A0A077ZFH5_TRITR Loading...

Proteasome activator complex subunit 3

AlphaFold DB , UniProt , Accession A0A077ZFH5, Species TRITR (Trichuris trichiura, Whipworm), Gene n/a, Length 533 aa.

Structure Viewer

Loading PAE data...

(Predicted Aligned Error values between residue pairs)

Download Structure PDB PAE Table

Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	48.5	Very low	59.9	Low	163 Å²	163	107.4 Å²	107.4	80%	0.803	57%	0.566	S	S	*	*				0	112.3	0	-79.5	-68.9	-63.9	0	0	106.1	D5	M1-D5 HydrophobicContact CE-CB 4.15Å
2	P	50.4	Low	60.4	Low	79 Å²	79	105.9 Å²	105.9	51%	0.513	56%	0.558	S	S	.	*			trans	-59	137.2	170.7	27.2	-31.2	0	0	0	108.4	D4 D5	P2-D4 PolarHBondContact O-N 3.37Å; P2-D4 VanDerWaalsContact O-N 3.15Å; P2-D5 WeakPolarHBondContact CG-OD2 3.34Å; P2-D5 PolarHBondContact O-N 2.78Å
3	E	57.8	Low	60.9	Low	167 Å²	167	105.2 Å²	105.2	78%	0.78	55%	0.554	S	S	*	*	G	3₁₀ helix	trans	-61.1	-22.6	-174.8	-69.3	177.1	159.5	0	0	112.4	D5 Q6	E3-D5 PolarHBondContact O-N 3.38Å; E3-Q6 PolarHBondContact O-N 3Å
4	D	60.2	Low	61.9	Low	139 Å²	139	106.1 Å²	106.1	74%	0.743	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-68.2	-27.4	179.9	-68.6	-36.4	0	0	0	114.3	P2 Q6 P8	P2-D4 PolarHBondContact O-N 3.37Å; P2-D4 VanDerWaalsContact O-N 3.15Å; D4-Q6 VanDerWaalsContact C-N 3.29Å; D4-Q6 PolarHBondContact O-N 3.3Å; D4-P8 WeakPolarHBondContact O-CD 3.39Å
5	D	58.4	Low	62.7	Low	90 Å²	90	102.7 Å²	102.7	48%	0.481	54%	0.54	S	S	.	.	G	3₁₀ helix	trans	-78.7	-14.3	178.2	-72.2	-25.5	0	0	0	112.6	M1 P2 E3	M1-D5 HydrophobicContact CE-CB 4.15Å; P2-D5 WeakPolarHBondContact CG-OD2 3.34Å; P2-D5 PolarHBondContact O-N 2.78Å; E3-D5 PolarHBondContact O-N 3.38Å
6	Q	59.1	Low	63.8	Low	93 Å²	93	104.2 Å²	104.2	44%	0.435	54%	0.543	S	S	.	.	H	α-helix	trans	-82.2	-29.1	-179.6	-64.3	-172.8	2.7	0	0	112.6	E3 D4 I9 L10	E3-Q6 PolarHBondContact O-N 3Å; D4-Q6 VanDerWaalsContact C-N 3.29Å; D4-Q6 PolarHBondContact O-N 3.3Å; Q6-I9 PolarHBondContact O-N 3.21Å; Q6-L10 HydrophobicContact CB-CD1 4.43Å; Q6-L10 WeakPolarHBondContact O-CB 3.48Å; Q6-L10 WeakPolarHBondContact O-CG 3.45Å; Q6-L10 PolarHBondContact O-N 3.35Å
7	A	62.2	Low	65	Low	51 Å²	51	106.5 Å²	106.5	42%	0.421	55%	0.548	S	S	.	.	H	α-helix	trans	-58.4	-47.6	-177.9	0	0	0	0	0	114.5	L10 K11	A7-L10 PolarHBondContact O-N 3.14Å; A7-K11 WeakPolarHBondContact O-CG 3.45Å; A7-K11 PolarHBondContact O-N 3.16Å
8	P	66	Low	66	Low	69 Å²	69	101.6 Å²	101.6	45%	0.448	53%	0.526	S	S	.	.	H	α-helix	trans	-68	-35.7	178.5	24.6	-33	0	0	0	112.6	D4 K11 L12	D4-P8 WeakPolarHBondContact O-CD 3.39Å; P8-K11 PolarHBondContact O-N 2.96Å; P8-L12 WeakPolarHBondContact O-CG 3.5Å; P8-L12 PolarHBondContact O-N 3.44Å
9	I	63.8	Low	67	Low	95 Å²	95	98.4 Å²	98.4	49%	0.487	51%	0.508	S	S	.	.	H	α-helix	trans	-65.7	-44.2	177.2	-60.4	174.1	0	0	0	110.3	Q6 K11 L12 L13	Q6-I9 PolarHBondContact O-N 3.21Å; I9-K11 PolarHBondContact O-N 2.66Å; I9-L12 PolarHBondContact O-N 3.28Å; I9-L13 HydrophobicContact CG2-CD1 4.06Å; I9-L13 HydrophobicContact CG2-CG 4.49Å; I9-L13 WeakPolarHBondContact O-CG 3.38Å; I9-L13 PolarHBondContact O-N 3.06Å
10	L	62.7	Low	68.1	Low	98 Å²	98	100.3 Å²	100.3	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-61.9	-41.7	176.1	-75.9	167.7	0	0	0	112	Q6 A7 L13 L14	Q6-L10 HydrophobicContact CB-CD1 4.43Å; Q6-L10 WeakPolarHBondContact O-CB 3.48Å; Q6-L10 WeakPolarHBondContact O-CG 3.45Å; Q6-L10 PolarHBondContact O-N 3.35Å; A7-L10 PolarHBondContact O-N 3.14Å; L10-L13 PolarHBondContact O-N 3.4Å; L10-L14 WeakPolarHBondContact O-CB 3.27Å; L10-L14 VanDerWaalsContact O-CG 3.26Å; L10-L14 WeakPolarHBondContact O-CG 3.49Å; L10-L14 PolarHBondContact O-N 3.35Å
11	K	69.3	Low	69.1	Low	137 Å²	137	97.1 Å²	97.1	60%	0.596	50%	0.502	S	S	*	.	H	α-helix	trans	-60.7	-45.7	175.2	-75.4	179	-179.5	-179.7	0	111.9	A7 P8 I9 L14 I15	A7-K11 WeakPolarHBondContact O-CG 3.45Å; A7-K11 PolarHBondContact O-N 3.16Å; P8-K11 PolarHBondContact O-N 2.96Å; I9-K11 PolarHBondContact O-N 2.66Å; K11-L14 PolarHBondContact O-N 3.01Å; K11-I15 WeakPolarHBondContact O-CD1 3.37Å; K11-I15 VanDerWaalsContact O-CG1 3.24Å; K11-I15 WeakPolarHBondContact O-CG1 3.33Å; K11-I15 PolarHBondContact O-N 2.9Å; K11-I15 VanDerWaalsContact O-N 3.09Å
12	L	66.7	Low	71.2	Confident	90 Å²	90	89.4 Å²	89.4	47%	0.471	46%	0.463	S	S	.	.	H	α-helix	trans	-63.1	-45.1	178.2	-72.4	172.2	0	0	0	112	P8 I9 L14 I15 E16	P8-L12 WeakPolarHBondContact O-CG 3.5Å; P8-L12 PolarHBondContact O-N 3.44Å; I9-L12 PolarHBondContact O-N 3.28Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 3Å; L12-I15 PolarHBondContact O-N 3.35Å; L12-I15 VanDerWaalsContact O-N 3.17Å; L12-E16 PolarHBondContact O-N 3.17Å
13	L	66.6	Low	73.1	Confident	97 Å²	97	93 Å²	93	51%	0.508	47%	0.467	S	S	.	.	H	α-helix	trans	-62.3	-38.2	177.2	-72.5	172.2	0	0	0	112.6	I9 L10 I15 K17	I9-L13 HydrophobicContact CG2-CD1 4.06Å; I9-L13 HydrophobicContact CG2-CG 4.49Å; I9-L13 WeakPolarHBondContact O-CG 3.38Å; I9-L13 PolarHBondContact O-N 3.06Å; L10-L13 PolarHBondContact O-N 3.4Å; L13-I15 VanDerWaalsContact C-N 3.33Å; L13-K17 VanDerWaalsContact O-CB 3.31Å; L13-K17 WeakPolarHBondContact O-CB 3.38Å; L13-K17 PolarHBondContact O-N 2.86Å
14	L	74.5	Confident	74.9	Confident	117 Å²	117	87.8 Å²	87.8	61%	0.613	45%	0.447	S	S	*	.	H	α-helix	trans	-65.1	-38.2	175.6	-74.4	169.9	0	0	0	111.8	L10 K11 L12 A18	L10-L14 WeakPolarHBondContact O-CB 3.27Å; L10-L14 VanDerWaalsContact O-CG 3.26Å; L10-L14 WeakPolarHBondContact O-CG 3.49Å; L10-L14 PolarHBondContact O-N 3.35Å; K11-L14 PolarHBondContact O-N 3.01Å; L12-L14 VanDerWaalsContact C-N 3.33Å; L12-L14 PolarHBondContact O-N 3Å; L14-A18 VanDerWaalsContact O-CB 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.41Å; L14-A18 PolarHBondContact O-N 3.4Å
15	I	74.8	Confident	76.5	Confident	56 Å²	56	81.2 Å²	81.2	29%	0.287	41%	0.411	S	S	.	.	H	α-helix	trans	-69.2	-45.1	178.5	-68.7	167.3	0	0	0	111.1	K11 L12 L13 K17 A18 E19	K11-I15 WeakPolarHBondContact O-CD1 3.37Å; K11-I15 VanDerWaalsContact O-CG1 3.24Å; K11-I15 WeakPolarHBondContact O-CG1 3.33Å; K11-I15 PolarHBondContact O-N 2.9Å; K11-I15 VanDerWaalsContact O-N 3.09Å; L12-I15 PolarHBondContact O-N 3.35Å; L12-I15 VanDerWaalsContact O-N 3.17Å; L13-I15 VanDerWaalsContact C-N 3.33Å; I15-K17 VanDerWaalsContact C-N 3.34Å; I15-K17 PolarHBondContact O-N 2.95Å; I15-A18 PolarHBondContact O-N 3.39Å; I15-E19 PolarHBondContact O-N 3.34Å
16	E	79.3	Confident	78.1	Confident	126 Å²	126	77 Å²	77	59%	0.589	39%	0.388	S	S	*	.	H	α-helix	trans	-60.8	-44.5	176.4	-73.1	-178.7	171.1	0	0	111.1	L12 A18 E19 E20	L12-E16 PolarHBondContact O-N 3.17Å; E16-A18 VanDerWaalsContact C-N 3.33Å; E16-A18 PolarHBondContact O-N 3.08Å; E16-E19 PolarHBondContact O-N 3.02Å; E16-E20 PolarHBondContact O-N 3.46Å
17	K	84.4	Confident	79.8	Confident	143 Å²	143	74.9 Å²	74.9	62%	0.622	38%	0.378	S	S	*	.	H	α-helix	trans	-63.2	-38.2	175.6	-173.2	178.3	-179.9	-178.6	0	112.4	L13 I15 S21	L13-K17 VanDerWaalsContact O-CB 3.31Å; L13-K17 WeakPolarHBondContact O-CB 3.38Å; L13-K17 PolarHBondContact O-N 2.86Å; I15-K17 VanDerWaalsContact C-N 3.34Å; I15-K17 PolarHBondContact O-N 2.95Å; K17-S21 VanDerWaalsContact O-CB 3.28Å; K17-S21 WeakPolarHBondContact O-CB 3.3Å; K17-S21 PolarHBondContact O-N 3.27Å; K17-S21 PolarHBondContact O-OG 3.18Å
18	A	83.4	Confident	81.3	Confident	19 Å²	19	78.6 Å²	78.6	16%	0.157	39%	0.387	C	S	.	.	H	α-helix	trans	-67.8	-38.5	176.7	0	0	0	0	0	111.9	L14 I15 E16 S21 Y22 L422 L425	L14-A18 VanDerWaalsContact O-CB 3.31Å; L14-A18 WeakPolarHBondContact O-CB 3.41Å; L14-A18 PolarHBondContact O-N 3.4Å; I15-A18 PolarHBondContact O-N 3.39Å; E16-A18 VanDerWaalsContact C-N 3.33Å; E16-A18 PolarHBondContact O-N 3.08Å; A18-S21 PolarHBondContact O-N 2.92Å; A18-Y22 WeakPolarHBondContact O-CB 3.47Å; A18-Y22 PolarHBondContact O-N 3.4Å; A18-L422 HydrophobicContact CB-CD2 4.21Å; A18-L425 HydrophobicContact CB-CD1 3.99Å
19	E	85.4	Confident	82.7	Confident	41 Å²	41	78.4 Å²	78.4	19%	0.192	38%	0.38	C	S	.	.	H	α-helix	trans	-65.6	-47.1	175.3	172.4	168.6	170.8	0	0	112.1	I15 E16 S21 Y22 R23 Y426 Y522 R525	I15-E19 PolarHBondContact O-N 3.34Å; E16-E19 PolarHBondContact O-N 3.02Å; E19-S21 VanDerWaalsContact C-N 3.3Å; E19-S21 PolarHBondContact O-N 2.86Å; E19-Y22 PolarHBondContact O-N 3.02Å; E19-R23 WeakPolarHBondContact O-CB 3.48Å; E19-R23 PolarHBondContact O-N 3.49Å; E19-Y426 WeakPolarHBondContact CG-OH 3.34Å; E19-Y522 WeakPolarHBondContact OE1-CD2 3.47Å; E19-Y522 WeakPolarHBondContact OE1-CE2 3.33Å; E19-Y522 WeakPolarHBondContact OE2-CE2 3.41Å; E19-R525 IonicContact OE2-NH1 3.68Å
20	E	88.5	Confident	84.3	Confident	135 Å²	135	73.9 Å²	73.9	63%	0.631	36%	0.357	S	S	*	.	H	α-helix	trans	-59.6	-44.2	174.2	-173.6	174	-161.7	0	0	110.6	E16 Y22 R23 T24	E16-E20 PolarHBondContact O-N 3.46Å; E20-Y22 VanDerWaalsContact C-N 3.33Å; E20-Y22 PolarHBondContact O-N 3.41Å; E20-R23 PolarHBondContact O-N 3.41Å; E20-T24 WeakPolarHBondContact O-CB 3.35Å; E20-T24 PolarHBondContact O-N 3.48Å; E20-T24 PolarHBondContact O-OG1 2.76Å
21	S	89.7	Confident	85.9	Confident	35 Å²	35	72 Å²	72	25%	0.245	35%	0.347	C	S	.	.	H	α-helix	trans	-59.8	-40.9	175.7	-62.6	0	0	0	0	112.6	K17 A18 E19 L25	K17-S21 VanDerWaalsContact O-CB 3.28Å; K17-S21 WeakPolarHBondContact O-CB 3.3Å; K17-S21 PolarHBondContact O-N 3.27Å; K17-S21 PolarHBondContact O-OG 3.18Å; A18-S21 PolarHBondContact O-N 2.92Å; E19-S21 VanDerWaalsContact C-N 3.3Å; E19-S21 PolarHBondContact O-N 2.86Å; S21-L25 WeakPolarHBondContact O-CB 3.22Å; S21-L25 PolarHBondContact O-N 3.37Å
22	Y	91.7	Very high	87.2	Confident	0 Å²	0	69 Å²	69	0%	0	34%	0.343	C	S	.	.	H	α-helix	trans	-68.1	-42.9	177.9	-173	-126.9	0	0	0	111.4	A18 E19 E20 L25 I26 A419 L422 A423 Y426 V514 W518 L521	A18-Y22 WeakPolarHBondContact O-CB 3.47Å; A18-Y22 PolarHBondContact O-N 3.4Å; E19-Y22 PolarHBondContact O-N 3.02Å; E20-Y22 VanDerWaalsContact C-N 3.33Å; E20-Y22 PolarHBondContact O-N 3.41Å; Y22-L25 PolarHBondContact O-N 2.75Å; Y22-I26 HydrophobicContact CD2-CG1 3.94Å; Y22-I26 HydrophobicContact CE1-CG1 4.47Å; Y22-I26 HydrophobicContact CE2-CD1 3.96Å; Y22-I26 HydrophobicContact CE2-CG1 3.61Å; Y22-I26 WeakPolarHBondContact O-CB 3.44Å; Y22-I26 WeakPolarHBondContact O-CG1 3.42Å; Y22-I26 PolarHBondContact O-N 2.86Å; Y22-A419 HydrophobicContact CE2-CB 4.29Å; Y22-A419 WeakPolarHBondContact CE2-O 3.42Å; Y22-L422 HydrophobicContact CD2-CB 3.36Å; Y22-L422 HydrophobicContact CD2-CD1 3.96Å; Y22-L422 HydrophobicContact CD2-CG 4.3Å; Y22-L422 HydrophobicContact CE2-CB 4.05Å; Y22-L422 HydrophobicContact CG-CB 3.87Å; Y22-L422 HydrophobicContact CG-CD1 4.46Å; Y22-A423 HydrophobicContact CE2-CB 4.32Å; Y22-Y426 HydrophobicContact CD1-CD2 4.43Å; Y22-Y426 AromaticContact CD1-CE2 3.56Å; Y22-Y426 HydrophobicContact CD1-CE2 3.56Å; Y22-Y426 HydrophobicContact CE1-CD2 4.48Å; Y22-Y426 HydrophobicContact CE1-CE2 4.01Å; Y22-Y426 HydrophobicContact CG-CE2 4.27Å; Y22-V514 HydrophobicContact CE1-CG1 4.15Å; Y22-W518 AromaticContact CD1-CH2 3.91Å; Y22-W518 HydrophobicContact CD1-CH2 3.91Å; Y22-W518 AromaticContact CD1-CZ3 3.57Å; Y22-W518 HydrophobicContact CD1-CZ3 3.57Å; Y22-W518 HydrophobicContact CE1-CH2 4.49Å; Y22-W518 AromaticContact CE1-CZ3 3.71Å; Y22-W518 HydrophobicContact CE1-CZ3 3.71Å; Y22-L521 HydrophobicContact CE1-CD1 4.38Å
23	R	91.6	Very high	88.6	Confident	156 Å²	156	65.1 Å²	65.1	59%	0.589	32%	0.323	S	S	*	.	H	α-helix	trans	-61.3	-49.4	177	-168.6	-176.8	175.7	-174.6	-4.5	111.4	E19 E20 I26 F27 W518	E19-R23 WeakPolarHBondContact O-CB 3.48Å; E19-R23 PolarHBondContact O-N 3.49Å; E20-R23 PolarHBondContact O-N 3.41Å; R23-I26 PolarHBondContact O-N 3.27Å; R23-F27 HydrophobicContact CB-CD2 4.35Å; R23-F27 HydrophobicContact CG-CD2 3.52Å; R23-F27 HydrophobicContact CG-CE2 3.98Å; R23-F27 WeakPolarHBondContact O-CB 3.03Å; R23-F27 VanDerWaalsContact O-CD2 3.27Å; R23-F27 WeakPolarHBondContact O-CD2 3.28Å; R23-F27 PolarHBondContact O-N 3.11Å; R23-W518 HydrophobicContact CB-CH2 3.83Å; R23-W518 HydrophobicContact CB-CZ2 4.12Å; R23-W518 HydrophobicContact CG-CH2 4.15Å; R23-W518 HydrophobicContact CG-CZ2 4.08Å
24	T	93.9	Very high	90	Very high	57 Å²	57	60.6 Å²	60.6	35%	0.35	30%	0.3	S	S	.	.	H	α-helix	trans	-62.7	-43.2	177.5	-62.7	0	0	0	0	111.4	E20 I26 E28 Q29	E20-T24 WeakPolarHBondContact O-CB 3.35Å; E20-T24 PolarHBondContact O-N 3.48Å; E20-T24 PolarHBondContact O-OG1 2.76Å; T24-I26 PolarHBondContact O-N 3.46Å; T24-E28 WeakPolarHBondContact O-CB 3.47Å; T24-E28 PolarHBondContact O-N 3.01Å; T24-Q29 PolarHBondContact O-N 2.77Å
25	L	94.1	Very high	91.1	Very high	1 Å²	1	60.6 Å²	60.6	1%	0.005	30%	0.297	C	S	.	.	I	π-helix	trans	-58.2	-51.7	177.1	178.1	63.3	0	0	0	111.2	S21 Y22 Q29 F30 R418 A419 L422	S21-L25 WeakPolarHBondContact O-CB 3.22Å; S21-L25 PolarHBondContact O-N 3.37Å; Y22-L25 PolarHBondContact O-N 2.75Å; L25-Q29 HydrophobicContact CD1-CB 4.24Å; L25-Q29 HydrophobicContact CD1-CG 4.43Å; L25-Q29 VanDerWaalsContact O-CB 3.31Å; L25-Q29 WeakPolarHBondContact O-CB 3.21Å; L25-Q29 PolarHBondContact O-N 2.87Å; L25-F30 HydrophobicContact CD1-CD2 4.19Å; L25-F30 HydrophobicContact CD1-CE2 3.87Å; L25-F30 HydrophobicContact CD2-CE2 4.48Å; L25-F30 HydrophobicContact CG-CD2 4.23Å; L25-F30 HydrophobicContact CG-CE2 3.82Å; L25-F30 WeakPolarHBondContact O-CD2 3.17Å; L25-F30 PolarHBondContact O-N 3.28Å; L25-R418 HydrophobicContact CD2-CB 4.07Å; L25-R418 HydrophobicContact CD2-CG 3.79Å; L25-A419 HydrophobicContact CD2-CB 3.84Å; L25-L422 HydrophobicContact CD2-CD1 3.97Å
26	I	93	Very high	92.1	Very high	0 Å²	0	61 Å²	61	0%	0	30%	0.298	C	S	.	.	I	π-helix	trans	-75.1	-47.4	-175.1	-63.9	-60.7	0	0	0	112.4	Y22 R23 T24 F30 A419 F444 H511 V514	Y22-I26 HydrophobicContact CD2-CG1 3.94Å; Y22-I26 HydrophobicContact CE1-CG1 4.47Å; Y22-I26 HydrophobicContact CE2-CD1 3.96Å; Y22-I26 HydrophobicContact CE2-CG1 3.61Å; Y22-I26 WeakPolarHBondContact O-CB 3.44Å; Y22-I26 WeakPolarHBondContact O-CG1 3.42Å; Y22-I26 PolarHBondContact O-N 2.86Å; R23-I26 PolarHBondContact O-N 3.27Å; T24-I26 PolarHBondContact O-N 3.46Å; I26-F30 HydrophobicContact CD1-CD1 4.26Å; I26-F30 HydrophobicContact CD1-CD2 4.35Å; I26-F30 HydrophobicContact CD1-CE1 3.99Å; I26-F30 HydrophobicContact CD1-CE2 4.05Å; I26-F30 HydrophobicContact CD1-CG 4.45Å; I26-F30 HydrophobicContact CD1-CZ 3.88Å; I26-F30 WeakPolarHBondContact O-CB 3.37Å; I26-A419 HydrophobicContact CD1-CB 3.92Å; I26-F444 HydrophobicContact CD1-CZ 3.93Å; I26-H511 PolarHBondContact O-CD2 3.47Å; I26-V514 HydrophobicContact CB-CG1 4.49Å; I26-V514 HydrophobicContact CD1-CG2 4.41Å; I26-V514 HydrophobicContact CG1-CG1 4.31Å; I26-V514 HydrophobicContact CG2-CB 3.83Å; I26-V514 HydrophobicContact CG2-CG1 3.79Å; I26-V514 HydrophobicContact CG2-CG2 4.42Å
27	F	93.7	Very high	92.9	Very high	49 Å²	49	55 Å²	55	22%	0.215	27%	0.27	C	S	.	.	I	π-helix	trans	-91.2	-14.1	-169.6	-62.1	-65.3	0	0	0	114.6	R23 L31 H511 V514 R515 W518	R23-F27 HydrophobicContact CB-CD2 4.35Å; R23-F27 HydrophobicContact CG-CD2 3.52Å; R23-F27 HydrophobicContact CG-CE2 3.98Å; R23-F27 WeakPolarHBondContact O-CB 3.03Å; R23-F27 VanDerWaalsContact O-CD2 3.27Å; R23-F27 WeakPolarHBondContact O-CD2 3.28Å; R23-F27 PolarHBondContact O-N 3.11Å; F27-L31 WeakPolarHBondContact O-CD1 3.31Å; F27-H511 AromaticContact CD1-CD2 3.83Å; F27-H511 AromaticContact CD1-NE2 3.65Å; F27-V514 HydrophobicContact CZ-CG1 4.42Å; F27-R515 HydrophobicContact CE1-CB 3.7Å; F27-R515 HydrophobicContact CE1-CG 3.8Å; F27-R515 HydrophobicContact CZ-CB 4.46Å; F27-W518 AromaticContact CE2-CD2 3.78Å; F27-W518 HydrophobicContact CE2-CD2 3.78Å; F27-W518 AromaticContact CE2-CE3 3.52Å; F27-W518 HydrophobicContact CE2-CE3 3.52Å; F27-W518 HydrophobicContact CE2-CG 4.47Å; F27-W518 HydrophobicContact CE2-CH2 4.08Å; F27-W518 HydrophobicContact CE2-CZ2 4.33Å; F27-W518 AromaticContact CE2-CZ3 3.67Å; F27-W518 HydrophobicContact CE2-CZ3 3.67Å; F27-W518 HydrophobicContact CZ-CB 4.44Å; F27-W518 AromaticContact CZ-CD2 3.93Å; F27-W518 HydrophobicContact CZ-CD2 3.93Å; F27-W518 AromaticContact CZ-CE3 3.69Å; F27-W518 HydrophobicContact CZ-CE3 3.69Å; F27-W518 HydrophobicContact CZ-CG 4.26Å; F27-W518 HydrophobicContact CZ-CZ3 4.26Å
28	E	94.1	Very high	93.5	Very high	129 Å²	129	50.9 Å²	50.9	60%	0.603	25%	0.254	S	S	*	.	I	π-helix	trans	-117.9	-55.1	177.8	-57.1	-179.3	-178.7	0	0	110.5	T24 L31 S32	T24-E28 WeakPolarHBondContact O-CB 3.47Å; T24-E28 PolarHBondContact O-N 3.01Å; E28-L31 PolarHBondContact O-N 3.29Å; E28-S32 WeakPolarHBondContact O-CB 3.44Å; E28-S32 PolarHBondContact O-N 3.05Å
29	Q	95.5	Very high	94.1	Very high	65 Å²	65	56.4 Å²	56.4	30%	0.304	28%	0.275	S	S	.	.	I	π-helix	trans	-69.8	-43	-173	-165.5	-176.9	-13.3	0	0	112.4	T24 L25 L31 S32 C33 N415	T24-Q29 PolarHBondContact O-N 2.77Å; L25-Q29 HydrophobicContact CD1-CB 4.24Å; L25-Q29 HydrophobicContact CD1-CG 4.43Å; L25-Q29 VanDerWaalsContact O-CB 3.31Å; L25-Q29 WeakPolarHBondContact O-CB 3.21Å; L25-Q29 PolarHBondContact O-N 2.87Å; Q29-L31 PolarHBondContact O-N 2.98Å; Q29-S32 PolarHBondContact O-N 2.95Å; Q29-C33 WeakPolarHBondContact O-CB 3.49Å; Q29-C33 PolarHBondContact O-N 3.26Å; Q29-C33 PolarHBondContact O-SG 3.5Å; Q29-N415 PolarHBondContact NE2-OD1 3.47Å
30	F	97	Very high	94.6	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-63.4	-40.4	178.2	-83.2	-139.2	0	0	0	112	L25 I26 C33 A34 N415 A419 F444 F506 Y507 M510 H511	L25-F30 HydrophobicContact CD1-CD2 4.19Å; L25-F30 HydrophobicContact CD1-CE2 3.87Å; L25-F30 HydrophobicContact CD2-CE2 4.48Å; L25-F30 HydrophobicContact CG-CD2 4.23Å; L25-F30 HydrophobicContact CG-CE2 3.82Å; L25-F30 WeakPolarHBondContact O-CD2 3.17Å; L25-F30 PolarHBondContact O-N 3.28Å; I26-F30 HydrophobicContact CD1-CD1 4.26Å; I26-F30 HydrophobicContact CD1-CD2 4.35Å; I26-F30 HydrophobicContact CD1-CE1 3.99Å; I26-F30 HydrophobicContact CD1-CE2 4.05Å; I26-F30 HydrophobicContact CD1-CG 4.45Å; I26-F30 HydrophobicContact CD1-CZ 3.88Å; I26-F30 WeakPolarHBondContact O-CB 3.37Å; F30-C33 PolarHBondContact O-N 2.76Å; F30-A34 WeakPolarHBondContact O-CB 3.34Å; F30-A34 PolarHBondContact O-N 3.26Å; F30-N415 HydrophobicContact CE2-CB 3.87Å; F30-N415 HydrophobicContact CZ-CB 4.36Å; F30-A419 HydrophobicContact CE2-CB 4.25Å; F30-A419 HydrophobicContact CZ-CB 3.79Å; F30-F444 HydrophobicContact CE1-CE1 4.06Å; F30-F444 HydrophobicContact CZ-CE1 4.09Å; F30-F506 HydrophobicContact CE1-CE1 4.44Å; F30-F506 HydrophobicContact CE1-CZ 4.01Å; F30-F506 HydrophobicContact CZ-CZ 4.24Å; F30-Y507 HydrophobicContact CB-CD1 3.92Å; F30-Y507 AromaticContact CD1-CD1 3.7Å; F30-Y507 HydrophobicContact CD1-CD1 3.7Å; F30-Y507 HydrophobicContact CD1-CE1 4.47Å; F30-Y507 HydrophobicContact CD2-CD1 4.11Å; F30-Y507 HydrophobicContact CD2-CE1 4.23Å; F30-Y507 HydrophobicContact CE1-CD1 4.16Å; F30-Y507 HydrophobicContact CE2-CE1 4.47Å; F30-Y507 AromaticContact CG-CD1 3.65Å; F30-Y507 HydrophobicContact CG-CD1 3.65Å; F30-Y507 HydrophobicContact CG-CE1 4.24Å; F30-M510 HydrophobicContact CD1-CB 4.14Å; F30-M510 HydrophobicContact CE1-CB 3.77Å; F30-H511 HydrophobicContact CB-CB 4.44Å
