	-67.8	171.4	0	0	0	112.4	L166 Q167 S172 S182 L185 A186 I189 L215 R224 V227 L228	L166-L170 WeakPolarHBondContact O-CG 3.22Å; L166-L170 PolarHBondContact O-N 3.25Å; Q167-L170 PolarHBondContact O-N 3.09Å; L170-S172 VanDerWaalsContact C-N 3.26Å; L170-S172 PolarHBondContact O-N 3.18Å; L170-S182 WeakPolarHBondContact CD1-O 3.26Å; L170-L185 HydrophobicContact CD1-CB 3.69Å; L170-L185 HydrophobicContact CD1-CD1 4.37Å; L170-A186 HydrophobicContact CD1-CB 4.5Å; L170-I189 HydrophobicContact CD1-CD1 4.37Å; L170-L215 HydrophobicContact CD2-CD1 4.11Å; L170-L215 HydrophobicContact CD2-CD2 4.13Å; L170-L215 HydrophobicContact CG-CD1 4.44Å; L170-R224 HydrophobicContact CD2-CG 4.37Å; L170-R224 WeakPolarHBondContact O-CD 3.29Å; L170-V227 HydrophobicContact CD2-CG1 3.93Å; L170-L228 HydrophobicContact CB-CD2 4.45Å; L170-L228 HydrophobicContact CD2-CD2 4.42Å
171	E	91.2	Very high	89.3	Confident	90 Å²	90	65 Å²	65	42%	0.421	37%	0.367	S	S	.	.	T	Hydrogen-bonded Turn	trans	-80.5	0.4	179	-66.7	169.4	-178.1	0	0	113.7	Q167 G173 I175	Q167-E171 HydrophobicContact CG-CG 4.39Å; Q167-E171 WeakPolarHBondContact CG-OE1 3.42Å; Q167-E171 PolarHBondContact NE2-OE1 3.32Å; Q167-E171 WeakPolarHBondContact O-CG 3.41Å; Q167-E171 PolarHBondContact O-N 3.34Å; E171-G173 PolarHBondContact O-N 2.74Å; E171-I175 HydrophobicContact CG-CD1 4.38Å
172	S	87.5	Confident	89.2	Confident	50 Å²	50	60.6 Å²	60.6	35%	0.35	35%	0.349	S	S	.	.	S	Bend	trans	-72.9	26.6	-174.3	67.1	0	0	0	0	115.6	S168 A169 L170 R224	S168-S172 PolarHBondContact O-N 2.9Å; A169-S172 WeakPolarHBondContact O-CB 3.33Å; A169-S172 PolarHBondContact O-N 3.06Å; A169-S172 PolarHBondContact O-OG 3.06Å; L170-S172 VanDerWaalsContact C-N 3.26Å; L170-S172 PolarHBondContact O-N 3.18Å; S172-R224 PolarHBondContact O-NH1 3.34Å; S172-R224 PolarHBondContact OG-NH1 2.97Å
173	G	82.8	Confident	89	Confident	36 Å²	36	65.8 Å²	65.8	37%	0.371	37%	0.372	S	S	.	.	S	Bend	trans	169.5	-163.8	175.8	0	0	0	0	0	112.5	E171 I175	E171-G173 PolarHBondContact O-N 2.74Å; G173-I175 PolarHBondContact O-N 2.96Å
174	N	83.2	Confident	88.9	Confident	147 Å²	147	68.7 Å²	68.7	79%	0.786	39%	0.386	S	S	*	.	P	Polyproline II helix	trans	-64.8	127.5	-174.1	-164.5	18.1	0	0	0	112.2
175	I	82.7	Confident	88.8	Confident	74 Å²	74	64.3 Å²	64.3	38%	0.379	37%	0.365	S	S	.	.	P	Polyproline II helix	trans	-99.7	122	177.2	-56.5	174.6	0	0	0	107.3	E171 G173 A179	E171-I175 HydrophobicContact CG-CD1 4.38Å; G173-I175 PolarHBondContact O-N 2.96Å; I175-A179 HydrophobicContact CG2-CB 3.82Å
176	P	79.7	Confident	88.7	Confident	41 Å²	41	61 Å²	61	27%	0.266	35%	0.349	S	S	.	.	P	Polyproline II helix	trans	-73.2	146.3	-179.7	32	-35.6	0	0	0	111.1	G178 A179 L225 M229	P176-G178 PolarHBondContact O-N 3.47Å; P176-G178 VanDerWaalsContact O-N 3.17Å; P176-A179 HydrophobicContact CG-CB 4.06Å; P176-A179 WeakPolarHBondContact O-CB 3.34Å; P176-A179 PolarHBondContact O-N 2.89Å; P176-A179 VanDerWaalsContact O-N 3.1Å; P176-L225 HydrophobicContact CG-CD1 3.74Å; P176-M229 HydrophobicContact CG-SD 3.77Å
177	S	78.1	Confident	88.6	Confident	135 Å²	135	61.9 Å²	61.9	94%	0.944	35%	0.354	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.1	116.6	171.4	-169.1	0	0	0	0	109.6
178	G	81.8	Confident	88.6	Confident	65 Å²	65	62.2 Å²	62.2	67%	0.67	35%	0.353	S	S	*	.	T	Hydrogen-bonded Turn	trans	107.3	1.3	-172.8	0	0	0	0	0	115.7	P176	P176-G178 PolarHBondContact O-N 3.47Å; P176-G178 VanDerWaalsContact O-N 3.17Å
179	A	85.5	Confident	88.6	Confident	26 Å²	26	59.3 Å²	59.3	22%	0.215	33%	0.332	C	S	.	.	P	Polyproline II helix	trans	-65.6	154.8	166.9	0	0	0	0	0	112.8	I175 P176 L228	I175-A179 HydrophobicContact CG2-CB 3.82Å; P176-A179 HydrophobicContact CG-CB 4.06Å; P176-A179 WeakPolarHBondContact O-CB 3.34Å; P176-A179 PolarHBondContact O-N 2.89Å; P176-A179 VanDerWaalsContact O-N 3.1Å; A179-L228 WeakPolarHBondContact CA-O 3.33Å; A179-L228 HydrophobicContact CB-CB 3.96Å; A179-L228 HydrophobicContact CB-CD2 4.35Å
180	Y	86.8	Confident	88.6	Confident	135 Å²	135	59.3 Å²	59.3	53%	0.529	33%	0.332	S	S	.	.	P	Polyproline II helix	trans	-68.1	151.5	163.7	-67.1	-85.7	0	0	0	111.2	S182 L228	Y180-S182 PolarHBondContact O-N 3.23Å; Y180-L228 WeakPolarHBondContact CD2-O 3.19Å; Y180-L228 PolarHBondContact N-O 3.27Å
181	E	89.3	Confident	88.6	Confident	149 Å²	149	59.6 Å²	59.6	70%	0.696	33%	0.334	S	S	*	.	P	Polyproline II helix	trans	-61.1	128.1	179.4	-64.2	174.8	164.4	0	0	111.9	E183 F184 L185	E181-E183 VanDerWaalsContact C-N 3.25Å; E181-E183 PolarHBondContact O-N 3.15Å; E181-F184 HydrophobicContact CB-CB 4.25Å; E181-F184 PolarHBondContact O-N 3.37Å; E181-L185 PolarHBondContact O-N 2.94Å
182	S	91.2	Very high	88.8	Confident	10 Å²	10	55.5 Å²	55.5	7%	0.07	32%	0.316	C	S	.	.	H	α-helix	trans	-56	-37.5	-178.8	-61.3	0	0	0	0	113.2	L170 Y180 A186	L170-S182 WeakPolarHBondContact CD1-O 3.26Å; Y180-S182 PolarHBondContact O-N 3.23Å; S182-A186 VanDerWaalsContact O-CB 3.22Å; S182-A186 WeakPolarHBondContact O-CB 3.25Å; S182-A186 PolarHBondContact O-N 3.12Å
183	E	91.4	Very high	89.1	Confident	115 Å²	115	53.1 Å²	53.1	54%	0.537	30%	0.299	S	S	.	.	H	α-helix	trans	-66.1	-51.5	177.4	-176.8	175.5	177.9	0	0	111.5	E181 L185 A186 I187	E181-E183 VanDerWaalsContact C-N 3.25Å; E181-E183 PolarHBondContact O-N 3.15Å; E183-L185 VanDerWaalsContact C-N 3.33Å; E183-L185 PolarHBondContact O-N 3.18Å; E183-A186 PolarHBondContact O-N 3.39Å; E183-A186 VanDerWaalsContact O-N 3.17Å; E183-I187 HydrophobicContact CG-CD1 3.82Å; E183-I187 WeakPolarHBondContact O-CB 3.44Å; E183-I187 VanDerWaalsContact O-CG1 3.26Å; E183-I187 WeakPolarHBondContact O-CG1 3.49Å; E183-I187 PolarHBondContact O-N 2.9Å
184	F	91.5	Very high	89.7	Confident	83 Å²	83	54.1 Å²	54.1	36%	0.364	29%	0.292	S	S	.	.	H	α-helix	trans	-59.9	-42.7	178.2	-179	-99	0	0	0	112	L152 E181 I187 R188	L152-F184 HydrophobicContact CD1-CE2 4.49Å; E181-F184 HydrophobicContact CB-CB 4.25Å; E181-F184 PolarHBondContact O-N 3.37Å; F184-I187 PolarHBondContact O-N 2.9Å; F184-R188 HydrophobicContact CD1-CG 4.41Å; F184-R188 HydrophobicContact CE1-CG 3.99Å; F184-R188 HydrophobicContact CE2-CG 4.4Å; F184-R188 HydrophobicContact CZ-CG 3.98Å; F184-R188 WeakPolarHBondContact O-CB 3.44Å; F184-R188 WeakPolarHBondContact O-CG 3.25Å; F184-R188 PolarHBondContact O-N 3.29Å
185	L	93.1	Very high	90.1	Very high	10 Å²	10	51.5 Å²	51.5	5%	0.052	28%	0.278	C	S	.	.	H	α-helix	trans	-62.1	-46.9	173.6	-76.9	177.1	0	0	0	111.9	L170 E181 E183 I187 R188 I189 V227 L228 P234	L170-L185 HydrophobicContact CD1-CB 3.69Å; L170-L185 HydrophobicContact CD1-CD1 4.37Å; E181-L185 PolarHBondContact O-N 2.94Å; E183-L185 VanDerWaalsContact C-N 3.33Å; E183-L185 PolarHBondContact O-N 3.18Å; L185-I187 VanDerWaalsContact C-N 3.34Å; L185-I187 PolarHBondContact O-N 2.84Å; L185-R188 PolarHBondContact O-N 3.41Å; L185-I189 HydrophobicContact CB-CD1 4.39Å; L185-I189 WeakPolarHBondContact O-CB 2.78Å; L185-I189 WeakPolarHBondContact O-CD1 2.79Å; L185-I189 WeakPolarHBondContact O-CG1 3.3Å; L185-I189 PolarHBondContact O-N 3.1Å; L185-V227 HydrophobicContact CD1-CG1 4.4Å; L185-L228 HydrophobicContact CD1-CD2 4.01Å; L185-P234 HydrophobicContact CD2-CG 4.43Å
186	A	94.5	Very high	90.5	Very high	1 Å²	1	52.3 Å²	52.3	1%	0.008	28%	0.283	C	S	.	.	H	α-helix	trans	-61.5	-41.2	178.6	0	0	0	0	0	112.5	L166 Q167 L170 S182 E183 E190	L166-A186 HydrophobicContact CB-CB 3.86Å; Q167-A186 HydrophobicContact CB-CB 3.86Å; L170-A186 HydrophobicContact CD1-CB 4.5Å; S182-A186 VanDerWaalsContact O-CB 3.22Å; S182-A186 WeakPolarHBondContact O-CB 3.25Å; S182-A186 PolarHBondContact O-N 3.12Å; E183-A186 PolarHBondContact O-N 3.39Å; E183-A186 VanDerWaalsContact O-N 3.17Å; A186-E190 VanDerWaalsContact O-CB 3.29Å; A186-E190 WeakPolarHBondContact O-CB 3.49Å; A186-E190 PolarHBondContact O-N 3.02Å
187	I	93.6	Very high	91.1	Very high	19 Å²	19	53.1 Å²	53.1	10%	0.097	28%	0.282	C	S	.	.	H	α-helix	trans	-61.1	-45.9	174.3	-69.6	166.9	0	0	0	110.8	L152 E183 F184 L185 S191	L152-I187 HydrophobicContact CB-CG2 3.45Å; L152-I187 VanDerWaalsContact CB-CG2 3.45Å; L152-I187 HydrophobicContact CD1-CG2 3.83Å; L152-I187 HydrophobicContact CG-CG2 4.15Å; E183-I187 HydrophobicContact CG-CD1 3.82Å; E183-I187 WeakPolarHBondContact O-CB 3.44Å; E183-I187 VanDerWaalsContact O-CG1 3.26Å; E183-I187 WeakPolarHBondContact O-CG1 3.49Å; E183-I187 PolarHBondContact O-N 2.9Å; F184-I187 PolarHBondContact O-N 2.9Å; L185-I187 VanDerWaalsContact C-N 3.34Å; L185-I187 PolarHBondContact O-N 2.84Å; I187-S191 WeakPolarHBondContact O-CB 3.47Å; I187-S191 PolarHBondContact O-N 3.41Å; I187-S191 PolarHBondContact O-OG 2.81Å
188	R	94.1	Very high	91.6	Very high	59 Å²	59	52.2 Å²	52.2	22%	0.223	27%	0.267	C	S	.	.	H	α-helix	trans	-67.1	-47.3	178.9	-76.2	-92.4	64.3	-120.7	-0.1	111.9	L152 F184 L185 E190 S191 S192 P234 D235	L152-R188 HydrophobicContact CD1-CG 4.26Å; F184-R188 HydrophobicContact CD1-CG 4.41Å; F184-R188 HydrophobicContact CE1-CG 3.99Å; F184-R188 HydrophobicContact CE2-CG 4.4Å; F184-R188 HydrophobicContact CZ-CG 3.98Å; F184-R188 WeakPolarHBondContact O-CB 3.44Å; F184-R188 WeakPolarHBondContact O-CG 3.25Å; F184-R188 PolarHBondContact O-N 3.29Å; L185-R188 PolarHBondContact O-N 3.41Å; R188-E190 VanDerWaalsContact C-N 3.34Å; R188-E190 PolarHBondContact O-N 2.88Å; R188-S191 WeakPolarHBondContact O-CB 3.32Å; R188-S191 PolarHBondContact O-N 3.16Å; R188-S192 PolarHBondContact O-N 3.45Å; R188-S192 PolarHBondContact O-OG 3.18Å; R188-S192 VanDerWaalsContact O-OG 3.05Å; R188-P234 HydrophobicContact CB-CB 4.02Å; R188-P234 HydrophobicContact CB-CG 3.92Å; R188-D235 IonicContact NH1-OD1 2.65Å
189	I	94.9	Very high	91.9	Very high	0 Å²	0	52.8 Å²	52.8	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60	-43.4	177.7	-65	159.7	0	0	0	110.8	L166 L170 L185 S192 I193 V227 P234 L237	L166-I189 HydrophobicContact CD1-CB 4.36Å; L166-I189 HydrophobicContact CD1-CG2 3.97Å; L166-I189 HydrophobicContact CD2-CG2 4.13Å; L170-I189 HydrophobicContact CD1-CD1 4.37Å; L185-I189 HydrophobicContact CB-CD1 4.39Å; L185-I189 WeakPolarHBondContact O-CB 2.78Å; L185-I189 WeakPolarHBondContact O-CD1 2.79Å; L185-I189 WeakPolarHBondContact O-CG1 3.3Å; L185-I189 PolarHBondContact O-N 3.1Å; I189-S192 PolarHBondContact O-N 2.88Å; I189-I193 HydrophobicContact CG2-CD1 3.87Å; I189-I193 VanDerWaalsContact O-CG1 3.25Å; I189-I193 WeakPolarHBondContact O-CG1 3.38Å; I189-I193 PolarHBondContact O-N 3.34Å; I189-V227 HydrophobicContact CD1-CG1 4.14Å; I189-P234 HydrophobicContact CG1-CB 3.89Å; I189-P234 HydrophobicContact CG1-CG 4.38Å; I189-L237 HydrophobicContact CD1-CD2 3.67Å; I189-L237 HydrophobicContact CG1-CD2 3.98Å; I189-L237 HydrophobicContact CG2-CD2 4.16Å
190	E	95	Very high	92.2	Very high	0 Å²	0	52.6 Å²	52.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-63.1	-43.7	176.1	-172.8	-81.9	142.6	0	0	111.7	R159 A162 R163 L166 A186 R188 I193 Y194 Y204	R159-E190 IonicContact CZ-OE1 3.38Å; R159-E190 IonicContact CZ-OE2 3.61Å; R159-E190 IonicContact NE-OE1 3.16Å; R159-E190 PolarHBondContact NE-OE1 3.45Å; R159-E190 IonicContact NE-OE2 3.8Å; R159-E190 PolarHBondContact NE-OE2 3.33Å; R159-E190 IonicContact NH2-OE1 3.19Å; R159-E190 PolarHBondContact NH2-OE1 3.32Å; R159-E190 IonicContact NH2-OE2 2.87Å; R159-E190 PolarHBondContact NH2-OE2 2.86Å; A162-E190 HydrophobicContact CB-CG 4Å; R163-E190 HydrophobicContact CG-CB 3.61Å; R163-E190 HydrophobicContact CG-CG 3.77Å; R163-E190 IonicContact CZ-OE2 3.25Å; R163-E190 VanDerWaalsContact CZ-OE2 3.25Å; R163-E190 IonicContact NE-OE2 2.84Å; R163-E190 PolarHBondContact NE-OE2 3.19Å; R163-E190 IonicContact NH2-OE2 2.81Å; R163-E190 PolarHBondContact NH2-OE2 3.17Å; L166-E190 HydrophobicContact CD1-CB 3.98Å; A186-E190 VanDerWaalsContact O-CB 3.29Å; A186-E190 WeakPolarHBondContact O-CB 3.49Å; A186-E190 PolarHBondContact O-N 3.02Å; R188-E190 VanDerWaalsContact C-N 3.34Å; R188-E190 PolarHBondContact O-N 2.88Å; E190-I193 PolarHBondContact O-N 2.85Å; E190-Y194 PolarHBondContact O-N 3.3Å; E190-Y204 WeakPolarHBondContact CG-OH 3.41Å; E190-Y204 PolarHBondContact OE1-OH 3.45Å
191	S	93.7	Very high	92.4	Very high	6 Å²	6	49.3 Å²	49.3	4%	0.042	24%	0.242	C	C	.	.	H	α-helix	trans	-61	-50.7	177.2	-55.6	0	0	0	0	110.9	I187 R188 I193 Y194 D195	I187-S191 WeakPolarHBondContact O-CB 3.47Å; I187-S191 PolarHBondContact O-N 3.41Å; I187-S191 PolarHBondContact O-OG 2.81Å; R188-S191 WeakPolarHBondContact O-CB 3.32Å; R188-S191 PolarHBondContact O-N 3.16Å; S191-I193 PolarHBondContact O-N 3.48Å; S191-Y194 CarbonylContact O-C 3.6Å; S191-Y194 WeakPolarHBondContact O-CA 3.4Å; S191-Y194 WeakPolarHBondContact O-CB 3.44Å; S191-Y194 PolarHBondContact O-N 3.44Å; S191-D195 PolarHBondContact O-N 2.88Å
192	S	93.9	Very high	92.6	Very high	4 Å²	4	46.6 Å²	46.6	3%	0.028	24%	0.238	C	C	.	.	H	α-helix	trans	-62.2	-25.5	177	-54.8	0	0	0	0	113.5	R188 I189 L196 D235 A238	R188-S192 PolarHBondContact O-N 3.45Å; R188-S192 PolarHBondContact O-OG 3.18Å; R188-S192 VanDerWaalsContact O-OG 3.05Å; I189-S192 PolarHBondContact O-N 2.88Å; S192-L196 WeakPolarHBondContact O-CG 3.33Å; S192-D235 WeakPolarHBondContact CB-OD1 3.35Å; S192-D235 PolarHBondContact OG-OD1 3.02Å; S192-A238 WeakPolarHBondContact O-CB 3.28Å
193	I	94.8	Very high	92.8	Very high	0 Å²	0	53.4 Å²	53.4	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-77.5	-39.6	170.4	-69.6	167.2	0	0	0	110.9	I189 E190 S191 L196 F197 Y204 R207 V208 R211 A238	I189-I193 HydrophobicContact CG2-CD1 3.87Å; I189-I193 VanDerWaalsContact O-CG1 3.25Å; I189-I193 WeakPolarHBondContact O-CG1 3.38Å; I189-I193 PolarHBondContact O-N 3.34Å; E190-I193 PolarHBondContact O-N 2.85Å; S191-I193 PolarHBondContact O-N 3.48Å; I193-L196 PolarHBondContact O-N 2.86Å; I193-F197 HydrophobicContact CG2-CD2 4.33Å; I193-F197 HydrophobicContact CG2-CE2 4.32Å; I193-F197 VanDerWaalsContact O-CD2 3.31Å; I193-F197 WeakPolarHBondContact O-CD2 3.34Å; I193-Y204 HydrophobicContact CG2-CD2 3.75Å; I193-Y204 HydrophobicContact CG2-CE2 3.96Å; I193-R207 HydrophobicContact CD1-CG 4.27Å; I193-R207 HydrophobicContact CG1-CG 4.1Å; I193-R207 HydrophobicContact CG2-CB 4.04Å; I193-R207 HydrophobicContact CG2-CG 3.77Å; I193-V208 HydrophobicContact CD1-CG2 4.34Å; I193-V208 HydrophobicContact CG2-CG2 4.08Å; I193-R211 HydrophobicContact CD1-CG 3.99Å; I193-A238 HydrophobicContact CG1-CB 3.71Å
194	Y	94.3	Very high	93	Very high	58 Å²	58	48 Å²	48	23%	0.227	24%	0.241	C	C	.	.	H	α-helix	trans	-64.3	-41.6	175.5	-172	-94.2	0	0	0	111.6	R159 E190 S191 L196 F197 N198 Y204	R159-Y194 HydrophobicContact CG-CD2 4.37Å; R159-Y194 VanDerWaalsContact NH1-CD1 3.35Å; E190-Y194 PolarHBondContact O-N 3.3Å; S191-Y194 CarbonylContact O-C 3.6Å; S191-Y194 WeakPolarHBondContact O-CA 3.4Å; S191-Y194 WeakPolarHBondContact O-CB 3.44Å; S191-Y194 PolarHBondContact O-N 3.44Å; Y194-L196 PolarHBondContact O-N 3.31Å; Y194-L196 VanDerWaalsContact O-N 3.11Å; Y194-F197 PolarHBondContact O-N 3.12Å; Y194-N198 WeakPolarHBondContact O-CA 3.47Å; Y194-N198 PolarHBondContact O-N 3.47Å; Y194-N198 PolarHBondContact OH-O 3.17Å; Y194-Y204 HydrophobicContact CD2-CD2 4.35Å; Y194-Y204 HydrophobicContact CD2-CE2 4.01Å
195	D	92.6	Very high	93.1	Very high	92 Å²	92	47.8 Å²	47.8	49%	0.492	24%	0.239	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.6	-14.8	180	-60.9	-27.2	0	0	0	113.2	S191	S191-D195 PolarHBondContact O-N 2.88Å
196	L	91.5	Very high	93.2	Very high	91 Å²	91	52 Å²	52	48%	0.476	26%	0.259	S	S	.	.	T	Hydrogen-bonded Turn	trans	-91.7	-12.7	174.2	-70.8	172	0	0	0	114.6	S192 I193 Y194 A238	S192-L196 WeakPolarHBondContact O-CG 3.33Å; I193-L196 PolarHBondContact O-N 2.86Å; Y194-L196 PolarHBondContact O-N 3.31Å; Y194-L196 VanDerWaalsContact O-N 3.11Å; L196-A238 HydrophobicContact CD1-CB 3.85Å
197	F	90.6	Very high	93.2	Very high	58 Å²	58	55.4 Å²	55.4	25%	0.254	27%	0.271	S	S	.	.	T	Hydrogen-bonded Turn	trans	-127.3	-22.2	-177.9	-66.7	-67.3	0	0	0	113.9	I193 Y194 N199 K203 Y204 R207	I193-F197 HydrophobicContact CG2-CD2 4.33Å; I193-F197 HydrophobicContact CG2-CE2 4.32Å; I193-F197 VanDerWaalsContact O-CD2 3.31Å; I193-F197 WeakPolarHBondContact O-CD2 3.34Å; Y194-F197 PolarHBondContact O-N 3.12Å; F197-N199 PolarHBondContact O-N 3.07Å; F197-K203 HydrophobicContact CD1-CB 4.1Å; F197-K203 HydrophobicContact CE1-CB 3.74Å; F197-K203 HydrophobicContact CZ-CB 4.24Å; F197-Y204 HydrophobicContact CD2-CD2 4.39Å; F197-R207 HydrophobicContact CE2-CB 3.76Å; F197-R207 HydrophobicContact CE2-CG 4.05Å; F197-R207 HydrophobicContact CZ-CB 4.25Å
198	N	88.5	Confident	93.3	Very high	115 Å²	115	54.7 Å²	54.7	62%	0.615	27%	0.268	S	S	*	.	S	Bend	trans	53.5	7.2	-175.8	-55.2	94.8	0	0	0	115.8	Y194	Y194-N198 WeakPolarHBondContact O-CA 3.47Å; Y194-N198 PolarHBondContact O-N 3.47Å; Y194-N198 PolarHBondContact OH-O 3.17Å
199	N	90.1	Very high	93.3	Very high	78 Å²	78	58.1 Å²	58.1	42%	0.417	28%	0.281	S	S	.	.	S	Bend	trans	-150.5	152	-175.9	-171.6	23	0	0	0	111.3	F197 D201 Y204	F197-N199 PolarHBondContact O-N 3.07Å; N199-D201 PolarHBondContact ND2-OD1 3.03Å; N199-D201 PolarHBondContact ND2-OD2 2.81Å; N199-D201 PolarHBondContact O-N 3Å; N199-Y204 WeakPolarHBondContact O-CB 3.29Å
200	T	90.6	Very high	93.3	Very high	21 Å²	21	59.2 Å²	59.2	13%	0.129	29%	0.288	C	S	.	.			trans	-84.2	40.5	-175.6	-45.3	0	0	0	0	112.2	D156 V158 Y204 K205	D156-T200 PolarHBondContact OD2-OG1 3.13Å; V158-T200 HydrophobicContact CB-CG2 3.65Å; V158-T200 HydrophobicContact CG1-CG2 3.43Å; V158-T200 VanDerWaalsContact CG1-CG2 3.43Å; V158-T200 HydrophobicContact CG2-CG2 4.32Å; T200-Y204 HydrophobicContact CG2-CD1 4Å; T200-Y204 HydrophobicContact CG2-CE1 3.92Å; T200-K205 VanDerWaalsContact O-CE 3.25Å; T200-K205 WeakPolarHBondContact O-CE 3.46Å; T200-K205 PolarHBondContact O-NZ 2.69Å
201	D	92	Very high	93.3	Very high	67 Å²	67	59.3 Å²	59.3	36%	0.358	29%	0.288	S	S	.	.			trans	-68.3	166.5	-173.1	-92.2	-41.2	0	0	0	114.6	N199 K203 Y204 K205	N199-D201 PolarHBondContact ND2-OD1 3.03Å; N199-D201 PolarHBondContact ND2-OD2 2.81Å; N199-D201 PolarHBondContact O-N 3Å; D201-K203 PolarHBondContact O-N 2.92Å; D201-Y204 PolarHBondContact O-N 3.19Å; D201-Y204 VanDerWaalsContact O-N 3.15Å; D201-K205 WeakPolarHBondContact O-CG 3.43Å; D201-K205 PolarHBondContact O-N 3.13Å
202	P	93.5	Very high	93.4	Very high	92 Å²	92	59.6 Å²	59.6	60%	0.597	29%	0.289	S	S	*	.	H	α-helix	trans	-55	-30.4	168.5	22.4	-33.4	0	0	0	112.9	Q206	P202-Q206 VanDerWaalsContact O-CB 3.28Å; P202-Q206 WeakPolarHBondContact O-CB 3.41Å; P202-Q206 PolarHBondContact O-N 3.26Å
203	K	93.8	Very high	93.4	Very high	153 Å²	153	65.6 Å²	65.6	67%	0.665	32%	0.319	S	S	*	.	H	α-helix	trans	-65.4	-47.9	174.1	-66.3	179	-179.8	173.9	0	112.3	F197 D201 Q206 R207	F197-K203 HydrophobicContact CD1-CB 4.1Å; F197-K203 HydrophobicContact CE1-CB 3.74Å; F197-K203 HydrophobicContact CZ-CB 4.24Å; D201-K203 PolarHBondContact O-N 2.92Å; K203-Q206 PolarHBondContact O-N 3.43Å; K203-R207 PolarHBondContact O-N 3.18Å
204	Y	95.7	Very high	93.3	Very high	1 Å²	1	66.7 Å²	66.7	0%	0.004	32%	0.324	C	S	.	.	H	α-helix	trans	-58.6	-51.8	172.4	163.6	-87.2	0	0	0	110.8	A162 E190 I193 Y194 F197 N199 T200 D201 Q206 R207 V208	A162-Y204 WeakPolarHBondContact CB-OH 3.43Å; E190-Y204 WeakPolarHBondContact CG-OH 3.41Å; E190-Y204 PolarHBondContact OE1-OH 3.45Å; I193-Y204 HydrophobicContact CG2-CD2 3.75Å; I193-Y204 HydrophobicContact CG2-CE2 3.96Å; Y194-Y204 HydrophobicContact CD2-CD2 4.35Å; Y194-Y204 HydrophobicContact CD2-CE2 4.01Å; F197-Y204 HydrophobicContact CD2-CD2 4.39Å; N199-Y204 WeakPolarHBondContact O-CB 3.29Å; T200-Y204 HydrophobicContact CG2-CD1 4Å; T200-Y204 HydrophobicContact CG2-CE1 3.92Å; D201-Y204 PolarHBondContact O-N 3.19Å; D201-Y204 VanDerWaalsContact O-N 3.15Å; Y204-Q206 VanDerWaalsContact C-N 3.25Å; Y204-Q206 PolarHBondContact O-N 2.96Å; Y204-R207 WeakPolarHBondContact O-CB 3.33Å; Y204-R207 PolarHBondContact O-N 3.03Å; Y204-R207 VanDerWaalsContact O-N 3.09Å; Y204-V208 HydrophobicContact CE1-CG2 4.19Å; Y204-V208 HydrophobicContact CE2-CG2 4.32Å; Y204-V208 PolarHBondContact O-N 2.98Å
205	K	94.8	Very high	93.3	Very high	78 Å²	78	64 Å²	64	34%	0.339	31%	0.314	S	S	.	.	H	α-helix	trans	-56.9	-39.2	178.9	-72.7	163	175.7	142.3	0	111.7	T200 D201 R209	T200-K205 VanDerWaalsContact O-CE 3.25Å; T200-K205 WeakPolarHBondContact O-CE 3.46Å; T200-K205 PolarHBondContact O-NZ 2.69Å; D201-K205 WeakPolarHBondContact O-CG 3.43Å; D201-K205 PolarHBondContact O-N 3.13Å; K205-R209 WeakPolarHBondContact O-CG 3.2Å; K205-R209 PolarHBondContact O-N 3.24Å; K205-R209 VanDerWaalsContact O-N 3.12Å
206	Q	94.6	Very high	93.3	Very high	99 Å²	99	67 Å²	67	46%	0.463	32%	0.319	S	S	.	.	H	α-helix	trans	-70.8	-42	176.7	-170.8	61.6	7.6	0	0	112.6	P202 K203 Y204 V208 R209 T210	P202-Q206 VanDerWaalsContact O-CB 3.28Å; P202-Q206 WeakPolarHBondContact O-CB 3.41Å; P202-Q206 PolarHBondContact O-N 3.26Å; K203-Q206 PolarHBondContact O-N 3.43Å; Y204-Q206 VanDerWaalsContact C-N 3.25Å; Y204-Q206 PolarHBondContact O-N 2.96Å; Q206-V208 VanDerWaalsContact C-N 3.32Å; Q206-V208 PolarHBondContact O-N 3.35Å; Q206-R209 PolarHBondContact O-N 3.06Å; Q206-T210 PolarHBondContact O-N 3.42Å; Q206-T210 PolarHBondContact O-OG1 2.93Å; Q206-T210 VanDerWaalsContact O-OG1 3.12Å
207	R	94.4	Very high	93.3	Very high	72 Å²	72	65.4 Å²	65.4	27%	0.272	31%	0.31	S	S	.	.	H	α-helix	trans	-56.8	-45.8	175.3	-175	64.4	64.1	128.1	-9.1	111.1	I193 F197 K203 Y204 T210 R211 A238 S239	I193-R207 HydrophobicContact CD1-CG 4.27Å; I193-R207 HydrophobicContact CG1-CG 4.1Å; I193-R207 HydrophobicContact CG2-CB 4.04Å; I193-R207 HydrophobicContact CG2-CG 3.77Å; F197-R207 HydrophobicContact CE2-CB 3.76Å; F197-R207 HydrophobicContact CE2-CG 4.05Å; F197-R207 HydrophobicContact CZ-CB 4.25Å; K203-R207 PolarHBondContact O-N 3.18Å; Y204-R207 WeakPolarHBondContact O-CB 3.33Å; Y204-R207 PolarHBondContact O-N 3.03Å; Y204-R207 VanDerWaalsContact O-N 3.09Å; R207-T210 PolarHBondContact O-N 3.1Å; R207-R211 WeakPolarHBondContact O-CG 3.3Å; R207-R211 PolarHBondContact O-N 3.44Å; R207-R211 VanDerWaalsContact O-N 3.08Å; R207-A238 PolarHBondContact NH1-O 3.11Å; R207-S239 PolarHBondContact NH1-O 3.17Å
208	V	95.7	Very high	93.2	Very high	5 Å²	5	67.5 Å²	67.5	3%	0.03	33%	0.333	C	S	.	.	H	α-helix	trans	-58.3	-53.2	174.7	175.1	0	0	0	0	111.1	A162 L166 I193 Y204 Q206 T210 R211 V212	A162-V208 HydrophobicContact CB-CG1 3.86Å; A162-V208 HydrophobicContact CB-CG2 4.1Å; L166-V208 HydrophobicContact CG-CG1 4.44Å; I193-V208 HydrophobicContact CD1-CG2 4.34Å; I193-V208 HydrophobicContact CG2-CG2 4.08Å; Y204-V208 HydrophobicContact CE1-CG2 4.19Å; Y204-V208 HydrophobicContact CE2-CG2 4.32Å; Y204-V208 PolarHBondContact O-N 2.98Å; Q206-V208 VanDerWaalsContact C-N 3.32Å; Q206-V208 PolarHBondContact O-N 3.35Å; V208-T210 VanDerWaalsContact C-N 3.3Å; V208-T210 PolarHBondContact O-N 2.81Å; V208-R211 PolarHBondContact O-N 3.43Å; V208-V212 HydrophobicContact CG1-CG2 4.24Å; V208-V212 WeakPolarHBondContact O-CG2 3.4Å; V208-V212 PolarHBondContact O-N 3.44Å
209	R	95	Very high	93	Very high	130 Å²	130	68 Å²	68	49%	0.491	34%	0.335	S	S	.	.	H	α-helix	trans	-55.8	-43.5	178.4	-71.5	-179.6	-155.7	116.9	-0.9	112.5	K205 Q206 R211 V212 M213	K205-R209 WeakPolarHBondContact O-CG 3.2Å; K205-R209 PolarHBondContact O-N 3.24Å; K205-R209 VanDerWaalsContact O-N 3.12Å; Q206-R209 PolarHBondContact O-N 3.06Å; R209-R211 VanDerWaalsContact C-N 3.33Å; R209-R211 PolarHBondContact O-N 3.35Å; R209-V212 PolarHBondContact O-N 2.74Å; R209-M213 WeakPolarHBondContact O-CB 3.39Å; R209-M213 PolarHBondContact O-N 3.39Å