31	L	95.9	Very high	94.7	Very high	60 Å²	60	51.9 Å²	51.9	31%	0.314	25%	0.252	S	S	.	.	H	α-helix	trans	-65.1	-44.6	175.8	-71	-177.7	0	0	0	111.6	F27 E28 Q29 C33 A34 E35 L508	F27-L31 WeakPolarHBondContact O-CD1 3.31Å; E28-L31 PolarHBondContact O-N 3.29Å; Q29-L31 PolarHBondContact O-N 2.98Å; L31-C33 VanDerWaalsContact C-N 3.35Å; L31-C33 PolarHBondContact O-N 3.46Å; L31-A34 PolarHBondContact O-N 3.47Å; L31-E35 WeakPolarHBondContact O-CG 3.42Å; L31-E35 PolarHBondContact O-N 3.4Å; L31-L508 HydrophobicContact CD2-CD2 4.31Å
32	S	96.4	Very high	94.9	Very high	72 Å²	72	54 Å²	54	50%	0.503	26%	0.264	S	S	.	.	H	α-helix	trans	-59.5	-44.6	175.7	-176.9	0	0	0	0	111.8	E28 Q29 E35 E36	E28-S32 WeakPolarHBondContact O-CB 3.44Å; E28-S32 PolarHBondContact O-N 3.05Å; Q29-S32 PolarHBondContact O-N 2.95Å; S32-E35 PolarHBondContact O-N 3.02Å; S32-E36 PolarHBondContact O-N 3.49Å
33	C	96.7	Very high	95	Very high	9 Å²	9	58.1 Å²	58.1	6%	0.061	29%	0.293	C	S	.	.	H	α-helix	trans	-66.3	-38.7	176.1	-69	0	0	0	0	112.4	Q29 F30 L31 E35 E36 V37 Y507	Q29-C33 WeakPolarHBondContact O-CB 3.49Å; Q29-C33 PolarHBondContact O-N 3.26Å; Q29-C33 PolarHBondContact O-SG 3.5Å; F30-C33 PolarHBondContact O-N 2.76Å; L31-C33 VanDerWaalsContact C-N 3.35Å; L31-C33 PolarHBondContact O-N 3.46Å; C33-E35 VanDerWaalsContact C-N 3.34Å; C33-E35 PolarHBondContact O-N 3.41Å; C33-E36 PolarHBondContact O-N 2.86Å; C33-V37 WeakPolarHBondContact O-CB 3.24Å; C33-V37 VanDerWaalsContact O-CG2 3.24Å; C33-V37 WeakPolarHBondContact O-CG2 3.31Å; C33-V37 PolarHBondContact O-N 2.79Å; C33-Y507 HydrophobicContact CB-CD1 4.1Å; C33-Y507 HydrophobicContact CB-CD2 3.92Å; C33-Y507 HydrophobicContact CB-CE1 3.71Å; C33-Y507 HydrophobicContact CB-CE2 3.52Å; C33-Y507 HydrophobicContact CB-CG 4.19Å
34	A	96.7	Very high	95	Very high	3 Å²	3	51.8 Å²	51.8	3%	0.025	27%	0.27	C	S	.	.	H	α-helix	trans	-60.3	-44.7	173.9	0	0	0	0	0	111.3	F30 L31 V37 N38 E504 L508	F30-A34 WeakPolarHBondContact O-CB 3.34Å; F30-A34 PolarHBondContact O-N 3.26Å; L31-A34 PolarHBondContact O-N 3.47Å; A34-V37 PolarHBondContact O-N 2.91Å; A34-N38 VanDerWaalsContact O-CB 3.26Å; A34-N38 WeakPolarHBondContact O-CB 3.36Å; A34-N38 PolarHBondContact O-N 3.5Å; A34-E504 HydrophobicContact CB-CG 4.36Å; A34-L508 HydrophobicContact CB-CD2 3.81Å; A34-L508 HydrophobicContact CB-CG 4.02Å
35	E	96.7	Very high	94.9	Very high	116 Å²	116	52.4 Å²	52.4	54%	0.542	28%	0.275	S	S	.	.	H	α-helix	trans	-64.6	-40	176	-71.6	-178.4	-171.9	0	0	112.9	L31 S32 C33 N38 K39	L31-E35 WeakPolarHBondContact O-CG 3.42Å; L31-E35 PolarHBondContact O-N 3.4Å; S32-E35 PolarHBondContact O-N 3.02Å; C33-E35 VanDerWaalsContact C-N 3.34Å; C33-E35 PolarHBondContact O-N 3.41Å; E35-N38 PolarHBondContact O-N 3.2Å; E35-K39 VanDerWaalsContact O-CG 3.26Å; E35-K39 WeakPolarHBondContact O-CG 3.42Å; E35-K39 PolarHBondContact O-N 2.94Å
36	E	96.6	Very high	94.6	Very high	65 Å²	65	57.7 Å²	57.7	30%	0.304	31%	0.307	S	S	.	.	H	α-helix	trans	-60	-51.2	175.2	-171.8	-170.6	150.5	0	0	110.6	S32 C33 N38 K39 I40 Q408 K411	S32-E36 PolarHBondContact O-N 3.49Å; C33-E36 PolarHBondContact O-N 2.86Å; E36-N38 VanDerWaalsContact C-N 3.33Å; E36-N38 PolarHBondContact O-N 3.19Å; E36-K39 PolarHBondContact O-N 3.17Å; E36-I40 HydrophobicContact CG-CD1 4.25Å; E36-I40 WeakPolarHBondContact O-CG1 3.49Å; E36-I40 PolarHBondContact O-N 2.98Å; E36-I40 VanDerWaalsContact O-N 3.07Å; E36-Q408 PolarHBondContact OE1-NE2 3.19Å; E36-K411 VanDerWaalsContact CD-NZ 3.33Å; E36-K411 IonicContact OE1-NZ 3.79Å; E36-K411 PolarHBondContact OE1-NZ 2.9Å; E36-K411 IonicContact OE2-NZ 3.29Å; E36-K411 PolarHBondContact OE2-NZ 3.33Å; E36-K411 VanDerWaalsContact OE2-NZ 3.12Å
37	V	96.2	Very high	94.4	Very high	0 Å²	0	61.7 Å²	61.7	0%	0	34%	0.335	C	S	.	.	H	α-helix	trans	-63	-41.4	179.3	175.8	0	0	0	0	110.8	C33 A34 K39 I40 W41 Q408 L500 I503 E504 Y507	C33-V37 WeakPolarHBondContact O-CB 3.24Å; C33-V37 VanDerWaalsContact O-CG2 3.24Å; C33-V37 WeakPolarHBondContact O-CG2 3.31Å; C33-V37 PolarHBondContact O-N 2.79Å; A34-V37 PolarHBondContact O-N 2.91Å; V37-K39 PolarHBondContact O-N 3.27Å; V37-I40 WeakPolarHBondContact O-CB 3.42Å; V37-I40 PolarHBondContact O-N 2.93Å; V37-I40 VanDerWaalsContact O-N 3.15Å; V37-W41 PolarHBondContact O-N 3.37Å; V37-Q408 HydrophobicContact CG2-CB 4.39Å; V37-Q408 HydrophobicContact CG2-CG 4.25Å; V37-L500 WeakPolarHBondContact CG1-O 3.38Å; V37-I503 HydrophobicContact CG1-CB 4.19Å; V37-I503 HydrophobicContact CG1-CG2 4.24Å; V37-I503 HydrophobicContact CG2-CG2 3.9Å; V37-E504 HydrophobicContact CB-CB 4.48Å; V37-E504 HydrophobicContact CG1-CB 4.04Å; V37-Y507 HydrophobicContact CG2-CE2 4.35Å
38	N	96.6	Very high	94.1	Very high	56 Å²	56	60.8 Å²	60.8	30%	0.299	33%	0.334	S	S	.	.	H	α-helix	trans	-58.2	-47	176	-174.8	34.4	0	0	0	112.3	A34 E35 E36 I40 W41 T42 E504	A34-N38 VanDerWaalsContact O-CB 3.26Å; A34-N38 WeakPolarHBondContact O-CB 3.36Å; A34-N38 PolarHBondContact O-N 3.5Å; E35-N38 PolarHBondContact O-N 3.2Å; E36-N38 VanDerWaalsContact C-N 3.33Å; E36-N38 PolarHBondContact O-N 3.19Å; N38-I40 VanDerWaalsContact C-N 3.28Å; N38-I40 PolarHBondContact O-N 3.25Å; N38-W41 VanDerWaalsContact CA-CD1 3.44Å; N38-W41 PolarHBondContact O-N 3.41Å; N38-W41 PolarHBondContact OD1-NE1 3.21Å; N38-T42 WeakPolarHBondContact O-CB 3.16Å; N38-T42 VanDerWaalsContact O-CG2 3.31Å; N38-T42 WeakPolarHBondContact O-CG2 3.18Å; N38-T42 PolarHBondContact O-N 3.42Å; N38-T42 PolarHBondContact O-OG1 2.97Å; N38-T42 WeakPolarHBondContact OD1-CG2 3.39Å; N38-E504 HydrophobicContact CB-CG 4.45Å
39	K	96.4	Very high	93.6	Very high	135 Å²	135	58.9 Å²	58.9	59%	0.587	33%	0.333	S	S	*	.	H	α-helix	trans	-59.3	-40.9	175.6	-72.4	165.2	-173.2	165.5	0	111.6	E35 E36 V37 T42 S43	E35-K39 VanDerWaalsContact O-CG 3.26Å; E35-K39 WeakPolarHBondContact O-CG 3.42Å; E35-K39 PolarHBondContact O-N 2.94Å; E36-K39 PolarHBondContact O-N 3.17Å; V37-K39 PolarHBondContact O-N 3.27Å; K39-T42 PolarHBondContact O-OG1 3.39Å; K39-S43 VanDerWaalsContact O-CB 3.3Å; K39-S43 WeakPolarHBondContact O-CB 3.4Å; K39-S43 PolarHBondContact O-N 2.89Å; K39-S43 PolarHBondContact O-OG 3.05Å
40	I	94.6	Very high	93	Very high	31 Å²	31	57.5 Å²	57.5	16%	0.159	33%	0.326	C	S	.	.	H	α-helix	trans	-64.9	-56.6	178.9	-66.5	165.2	0	0	0	110.3	E36 V37 N38 T42 S43 I44 T404 Q408 L500	E36-I40 HydrophobicContact CG-CD1 4.25Å; E36-I40 WeakPolarHBondContact O-CG1 3.49Å; E36-I40 PolarHBondContact O-N 2.98Å; E36-I40 VanDerWaalsContact O-N 3.07Å; V37-I40 WeakPolarHBondContact O-CB 3.42Å; V37-I40 PolarHBondContact O-N 2.93Å; V37-I40 VanDerWaalsContact O-N 3.15Å; N38-I40 VanDerWaalsContact C-N 3.28Å; N38-I40 PolarHBondContact O-N 3.25Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 2.97Å; I40-S43 PolarHBondContact O-N 2.96Å; I40-S43 VanDerWaalsContact O-N 3.1Å; I40-S43 PolarHBondContact O-OG 2.85Å; I40-I44 WeakPolarHBondContact O-CG1 3.27Å; I40-I44 PolarHBondContact O-N 2.95Å; I40-T404 HydrophobicContact CD1-CG2 4.15Å; I40-T404 HydrophobicContact CG2-CG2 3.59Å; I40-Q408 HydrophobicContact CD1-CG 3.91Å; I40-L500 HydrophobicContact CG2-CD1 4.11Å
41	W	92	Very high	91.7	Very high	51 Å²	51	59.8 Å²	59.8	19%	0.193	35%	0.35	C	S	.	.	H	α-helix	trans	-71.9	-29.6	-170.5	79.2	-106.2	0	0	0	113.4	V37 N38 S43 I44 L500 E504	V37-W41 PolarHBondContact O-N 3.37Å; N38-W41 VanDerWaalsContact CA-CD1 3.44Å; N38-W41 PolarHBondContact O-N 3.41Å; N38-W41 PolarHBondContact OD1-NE1 3.21Å; W41-S43 VanDerWaalsContact C-N 3.3Å; W41-I44 PolarHBondContact O-N 3.22Å; W41-L500 HydrophobicContact CB-CB 3.66Å; W41-L500 HydrophobicContact CB-CD1 4.09Å; W41-E504 PolarHBondContact NE1-OE2 3.11Å
42	T	93.3	Very high	90	Very high	79 Å²	79	60.7 Å²	60.7	49%	0.485	36%	0.361	S	S	.	.	H	α-helix	trans	-73	-22.1	172.9	56.7	0	0	0	0	113	N38 K39 I40	N38-T42 WeakPolarHBondContact O-CB 3.16Å; N38-T42 VanDerWaalsContact O-CG2 3.31Å; N38-T42 WeakPolarHBondContact O-CG2 3.18Å; N38-T42 PolarHBondContact O-N 3.42Å; N38-T42 PolarHBondContact O-OG1 2.97Å; N38-T42 WeakPolarHBondContact OD1-CG2 3.39Å; K39-T42 PolarHBondContact O-OG1 3.39Å; I40-T42 VanDerWaalsContact C-N 3.34Å; I40-T42 PolarHBondContact O-N 2.97Å
43	S	93.9	Very high	87.9	Confident	87 Å²	87	66.3 Å²	66.3	61%	0.608	37%	0.371	S	S	*	.	H	α-helix	trans	-78.7	-17.6	174	75.8	0	0	0	0	113.8	K39 I40 W41	K39-S43 VanDerWaalsContact O-CB 3.3Å; K39-S43 WeakPolarHBondContact O-CB 3.4Å; K39-S43 PolarHBondContact O-N 2.89Å; K39-S43 PolarHBondContact O-OG 3.05Å; I40-S43 PolarHBondContact O-N 2.96Å; I40-S43 VanDerWaalsContact O-N 3.1Å; I40-S43 PolarHBondContact O-OG 2.85Å; W41-S43 VanDerWaalsContact C-N 3.3Å
44	I	91.5	Very high	85.8	Confident	22 Å²	22	67.9 Å²	67.9	11%	0.113	38%	0.379	C	S	.	.	S	Bend	trans	-77.6	127.5	179.9	-62.4	166.4	0	0	0	109.3	I40 W41 L401 Y493 R497 L500	I40-I44 WeakPolarHBondContact O-CG1 3.27Å; I40-I44 PolarHBondContact O-N 2.95Å; W41-I44 PolarHBondContact O-N 3.22Å; I44-L401 HydrophobicContact CD1-CD1 3.37Å; I44-L401 HydrophobicContact CG1-CD1 4.36Å; I44-Y493 HydrophobicContact CG2-CE1 4.42Å; I44-Y493 HydrophobicContact CG2-CE2 4.2Å; I44-Y493 WeakPolarHBondContact CG2-OH 3.2Å; I44-R497 HydrophobicContact CB-CG 4.46Å; I44-R497 HydrophobicContact CG2-CG 3.85Å; I44-L500 HydrophobicContact CD1-CD1 3.38Å
45	P	90.8	Very high	83.6	Confident	70 Å²	70	72.4 Å²	72.4	46%	0.455	41%	0.406	S	S	.	.			trans	-51	144.3	175.9	-28	35	0	0	0	113.1	S47 Y493 R497	P45-S47 VanDerWaalsContact C-N 3.3Å; P45-S47 WeakPolarHBondContact CB-O 3.36Å; P45-Y493 PolarHBondContact O-OH 2.98Å; P45-R497 PolarHBondContact O-NE 2.88Å
46	V	89.2	Confident	81.4	Confident	113 Å²	113	72.7 Å²	72.7	69%	0.685	41%	0.412	S	S	*	.	S	Bend	trans	-66.8	-38.2	176.2	179.9	0	0	0	0	110.5
47	S	87.5	Confident	79.3	Confident	84 Å²	84	70.8 Å²	70.8	59%	0.587	40%	0.404	S	S	*	.	S	Bend	trans	-94.3	139.1	176.1	56.1	0	0	0	0	111.6	P45	P45-S47 VanDerWaalsContact C-N 3.3Å; P45-S47 WeakPolarHBondContact CB-O 3.36Å
48	P	87.9	Confident	77.1	Confident	29 Å²	29	72.4 Å²	72.4	19%	0.188	42%	0.415	C	S	.	.			trans	-54.8	135.7	174.6	-21.8	29.6	0	0	0	112.3	F50 V490 Y493	P48-F50 HydrophobicContact CB-CD1 4.04Å; P48-F50 HydrophobicContact CB-CD2 4.11Å; P48-F50 HydrophobicContact CB-CE1 3.73Å; P48-F50 HydrophobicContact CB-CE2 3.8Å; P48-F50 HydrophobicContact CB-CG 4.24Å; P48-F50 HydrophobicContact CB-CZ 3.6Å; P48-F50 HydrophobicContact CG-CZ 4.36Å; P48-F50 PolarHBondContact O-N 3.17Å; P48-F50 VanDerWaalsContact O-N 3.1Å; P48-V490 HydrophobicContact CG-CG1 4.27Å; P48-V490 HydrophobicContact CG-CG2 4.41Å; P48-Y493 HydrophobicContact CB-CD1 4.01Å; P48-Y493 HydrophobicContact CB-CE1 4.27Å; P48-Y493 HydrophobicContact CB-CG 4.14Å; P48-Y493 HydrophobicContact CG-CD1 3.68Å; P48-Y493 HydrophobicContact CG-CE1 4.15Å; P48-Y493 HydrophobicContact CG-CG 4.14Å
49	P	84.8	Confident	75	Confident	90 Å²	90	72.4 Å²	72.4	58%	0.584	41%	0.414	S	S	*	.	S	Bend	trans	-77.7	12.1	179.2	33.7	-37.1	0	0	0	113.1	A397 Y493	P49-A397 HydrophobicContact CG-CB 3.83Å; P49-Y493 HydrophobicContact CG-CE2 4.43Å
50	F	82.7	Confident	72.7	Confident	35 Å²	35	66.7 Å²	66.7	15%	0.154	39%	0.391	C	S	.	.	S	Bend	trans	-119.7	133.3	177.5	48.8	-94.4	0	0	0	109.8	P48 A397 I398 Y486 D489 V490 Y493	P48-F50 HydrophobicContact CB-CD1 4.04Å; P48-F50 HydrophobicContact CB-CD2 4.11Å; P48-F50 HydrophobicContact CB-CE1 3.73Å; P48-F50 HydrophobicContact CB-CE2 3.8Å; P48-F50 HydrophobicContact CB-CG 4.24Å; P48-F50 HydrophobicContact CB-CZ 3.6Å; P48-F50 HydrophobicContact CG-CZ 4.36Å; P48-F50 PolarHBondContact O-N 3.17Å; P48-F50 VanDerWaalsContact O-N 3.1Å; F50-A397 HydrophobicContact CD1-CB 3.76Å; F50-A397 HydrophobicContact CE1-CB 4.08Å; F50-I398 HydrophobicContact CE1-CD1 4.32Å; F50-I398 HydrophobicContact CE1-CG1 4.06Å; F50-I398 HydrophobicContact CZ-CD1 4.04Å; F50-I398 HydrophobicContact CZ-CG1 4.25Å; F50-Y486 HydrophobicContact CD2-CE2 4.31Å; F50-D489 HydrophobicContact CE2-CB 4.02Å; F50-D489 HydrophobicContact CZ-CB 4.25Å; F50-V490 HydrophobicContact CE2-CG2 3.97Å; F50-Y493 AromaticContact CE1-CD2 3.99Å; F50-Y493 HydrophobicContact CE1-CD2 3.99Å; F50-Y493 HydrophobicContact CE1-CG 4.32Å; F50-Y493 HydrophobicContact CZ-CG 4.4Å
51	G	68.4	Low	70.5	Confident	49 Å²	49	68.4 Å²	68.4	51%	0.505	40%	0.4	S	S	.	.			trans	-82.7	164.8	-175.2	0	0	0	0	0	113.3	R53 Y486	G51-R53 PolarHBondContact O-N 3.41Å; G51-Y486 WeakPolarHBondContact O-CE2 3.42Å
52	S	60.5	Low	68.1	Low	79 Å²	79	72.3 Å²	72.3	55%	0.552	42%	0.424	S	S	*	.	S	Bend	trans	-68.3	8	171.4	58.2	0	0	0	0	114.5	L54 Y486	S52-L54 PolarHBondContact O-N 3.34Å; S52-Y486 VanDerWaalsContact CA-CE2 3.42Å
53	R	52.5	Low	65.7	Low	189 Å²	189	71.6 Å²	71.6	71%	0.713	42%	0.419	S	S	*	.			trans	-75.6	92	-176.5	-64.9	-171	-179.6	-170.9	2.2	108.7	G51 T55 D56	G51-R53 PolarHBondContact O-N 3.41Å; R53-T55 WeakPolarHBondContact CB-OG1 3.49Å; R53-T55 PolarHBondContact O-N 2.96Å; R53-T55 PolarHBondContact O-OG1 3.04Å; R53-D56 PolarHBondContact O-N 3.32Å
54	L	53.8	Low	63.2	Low	42 Å²	42	72.2 Å²	72.2	22%	0.22	41%	0.412	C	S	.	.	G	3₁₀ helix	trans	-49.4	-9.9	169.4	-70.5	147.3	0	0	0	114.4	S52 D56 V57 E479 R482 L483	S52-L54 PolarHBondContact O-N 3.34Å; L54-D56 PolarHBondContact O-N 3.38Å; L54-D56 VanDerWaalsContact O-N 3.14Å; L54-V57 PolarHBondContact O-N 3.26Å; L54-E479 WeakPolarHBondContact CD1-OE1 3.39Å; L54-E479 WeakPolarHBondContact CD2-OE1 3.38Å; L54-E479 WeakPolarHBondContact CG-OE1 3.24Å; L54-R482 VanDerWaalsContact CD2-C 3.42Å; L54-R482 HydrophobicContact CD2-CB 3.45Å; L54-R482 VanDerWaalsContact CD2-CB 3.45Å; L54-R482 WeakPolarHBondContact CD2-O 3.38Å; L54-L483 HydrophobicContact CD1-CD2 3.74Å; L54-L483 HydrophobicContact CD1-CG 4.21Å; L54-L483 HydrophobicContact CD2-CD2 4.41Å; L54-L483 HydrophobicContact CG-CD2 4.49Å
55	T	49.3	Very low	61.1	Low	98 Å²	98	79.3 Å²	79.3	60%	0.601	45%	0.445	S	S	*	.	G	3₁₀ helix	trans	-59.2	-17.1	173.1	54.3	0	0	0	0	114	R53	R53-T55 WeakPolarHBondContact CB-OG1 3.49Å; R53-T55 PolarHBondContact O-N 2.96Å; R53-T55 PolarHBondContact O-OG1 3.04Å
56	D	49.7	Very low	59	Low	123 Å²	123	80 Å²	80	66%	0.658	46%	0.457	S	S	*	.	G	3₁₀ helix	trans	-89.5	-9	-176.5	-60.9	-12.9	0	0	0	113	R53 L54 P58	R53-D56 PolarHBondContact O-N 3.32Å; L54-D56 PolarHBondContact O-N 3.38Å; L54-D56 VanDerWaalsContact O-N 3.14Å; D56-P58 VanDerWaalsContact O-CD 3.25Å; D56-P58 WeakPolarHBondContact O-CD 3.4Å
57	V	52.9	Low	56.9	Low	24 Å²	24	81.8 Å²	81.8	15%	0.145	46%	0.458	C	S	.	.	S	Bend	trans	-94.8	102.6	170.5	-173.9	0	0	0	0	107.8	L54 I59 I472 R482 L485	L54-V57 PolarHBondContact O-N 3.26Å; V57-I59 PolarHBondContact O-N 2.91Å; V57-I472 HydrophobicContact CG1-CG2 4.32Å; V57-R482 PolarHBondContact O-NH2 2.97Å; V57-L485 HydrophobicContact CG1-CD2 4.42Å; V57-L485 HydrophobicContact CG2-CD2 3.91Å
58	P	51.3	Low	55.1	Low	34 Å²	34	81 Å²	81	22%	0.221	45%	0.446	C	S	.	.			trans	-58	131.8	-177.1	19.9	-29.6	0	0	0	111.1	D56 P60 Y80 I392	D56-P58 VanDerWaalsContact O-CD 3.25Å; D56-P58 WeakPolarHBondContact O-CD 3.4Å; P58-P60 VanDerWaalsContact O-CD 3.32Å; P58-P60 WeakPolarHBondContact O-CD 3.39Å; P58-Y80 HydrophobicContact CB-CD1 3.61Å; P58-Y80 HydrophobicContact CB-CE1 3.34Å; P58-Y80 HydrophobicContact CG-CE1 4.13Å; P58-I392 HydrophobicContact CG-CG1 4.32Å
59	I	52.2	Low	53.2	Low	56 Å²	56	88.3 Å²	88.3	29%	0.287	48%	0.478	S	S	.	.			trans	-77.3	118.5	165.9	-56.4	175.8	0	0	0	106.1	V57 L61 P476	V57-I59 PolarHBondContact O-N 2.91Å; I59-L61 HydrophobicContact CG2-CD2 4.03Å; I59-L61 HydrophobicContact CG2-CG 4.27Å; I59-L61 PolarHBondContact O-N 3.43Å; I59-P476 HydrophobicContact CG2-CB 4.2Å
60	P	48.2	Very low	51.8	Low	16 Å²	16	92.7 Å²	92.7	10%	0.104	49%	0.491	C	S	.	.			trans	-65.6	103.1	164	25.6	-28.3	0	0	0	107.5	P58 H387	P58-P60 VanDerWaalsContact O-CD 3.32Å; P58-P60 WeakPolarHBondContact O-CD 3.39Å; P60-H387 HydrophobicContact CB-CB 3.73Å; P60-H387 HydrophobicContact CG-CB 4.04Å
61	L	47	Very low	50.1	Low	66 Å²	66	99.1 Å²	99.1	35%	0.346	52%	0.519	S	S	.	.			trans	-83.6	124.4	168.9	-70.4	172.7	0	0	0	107.7	I59 V63 V81	I59-L61 HydrophobicContact CG2-CD2 4.03Å; I59-L61 HydrophobicContact CG2-CG 4.27Å; I59-L61 PolarHBondContact O-N 3.43Å; L61-V63 PolarHBondContact O-N 2.95Å; L61-V81 HydrophobicContact CD1-CB 4.48Å
62	I	43.6	Very low	48.8	Very low	134 Å²	134	101.2 Å²	101.2	69%	0.687	54%	0.54	S	S	*	.			trans	-70	109.5	166.2	-57.1	170.6	0	0	0	105.6
63	V	41.5	Very low	48.1	Very low	63 Å²	63	99.4 Å²	99.4	38%	0.382	53%	0.528	S	S	.	.			trans	-86.5	122.8	164.7	-179.1	0	0	0	0	105.9	L61 E65 E67	L61-V63 PolarHBondContact O-N 2.95Å; V63-E65 PolarHBondContact O-N 2.72Å; V63-E67 HydrophobicContact CG1-CB 4.36Å
64	E	42.5	Very low	47.5	Very low	100 Å²	100	94.4 Å²	94.4	47%	0.467	52%	0.52	S	S	.	.			trans	-59.5	135.2	172.7	-70.7	-177.6	163.9	0	0	109.1	A66 E67	E64-A66 PolarHBondContact O-N 3.23Å; E64-E67 PolarHBondContact O-N 3.49Å; E64-E67 VanDerWaalsContact O-N 3.15Å
65	E	47.3	Very low	46.7	Very low	172 Å²	172	98.7 Å²	98.7	80%	0.804	55%	0.55	S	S	*	.	G	3₁₀ helix	trans	-54.7	-17	179.7	-71.5	179.1	151.2	0	0	113.2	V63 E67 L68	V63-E65 PolarHBondContact O-N 2.72Å; E65-E67 VanDerWaalsContact C-N 3.3Å; E65-E67 PolarHBondContact O-N 2.84Å; E65-L68 PolarHBondContact O-N 3.44Å
66	A	45.2	Very low	46.4	Very low	85 Å²	85	97.6 Å²	97.6	70%	0.702	56%	0.558	S	S	*	*	G	3₁₀ helix	trans	-68	-18.9	178.4	0	0	0	0	0	115	E64	E64-A66 PolarHBondContact O-N 3.23Å