210	T	94.8	Very high	93	Very high	23 Å²	23	64.9 Å²	64.9	14%	0.141	32%	0.318	C	S	.	.	H	α-helix	trans	-61.7	-39	177.5	-62.3	0	0	0	0	111.7	Q206 R207 V208 N214 S242 M245	Q206-T210 PolarHBondContact O-N 3.42Å; Q206-T210 PolarHBondContact O-OG1 2.93Å; Q206-T210 VanDerWaalsContact O-OG1 3.12Å; R207-T210 PolarHBondContact O-N 3.1Å; V208-T210 VanDerWaalsContact C-N 3.3Å; V208-T210 PolarHBondContact O-N 2.81Å; T210-N214 PolarHBondContact O-N 3.29Å; T210-N214 VanDerWaalsContact O-N 3.11Å; T210-N214 PolarHBondContact O-ND2 2.98Å; T210-S242 VanDerWaalsContact CG2-OG 3.31Å; T210-S242 WeakPolarHBondContact CG2-OG 3.31Å; T210-M245 HydrophobicContact CG2-CE 4.21Å
211	R	94.8	Very high	92.9	Very high	3 Å²	3	66.8 Å²	66.8	1%	0.011	33%	0.331	C	S	.	.	H	α-helix	trans	-68.8	-45.6	175.1	-61.6	-34	-171.3	-141.7	2.2	112.4	L166 I193 R207 V208 R209 M213 N214 L215 L237 A238 M240	L166-R211 HydrophobicContact CD2-CB 3.94Å; I193-R211 HydrophobicContact CD1-CG 3.99Å; R207-R211 WeakPolarHBondContact O-CG 3.3Å; R207-R211 PolarHBondContact O-N 3.44Å; R207-R211 VanDerWaalsContact O-N 3.08Å; V208-R211 PolarHBondContact O-N 3.43Å; R209-R211 VanDerWaalsContact C-N 3.33Å; R209-R211 PolarHBondContact O-N 3.35Å; R211-M213 PolarHBondContact O-N 3.43Å; R211-N214 PolarHBondContact O-N 2.65Å; R211-L215 WeakPolarHBondContact O-CB 3.37Å; R211-L215 WeakPolarHBondContact O-CG 3.44Å; R211-L215 PolarHBondContact O-N 2.86Å; R211-L237 PolarHBondContact NE-O 3.43Å; R211-L237 PolarHBondContact NH2-O 3.23Å; R211-A238 VanDerWaalsContact NH2-C 3.34Å; R211-A238 PolarHBondContact NH2-O 2.75Å; R211-M240 VanDerWaalsContact CZ-O 3.22Å; R211-M240 PolarHBondContact NH1-O 2.97Å; R211-M240 PolarHBondContact NH2-O 3.32Å
212	V	95.2	Very high	92.8	Very high	11 Å²	11	68.1 Å²	68.1	7%	0.067	34%	0.338	C	S	.	.	H	α-helix	trans	-56.4	-38.9	175.4	172.1	0	0	0	0	111.4	M165 L166 A169 V208 R209 R216	M165-V212 HydrophobicContact CB-CG2 3.89Å; M165-V212 HydrophobicContact CE-CG1 4.32Å; M165-V212 HydrophobicContact CE-CG2 4.49Å; L166-V212 HydrophobicContact CD2-CG2 3.85Å; L166-V212 HydrophobicContact CG-CG2 4.11Å; A169-V212 HydrophobicContact CB-CG1 4.29Å; V208-V212 HydrophobicContact CG1-CG2 4.24Å; V208-V212 WeakPolarHBondContact O-CG2 3.4Å; V208-V212 PolarHBondContact O-N 3.44Å; R209-V212 PolarHBondContact O-N 2.74Å; V212-R216 WeakPolarHBondContact O-CB 3.38Å; V212-R216 WeakPolarHBondContact O-CD 3.25Å; V212-R216 WeakPolarHBondContact O-CG 3.16Å; V212-R216 PolarHBondContact O-N 3.38Å
213	M	93.5	Very high	92.8	Very high	130 Å²	130	64.3 Å²	64.3	64%	0.64	31%	0.313	S	S	*	.	H	α-helix	trans	-67.7	-48.3	176.2	-170.7	-178.5	80.1	0	0	112.5	R209 R211 R216 D217	R209-M213 WeakPolarHBondContact O-CB 3.39Å; R209-M213 PolarHBondContact O-N 3.39Å; R211-M213 PolarHBondContact O-N 3.43Å; M213-R216 PolarHBondContact O-N 3.42Å; M213-D217 PolarHBondContact O-N 2.92Å
214	N	94.1	Very high	92.7	Very high	23 Å²	23	58.5 Å²	58.5	12%	0.123	29%	0.287	C	S	.	.	H	α-helix	trans	-69.7	-35.5	-178.3	-77.1	-96.3	0	0	0	112.5	T210 R211 R216 D217 L223 M245	T210-N214 PolarHBondContact O-N 3.29Å; T210-N214 VanDerWaalsContact O-N 3.11Å; T210-N214 PolarHBondContact O-ND2 2.98Å; R211-N214 PolarHBondContact O-N 2.65Å; N214-R216 PolarHBondContact O-N 2.81Å; N214-D217 PolarHBondContact O-N 2.97Å; N214-L223 HydrophobicContact CB-CD2 3.92Å; N214-M245 HydrophobicContact CB-CE 3.88Å; N214-M245 HydrophobicContact CB-SD 4.08Å; N214-M245 VanDerWaalsContact CG-CE 3.46Å; N214-M245 WeakPolarHBondContact ND2-CE 3.36Å
215	L	93.2	Very high	92.5	Very high	3 Å²	3	61.8 Å²	61.8	2%	0.016	30%	0.304	C	S	.	.	H	α-helix	trans	-69.7	-19	174.6	-71.2	172.6	0	0	0	113.3	L166 A169 L170 R211 R224 V227 L237	L166-L215 HydrophobicContact CD2-CD1 4.3Å; A169-L215 HydrophobicContact CB-CB 3.8Å; A169-L215 HydrophobicContact CB-CD1 4.32Å; L170-L215 HydrophobicContact CD2-CD1 4.11Å; L170-L215 HydrophobicContact CD2-CD2 4.13Å; L170-L215 HydrophobicContact CG-CD1 4.44Å; R211-L215 WeakPolarHBondContact O-CB 3.37Å; R211-L215 WeakPolarHBondContact O-CG 3.44Å; R211-L215 PolarHBondContact O-N 2.86Å; L215-R224 HydrophobicContact CD2-CB 4.49Å; L215-R224 WeakPolarHBondContact O-CD 3.37Å; L215-V227 HydrophobicContact CD2-CG2 4.26Å; L215-L237 HydrophobicContact CD1-CD2 4.5Å
216	R	92.8	Very high	92.3	Very high	155 Å²	155	61 Å²	61	59%	0.585	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.7	3.6	176.4	-70	177.9	65.8	-178.5	1.1	113.7	A169 V212 M213 N214 S218	A169-R216 HydrophobicContact CB-CG 3.78Å; V212-R216 WeakPolarHBondContact O-CB 3.38Å; V212-R216 WeakPolarHBondContact O-CD 3.25Å; V212-R216 WeakPolarHBondContact O-CG 3.16Å; V212-R216 PolarHBondContact O-N 3.38Å; M213-R216 PolarHBondContact O-N 3.42Å; N214-R216 PolarHBondContact O-N 2.81Å; R216-S218 PolarHBondContact O-N 2.74Å
217	D	91	Very high	92.3	Very high	56 Å²	56	56.4 Å²	56.4	30%	0.299	28%	0.282	S	S	.	.			trans	-67.1	117.5	179.2	179.6	19.6	0	0	0	111	M213 N214 N219 N220	M213-D217 PolarHBondContact O-N 2.92Å; N214-D217 PolarHBondContact O-N 2.97Å; D217-N219 PolarHBondContact O-N 3.28Å; D217-N219 WeakPolarHBondContact OD1-CB 3.46Å; D217-N219 PolarHBondContact OD1-N 3.44Å; D217-N219 PolarHBondContact OD1-ND2 3.02Å; D217-N219 VanDerWaalsContact OD1-ND2 3.12Å; D217-N220 PolarHBondContact O-N 3.21Å; D217-N220 WeakPolarHBondContact OD2-CB 3.13Å; D217-N220 PolarHBondContact OD2-N 2.95Å
218	S	88.6	Confident	92.2	Very high	103 Å²	103	53 Å²	53	72%	0.72	27%	0.269	S	S	*	.	T	Hydrogen-bonded Turn	trans	-64.2	-21.6	175.6	54.1	0	0	0	0	113.2	R216	R216-S218 PolarHBondContact O-N 2.74Å
219	N	86.1	Confident	92	Very high	126 Å²	126	56.3 Å²	56.3	67%	0.674	29%	0.285	S	S	*	.	T	Hydrogen-bonded Turn	trans	-87.8	-17.9	-176.3	-48.3	-39.3	0	0	0	112.1	D217 P221	D217-N219 PolarHBondContact O-N 3.28Å; D217-N219 WeakPolarHBondContact OD1-CB 3.46Å; D217-N219 PolarHBondContact OD1-N 3.44Å; D217-N219 PolarHBondContact OD1-ND2 3.02Å; D217-N219 VanDerWaalsContact OD1-ND2 3.12Å; N219-P221 VanDerWaalsContact C-CD 3.46Å
220	N	88.3	Confident	91.7	Very high	11 Å²	11	52 Å²	52	6%	0.059	28%	0.282	C	S	.	.			trans	-129.1	59.1	178.7	-165.4	16.7	0	0	0	113.8	D217 N222 L223 M245 A246 S247	D217-N220 PolarHBondContact O-N 3.21Å; D217-N220 WeakPolarHBondContact OD2-CB 3.13Å; D217-N220 PolarHBondContact OD2-N 2.95Å; N220-N222 PolarHBondContact O-N 2.95Å; N220-N222 VanDerWaalsContact O-N 3.08Å; N220-L223 PolarHBondContact O-N 3.04Å; N220-L223 VanDerWaalsContact O-N 3.15Å; N220-M245 PolarHBondContact ND2-O 2.82Å; N220-A246 PolarHBondContact ND2-O 3.46Å; N220-S247 PolarHBondContact ND2-N 3.45Å; N220-S247 VanDerWaalsContact ND2-N 3.17Å
221	P	89.4	Confident	91.5	Very high	62 Å²	62	57.9 Å²	57.9	40%	0.403	31%	0.307	S	S	.	.	H	α-helix	trans	-60.7	-21.4	176.1	27.7	-35.9	0	0	0	112.8	N219 L223 R224 L225	N219-P221 VanDerWaalsContact C-CD 3.46Å; P221-L223 VanDerWaalsContact C-N 3.33Å; P221-L223 PolarHBondContact O-N 3.35Å; P221-R224 PolarHBondContact O-N 3.04Å; P221-L225 PolarHBondContact O-N 3.24Å
222	N	90.7	Very high	91.4	Very high	94 Å²	94	59.1 Å²	59.1	50%	0.503	32%	0.315	S	S	.	.	H	α-helix	trans	-63.5	-33.3	177.1	-64.7	-57.1	0	0	0	112.9	N220 L225 N226	N220-N222 PolarHBondContact O-N 2.95Å; N220-N222 VanDerWaalsContact O-N 3.08Å; N222-L225 PolarHBondContact O-N 3.41Å; N222-N226 VanDerWaalsContact O-CB 3.29Å; N222-N226 WeakPolarHBondContact O-CB 3.31Å; N222-N226 PolarHBondContact O-N 2.98Å; N222-N226 PolarHBondContact O-ND2 2.92Å
223	L	92.1	Very high	91.3	Very high	12 Å²	12	61.1 Å²	61.1	6%	0.063	33%	0.33	C	S	.	.	H	α-helix	trans	-61.7	-48.3	175	178.6	70.1	0	0	0	110.9	N214 N220 P221 N226 V227 M245	N214-L223 HydrophobicContact CB-CD2 3.92Å; N220-L223 PolarHBondContact O-N 3.04Å; N220-L223 VanDerWaalsContact O-N 3.15Å; P221-L223 VanDerWaalsContact C-N 3.33Å; P221-L223 PolarHBondContact O-N 3.35Å; L223-N226 PolarHBondContact O-N 3.29Å; L223-V227 WeakPolarHBondContact O-CG2 3.48Å; L223-V227 PolarHBondContact O-N 3.25Å; L223-M245 HydrophobicContact CD1-CB 4.4Å; L223-M245 HydrophobicContact CD1-CG 4.38Å; L223-M245 HydrophobicContact CD2-CB 3.98Å; L223-M245 HydrophobicContact CD2-CG 4.31Å; L223-M245 HydrophobicContact CD2-SD 4.4Å
224	R	91.7	Very high	91.3	Very high	32 Å²	32	56.1 Å²	56.1	12%	0.121	31%	0.307	C	S	.	.	H	α-helix	trans	-63.4	-42.4	178.7	-168.5	180	68.5	-149.3	-5.2	111.2	A169 L170 S172 L215 P221 V227 L228	A169-R224 WeakPolarHBondContact O-CD 3.17Å; L170-R224 HydrophobicContact CD2-CG 4.37Å; L170-R224 WeakPolarHBondContact O-CD 3.29Å; S172-R224 PolarHBondContact O-NH1 3.34Å; S172-R224 PolarHBondContact OG-NH1 2.97Å; L215-R224 HydrophobicContact CD2-CB 4.49Å; L215-R224 WeakPolarHBondContact O-CD 3.37Å; P221-R224 PolarHBondContact O-N 3.04Å; R224-V227 PolarHBondContact O-N 3.08Å; R224-L228 HydrophobicContact CG-CD1 4.19Å; R224-L228 WeakPolarHBondContact O-CB 3.23Å; R224-L228 VanDerWaalsContact O-CG 3.32Å; R224-L228 WeakPolarHBondContact O-CG 3.45Å; R224-L228 PolarHBondContact O-N 3.27Å
225	L	91.2	Very high	91.3	Very high	70 Å²	70	59 Å²	59	37%	0.366	32%	0.322	S	S	.	.	H	α-helix	trans	-59.7	-46.3	173.9	179.5	60.6	0	0	0	112	P176 P221 N222 V227 L228 M229	P176-L225 HydrophobicContact CG-CD1 3.74Å; P221-L225 PolarHBondContact O-N 3.24Å; N222-L225 PolarHBondContact O-N 3.41Å; L225-V227 VanDerWaalsContact C-N 3.29Å; L225-V227 PolarHBondContact O-N 3Å; L225-L228 PolarHBondContact O-N 3.35Å; L225-M229 HydrophobicContact CD1-CG 3.86Å; L225-M229 HydrophobicContact CG-CG 4.39Å; L225-M229 WeakPolarHBondContact O-CB 3.44Å; L225-M229 WeakPolarHBondContact O-CG 3.25Å; L225-M229 PolarHBondContact O-N 2.96Å
226	N	92.2	Very high	91.4	Very high	62 Å²	62	63.2 Å²	63.2	33%	0.332	34%	0.34	S	S	.	.	H	α-helix	trans	-65.9	-30.2	-179.7	-71.4	-15.9	0	0	0	113	N222 L223 G230 H231 V232	N222-N226 VanDerWaalsContact O-CB 3.29Å; N222-N226 WeakPolarHBondContact O-CB 3.31Å; N222-N226 PolarHBondContact O-N 2.98Å; N222-N226 PolarHBondContact O-ND2 2.92Å; L223-N226 PolarHBondContact O-N 3.29Å; N226-G230 PolarHBondContact O-N 3.5Å; N226-H231 HydrophobicContact CB-CB 4.13Å; N226-H231 WeakPolarHBondContact O-CA 3.45Å; N226-H231 WeakPolarHBondContact O-CB 3.49Å; N226-H231 PolarHBondContact O-N 3.34Å; N226-V232 HydrophobicContact CB-CG2 4.15Å; N226-V232 PolarHBondContact O-N 2.87Å; N226-V232 VanDerWaalsContact O-N 3.14Å
227	V	93.3	Very high	91.4	Very high	1 Å²	1	55.8 Å²	55.8	1%	0.006	31%	0.312	C	S	.	.	H	α-helix	trans	-73	-46.6	171	173.2	0	0	0	0	110.8	L170 L185 I189 L215 L223 R224 L225 M229 G230 V232 L237	L170-V227 HydrophobicContact CD2-CG1 3.93Å; L185-V227 HydrophobicContact CD1-CG1 4.4Å; I189-V227 HydrophobicContact CD1-CG1 4.14Å; L215-V227 HydrophobicContact CD2-CG2 4.26Å; L223-V227 WeakPolarHBondContact O-CG2 3.48Å; L223-V227 PolarHBondContact O-N 3.25Å; R224-V227 PolarHBondContact O-N 3.08Å; L225-V227 VanDerWaalsContact C-N 3.29Å; L225-V227 PolarHBondContact O-N 3Å; V227-M229 VanDerWaalsContact C-N 3.3Å; V227-M229 PolarHBondContact O-N 3.17Å; V227-G230 PolarHBondContact O-N 2.98Å; V227-V232 HydrophobicContact CG2-CB 4.03Å; V227-V232 HydrophobicContact CG2-CG1 4.32Å; V227-L237 HydrophobicContact CG1-CD2 4.19Å; V227-L237 HydrophobicContact CG2-CD1 4.16Å; V227-L237 HydrophobicContact CG2-CD2 3.89Å
228	L	92.5	Very high	91.5	Very high	1 Å²	1	53.2 Å²	53.2	1%	0.005	30%	0.298	C	S	.	.	H	α-helix	trans	-61.7	-32.8	178.3	-75.4	172	0	0	0	113.5	L170 A179 Y180 L185 R224 L225	L170-L228 HydrophobicContact CB-CD2 4.45Å; L170-L228 HydrophobicContact CD2-CD2 4.42Å; A179-L228 WeakPolarHBondContact CA-O 3.33Å; A179-L228 HydrophobicContact CB-CB 3.96Å; A179-L228 HydrophobicContact CB-CD2 4.35Å; Y180-L228 WeakPolarHBondContact CD2-O 3.19Å; Y180-L228 PolarHBondContact N-O 3.27Å; L185-L228 HydrophobicContact CD1-CD2 4.01Å; R224-L228 HydrophobicContact CG-CD1 4.19Å; R224-L228 WeakPolarHBondContact O-CB 3.23Å; R224-L228 VanDerWaalsContact O-CG 3.32Å; R224-L228 WeakPolarHBondContact O-CG 3.45Å; R224-L228 PolarHBondContact O-N 3.27Å; L225-L228 PolarHBondContact O-N 3.35Å
229	M	91.2	Very high	91.7	Very high	75 Å²	75	51.1 Å²	51.1	37%	0.369	28%	0.284	S	S	.	.	T	Hydrogen-bonded Turn	trans	-88.6	-2	175.5	-61.4	-55.9	-59.7	0	0	113.7	P176 L225 V227 H231	P176-M229 HydrophobicContact CG-SD 3.77Å; L225-M229 HydrophobicContact CD1-CG 3.86Å; L225-M229 HydrophobicContact CG-CG 4.39Å; L225-M229 WeakPolarHBondContact O-CB 3.44Å; L225-M229 WeakPolarHBondContact O-CG 3.25Å; L225-M229 PolarHBondContact O-N 2.96Å; V227-M229 VanDerWaalsContact C-N 3.3Å; V227-M229 PolarHBondContact O-N 3.17Å; M229-H231 VanDerWaalsContact C-N 3.34Å; M229-H231 PolarHBondContact O-N 3.1Å
230	G	89.5	Confident	91.9	Very high	40 Å²	40	45.8 Å²	45.8	41%	0.412	26%	0.255	S	S	.	.	T	Hydrogen-bonded Turn	trans	75.2	10.9	179.6	0	0	0	0	0	116.1	N226 V227 V232	N226-G230 PolarHBondContact O-N 3.5Å; V227-G230 PolarHBondContact O-N 2.98Å; G230-V232 PolarHBondContact O-N 3.33Å
231	H	90.9	Very high	92.1	Very high	146 Å²	146	48.5 Å²	48.5	68%	0.676	27%	0.272	S	S	*	.	S	Bend	trans	-65.8	-23.8	171.1	-66	-46	0	0	0	112.8	N226 M229	N226-H231 HydrophobicContact CB-CB 4.13Å; N226-H231 WeakPolarHBondContact O-CA 3.45Å; N226-H231 WeakPolarHBondContact O-CB 3.49Å; N226-H231 PolarHBondContact O-N 3.34Å; M229-H231 VanDerWaalsContact C-N 3.34Å; M229-H231 PolarHBondContact O-N 3.1Å
232	V	92.3	Very high	92	Very high	28 Å²	28	48.4 Å²	48.4	17%	0.17	27%	0.273	C	S	.	.	S	Bend	trans	-116.9	117.5	170.5	179.9	0	0	0	0	108.5	N226 V227 G230 K236 L237 M240	N226-V232 HydrophobicContact CB-CG2 4.15Å; N226-V232 PolarHBondContact O-N 2.87Å; N226-V232 VanDerWaalsContact O-N 3.14Å; V227-V232 HydrophobicContact CG2-CB 4.03Å; V227-V232 HydrophobicContact CG2-CG1 4.32Å; G230-V232 PolarHBondContact O-N 3.33Å; V232-K236 HydrophobicContact CG1-CG 4.49Å; V232-L237 HydrophobicContact CG1-CB 4.06Å; V232-L237 HydrophobicContact CG1-CD1 4.38Å; V232-M240 HydrophobicContact CG1-SD 4.38Å
233	S	93.4	Very high	91.9	Very high	54 Å²	54	49.2 Å²	49.2	38%	0.378	27%	0.273	S	S	.	.			trans	-69.5	150.4	177.4	66.8	0	0	0	0	111.9	D235 K236 L237	S233-D235 PolarHBondContact O-N 3.47Å; S233-K236 PolarHBondContact O-N 2.99Å; S233-K236 VanDerWaalsContact O-N 3.17Å; S233-K236 WeakPolarHBondContact OG-CB 3.49Å; S233-K236 PolarHBondContact OG-N 3.3Å; S233-L237 PolarHBondContact O-N 2.95Å
234	P	93.4	Very high	91.8	Very high	25 Å²	25	52.3 Å²	52.3	16%	0.162	29%	0.288	C	S	.	.	H	α-helix	trans	-52.4	-36.1	174.8	-30.3	37.6	0	0	0	113.8	L185 R188 I189 L237 A238	L185-P234 HydrophobicContact CD2-CG 4.43Å; R188-P234 HydrophobicContact CB-CB 4.02Å; R188-P234 HydrophobicContact CB-CG 3.92Å; I189-P234 HydrophobicContact CG1-CB 3.89Å; I189-P234 HydrophobicContact CG1-CG 4.38Å; P234-L237 CarbonylContact O-C 3.56Å; P234-L237 PolarHBondContact O-N 3.24Å; P234-A238 WeakPolarHBondContact O-CB 3.49Å; P234-A238 PolarHBondContact O-N 2.95Å
235	D	94	Very high	91.7	Very high	83 Å²	83	50.9 Å²	50.9	44%	0.444	28%	0.283	S	S	.	.	H	α-helix	trans	-75.6	-36.3	-178.4	-42.6	-72.7	0	0	0	112.4	R188 S192 S233 A238 S239	R188-D235 IonicContact NH1-OD1 2.65Å; S192-D235 WeakPolarHBondContact CB-OD1 3.35Å; S192-D235 PolarHBondContact OG-OD1 3.02Å; S233-D235 PolarHBondContact O-N 3.47Å; D235-A238 PolarHBondContact O-N 2.81Å; D235-S239 PolarHBondContact O-N 2.84Å; D235-S239 VanDerWaalsContact O-N 3.12Å; D235-S239 PolarHBondContact O-OG 3.08Å
236	K	94	Very high	91.5	Very high	91 Å²	91	48.5 Å²	48.5	40%	0.396	27%	0.273	S	S	.	.	H	α-helix	trans	-67.9	-41	170	-180	56.6	-175.6	171.9	0	110.6	V232 S233 A238 S239 M240 E244	V232-K236 HydrophobicContact CG1-CG 4.49Å; S233-K236 PolarHBondContact O-N 2.99Å; S233-K236 VanDerWaalsContact O-N 3.17Å; S233-K236 WeakPolarHBondContact OG-CB 3.49Å; S233-K236 PolarHBondContact OG-N 3.3Å; K236-A238 VanDerWaalsContact C-N 3.31Å; K236-A238 PolarHBondContact O-N 3.22Å; K236-S239 WeakPolarHBondContact CA-OG 2.93Å; K236-S239 PolarHBondContact O-N 2.79Å; K236-S239 PolarHBondContact O-OG 3.32Å; K236-S239 VanDerWaalsContact O-OG 3.11Å; K236-M240 HydrophobicContact CD-CB 4.4Å; K236-M240 WeakPolarHBondContact O-CB 3.38Å; K236-M240 VanDerWaalsContact O-CG 3.28Å; K236-M240 WeakPolarHBondContact O-CG 3.38Å; K236-M240 PolarHBondContact O-N 3.28Å; K236-E244 WeakPolarHBondContact CE-OE2 3.33Å; K236-E244 IonicContact NZ-OE2 3.47Å; K236-E244 PolarHBondContact NZ-OE2 2.85Å
237	L	94	Very high	91.4	Very high	0 Å²	0	46.9 Å²	46.9	0%	0	27%	0.266	C	S	.	.	H	α-helix	trans	-63.5	-36.1	173.4	-168	68.8	0	0	0	111.5	I189 R211 L215 V227 V232 S233 P234 M240 M245	I189-L237 HydrophobicContact CD1-CD2 3.67Å; I189-L237 HydrophobicContact CG1-CD2 3.98Å; I189-L237 HydrophobicContact CG2-CD2 4.16Å; R211-L237 PolarHBondContact NE-O 3.43Å; R211-L237 PolarHBondContact NH2-O 3.23Å; L215-L237 HydrophobicContact CD1-CD2 4.5Å; V227-L237 HydrophobicContact CG1-CD2 4.19Å; V227-L237 HydrophobicContact CG2-CD1 4.16Å; V227-L237 HydrophobicContact CG2-CD2 3.89Å; V232-L237 HydrophobicContact CG1-CB 4.06Å; V232-L237 HydrophobicContact CG1-CD1 4.38Å; S233-L237 PolarHBondContact O-N 2.95Å; P234-L237 CarbonylContact O-C 3.56Å; P234-L237 PolarHBondContact O-N 3.24Å; L237-M240 HydrophobicContact CD1-SD 3.96Å; L237-M245 HydrophobicContact CD1-SD 3.94Å
238	A	93.4	Very high	91.2	Very high	1 Å²	1	54.2 Å²	54.2	1%	0.008	30%	0.298	C	S	.	.	H	α-helix	trans	-66.6	-37.5	176.5	0	0	0	0	0	112.6	S192 I193 L196 R207 R211 P234 D235 K236	S192-A238 WeakPolarHBondContact O-CB 3.28Å; I193-A238 HydrophobicContact CG1-CB 3.71Å; L196-A238 HydrophobicContact CD1-CB 3.85Å; R207-A238 PolarHBondContact NH1-O 3.11Å; R211-A238 VanDerWaalsContact NH2-C 3.34Å; R211-A238 PolarHBondContact NH2-O 2.75Å; P234-A238 WeakPolarHBondContact O-CB 3.49Å; P234-A238 PolarHBondContact O-N 2.95Å; D235-A238 PolarHBondContact O-N 2.81Å; K236-A238 VanDerWaalsContact C-N 3.31Å; K236-A238 PolarHBondContact O-N 3.22Å
239	S	92.1	Very high	91.1	Very high	59 Å²	59	61.2 Å²	61.2	41%	0.413	33%	0.331	S	S	.	.	H	α-helix	trans	-86	-43.7	-174.1	50.3	0	0	0	0	115.5	R207 D235 K236	R207-S239 PolarHBondContact NH1-O 3.17Å; D235-S239 PolarHBondContact O-N 2.84Å; D235-S239 VanDerWaalsContact O-N 3.12Å; D235-S239 PolarHBondContact O-OG 3.08Å; K236-S239 WeakPolarHBondContact CA-OG 2.93Å; K236-S239 PolarHBondContact O-N 2.79Å; K236-S239 PolarHBondContact O-OG 3.32Å; K236-S239 VanDerWaalsContact O-OG 3.11Å
240	M	90.6	Very high	91	Very high	15 Å²	15	62 Å²	62	7%	0.074	34%	0.335	C	S	.	.	S	Bend	trans	-57.3	157.8	-167.8	67.1	-167.1	-58.6	0	0	117	R211 V232 K236 L237 E244 M245	R211-M240 VanDerWaalsContact CZ-O 3.22Å; R211-M240 PolarHBondContact NH1-O 2.97Å; R211-M240 PolarHBondContact NH2-O 3.32Å; V232-M240 HydrophobicContact CG1-SD 4.38Å; K236-M240 HydrophobicContact CD-CB 4.4Å; K236-M240 WeakPolarHBondContact O-CB 3.38Å; K236-M240 VanDerWaalsContact O-CG 3.28Å; K236-M240 WeakPolarHBondContact O-CG 3.38Å; K236-M240 PolarHBondContact O-N 3.28Å; L237-M240 HydrophobicContact CD1-SD 3.96Å; M240-E244 HydrophobicContact CB-CB 4.16Å; M240-E244 HydrophobicContact CE-CB 3.62Å; M240-E244 WeakPolarHBondContact CE-O 2.91Å; M240-M245 HydrophobicContact CE-CB 4.39Å; M240-M245 HydrophobicContact CE-CG 3.57Å; M240-M245 HydrophobicContact CG-CG 3.75Å; M240-M245 HydrophobicContact CG-SD 4.24Å; M240-M245 HydrophobicContact SD-CG 3.61Å; M240-M245 HydrophobicContact SD-SD 4.39Å
241	T	91.3	Very high	91	Very high	68 Å²	68	64 Å²	64	42%	0.417	33%	0.332	S	S	.	.			trans	-74	167.3	177	70.7	0	0	0	0	113	E243 E244 M245	T241-E243 PolarHBondContact O-N 2.92Å; T241-E243 PolarHBondContact OG1-N 3.29Å; T241-E244 PolarHBondContact N-OE1 3.2Å; T241-E244 WeakPolarHBondContact OG1-CG 2.97Å; T241-E244 PolarHBondContact OG1-N 3.34Å; T241-E244 PolarHBondContact OG1-OE1 3.04Å; T241-M245 WeakPolarHBondContact O-CG 3.33Å; T241-M245 PolarHBondContact O-N 2.94Å
242	S	88.3	Confident	91.1	Very high	59 Å²	59	61.8 Å²	61.8	41%	0.413	32%	0.322	S	S	.	.	T	Hydrogen-bonded Turn	trans	-65.5	-14.8	167.9	-53.8	0	0	0	0	113.2	T210	T210-S242 VanDerWaalsContact CG2-OG 3.31Å; T210-S242 WeakPolarHBondContact CG2-OG 3.31Å
243	E	87.8	Confident	91.2	Very high	111 Å²	111	63.5 Å²	63.5	52%	0.519	33%	0.33	S	S	.	.	T	Hydrogen-bonded Turn	trans	-89.8	-40.5	-177.7	-45	-157.4	100.1	0	0	110.5	T241 M245 A246 R254	T241-E243 PolarHBondContact O-N 2.92Å; T241-E243 PolarHBondContact OG1-N 3.29Å; E243-M245 PolarHBondContact O-N 3.24Å; E243-A246 WeakPolarHBondContact O-CB 3.47Å; E243-A246 PolarHBondContact O-N 3.22Å; E243-R254 IonicContact OE1-CZ 2.79Å; E243-R254 IonicContact OE1-NH1 2.82Å; E243-R254 PolarHBondContact OE1-NH1 3.1Å
244	E	90	Very high	91.1	Very high	78 Å²	78	64.8 Å²	64.8	36%	0.364	33%	0.326	S	S	.	.	T	Hydrogen-bonded Turn	trans	-61.8	-25.9	169.6	-70.7	175.1	-102.5	0	0	113.4	K236 M240 T241	K236-E244 WeakPolarHBondContact CE-OE2 3.33Å; K236-E244 IonicContact NZ-OE2 3.47Å; K236-E244 PolarHBondContact NZ-OE2 2.85Å; M240-E244 HydrophobicContact CB-CB 4.16Å; M240-E244 HydrophobicContact CE-CB 3.62Å; M240-E244 WeakPolarHBondContact CE-O 2.91Å; T241-E244 PolarHBondContact N-OE1 3.2Å; T241-E244 WeakPolarHBondContact OG1-CG 2.97Å; T241-E244 PolarHBondContact OG1-N 3.34Å; T241-E244 PolarHBondContact OG1-OE1 3.04Å
245	M	89.6	Confident	91.2	Very high	2 Å²	2	68.4 Å²	68.4	1%	0.01	34%	0.341	C	S	.	.	T	Hydrogen-bonded Turn	trans	-84.1	-6.4	178.3	-73.9	-170.7	-57.9	0	0	114.4	T210 N214 N220 L223 L237 M240 T241 E243	T210-M245 HydrophobicContact CG2-CE 4.21Å; N214-M245 HydrophobicContact CB-CE 3.88Å; N214-M245 HydrophobicContact CB-SD 4.08Å; N214-M245 VanDerWaalsContact CG-CE 3.46Å; N214-M245 WeakPolarHBondContact ND2-CE 3.36Å; N220-M245 PolarHBondContact ND2-O 2.82Å; L223-M245 HydrophobicContact CD1-CB 4.4Å; L223-M245 HydrophobicContact CD1-CG 4.38Å; L223-M245 HydrophobicContact CD2-CB 3.98Å; L223-M245 HydrophobicContact CD2-CG 4.31Å; L223-M245 HydrophobicContact CD2-SD 4.4Å; L237-M245 HydrophobicContact CD1-SD 3.94Å; M240-M245 HydrophobicContact CE-CB 4.39Å; M240-M245 HydrophobicContact CE-CG 3.57Å; M240-M245 HydrophobicContact CG-CG 3.75Å; M240-M245 HydrophobicContact CG-SD 4.24Å; M240-M245 HydrophobicContact SD-CG 3.61Å; M240-M245 HydrophobicContact SD-SD 4.39Å; T241-M245 WeakPolarHBondContact O-CG 3.33Å; T241-M245 PolarHBondContact O-N 2.94Å; E243-M245 PolarHBondContact O-N 3.24Å
246	A	88.6	Confident	91.3	Very high	20 Å²	20	69.6 Å²	69.6	17%	0.165	34%	0.342	C	S	.	.	S	Bend	trans	-67.2	168.9	-175.1	0	0	0	0	0	112.9	N220 E243 M250	N220-A246 PolarHBondContact ND2-O 3.46Å; E243-A246 WeakPolarHBondContact O-CB 3.47Å; E243-A246 PolarHBondContact O-N 3.22Å; A246-M250 HydrophobicContact CB-CB 4.28Å; A246-M250 HydrophobicContact CB-CG 4.27Å
247	S	89.8	Confident	91.3	Very high	27 Å²	27	71.4 Å²	71.4	19%	0.189	35%	0.348	C	S	.	.			trans	-60.7	148.9	169.8	68.5	0	0	0	0	109.5	N220 E249 M250 K251	N220-S247 PolarHBondContact ND2-N 3.45Å; N220-S247 VanDerWaalsContact ND2-N 3.17Å; S247-E249 PolarHBondContact O-N 3.31Å; S247-M250 CarbonylContact O-C 3.58Å; S247-M250 PolarHBondContact O-N 2.82Å; S247-M250 WeakPolarHBondContact OG-CB 3.25Å; S247-M250 PolarHBondContact OG-N 3.04Å; S247-K251 PolarHBondContact O-N 2.86Å