67	E	45.9	Very low	45.7	Very low	150 Å²	150	100.1 Å²	100.1	70%	0.701	56%	0.56	S	S	*	*	G	3₁₀ helix	trans	-96.5	-8.2	178.2	-67.1	-169.3	166.4	0	0	114	V63 E64 E65	V63-E67 HydrophobicContact CG1-CB 4.36Å; E64-E67 PolarHBondContact O-N 3.49Å; E64-E67 VanDerWaalsContact O-N 3.15Å; E65-E67 VanDerWaalsContact C-N 3.3Å; E65-E67 PolarHBondContact O-N 2.84Å
68	L	49.2	Very low	45	Very low	67 Å²	67	101.9 Å²	101.9	35%	0.351	57%	0.568	S	S	.	*	S	Bend	trans	-83.8	-16.1	-178.2	-93.6	152.6	0	0	0	113.8	E65 S73	E65-L68 PolarHBondContact O-N 3.44Å; L68-S73 WeakPolarHBondContact CD2-OG 3.43Å
69	E	49.5	Very low	44.3	Very low	183 Å²	183	106.4 Å²	106.4	86%	0.855	59%	0.586	S	S	*	*	S	Bend	trans	-77.9	-17.6	179.5	-70.1	-164.5	154.3	0	0	114
70	E	53.6	Low	43.8	Very low	181 Å²	181	109.1 Å²	109.1	85%	0.846	59%	0.593	S	S	*	*	S	Bend	trans	-91.6	-11.7	-173.8	-143.6	-177.5	-170.9	0	0	114.3
71	K	47.3	Very low	43.3	Very low	171 Å²	171	112.7 Å²	112.7	74%	0.743	62%	0.615	S	S	*	*	S	Bend	trans	-138.2	108.1	175.3	-70	178.9	-176.7	168.2	0	108.1	S73	K71-S73 PolarHBondContact O-N 2.98Å
72	G	41.3	Very low	42.9	Very low	93 Å²	93	120.5 Å²	120.5	96%	0.959	64%	0.64	S	S	*	*			trans	-58.6	65.5	-175.9	0	0	0	0	0	115.5
73	S	45.7	Very low	42.8	Very low	41 Å²	41	119 Å²	119	29%	0.287	63%	0.628	S	S	.	*	P	Polyproline II helix	trans	-92.4	137.9	169.4	89.5	0	0	0	0	108.3	L68 K71	L68-S73 WeakPolarHBondContact CD2-OG 3.43Å; K71-S73 PolarHBondContact O-N 2.98Å
74	P	40.5	Very low	42.7	Very low	84 Å²	84	123.5 Å²	123.5	55%	0.545	64%	0.643	S	S	.	*	P	Polyproline II helix	trans	-60.6	140.2	179.3	23.8	-31.2	0	0	0	110.5	G76 Y77	P74-G76 PolarHBondContact O-N 3.34Å; P74-G76 VanDerWaalsContact O-N 3.14Å; P74-Y77 HydrophobicContact CG-CD2 4.27Å; P74-Y77 HydrophobicContact CG-CE2 4.48Å
75	P	36.8	Very low	42.8	Very low	131 Å²	131	128 Å²	128	85%	0.851	66%	0.661	S	S	*	*	T	Hydrogen-bonded Turn	trans	-60.9	118.9	-179.6	25.2	-31.9	0	0	0	109.1
76	G	43.1	Very low	42.7	Very low	76 Å²	76	124.2 Å²	124.2	78%	0.784	65%	0.653	S	S	*	*	T	Hydrogen-bonded Turn	trans	135.3	-3.5	179.6	0	0	0	0	0	116.5	P74	P74-G76 PolarHBondContact O-N 3.34Å; P74-G76 VanDerWaalsContact O-N 3.14Å
77	Y	36.1	Very low	42.8	Very low	176 Å²	176	124.3 Å²	124.3	69%	0.69	64%	0.642	S	S	*	*			trans	-90.4	111.2	177.4	-96.3	-95.4	0	0	0	112.8	P74	P74-Y77 HydrophobicContact CG-CD2 4.27Å; P74-Y77 HydrophobicContact CG-CE2 4.48Å
78	L	37.7	Very low	42.7	Very low	61 Å²	61	122.7 Å²	122.7	32%	0.319	63%	0.633	S	S	.	*			trans	-73.6	120.2	164.8	-84.4	160.9	0	0	0	109.9	Y80	L78-Y80 PolarHBondContact O-N 3.02Å
79	H	36.3	Very low	42.1	Very low	129 Å²	129	122.7 Å²	122.7	60%	0.597	65%	0.649	S	S	*	*			trans	-81.3	107.1	168.3	-84	-75.7	0	0	0	110.4	V81	H79-V81 PolarHBondContact O-N 3.41Å; H79-V81 VanDerWaalsContact O-N 3.16Å
80	Y	41	Very low	41.8	Very low	112 Å²	112	116.7 Å²	116.7	44%	0.439	63%	0.631	S	S	.	*			trans	-75	100.4	166.7	-61.2	-78.5	0	0	0	109.3	P58 L78 R82	P58-Y80 HydrophobicContact CB-CD1 3.61Å; P58-Y80 HydrophobicContact CB-CE1 3.34Å; P58-Y80 HydrophobicContact CG-CE1 4.13Å; L78-Y80 PolarHBondContact O-N 3.02Å; Y80-R82 PolarHBondContact O-N 3Å
81	V	37.8	Very low	41	Very low	92 Å²	92	117.5 Å²	117.5	56%	0.558	63%	0.634	S	S	*	*			trans	-78.6	106.3	168.7	-176.8	0	0	0	0	107.9	L61 H79 K83	L61-V81 HydrophobicContact CD1-CB 4.48Å; H79-V81 PolarHBondContact O-N 3.41Å; H79-V81 VanDerWaalsContact O-N 3.16Å; V81-K83 HydrophobicContact CG1-CG 3.98Å; V81-K83 PolarHBondContact O-N 3.33Å
82	R	39.4	Very low	40.7	Very low	230 Å²	230	118.7 Å²	118.7	87%	0.868	64%	0.635	S	S	*	*			trans	-66.3	82.9	167.4	-165.7	-175.4	-130.2	170.6	3.8	108.2	Y80 K84	Y80-R82 PolarHBondContact O-N 3Å; R82-K84 PolarHBondContact O-N 2.85Å
83	K	42.1	Very low	40.7	Very low	103 Å²	103	120 Å²	120	45%	0.448	63%	0.627	S	S	.	*			trans	-62.9	128.3	176.1	-78.4	-168.9	176.5	-177.6	0	109.3	V81 D87 F88	V81-K83 HydrophobicContact CG1-CG 3.98Å; V81-K83 PolarHBondContact O-N 3.33Å; K83-D87 VanDerWaalsContact CA-OD2 3.25Å; K83-D87 WeakPolarHBondContact CA-OD2 3.42Å; K83-D87 HydrophobicContact CB-CB 4.04Å; K83-D87 WeakPolarHBondContact CB-OD2 3.35Å; K83-D87 HydrophobicContact CD-CB 4.15Å; K83-D87 HydrophobicContact CG-CB 4.24Å; K83-F88 HydrophobicContact CB-CE2 4.24Å
84	K	38.1	Very low	40.7	Very low	157 Å²	157	126.7 Å²	126.7	68%	0.683	65%	0.654	S	S	*	*			trans	-73.3	158.2	175.7	-72.8	-178.3	179.4	178.7	0	108.5	R82 S86 D87	R82-K84 PolarHBondContact O-N 2.85Å; K84-S86 WeakPolarHBondContact CB-OG 3.45Å; K84-S86 PolarHBondContact O-N 2.95Å; K84-D87 PolarHBondContact N-OD2 2.88Å; K84-D87 WeakPolarHBondContact O-CB 3.22Å; K84-D87 PolarHBondContact O-N 3.39Å
85	K	44.8	Very low	40.9	Very low	195 Å²	195	127.3 Å²	127.3	85%	0.848	67%	0.666	S	S	*	*	G	3₁₀ helix	trans	-50.7	-29.1	174.8	-80.6	-174.4	172.9	-173.7	0	113.1	D87 F88	K85-D87 PolarHBondContact O-N 3.44Å; K85-F88 PolarHBondContact O-N 3.25Å
86	S	45.9	Very low	41.2	Very low	92 Å²	92	127.8 Å²	127.8	64%	0.643	66%	0.657	S	S	*	*	G	3₁₀ helix	trans	-60.9	-23.7	174.8	51.3	0	0	0	0	114.7	K84 F88	K84-S86 WeakPolarHBondContact CB-OG 3.45Å; K84-S86 PolarHBondContact O-N 2.95Å; S86-F88 VanDerWaalsContact C-N 3.32Å
87	D	47.9	Very low	41.3	Very low	86 Å²	86	133.5 Å²	133.5	46%	0.46	66%	0.663	S	S	.	*	G	3₁₀ helix	trans	-87.1	-10.5	-170.6	-52.1	-17.9	0	0	0	111.8	K83 K84 K85	K83-D87 VanDerWaalsContact CA-OD2 3.25Å; K83-D87 WeakPolarHBondContact CA-OD2 3.42Å; K83-D87 HydrophobicContact CB-CB 4.04Å; K83-D87 WeakPolarHBondContact CB-OD2 3.35Å; K83-D87 HydrophobicContact CD-CB 4.15Å; K83-D87 HydrophobicContact CG-CB 4.24Å; K84-D87 PolarHBondContact N-OD2 2.88Å; K84-D87 WeakPolarHBondContact O-CB 3.22Å; K84-D87 PolarHBondContact O-N 3.39Å; K85-D87 PolarHBondContact O-N 3.44Å
88	F	42.7	Very low	41.7	Very low	117 Å²	117	132.6 Å²	132.6	51%	0.513	66%	0.663	S	S	.	*	S	Bend	trans	-97.6	106	167.8	-68.8	-86.5	0	0	0	107.3	K83 K85 S86 A90	K83-F88 HydrophobicContact CB-CE2 4.24Å; K85-F88 PolarHBondContact O-N 3.25Å; S86-F88 VanDerWaalsContact C-N 3.32Å; F88-A90 PolarHBondContact O-N 3.44Å
89	G	37.3	Very low	41.9	Very low	67 Å²	67	138.2 Å²	138.2	69%	0.691	69%	0.687	S	S	*	*			trans	-67.1	47.5	175.5	0	0	0	0	0	113.9	R351	G89-R351 PolarHBondContact O-NH2 3.31Å
90	A	42.9	Very low	42.2	Very low	57 Å²	57	138 Å²	138	47%	0.471	70%	0.697	S	S	.	*			trans	-110.7	100.2	166.3	0	0	0	0	0	106.9	F88 Y92	F88-A90 PolarHBondContact O-N 3.44Å; A90-Y92 VanDerWaalsContact C-N 3.32Å; A90-Y92 HydrophobicContact CB-CD2 4.43Å; A90-Y92 HydrophobicContact CB-CE2 4.2Å; A90-Y92 PolarHBondContact O-N 3.2Å
91	Q	35.8	Very low	42	Very low	197 Å²	197	137.9 Å²	137.9	92%	0.921	71%	0.71	S	S	*	*			trans	-61.5	100	159.6	-78.9	173.4	-19	0	0	106.8
92	Y	40.9	Very low	42.1	Very low	196 Å²	196	141 Å²	141	77%	0.769	72%	0.724	S	S	*	*			trans	-71.7	134.8	155	-76.3	-88.7	0	0	0	106.4	A90 E94	A90-Y92 VanDerWaalsContact C-N 3.32Å; A90-Y92 HydrophobicContact CB-CD2 4.43Å; A90-Y92 HydrophobicContact CB-CE2 4.2Å; A90-Y92 PolarHBondContact O-N 3.2Å; Y92-E94 PolarHBondContact O-N 3.23Å
93	P	43.1	Very low	41.9	Very low	122 Å²	122	137.6 Å²	137.6	79%	0.792	72%	0.722	S	S	*	*			trans	-57.4	115.2	174.1	22.8	-29.8	0	0	0	107.7	A95	P93-A95 PolarHBondContact O-N 3.24Å; P93-A95 VanDerWaalsContact O-N 3.1Å
94	E	45.7	Very low	41.7	Very low	181 Å²	181	139 Å²	139	85%	0.846	73%	0.733	S	S	*	*			trans	-59.4	116	170.1	-71.6	-174.6	160.5	0	0	106.6	Y92 E96	Y92-E94 PolarHBondContact O-N 3.23Å; E94-E96 VanDerWaalsContact C-N 3.3Å; E94-E96 PolarHBondContact O-N 3.08Å
95	A	43.9	Very low	41.7	Very low	97 Å²	97	137.4 Å²	137.4	80%	0.802	74%	0.737	S	S	*	*			trans	-61.6	101.9	162.4	0	0	0	0	0	106.2	P93 E97	P93-A95 PolarHBondContact O-N 3.24Å; P93-A95 VanDerWaalsContact O-N 3.1Å; A95-E97 VanDerWaalsContact C-N 3.34Å; A95-E97 PolarHBondContact O-N 3.24Å
96	E	42.9	Very low	41.4	Very low	140 Å²	140	132.2 Å²	132.2	65%	0.654	73%	0.73	S	S	*	*			trans	-59.3	95.5	171.3	-75.4	-173.4	149.3	0	0	108.7	E94 K98	E94-E96 VanDerWaalsContact C-N 3.3Å; E94-E96 PolarHBondContact O-N 3.08Å; E96-K98 HydrophobicContact CB-CG 4.46Å; E96-K98 PolarHBondContact O-N 3.15Å; E96-K98 IonicContact OE1-NZ 2.98Å; E96-K98 WeakPolarHBondContact OE2-CE 3.44Å; E96-K98 IonicContact OE2-NZ 2.7Å; E96-K98 PolarHBondContact OE2-NZ 3.02Å
97	E	44.9	Very low	41	Very low	196 Å²	196	133.5 Å²	133.5	92%	0.916	74%	0.738	S	S	*	*			trans	-68.2	85.4	152	-88.6	-175.5	153.4	0	0	107.4	A95 E99	A95-E97 VanDerWaalsContact C-N 3.34Å; A95-E97 PolarHBondContact O-N 3.24Å; E97-E99 PolarHBondContact O-N 3.45Å
98	K	44.9	Very low	40.6	Very low	157 Å²	157	137.4 Å²	137.4	68%	0.683	75%	0.754	S	S	*	*			trans	-74.8	108.8	165.7	-91.6	170.9	173.2	143.7	0	109	E96	E96-K98 HydrophobicContact CB-CG 4.46Å; E96-K98 PolarHBondContact O-N 3.15Å; E96-K98 IonicContact OE1-NZ 2.98Å; E96-K98 WeakPolarHBondContact OE2-CE 3.44Å; E96-K98 IonicContact OE2-NZ 2.7Å; E96-K98 PolarHBondContact OE2-NZ 3.02Å
99	E	42.6	Very low	40.5	Very low	179 Å²	179	137.4 Å²	137.4	84%	0.836	76%	0.759	S	S	*	*	P	Polyproline II helix	trans	-54.8	134.5	158.2	-69.4	-174	153.8	0	0	109.9	E97	E97-E99 PolarHBondContact O-N 3.45Å
100	P	42	Very low	40.7	Very low	124 Å²	124	142.1 Å²	142.1	81%	0.805	76%	0.76	S	S	*	*	P	Polyproline II helix	trans	-77.9	129.1	175.4	28.9	-30.1	0	0	0	110.9
101	P	37.3	Very low	40.6	Very low	110 Å²	110	144.7 Å²	144.7	71%	0.714	77%	0.77	S	S	*	*	P	Polyproline II helix	trans	-92.2	157	179.4	37.1	-32.2	0	0	0	111.2
102	D	38.4	Very low	40.9	Very low	157 Å²	157	144.6 Å²	144.6	84%	0.84	77%	0.77	S	S	*	*			trans	-173	128.6	138.5	-97.9	-23.5	0	0	0	111.1
103	L	35.9	Very low	40.8	Very low	159 Å²	159	138.5 Å²	138.5	83%	0.832	77%	0.766	S	S	*	*			trans	-166.2	118.1	133	-100.5	162.1	0	0	0	109.9
104	I	37.8	Very low	40.8	Very low	133 Å²	133	140.9 Å²	140.9	68%	0.682	77%	0.767	S	S	*	*			trans	104.4	93.5	140.2	-58.5	165.2	0	0	0	118.5
105	T	38.5	Very low	40.6	Very low	124 Å²	124	139.2 Å²	139.2	76%	0.761	76%	0.759	S	S	*	*			trans	69.2	128.2	130.7	54.8	0	0	0	0	125
106	A	37.8	Very low	40.4	Very low	85 Å²	85	138.6 Å²	138.6	70%	0.702	75%	0.749	S	S	*	*			trans	77.8	104.2	130.8	0	0	0	0	0	118.2
107	C	37.4	Very low	40.3	Very low	119 Å²	119	141.1 Å²	141.1	80%	0.804	75%	0.752	S	S	*	*				83	124.8	98.3	-77.4	0	0	0	0	111.8
108	E	40	Very low	40.1	Very low	169 Å²	169	141.2 Å²	141.2	79%	0.79	74%	0.744	S	S	*	*			cis	-167	154	43.1	-120.5	161.9	-155.2	0	0	112.5
109	D	39.8	Very low	39.8	Very low	117 Å²	117	138.5 Å²	138.5	63%	0.626	75%	0.745	S	S	*	*			trans	59.6	140.9	144.4	-79.6	0.8	0	0	0	122.5
110	K	42.7	Very low	39.5	Very low	165 Å²	165	136 Å²	136	72%	0.717	75%	0.747	S	S	*	*			cis	170.9	136.5	-6.4	-126.8	-176.4	-151	120	0	105.8
111	V	40.3	Very low	39.3	Very low	111 Å²	111	133.4 Å²	133.4	67%	0.673	74%	0.743	S	S	*	*				161.3	117.6	83.2	174.5	0	0	0	0	107.4
112	Q	42.4	Very low	39.5	Very low	196 Å²	196	136.8 Å²	136.8	92%	0.916	75%	0.749	S	S	*	*				45.7	142.6	107.8	-68.9	176	-34.5	0	0	119.4
113	G	39.4	Very low	39.7	Very low	68 Å²	68	135.1 Å²	135.1	70%	0.701	74%	0.736	S	S	*	*			cis	171.6	168.8	3	0	0	0	0	0	113.6
114	E	42.7	Very low	39.9	Very low	171 Å²	171	134.3 Å²	134.3	80%	0.799	73%	0.726	S	S	*	*			trans	58.8	152.4	143.8	-61.8	-163.2	131.7	0	0	122.2
115	Q	40.3	Very low	39.8	Very low	147 Å²	147	136.5 Å²	136.5	69%	0.687	73%	0.726	S	S	*	*			cis	-176.8	163.5	-4.3	-109.2	-172.4	26.5	0	0	109.2
116	S	40	Very low	39.8	Very low	83 Å²	83	138.8 Å²	138.8	58%	0.58	72%	0.721	S	S	*	*			trans	90.9	116.9	136.5	-96.5	0	0	0	0	125.3
117	R	40.9	Very low	39.9	Very low	194 Å²	194	144.6 Å²	144.6	73%	0.732	72%	0.724	S	S	*	*				91.9	122.7	115.9	-77.3	177.4	178.4	-168.1	2.5	124.5
118	R	40.2	Very low	39.7	Very low	197 Å²	197	144.3 Å²	144.3	74%	0.743	72%	0.724	S	S	*	*				87.9	115.9	119.3	-78.7	-177.6	-178.5	-165.7	-0.7	124.5
119	S	38.5	Very low	39.9	Very low	100 Å²	100	141.8 Å²	141.8	70%	0.699	72%	0.722	S	S	*	*				72.6	135.9	117.1	71.8	0	0	0	0	126.2
120	S	38.1	Very low	40	Very low	127 Å²	127	143.1 Å²	143.1	89%	0.888	73%	0.734	S	S	*	*				111.5	141.5	125.1	75.4	0	0	0	0	122.7
121	G	37.9	Very low	39.7	Very low	69 Å²	69	138.4 Å²	138.4	71%	0.711	73%	0.732	S	S	*	*			trans	134.4	102.4	154.4	0	0	0	0	0	116.4
122	Q	41.4	Very low	40	Very low	181 Å²	181	139 Å²	139	85%	0.846	74%	0.738	S	S	*	*				68.1	141.5	92.6	-74.8	-168.7	-15.4	0	0	115.5
123	E	41.3	Very low	40	Very low	123 Å²	123	135.8 Å²	135.8	58%	0.575	73%	0.734	S	S	*	*			cis	-176.8	159.6	23.2	-129.2	-175.5	157.3	0	0	115.1
124	K	39.7	Very low	39.8	Very low	141 Å²	141	139 Å²	139	61%	0.613	74%	0.74	S	S	*	*			trans	66.4	148.7	144.1	-79.3	162.7	179.2	150.9	0	121.1
125	R	37	Very low	39.7	Very low	179 Å²	179	140.1 Å²	140.1	68%	0.675	75%	0.746	S	S	*	*			cis	-176.8	142.3	15.1	-125.2	165.8	176.3	-175.4	0.8	113
126	R	38.7	Very low	39.5	Very low	173 Å²	173	139.7 Å²	139.7	65%	0.653	75%	0.753	S	S	*	*			trans	65.3	146.7	136.5	-73.8	175.6	179.3	-161.6	-1.2	120.8
127	R	39.1	Very low	39.7	Very low	207 Å²	207	140.8 Å²	140.8	78%	0.781	77%	0.767	S	S	*	*			cis	-169.4	153.2	15.3	-110.8	164	-174.9	-155.3	0.4	110.9
128	S	33.8	Very low	39.5	Very low	113 Å²	113	138.9 Å²	138.9	79%	0.79	77%	0.772	S	S	*	*			trans	-94.5	-153.5	175.7	-36.2	0	0	0	0	112.5
129	P	44	Very low	39.6	Very low	115 Å²	115	136.8 Å²	136.8	75%	0.747	77%	0.774	S	S	*	*			cis	-143.8	-157.7	-22.5	32.7	-7.7	0	0	0	115.2
130	V	42.2	Very low	39.6	Very low	145 Å²	145	138.9 Å²	138.9	88%	0.879	78%	0.778	S	S	*	*			trans	100.7	132.4	158.4	-168.9	0	0	0	0	115
131	G	35.9	Very low	39.7	Very low	66 Å²	66	137.6 Å²	137.6	68%	0.68	77%	0.769	S	S	*	*			cis	154.8	152	5.4	0	0	0	0	0	109.5
132	P	46.3	Very low	39.7	Very low	125 Å²	125	138.6 Å²	138.6	81%	0.812	77%	0.765	S	S	*	*			trans	-104.8	-175.1	-167.1	41.3	-33.5	0	0	0	114.7
133	P	42.3	Very low	39.6	Very low	128 Å²	128	136.1 Å²	136.1	83%	0.831	76%	0.762	S	S	*	*				-159.7	-178.2	105.5	39.8	-17.7	0	0	0	118.6
134	T	35.8	Very low	39.5	Very low	134 Å²	134	134.6 Å²	134.6	82%	0.822	77%	0.765	S	S	*	*			trans	-80.2	159.2	-175.6	-18	0	0	0	0	116.5
135	E	41.2	Very low	39.6	Very low	195 Å²	195	136 Å²	136	91%	0.911	77%	0.774	S	S	*	*			trans	-148.5	147.1	159.4	-110.6	-179.7	-175.3	0	0	113.1
136	T	36	Very low	39.8	Very low	139 Å²	139	132.7 Å²	132.7	85%	0.853	77%	0.77	S	S	*	*			trans	-120.3	153	-173	40.8	0	0	0	0	111.3
137	A	43.1	Very low	40	Very low	105 Å²	105	132 Å²	132	87%	0.868	77%	0.772	S	S	*	*			trans	-161.9	140.9	157	0	0	0	0	0	114.3
138	N	36.3	Very low	40	Very low	155 Å²	155	129.3 Å²	129.3	83%	0.829	77%	0.773	S	S	*	*			trans	-88.1	172.1	-174.5	-72.9	-41.8	0	0	0	115
139	L	43.3	Very low	40	Very low	152 Å²	152	127.9 Å²	127.9	80%	0.796	77%	0.768	S	S	*	*				161.2	112.5	129.6	-82.8	157.6	0	0	0	110.3
140	N	38.9	Very low	39.8	Very low	144 Å²	144	130.4 Å²	130.4	77%	0.77	78%	0.775	S	S	*	*				56.7	141.8	98.1	-69.7	-6.3	0	0	0	115.1
141	S	38.8	Very low	39.6	Very low	100 Å²	100	130.8 Å²	130.8	70%	0.699	77%	0.77	S	S	*	*			cis	-178	155	-0.3	49.3	0	0	0	0	109.6
142	S	38.6	Very low	39.7	Very low	91 Å²	91	133 Å²	133	64%	0.636	77%	0.773	S	S	*	*			trans	72.5	128.8	136.3	62.7	0	0	0	0	124.8
143	T	38.6	Very low	39.3	Very low	128 Å²	128	132 Å²	132	79%	0.785	77%	0.769	S	S	*	*			trans	71.5	145	133	53.6	0	0	0	0	118.9
144	S	40.3	Very low	39	Very low	92 Å²	92	136.9 Å²	136.9	64%	0.643	77%	0.77	S	S	*	*			cis	-179.2	150.4	-1.3	42.9	0	0	0	0	107.4
145	E	40.6	Very low	39.1	Very low	171 Å²	171	136.8 Å²	136.8	80%	0.799	77%	0.769	S	S	*	*			trans	66.3	132.7	141.2	-70	179.7	166.5	0	0	123.4
146	D	41.9	Very low	39	Very low	108 Å²	108	131.7 Å²	131.7	58%	0.578	76%	0.761	S	S	*	*				96.7	108.9	129.9	-83.1	-6.8	0	0	0	122.6
147	K	42.9	Very low	39.1	Very low	160 Å²	160	129.8 Å²	129.8	70%	0.696	75%	0.753	S	S	*	*				82.3	119.3	120.4	-70.9	169.9	-173.8	147.9	0	121.2
148	N	38.9	Very low	38.8	Very low	150 Å²	150	131.3 Å²	131.3	80%	0.802	75%	0.746	S	S	*	*				70.3	111.1	129.5	-78.1	-4.5	0	0	0	121.2
149	A	34.9	Very low	39	Very low	83 Å²	83	129.6 Å²	129.6	69%	0.686	74%	0.737	S	S	*	*				51.5	111.4	118.9	0	0	0	0	0	119.2
150	N	38.1	Very low	38.9	Very low	167 Å²	167	129.2 Å²	129.2	89%	0.893	74%	0.736	S	S	*	*				-173.3	121.2	115.2	-101	-22.3	0	0	0	112.8
151	I	38.2	Very low	38.9	Very low	153 Å²	153	128 Å²	128	79%	0.785	74%	0.738	S	S	*	*			trans	-74.5	150.9	153.1	-63.2	169.2	0	0	0	105.6
152	P	38.6	Very low	38.9	Very low	113 Å²	113	126.5 Å²	126.5	73%	0.734	74%	0.739	S	S	*	*				-151.4	158.8	52.7	23.8	4.5	0	0	0	120.8
153	S	37.8	Very low	39.2	Very low	104 Å²	104	131.8 Å²	131.8	73%	0.727	75%	0.751	S	S	*	*			trans	3.9	135.3	141.6	59.1	0	0	0	0	122.7
154	R	36.6	Very low	39.3	Very low	230 Å²	230	133.8 Å²	133.8	87%	0.868	76%	0.757	S	S	*	*				173.4	116.6	117	-102.5	-179.7	162	171.6	-4.6	109.2
155	V	37.1	Very low	39.1	Very low	132 Å²	132	133.3 Å²	133.3	80%	0.8	77%	0.766	S	S	*	*				76.5	129.5	85.1	174.8	0	0	0	0	114.3
156	A	39	Very low	39.1	Very low	89 Å²	89	134.2 Å²	134.2	74%	0.736	77%	0.767	S	S	*	*			trans	79	144.6	162.7	0	0	0	0	0	116.4
157	S	38	Very low	38.9	Very low	98 Å²	98	136.6 Å²	136.6	69%	0.685	77%	0.774	S	S	*	*			cis	-173.9	149.6	-9	-112.2	0	0	0	0	106.8
158	L	38.4	Very low	38.6	Very low	137 Å²	137	134.9 Å²	134.9	72%	0.717	78%	0.777	S	S	*	*			trans	60	128.3	139.9	-68.2	156.6	0	0	0	122.1
159	D	40.1	Very low	38.4	Very low	119 Å²	119	132.2 Å²	132.2	64%	0.636	78%	0.776	S	S	*	*			trans	69.4	113	133.8	-61.9	-15.8	0	0	0	120.8
160	N	40.9	Very low	38.1	Very low	144 Å²	144	132.4 Å²	132.4	77%	0.77	79%	0.786	S	S	*	*				173.5	132.3	90.8	-96	-52.4	0	0	0	114.4
161	S	39.6	Very low	37.8	Very low	118 Å²	118	128.8 Å²	128.8	83%	0.825	78%	0.779	S	S	*	*			trans	61.9	128.6	135.2	80.3	0	0	0	0	121.1
162	G	37.8	Very low	37.5	Very low	70 Å²	70	127.5 Å²	127.5	72%	0.722	78%	0.778	S	S	*	*			trans	161.4	82.6	148.9	0	0	0	0	0	119
163	K	44.8	Very low	37.1	Very low	201 Å²	201	128.9 Å²	128.9	87%	0.874	78%	0.779	S	S	*	*			trans	73.9	108.7	139.6	-61.8	177.5	179	175.7	0	120.9
164	N	40.5	Very low	36.8	Very low	171 Å²	171	129.8 Å²	129.8	91%	0.914	78%	0.775	S	S	*	*				39.2	122.3	126.2	-61.2	-6.4	0	0	0	121.1
165	G	37.1	Very low	36.6	Very low	81 Å²	81	126.3 Å²	126.3	84%	0.835	77%	0.774	S	S	*	*			trans	171.9	110.5	153.3	0	0	0	0	0	113.4
166	K	39.9	Very low	36.3	Very low	191 Å²	191	124.5 Å²	124.5	83%	0.83	77%	0.767	S	S	*	*			trans	-72.5	160.2	-177.7	-73.6	174.1	165.4	178.2	0	114
167	H	36.8	Very low	36.1	Very low	157 Å²	157	130 Å²	130	73%	0.727	78%	0.775	S	S	*	*			trans	109.5	100.3	146.1	-76.7	-75.4	0	0	0	120
168	V	37.1	Very low	35.7	Very low	125 Å²	125	131.1 Å²	131.1	76%	0.758	78%	0.782	S	S	*	*				63.3	105.7	121.4	-175.3	0	0	0	0	120
169	A	34.7	Very low	35.4	Very low	94 Å²	94	136.2 Å²	136.2	78%	0.777	79%	0.792	S	S	*	*			trans	39.6	102	132.4	0	0	0	0	0	120.6
170	G	29	Very low	34.9	Very low	87 Å²	87	139.4 Å²	139.4	90%	0.897	80%	0.803	S	S	*	*				64.8	91.9	89.1	0	0	0	0	0	118.4
171	A	32.3	Very low	34.5	Very low	90 Å²	90	138.8 Å²	138.8	74%	0.744	80%	0.804	S	S	*	*			trans	-125.6	127	162.3	0	0	0	0	0	110.5
172	V	31.5	Very low	33.8	Very low	126 Å²	126	139.6 Å²	139.6	76%	0.764	80%	0.804	S	S	*	*				72.4	113.2	125.7	-179	0	0	0	0	120.4
173	L	30.6	Very low	33.6	Very low	142 Å²	142	142.5 Å²	142.5	74%	0.743	81%	0.812	S	S	*	*			trans	69.2	133.6	134.7	-68	167.7	0	0	0	124.2
174	D	31.5	Very low	33.1	Very low	124 Å²	124	141.8 Å²	141.8	66%	0.663	81%	0.812	S	S	*	*			trans	68.7	121.4	135.4	-73.7	-22.5	0	0	0	121.7
175	N	32.7	Very low	32.6	Very low	157 Å²	157	144.3 Å²	144.3	84%	0.84	81%	0.808	S	S	*	*				-165.4	111.2	118	-97.4	-37.3	0	0	0	113.2
176	S	30.8	Very low	32.5	Very low	93 Å²	93	148.7 Å²	148.7	65%	0.65	81%	0.812	S	S	*	*			trans	20.3	129.9	131.4	-35.9	0	0	0	0	120.5
177	K	34.8	Very low	32.3	Very low	206 Å²	206	147.2 Å²	147.2	90%	0.896	81%	0.808	S	S	*	*				169.9	136	105.1	-94	172.9	-179.6	175.6	0	113.3
178	S	29.2	Very low	32.1	Very low	120 Å²	120	146.4 Å²	146.4	84%	0.839	81%	0.813	S	S	*	*			trans	-66.1	151.7	-178.3	-27.8	0	0	0	0	115.1
179	R	31.8	Very low	32	Very low	244 Å²	244	144.1 Å²	144.1	92%	0.921	82%	0.815	S	S	*	*			trans	-155.1	116.6	151.4	-123.6	176	176.8	175.5	-1.9	111.3
180	E	28.7	Very low	31.8	Very low	187 Å²	187	146 Å²	146	87%	0.874	82%	0.817	S	S	*	*			trans	-69.6	136.9	167	-74.7	172.6	139.7	0	0	110.4
181	V	32.5	Very low	32	Very low	130 Å²	130	146.7 Å²	146.7	79%	0.788	81%	0.814	S	S	*	*			trans	-139.4	111.8	157.4	-178.9	0	0	0	0	108.3
182	T	26.2	Very low	32.3	Very low	135 Å²	135	146.3 Å²	146.3	83%	0.828	81%	0.811	S	S	*	*			trans	-68.4	138.8	161.4	33.5	0	0	0	0	109.7
183	C	32.2	Very low	32.6	Very low	132 Å²	132	149.1 Å²	149.1	89%	0.892	82%	0.816	S	S	*	*			trans	-139	130.6	163	-120.6	0	0	0	0	111.6
184	E	34.8	Very low	32.9	Very low	185 Å²	185	146.3 Å²	146.3	86%	0.864	81%	0.808	S	S	*	*			trans	-80.8	157.2	-167.1	-66.5	174.6	136.4	0	0	113.5	L186	E184-L186 PolarHBondContact O-N 3.05Å
185	R	29.9	Very low	33.2	Very low	224 Å²	224	149.7 Å²	149.7	85%	0.845	82%	0.817	S	S	*	*			trans	-59.8	107.2	174.2	-167.7	-179	-156.4	163	5.7	112.1	H187	R185-H187 PolarHBondContact O-N 3.46Å
186	L	34.6	Very low	33.7	Very low	173 Å²	173	148.3 Å²	148.3	91%	0.906	81%	0.814	S	S	*	*	P	Polyproline II helix	trans	-75.4	118.9	171.7	-82.9	169.2	0	0	0	111.7	E184	E184-L186 PolarHBondContact O-N 3.05Å
187	H	37.1	Very low	34.1	Very low	161 Å²	161	148.8 Å²	148.8	75%	0.745	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-76.1	137.2	171.2	-83.3	40.4	0	0	0	111.4	R185	R185-H187 PolarHBondContact O-N 3.46Å
188	V	32.7	Very low	34.4	Very low	140 Å²	140	143.3 Å²	143.3	85%	0.848	81%	0.811	S	S	*	*	P	Polyproline II helix	trans	-70.9	126.2	166.3	174.6	0	0	0	0	109.3
189	G	33.9	Very low	35.1	Very low	77 Å²	77	146 Å²	146	79%	0.794	81%	0.808	S	S	*	*			trans	-120.1	118.7	169.6	0	0	0	0	0	110.7
190	T	30.8	Very low	35.5	Very low	133 Å²	133	143.1 Å²	143.1	82%	0.816	81%	0.805	S	S	*	*			trans	-100.1	158.4	172.9	36.5	0	0	0	0	111.8
191	A	33.4	Very low	36	Very low	102 Å²	102	139.7 Å²	139.7	84%	0.843	80%	0.801	S	S	*	*			trans	100.8	116.8	158	0	0	0	0	0	118.5
192	A	38.7	Very low	36.6	Very low	81 Å²	81	139 Å²	139	67%	0.669	80%	0.8	S	S	*	*				167.4	115.6	113.5	0	0	0	0	0	110.9
193	E	38.1	Very low	37.3	Very low	186 Å²	186	141 Å²	141	87%	0.869	80%	0.804	S	S	*	*				82	144.6	120	-67.5	-178.2	175.9	0	0	116.2
194	S	37.5	Very low	37.7	Very low	82 Å²	82	138.8 Å²	138.8	57%	0.573	80%	0.796	S	S	*	*			cis	-175.5	160.4	-17.7	53.8	0	0	0	0	108
195	K	37.4	Very low	37.7	Very low	196 Å²	196	135.6 Å²	135.6	85%	0.852	79%	0.791	S	S	*	*			trans	81.4	131.3	165.4	-54.2	172.5	-179.7	171.6	0	115.6
196	T	41.8	Very low	38	Very low	128 Å²	128	131.5 Å²	131.5	79%	0.785	80%	0.795	S	S	*	*			cis	-162	145.2	39.8	41.2	0	0	0	0	113.2
197	A	39.8	Very low	38.2	Very low	103 Å²	103	132.8 Å²	132.8	85%	0.851	79%	0.794	S	S	*	*			trans	56.2	144.6	141.5	0	0	0	0	0	120.1
198	S	41	Very low	38	Very low	91 Å²	91	130 Å²	130	64%	0.636	80%	0.798	S	S	*	*			cis	-176	147.1	9.7	130.2	0	0	0	0	109.2
199	K	43.8	Very low	38.1	Very low	177 Å²	177	128.5 Å²	128.5	77%	0.77	79%	0.794	S	S	*	*			trans	86.1	115.9	149	-78	170.7	-172.2	-179.8	0	122.5
200	Q	40.7	Very low	38.3	Very low	182 Å²	182	131.7 Å²	131.7	85%	0.85	80%	0.798	S	S	*	*			trans	101.9	131	133.4	-73	174.3	-6.8	0	0	119.1
201	S	39.8	Very low	38.5	Very low	115 Å²	115	129 Å²	129	80%	0.804	80%	0.797	S	S	*	*			trans	-120.3	-162.1	-154.5	-50	0	0	0	0	110.3
202	P	43.8	Very low	38.6	Very low	115 Å²	115	132 Å²	132	75%	0.747	80%	0.799	S	S	*	*				-128.5	-175.5	-95.3	38.6	-18.8	0	0	0	112.2
203	L	40.7	Very low	38.6	Very low	177 Å²	177	139.6 Å²	139.6	93%	0.927	81%	0.81	S	S	*	*			trans	169.1	138.4	156.7	-90.4	155.1	0	0	0	105.9
204	A	41.5	Very low	38.7	Very low	86 Å²	86	136.1 Å²	136.1	71%	0.711	80%	0.804	S	S	*	*			cis	-170.2	168.5	-8.6	0	0	0	0	0	106
205	P	35.6	Very low	38.8	Very low	118 Å²	118	140 Å²	140	77%	0.766	82%	0.816	S	S	*	*			trans	-107.4	161.7	-152	39.1	-32.5	0	0	0	115.8
206	C	36.1	Very low	38.7	Very low	138 Å²	138	139.2 Å²	139.2	93%	0.932	82%	0.816	S	S	*	*			trans	-125.6	127.8	161.2	-78.6	0	0	0	0	111.5
207	K	38.5	Very low	38.7	Very low	201 Å²	201	143.5 Å²	143.5	87%	0.874	82%	0.817	S	S	*	*			trans	-78.1	134.7	-176.3	-68.4	172.6	173.7	177.2	0	111.8
208	A	32.8	Very low	38.5	Very low	101 Å²	101	144.6 Å²	144.6	84%	0.835	82%	0.816	S	S	*	*				63.6	117.8	111.2	0	0	0	0	0	118.7
209	S	35.4	Very low	38.2	Very low	110 Å²	110	152 Å²	152	77%	0.769	83%	0.83	S	S	*	*			trans	-163.9	98.7	142.2	172.8	0	0	0	0	111.6
210	T	38.1	Very low	37.9	Very low	143 Å²	143	151.8 Å²	151.8	88%	0.877	84%	0.836	S	S	*	*			trans	31.8	126	134.3	5.4	0	0	0	0	121.6
211	G	34.6	Very low	37.5	Very low	77 Å²	77	148 Å²	148	79%	0.794	83%	0.83	S	S	*	*			trans	170.8	36.7	159.6	0	0	0	0	0	118.1
212	D	35.9	Very low	37.3	Very low	165 Å²	165	149 Å²	149	88%	0.882	83%	0.832	S	S	*	*			trans	-82.2	124.9	173.6	-82.1	-37.3	0	0	0	112
213	R	38	Very low	37.1	Very low	241 Å²	241	149.1 Å²	149.1	91%	0.909	83%	0.832	S	S	*	*			trans	-130.2	115.4	155.5	-92.3	-169.9	177.4	-165.6	0.6	108.8
214	P	39.2	Very low	36.8	Very low	112 Å²	112	146.7 Å²	146.7	73%	0.727	83%	0.827	S	S	*	*			trans	-84.8	124.9	166.3	31	-27.3	0	0	0	109.8	Q216	P214-Q216 PolarHBondContact O-N 3.45Å
215	I	40.6	Very low	36.2	Very low	165 Å²	165	148.7 Å²	148.7	85%	0.846	83%	0.831	S	S	*	*			trans	-72.1	110.1	168.6	-64.6	173.1	0	0	0	107.7
216	Q	34.8	Very low	36.1	Very low	179 Å²	179	150.5 Å²	150.5	84%	0.836	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-76	120.2	170.2	-73.1	179.9	-7.7	0	0	109.5	P214	P214-Q216 PolarHBondContact O-N 3.45Å
217	R	41.5	Very low	35.9	Very low	217 Å²	217	155.3 Å²	155.3	82%	0.819	83%	0.834	S	S	*	*	P	Polyproline II helix	trans	-81.4	140.5	159.6	-76.3	-174.7	180	-168	-0.9	109.3	R219	R217-R219 PolarHBondContact O-N 3.28Å
218	P	37.5	Very low	35.8	Very low	126 Å²	126	154.2 Å²	154.2	82%	0.818	83%	0.832	S	S	*	*	P	Polyproline II helix	trans	-67.6	127.3	178	25.5	-30.1	0	0	0	110.9	L220	P218-L220 PolarHBondContact O-N 3.41Å
219	R	33.9	Very low	35.8	Very low	248 Å²	248	155.4 Å²	155.4	94%	0.936	83%	0.831	S	S	*	*			trans	-76.3	114.7	167.3	-74.9	-175.7	174.2	179.7	-1.7	108.5	R217	R217-R219 PolarHBondContact O-N 3.28Å
220	L	37.4	Very low	35.8	Very low	171 Å²	171	154.8 Å²	154.8	90%	0.895	83%	0.833	S	S	*	*	P	Polyproline II helix	trans	-86.3	121.4	161.1	-103.1	141.5	0	0	0	108.8	P218	P218-L220 PolarHBondContact O-N 3.41Å
221	S	32.9	Very low	35.8	Very low	104 Å²	104	154.7 Å²	154.7	73%	0.727	83%	0.827	S	S	*	*	P	Polyproline II helix	trans	-68.2	131.4	-175.7	42	0	0	0	0	113.5
222	T	35.6	Very low	36	Very low	136 Å²	136	159.1 Å²	159.1	83%	0.834	82%	0.824	S	S	*	*	P	Polyproline II helix	trans	-74.8	132.8	159.7	45.1	0	0	0	0	110.7
223	P	38.7	Very low	36	Very low	116 Å²	116	157.4 Å²	157.4	75%	0.753	82%	0.815	S	S	*	*	P	Polyproline II helix	trans	-86.4	159.2	163.5	33.7	-28.7	0	0	0	111.4
224	P	34.2	Very low	35.9	Very low	126 Å²	126	152.2 Å²	152.2	82%	0.818	81%	0.805	S	S	*	*	P	Polyproline II helix	trans	-87.5	148.9	-161	34.4	-33.7	0	0	0	114
225	T	30.1	Very low	35.8	Very low	129 Å²	129	157.8 Å²	157.8	79%	0.791	81%	0.812	S	S	*	*	P	Polyproline II helix	trans	-67.1	134.2	163.7	35.2	0	0	0	0	111.7
226	N	33.7	Very low	35.4	Very low	155 Å²	155	157.2 Å²	157.2	83%	0.829	81%	0.811	S	S	*	*			trans	177.8	112.4	144.6	-89.3	-20.9	0	0	0	109.7
227	Y	31.5	Very low	35.7	Very low	239 Å²	239	153.4 Å²	153.4	94%	0.937	80%	0.801	S	S	*	*			trans	-172.7	136.3	130.3	-117.6	-88.1	0	0	0	110.7
228	E	35.8	Very low	35.3	Very low	179 Å²	179	148.9 Å²	148.9	84%	0.836	80%	0.798	S	S	*	*			trans	-68.3	164.4	-176.8	-83.8	-179.6	132.7	0	0	115.4
229	P	33.3	Very low	35.1	Very low	126 Å²	126	148.9 Å²	148.9	82%	0.818	80%	0.796	S	S	*	*			trans	-97.2	151.1	-173.9	37.7	-31.1	0	0	0	114.2
230	A	35.6	Very low	35.1	Very low	97 Å²	97	142.6 Å²	142.6	80%	0.802	79%	0.79	S	S	*	*			trans	-142.7	104.3	159.5	0	0	0	0	0	107.4
231	D	36.7	Very low	34.9	Very low	141 Å²	141	139.1 Å²	139.1	75%	0.754	79%	0.786	S	S	*	*				72.6	92.6	76.1	-153	35.4	0	0	0	112.2
232	K	38.9	Very low	34.8	Very low	169 Å²	169	138.7 Å²	138.7	74%	0.735	79%	0.789	S	S	*	*				158.2	129.1	124.6	-84.8	167	-172.8	175.5	0	115.6
233	D	36.1	Very low	34.7	Very low	130 Å²	130	143.8 Å²	143.8	70%	0.695	79%	0.793	S	S	*	*			trans	68.8	105	140.1	-67.3	-42.8	0	0	0	120.4
234	N	36.5	Very low	34.2	Very low	131 Å²	131	148.4 Å²	148.4	70%	0.701	80%	0.801	S	S	*	*				82.2	101.4	79.7	-99.5	-35.8	0	0	0	115.3
235	R	35.9	Very low	34.3	Very low	230 Å²	230	148.7 Å²	148.7	87%	0.868	80%	0.8	S	S	*	*				143.5	110.6	115.7	-82.3	171.4	-172.6	-169.1	4.1	115.6
236	N	33	Very low	34.3	Very low	153 Å²	153	147.7 Å²	147.7	82%	0.818	80%	0.798	S	S	*	*			trans	-40.3	178.3	141.3	-93.3	-7.6	0	0	0	115.7
237	P	40.6	Very low	34.3	Very low	99 Å²	99	147.7 Å²	147.7	64%	0.643	79%	0.792	S	S	*	*			cis	-145.7	-166.8	-8.5	28.7	-3	0	0	0	115.9
238	T	33.5	Very low	34.3	Very low	122 Å²	122	142.4 Å²	142.4	75%	0.748	78%	0.78	S	S	*	*			trans	76.5	132.1	145.7	34.9	0	0	0	0	117.2
239	T	32.9	Very low	34.2	Very low	126 Å²	126	137 Å²	137	77%	0.773	76%	0.762	S	S	*	*			cis	-168.9	141.9	33.5	33.1	0	0	0	0	109.4
240	S	33.9	Very low	34.3	Very low	116 Å²	116	134.4 Å²	134.4	81%	0.811	75%	0.746	S	S	*	*				165.1	119	121.5	64	0	0	0	0	113.7
241	A	34.5	Very low	34.6	Very low	98 Å²	98	131.9 Å²	131.9	81%	0.81	72%	0.722	S	S	*	*			trans	52.5	112	136.6	0	0	0	0	0	121.9
242	A	30.5	Very low	34.4	Very low	95 Å²	95	129.3 Å²	129.3	79%	0.785	72%	0.715	S	S	*	*				70.1	96	122.9	0	0	0	0	0	120.5
243	R	32.1	Very low	34	Very low	243 Å²	243	131 Å²	131	92%	0.917	72%	0.723	S	S	*	*				-176.8	117.9	112.4	-103.8	175	174	-177.4	-2.4	109.3
244	K	29.8	Very low	33.9	Very low	212 Å²	212	131.4 Å²	131.4	92%	0.922	73%	0.73	S	S	*	*			trans	-80.8	111.9	169.1	-85.5	178.4	173.2	179.7	0	108.2
245	T	35.4	Very low	33.7	Very low	132 Å²	132	133.9 Å²	133.9	81%	0.81	74%	0.737	S	S	*	*			trans	-122.3	91.2	154	50.6	0	0	0	0	106.2	F247	T245-F247 PolarHBondContact O-N 3.29Å
246	S	30.3	Very low	33.4	Very low	108 Å²	108	130.1 Å²	130.1	76%	0.755	73%	0.727	S	S	*	*			trans	-73.2	102.7	172.2	49.3	0	0	0	0	108.4	D248	S246-D248 PolarHBondContact O-N 3.27Å
247	F	34.5	Very low	33.2	Very low	156 Å²	156	128.2 Å²	128.2	68%	0.684	73%	0.726	S	S	*	*			trans	-84.6	91.4	165.6	-152	-96.8	0	0	0	107	T245 S249	T245-F247 PolarHBondContact O-N 3.29Å; F247-S249 PolarHBondContact O-N 3.5Å
248	D	30.6	Very low	32.8	Very low	128 Å²	128	131.4 Å²	131.4	68%	0.684	73%	0.734	S	S	*	*			trans	-74.9	105.2	174.3	-102.8	-28.5	0	0	0	109.2	S246 S250	S246-D248 PolarHBondContact O-N 3.27Å; D248-S250 PolarHBondContact O-N 3.03Å
249	S	34.5	Very low	32.5	Very low	66 Å²	66	129.9 Å²	129.9	46%	0.462	73%	0.734	S	S	.	*			trans	-67.7	76.2	162.9	-175.1	0	0	0	0	109.2	F247 C251 Q491	F247-S249 PolarHBondContact O-N 3.5Å; S249-C251 PolarHBondContact O-N 3.5Å; S249-Q491 PolarHBondContact OG-NE2 3.27Å
250	S	33.7	Very low	32.5	Very low	70 Å²	70	129.8 Å²	129.8	49%	0.49	73%	0.734	S	S	.	*	T	Hydrogen-bonded Turn	trans	-93.7	62.6	-177.4	71.9	0	0	0	0	112	D248 R464	D248-S250 PolarHBondContact O-N 3.03Å; S250-R464 PolarHBondContact OG-NH2 2.86Å; S250-R464 VanDerWaalsContact OG-NH2 3.1Å
251	C	42	Very low	32.4	Very low	45 Å²	45	129.1 Å²	129.1	30%	0.304	74%	0.736	S	S	.	*	T	Hydrogen-bonded Turn	trans	-130.3	15	157.8	-159.5	0	0	0	0	110.1	S249 C457	S249-C251 PolarHBondContact O-N 3.5Å; C251-C457 WeakPolarHBondContact CB-SG 3.23Å; C251-C457 WeakPolarHBondContact SG-CB 3.3Å; C251-C457 CovalentContact SG-SG 2.14Å; C251-C457 PolarHBondContact SG-SG 3.41Å
252	S	33.1	Very low	32.5	Very low	87 Å²	87	128.7 Å²	128.7	61%	0.608	73%	0.727	S	S	*	*	S	Bend	trans	-145.4	58.6	176.5	59	0	0	0	0	114.4
253	K	30.5	Very low	32.9	Very low	204 Å²	204	134.4 Å²	134.4	89%	0.887	73%	0.728	S	S	*	*			trans	-176.4	96.7	158.3	-109.6	164.6	-175.5	174.7	0	109.5
254	T	34.7	Very low	33.1	Very low	138 Å²	138	130.1 Å²	130.1	85%	0.847	72%	0.722	S	S	*	*			trans	-121.8	108.8	163	-23.3	0	0	0	0	106.7
255	Q	31.8	Very low	33.4	Very low	184 Å²	184	126.8 Å²	126.8	86%	0.86	72%	0.715	S	S	*	*			trans	-76.6	134	167.4	-75.4	-178	-18.5	0	0	108.5
256	F	30	Very low	33.5	Very low	150 Å²	150	126.4 Å²	126.4	66%	0.658	71%	0.708	S	S	*	*			trans	-62.4	144.8	-179.2	-82.2	-94.9	0	0	0	113.7	E446	F256-E446 HydrophobicContact CZ-CG 4.09Å
257	S	29.3	Very low	34.1	Very low	113 Å²	113	126.3 Å²	126.3	79%	0.79	70%	0.698	S	S	*	*			trans	-142.9	107.9	153.4	165.7	0	0	0	0	107.8	A259	S257-A259 PolarHBondContact O-N 2.87Å
258	M	31.4	Very low	34.1	Very low	166 Å²	166	124.8 Å²	124.8	82%	0.818	70%	0.697	S	S	*	*			trans	-56.7	119.3	173.9	-83	-176	158.5	0	0	111.2
259	A	27.1	Very low	34.3	Very low	90 Å²	90	127.6 Å²	127.6	74%	0.744	70%	0.703	S	S	*	*			trans	-128.2	57.6	160.8	0	0	0	0	0	109.2	S257 A261	S257-A259 PolarHBondContact O-N 2.87Å; A259-A261 VanDerWaalsContact C-N 3.3Å; A259-A261 PolarHBondContact O-N 3.25Å; A259-A261 VanDerWaalsContact O-N 3.08Å
260	T	33.8	Very low	34.5	Very low	124 Å²	124	131.3 Å²	131.3	76%	0.761	72%	0.717	S	S	*	*	T	Hydrogen-bonded Turn	trans	-80.9	73.3	173.9	43.4	0	0	0	0	110.2
261	A	31.7	Very low	34.6	Very low	103 Å²	103	131.5 Å²	131.5	85%	0.851	72%	0.718	S	S	*	*	T	Hydrogen-bonded Turn	trans	-153.9	6.2	171.7	0	0	0	0	0	116.2	A259	A259-A261 VanDerWaalsContact C-N 3.3Å; A259-A261 PolarHBondContact O-N 3.25Å; A259-A261 VanDerWaalsContact O-N 3.08Å
262	S	35.2	Very low	34.2	Very low	89 Å²	89	135.7 Å²	135.7	62%	0.622	74%	0.738	S	S	*	*	S	Bend	trans	-131.5	5	-170.3	-178.5	0	0	0	0	115.6
263	W	38.9	Very low	34.4	Very low	215 Å²	215	135.3 Å²	135.3	81%	0.814	74%	0.74	S	S	*	*	S	Bend	trans	-95	-7	-172.5	-109	58.5	0	0	0	115.5	D265	W263-D265 VanDerWaalsContact C-N 3.33Å; W263-D265 PolarHBondContact O-N 2.85Å
264	L	37.8	Very low	34.8	Very low	152 Å²	152	134.1 Å²	134.1	80%	0.796	73%	0.731	S	S	*	*	G	3₁₀ helix	trans	-75.2	-18.3	-179.3	-82.2	157	0	0	0	113.8
265	D	34.7	Very low	34.6	Very low	143 Å²	143	135.4 Å²	135.4	77%	0.765	73%	0.73	S	S	*	*	G	3₁₀ helix	trans	-91.5	-0.8	-176	-67	-24.2	0	0	0	114.5	W263	W263-D265 VanDerWaalsContact C-N 3.33Å; W263-D265 PolarHBondContact O-N 2.85Å
266	N	38.6	Very low	34.6	Very low	123 Å²	123	132.7 Å²	132.7	66%	0.658	73%	0.725	S	S	*	*	G	3₁₀ helix	trans	-112.9	6.5	-178.3	-80.8	-37.6	0	0	0	114.4
267	I	41.4	Very low	34.9	Very low	107 Å²	107	132.5 Å²	132.5	55%	0.549	74%	0.737	S	S	.	*	T	Hydrogen-bonded Turn	trans	-82.8	-19	-178	-65.1	176.6	0	0	0	112.2	F269	I267-F269 PolarHBondContact O-N 3.37Å
268	D	35.9	Very low	35.1	Very low	124 Å²	124	133.7 Å²	133.7	66%	0.663	74%	0.739	S	S	*	*	H	α-helix	trans	-69	-15	179.2	-70.6	-23	0	0	0	113.5	L270	D268-L270 PolarHBondContact O-N 3.31Å
269	F	34	Very low	35.1	Very low	187 Å²	187	134.4 Å²	134.4	82%	0.82	74%	0.741	S	S	*	*	H	α-helix	trans	-82.3	-10.6	-175.1	-145.5	-95.6	0	0	0	114.8	I267	I267-F269 PolarHBondContact O-N 3.37Å
270	L	38.2	Very low	35.4	Very low	144 Å²	144	139.2 Å²	139.2	75%	0.754	75%	0.745	S	S	*	*	H	α-helix	trans	-110.8	-11.7	179.6	-72.5	168.4	0	0	0	113.8	D268	D268-L270 PolarHBondContact O-N 3.31Å
271	S	36.1	Very low	35.3	Very low	74 Å²	74	141.3 Å²	141.3	52%	0.517	75%	0.751	S	S	.	*	H	α-helix	trans	-80.1	-34.9	177.7	170.9	0	0	0	0	112.8	A273	S271-A273 PolarHBondContact O-N 3.29Å
272	D	33.4	Very low	35.1	Very low	133 Å²	133	145 Å²	145	71%	0.711	75%	0.753	S	S	*	*	T	Hydrogen-bonded Turn	trans	-82.1	-10.7	-172.1	-79.8	-8.9	0	0	0	114.8
273	A	38	Very low	34.9	Very low	79 Å²	79	147 Å²	147	65%	0.653	76%	0.763	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.2	-5.3	179.5	0	0	0	0	0	114.4	S271	S271-A273 PolarHBondContact O-N 3.29Å
274	Y	38.7	Very low	34.5	Very low	178 Å²	178	145.4 Å²	145.4	70%	0.698	76%	0.762	S	S	*	*	S	Bend	trans	-120	4.9	-170.7	-86.3	-81.7	0	0	0	116.1
275	M	30.3	Very low	34.1	Very low	166 Å²	166	146.4 Å²	146.4	82%	0.818	76%	0.763	S	S	*	*	S	Bend	trans	-127.6	28.4	-168.7	-73.2	-66.7	-177.6	0	0	116.8
276	T	32.2	Very low	33.9	Very low	126 Å²	126	146.7 Å²	146.7	77%	0.773	77%	0.769	S	S	*	*			trans	-135.9	79.9	174.2	50.8	0	0	0	0	114
277	T	35.6	Very low	33.5	Very low	147 Å²	147	149.4 Å²	149.4	90%	0.902	78%	0.782	S	S	*	*			trans	-150.8	116.2	144.1	40.9	0	0	0	0	110.2
278	T	35.2	Very low	32.8	Very low	137 Å²	137	147 Å²	147	84%	0.84	78%	0.784	S	S	*	*			trans	-75.2	141.3	-172.4	40.4	0	0	0	0	115.3