248	K	87.7	Confident	91.3	Very high	155 Å²	155	75.3 Å²	75.3	67%	0.674	37%	0.372	S	S	*	.	H	α-helix	trans	-51.6	-47.2	-178.9	179.1	179.3	168.3	-178.2	0	111.4	M250 K251 E252	K248-M250 PolarHBondContact O-N 2.96Å; K248-K251 WeakPolarHBondContact O-CB 3.48Å; K248-K251 PolarHBondContact O-N 3Å; K248-E252 VanDerWaalsContact CE-CD 3.47Å; K248-E252 WeakPolarHBondContact CE-OE1 3.47Å; K248-E252 HydrophobicContact CG-CG 4.43Å; K248-E252 IonicContact NZ-OE1 2.84Å; K248-E252 WeakPolarHBondContact O-CG 3.44Å; K248-E252 PolarHBondContact O-N 2.89Å
249	E	90.5	Very high	91.4	Very high	149 Å²	149	81 Å²	81	70%	0.696	40%	0.396	S	S	*	.	H	α-helix	trans	-56.6	-46.7	174.4	-178.4	-179.3	-162.7	0	0	113	S247 K251 E252 L253	S247-E249 PolarHBondContact O-N 3.31Å; E249-K251 VanDerWaalsContact C-N 3.27Å; E249-K251 PolarHBondContact O-N 3.48Å; E249-E252 PolarHBondContact O-N 3.09Å; E249-L253 WeakPolarHBondContact O-CB 3.49Å; E249-L253 PolarHBondContact O-N 3.19Å
250	M	89.4	Confident	91.4	Very high	91 Å²	91	82.2 Å²	82.2	45%	0.448	40%	0.395	S	S	.	.	H	α-helix	trans	-73	-17.3	179.3	-174.7	57.5	67.4	0	0	113.5	A246 S247 K248 R254	A246-M250 HydrophobicContact CB-CB 4.28Å; A246-M250 HydrophobicContact CB-CG 4.27Å; S247-M250 CarbonylContact O-C 3.58Å; S247-M250 PolarHBondContact O-N 2.82Å; S247-M250 WeakPolarHBondContact OG-CB 3.25Å; S247-M250 PolarHBondContact OG-N 3.04Å; K248-M250 PolarHBondContact O-N 2.96Å; M250-R254 PolarHBondContact O-NE 3.37Å
251	K	90.5	Very high	91.6	Very high	83 Å²	83	85 Å²	85	36%	0.361	41%	0.413	S	S	.	.	H	α-helix	trans	-81.3	-50.9	170.1	-173.4	175.5	-179.8	-70.5	0	110.3	S247 K248 E249 L253 R254 E255	S247-K251 PolarHBondContact O-N 2.86Å; K248-K251 WeakPolarHBondContact O-CB 3.48Å; K248-K251 PolarHBondContact O-N 3Å; E249-K251 VanDerWaalsContact C-N 3.27Å; E249-K251 PolarHBondContact O-N 3.48Å; K251-L253 VanDerWaalsContact C-N 3.31Å; K251-L253 PolarHBondContact O-N 3.24Å; K251-R254 PolarHBondContact O-N 3.34Å; K251-R254 VanDerWaalsContact O-N 3.15Å; K251-E255 IonicContact NZ-OE1 2.75Å; K251-E255 PolarHBondContact NZ-OE1 3.25Å; K251-E255 WeakPolarHBondContact O-CG 3.48Å; K251-E255 PolarHBondContact O-N 3.15Å
252	E	92.8	Very high	91.6	Very high	98 Å²	98	86 Å²	86	46%	0.458	42%	0.415	S	S	.	.	H	α-helix	trans	-60.1	-38.9	177.2	-71.1	171.5	159	0	0	112	K248 E249 E255 K256	K248-E252 VanDerWaalsContact CE-CD 3.47Å; K248-E252 WeakPolarHBondContact CE-OE1 3.47Å; K248-E252 HydrophobicContact CG-CG 4.43Å; K248-E252 IonicContact NZ-OE1 2.84Å; K248-E252 WeakPolarHBondContact O-CG 3.44Å; K248-E252 PolarHBondContact O-N 2.89Å; E249-E252 PolarHBondContact O-N 3.09Å; E252-E255 PolarHBondContact O-N 3.02Å; E252-K256 WeakPolarHBondContact O-CB 3.41Å; E252-K256 PolarHBondContact O-N 2.95Å
253	L	93.3	Very high	91.7	Very high	64 Å²	64	86.9 Å²	86.9	34%	0.335	41%	0.413	S	S	.	.	H	α-helix	trans	-65.4	-39.5	175.2	-176.2	62.7	0	0	0	112.5	E249 K251 Y257	E249-L253 WeakPolarHBondContact O-CB 3.49Å; E249-L253 PolarHBondContact O-N 3.19Å; K251-L253 VanDerWaalsContact C-N 3.31Å; K251-L253 PolarHBondContact O-N 3.24Å; L253-Y257 HydrophobicContact CD1-CD2 4.12Å; L253-Y257 HydrophobicContact CD1-CE2 3.48Å; L253-Y257 VanDerWaalsContact CD1-CE2 3.48Å; L253-Y257 HydrophobicContact CD2-CE2 4.11Å; L253-Y257 HydrophobicContact CG-CD2 3.99Å; L253-Y257 HydrophobicContact CG-CE2 3.56Å; L253-Y257 VanDerWaalsContact O-CD2 3.25Å; L253-Y257 WeakPolarHBondContact O-CD2 3.33Å; L253-Y257 PolarHBondContact O-N 3.34Å
254	R	92.7	Very high	91.7	Very high	82 Å²	82	87.2 Å²	87.2	31%	0.309	42%	0.418	S	S	.	.	H	α-helix	trans	-69.3	-44.8	174.3	-90.7	-173.6	-77.1	-172.3	-11	111.9	E243 M250 K251 K256 Y257 T258	E243-R254 IonicContact OE1-CZ 2.79Å; E243-R254 IonicContact OE1-NH1 2.82Å; E243-R254 PolarHBondContact OE1-NH1 3.1Å; M250-R254 PolarHBondContact O-NE 3.37Å; K251-R254 PolarHBondContact O-N 3.34Å; K251-R254 VanDerWaalsContact O-N 3.15Å; R254-K256 PolarHBondContact O-N 2.99Å; R254-Y257 PolarHBondContact O-N 3.02Å; R254-T258 WeakPolarHBondContact O-CB 3.31Å; R254-T258 PolarHBondContact O-N 3.29Å; R254-T258 PolarHBondContact O-OG1 3.22Å; R254-T258 VanDerWaalsContact O-OG1 3.06Å
255	E	94.2	Very high	91.5	Very high	100 Å²	100	90.2 Å²	90.2	47%	0.467	43%	0.432	S	S	.	.	H	α-helix	trans	-57.5	-40.9	174.9	-73.6	171.2	179.6	0	0	111.4	K251 E252 K259	K251-E255 IonicContact NZ-OE1 2.75Å; K251-E255 PolarHBondContact NZ-OE1 3.25Å; K251-E255 WeakPolarHBondContact O-CG 3.48Å; K251-E255 PolarHBondContact O-N 3.15Å; E252-E255 PolarHBondContact O-N 3.02Å; E255-K259 VanDerWaalsContact O-CB 3.29Å; E255-K259 WeakPolarHBondContact O-CB 3.34Å; E255-K259 PolarHBondContact O-N 3.39Å
256	K	95.7	Very high	91.1	Very high	109 Å²	109	97.3 Å²	97.3	47%	0.474	47%	0.465	S	S	.	.	H	α-helix	trans	-59.2	-55.6	171.8	-175	-169.6	165.4	-169.1	0	111.8	E252 R254 T258 K259 E260	E252-K256 WeakPolarHBondContact O-CB 3.41Å; E252-K256 PolarHBondContact O-N 2.95Å; R254-K256 PolarHBondContact O-N 2.99Å; K256-T258 PolarHBondContact O-N 2.89Å; K256-K259 WeakPolarHBondContact O-CB 3.43Å; K256-K259 PolarHBondContact O-N 2.83Å; K256-K259 VanDerWaalsContact O-N 3.16Å; K256-E260 WeakPolarHBondContact CE-OE1 3.32Å; K256-E260 VanDerWaalsContact CE-OE2 3.3Å; K256-E260 WeakPolarHBondContact CE-OE2 3.37Å; K256-E260 HydrophobicContact CG-CG 4.48Å; K256-E260 IonicContact NZ-OE1 3.86Å; K256-E260 PolarHBondContact NZ-OE1 3.46Å; K256-E260 IonicContact NZ-OE2 2.65Å; K256-E260 WeakPolarHBondContact O-CG 3.21Å; K256-E260 PolarHBondContact O-N 3.01Å
257	Y	95.2	Very high	90.3	Very high	129 Å²	129	102.7 Å²	102.7	51%	0.506	49%	0.488	S	S	.	.	H	α-helix	trans	-65.3	-36.5	-178.2	-70.2	-45	0	0	0	113.2	L253 R254 K259 E260 T261	L253-Y257 HydrophobicContact CD1-CD2 4.12Å; L253-Y257 HydrophobicContact CD1-CE2 3.48Å; L253-Y257 VanDerWaalsContact CD1-CE2 3.48Å; L253-Y257 HydrophobicContact CD2-CE2 4.11Å; L253-Y257 HydrophobicContact CG-CD2 3.99Å; L253-Y257 HydrophobicContact CG-CE2 3.56Å; L253-Y257 VanDerWaalsContact O-CD2 3.25Å; L253-Y257 WeakPolarHBondContact O-CD2 3.33Å; L253-Y257 PolarHBondContact O-N 3.34Å; R254-Y257 PolarHBondContact O-N 3.02Å; Y257-K259 VanDerWaalsContact C-N 3.33Å; Y257-E260 WeakPolarHBondContact CD1-OE2 3.41Å; Y257-E260 PolarHBondContact O-N 3.05Å; Y257-T261 WeakPolarHBondContact O-CB 3.35Å; Y257-T261 PolarHBondContact O-N 2.89Å; Y257-T261 PolarHBondContact O-OG1 2.9Å
258	T	94	Very high	89.1	Confident	82 Å²	82	105.6 Å²	105.6	50%	0.503	51%	0.514	S	S	.	.	H	α-helix	trans	-61.8	-42.9	172.5	-61.4	0	0	0	0	110.7	R254 K256 T261 I262	R254-T258 WeakPolarHBondContact O-CB 3.31Å; R254-T258 PolarHBondContact O-N 3.29Å; R254-T258 PolarHBondContact O-OG1 3.22Å; R254-T258 VanDerWaalsContact O-OG1 3.06Å; K256-T258 PolarHBondContact O-N 2.89Å; T258-T261 PolarHBondContact O-N 2.85Å; T258-I262 HydrophobicContact CG2-CD1 3.93Å; T258-I262 WeakPolarHBondContact O-CD1 3.43Å; T258-I262 VanDerWaalsContact O-CG1 3.25Å; T258-I262 WeakPolarHBondContact O-CG1 3.5Å; T258-I262 PolarHBondContact O-N 2.97Å
259	K	94.9	Very high	88.1	Confident	121 Å²	121	103.7 Å²	103.7	53%	0.526	52%	0.515	S	S	.	.	H	α-helix	trans	-62.8	-51.2	174.6	-177.8	-173.6	165.8	-172.8	0	111.9	E255 K256 Y257 T261 I262 E263	E255-K259 VanDerWaalsContact O-CB 3.29Å; E255-K259 WeakPolarHBondContact O-CB 3.34Å; E255-K259 PolarHBondContact O-N 3.39Å; K256-K259 WeakPolarHBondContact O-CB 3.43Å; K256-K259 PolarHBondContact O-N 2.83Å; K256-K259 VanDerWaalsContact O-N 3.16Å; Y257-K259 VanDerWaalsContact C-N 3.33Å; K259-T261 VanDerWaalsContact C-N 3.26Å; K259-T261 PolarHBondContact O-N 3.26Å; K259-I262 PolarHBondContact O-N 3.32Å; K259-I262 VanDerWaalsContact O-N 3.1Å; K259-E263 WeakPolarHBondContact CE-OE1 3.31Å; K259-E263 WeakPolarHBondContact CE-OE2 3.36Å; K259-E263 HydrophobicContact CG-CG 4.45Å; K259-E263 IonicContact NZ-OE1 2.96Å; K259-E263 PolarHBondContact NZ-OE1 3.45Å; K259-E263 WeakPolarHBondContact O-CG 3.43Å; K259-E263 PolarHBondContact O-N 3.19Å
260	E	93.2	Very high	87	Confident	83 Å²	83	100.2 Å²	100.2	39%	0.388	50%	0.504	S	S	.	.	H	α-helix	trans	-59	-38.7	178.8	-72.9	175.7	151	0	0	111.3	K256 Y257 E263 D264	K256-E260 WeakPolarHBondContact CE-OE1 3.32Å; K256-E260 VanDerWaalsContact CE-OE2 3.3Å; K256-E260 WeakPolarHBondContact CE-OE2 3.37Å; K256-E260 HydrophobicContact CG-CG 4.48Å; K256-E260 IonicContact NZ-OE1 3.86Å; K256-E260 PolarHBondContact NZ-OE1 3.46Å; K256-E260 IonicContact NZ-OE2 2.65Å; K256-E260 WeakPolarHBondContact O-CG 3.21Å; K256-E260 PolarHBondContact O-N 3.01Å; Y257-E260 WeakPolarHBondContact CD1-OE2 3.41Å; Y257-E260 PolarHBondContact O-N 3.05Å; E260-E263 PolarHBondContact O-N 3.27Å; E260-D264 WeakPolarHBondContact O-CB 3.16Å; E260-D264 PolarHBondContact O-N 2.88Å
261	T	93.5	Very high	86.1	Confident	74 Å²	74	99.4 Å²	99.4	45%	0.454	52%	0.519	S	S	.	.	H	α-helix	trans	-63.1	-44.3	174.5	-55.5	0	0	0	0	111.7	Y257 T258 K259 H265	Y257-T261 WeakPolarHBondContact O-CB 3.35Å; Y257-T261 PolarHBondContact O-N 2.89Å; Y257-T261 PolarHBondContact O-OG1 2.9Å; T258-T261 PolarHBondContact O-N 2.85Å; K259-T261 VanDerWaalsContact C-N 3.26Å; K259-T261 PolarHBondContact O-N 3.26Å; T261-H265 WeakPolarHBondContact O-CB 3.36Å; T261-H265 PolarHBondContact O-N 3.16Å; T261-H265 PolarHBondContact O-ND1 3.01Å
262	I	91.5	Very high	85.6	Confident	88 Å²	88	97.5 Å²	97.5	45%	0.451	52%	0.523	S	S	.	.	H	α-helix	trans	-65.7	-41.2	178	-70.5	164.8	0	0	0	110.9	T258 K259 Q266	T258-I262 HydrophobicContact CG2-CD1 3.93Å; T258-I262 WeakPolarHBondContact O-CD1 3.43Å; T258-I262 VanDerWaalsContact O-CG1 3.25Å; T258-I262 WeakPolarHBondContact O-CG1 3.5Å; T258-I262 PolarHBondContact O-N 2.97Å; K259-I262 PolarHBondContact O-N 3.32Å; K259-I262 VanDerWaalsContact O-N 3.1Å; I262-Q266 VanDerWaalsContact CG2-NE2 3.33Å; I262-Q266 WeakPolarHBondContact O-CB 3.42Å; I262-Q266 VanDerWaalsContact O-CG 3.26Å; I262-Q266 WeakPolarHBondContact O-CG 3.37Å; I262-Q266 PolarHBondContact O-N 3.42Å
263	E	90	Very high	85.2	Confident	78 Å²	78	96.2 Å²	96.2	36%	0.364	52%	0.522	S	S	.	.	H	α-helix	trans	-65	-47	177.5	-72.4	177.6	153.8	0	0	111	K259 E260 H265 Q266 M267	K259-E263 WeakPolarHBondContact CE-OE1 3.31Å; K259-E263 WeakPolarHBondContact CE-OE2 3.36Å; K259-E263 HydrophobicContact CG-CG 4.45Å; K259-E263 IonicContact NZ-OE1 2.96Å; K259-E263 PolarHBondContact NZ-OE1 3.45Å; K259-E263 WeakPolarHBondContact O-CG 3.43Å; K259-E263 PolarHBondContact O-N 3.19Å; E260-E263 PolarHBondContact O-N 3.27Å; E263-H265 PolarHBondContact O-N 3.29Å; E263-Q266 PolarHBondContact O-N 3.43Å; E263-Q266 VanDerWaalsContact O-N 3.12Å; E263-M267 HydrophobicContact CB-CE 4.37Å; E263-M267 WeakPolarHBondContact O-CG 3.41Å; E263-M267 PolarHBondContact O-N 2.87Å
264	D	88.1	Confident	85	Confident	118 Å²	118	97.9 Å²	97.9	63%	0.631	53%	0.528	S	S	*	.	H	α-helix	trans	-59.1	-45.8	176.5	-173.6	60.9	0	0	0	112.4	E260 Q266 M267	E260-D264 WeakPolarHBondContact O-CB 3.16Å; E260-D264 PolarHBondContact O-N 2.88Å; D264-Q266 VanDerWaalsContact C-N 3.26Å; D264-Q266 PolarHBondContact O-N 3.46Å; D264-M267 PolarHBondContact O-N 2.86Å; D264-M267 VanDerWaalsContact O-N 3.13Å
265	H	85.6	Confident	84.8	Confident	142 Å²	142	95.1 Å²	95.1	66%	0.657	52%	0.52	S	S	*	.	H	α-helix	trans	-67.5	-23.8	176.6	-74.3	65.7	0	0	0	113.3	T261 E263	T261-H265 WeakPolarHBondContact O-CB 3.36Å; T261-H265 PolarHBondContact O-N 3.16Å; T261-H265 PolarHBondContact O-ND1 3.01Å; E263-H265 PolarHBondContact O-N 3.29Å
266	Q	82.1	Confident	84.5	Confident	150 Å²	150	95.5 Å²	95.5	70%	0.701	53%	0.525	S	S	*	.	H	α-helix	trans	-82.2	-23.9	173	-75.1	178	21.4	0	0	113	I262 E263 D264 A268	I262-Q266 VanDerWaalsContact CG2-NE2 3.33Å; I262-Q266 WeakPolarHBondContact O-CB 3.42Å; I262-Q266 VanDerWaalsContact O-CG 3.26Å; I262-Q266 WeakPolarHBondContact O-CG 3.37Å; I262-Q266 PolarHBondContact O-N 3.42Å; E263-Q266 PolarHBondContact O-N 3.43Å; E263-Q266 VanDerWaalsContact O-N 3.12Å; D264-Q266 VanDerWaalsContact C-N 3.26Å; D264-Q266 PolarHBondContact O-N 3.46Å; Q266-A268 PolarHBondContact O-N 2.91Å
267	M	70.8	Confident	84.2	Confident	134 Å²	134	97.8 Å²	97.8	66%	0.66	54%	0.542	S	S	*	.			trans	-77.6	27.9	179.3	-71.5	-166.2	-150	0	0	114.1	E263 D264 V269	E263-M267 HydrophobicContact CB-CE 4.37Å; E263-M267 WeakPolarHBondContact O-CG 3.41Å; E263-M267 PolarHBondContact O-N 2.87Å; D264-M267 PolarHBondContact O-N 2.86Å; D264-M267 VanDerWaalsContact O-N 3.13Å; M267-V269 VanDerWaalsContact O-CG2 3.25Å; M267-V269 WeakPolarHBondContact O-CG2 3.17Å; M267-V269 PolarHBondContact O-N 2.87Å
268	A	65.1	Low	83.7	Confident	87 Å²	87	93.4 Å²	93.4	72%	0.719	53%	0.527	S	S	*	.			trans	-56.2	89.3	-176.4	0	0	0	0	0	113.3	Q266 T270	Q266-A268 PolarHBondContact O-N 2.91Å; A268-T270 PolarHBondContact O-N 2.94Å
269	V	67.6	Low	83.5	Confident	116 Å²	116	98 Å²	98	70%	0.703	54%	0.535	S	S	*	.			trans	-67.8	129.8	-176	-173.6	0	0	0	0	109.7	M267 G271	M267-V269 VanDerWaalsContact O-CG2 3.25Å; M267-V269 WeakPolarHBondContact O-CG2 3.17Å; M267-V269 PolarHBondContact O-N 2.87Å; V269-G271 PolarHBondContact O-N 2.83Å
270	T	65.7	Low	83.3	Confident	75 Å²	75	92.3 Å²	92.3	46%	0.46	51%	0.51	S	S	.	.			trans	-59.8	107.3	174.6	51.8	0	0	0	0	110.2	A268 G272	A268-T270 PolarHBondContact O-N 2.94Å; T270-G272 PolarHBondContact O-N 3.05Å
271	G	71.9	Confident	83.1	Confident	75 Å²	75	90.9 Å²	90.9	77%	0.773	52%	0.518	S	S	*	.	S	Bend	trans	-56.2	124.2	-172	0	0	0	0	0	113.7	V269	V269-G271 PolarHBondContact O-N 2.83Å
272	G	79.3	Confident	82.9	Confident	42 Å²	42	94.5 Å²	94.5	43%	0.433	53%	0.528	S	S	.	.	S	Bend	trans	166.9	165.5	-179.7	0	0	0	0	0	110.3	T270	T270-G272 PolarHBondContact O-N 3.05Å
273	T	85	Confident	82.9	Confident	72 Å²	72	92.3 Å²	92.3	44%	0.442	52%	0.52	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.3	114	176.8	34.2	0	0	0	0	109.9	T289 Y290	T273-T289 WeakPolarHBondContact O-CA 3.3Å; T273-Y290 PolarHBondContact N-O 3.11Å; T273-Y290 WeakPolarHBondContact O-CD1 3.31Å; T273-Y290 PolarHBondContact O-N 3.39Å; T273-Y290 VanDerWaalsContact OG1-CD1 3.28Å; T273-Y290 WeakPolarHBondContact OG1-CD1 3.32Å; T273-Y290 WeakPolarHBondContact OG1-CE1 3.39Å; T273-Y290 PolarHBondContact OG1-O 3.34Å; T273-Y290 VanDerWaalsContact OG1-O 3.11Å
274	E	87.8	Confident	82.9	Confident	98 Å²	98	96.1 Å²	96.1	46%	0.458	54%	0.535	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-64.4	138	173.7	-66.6	-157	146.8	0	0	111	K287 T289 N309	E274-K287 VanDerWaalsContact CD-NZ 3.29Å; E274-K287 WeakPolarHBondContact OE1-CE 3.23Å; E274-K287 IonicContact OE1-NZ 2.6Å; E274-K287 PolarHBondContact OE1-NZ 3.44Å; E274-K287 WeakPolarHBondContact OE2-CE 3.24Å; E274-K287 IonicContact OE2-NZ 3.64Å; E274-K287 PolarHBondContact OE2-NZ 3.26Å; E274-T289 HydrophobicContact CG-CG2 3.79Å; E274-N309 PolarHBondContact OE1-ND2 2.92Å
275	T	88.4	Confident	83	Confident	24 Å²	24	94.8 Å²	94.8	15%	0.147	53%	0.525	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-147.5	142.6	177.9	49.3	0	0	0	0	111.7	L277 T286 C288 Y290	T275-L277 HydrophobicContact CG2-CD1 4.38Å; T275-T286 VanDerWaalsContact O-O 3.05Å; T275-C288 PolarHBondContact N-O 2.89Å; T275-C288 PolarHBondContact O-N 2.91Å; T275-C288 VanDerWaalsContact O-N 3.17Å; T275-C288 VanDerWaalsContact O-O 3.05Å; T275-C288 PolarHBondContact OG1-O 2.64Å; T275-C288 VanDerWaalsContact OG1-O 3.05Å; T275-Y290 HydrophobicContact CG2-CD1 3.54Å; T275-Y290 HydrophobicContact CG2-CE1 3.44Å; T275-Y290 VanDerWaalsContact CG2-CE1 3.44Å
276	D	89.6	Confident	83.3	Confident	109 Å²	109	90.5 Å²	90.5	58%	0.583	51%	0.509	S	S	*	.	S	Bend	trans	-93.9	-1.3	167.9	-77.1	-64.7	0	0	0	113.6	L278 T286	D276-L278 PolarHBondContact O-N 2.95Å; D276-T286 WeakPolarHBondContact O-CB 3.43Å; D276-T286 WeakPolarHBondContact O-CG2 3.27Å; D276-T286 WeakPolarHBondContact OD1-CB 3.39Å; D276-T286 PolarHBondContact OD1-OG1 3.48Å
277	L	87.8	Confident	83.7	Confident	157 Å²	157	87.2 Å²	87.2	82%	0.822	49%	0.493	S	S	*	.	S	Bend	trans	-65	-17.6	179.2	-66.6	168	0	0	0	113.5	T275	T275-L277 HydrophobicContact CG2-CD1 4.38Å
278	L	86.2	Confident	84.6	Confident	36 Å²	36	80.9 Å²	80.9	19%	0.188	46%	0.461	C	S	.	.	S	Bend	trans	-119.9	104.9	-167	-61.3	174.8	0	0	0	110.6	D276 C288 V306 L317	D276-L278 PolarHBondContact O-N 2.95Å; L278-C288 HydrophobicContact CB-CB 4.31Å; L278-C288 PolarHBondContact O-SG 3.46Å; L278-V306 HydrophobicContact CB-CG1 4.33Å; L278-V306 HydrophobicContact CD1-CB 4.41Å; L278-V306 HydrophobicContact CD1-CG1 3.68Å; L278-V306 HydrophobicContact CD1-CG2 3.77Å; L278-L317 HydrophobicContact CD2-CD1 4.07Å
279	R	89.2	Confident	85.8	Confident	179 Å²	179	77.1 Å²	77.1	68%	0.675	43%	0.429	S	S	*	.			trans	-79.1	124.9	177.3	-173.3	172.7	-69.5	-175.3	-2.1	111.2	G281 K284	R279-G281 PolarHBondContact O-N 3.13Å; R279-K284 WeakPolarHBondContact CD-O 3.41Å; R279-K284 VanDerWaalsContact CG-O 3.31Å; R279-K284 WeakPolarHBondContact CG-O 3.18Å
280	C	90.6	Very high	86.9	Confident	1 Å²	1	74.7 Å²	74.7	1%	0.007	41%	0.408	C	S	.	.			trans	-69.3	127.7	177	178.4	0	0	0	0	112.3	K282 K284 Q285 C308 C311 W315	C280-K282 PolarHBondContact O-N 3.4Å; C280-K282 PolarHBondContact SG-N 2.92Å; C280-K284 WeakPolarHBondContact O-CA 3.49Å; C280-K284 PolarHBondContact O-N 2.88Å; C280-Q285 PolarHBondContact N-O 2.92Å; C280-C308 HydrophobicContact CB-CB 3.76Å; C280-C308 VanDerWaalsContact CB-SG 3.53Å; C280-C311 PolarHBondContact SG-SG 2.85Å; C280-W315 HydrophobicContact CB-CH2 3.81Å; C280-W315 HydrophobicContact CB-CZ3 4.15Å
281	G	88.9	Confident	88	Confident	54 Å²	54	73.8 Å²	73.8	56%	0.557	40%	0.4	S	S	*	.	T	Hydrogen-bonded Turn	trans	-63.6	-22.7	179.4	0	0	0	0	0	115.1	R279	R279-G281 PolarHBondContact O-N 3.13Å
282	K	89.4	Confident	88.8	Confident	150 Å²	150	75.1 Å²	75.1	65%	0.652	39%	0.387	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-63.7	178.6	-67.4	-164.7	-179.2	-171.9	0	112.8	C280 H313	C280-K282 PolarHBondContact O-N 3.4Å; C280-K282 PolarHBondContact SG-N 2.92Å; K282-H313 HydrophobicContact CD-CB 4.13Å; K282-H313 HydrophobicContact CG-CB 4.42Å
283	C	92.3	Very high	89.1	Confident	42 Å²	42	76 Å²	76	28%	0.284	38%	0.383	S	S	.	.	T	Hydrogen-bonded Turn	trans	-90.5	-4.8	-175.3	65.3	0	0	0	0	114.7	Q285 C308 C311	C283-Q285 PolarHBondContact O-N 2.62Å; C283-Q285 PolarHBondContact SG-OE1 3.17Å; C283-C308 VanDerWaalsContact SG-SG 3.61Å; C283-C311 HydrophobicContact CB-CB 4.19Å; C283-C311 VanDerWaalsContact SG-SG 3.62Å
284	K	89.6	Confident	89.3	Confident	157 Å²	157	77 Å²	77	68%	0.683	38%	0.383	S	S	*	.			trans	61.1	6.4	-178.8	-55.4	178.4	-177.1	176.4	0	115.8	R279 C280	R279-K284 WeakPolarHBondContact CD-O 3.41Å; R279-K284 VanDerWaalsContact CG-O 3.31Å; R279-K284 WeakPolarHBondContact CG-O 3.18Å; C280-K284 WeakPolarHBondContact O-CA 3.49Å; C280-K284 PolarHBondContact O-N 2.88Å
285	Q	90.3	Very high	89	Confident	91 Å²	91	75.8 Å²	75.8	43%	0.425	38%	0.382	S	S	.	.			trans	-82.3	160.4	174.2	-64.7	159.7	-23.2	0	0	111	C280 C283 N310	C280-Q285 PolarHBondContact N-O 2.92Å; C283-Q285 PolarHBondContact O-N 2.62Å; C283-Q285 PolarHBondContact SG-OE1 3.17Å; Q285-N310 PolarHBondContact OE1-ND2 3.06Å
286	T	91.3	Very high	88.7	Confident	52 Å²	52	81.6 Å²	81.6	32%	0.319	40%	0.401	S	S	.	.			trans	-92.7	-26.1	-175.1	48.3	0	0	0	0	114.4	T275 D276 C288	T275-T286 VanDerWaalsContact O-O 3.05Å; D276-T286 WeakPolarHBondContact O-CB 3.43Å; D276-T286 WeakPolarHBondContact O-CG2 3.27Å; D276-T286 WeakPolarHBondContact OD1-CB 3.39Å; D276-T286 PolarHBondContact OD1-OG1 3.48Å; T286-C288 PolarHBondContact O-N 2.64Å; T286-C288 PolarHBondContact O-SG 2.98Å; T286-C288 VanDerWaalsContact O-SG 3.4Å
287	K	90.7	Very high	88.5	Confident	81 Å²	81	79.7 Å²	79.7	35%	0.352	40%	0.396	S	S	.	.			trans	-65	100.6	-172.5	-164.6	176.3	-170.3	-172.1	0	112.5	E274 N309	E274-K287 VanDerWaalsContact CD-NZ 3.29Å; E274-K287 WeakPolarHBondContact OE1-CE 3.23Å; E274-K287 IonicContact OE1-NZ 2.6Å; E274-K287 PolarHBondContact OE1-NZ 3.44Å; E274-K287 WeakPolarHBondContact OE2-CE 3.24Å; E274-K287 IonicContact OE2-NZ 3.64Å; E274-K287 PolarHBondContact OE2-NZ 3.26Å; K287-N309 HydrophobicContact CD-CB 4.44Å; K287-N309 HydrophobicContact CG-CB 4.33Å; K287-N309 PolarHBondContact O-N 3.36Å
288	C	89.3	Confident	88.1	Confident	0 Å²	0	77 Å²	77	0%	0	40%	0.397	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-138.2	133.2	-179.8	-56.3	0	0	0	0	111.7	T275 L278 T286 V306 Y307	T275-C288 PolarHBondContact N-O 2.89Å; T275-C288 PolarHBondContact O-N 2.91Å; T275-C288 VanDerWaalsContact O-N 3.17Å; T275-C288 VanDerWaalsContact O-O 3.05Å; T275-C288 PolarHBondContact OG1-O 2.64Å; T275-C288 VanDerWaalsContact OG1-O 3.05Å; L278-C288 HydrophobicContact CB-CB 4.31Å; L278-C288 PolarHBondContact O-SG 3.46Å; T286-C288 PolarHBondContact O-N 2.64Å; T286-C288 PolarHBondContact O-SG 2.98Å; T286-C288 VanDerWaalsContact O-SG 3.4Å; C288-V306 HydrophobicContact CB-CG1 3.87Å; C288-Y307 CarbonylContact C-O 3.39Å; C288-Y307 WeakPolarHBondContact CA-O 3.45Å; C288-Y307 WeakPolarHBondContact CB-O 3.01Å
289	T	90.5	Very high	88.1	Confident	9 Å²	9	82.5 Å²	82.5	6%	0.055	43%	0.427	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-76.9	145.2	160.9	44.6	0	0	0	0	110.8	T273 E274 V306 Y307 N309	T273-T289 WeakPolarHBondContact O-CA 3.3Å; E274-T289 HydrophobicContact CG-CG2 3.79Å; T289-V306 WeakPolarHBondContact O-CA 3.23Å; T289-Y307 PolarHBondContact N-O 2.86Å; T289-Y307 PolarHBondContact O-N 3.07Å; T289-N309 PolarHBondContact N-OD1 2.94Å; T289-N309 VanDerWaalsContact N-OD1 3.1Å; T289-N309 PolarHBondContact OG1-OD1 3.46Å
290	Y	90.2	Very high	87.6	Confident	65 Å²	65	77.6 Å²	77.6	26%	0.255	41%	0.412	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-120.9	155.8	164.3	81.7	-88.7	0	0	0	111.4	T273 T275 Q292 T304 F305	T273-Y290 PolarHBondContact N-O 3.11Å; T273-Y290 WeakPolarHBondContact O-CD1 3.31Å; T273-Y290 PolarHBondContact O-N 3.39Å; T273-Y290 VanDerWaalsContact OG1-CD1 3.28Å; T273-Y290 WeakPolarHBondContact OG1-CD1 3.32Å; T273-Y290 WeakPolarHBondContact OG1-CE1 3.39Å; T273-Y290 PolarHBondContact OG1-O 3.34Å; T273-Y290 VanDerWaalsContact OG1-O 3.11Å; T275-Y290 HydrophobicContact CG2-CD1 3.54Å; T275-Y290 HydrophobicContact CG2-CE1 3.44Å; T275-Y290 VanDerWaalsContact CG2-CE1 3.44Å; Y290-Q292 HydrophobicContact CD2-CG 4.29Å; Y290-Q292 HydrophobicContact CE2-CG 4.2Å; Y290-T304 HydrophobicContact CD2-CG2 3.85Å; Y290-T304 HydrophobicContact CG-CG2 4.25Å; Y290-F305 CarbonylContact C-O 3.16Å; Y290-F305 VanDerWaalsContact CA-O 3.23Å; Y290-F305 WeakPolarHBondContact CA-O 3.42Å; Y290-F305 WeakPolarHBondContact CB-O 3.31Å
291	N	89.5	Confident	87.2	Confident	55 Å²	55	81.3 Å²	81.3	29%	0.294	44%	0.435	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-145.8	130.4	171	75.3	-76.7	0	0	0	110.2	V293 F305	N291-V293 VanDerWaalsContact ND2-CG2 3.35Å; N291-V293 WeakPolarHBondContact ND2-CG2 3.48Å; N291-F305 PolarHBondContact N-O 3.08Å; N291-F305 PolarHBondContact O-N 3.23Å; N291-F305 VanDerWaalsContact OD1-CB 3.31Å; N291-F305 WeakPolarHBondContact OD1-CB 3.5Å