279	E	29.4	Very low	32.6	Very low	182 Å²	182	149 Å²	149	85%	0.85	80%	0.795	S	S	*	*			trans	6.5	116.5	147	-77.6	-175.6	132.2	0	0	119.4
280	K	34.3	Very low	32.5	Very low	191 Å²	191	148.1 Å²	148.1	83%	0.83	80%	0.797	S	S	*	*				175.4	131.7	112.1	-99.2	170.8	180	174	0	112.3
281	L	32.2	Very low	32.3	Very low	168 Å²	168	146.1 Å²	146.1	88%	0.88	79%	0.793	S	S	*	*			trans	75.4	104.2	157.6	-65.7	152.5	0	0	0	118.2
282	M	27.4	Very low	32.2	Very low	181 Å²	181	149.7 Å²	149.7	89%	0.892	81%	0.806	S	S	*	*			trans	-77.8	158.2	161.8	-71.7	-142.2	158.9	0	0	112.1
283	P	30.1	Very low	32.2	Very low	129 Å²	129	148.5 Å²	148.5	84%	0.838	80%	0.803	S	S	*	*				-140.3	167.6	101.1	35.1	-18.7	0	0	0	115.9
284	K	30	Very low	31.9	Very low	183 Å²	183	151.2 Å²	151.2	80%	0.796	81%	0.806	S	S	*	*			trans	-52.5	155.3	-169.5	-79.9	172.7	170.3	-179.9	0	118.6
285	E	29.8	Very low	31.7	Very low	173 Å²	173	147.6 Å²	147.6	81%	0.808	80%	0.803	S	S	*	*			trans	80.2	101.9	155.1	-73.8	169.4	-152.5	0	0	118.4
286	T	31.1	Very low	31.8	Very low	148 Å²	148	144.4 Å²	144.4	91%	0.908	79%	0.794	S	S	*	*				-179.7	149.6	117.5	21.2	0	0	0	0	112
287	I	30.1	Very low	31.7	Very low	180 Å²	180	145.5 Å²	145.5	92%	0.923	80%	0.795	S	S	*	*			trans	-63.3	133.5	176	-66	152.9	0	0	0	109.9
288	G	27.8	Very low	31.5	Very low	58 Å²	58	145.9 Å²	145.9	60%	0.598	79%	0.786	S	S	*	*			trans	151.6	124.5	167.4	0	0	0	0	0	114.1
289	D	30.6	Very low	31.6	Very low	164 Å²	164	148 Å²	148	88%	0.877	78%	0.784	S	S	*	*			trans	72.9	86.7	148.3	-49.1	-27.6	0	0	0	119.2
290	I	32.4	Very low	31.5	Very low	169 Å²	169	145.8 Å²	145.8	87%	0.867	78%	0.777	S	S	*	*			trans	-96.4	120.1	147.5	-60.2	172.9	0	0	0	106	D292	I290-D292 PolarHBondContact O-N 3.34Å
291	P	34.4	Very low	31.5	Very low	103 Å²	103	142.3 Å²	142.3	67%	0.669	78%	0.777	S	S	*	*			trans	-73.9	130.6	-178.5	28.5	-31	0	0	0	110.8	V293	P291-V293 PolarHBondContact O-N 3.04Å
292	D	33.2	Very low	31.4	Very low	148 Å²	148	141.3 Å²	141.3	79%	0.791	77%	0.773	S	S	*	*			trans	-57.2	99.1	167.3	-102	-30.3	0	0	0	110	I290 L294	I290-D292 PolarHBondContact O-N 3.34Å; D292-L294 PolarHBondContact O-N 3.11Å
293	V	32.9	Very low	31.8	Very low	108 Å²	108	139.6 Å²	139.6	66%	0.655	77%	0.772	S	S	*	*	S	Bend	trans	-79.9	57.1	171.3	-172.7	0	0	0	0	109.2	P291	P291-V293 PolarHBondContact O-N 3.04Å
294	L	33.3	Very low	31.8	Very low	136 Å²	136	137.9 Å²	137.9	71%	0.712	76%	0.763	S	S	*	*			trans	-159.9	49.5	162.2	-75.3	-171.8	0	0	0	109.3	D292 P296	D292-L294 PolarHBondContact O-N 3.11Å; L294-P296 WeakPolarHBondContact O-CD 3.34Å
295	T	33.8	Very low	32	Very low	103 Å²	103	135.8 Å²	135.8	63%	0.632	76%	0.761	S	S	*	*			trans	-72.6	122.2	168.2	-1.5	0	0	0	0	108.9	L297	T295-L297 PolarHBondContact O-N 2.93Å
296	P	31.9	Very low	32.3	Very low	99 Å²	99	132.2 Å²	132.2	64%	0.643	76%	0.755	S	S	*	*			trans	-61.7	131.6	167.4	-13.9	27.9	0	0	0	108.3	L294 E298	L294-P296 WeakPolarHBondContact O-CD 3.34Å; P296-E298 PolarHBondContact O-N 2.94Å
297	L	31.4	Very low	32.6	Very low	148 Å²	148	132.1 Å²	132.1	78%	0.775	75%	0.749	S	S	*	*			trans	-25.2	107.4	177	-95.5	86.6	0	0	0	112.8	T295 F299	T295-L297 PolarHBondContact O-N 2.93Å; L297-F299 PolarHBondContact O-N 3.43Å
298	E	31.1	Very low	32.7	Very low	155 Å²	155	131 Å²	131	72%	0.724	75%	0.745	S	S	*	*			trans	-66.1	111	162.7	-68.6	-171.9	163	0	0	107.6	P296 L300	P296-E298 PolarHBondContact O-N 2.94Å; E298-L300 PolarHBondContact O-N 3.37Å; E298-L300 VanDerWaalsContact O-N 3.09Å
299	F	36	Very low	33	Very low	182 Å²	182	133.1 Å²	133.1	80%	0.798	75%	0.748	S	S	*	*			trans	-74.4	97	164.4	-77.1	-84.1	0	0	0	107.6	L297 S301	L297-F299 PolarHBondContact O-N 3.43Å; F299-S301 PolarHBondContact O-N 3.09Å
300	L	28.3	Very low	33	Very low	136 Å²	136	133.4 Å²	133.4	71%	0.712	75%	0.748	S	S	*	*			trans	-51.7	129.8	169.7	-69.9	163.2	0	0	0	110.3	E298	E298-L300 PolarHBondContact O-N 3.37Å; E298-L300 VanDerWaalsContact O-N 3.09Å
301	S	34.6	Very low	32.7	Very low	118 Å²	118	132.4 Å²	132.4	83%	0.825	74%	0.743	S	S	*	*			trans	-135.9	81.3	158.3	-61.3	0	0	0	0	106.9	F299 V303	F299-S301 PolarHBondContact O-N 3.09Å; S301-V303 PolarHBondContact O-N 2.99Å
302	D	29	Very low	32.4	Very low	146 Å²	146	133.5 Å²	133.5	78%	0.781	75%	0.753	S	S	*	*			trans	-72.3	110.2	163.6	-83.1	-31.5	0	0	0	108.6
303	V	35.2	Very low	32	Very low	145 Å²	145	132.1 Å²	132.1	88%	0.879	75%	0.75	S	S	*	*			trans	-143.1	116.2	142.5	-171.6	0	0	0	0	109.1	S301	S301-V303 PolarHBondContact O-N 2.99Å
304	S	31.4	Very low	31.9	Very low	94 Å²	94	131.5 Å²	131.5	66%	0.657	76%	0.757	S	S	*	*			trans	-55.7	137.5	173.2	-153.8	0	0	0	0	113.6
305	D	34.1	Very low	31.7	Very low	139 Å²	139	132.8 Å²	132.8	74%	0.743	76%	0.759	S	S	*	*				166.9	128.5	100.4	-97	-19.1	0	0	0	113.5
306	S	35.8	Very low	31.3	Very low	98 Å²	98	133.9 Å²	133.9	69%	0.685	76%	0.76	S	S	*	*			trans	75.2	122.2	144.9	67.1	0	0	0	0	122.2
307	D	37	Very low	31.2	Very low	145 Å²	145	137 Å²	137	78%	0.775	77%	0.765	S	S	*	*			trans	85.1	76.5	139.5	-57.8	-14.5	0	0	0	121.3
308	N	32.6	Very low	31	Very low	158 Å²	158	134.6 Å²	134.6	85%	0.845	76%	0.761	S	S	*	*				67.6	152.5	119.6	-91.2	-7.8	0	0	0	122.1
309	P	34.3	Very low	31.2	Very low	102 Å²	102	139.5 Å²	139.5	66%	0.662	77%	0.773	S	S	*	*			trans	-114.6	167.5	-139.9	41.4	-31.3	0	0	0	112.7
310	I	31.5	Very low	31.2	Very low	169 Å²	169	139.3 Å²	139.3	87%	0.867	78%	0.775	S	S	*	*			trans	-155.3	129.2	148.9	-88.7	129.2	0	0	0	109.5
311	L	25.1	Very low	31.4	Very low	149 Å²	149	138.9 Å²	138.9	78%	0.78	77%	0.773	S	S	*	*			trans	-57.1	148.4	167.5	-69.6	98.9	0	0	0	112.1
312	S	28.8	Very low	31.5	Very low	126 Å²	126	141.5 Å²	141.5	88%	0.881	78%	0.778	S	S	*	*			trans	-158.1	113.5	133.1	-142	0	0	0	0	113.2
313	T	25	Very low	31.7	Very low	118 Å²	118	142.3 Å²	142.3	72%	0.724	78%	0.775	S	S	*	*			trans	-75.9	134.6	164.3	-12.5	0	0	0	0	109.7
314	A	30.5	Very low	31.7	Very low	96 Å²	96	142.9 Å²	142.9	79%	0.793	77%	0.772	S	S	*	*			trans	-156.2	100.1	159.3	0	0	0	0	0	106.7
315	H	27.7	Very low	31.6	Very low	162 Å²	162	142.1 Å²	142.1	75%	0.75	77%	0.772	S	S	*	*				59.6	102	70.1	-103.9	-43	0	0	0	116.1
316	I	25.7	Very low	31.4	Very low	127 Å²	127	144.2 Å²	144.2	65%	0.651	78%	0.775	S	S	*	*				76.1	151.5	126.7	-78.2	178.1	0	0	0	121.5
317	E	30.1	Very low	31.1	Very low	163 Å²	163	146.2 Å²	146.2	76%	0.762	78%	0.777	S	S	*	*			trans	93.2	91.1	164.4	-83.8	150.2	-140.2	0	0	116.7
318	S	27	Very low	30.7	Very low	98 Å²	98	146 Å²	146	69%	0.685	78%	0.775	S	S	*	*				65.4	98.2	78	75.8	0	0	0	0	114.3
319	W	35.7	Very low	30.7	Very low	259 Å²	259	145.2 Å²	145.2	98%	0.981	77%	0.771	S	S	*	*			trans	-126.6	125.5	158.6	-83.9	54.4	0	0	0	108.7
320	E	35.8	Very low	30.3	Very low	178 Å²	178	143.6 Å²	143.6	83%	0.832	77%	0.773	S	S	*	*			trans	-80.9	158.6	-167.8	-64.6	171.6	138.4	0	0	113.3
321	D	33.2	Very low	30.3	Very low	126 Å²	126	145.5 Å²	145.5	67%	0.674	78%	0.775	S	S	*	*			trans	37.3	111.9	143.2	-73.4	-10.9	0	0	0	119.7
322	D	37.2	Very low	30.6	Very low	173 Å²	173	147.5 Å²	147.5	93%	0.925	78%	0.778	S	S	*	*			trans	-135.2	117.9	132.3	-99.1	-29.9	0	0	0	110
323	K	32.1	Very low	30.7	Very low	164 Å²	164	148 Å²	148	71%	0.713	78%	0.775	S	S	*	*			trans	-87.3	136.6	169.7	-68.5	171.8	-179.5	165.3	0	107.7
324	D	35.8	Very low	31.1	Very low	156 Å²	156	153.3 Å²	153.3	83%	0.834	78%	0.782	S	S	*	*			trans	161.8	104.4	143.5	-79.9	-19.6	0	0	0	107.3
325	A	28.9	Very low	31.2	Very low	78 Å²	78	155.3 Å²	155.3	65%	0.645	78%	0.78	S	S	*	*				78.7	139.9	88.4	0	0	0	0	0	113.8
326	F	30.1	Very low	31.6	Very low	184 Å²	184	153 Å²	153	81%	0.807	79%	0.789	S	S	*	*			trans	88.3	95.1	172	-63.5	-90	0	0	0	116.4
327	L	28.8	Very low	32.1	Very low	139 Å²	139	151.1 Å²	151.1	73%	0.728	79%	0.786	S	S	*	*				85	113.4	72.7	-80	175.9	0	0	0	114.1
328	L	29.3	Very low	32.6	Very low	141 Å²	141	150.9 Å²	150.9	74%	0.738	79%	0.791	S	S	*	*			trans	78.8	140.5	137.6	-117.9	80.8	0	0	0	120.7
329	N	31.9	Very low	33.2	Very low	142 Å²	142	153 Å²	153	76%	0.759	79%	0.794	S	S	*	*			trans	89.5	100.8	166.6	-54.8	-15.8	0	0	0	113.8
330	G	25.9	Very low	33.4	Very low	68 Å²	68	147 Å²	147	70%	0.701	79%	0.786	S	S	*	*			cis	86.5	89.1	46.4	0	0	0	0	0	108.4
331	F	31.6	Very low	33.8	Very low	208 Å²	208	144 Å²	144	91%	0.912	78%	0.78	S	S	*	*			trans	-128.2	110.2	164.1	-113.1	-90.8	0	0	0	110.4
332	F	30.9	Very low	34.2	Very low	191 Å²	191	144 Å²	144	84%	0.838	78%	0.78	S	S	*	*			trans	-60.4	144	174.8	-97.8	-106.5	0	0	0	111.6	R334	F332-R334 PolarHBondContact O-N 3.44Å
333	V	32.1	Very low	34.5	Very low	137 Å²	137	141.8 Å²	141.8	83%	0.83	78%	0.775	S	S	*	*			trans	-39.6	118.2	147.5	176.9	0	0	0	0	108.7
334	R	33.9	Very low	35	Very low	230 Å²	230	140.6 Å²	140.6	87%	0.868	78%	0.776	S	S	*	*			trans	-120.3	115.4	171.8	-149.9	173.2	179.7	170	-1.7	107.6	F332 A336	F332-R334 PolarHBondContact O-N 3.44Å; R334-A336 PolarHBondContact O-N 2.98Å
335	D	31.1	Very low	34.9	Very low	138 Å²	138	141.4 Å²	141.4	74%	0.738	78%	0.775	S	S	*	*			trans	-43.5	117.4	171.7	-75.1	-47.6	0	0	0	110.9	S337	D335-S337 PolarHBondContact O-N 3.49Å
336	A	36.4	Very low	35.4	Very low	114 Å²	114	144.6 Å²	144.6	94%	0.942	78%	0.78	S	S	*	*			trans	-86.5	66.3	164.8	0	0	0	0	0	108.6	R334	R334-A336 PolarHBondContact O-N 2.98Å
337	S	36.7	Very low	35.6	Very low	86 Å²	86	141.7 Å²	141.7	60%	0.601	78%	0.777	S	S	*	*			trans	-129.2	73.3	166.6	63.3	0	0	0	0	108.1	D335	D335-S337 PolarHBondContact O-N 3.49Å
338	D	39.4	Very low	36	Very low	159 Å²	159	142.7 Å²	142.7	85%	0.85	78%	0.778	S	S	*	*			trans	172.2	77.5	156.6	-95.9	-17.7	0	0	0	108.2
339	D	40.6	Very low	36.3	Very low	141 Å²	141	141.4 Å²	141.4	75%	0.754	78%	0.778	S	S	*	*			trans	-137.4	70.3	158	-148.8	-14	0	0	0	108.3	T341	D339-T341 PolarHBondContact O-N 2.92Å; D339-T341 PolarHBondContact OD1-OG1 2.91Å
340	V	40	Very low	36.6	Very low	134 Å²	134	143.8 Å²	143.8	81%	0.812	78%	0.782	S	S	*	*			trans	-83	81.3	160.5	-179.7	0	0	0	0	105.6
341	T	44.4	Very low	37.2	Very low	115 Å²	115	150.4 Å²	150.4	71%	0.706	79%	0.786	S	S	*	*			trans	-95.5	122.6	163	-59.8	0	0	0	0	107.3	D339	D339-T341 PolarHBondContact O-N 2.92Å; D339-T341 PolarHBondContact OD1-OG1 2.91Å
342	D	41.8	Very low	37.5	Very low	126 Å²	126	148.2 Å²	148.2	67%	0.674	78%	0.778	S	S	*	*			trans	-45.9	144	-174.2	-76.8	-54.1	0	0	0	114.1	D344	D342-D344 PolarHBondContact O-N 2.87Å
343	P	41.8	Very low	38.2	Very low	126 Å²	126	144.9 Å²	144.9	82%	0.818	78%	0.776	S	S	*	*			trans	-77.7	73.1	175.3	34.6	-33.7	0	0	0	109.9	E345	P343-E345 PolarHBondContact O-N 3.37Å
344	D	44.1	Very low	39	Very low	140 Å²	140	145.8 Å²	145.8	75%	0.749	77%	0.774	S	S	*	*			trans	-72.6	88.8	162.9	-85.4	-17.8	0	0	0	108.5	D342 I346	D342-D344 PolarHBondContact O-N 2.87Å; D344-I346 PolarHBondContact O-N 2.87Å
345	E	34.1	Very low	39.1	Very low	173 Å²	173	139.2 Å²	139.2	81%	0.808	76%	0.764	S	S	*	*			trans	27.6	61.1	139.1	-148.8	168.9	-153.9	0	0	116.1	P343 T347	P343-E345 PolarHBondContact O-N 3.37Å; E345-T347 VanDerWaalsContact C-N 3.27Å; E345-T347 PolarHBondContact O-N 3.42Å
346	I	38.2	Very low	39.4	Very low	144 Å²	144	138.8 Å²	138.8	74%	0.738	76%	0.761	S	S	*	*			trans	-74.3	91	159.5	-57.5	178.2	0	0	0	106.5	D344 Q348	D344-I346 PolarHBondContact O-N 2.87Å; I346-Q348 HydrophobicContact CG2-CG 3.89Å; I346-Q348 PolarHBondContact O-N 3.2Å
347	T	34.2	Very low	39.5	Very low	123 Å²	123	140.4 Å²	140.4	76%	0.755	75%	0.753	S	S	*	*			trans	-56.2	87.2	155.6	29.1	0	0	0	0	108.4	E345	E345-T347 VanDerWaalsContact C-N 3.27Å; E345-T347 PolarHBondContact O-N 3.42Å
348	Q	37.6	Very low	39.7	Very low	160 Å²	160	141.6 Å²	141.6	75%	0.748	75%	0.753	S	S	*	*			trans	-65.5	129.1	164.6	-71.6	-164.1	-12.1	0	0	107.4	I346 K350	I346-Q348 HydrophobicContact CG2-CG 3.89Å; I346-Q348 PolarHBondContact O-N 3.2Å; Q348-K350 PolarHBondContact O-N 2.72Å
349	P	35.5	Very low	39.5	Very low	114 Å²	114	138.8 Å²	138.8	74%	0.74	74%	0.743	S	S	*	*			trans	-57.9	119.8	172.5	23.2	-30.5	0	0	0	107.7	R351	P349-R351 PolarHBondContact O-N 3.03Å
350	K	37.2	Very low	39.5	Very low	193 Å²	193	138.6 Å²	138.6	84%	0.839	75%	0.747	S	S	*	*			trans	-52.6	103.1	170.6	-165.9	177.8	-174.1	-177.7	0	106.4	Q348 E352	Q348-K350 PolarHBondContact O-N 2.72Å; K350-E352 VanDerWaalsContact C-N 3.32Å; K350-E352 PolarHBondContact O-N 2.95Å
351	R	40.1	Very low	39.5	Very low	207 Å²	207	140.2 Å²	140.2	78%	0.781	74%	0.743	S	S	*	*			trans	-63.6	100	173.8	-78.6	-174.3	177.6	168.6	0.9	106.3	G89 P349	G89-R351 PolarHBondContact O-NH2 3.31Å; P349-R351 PolarHBondContact O-N 3.03Å
352	E	38.2	Very low	39.2	Very low	162 Å²	162	140 Å²	140	76%	0.757	74%	0.744	S	S	*	*			trans	-60.6	133	163.6	-65.3	-170.5	163.1	0	0	106.8	K350 I354	K350-E352 VanDerWaalsContact C-N 3.32Å; K350-E352 PolarHBondContact O-N 2.95Å; E352-I354 PolarHBondContact O-N 3.31Å
353	P	45.1	Very low	39.1	Very low	121 Å²	121	137.5 Å²	137.5	79%	0.786	74%	0.737	S	S	*	*			trans	-55.7	120.6	173	23.7	-30.8	0	0	0	106.5	S355	P353-S355 PolarHBondContact O-N 2.92Å
354	I	47.4	Very low	39.2	Very low	155 Å²	155	140 Å²	140	80%	0.795	74%	0.742	S	S	*	*			trans	-55	113.8	162.2	-62.8	170.8	0	0	0	103.6	E352 L356	E352-I354 PolarHBondContact O-N 3.31Å; I354-L356 PolarHBondContact O-N 2.97Å
355	S	37.1	Very low	39.1	Very low	93 Å²	93	139 Å²	139	65%	0.65	75%	0.745	S	S	*	*			trans	-61.3	88	176.7	49.2	0	0	0	0	107.4	P353 N357	P353-S355 PolarHBondContact O-N 2.92Å; S355-N357 PolarHBondContact O-N 3.44Å; S355-N357 VanDerWaalsContact O-N 3.11Å
356	L	38.3	Very low	39.3	Very low	128 Å²	128	136.9 Å²	136.9	67%	0.67	74%	0.739	S	S	*	*			trans	-60.2	110.4	155.4	-80.3	157.6	0	0	0	103.9	I354 L358	I354-L356 PolarHBondContact O-N 2.97Å; L356-L358 HydrophobicContact CB-CD1 4.37Å; L356-L358 HydrophobicContact CB-CG 4.25Å; L356-L358 PolarHBondContact O-N 3.23Å
357	N	37	Very low	39.4	Very low	148 Å²	148	137.7 Å²	137.7	79%	0.791	74%	0.74	S	S	*	*			trans	-65.4	68.6	168.3	-75.3	-42.8	0	0	0	107.7	S355	S355-N357 PolarHBondContact O-N 3.44Å; S355-N357 VanDerWaalsContact O-N 3.11Å
358	L	41.5	Very low	39.4	Very low	111 Å²	111	137.9 Å²	137.9	58%	0.581	75%	0.746	S	S	*	*			trans	-65.2	128.9	168.7	-79.4	156.2	0	0	0	106	L356 T360	L356-L358 HydrophobicContact CB-CD1 4.37Å; L356-L358 HydrophobicContact CB-CG 4.25Å; L356-L358 PolarHBondContact O-N 3.23Å; L358-T360 PolarHBondContact O-N 3.41Å
359	P	36.1	Very low	39.6	Very low	100 Å²	100	136.6 Å²	136.6	65%	0.649	75%	0.749	S	S	*	*			trans	-51.7	124	168.1	21.3	-29.8	0	0	0	106.9	F361	P359-F361 PolarHBondContact O-N 3.37Å
360	T	39.6	Very low	39.7	Very low	137 Å²	137	142 Å²	142	84%	0.84	76%	0.755	S	S	*	*			trans	-55.9	105.2	176	-55.2	0	0	0	0	106.7	L358	L358-T360 PolarHBondContact O-N 3.41Å
361	F	40.6	Very low	39.7	Very low	168 Å²	168	141.3 Å²	141.3	74%	0.737	76%	0.756	S	S	*	*			trans	-51.6	131.1	169.6	-79.5	-86.1	0	0	0	106.9	P359 S363	P359-F361 PolarHBondContact O-N 3.37Å; F361-S363 PolarHBondContact O-N 3.44Å
362	P	38.2	Very low	39.6	Very low	111 Å²	111	138.3 Å²	138.3	72%	0.721	76%	0.756	S	S	*	*			trans	-53	119	173.1	-18.8	28.8	0	0	0	106.8	L364	P362-L364 PolarHBondContact O-N 2.92Å
363	S	39.4	Very low	39.5	Very low	74 Å²	74	139.2 Å²	139.2	52%	0.517	76%	0.76	S	S	.	*			trans	-58.7	113.4	177.4	102.9	0	0	0	0	106.4	F361 C365	F361-S363 PolarHBondContact O-N 3.44Å; S363-C365 PolarHBondContact O-N 3.44Å
364	L	43.9	Very low	39.3	Very low	178 Å²	178	140.6 Å²	140.6	93%	0.932	76%	0.759	S	S	*	*	T	Hydrogen-bonded Turn	trans	-68	14.9	175.2	-74	166.4	0	0	0	112	P362	P362-L364 PolarHBondContact O-N 2.92Å
365	C	42.3	Very low	39	Very low	118 Å²	118	138.7 Å²	138.7	80%	0.797	76%	0.755	S	S	*	*	T	Hydrogen-bonded Turn	trans	-101.7	-6.2	-177.5	-68.3	0	0	0	0	113.6	S363	S363-C365 PolarHBondContact O-N 3.44Å
366	D	38	Very low	39.3	Very low	129 Å²	129	137.9 Å²	137.9	69%	0.69	75%	0.746	S	S	*	*	S	Bend	trans	-111.4	128.5	177.5	-83.5	-32.5	0	0	0	111.8
367	Q	39.1	Very low	39.5	Very low	162 Å²	162	135.4 Å²	135.4	76%	0.757	74%	0.738	S	S	*	*			trans	83.8	85.4	165.5	-60.6	173	7.8	0	0	117.2	V369	Q367-V369 WeakPolarHBondContact O-CG2 3.37Å; Q367-V369 PolarHBondContact O-N 3.19Å
368	S	35.4	Very low	40.1	Very low	127 Å²	127	136 Å²	136	89%	0.888	74%	0.736	S	S	*	*				24.3	71.4	120.9	65.5	0	0	0	0	117.1
369	V	41.8	Very low	40.3	Very low	133 Å²	133	138.3 Å²	138.3	81%	0.806	74%	0.743	S	S	*	*			trans	-130.8	141.7	165.9	-178.4	0	0	0	0	108.2	Q367	Q367-V369 WeakPolarHBondContact O-CG2 3.37Å; Q367-V369 PolarHBondContact O-N 3.19Å
370	R	37.8	Very low	40.5	Very low	228 Å²	228	135.5 Å²	135.5	86%	0.86	73%	0.728	S	S	*	*			trans	-52.8	141	-159.3	-66.9	175.9	170.8	164.7	-3.9	114.7	D372	R370-D372 PolarHBondContact O-N 3.16Å; R370-D372 VanDerWaalsContact O-N 3.07Å
371	M	36.8	Very low	40.5	Very low	177 Å²	177	135.1 Å²	135.1	87%	0.872	72%	0.715	S	S	*	*	S	Bend	trans	-76.9	31	-175.8	-104.8	-89.8	-162.8	0	0	114.9
372	D	37.3	Very low	40.5	Very low	145 Å²	145	131.4 Å²	131.4	78%	0.775	71%	0.706	S	S	*	*	S	Bend	trans	-127.4	118.2	175.6	-65.2	-46.3	0	0	0	107.8	R370	R370-D372 PolarHBondContact O-N 3.16Å; R370-D372 VanDerWaalsContact O-N 3.07Å
373	E	36.4	Very low	40.3	Very low	180 Å²	180	128.6 Å²	128.6	84%	0.841	69%	0.692	S	S	*	*			trans	73.7	76.8	-173.9	-65.1	-179.1	148	0	0	117	T375	E373-T375 PolarHBondContact O-N 3.23Å; E373-T375 VanDerWaalsContact O-N 3.14Å
374	I	42.2	Very low	40.3	Very low	151 Å²	151	130.9 Å²	130.9	77%	0.774	70%	0.697	S	S	*	*			trans	-79.8	83.1	151.6	-56.5	175.3	0	0	0	107.4	V376	I374-V376 PolarHBondContact O-N 3.17Å
375	T	40.4	Very low	40.3	Very low	115 Å²	115	131.4 Å²	131.4	71%	0.706	69%	0.687	S	S	*	*			trans	-69.8	100.9	160	17.2	0	0	0	0	107.3	E373 P377	E373-T375 PolarHBondContact O-N 3.23Å; E373-T375 VanDerWaalsContact O-N 3.14Å; T375-P377 VanDerWaalsContact O-CD 3.32Å; T375-P377 WeakPolarHBondContact O-CD 3.31Å; T375-P377 VanDerWaalsContact O-N 3.13Å
376	V	42.2	Very low	40.3	Very low	76 Å²	76	128.8 Å²	128.8	46%	0.461	67%	0.67	S	S	.	*			trans	-54.9	119.3	167.3	178.5	0	0	0	0	106.8	I374 E378 A380 K381	I374-V376 PolarHBondContact O-N 3.17Å; V376-E378 PolarHBondContact O-N 3.07Å; V376-A380 HydrophobicContact CG1-CB 3.93Å; V376-K381 HydrophobicContact CG1-CG 4.08Å
377	P	44.2	Very low	40.6	Very low	76 Å²	76	125 Å²	125	49%	0.494	65%	0.648	S	S	.	*			trans	-52.7	136.6	178.4	-23	31.5	0	0	0	109.2	T375 E379 A380 K381	T375-P377 VanDerWaalsContact O-CD 3.32Å; T375-P377 WeakPolarHBondContact O-CD 3.31Å; T375-P377 VanDerWaalsContact O-N 3.13Å; P377-E379 HydrophobicContact CB-CB 4.46Å; P377-E379 PolarHBondContact O-N 3.49Å; P377-E379 VanDerWaalsContact O-N 3.12Å; P377-A380 WeakPolarHBondContact O-CB 3.26Å; P377-A380 PolarHBondContact O-N 2.88Å; P377-K381 PolarHBondContact O-N 3.29Å
378	E	49.6	Very low	40.8	Very low	161 Å²	161	117.9 Å²	117.9	75%	0.752	62%	0.618	S	S	*	*	H	α-helix	trans	-55.1	-33.2	179.1	-157.6	174.7	-155.8	0	0	110.8	V376 A380 K381 V382	V376-E378 PolarHBondContact O-N 3.07Å; E378-A380 VanDerWaalsContact C-N 3.32Å; E378-A380 PolarHBondContact O-N 3.16Å; E378-K381 WeakPolarHBondContact O-CB 3.46Å; E378-K381 PolarHBondContact O-N 2.71Å; E378-K381 VanDerWaalsContact O-N 3.08Å; E378-V382 VanDerWaalsContact O-CG2 3.3Å; E378-V382 WeakPolarHBondContact O-CG2 3.49Å; E378-V382 PolarHBondContact O-N 3.33Å
379	E	44.1	Very low	41.3	Very low	159 Å²	159	113.9 Å²	113.9	74%	0.743	59%	0.593	S	S	*	*	H	α-helix	trans	-57.2	-36	172.4	-65.2	154.8	-167.3	0	0	113.7	P377 V382 A383	P377-E379 HydrophobicContact CB-CB 4.46Å; P377-E379 PolarHBondContact O-N 3.49Å; P377-E379 VanDerWaalsContact O-N 3.12Å; E379-V382 PolarHBondContact O-N 2.95Å; E379-A383 WeakPolarHBondContact O-CB 3.31Å; E379-A383 PolarHBondContact O-N 2.97Å
380	A	41.5	Very low	41.6	Very low	40 Å²	40	114.6 Å²	114.6	33%	0.331	59%	0.592	S	S	.	*	H	α-helix	trans	-77.5	-29.4	175.9	0	0	0	0	0	112.4	V376 P377 E378 V382 I384	V376-A380 HydrophobicContact CG1-CB 3.93Å; P377-A380 WeakPolarHBondContact O-CB 3.26Å; P377-A380 PolarHBondContact O-N 2.88Å; E378-A380 VanDerWaalsContact C-N 3.32Å; E378-A380 PolarHBondContact O-N 3.16Å; A380-V382 VanDerWaalsContact C-N 3.34Å; A380-I384 WeakPolarHBondContact O-CG1 3.37Å; A380-I384 PolarHBondContact O-N 2.66Å
381	K	39.8	Very low	42.3	Very low	129 Å²	129	108.1 Å²	108.1	56%	0.561	58%	0.575	S	S	*	*	H	α-helix	trans	-69.2	-35.4	168.7	-68.5	179.9	-178.7	173.5	0	111	V376 P377 E378	V376-K381 HydrophobicContact CG1-CG 4.08Å; P377-K381 PolarHBondContact O-N 3.29Å; E378-K381 WeakPolarHBondContact O-CB 3.46Å; E378-K381 PolarHBondContact O-N 2.71Å; E378-K381 VanDerWaalsContact O-N 3.08Å
382	V	40.6	Very low	43.7	Very low	91 Å²	91	101.1 Å²	101.1	55%	0.552	54%	0.541	S	S	*	.	H	α-helix	trans	-73.2	-37.7	176.8	174.8	0	0	0	0	111.3	E378 E379 A380 I384 W385 S386	E378-V382 VanDerWaalsContact O-CG2 3.3Å; E378-V382 WeakPolarHBondContact O-CG2 3.49Å; E378-V382 PolarHBondContact O-N 3.33Å; E379-V382 PolarHBondContact O-N 2.95Å; A380-V382 VanDerWaalsContact C-N 3.34Å; V382-I384 PolarHBondContact O-N 2.98Å; V382-W385 CarbonylContact O-C 3.49Å; V382-W385 PolarHBondContact O-N 3.46Å; V382-S386 VanDerWaalsContact O-CB 3.29Å; V382-S386 WeakPolarHBondContact O-CB 3.44Å; V382-S386 PolarHBondContact O-N 3.45Å; V382-S386 PolarHBondContact O-OG 2.87Å
383	A	34.3	Very low	45.4	Very low	51 Å²	51	100.3 Å²	100.3	42%	0.421	53%	0.532	S	S	.	.	H	α-helix	trans	-69.2	-32.6	-178.6	0	0	0	0	0	114.5	E379 W385 S386 H387	E379-A383 WeakPolarHBondContact O-CB 3.31Å; E379-A383 PolarHBondContact O-N 2.97Å; A383-W385 PolarHBondContact O-N 3.25Å; A383-S386 PolarHBondContact O-OG 2.87Å; A383-H387 PolarHBondContact O-NE2 3.33Å
384	I	39.5	Very low	47.5	Very low	123 Å²	123	93.2 Å²	93.2	63%	0.631	50%	0.502	S	S	*	.	H	α-helix	trans	-72.5	-24.6	175.3	-62.2	167.2	0	0	0	110.9	A380 V382	A380-I384 WeakPolarHBondContact O-CG1 3.37Å; A380-I384 PolarHBondContact O-N 2.66Å; V382-I384 PolarHBondContact O-N 2.98Å
385	W	42.3	Very low	49.6	Very low	188 Å²	188	87.2 Å²	87.2	71%	0.712	47%	0.472	S	S	*	.	H	α-helix	trans	-104.6	-5.1	-174.5	-69.1	68.5	0	0	0	113.7	V382 A383 H387	V382-W385 CarbonylContact O-C 3.49Å; V382-W385 PolarHBondContact O-N 3.46Å; A383-W385 PolarHBondContact O-N 3.25Å; W385-H387 VanDerWaalsContact C-N 3.27Å; W385-H387 PolarHBondContact O-N 3.45Å
386	S	42.7	Very low	51.9	Low	64 Å²	64	85 Å²	85	45%	0.448	45%	0.454	S	S	.	.			trans	-79.1	-6	-179.3	58.9	0	0	0	0	113.8	V382 A383 G388	V382-S386 VanDerWaalsContact O-CB 3.29Å; V382-S386 WeakPolarHBondContact O-CB 3.44Å; V382-S386 PolarHBondContact O-N 3.45Å; V382-S386 PolarHBondContact O-OG 2.87Å; A383-S386 PolarHBondContact O-OG 2.87Å; S386-G388 PolarHBondContact O-N 2.96Å; S386-G388 VanDerWaalsContact O-N 3.08Å
387	H	43.9	Very low	54.1	Low	49 Å²	49	82.7 Å²	82.7	23%	0.227	44%	0.442	C	S	.	.	S	Bend	trans	-84.8	59.9	-175.6	-62.5	-48.3	0	0	0	114	P60 A383 W385 A389 I473	P60-H387 HydrophobicContact CB-CB 3.73Å; P60-H387 HydrophobicContact CG-CB 4.04Å; A383-H387 PolarHBondContact O-NE2 3.33Å; W385-H387 VanDerWaalsContact C-N 3.27Å; W385-H387 PolarHBondContact O-N 3.45Å; H387-A389 PolarHBondContact O-N 3.48Å; H387-I473 HydrophobicContact CB-CG2 3.9Å
388	G	44.4	Very low	56.4	Low	13 Å²	13	79 Å²	79	13%	0.134	42%	0.418	C	S	.	.	S	Bend	trans	54.3	10.8	167.9	0	0	0	0	0	116.6	S386 N390 N391	S386-G388 PolarHBondContact O-N 2.96Å; S386-G388 VanDerWaalsContact O-N 3.08Å; G388-N390 PolarHBondContact O-N 3.44Å; G388-N391 PolarHBondContact O-N 3.03Å
389	A	46.7	Very low	58.4	Low	42 Å²	42	77.3 Å²	77.3	35%	0.347	41%	0.405	S	S	.	.	G	3₁₀ helix	trans	-66.4	-26.6	-168.8	0	0	0	0	0	111.4	H387 N391 I473	H387-A389 PolarHBondContact O-N 3.48Å; A389-N391 PolarHBondContact O-N 3.06Å; A389-I473 HydrophobicContact CB-CD1 3.82Å
390	N	47.2	Very low	60.7	Low	148 Å²	148	75.3 Å²	75.3	79%	0.791	40%	0.399	S	S	*	.	G	3₁₀ helix	trans	-69.9	-8.1	175	-63.7	-10.2	0	0	0	113.3	G388	G388-N390 PolarHBondContact O-N 3.44Å
391	N	53.2	Low	63.2	Low	93 Å²	93	74 Å²	74	50%	0.497	39%	0.386	S	S	.	.	G	3₁₀ helix	trans	-121.4	2.7	-173	-129.7	16.5	0	0	0	114.9	G388 A389 Q393	G388-N391 PolarHBondContact O-N 3.03Å; A389-N391 PolarHBondContact O-N 3.06Å; N391-Q393 VanDerWaalsContact C-N 3.34Å; N391-Q393 PolarHBondContact O-N 3.47Å
392	I	65.2	Low	65.9	Low	30 Å²	30	68.3 Å²	68.3	15%	0.154	36%	0.361	C	S	.	.			trans	-78.9	90.4	174.1	-51	178	0	0	0	108.9	P58 L469 I473	P58-I392 HydrophobicContact CG-CG1 4.32Å; I392-L469 HydrophobicContact CB-CD1 4.49Å; I392-L469 HydrophobicContact CB-CD2 4.46Å; I392-L469 HydrophobicContact CD1-CD2 4.02Å; I392-L469 HydrophobicContact CG2-CD1 4.01Å; I392-L469 HydrophobicContact CG2-CD2 3.63Å; I392-L469 HydrophobicContact CG2-CG 4.5Å; I392-I473 HydrophobicContact CD1-CD1 4.08Å; I392-I473 HydrophobicContact CD1-CG1 4.1Å
393	Q	72.6	Confident	68.5	Low	127 Å²	127	66.5 Å²	66.5	59%	0.593	35%	0.353	S	S	*	.			trans	-61.4	148.9	-177.7	-62.4	-172.7	-0.7	0	0	111.8	N391 R465	N391-Q393 VanDerWaalsContact C-N 3.34Å; N391-Q393 PolarHBondContact O-N 3.47Å; Q393-R465 PolarHBondContact O-NH1 2.79Å; Q393-R465 PolarHBondContact O-NH2 2.93Å
394	S	81	Confident	71.4	Confident	31 Å²	31	66.2 Å²	66.2	22%	0.217	35%	0.346	C	S	.	.			trans	-58.9	144.6	163.8	57.5	0	0	0	0	110	Q396	S394-Q396 PolarHBondContact O-N 3.2Å
395	N	86.3	Confident	74.1	Confident	25 Å²	25	60.4 Å²	60.4	13%	0.134	32%	0.316	C	S	.	.			trans	-57.6	114.7	172	-175.7	-36.3	0	0	0	109.9	A397 I398 R399 D489	N395-A397 VanDerWaalsContact C-N 3.34Å; N395-A397 PolarHBondContact O-N 3.36Å; N395-A397 PolarHBondContact OD1-N 3.29Å; N395-A397 VanDerWaalsContact OD1-N 3.14Å; N395-I398 HydrophobicContact CB-CB 4.21Å; N395-I398 HydrophobicContact CB-CD1 3.96Å; N395-I398 HydrophobicContact CB-CG1 4.23Å; N395-I398 PolarHBondContact O-N 3.1Å; N395-I398 PolarHBondContact OD1-N 3.2Å; N395-R399 WeakPolarHBondContact O-CB 3.49Å; N395-R399 PolarHBondContact O-N 3.18Å; N395-D489 VanDerWaalsContact CB-OD2 3.32Å; N395-D489 WeakPolarHBondContact CB-OD2 3.45Å; N395-D489 PolarHBondContact ND2-OD2 2.97Å
396	Q	87.8	Confident	76.6	Confident	70 Å²	70	52.4 Å²	52.4	33%	0.327	29%	0.292	S	S	.	.	H	α-helix	trans	-64.7	-37.8	-171.7	-68.3	-61.9	-18.5	0	0	112.4	S394 R399 L400	S394-Q396 PolarHBondContact O-N 3.2Å; Q396-R399 PolarHBondContact O-N 2.64Å; Q396-L400 WeakPolarHBondContact O-CG 3.34Å; Q396-L400 PolarHBondContact O-N 2.86Å
397	A	88.7	Confident	79.1	Confident	26 Å²	26	54.9 Å²	54.9	22%	0.215	30%	0.297	C	S	.	.	H	α-helix	trans	-64	-44.1	177.7	0	0	0	0	0	111.2	P49 F50 N395 L401	P49-A397 HydrophobicContact CG-CB 3.83Å; F50-A397 HydrophobicContact CD1-CB 3.76Å; F50-A397 HydrophobicContact CE1-CB 4.08Å; N395-A397 VanDerWaalsContact C-N 3.34Å; N395-A397 PolarHBondContact O-N 3.36Å; N395-A397 PolarHBondContact OD1-N 3.29Å; N395-A397 VanDerWaalsContact OD1-N 3.14Å; A397-L401 WeakPolarHBondContact O-CB 3.15Å; A397-L401 PolarHBondContact O-N 3.35Å
398	I	93.2	Very high	81.7	Confident	0 Å²	0	52.8 Å²	52.8	0%	0	29%	0.287	C	S	.	.	H	α-helix	trans	-68.5	-39.1	177.4	-62.4	171.8	0	0	0	110.7	F50 N395 L400 L401 H402 Y461 D489 E492	F50-I398 HydrophobicContact CE1-CD1 4.32Å; F50-I398 HydrophobicContact CE1-CG1 4.06Å; F50-I398 HydrophobicContact CZ-CD1 4.04Å; F50-I398 HydrophobicContact CZ-CG1 4.25Å; N395-I398 HydrophobicContact CB-CB 4.21Å; N395-I398 HydrophobicContact CB-CD1 3.96Å; N395-I398 HydrophobicContact CB-CG1 4.23Å; N395-I398 PolarHBondContact O-N 3.1Å; N395-I398 PolarHBondContact OD1-N 3.2Å; I398-L400 PolarHBondContact O-N 2.14Å; I398-L401 PolarHBondContact O-N 3.11Å; I398-H402 WeakPolarHBondContact O-CB 3.42Å; I398-H402 PolarHBondContact O-N 3.41Å; I398-Y461 HydrophobicContact CD1-CE2 4.29Å; I398-Y461 WeakPolarHBondContact CD1-OH 3.24Å; I398-Y461 HydrophobicContact CG2-CD1 4.41Å; I398-Y461 HydrophobicContact CG2-CE1 3.69Å; I398-Y461 HydrophobicContact CG2-CE2 4.48Å; I398-D489 HydrophobicContact CD1-CB 3.54Å; I398-D489 VanDerWaalsContact CD1-O 3.24Å; I398-D489 WeakPolarHBondContact CD1-O 3.36Å; I398-E492 HydrophobicContact CG2-CG 4.05Å
399	R	92.5	Very high	84.1	Confident	124 Å²	124	52.1 Å²	52.1	47%	0.468	28%	0.281	S	S	.	.	H	α-helix	trans	-60.7	-45.3	176.9	-174.6	173.5	69.7	155.6	10.2	112.2	N395 Q396 L401 H402 S403	N395-R399 WeakPolarHBondContact O-CB 3.49Å; N395-R399 PolarHBondContact O-N 3.18Å; Q396-R399 PolarHBondContact O-N 2.64Å; R399-L401 VanDerWaalsContact C-N 3.34Å; R399-H402 PolarHBondContact O-N 2.93Å; R399-S403 PolarHBondContact O-N 2.9Å
400	L	92	Very high	86.5	Confident	117 Å²	117	50.7 Å²	50.7	61%	0.613	27%	0.27	S	S	*	.	H	α-helix	trans	-62.3	-44.3	175.2	-70.4	172.4	0	0	0	110.9	Q396 I398 H402 S403 T404	Q396-L400 WeakPolarHBondContact O-CG 3.34Å; Q396-L400 PolarHBondContact O-N 2.86Å; I398-L400 PolarHBondContact O-N 2.14Å; L400-H402 PolarHBondContact O-N 3.5Å; L400-S403 WeakPolarHBondContact O-CB 3.28Å; L400-S403 PolarHBondContact O-N 3.5Å; L400-T404 PolarHBondContact O-N 3.35Å; L400-T404 VanDerWaalsContact O-N 3.13Å; L400-T404 PolarHBondContact O-OG1 3.17Å
401	L	94.1	Very high	88.8	Confident	13 Å²	13	47.7 Å²	47.7	7%	0.068	25%	0.25	C	C	.	.	H	α-helix	trans	-63.8	-39.3	178.4	-175.2	52.8	0	0	0	112.7	I44 A397 I398 R399 T404 L405 Y493 C496 L500	I44-L401 HydrophobicContact CD1-CD1 3.37Å; I44-L401 HydrophobicContact CG1-CD1 4.36Å; A397-L401 WeakPolarHBondContact O-CB 3.15Å; A397-L401 PolarHBondContact O-N 3.35Å; I398-L401 PolarHBondContact O-N 3.11Å; R399-L401 VanDerWaalsContact C-N 3.34Å; L401-T404 PolarHBondContact O-N 3.48Å; L401-L405 VanDerWaalsContact O-CB 3.24Å; L401-L405 WeakPolarHBondContact O-CB 3.4Å; L401-L405 PolarHBondContact O-N 3.43Å; L401-Y493 HydrophobicContact CD2-CD2 3.9Å; L401-Y493 HydrophobicContact CD2-CE2 4.14Å; L401-C496 HydrophobicContact CD1-CB 4.32Å; L401-C496 HydrophobicContact CD2-CB 3.27Å; L401-C496 HydrophobicContact CG-CB 3.58Å; L401-L500 HydrophobicContact CD1-CD1 4.04Å
402	H	95.8	Very high	90.9	Very high	9 Å²	9	43.3 Å²	43.3	4%	0.042	23%	0.226	C	C	.	.	H	α-helix	trans	-65.1	-36.1	173.5	-77.3	-178.1	0	0	0	113.1	I398 R399 L400 G406 I458 Y461 Y462 E492 C496	I398-H402 WeakPolarHBondContact O-CB 3.42Å; I398-H402 PolarHBondContact O-N 3.41Å; R399-H402 PolarHBondContact O-N 2.93Å; L400-H402 PolarHBondContact O-N 3.5Å; H402-G406 PolarHBondContact O-N 2.95Å; H402-I458 HydrophobicContact CB-CG2 4.25Å; H402-Y461 AromaticContact CE1-CD1 3.36Å; H402-Y461 WeakPolarHBondContact CE1-CD1 3.48Å; H402-Y461 AromaticContact CE1-CE1 3.86Å; H402-Y461 AromaticContact CE1-CG 3.88Å; H402-Y462 AromaticContact ND1-CE2 3.26Å; H402-Y462 VanDerWaalsContact ND1-CE2 3.26Å; H402-Y462 WeakPolarHBondContact ND1-CE2 3.18Å; H402-Y462 AromaticContact ND1-CZ 3.47Å; H402-Y462 PolarHBondContact ND1-OH 3.07Å; H402-E492 IonicContact CE1-OE1 3.26Å; H402-E492 IonicContact NE2-OE1 3.45Å; H402-E492 PolarHBondContact NE2-OE1 3.35Å; H402-C496 PolarHBondContact CD2-SG 3.01Å; H402-C496 PolarHBondContact NE2-SG 3.39Å; H402-C496 VanDerWaalsContact NE2-SG 3.38Å
403	S	94.5	Very high	92.4	Very high	54 Å²	54	43.4 Å²	43.4	38%	0.378	23%	0.227	S	C	.	.	H	α-helix	trans	-60.9	-51.1	173.6	-175.3	0	0	0	0	110.5	R399 L400 G406 Q407	R399-S403 PolarHBondContact O-N 2.9Å; L400-S403 WeakPolarHBondContact O-CB 3.28Å; L400-S403 PolarHBondContact O-N 3.5Å; S403-G406 PolarHBondContact O-N 3.15Å; S403-Q407 WeakPolarHBondContact O-CG 3.31Å; S403-Q407 PolarHBondContact O-N 2.85Å
404	T	95.1	Very high	93.6	Very high	45 Å²	45	43.5 Å²	43.5	28%	0.276	23%	0.229	S	C	.	.	H	α-helix	trans	-63.4	-45.6	177.7	-53.9	0	0	0	0	112.2	I40 L400 L401 G406 Q407 Q408	I40-T404 HydrophobicContact CD1-CG2 4.15Å; I40-T404 HydrophobicContact CG2-CG2 3.59Å; L400-T404 PolarHBondContact O-N 3.35Å; L400-T404 VanDerWaalsContact O-N 3.13Å; L400-T404 PolarHBondContact O-OG1 3.17Å; L401-T404 PolarHBondContact O-N 3.48Å; T404-G406 PolarHBondContact O-N 2.92Å; T404-Q407 PolarHBondContact O-N 3.49Å; T404-Q408 WeakPolarHBondContact O-CG 3.46Å; T404-Q408 PolarHBondContact O-N 2.81Å
405	L	96.3	Very high	94.3	Very high	0 Å²	0	42.7 Å²	42.7	0%	0	22%	0.222	C	C	.	.	H	α-helix	trans	-61.3	-43.4	177.5	176.4	62.5	0	0	0	111.4	L401 Q407 Q408 L409 I458 C496 R499 L500 I503	L401-L405 VanDerWaalsContact O-CB 3.24Å; L401-L405 WeakPolarHBondContact O-CB 3.4Å; L401-L405 PolarHBondContact O-N 3.43Å; L405-Q407 PolarHBondContact O-N 2.85Å; L405-Q408 PolarHBondContact O-N 3.39Å; L405-L409 HydrophobicContact CD1-CD1 3.98Å; L405-L409 HydrophobicContact CD1-CG 4.04Å; L405-L409 HydrophobicContact CD2-CD1 4.46Å; L405-L409 HydrophobicContact CG-CD1 3.84Å; L405-L409 HydrophobicContact CG-CG 4.34Å; L405-L409 WeakPolarHBondContact O-CB 3.44Å; L405-L409 WeakPolarHBondContact O-CG 3.22Å; L405-L409 PolarHBondContact O-N 2.91Å; L405-I458 HydrophobicContact CD2-CD1 4.21Å; L405-I458 HydrophobicContact CD2-CG1 4.28Å; L405-I458 HydrophobicContact CG-CD1 4.26Å; L405-C496 HydrophobicContact CD2-CB 4.41Å; L405-R499 HydrophobicContact CD1-CB 3.98Å; L405-R499 HydrophobicContact CD2-CB 4.25Å; L405-L500 HydrophobicContact CB-CD2 4.49Å; L405-L500 HydrophobicContact CD1-CD2 3.81Å; L405-L500 HydrophobicContact CD1-CG 3.97Å; L405-I503 HydrophobicContact CD1-CD1 3.78Å
406	G	95.8	Very high	94.8	Very high	20 Å²	20	41.5 Å²	41.5	21%	0.206	22%	0.216	C	C	.	.	H	α-helix	trans	-61.9	-40.7	178	0	0	0	0	0	112.6	H402 S403 T404 G410	H402-G406 PolarHBondContact O-N 2.95Å; S403-G406 PolarHBondContact O-N 3.15Å; T404-G406 PolarHBondContact O-N 2.92Å; G406-G410 PolarHBondContact O-N 3.32Å
407	Q	96	Very high	95.1	Very high	117 Å²	117	43.3 Å²	43.3	55%	0.547	22%	0.224	S	C	.	.	H	α-helix	trans	-62.8	-46.4	173.7	-71.9	174.2	-11.9	0	0	111.9	S403 T404 L405 G410 K411	S403-Q407 WeakPolarHBondContact O-CG 3.31Å; S403-Q407 PolarHBondContact O-N 2.85Å; T404-Q407 PolarHBondContact O-N 3.49Å; L405-Q407 PolarHBondContact O-N 2.85Å; Q407-G410 PolarHBondContact O-N 2.94Å; Q407-K411 WeakPolarHBondContact O-CG 3.19Å; Q407-K411 PolarHBondContact O-N 3.43Å
408	Q	96.8	Very high	95.3	Very high	4 Å²	4	47.6 Å²	47.6	2%	0.019	24%	0.235	C	C	.	.	H	α-helix	trans	-68.2	-38.2	180	-64.3	-55.1	-34.1	0	0	112.4	E36 V37 I40 T404 L405 K411 A412 L500 I503	E36-Q408 PolarHBondContact OE1-NE2 3.19Å; V37-Q408 HydrophobicContact CG2-CB 4.39Å; V37-Q408 HydrophobicContact CG2-CG 4.25Å; I40-Q408 HydrophobicContact CD1-CG 3.91Å; T404-Q408 WeakPolarHBondContact O-CG 3.46Å; T404-Q408 PolarHBondContact O-N 2.81Å; L405-Q408 PolarHBondContact O-N 3.39Å; Q408-K411 PolarHBondContact O-N 3.09Å; Q408-A412 VanDerWaalsContact O-CB 3.32Å; Q408-A412 WeakPolarHBondContact O-CB 3.26Å; Q408-A412 PolarHBondContact O-N 3.4Å; Q408-L500 HydrophobicContact CB-CD2 4.33Å; Q408-L500 HydrophobicContact CG-CD2 4.3Å; Q408-I503 HydrophobicContact CB-CD1 4.16Å
409	L	96.6	Very high	95.3	Very high	0 Å²	0	47.6 Å²	47.6	0%	0	24%	0.235	C	C	.	.	H	α-helix	trans	-63.1	-45.3	172.2	-77.5	171.1	0	0	0	111.4	L405 K411 A412 I413 L451 K454 Q455 I458 I503	L405-L409 HydrophobicContact CD1-CD1 3.98Å; L405-L409 HydrophobicContact CD1-CG 4.04Å; L405-L409 HydrophobicContact CD2-CD1 4.46Å; L405-L409 HydrophobicContact CG-CD1 3.84Å; L405-L409 HydrophobicContact CG-CG 4.34Å; L405-L409 WeakPolarHBondContact O-CB 3.44Å; L405-L409 WeakPolarHBondContact O-CG 3.22Å; L405-L409 PolarHBondContact O-N 2.91Å; L409-K411 PolarHBondContact O-N 3.37Å; L409-A412 PolarHBondContact O-N 3.07Å; L409-I413 WeakPolarHBondContact O-CB 3.4Å; L409-I413 VanDerWaalsContact O-CG1 3.25Å; L409-I413 WeakPolarHBondContact O-CG1 3.46Å; L409-I413 PolarHBondContact O-N 3.25Å; L409-L451 HydrophobicContact CD2-CD2 4.1Å; L409-K454 HydrophobicContact CD1-CB 4.28Å; L409-K454 HydrophobicContact CD2-CB 3.99Å; L409-Q455 HydrophobicContact CD1-CB 4.42Å; L409-I458 HydrophobicContact CD1-CD1 4.08Å; L409-I503 HydrophobicContact CD2-CD1 3.59Å; L409-I503 HydrophobicContact CD2-CG1 3.96Å; L409-I503 HydrophobicContact CG-CD1 3.74Å
410	G	95.7	Very high	95.3	Very high	12 Å²	12	42 Å²	42	12%	0.124	22%	0.215	C	C	.	.	H	α-helix	trans	-57.8	-46.9	176.4	0	0	0	0	0	112.3	G406 Q407 M414	G406-G410 PolarHBondContact O-N 3.32Å; Q407-G410 PolarHBondContact O-N 2.94Å; G410-M414 WeakPolarHBondContact O-CB 3.15Å; G410-M414 WeakPolarHBondContact O-CG 3.31Å; G410-M414 PolarHBondContact O-N 3.48Å; G410-M414 VanDerWaalsContact O-N 3.09Å