292	Q	88.4	Confident	87.1	Confident	104 Å²	104	83.7 Å²	83.7	49%	0.486	43%	0.433	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-93.1	131.5	-179.6	-76.2	164.9	-17.1	0	0	110.4	Y290 M302 T304	Y290-Q292 HydrophobicContact CD2-CG 4.29Å; Y290-Q292 HydrophobicContact CE2-CG 4.2Å; Q292-M302 HydrophobicContact CB-SD 3.86Å; Q292-M302 VanDerWaalsContact CD-SD 3.55Å; Q292-M302 HydrophobicContact CG-SD 3.94Å; Q292-M302 PolarHBondContact OE1-SD 3.44Å; Q292-T304 HydrophobicContact CG-CG2 4.41Å; Q292-T304 WeakPolarHBondContact CG-OG1 3.42Å
293	V	86.9	Confident	87	Confident	59 Å²	59	77 Å²	77	36%	0.358	41%	0.405	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.7	134.5	-179.6	-172.6	0	0	0	0	110.1	N291 T295 T303 F305	N291-V293 VanDerWaalsContact ND2-CG2 3.35Å; N291-V293 WeakPolarHBondContact ND2-CG2 3.48Å; V293-T295 HydrophobicContact CB-CG2 4.11Å; V293-T295 HydrophobicContact CG1-CG2 3.8Å; V293-T295 PolarHBondContact O-N 3.23Å; V293-T295 VanDerWaalsContact O-N 3.14Å; V293-T303 PolarHBondContact N-O 3.28Å; V293-T303 PolarHBondContact O-N 3.17Å; V293-F305 HydrophobicContact CB-CD2 4.26Å; V293-F305 HydrophobicContact CB-CE2 4.14Å; V293-F305 HydrophobicContact CG2-CD2 4.18Å; V293-F305 HydrophobicContact CG2-CE2 4.45Å
294	Q	87.5	Confident	86.8	Confident	94 Å²	94	75.7 Å²	75.7	44%	0.439	40%	0.396	S	S	.	.			trans	-76.9	96	170.3	-168.3	62.5	23	0	0	109.5	R296 S297 E300 M302	Q294-R296 PolarHBondContact NE2-O 3.19Å; Q294-R296 VanDerWaalsContact NE2-O 3.13Å; Q294-S297 PolarHBondContact NE2-O 3.24Å; Q294-E300 PolarHBondContact NE2-O 3.48Å; Q294-M302 VanDerWaalsContact OE1-CA 3.29Å
295	T	81.9	Confident	86.7	Confident	72 Å²	72	69.5 Å²	69.5	44%	0.442	37%	0.369	S	S	.	.			trans	-101	8.4	-177.7	50	0	0	0	0	114.5	V293 T303 F305	V293-T295 HydrophobicContact CB-CG2 4.11Å; V293-T295 HydrophobicContact CG1-CG2 3.8Å; V293-T295 PolarHBondContact O-N 3.23Å; V293-T295 VanDerWaalsContact O-N 3.14Å; T295-T303 PolarHBondContact OG1-OG1 3.32Å; T295-F305 HydrophobicContact CG2-CE2 3.72Å; T295-F305 HydrophobicContact CG2-CZ 3.96Å
296	R	83.3	Confident	86.7	Confident	147 Å²	147	65.2 Å²	65.2	56%	0.555	35%	0.349	S	S	*	.	S	Bend	trans	-147.6	178.9	-174.7	-70.4	-172	160.8	-163	-12.3	110.8	Q294 E300	Q294-R296 PolarHBondContact NE2-O 3.19Å; Q294-R296 VanDerWaalsContact NE2-O 3.13Å; R296-E300 HydrophobicContact CB-CB 4.07Å; R296-E300 VanDerWaalsContact CD-OE1 3.3Å; R296-E300 WeakPolarHBondContact CD-OE1 3.33Å; R296-E300 WeakPolarHBondContact CD-OE2 3.18Å; R296-E300 IonicContact CZ-OE1 3.88Å; R296-E300 IonicContact CZ-OE2 3.64Å; R296-E300 IonicContact NE-OE1 3.26Å; R296-E300 IonicContact NE-OE2 3.87Å; R296-E300 IonicContact NH1-OE1 3.9Å; R296-E300 PolarHBondContact NH1-OE1 2.84Å; R296-E300 IonicContact NH1-OE2 2.91Å; R296-E300 PolarHBondContact NH1-OE2 3.36Å
297	S	84.9	Confident	86.6	Confident	68 Å²	68	66.2 Å²	66.2	48%	0.476	35%	0.347	S	S	.	.			trans	-53.2	160.8	178.2	47.1	0	0	0	0	113	Q294 D299 E300	Q294-S297 PolarHBondContact NE2-O 3.24Å; S297-D299 PolarHBondContact O-N 2.91Å; S297-D299 VanDerWaalsContact O-N 3.13Å; S297-E300 PolarHBondContact O-N 3.36Å; S297-E300 VanDerWaalsContact O-N 3.1Å
298	A	79.6	Confident	86.6	Confident	102 Å²	102	62.3 Å²	62.3	84%	0.843	33%	0.33	S	S	*	.	T	Hydrogen-bonded Turn	trans	-60.8	-22.6	-175.9	0	0	0	0	0	113.9	E300	A298-E300 VanDerWaalsContact C-N 3.35Å
299	D	85.1	Confident	86.5	Confident	151 Å²	151	64.3 Å²	64.3	81%	0.807	34%	0.341	S	S	*	.	T	Hydrogen-bonded Turn	trans	-78.7	-15.4	179.7	-37.8	-85.2	0	0	0	113.4	S297	S297-D299 PolarHBondContact O-N 2.91Å; S297-D299 VanDerWaalsContact O-N 3.13Å
300	E	79.3	Confident	86.4	Confident	76 Å²	76	68 Å²	68	36%	0.355	36%	0.36	S	S	.	.	S	Bend	trans	-97.7	138.7	174.9	-75.7	-161.6	-132.2	0	0	111.6	Q294 R296 S297 A298	Q294-E300 PolarHBondContact NE2-O 3.48Å; R296-E300 HydrophobicContact CB-CB 4.07Å; R296-E300 VanDerWaalsContact CD-OE1 3.3Å; R296-E300 WeakPolarHBondContact CD-OE1 3.33Å; R296-E300 WeakPolarHBondContact CD-OE2 3.18Å; R296-E300 IonicContact CZ-OE1 3.88Å; R296-E300 IonicContact CZ-OE2 3.64Å; R296-E300 IonicContact NE-OE1 3.26Å; R296-E300 IonicContact NE-OE2 3.87Å; R296-E300 IonicContact NH1-OE1 3.9Å; R296-E300 PolarHBondContact NH1-OE1 2.84Å; R296-E300 IonicContact NH1-OE2 2.91Å; R296-E300 PolarHBondContact NH1-OE2 3.36Å; S297-E300 PolarHBondContact O-N 3.36Å; S297-E300 VanDerWaalsContact O-N 3.1Å; A298-E300 VanDerWaalsContact C-N 3.35Å
301	P	82.8	Confident	86.3	Confident	78 Å²	78	67.5 Å²	67.5	51%	0.506	37%	0.366	S	S	.	.	P	Polyproline II helix	trans	-67.4	153.5	179.4	29.1	-35.4	0	0	0	112.3	T303 H319	P301-T303 PolarHBondContact O-N 3.3Å; P301-H319 HydrophobicContact CG-CB 4.43Å
302	M	85.2	Confident	86.2	Confident	104 Å²	104	66.8 Å²	66.8	51%	0.512	37%	0.372	S	S	.	.	P	Polyproline II helix	trans	-49.9	135	176.4	60.1	176.2	67.7	0	0	112.3	Q292 Q294	Q292-M302 HydrophobicContact CB-SD 3.86Å; Q292-M302 VanDerWaalsContact CD-SD 3.55Å; Q292-M302 HydrophobicContact CG-SD 3.94Å; Q292-M302 PolarHBondContact OE1-SD 3.44Å; Q294-M302 VanDerWaalsContact OE1-CA 3.29Å
303	T	87.9	Confident	86.2	Confident	11 Å²	11	63 Å²	63	7%	0.067	35%	0.354	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.5	117.9	-179.8	-67.5	0	0	0	0	109.8	V293 T295 P301 F305 K316	V293-T303 PolarHBondContact N-O 3.28Å; V293-T303 PolarHBondContact O-N 3.17Å; T295-T303 PolarHBondContact OG1-OG1 3.32Å; P301-T303 PolarHBondContact O-N 3.3Å; T303-F305 HydrophobicContact CG2-CD2 4.15Å; T303-F305 HydrophobicContact CG2-CE2 3.75Å; T303-F305 HydrophobicContact CG2-CZ 4.11Å; T303-F305 PolarHBondContact O-N 3.32Å; T303-K316 HydrophobicContact CG2-CB 3.91Å; T303-K316 HydrophobicContact CG2-CD 3.98Å; T303-K316 HydrophobicContact CG2-CG 4.48Å
304	T	87.7	Confident	86.3	Confident	13 Å²	13	65.5 Å²	65.5	8%	0.08	36%	0.357	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-78.6	109.6	171.9	-56.9	0	0	0	0	109.5	Y290 Q292 V306 K316 L317	Y290-T304 HydrophobicContact CD2-CG2 3.85Å; Y290-T304 HydrophobicContact CG-CG2 4.25Å; Q292-T304 HydrophobicContact CG-CG2 4.41Å; Q292-T304 WeakPolarHBondContact CG-OG1 3.42Å; T304-V306 HydrophobicContact CG2-CG2 4.09Å; T304-K316 CarbonylContact O-C 3.56Å; T304-K316 VanDerWaalsContact O-CA 3.31Å; T304-K316 WeakPolarHBondContact O-CA 3.43Å; T304-L317 HydrophobicContact CG2-CD1 4.27Å; T304-L317 PolarHBondContact O-N 3.25Å
305	F	88.5	Confident	86.4	Confident	28 Å²	28	61.2 Å²	61.2	12%	0.123	34%	0.337	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-81.4	146.1	164.6	-70.1	-93.1	0	0	0	109.5	Y290 N291 V293 T295 T303 K316 V329	Y290-F305 CarbonylContact C-O 3.16Å; Y290-F305 VanDerWaalsContact CA-O 3.23Å; Y290-F305 WeakPolarHBondContact CA-O 3.42Å; Y290-F305 WeakPolarHBondContact CB-O 3.31Å; N291-F305 PolarHBondContact N-O 3.08Å; N291-F305 PolarHBondContact O-N 3.23Å; N291-F305 VanDerWaalsContact OD1-CB 3.31Å; N291-F305 WeakPolarHBondContact OD1-CB 3.5Å; V293-F305 HydrophobicContact CB-CD2 4.26Å; V293-F305 HydrophobicContact CB-CE2 4.14Å; V293-F305 HydrophobicContact CG2-CD2 4.18Å; V293-F305 HydrophobicContact CG2-CE2 4.45Å; T295-F305 HydrophobicContact CG2-CE2 3.72Å; T295-F305 HydrophobicContact CG2-CZ 3.96Å; T303-F305 HydrophobicContact CG2-CD2 4.15Å; T303-F305 HydrophobicContact CG2-CE2 3.75Å; T303-F305 HydrophobicContact CG2-CZ 4.11Å; T303-F305 PolarHBondContact O-N 3.32Å; F305-K316 HydrophobicContact CD1-CB 4.22Å; F305-K316 HydrophobicContact CE1-CB 4.37Å; F305-V329 HydrophobicContact CD1-CG2 3.96Å; F305-V329 HydrophobicContact CE1-CG1 4.33Å; F305-V329 HydrophobicContact CE1-CG2 3.91Å
306	V	89.6	Confident	86.7	Confident	0 Å²	0	60.4 Å²	60.4	0%	0	33%	0.327	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-136	136.8	-177.8	-170.5	0	0	0	0	109	L278 C288 T289 T304 R314 W315 L317	L278-V306 HydrophobicContact CB-CG1 4.33Å; L278-V306 HydrophobicContact CD1-CB 4.41Å; L278-V306 HydrophobicContact CD1-CG1 3.68Å; L278-V306 HydrophobicContact CD1-CG2 3.77Å; C288-V306 HydrophobicContact CB-CG1 3.87Å; T289-V306 WeakPolarHBondContact O-CA 3.23Å; T304-V306 HydrophobicContact CG2-CG2 4.09Å; V306-R314 CarbonylContact O-C 3.57Å; V306-R314 VanDerWaalsContact O-CA 3.28Å; V306-R314 WeakPolarHBondContact O-CA 3.37Å; V306-R314 WeakPolarHBondContact O-CG 3.48Å; V306-W315 HydrophobicContact CB-CD2 4Å; V306-W315 HydrophobicContact CB-CG 4.28Å; V306-W315 HydrophobicContact CB-CZ2 4.02Å; V306-W315 HydrophobicContact CG1-CD2 4.25Å; V306-W315 HydrophobicContact CG1-CH2 3.85Å; V306-W315 HydrophobicContact CG1-CZ2 3.39Å; V306-W315 HydrophobicContact CG1-CZ3 4.46Å; V306-W315 PolarHBondContact N-O 3.02Å; V306-W315 PolarHBondContact O-N 2.65Å; V306-W315 VanDerWaalsContact O-O 3.13Å; V306-L317 HydrophobicContact CG2-CD1 4.19Å; V306-L317 HydrophobicContact CG2-CG 4.14Å
307	Y	89.5	Confident	86.6	Confident	73 Å²	73	54.8 Å²	54.8	29%	0.286	31%	0.308	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.1	129.5	177.9	172.5	-97.9	0	0	0	109.4	C288 T289 N309 G312 R314	C288-Y307 CarbonylContact C-O 3.39Å; C288-Y307 WeakPolarHBondContact CA-O 3.45Å; C288-Y307 WeakPolarHBondContact CB-O 3.01Å; T289-Y307 PolarHBondContact N-O 2.86Å; T289-Y307 PolarHBondContact O-N 3.07Å; Y307-N309 PolarHBondContact O-OD1 2.86Å; Y307-G312 WeakPolarHBondContact CE2-O 3.28Å; Y307-R314 HydrophobicContact CD2-CB 4.43Å
308	C	90.3	Very high	85.9	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	30%	0.296	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-89.7	113.8	176	179.4	0	0	0	0	111.2	C280 C283 N310 C311 G312 H313 W315	C280-C308 HydrophobicContact CB-CB 3.76Å; C280-C308 VanDerWaalsContact CB-SG 3.53Å; C283-C308 VanDerWaalsContact SG-SG 3.61Å; C308-N310 PolarHBondContact O-N 3.34Å; C308-C311 PolarHBondContact O-N 2.98Å; C308-C311 VanDerWaalsContact SG-SG 3.65Å; C308-G312 PolarHBondContact O-N 3.11Å; C308-H313 PolarHBondContact N-O 3.07Å; C308-W315 HydrophobicContact CB-CH2 4.15Å; C308-W315 HydrophobicContact CB-CZ3 3.89Å
309	N	87.5	Confident	85	Confident	41 Å²	41	53 Å²	53	22%	0.219	28%	0.277	C	S	.	.	T	Hydrogen-bonded Turn	trans	-62.1	-20.6	-173.2	-58	16.2	0	0	0	112.9	E274 K287 T289 Y307	E274-N309 PolarHBondContact OE1-ND2 2.92Å; K287-N309 HydrophobicContact CD-CB 4.44Å; K287-N309 HydrophobicContact CG-CB 4.33Å; K287-N309 PolarHBondContact O-N 3.36Å; T289-N309 PolarHBondContact N-OD1 2.94Å; T289-N309 VanDerWaalsContact N-OD1 3.1Å; T289-N309 PolarHBondContact OG1-OD1 3.46Å; Y307-N309 PolarHBondContact O-OD1 2.86Å
310	N	87.9	Confident	83.5	Confident	87 Å²	87	49 Å²	49	47%	0.465	26%	0.26	S	S	.	.	T	Hydrogen-bonded Turn	trans	-97	-13.8	-174.7	-60.8	3.2	0	0	0	114.5	Q285 C308	Q285-N310 PolarHBondContact OE1-ND2 3.06Å; C308-N310 PolarHBondContact O-N 3.34Å
311	C	89.9	Confident	82.1	Confident	55 Å²	55	50.8 Å²	50.8	37%	0.372	28%	0.282	S	S	.	.	T	Hydrogen-bonded Turn	trans	-143.7	7.7	-178.2	69.8	0	0	0	0	115	C280 C283 C308 H313	C280-C311 PolarHBondContact SG-SG 2.85Å; C283-C311 HydrophobicContact CB-CB 4.19Å; C283-C311 VanDerWaalsContact SG-SG 3.62Å; C308-C311 PolarHBondContact O-N 2.98Å; C308-C311 VanDerWaalsContact SG-SG 3.65Å; C311-H313 PolarHBondContact O-N 2.91Å
312	G	86.4	Confident	80.7	Confident	40 Å²	40	50.5 Å²	50.5	41%	0.412	29%	0.293	S	S	.	.			trans	68.2	1.4	177.5	0	0	0	0	0	115.4	Y307 C308 R314	Y307-G312 WeakPolarHBondContact CE2-O 3.28Å; C308-G312 PolarHBondContact O-N 3.11Å; G312-R314 PolarHBondContact O-N 3.2Å
313	H	88.1	Confident	78.9	Confident	24 Å²	24	48.8 Å²	48.8	11%	0.111	29%	0.291	C	S	.	.			trans	-71.4	121.4	-176.3	-175.1	36.3	0	0	0	110.9	K282 C308 C311 W315	K282-H313 HydrophobicContact CD-CB 4.13Å; K282-H313 HydrophobicContact CG-CB 4.42Å; C308-H313 PolarHBondContact N-O 3.07Å; C311-H313 PolarHBondContact O-N 2.91Å; H313-W315 HydrophobicContact CB-CZ3 4.39Å; H313-W315 AromaticContact CD2-CE3 3.52Å; H313-W315 AromaticContact CD2-CZ3 3.8Å; H313-W315 AromaticContact NE2-CE3 3.94Å; H313-W315 VanDerWaalsContact O-CZ3 3.31Å; H313-W315 WeakPolarHBondContact O-CZ3 3.19Å
314	R	88.6	Confident	77.3	Confident	112 Å²	112	55.8 Å²	55.8	42%	0.423	32%	0.316	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.8	135.8	174.1	-161.5	178.5	-175.3	-179.6	1.1	111.8	V306 Y307 G312 V329	V306-R314 CarbonylContact O-C 3.57Å; V306-R314 VanDerWaalsContact O-CA 3.28Å; V306-R314 WeakPolarHBondContact O-CA 3.37Å; V306-R314 WeakPolarHBondContact O-CG 3.48Å; Y307-R314 HydrophobicContact CD2-CB 4.43Å; G312-R314 PolarHBondContact O-N 3.2Å; R314-V329 HydrophobicContact CG-CB 4.42Å; R314-V329 PolarHBondContact O-N 3.43Å
315	W	89.5	Confident	75.9	Confident	4 Å²	4	59.3 Å²	59.3	2%	0.015	33%	0.334	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-140.1	177.8	170.5	65.2	95.6	0	0	0	110.4	C280 V306 C308 H313 Q326 A327	C280-W315 HydrophobicContact CB-CH2 3.81Å; C280-W315 HydrophobicContact CB-CZ3 4.15Å; V306-W315 HydrophobicContact CB-CD2 4Å; V306-W315 HydrophobicContact CB-CG 4.28Å; V306-W315 HydrophobicContact CB-CZ2 4.02Å; V306-W315 HydrophobicContact CG1-CD2 4.25Å; V306-W315 HydrophobicContact CG1-CH2 3.85Å; V306-W315 HydrophobicContact CG1-CZ2 3.39Å; V306-W315 HydrophobicContact CG1-CZ3 4.46Å; V306-W315 PolarHBondContact N-O 3.02Å; V306-W315 PolarHBondContact O-N 2.65Å; V306-W315 VanDerWaalsContact O-O 3.13Å; C308-W315 HydrophobicContact CB-CH2 4.15Å; C308-W315 HydrophobicContact CB-CZ3 3.89Å; H313-W315 HydrophobicContact CB-CZ3 4.39Å; H313-W315 AromaticContact CD2-CE3 3.52Å; H313-W315 AromaticContact CD2-CZ3 3.8Å; H313-W315 AromaticContact NE2-CE3 3.94Å; H313-W315 VanDerWaalsContact O-CZ3 3.31Å; H313-W315 WeakPolarHBondContact O-CZ3 3.19Å; W315-Q326 HydrophobicContact CB-CG 4.24Å; W315-Q326 HydrophobicContact CG-CG 3.98Å; W315-A327 WeakPolarHBondContact CA-O 2.98Å; W315-A327 WeakPolarHBondContact CB-O 3.3Å
316	K	88.2	Confident	74.5	Confident	55 Å²	55	62.3 Å²	62.3	24%	0.239	35%	0.348	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-128.6	149.3	169.9	62.3	175.4	-178.3	161.5	0	109.7	T303 T304 F305 C318 A327 V329	T303-K316 HydrophobicContact CG2-CB 3.91Å; T303-K316 HydrophobicContact CG2-CD 3.98Å; T303-K316 HydrophobicContact CG2-CG 4.48Å; T304-K316 CarbonylContact O-C 3.56Å; T304-K316 VanDerWaalsContact O-CA 3.31Å; T304-K316 WeakPolarHBondContact O-CA 3.43Å; F305-K316 HydrophobicContact CD1-CB 4.22Å; F305-K316 HydrophobicContact CE1-CB 4.37Å; K316-C318 VanDerWaalsContact CE-SG 3.54Å; K316-A327 HydrophobicContact CG-CB 4.01Å; K316-A327 PolarHBondContact N-O 2.96Å; K316-A327 PolarHBondContact O-N 3.14Å; K316-V329 HydrophobicContact CB-CG2 3.74Å; K316-V329 HydrophobicContact CD-CG2 4.16Å; K316-V329 HydrophobicContact CG-CG2 3.73Å
317	L	82.6	Confident	73.1	Confident	29 Å²	29	63.8 Å²	63.8	15%	0.152	36%	0.36	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-95.5	117	168	-61.1	173.2	0	0	0	107.4	L278 T304 V306 W324	L278-L317 HydrophobicContact CD2-CD1 4.07Å; T304-L317 HydrophobicContact CG2-CD1 4.27Å; T304-L317 PolarHBondContact O-N 3.25Å; V306-L317 HydrophobicContact CG2-CD1 4.19Å; V306-L317 HydrophobicContact CG2-CG 4.14Å; L317-W324 HydrophobicContact CB-CE3 3.95Å; L317-W324 HydrophobicContact CB-CZ3 4.14Å
318	C	69.2	Low	71.7	Confident	34 Å²	34	64 Å²	64	23%	0.23	37%	0.369	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-104.3	125.4	170.9	-71.3	0	0	0	0	108.6	K316 C320 I325	K316-C318 VanDerWaalsContact CE-SG 3.54Å; C318-C320 PolarHBondContact O-N 3.14Å; C318-I325 PolarHBondContact N-O 2.91Å; C318-I325 PolarHBondContact O-N 2.69Å
319	H	62.3	Low	70	Confident	97 Å²	97	65.7 Å²	65.7	45%	0.449	38%	0.379	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-84.1	110	173.7	-172.2	-85.3	0	0	0	108.8	P301 W324	P301-H319 HydrophobicContact CG-CB 4.43Å; H319-W324 HydrophobicContact CB-CE3 4.3Å; H319-W324 HydrophobicContact CB-CH2 4.48Å; H319-W324 HydrophobicContact CB-CZ3 4.15Å; H319-W324 AromaticContact CD2-CE2 3.79Å; H319-W324 AromaticContact CD2-CZ2 3.91Å
320	C	51.7	Low	67.8	Low	67 Å²	67	71.7 Å²	71.7	45%	0.453	40%	0.404	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-135.8	131.1	-176.4	-166.2	0	0	0	0	109.8	C318 G322 S323 I325	C318-C320 PolarHBondContact O-N 3.14Å; C320-G322 VanDerWaalsContact C-N 3.29Å; C320-G322 PolarHBondContact O-N 3.44Å; C320-G322 VanDerWaalsContact O-N 3.15Å; C320-S323 PolarHBondContact N-O 2.73Å; C320-S323 PolarHBondContact O-N 3.13Å; C320-S323 VanDerWaalsContact O-O 3.07Å; C320-I325 HydrophobicContact CB-CD1 4.09Å
321	S	51.2	Low	65.8	Low	115 Å²	115	72.8 Å²	72.8	80%	0.804	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	43.9	49.2	177	56.1	0	0	0	0	114.3	S323	S321-S323 VanDerWaalsContact C-N 3.28Å; S321-S323 PolarHBondContact O-N 3.13Å
322	G	52.4	Low	63.5	Low	71 Å²	71	79.4 Å²	79.4	73%	0.732	44%	0.438	S	S	*	.	T	Hydrogen-bonded Turn	trans	73.5	8.7	177.1	0	0	0	0	0	116.1	C320	C320-G322 VanDerWaalsContact C-N 3.29Å; C320-G322 PolarHBondContact O-N 3.44Å; C320-G322 VanDerWaalsContact O-N 3.15Å
323	S	47.9	Very low	60.9	Low	68 Å²	68	85.3 Å²	85.3	48%	0.476	46%	0.455	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-130.8	152.2	179.1	-168.2	0	0	0	0	112.5	C320 S321	C320-S323 PolarHBondContact N-O 2.73Å; C320-S323 PolarHBondContact O-N 3.13Å; C320-S323 VanDerWaalsContact O-O 3.07Å; S321-S323 VanDerWaalsContact C-N 3.28Å; S321-S323 PolarHBondContact O-N 3.13Å
324	W	53.6	Low	58.1	Low	158 Å²	158	91.4 Å²	91.4	60%	0.598	49%	0.488	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-91.3	108.9	177.6	-71.5	99.8	0	0	0	110.1	L317 H319	L317-W324 HydrophobicContact CB-CE3 3.95Å; L317-W324 HydrophobicContact CB-CZ3 4.14Å; H319-W324 HydrophobicContact CB-CE3 4.3Å; H319-W324 HydrophobicContact CB-CH2 4.48Å; H319-W324 HydrophobicContact CB-CZ3 4.15Å; H319-W324 AromaticContact CD2-CE2 3.79Å; H319-W324 AromaticContact CD2-CZ2 3.91Å
325	I	59.2	Low	55.3	Low	87 Å²	87	89.9 Å²	89.9	45%	0.446	49%	0.491	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-102.6	123.4	-179.2	-54.8	-178.8	0	0	0	109.7	C318 C320 A327	C318-I325 PolarHBondContact N-O 2.91Å; C318-I325 PolarHBondContact O-N 2.69Å; C320-I325 HydrophobicContact CB-CD1 4.09Å; I325-A327 PolarHBondContact O-N 2.81Å
326	Q	58.9	Low	52.7	Low	91 Å²	91	96.3 Å²	96.3	43%	0.425	52%	0.524	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-78	114	171.7	175.1	167.7	9.9	0	0	110	W315	W315-Q326 HydrophobicContact CB-CG 4.24Å; W315-Q326 HydrophobicContact CG-CG 3.98Å
327	A	60	Low	50.2	Low	31 Å²	31	101.6 Å²	101.6	26%	0.256	55%	0.547	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.4	128.9	174.3	0	0	0	0	0	110.4	W315 K316 I325 V329	W315-A327 WeakPolarHBondContact CA-O 2.98Å; W315-A327 WeakPolarHBondContact CB-O 3.3Å; K316-A327 HydrophobicContact CG-CB 4.01Å; K316-A327 PolarHBondContact N-O 2.96Å; K316-A327 PolarHBondContact O-N 3.14Å; I325-A327 PolarHBondContact O-N 2.81Å; A327-V329 PolarHBondContact O-N 3.47Å
328	V	59.5	Low	47.7	Very low	79 Å²	79	109.4 Å²	109.4	48%	0.479	58%	0.58	S	S	.	*	E	Extended strand (participates in β ladder)	trans	-65.1	131.3	176.8	176.3	0	0	0	0	109.8	F330	V328-F330 HydrophobicContact CB-CD2 4.44Å; V328-F330 HydrophobicContact CB-CE2 4.23Å; V328-F330 HydrophobicContact CG1-CD2 4Å; V328-F330 HydrophobicContact CG1-CE2 3.89Å; V328-F330 HydrophobicContact CG1-CZ 4.48Å; V328-F330 PolarHBondContact O-N 2.98Å
329	V	56.2	Low	46.3	Very low	35 Å²	35	114.7 Å²	114.7	21%	0.212	61%	0.606	C	S	.	*			trans	-90.3	92.8	173.8	175.9	0	0	0	0	107.4	F305 R314 K316 A327	F305-V329 HydrophobicContact CD1-CG2 3.96Å; F305-V329 HydrophobicContact CE1-CG1 4.33Å; F305-V329 HydrophobicContact CE1-CG2 3.91Å; R314-V329 HydrophobicContact CG-CB 4.42Å; R314-V329 PolarHBondContact O-N 3.43Å; K316-V329 HydrophobicContact CB-CG2 3.74Å; K316-V329 HydrophobicContact CD-CG2 4.16Å; K316-V329 HydrophobicContact CG-CG2 3.73Å; A327-V329 PolarHBondContact O-N 3.47Å
330	F	41.3	Very low	45.4	Very low	166 Å²	166	116.3 Å²	116.3	73%	0.728	62%	0.622	S	S	*	*			trans	-65.3	132	162.4	-75.6	-91.3	0	0	0	108.6	V328 K332	V328-F330 HydrophobicContact CB-CD2 4.44Å; V328-F330 HydrophobicContact CB-CE2 4.23Å; V328-F330 HydrophobicContact CG1-CD2 4Å; V328-F330 HydrophobicContact CG1-CE2 3.89Å; V328-F330 HydrophobicContact CG1-CZ 4.48Å; V328-F330 PolarHBondContact O-N 2.98Å; F330-K332 PolarHBondContact O-N 3.48Å; F330-K332 VanDerWaalsContact O-N 3.17Å
331	P	45.6	Very low	45.2	Very low	111 Å²	111	123 Å²	123	72%	0.721	66%	0.66	S	S	*	*			trans	-62.7	118.2	163.7	28.1	-31.3	0	0	0	107.2	E333	P331-E333 PolarHBondContact O-N 2.96Å
332	K	40.7	Very low	44.9	Very low	194 Å²	194	123.4 Å²	123.4	84%	0.843	65%	0.653	S	S	*	*			trans	-70.3	111.8	161	-78.7	-166.8	172.3	-168.7	0	106.3	F330 L334	F330-K332 PolarHBondContact O-N 3.48Å; F330-K332 VanDerWaalsContact O-N 3.17Å; K332-L334 PolarHBondContact O-N 3.13Å
333	E	32.9	Very low	44.5	Very low	164 Å²	164	126.1 Å²	126.1	77%	0.766	65%	0.648	S	S	*	*			trans	-56.3	125.4	169.8	-59.4	174.3	124.3	0	0	108.3	P331 T335	P331-E333 PolarHBondContact O-N 2.96Å; E333-T335 WeakPolarHBondContact CB-OG1 3.47Å; E333-T335 PolarHBondContact O-N 3.1Å
334	L	28.5	Very low	44.4	Very low	151 Å²	151	129.3 Å²	129.3	79%	0.791	66%	0.658	S	S	*	*			trans	-78.3	69	162.2	-101.3	71.5	0	0	0	107.6	K332 I336	K332-L334 PolarHBondContact O-N 3.13Å; L334-I336 PolarHBondContact O-N 3.02Å
335	T	29.9	Very low	43.8	Very low	80 Å²	80	127.6 Å²	127.6	49%	0.491	66%	0.662	S	S	.	*			trans	-74.3	71.9	174.7	-38.2	0	0	0	0	108.5	E333 F337	E333-T335 WeakPolarHBondContact CB-OG1 3.47Å; E333-T335 PolarHBondContact O-N 3.1Å; T335-F337 VanDerWaalsContact C-N 3.25Å; T335-F337 HydrophobicContact CG2-CD2 3.78Å; T335-F337 HydrophobicContact CG2-CE2 3.5Å; T335-F337 VanDerWaalsContact CG2-CE2 3.5Å; T335-F337 HydrophobicContact CG2-CZ 4.32Å; T335-F337 PolarHBondContact O-N 3.15Å
336	I	35.2	Very low	42.9	Very low	140 Å²	140	130.2 Å²	130.2	72%	0.718	68%	0.675	S	S	*	*			trans	-69.2	89.3	173.8	-59.2	179.2	0	0	0	107	L334 K338	L334-I336 PolarHBondContact O-N 3.02Å; I336-K338 VanDerWaalsContact C-N 3.32Å; I336-K338 PolarHBondContact O-N 2.97Å
337	F	34.7	Very low	41.8	Very low	165 Å²	165	132.8 Å²	132.8	72%	0.724	69%	0.692	S	S	*	*			trans	-63.7	93.1	170.4	-89.6	-89.2	0	0	0	109.5	T335 L339	T335-F337 VanDerWaalsContact C-N 3.25Å; T335-F337 HydrophobicContact CG2-CD2 3.78Å; T335-F337 HydrophobicContact CG2-CE2 3.5Å; T335-F337 VanDerWaalsContact CG2-CE2 3.5Å; T335-F337 HydrophobicContact CG2-CZ 4.32Å; T335-F337 PolarHBondContact O-N 3.15Å; F337-L339 PolarHBondContact O-N 3.31Å; F337-L339 VanDerWaalsContact O-N 3.17Å
338	K	32	Very low	40.5	Very low	193 Å²	193	140.1 Å²	140.1	84%	0.839	72%	0.723	S	S	*	*			trans	-64.5	104.4	148.6	-87.9	-177.8	175	171.2	0	107.2	I336	I336-K338 VanDerWaalsContact C-N 3.32Å; I336-K338 PolarHBondContact O-N 2.97Å
339	L	39	Very low	39	Very low	146 Å²	146	144.8 Å²	144.8	76%	0.764	74%	0.742	S	S	*	*			trans	-140.1	129.3	161.4	-142.1	142.5	0	0	0	108.6	F337	F337-L339 PolarHBondContact O-N 3.31Å; F337-L339 VanDerWaalsContact O-N 3.17Å
340	V	43.2	Very low	37.6	Very low	130 Å²	130	153.9 Å²	153.9	79%	0.788	79%	0.786	S	S	*	*			trans	-92.9	134.7	-170.8	174.6	0	0	0	0	109.8
341	V	48.3	Very low	37.3	Very low	207 Å²	207	152.8 Å²	152.8	100%	1.255	79%	0.791	S	S	*	*			trans	-132.1	0	144.7	-178.6	0	0	0	0	106.2

Retrieved 341 of 341 residues in 405.9 ms (Link to these results)

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