411	K	96.2	Very high	95.2	Very high	85 Å²	85	39.1 Å²	39.1	37%	0.37	20%	0.204	S	C	.	.	H	α-helix	trans	-58.8	-47.6	173.3	-72.3	179.4	179	-175.1	0	111.8	E36 Q407 Q408 L409 M414 N415	E36-K411 VanDerWaalsContact CD-NZ 3.33Å; E36-K411 IonicContact OE1-NZ 3.79Å; E36-K411 PolarHBondContact OE1-NZ 2.9Å; E36-K411 IonicContact OE2-NZ 3.29Å; E36-K411 PolarHBondContact OE2-NZ 3.33Å; E36-K411 VanDerWaalsContact OE2-NZ 3.12Å; Q407-K411 WeakPolarHBondContact O-CG 3.19Å; Q407-K411 PolarHBondContact O-N 3.43Å; Q408-K411 PolarHBondContact O-N 3.09Å; L409-K411 PolarHBondContact O-N 3.37Å; K411-M414 PolarHBondContact O-N 3.03Å; K411-N415 WeakPolarHBondContact O-CB 3.34Å; K411-N415 VanDerWaalsContact O-CG 3.29Å; K411-N415 PolarHBondContact O-N 3.32Å; K411-N415 PolarHBondContact O-ND2 2.88Å
412	A	97.3	Very high	95	Very high	0 Å²	0	39.6 Å²	39.6	0%	0	21%	0.207	C	C	.	.	H	α-helix	trans	-62.9	-44.8	-178.8	0	0	0	0	0	112.4	Q408 L409 N415 C416 L451 I503 F506 Y507	Q408-A412 VanDerWaalsContact O-CB 3.32Å; Q408-A412 WeakPolarHBondContact O-CB 3.26Å; Q408-A412 PolarHBondContact O-N 3.4Å; L409-A412 PolarHBondContact O-N 3.07Å; A412-N415 PolarHBondContact O-N 3.15Å; A412-C416 WeakPolarHBondContact O-CB 3.35Å; A412-C416 PolarHBondContact O-N 3.36Å; A412-L451 HydrophobicContact CB-CD1 4Å; A412-L451 HydrophobicContact CB-CD2 4.1Å; A412-I503 HydrophobicContact CB-CG2 4.01Å; A412-F506 HydrophobicContact CB-CD1 4.24Å; A412-F506 HydrophobicContact CB-CE1 4.1Å; A412-Y507 VanDerWaalsContact CA-OH 3.22Å; A412-Y507 WeakPolarHBondContact CA-OH 3.48Å; A412-Y507 HydrophobicContact CB-CE2 4.25Å; A412-Y507 PolarHBondContact N-OH 2.9Å
413	I	97.1	Very high	94.7	Very high	33 Å²	33	39.2 Å²	39.2	17%	0.169	21%	0.205	C	C	.	.	H	α-helix	trans	-60.9	-47.7	177.5	-70.3	163.9	0	0	0	110.6	L409 C416 H417 L448 L451 L452	L409-I413 WeakPolarHBondContact O-CB 3.4Å; L409-I413 VanDerWaalsContact O-CG1 3.25Å; L409-I413 WeakPolarHBondContact O-CG1 3.46Å; L409-I413 PolarHBondContact O-N 3.25Å; I413-C416 PolarHBondContact O-N 3.06Å; I413-H417 WeakPolarHBondContact O-CB 3.4Å; I413-H417 PolarHBondContact O-N 2.98Å; I413-L448 HydrophobicContact CG2-CD1 3.98Å; I413-L451 HydrophobicContact CG1-CB 3.87Å; I413-L452 HydrophobicContact CD1-CD2 4.02Å; I413-L452 HydrophobicContact CG2-CD2 4.49Å
414	M	96	Very high	94.3	Very high	129 Å²	129	42.2 Å²	42.2	64%	0.635	21%	0.209	S	C	*	.	H	α-helix	trans	-62	-45.4	178.4	-77.7	-69	-71.3	0	0	112.2	G410 K411 H417 R418	G410-M414 WeakPolarHBondContact O-CB 3.15Å; G410-M414 WeakPolarHBondContact O-CG 3.31Å; G410-M414 PolarHBondContact O-N 3.48Å; G410-M414 VanDerWaalsContact O-N 3.09Å; K411-M414 PolarHBondContact O-N 3.03Å; M414-H417 PolarHBondContact O-N 3.41Å; M414-R418 VanDerWaalsContact O-CB 3.28Å; M414-R418 WeakPolarHBondContact O-CB 3.35Å; M414-R418 PolarHBondContact O-N 3.46Å
415	N	96.2	Very high	93.7	Very high	13 Å²	13	44.8 Å²	44.8	7%	0.07	22%	0.22	C	C	.	.	H	α-helix	trans	-65.6	-40.6	177.6	-75.4	-20.3	0	0	0	111.9	Q29 F30 K411 A412 R418 A419 Y507	Q29-N415 PolarHBondContact NE2-OD1 3.47Å; F30-N415 HydrophobicContact CE2-CB 3.87Å; F30-N415 HydrophobicContact CZ-CB 4.36Å; K411-N415 WeakPolarHBondContact O-CB 3.34Å; K411-N415 VanDerWaalsContact O-CG 3.29Å; K411-N415 PolarHBondContact O-N 3.32Å; K411-N415 PolarHBondContact O-ND2 2.88Å; A412-N415 PolarHBondContact O-N 3.15Å; N415-R418 PolarHBondContact O-N 3.15Å; N415-A419 WeakPolarHBondContact O-CB 3.4Å; N415-A419 PolarHBondContact O-N 3.38Å; N415-Y507 HydrophobicContact CB-CE1 4.16Å; N415-Y507 PolarHBondContact ND2-OH 2.89Å; N415-Y507 VanDerWaalsContact ND2-OH 3.12Å
416	C	96.6	Very high	93	Very high	1 Å²	1	45 Å²	45	1%	0.007	22%	0.221	C	C	.	.	H	α-helix	trans	-61.8	-49.5	176.1	-167.8	0	0	0	0	111.2	A412 I413 A419 S420 F444 L451 F506	A412-C416 WeakPolarHBondContact O-CB 3.35Å; A412-C416 PolarHBondContact O-N 3.36Å; I413-C416 PolarHBondContact O-N 3.06Å; C416-A419 PolarHBondContact O-N 3.12Å; C416-S420 WeakPolarHBondContact O-CB 3.27Å; C416-S420 PolarHBondContact O-N 3.46Å; C416-F444 PolarHBondContact SG-O 2.87Å; C416-L451 HydrophobicContact CB-CD1 4.18Å; C416-F506 HydrophobicContact CB-CE2 4.12Å; C416-F506 HydrophobicContact CB-CZ 3.63Å
417	H	94.1	Very high	92.3	Very high	108 Å²	108	46.4 Å²	46.4	50%	0.5	22%	0.223	S	C	.	.	H	α-helix	trans	-61.2	-47.6	177.3	-178.4	-92.7	0	0	0	111.5	I413 M414 A419 S420 S421	I413-H417 WeakPolarHBondContact O-CB 3.4Å; I413-H417 PolarHBondContact O-N 2.98Å; M414-H417 PolarHBondContact O-N 3.41Å; H417-A419 VanDerWaalsContact C-N 3.35Å; H417-A419 PolarHBondContact O-N 3.44Å; H417-S420 PolarHBondContact O-N 2.92Å; H417-S421 PolarHBondContact O-N 2.93Å; H417-S421 PolarHBondContact O-OG 3.32Å; H417-S421 VanDerWaalsContact O-OG 3.11Å
418	R	93.4	Very high	91.1	Very high	116 Å²	116	42.1 Å²	42.1	44%	0.438	21%	0.206	S	C	.	.	H	α-helix	trans	-60.6	-43.7	177.9	-173.1	-178.2	177	-168.8	-1.3	111.9	L25 M414 N415 L422	L25-R418 HydrophobicContact CD2-CB 4.07Å; L25-R418 HydrophobicContact CD2-CG 3.79Å; M414-R418 VanDerWaalsContact O-CB 3.28Å; M414-R418 WeakPolarHBondContact O-CB 3.35Å; M414-R418 PolarHBondContact O-N 3.46Å; N415-R418 PolarHBondContact O-N 3.15Å; R418-L422 HydrophobicContact CG-CD1 4.17Å; R418-L422 WeakPolarHBondContact O-CB 3.43Å; R418-L422 VanDerWaalsContact O-CG 3.31Å; R418-L422 WeakPolarHBondContact O-CG 3.44Å; R418-L422 PolarHBondContact O-N 3.49Å
419	A	94	Very high	89.7	Confident	0 Å²	0	50.2 Å²	50.2	0%	0	25%	0.248	C	C	.	.	H	α-helix	trans	-66.2	-42.3	178.1	0	0	0	0	0	111.9	Y22 L25 I26 F30 N415 C416 H417 L422 A423 F444	Y22-A419 HydrophobicContact CE2-CB 4.29Å; Y22-A419 WeakPolarHBondContact CE2-O 3.42Å; L25-A419 HydrophobicContact CD2-CB 3.84Å; I26-A419 HydrophobicContact CD1-CB 3.92Å; F30-A419 HydrophobicContact CE2-CB 4.25Å; F30-A419 HydrophobicContact CZ-CB 3.79Å; N415-A419 WeakPolarHBondContact O-CB 3.4Å; N415-A419 PolarHBondContact O-N 3.38Å; C416-A419 PolarHBondContact O-N 3.12Å; H417-A419 VanDerWaalsContact C-N 3.35Å; H417-A419 PolarHBondContact O-N 3.44Å; A419-L422 PolarHBondContact O-N 3.27Å; A419-A423 VanDerWaalsContact O-CB 3.31Å; A419-A423 WeakPolarHBondContact O-CB 3.25Å; A419-A423 PolarHBondContact O-N 2.93Å; A419-F444 HydrophobicContact CB-CD1 4.14Å; A419-F444 HydrophobicContact CB-CE1 3.5Å; A419-F444 VanDerWaalsContact CB-CE1 3.5Å; A419-F444 HydrophobicContact CB-CE2 4.18Å; A419-F444 HydrophobicContact CB-CZ 3.53Å
420	S	92.6	Very high	87.9	Confident	7 Å²	7	54.8 Å²	54.8	5%	0.049	29%	0.286	C	S	.	.	H	α-helix	trans	-57.4	-52.3	174	-171.4	0	0	0	0	110.9	C416 H417 L422 A423 Y424 N445	C416-S420 WeakPolarHBondContact O-CB 3.27Å; C416-S420 PolarHBondContact O-N 3.46Å; H417-S420 PolarHBondContact O-N 2.92Å; S420-L422 VanDerWaalsContact C-N 3.3Å; S420-L422 PolarHBondContact O-N 2.86Å; S420-A423 WeakPolarHBondContact O-CA 3.4Å; S420-A423 WeakPolarHBondContact O-CB 3.4Å; S420-A423 PolarHBondContact O-N 3.34Å; S420-Y424 WeakPolarHBondContact O-CD2 3.3Å; S420-Y424 PolarHBondContact O-N 2.65Å; S420-N445 PolarHBondContact OG-OD1 3.01Å
421	S	89.9	Confident	86.1	Confident	56 Å²	56	59.2 Å²	59.2	39%	0.392	30%	0.304	S	S	.	.	H	α-helix	trans	-59.4	-38.3	178.9	-62.2	0	0	0	0	113.2	H417	H417-S421 PolarHBondContact O-N 2.93Å; H417-S421 PolarHBondContact O-OG 3.32Å; H417-S421 VanDerWaalsContact O-OG 3.11Å
422	L	89.7	Confident	84.2	Confident	23 Å²	23	63.4 Å²	63.4	12%	0.12	33%	0.329	C	S	.	.	H	α-helix	trans	-71.7	-36.7	175.1	-71.8	170.1	0	0	0	112	A18 Y22 L25 R418 A419 S420 Y424 L425 Y426	A18-L422 HydrophobicContact CB-CD2 4.21Å; Y22-L422 HydrophobicContact CD2-CB 3.36Å; Y22-L422 HydrophobicContact CD2-CD1 3.96Å; Y22-L422 HydrophobicContact CD2-CG 4.3Å; Y22-L422 HydrophobicContact CE2-CB 4.05Å; Y22-L422 HydrophobicContact CG-CB 3.87Å; Y22-L422 HydrophobicContact CG-CD1 4.46Å; L25-L422 HydrophobicContact CD2-CD1 3.97Å; R418-L422 HydrophobicContact CG-CD1 4.17Å; R418-L422 WeakPolarHBondContact O-CB 3.43Å; R418-L422 VanDerWaalsContact O-CG 3.31Å; R418-L422 WeakPolarHBondContact O-CG 3.44Å; R418-L422 PolarHBondContact O-N 3.49Å; A419-L422 PolarHBondContact O-N 3.27Å; S420-L422 VanDerWaalsContact C-N 3.3Å; S420-L422 PolarHBondContact O-N 2.86Å; L422-Y424 VanDerWaalsContact C-N 3.34Å; L422-L425 HydrophobicContact CD2-CD1 4.13Å; L422-L425 WeakPolarHBondContact O-CB 3.18Å; L422-L425 PolarHBondContact O-N 3.05Å; L422-Y426 WeakPolarHBondContact O-CD2 3.22Å
423	A	88.3	Confident	82.4	Confident	0 Å²	0	66 Å²	66	0%	0	35%	0.347	C	S	.	.	H	α-helix	trans	-65.4	-35.7	174.9	0	0	0	0	0	112.1	Y22 A419 S420 L425 Y426 I440 V441 F444	Y22-A423 HydrophobicContact CE2-CB 4.32Å; A419-A423 VanDerWaalsContact O-CB 3.31Å; A419-A423 WeakPolarHBondContact O-CB 3.25Å; A419-A423 PolarHBondContact O-N 2.93Å; S420-A423 WeakPolarHBondContact O-CA 3.4Å; S420-A423 WeakPolarHBondContact O-CB 3.4Å; S420-A423 PolarHBondContact O-N 3.34Å; A423-L425 PolarHBondContact O-N 3.41Å; A423-Y426 WeakPolarHBondContact O-CB 3.32Å; A423-Y426 PolarHBondContact O-N 3.38Å; A423-I440 HydrophobicContact CB-CG2 4.29Å; A423-V441 HydrophobicContact CB-CG2 3.69Å; A423-F444 HydrophobicContact CB-CD2 4.4Å; A423-F444 HydrophobicContact CB-CE2 4.33Å
424	Y	85.8	Confident	80.9	Confident	117 Å²	117	69.4 Å²	69.4	46%	0.459	37%	0.369	S	S	.	.	H	α-helix	trans	-55.7	-33.1	172.9	-90	-75.1	0	0	0	112.7	S420 L422 Y426 I427 V441	S420-Y424 WeakPolarHBondContact O-CD2 3.3Å; S420-Y424 PolarHBondContact O-N 2.65Å; L422-Y424 VanDerWaalsContact C-N 3.34Å; Y424-Y426 PolarHBondContact O-N 3.38Å; Y424-Y426 VanDerWaalsContact O-N 3.11Å; Y424-I427 HydrophobicContact CD1-CD1 3.7Å; Y424-I427 HydrophobicContact CE1-CD1 4.16Å; Y424-I427 PolarHBondContact O-N 3.46Å; Y424-I427 VanDerWaalsContact O-N 3.11Å; Y424-V441 HydrophobicContact CD1-CG1 4.17Å; Y424-V441 HydrophobicContact CD1-CG2 4.35Å; Y424-V441 HydrophobicContact CD2-CG1 3.93Å; Y424-V441 HydrophobicContact CD2-CG2 4.07Å; Y424-V441 HydrophobicContact CE1-CG1 3.61Å; Y424-V441 HydrophobicContact CE2-CB 4.49Å; Y424-V441 HydrophobicContact CE2-CG1 3.35Å; Y424-V441 HydrophobicContact CE2-CG2 4.33Å; Y424-V441 HydrophobicContact CG-CG1 4.31Å; Y424-V441 HydrophobicContact CG-CG2 4.08Å; Y424-V441 WeakPolarHBondContact OH-CG1 3.24Å
425	L	83	Confident	80.2	Confident	99 Å²	99	64.3 Å²	64.3	52%	0.518	35%	0.345	S	S	.	.	T	Hydrogen-bonded Turn	trans	-68.3	-5.9	176.9	-57.6	175.3	0	0	0	113.7	A18 L422 A423 R525	A18-L425 HydrophobicContact CB-CD1 3.99Å; L422-L425 HydrophobicContact CD2-CD1 4.13Å; L422-L425 WeakPolarHBondContact O-CB 3.18Å; L422-L425 PolarHBondContact O-N 3.05Å; A423-L425 PolarHBondContact O-N 3.41Å; L425-R525 PolarHBondContact O-NH2 3.16Å
426	Y	82.2	Confident	79.7	Confident	6 Å²	6	65.8 Å²	65.8	2%	0.024	36%	0.355	C	S	.	.	T	Hydrogen-bonded Turn	trans	-98.9	-5.5	174.8	-70.3	-92.7	0	0	0	113.1	E19 Y22 L422 A423 Y424 P428 L521	E19-Y426 WeakPolarHBondContact CG-OH 3.34Å; Y22-Y426 HydrophobicContact CD1-CD2 4.43Å; Y22-Y426 AromaticContact CD1-CE2 3.56Å; Y22-Y426 HydrophobicContact CD1-CE2 3.56Å; Y22-Y426 HydrophobicContact CE1-CD2 4.48Å; Y22-Y426 HydrophobicContact CE1-CE2 4.01Å; Y22-Y426 HydrophobicContact CG-CE2 4.27Å; L422-Y426 WeakPolarHBondContact O-CD2 3.22Å; A423-Y426 WeakPolarHBondContact O-CB 3.32Å; A423-Y426 PolarHBondContact O-N 3.38Å; Y424-Y426 PolarHBondContact O-N 3.38Å; Y424-Y426 VanDerWaalsContact O-N 3.11Å; Y426-P428 WeakPolarHBondContact O-CD 3.28Å; Y426-L521 HydrophobicContact CD1-CB 4.27Å; Y426-L521 WeakPolarHBondContact CD1-O 3.5Å; Y426-L521 HydrophobicContact CG-CD2 4.49Å
427	I	80.6	Confident	79.2	Confident	49 Å²	49	66 Å²	66	25%	0.251	36%	0.356	S	S	.	.	S	Bend	trans	-74.4	118.3	175.4	-58.4	179.8	0	0	0	108.3	Y424 L429 A437 V441	Y424-I427 HydrophobicContact CD1-CD1 3.7Å; Y424-I427 HydrophobicContact CE1-CD1 4.16Å; Y424-I427 PolarHBondContact O-N 3.46Å; Y424-I427 VanDerWaalsContact O-N 3.11Å; I427-L429 PolarHBondContact O-N 3.28Å; I427-A437 HydrophobicContact CG1-CB 3.76Å; I427-V441 HydrophobicContact CD1-CG2 4.38Å
428	P	71.7	Confident	78.9	Confident	27 Å²	27	66 Å²	66	18%	0.175	35%	0.352	C	S	.	.			trans	-66.1	134.8	177.6	26.7	-32.6	0	0	0	110.3	Y426 A430 E431 T435	Y426-P428 WeakPolarHBondContact O-CD 3.28Å; P428-A430 PolarHBondContact O-N 2.99Å; P428-A430 VanDerWaalsContact O-N 3.14Å; P428-E431 HydrophobicContact CG-CB 4.44Å; P428-T435 HydrophobicContact CG-CG2 3.8Å
429	L	66	Low	78.8	Confident	173 Å²	173	63.9 Å²	63.9	91%	0.906	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-61.8	-22.9	-178	-69.5	170.1	0	0	0	113.7	I427	I427-L429 PolarHBondContact O-N 3.28Å
430	A	59	Low	78.8	Confident	97 Å²	97	63.9 Å²	63.9	80%	0.802	35%	0.348	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.4	-6.5	-165.4	0	0	0	0	0	115.1	P428	P428-A430 PolarHBondContact O-N 2.99Å; P428-A430 VanDerWaalsContact O-N 3.14Å
431	E	59.6	Low	78.8	Confident	105 Å²	105	63.6 Å²	63.6	49%	0.491	35%	0.346	S	S	.	.			trans	-119.5	121.1	-173.1	-62.1	-168.1	-173.1	0	0	113.1	P428 S433	P428-E431 HydrophobicContact CG-CB 4.44Å; E431-S433 WeakPolarHBondContact CB-OG 3.45Å; E431-S433 PolarHBondContact O-N 3.37Å; E431-S433 PolarHBondContact OE2-OG 3.19Å
432	L	55.5	Low	78.9	Confident	173 Å²	173	64.9 Å²	64.9	91%	0.906	35%	0.349	S	S	*	.			trans	-69	-5.8	164.2	-85.2	143.1	0	0	0	112.6
433	S	59.2	Low	79.2	Confident	53 Å²	53	66.8 Å²	66.8	37%	0.371	36%	0.357	S	S	.	.	S	Bend	trans	-64.8	146.1	179.9	70.1	0	0	0	0	110.4	E431 T435	E431-S433 WeakPolarHBondContact CB-OG 3.45Å; E431-S433 PolarHBondContact O-N 3.37Å; E431-S433 PolarHBondContact OE2-OG 3.19Å; S433-T435 PolarHBondContact O-N 3.07Å
434	V	65.8	Low	79.6	Confident	106 Å²	106	66.8 Å²	66.8	64%	0.642	36%	0.357	S	S	*	.			trans	-68.1	103.8	168.8	178.4	0	0	0	0	106.7	I439	V434-I439 HydrophobicContact CG1-CD1 3.92Å; V434-I439 HydrophobicContact CG1-CG1 3.65Å
435	T	81.3	Confident	80	Confident	21 Å²	21	63.5 Å²	63.5	13%	0.129	35%	0.347	C	S	.	.			trans	-87.1	155.8	176	59.6	0	0	0	0	110.1	P428 S433 A437 R438 I439	P428-T435 HydrophobicContact CG-CG2 3.8Å; S433-T435 PolarHBondContact O-N 3.07Å; T435-A437 PolarHBondContact O-N 3.11Å; T435-R438 WeakPolarHBondContact O-CB 3.33Å; T435-R438 PolarHBondContact O-N 2.66Å; T435-R438 PolarHBondContact OG1-N 3.4Å; T435-I439 PolarHBondContact O-N 3.03Å; T435-I439 VanDerWaalsContact O-N 3.16Å
436	V	85.9	Confident	80.6	Confident	45 Å²	45	62.5 Å²	62.5	27%	0.273	34%	0.34	S	S	.	.	H	α-helix	trans	-55.1	-35.6	173.3	175.6	0	0	0	0	111.2	R438 I439 I440 N517	V436-R438 VanDerWaalsContact C-N 3.35Å; V436-R438 PolarHBondContact O-N 3.37Å; V436-I439 PolarHBondContact O-N 3.38Å; V436-I440 HydrophobicContact CG1-CD1 3.93Å; V436-I440 WeakPolarHBondContact O-CG1 3.45Å; V436-I440 PolarHBondContact O-N 3.23Å; V436-N517 HydrophobicContact CG1-CB 3.6Å
437	A	86.4	Confident	81.3	Confident	4 Å²	4	64 Å²	64	3%	0.033	35%	0.346	C	S	.	.	H	α-helix	trans	-60.4	-42	174	0	0	0	0	0	112.5	I427 T435 I440 V441 L521	I427-A437 HydrophobicContact CG1-CB 3.76Å; T435-A437 PolarHBondContact O-N 3.11Å; A437-I440 PolarHBondContact O-N 3.13Å; A437-V441 WeakPolarHBondContact O-CB 3.11Å; A437-V441 VanDerWaalsContact O-CG2 3.28Å; A437-V441 WeakPolarHBondContact O-CG2 3.49Å; A437-V441 PolarHBondContact O-N 3.37Å; A437-L521 HydrophobicContact CB-CD2 3.68Å
438	R	88.2	Confident	82.1	Confident	110 Å²	110	63.3 Å²	63.3	42%	0.415	34%	0.342	S	S	.	.	H	α-helix	trans	-64.5	-43.5	177.7	-162.3	175.7	-150.3	151.4	6.4	112	T435 V436 I440 V441 D442	T435-R438 WeakPolarHBondContact O-CB 3.33Å; T435-R438 PolarHBondContact O-N 2.66Å; T435-R438 PolarHBondContact OG1-N 3.4Å; V436-R438 VanDerWaalsContact C-N 3.35Å; V436-R438 PolarHBondContact O-N 3.37Å; R438-I440 VanDerWaalsContact C-N 3.34Å; R438-I440 PolarHBondContact O-N 3.42Å; R438-V441 PolarHBondContact O-N 3.05Å; R438-D442 WeakPolarHBondContact O-CB 3.49Å; R438-D442 PolarHBondContact O-N 3.26Å
439	I	91	Very high	83.2	Confident	70 Å²	70	68 Å²	68	36%	0.359	36%	0.362	S	S	.	.	H	α-helix	trans	-59.9	-46.1	176.7	-62.1	171.4	0	0	0	110.6	V434 T435 V436 V441 D442 H443	V434-I439 HydrophobicContact CG1-CD1 3.92Å; V434-I439 HydrophobicContact CG1-CG1 3.65Å; T435-I439 PolarHBondContact O-N 3.03Å; T435-I439 VanDerWaalsContact O-N 3.16Å; V436-I439 PolarHBondContact O-N 3.38Å; I439-V441 VanDerWaalsContact C-N 3.34Å; I439-V441 PolarHBondContact O-N 3.13Å; I439-D442 PolarHBondContact O-N 2.7Å; I439-H443 PolarHBondContact O-CD2 3Å; I439-H443 VanDerWaalsContact O-CD2 3.29Å; I439-H443 PolarHBondContact O-N 3.32Å
440	I	92.6	Very high	84.6	Confident	0 Å²	0	62.4 Å²	62.4	0%	0	33%	0.333	C	S	.	.	H	α-helix	trans	-63.8	-41.2	179.2	-72.7	172.3	0	0	0	111.4	A423 V436 A437 R438 H443 F444 E513 V514 N517 L521	A423-I440 HydrophobicContact CB-CG2 4.29Å; V436-I440 HydrophobicContact CG1-CD1 3.93Å; V436-I440 WeakPolarHBondContact O-CG1 3.45Å; V436-I440 PolarHBondContact O-N 3.23Å; A437-I440 PolarHBondContact O-N 3.13Å; R438-I440 VanDerWaalsContact C-N 3.34Å; R438-I440 PolarHBondContact O-N 3.42Å; I440-H443 PolarHBondContact O-N 3.45Å; I440-F444 HydrophobicContact CG2-CD2 3.82Å; I440-F444 HydrophobicContact CG2-CE2 3.52Å; I440-F444 WeakPolarHBondContact O-CD2 3.41Å; I440-F444 PolarHBondContact O-N 2.87Å; I440-E513 HydrophobicContact CG1-CG 4.35Å; I440-V514 HydrophobicContact CG2-CG2 4Å; I440-N517 HydrophobicContact CD1-CB 3.73Å; I440-L521 HydrophobicContact CD1-CD1 3.67Å; I440-L521 HydrophobicContact CD1-CD2 3.94Å; I440-L521 HydrophobicContact CD1-CG 3.9Å
441	V	93	Very high	86.4	Confident	1 Å²	1	58 Å²	58	1%	0.006	30%	0.295	C	S	.	.	H	α-helix	trans	-62.5	-44.6	174.6	162.5	0	0	0	0	111.3	A423 Y424 I427 A437 R438 I439 H443 F444 N445	A423-V441 HydrophobicContact CB-CG2 3.69Å; Y424-V441 HydrophobicContact CD1-CG1 4.17Å; Y424-V441 HydrophobicContact CD1-CG2 4.35Å; Y424-V441 HydrophobicContact CD2-CG1 3.93Å; Y424-V441 HydrophobicContact CD2-CG2 4.07Å; Y424-V441 HydrophobicContact CE1-CG1 3.61Å; Y424-V441 HydrophobicContact CE2-CB 4.49Å; Y424-V441 HydrophobicContact CE2-CG1 3.35Å; Y424-V441 HydrophobicContact CE2-CG2 4.33Å; Y424-V441 HydrophobicContact CG-CG1 4.31Å; Y424-V441 HydrophobicContact CG-CG2 4.08Å; Y424-V441 WeakPolarHBondContact OH-CG1 3.24Å; I427-V441 HydrophobicContact CD1-CG2 4.38Å; A437-V441 WeakPolarHBondContact O-CB 3.11Å; A437-V441 VanDerWaalsContact O-CG2 3.28Å; A437-V441 WeakPolarHBondContact O-CG2 3.49Å; A437-V441 PolarHBondContact O-N 3.37Å; R438-V441 PolarHBondContact O-N 3.05Å; I439-V441 VanDerWaalsContact C-N 3.34Å; I439-V441 PolarHBondContact O-N 3.13Å; V441-H443 VanDerWaalsContact C-N 3.29Å; V441-H443 PolarHBondContact O-N 3.31Å; V441-F444 PolarHBondContact O-N 2.93Å; V441-F444 VanDerWaalsContact O-N 3.17Å; V441-N445 VanDerWaalsContact O-CG 3.24Å; V441-N445 PolarHBondContact O-N 3.29Å; V441-N445 PolarHBondContact O-ND2 3.24Å
442	D	93.2	Very high	88.1	Confident	84 Å²	84	56.9 Å²	56.9	45%	0.449	29%	0.292	S	S	.	.	H	α-helix	trans	-61.1	-40.2	177.8	-69.5	-22.5	0	0	0	111	R438 I439 N445 E446	R438-D442 WeakPolarHBondContact O-CB 3.49Å; R438-D442 PolarHBondContact O-N 3.26Å; I439-D442 PolarHBondContact O-N 2.7Å; D442-N445 PolarHBondContact O-N 2.98Å; D442-E446 PolarHBondContact O-N 3.42Å
443	H	94.8	Very high	89.9	Confident	62 Å²	62	51.2 Å²	51.2	29%	0.287	27%	0.267	S	S	.	.	H	α-helix	trans	-66.1	-39.7	174.2	-73.9	-159.8	0	0	0	112.7	I439 I440 V441 N445 E446 W447 M510 E513	I439-H443 PolarHBondContact O-CD2 3Å; I439-H443 VanDerWaalsContact O-CD2 3.29Å; I439-H443 PolarHBondContact O-N 3.32Å; I440-H443 PolarHBondContact O-N 3.45Å; V441-H443 VanDerWaalsContact C-N 3.29Å; V441-H443 PolarHBondContact O-N 3.31Å; H443-N445 VanDerWaalsContact C-N 3.28Å; H443-N445 PolarHBondContact O-N 3.39Å; H443-E446 PolarHBondContact O-N 3.38Å; H443-W447 VanDerWaalsContact O-CD1 3.25Å; H443-W447 PolarHBondContact O-N 3.48Å; H443-M510 HydrophobicContact CB-CE 4.14Å; H443-M510 HydrophobicContact CB-SD 4.33Å; H443-E513 IonicContact CE1-OE1 2.86Å; H443-E513 PolarHBondContact CE1-OE1 2.95Å; H443-E513 IonicContact CE1-OE2 3.24Å; H443-E513 IonicContact CG-OE1 2.76Å; H443-E513 IonicContact CG-OE2 2.77Å; H443-E513 IonicContact ND1-OE1 3.01Å; H443-E513 PolarHBondContact ND1-OE1 3.36Å; H443-E513 IonicContact ND1-OE2 3.73Å; H443-E513 PolarHBondContact ND1-OE2 2.9Å
444	F	96.3	Very high	91.6	Very high	0 Å²	0	50 Å²	50	0%	0	26%	0.255	C	S	.	.	H	α-helix	trans	-60.9	-38.3	171.4	-82	-63.5	0	0	0	111.9	I26 F30 C416 A419 A423 I440 V441 W447 L448 M510 V514	I26-F444 HydrophobicContact CD1-CZ 3.93Å; F30-F444 HydrophobicContact CE1-CE1 4.06Å; F30-F444 HydrophobicContact CZ-CE1 4.09Å; C416-F444 PolarHBondContact SG-O 2.87Å; A419-F444 HydrophobicContact CB-CD1 4.14Å; A419-F444 HydrophobicContact CB-CE1 3.5Å; A419-F444 VanDerWaalsContact CB-CE1 3.5Å; A419-F444 HydrophobicContact CB-CE2 4.18Å; A419-F444 HydrophobicContact CB-CZ 3.53Å; A423-F444 HydrophobicContact CB-CD2 4.4Å; A423-F444 HydrophobicContact CB-CE2 4.33Å; I440-F444 HydrophobicContact CG2-CD2 3.82Å; I440-F444 HydrophobicContact CG2-CE2 3.52Å; I440-F444 WeakPolarHBondContact O-CD2 3.41Å; I440-F444 PolarHBondContact O-N 2.87Å; V441-F444 PolarHBondContact O-N 2.93Å; V441-F444 VanDerWaalsContact O-N 3.17Å; F444-W447 PolarHBondContact O-N 3.16Å; F444-L448 VanDerWaalsContact O-CB 3.3Å; F444-L448 WeakPolarHBondContact O-CB 3.33Å; F444-L448 PolarHBondContact O-N 3.38Å; F444-M510 HydrophobicContact CB-CE 4.49Å; F444-M510 HydrophobicContact CD1-CE 3.53Å; F444-M510 HydrophobicContact CD1-CG 4.26Å; F444-M510 HydrophobicContact CD1-SD 4.47Å; F444-M510 HydrophobicContact CD2-CE 3.64Å; F444-M510 HydrophobicContact CE1-CB 3.98Å; F444-M510 HydrophobicContact CE1-CE 3.42Å; F444-M510 VanDerWaalsContact CE1-CE 3.42Å; F444-M510 HydrophobicContact CE1-CG 3.89Å; F444-M510 HydrophobicContact CE1-SD 4.41Å; F444-M510 HydrophobicContact CE2-CE 3.53Å; F444-M510 HydrophobicContact CG-CE 3.62Å; F444-M510 HydrophobicContact CZ-CB 4.3Å; F444-M510 HydrophobicContact CZ-CE 3.4Å; F444-M510 VanDerWaalsContact CZ-CE 3.4Å; F444-V514 HydrophobicContact CE2-CG2 4.25Å; F444-V514 HydrophobicContact CZ-CG2 4.19Å
445	N	95.1	Very high	92.8	Very high	48 Å²	48	48.4 Å²	48.4	26%	0.257	24%	0.241	S	C	.	.	H	α-helix	trans	-68.7	-40.9	178.4	-63.5	-31.1	0	0	0	111.6	S420 V441 D442 H443 L448 E449	S420-N445 PolarHBondContact OG-OD1 3.01Å; V441-N445 VanDerWaalsContact O-CG 3.24Å; V441-N445 PolarHBondContact O-N 3.29Å; V441-N445 PolarHBondContact O-ND2 3.24Å; D442-N445 PolarHBondContact O-N 2.98Å; H443-N445 VanDerWaalsContact C-N 3.28Å; H443-N445 PolarHBondContact O-N 3.39Å; N445-L448 WeakPolarHBondContact O-CB 3.31Å; N445-L448 PolarHBondContact O-N 3.49Å; N445-E449 PolarHBondContact O-N 3.09Å
446	E	96.1	Very high	93.4	Very high	79 Å²	79	49.4 Å²	49.4	37%	0.369	25%	0.249	S	C	.	.	H	α-helix	trans	-59.7	-47.8	173.5	-178.4	176.1	-175.7	0	0	111.3	F256 D442 H443 L448 E449 I450	F256-E446 HydrophobicContact CZ-CG 4.09Å; D442-E446 PolarHBondContact O-N 3.42Å; H443-E446 PolarHBondContact O-N 3.38Å; E446-L448 VanDerWaalsContact C-N 3.31Å; E446-L448 PolarHBondContact O-N 3.3Å; E446-E449 PolarHBondContact O-N 2.84Å; E446-I450 HydrophobicContact CG-CD1 4.19Å; E446-I450 WeakPolarHBondContact O-CG1 3.44Å; E446-I450 PolarHBondContact O-N 3.27Å
447	W	96.7	Very high	93.7	Very high	37 Å²	37	47.9 Å²	47.9	14%	0.14	24%	0.239	C	C	.	.	H	α-helix	trans	-63.4	-36.7	175.8	-84	109.3	0	0	0	112.8	H443 F444 E449 I450 L451 E505 F506 T509 M510	H443-W447 VanDerWaalsContact O-CD1 3.25Å; H443-W447 PolarHBondContact O-N 3.48Å; F444-W447 PolarHBondContact O-N 3.16Å; W447-E449 PolarHBondContact O-N 2.84Å; W447-I450 HydrophobicContact CD2-CD1 4.48Å; W447-I450 HydrophobicContact CE3-CB 4.41Å; W447-I450 HydrophobicContact CE3-CD1 4.18Å; W447-I450 HydrophobicContact CE3-CG2 4.33Å; W447-I450 HydrophobicContact CZ3-CG2 4.38Å; W447-I450 PolarHBondContact O-N 3.06Å; W447-L451 WeakPolarHBondContact O-CB 3.35Å; W447-L451 VanDerWaalsContact O-CG 3.23Å; W447-L451 WeakPolarHBondContact O-CG 3.26Å; W447-L451 PolarHBondContact O-N 3.39Å; W447-E505 HydrophobicContact CH2-CG 4.4Å; W447-F506 HydrophobicContact CB-CD2 3.75Å; W447-F506 HydrophobicContact CB-CE2 3.88Å; W447-F506 HydrophobicContact CD2-CB 4.18Å; W447-F506 AromaticContact CD2-CD2 3.66Å; W447-F506 HydrophobicContact CD2-CD2 3.66Å; W447-F506 HydrophobicContact CD2-CG 4.39Å; W447-F506 HydrophobicContact CE3-CB 3.69Å; W447-F506 AromaticContact CE3-CD2 3.84Å; W447-F506 HydrophobicContact CE3-CD2 3.84Å; W447-F506 HydrophobicContact CE3-CG 4.17Å; W447-F506 AromaticContact CG-CD2 3.63Å; W447-F506 HydrophobicContact CG-CD2 3.63Å; W447-F506 HydrophobicContact CG-CE2 4.16Å; W447-F506 HydrophobicContact CH2-CB 4.12Å; W447-F506 HydrophobicContact CZ3-CB 3.66Å; W447-T509 HydrophobicContact CZ2-CG2 4.38Å; W447-M510 HydrophobicContact CG-SD 4.4Å
448	L	96.2	Very high	94	Very high	35 Å²	35	48.5 Å²	48.5	18%	0.183	24%	0.242	C	C	.	.	H	α-helix	trans	-61.3	-44	175.8	-177.1	62.1	0	0	0	111.3	I413 F444 N445 E446 L451 L452	I413-L448 HydrophobicContact CG2-CD1 3.98Å; F444-L448 VanDerWaalsContact O-CB 3.3Å; F444-L448 WeakPolarHBondContact O-CB 3.33Å; F444-L448 PolarHBondContact O-N 3.38Å; N445-L448 WeakPolarHBondContact O-CB 3.31Å; N445-L448 PolarHBondContact O-N 3.49Å; E446-L448 VanDerWaalsContact C-N 3.31Å; E446-L448 PolarHBondContact O-N 3.3Å; L448-L451 PolarHBondContact O-N 3.47Å; L448-L452 HydrophobicContact CD1-CD1 4.26Å; L448-L452 HydrophobicContact CD1-CG 4.38Å; L448-L452 HydrophobicContact CG-CD1 4.04Å; L448-L452 WeakPolarHBondContact O-CB 3.46Å; L448-L452 VanDerWaalsContact O-CG 3.27Å; L448-L452 WeakPolarHBondContact O-CG 3.44Å; L448-L452 PolarHBondContact O-N 2.71Å
449	E	95.9	Very high	94.2	Very high	124 Å²	124	47.2 Å²	47.2	58%	0.579	25%	0.25	S	C	*	.	H	α-helix	trans	-61.6	-43.6	174.5	-71.1	-175.8	178.6	0	0	111.8	N445 E446 W447 L452 S453	N445-E449 PolarHBondContact O-N 3.09Å; E446-E449 PolarHBondContact O-N 2.84Å; W447-E449 PolarHBondContact O-N 2.84Å; E449-L452 PolarHBondContact O-N 2.81Å; E449-S453 WeakPolarHBondContact O-CB 3.33Å; E449-S453 PolarHBondContact O-N 2.9Å
450	I	95.5	Very high	94.4	Very high	57 Å²	57	48.4 Å²	48.4	29%	0.292	25%	0.253	S	S	.	.	H	α-helix	trans	-59.6	-50.8	176.3	-67	166.9	0	0	0	110.1	E446 W447 L452 S453 K454	E446-I450 HydrophobicContact CG-CD1 4.19Å; E446-I450 WeakPolarHBondContact O-CG1 3.44Å; E446-I450 PolarHBondContact O-N 3.27Å; W447-I450 HydrophobicContact CD2-CD1 4.48Å; W447-I450 HydrophobicContact CE3-CB 4.41Å; W447-I450 HydrophobicContact CE3-CD1 4.18Å; W447-I450 HydrophobicContact CE3-CG2 4.33Å; W447-I450 HydrophobicContact CZ3-CG2 4.38Å; W447-I450 PolarHBondContact O-N 3.06Å; I450-L452 PolarHBondContact O-N 3.47Å; I450-S453 WeakPolarHBondContact O-CB 3.36Å; I450-S453 PolarHBondContact O-N 3.34Å; I450-S453 PolarHBondContact O-OG 2.65Å; I450-K454 WeakPolarHBondContact O-CG 3.35Å; I450-K454 PolarHBondContact O-N 3.39Å; I450-K454 VanDerWaalsContact O-N 3.11Å
451	L	96.1	Very high	94.5	Very high	4 Å²	4	48.8 Å²	48.8	2%	0.021	25%	0.254	C	S	.	.	H	α-helix	trans	-62.4	-44.1	-178.3	-69.2	170.3	0	0	0	112	L409 A412 I413 C416 W447 L448 S453 K454 Q455 I503 F506	L409-L451 HydrophobicContact CD2-CD2 4.1Å; A412-L451 HydrophobicContact CB-CD1 4Å; A412-L451 HydrophobicContact CB-CD2 4.1Å; I413-L451 HydrophobicContact CG1-CB 3.87Å; C416-L451 HydrophobicContact CB-CD1 4.18Å; W447-L451 WeakPolarHBondContact O-CB 3.35Å; W447-L451 VanDerWaalsContact O-CG 3.23Å; W447-L451 WeakPolarHBondContact O-CG 3.26Å; W447-L451 PolarHBondContact O-N 3.39Å; L448-L451 PolarHBondContact O-N 3.47Å; L451-S453 VanDerWaalsContact C-N 3.31Å; L451-S453 PolarHBondContact O-N 3.41Å; L451-K454 PolarHBondContact O-N 3.1Å; L451-Q455 PolarHBondContact O-N 3.12Å; L451-Q455 VanDerWaalsContact O-N 3.07Å; L451-I503 HydrophobicContact CD2-CG1 4.2Å; L451-F506 HydrophobicContact CD1-CD1 4.22Å; L451-F506 HydrophobicContact CD1-CD2 4.31Å; L451-F506 HydrophobicContact CD1-CE1 4.14Å; L451-F506 HydrophobicContact CD1-CE2 4.22Å; L451-F506 HydrophobicContact CD1-CG 4.3Å; L451-F506 HydrophobicContact CD1-CZ 4.15Å
452	L	95.2	Very high	94.6	Very high	82 Å²	82	52.5 Å²	52.5	43%	0.429	27%	0.269	S	S	.	.	H	α-helix	trans	-62	-38.4	174.8	-72.6	169.6	0	0	0	111.9	I413 L448 E449 I450 K454 Q455 S456	I413-L452 HydrophobicContact CD1-CD2 4.02Å; I413-L452 HydrophobicContact CG2-CD2 4.49Å; L448-L452 HydrophobicContact CD1-CD1 4.26Å; L448-L452 HydrophobicContact CD1-CG 4.38Å; L448-L452 HydrophobicContact CG-CD1 4.04Å; L448-L452 WeakPolarHBondContact O-CB 3.46Å; L448-L452 VanDerWaalsContact O-CG 3.27Å; L448-L452 WeakPolarHBondContact O-CG 3.44Å; L448-L452 PolarHBondContact O-N 2.71Å; E449-L452 PolarHBondContact O-N 2.81Å; I450-L452 PolarHBondContact O-N 3.47Å; L452-K454 VanDerWaalsContact C-N 3.3Å; L452-K454 PolarHBondContact O-N 3.23Å; L452-Q455 WeakPolarHBondContact O-CB 3.37Å; L452-Q455 PolarHBondContact O-N 2.69Å; L452-S456 PolarHBondContact O-N 2.97Å; L452-S456 VanDerWaalsContact O-N 3.13Å
453	S	94.2	Very high	94.6	Very high	53 Å²	53	53.6 Å²	53.6	37%	0.371	27%	0.274	S	S	.	.	H	α-helix	trans	-62.3	-38.3	175.8	83.9	0	0	0	0	112	E449 I450 L451 S456 C457	E449-S453 WeakPolarHBondContact O-CB 3.33Å; E449-S453 PolarHBondContact O-N 2.9Å; I450-S453 WeakPolarHBondContact O-CB 3.36Å; I450-S453 PolarHBondContact O-N 3.34Å; I450-S453 PolarHBondContact O-OG 2.65Å; L451-S453 VanDerWaalsContact C-N 3.31Å; L451-S453 PolarHBondContact O-N 3.41Å; S453-S456 WeakPolarHBondContact O-CB 3.42Å; S453-S456 PolarHBondContact O-N 3.47Å; S453-S456 PolarHBondContact O-OG 2.84Å; S453-C457 PolarHBondContact O-N 3.34Å
454	K	93.4	Very high	94.5	Very high	27 Å²	27	55.6 Å²	55.6	12%	0.117	28%	0.279	C	S	.	.	H	α-helix	trans	-68.6	-39	177.1	-59	-46.4	-178.1	162.4	0	112	L409 I450 L451 L452 S456 C457 R499	L409-K454 HydrophobicContact CD1-CB 4.28Å; L409-K454 HydrophobicContact CD2-CB 3.99Å; I450-K454 WeakPolarHBondContact O-CG 3.35Å; I450-K454 PolarHBondContact O-N 3.39Å; I450-K454 VanDerWaalsContact O-N 3.11Å; L451-K454 PolarHBondContact O-N 3.1Å; L452-K454 VanDerWaalsContact C-N 3.3Å; L452-K454 PolarHBondContact O-N 3.23Å; K454-S456 PolarHBondContact O-N 3.45Å; K454-C457 PolarHBondContact O-N 3.3Å; K454-R499 HydrophobicContact CD-CG 4.07Å; K454-R499 HydrophobicContact CG-CG 4.4Å
455	Q	92.7	Very high	94.3	Very high	74 Å²	74	56.7 Å²	56.7	35%	0.346	28%	0.283	S	S	.	.	H	α-helix	trans	-56.5	-40.3	171.9	-172.9	66.1	19.7	0	0	111	L409 L451 L452 C457 I458	L409-Q455 HydrophobicContact CD1-CB 4.42Å; L451-Q455 PolarHBondContact O-N 3.12Å; L451-Q455 VanDerWaalsContact O-N 3.07Å; L452-Q455 WeakPolarHBondContact O-CB 3.37Å; L452-Q455 PolarHBondContact O-N 2.69Å; Q455-C457 VanDerWaalsContact C-N 3.34Å; Q455-C457 PolarHBondContact O-N 3.48Å; Q455-I458 PolarHBondContact O-N 3.43Å
456	S	92.8	Very high	93.9	Very high	42 Å²	42	56.6 Å²	56.6	29%	0.294	29%	0.288	S	S	.	.	H	α-helix	trans	-66.5	-29.4	176.6	86.7	0	0	0	0	114	L452 S453 K454 I458 S459 K460	L452-S456 PolarHBondContact O-N 2.97Å; L452-S456 VanDerWaalsContact O-N 3.13Å; S453-S456 WeakPolarHBondContact O-CB 3.42Å; S453-S456 PolarHBondContact O-N 3.47Å; S453-S456 PolarHBondContact O-OG 2.84Å; K454-S456 PolarHBondContact O-N 3.45Å; S456-I458 VanDerWaalsContact C-N 3.25Å; S456-I458 PolarHBondContact O-N 3.49Å; S456-S459 PolarHBondContact O-N 3.32Å; S456-K460 WeakPolarHBondContact O-CG 3.44Å; S456-K460 PolarHBondContact O-N 2.95Å; S456-K460 VanDerWaalsContact O-N 3.13Å; S456-K460 PolarHBondContact OG-NZ 2.84Å; S456-K460 VanDerWaalsContact OG-NZ 3.11Å
457	C	92.6	Very high	93.7	Very high	12 Å²	12	57.4 Å²	57.4	8%	0.081	29%	0.292	C	S	.	.	H	α-helix	trans	-65.7	-28.4	179.7	-75.3	0	0	0	0	110.8	C251 S453 K454 Q455 K460 Y461	C251-C457 WeakPolarHBondContact CB-SG 3.23Å; C251-C457 WeakPolarHBondContact SG-CB 3.3Å; C251-C457 CovalentContact SG-SG 2.14Å; C251-C457 PolarHBondContact SG-SG 3.41Å; S453-C457 PolarHBondContact O-N 3.34Å; K454-C457 PolarHBondContact O-N 3.3Å; Q455-C457 VanDerWaalsContact C-N 3.34Å; Q455-C457 PolarHBondContact O-N 3.48Å; C457-K460 PolarHBondContact O-N 3.42Å; C457-Y461 PolarHBondContact O-N 3.36Å
458	I	93.3	Very high	93.3	Very high	18 Å²	18	57 Å²	57	9%	0.092	29%	0.293	C	S	.	.	H	α-helix	trans	-60.9	-51.5	174.3	-61	176.4	0	0	0	111.3	H402 L405 L409 Q455 S456 K460 Y461 Y462	H402-I458 HydrophobicContact CB-CG2 4.25Å; L405-I458 HydrophobicContact CD2-CD1 4.21Å; L405-I458 HydrophobicContact CD2-CG1 4.28Å; L405-I458 HydrophobicContact CG-CD1 4.26Å; L409-I458 HydrophobicContact CD1-CD1 4.08Å; Q455-I458 PolarHBondContact O-N 3.43Å; S456-I458 VanDerWaalsContact C-N 3.25Å; S456-I458 PolarHBondContact O-N 3.49Å; I458-K460 VanDerWaalsContact C-N 3.35Å; I458-K460 PolarHBondContact O-N 3.49Å; I458-Y461 PolarHBondContact O-N 3.13Å; I458-Y462 HydrophobicContact CG2-CD2 4.4Å; I458-Y462 HydrophobicContact CG2-CE2 4.07Å; I458-Y462 VanDerWaalsContact O-CD2 3.31Å; I458-Y462 WeakPolarHBondContact O-CD2 3.49Å; I458-Y462 PolarHBondContact O-N 3.48Å
459	S	92.5	Very high	92.8	Very high	82 Å²	82	56.3 Å²	56.3	57%	0.573	29%	0.289	S	S	*	.	H	α-helix	trans	-65.8	-38.8	179.6	-53.9	0	0	0	0	111.9	S456 Y461 Y462 L463	S456-S459 PolarHBondContact O-N 3.32Å; S459-Y461 VanDerWaalsContact C-N 3.31Å; S459-Y461 PolarHBondContact O-N 3.28Å; S459-Y462 PolarHBondContact O-N 3.44Å; S459-L463 PolarHBondContact O-N 3.09Å; S459-L463 VanDerWaalsContact O-N 3.09Å
460	K	94.3	Very high	92.2	Very high	96 Å²	96	57.2 Å²	57.2	42%	0.417	29%	0.291	S	S	.	.	H	α-helix	trans	-61	-38.2	177.1	-74.2	168.7	179.4	160.2	0	112.2	S456 C457 I458 L463 R464	S456-K460 WeakPolarHBondContact O-CG 3.44Å; S456-K460 PolarHBondContact O-N 2.95Å; S456-K460 VanDerWaalsContact O-N 3.13Å; S456-K460 PolarHBondContact OG-NZ 2.84Å; S456-K460 VanDerWaalsContact OG-NZ 3.11Å; C457-K460 PolarHBondContact O-N 3.42Å; I458-K460 VanDerWaalsContact C-N 3.35Å; I458-K460 PolarHBondContact O-N 3.49Å; K460-L463 PolarHBondContact O-N 3.43Å; K460-R464 WeakPolarHBondContact O-CB 3.43Å; K460-R464 WeakPolarHBondContact O-CG 3.39Å; K460-R464 PolarHBondContact O-N 2.96Å
461	Y	95.3	Very high	91.7	Very high	8 Å²	8	58.3 Å²	58.3	3%	0.031	30%	0.297	C	S	.	.	H	α-helix	trans	-59.4	-51.2	175.2	162.3	-96.7	0	0	0	111.6	I398 H402 C457 I458 S459 L463 R464 R465 M488 D489 E492	I398-Y461 HydrophobicContact CD1-CE2 4.29Å; I398-Y461 WeakPolarHBondContact CD1-OH 3.24Å; I398-Y461 HydrophobicContact CG2-CD1 4.41Å; I398-Y461 HydrophobicContact CG2-CE1 3.69Å; I398-Y461 HydrophobicContact CG2-CE2 4.48Å; H402-Y461 AromaticContact CE1-CD1 3.36Å; H402-Y461 WeakPolarHBondContact CE1-CD1 3.48Å; H402-Y461 AromaticContact CE1-CE1 3.86Å; H402-Y461 AromaticContact CE1-CG 3.88Å; C457-Y461 PolarHBondContact O-N 3.36Å; I458-Y461 PolarHBondContact O-N 3.13Å; S459-Y461 VanDerWaalsContact C-N 3.31Å; S459-Y461 PolarHBondContact O-N 3.28Å; Y461-L463 VanDerWaalsContact C-N 3.28Å; Y461-L463 PolarHBondContact O-N 3.39Å; Y461-R464 PolarHBondContact O-N 3.44Å; Y461-R465 VanDerWaalsContact O-CB 3.25Å; Y461-R465 WeakPolarHBondContact O-CB 3.41Å; Y461-R465 PolarHBondContact O-N 2.92Å; Y461-R465 WeakPolarHBondContact OH-CD 3.3Å; Y461-M488 HydrophobicContact CD2-CE 4.5Å; Y461-M488 HydrophobicContact CE2-CE 4Å; Y461-D489 PolarHBondContact OH-OD1 3.43Å; Y461-E492 HydrophobicContact CD1-CG 4.36Å; Y461-E492 HydrophobicContact CD2-CB 3.55Å; Y461-E492 HydrophobicContact CD2-CG 3.44Å; Y461-E492 VanDerWaalsContact CD2-CG 3.44Å; Y461-E492 HydrophobicContact CE2-CB 3.65Å; Y461-E492 HydrophobicContact CE2-CG 3.82Å; Y461-E492 HydrophobicContact CG-CB 4.35Å; Y461-E492 HydrophobicContact CG-CG 3.72Å
462	Y	93.7	Very high	91.1	Very high	79 Å²	79	58.2 Å²	58.2	31%	0.31	30%	0.297	S	S	.	.	H	α-helix	trans	-63.8	-35.8	-178.9	-72.9	-69	0	0	0	112.5	H402 I458 S459 A466	H402-Y462 AromaticContact ND1-CE2 3.26Å; H402-Y462 VanDerWaalsContact ND1-CE2 3.26Å; H402-Y462 WeakPolarHBondContact ND1-CE2 3.18Å; H402-Y462 AromaticContact ND1-CZ 3.47Å; H402-Y462 PolarHBondContact ND1-OH 3.07Å; I458-Y462 HydrophobicContact CG2-CD2 4.4Å; I458-Y462 HydrophobicContact CG2-CE2 4.07Å; I458-Y462 VanDerWaalsContact O-CD2 3.31Å; I458-Y462 WeakPolarHBondContact O-CD2 3.49Å; I458-Y462 PolarHBondContact O-N 3.48Å; S459-Y462 PolarHBondContact O-N 3.44Å; Y462-A466 WeakPolarHBondContact O-CB 3.41Å; Y462-A466 PolarHBondContact O-N 3.23Å
463	L	93.2	Very high	90.3	Very high	106 Å²	106	56 Å²	56	56%	0.555	29%	0.286	S	S	*	.	H	α-helix	trans	-64	-52.9	174.9	-175.5	66.4	0	0	0	111.6	S459 K460 Y461 R465 A466 E467	S459-L463 PolarHBondContact O-N 3.09Å; S459-L463 VanDerWaalsContact O-N 3.09Å; K460-L463 PolarHBondContact O-N 3.43Å; Y461-L463 VanDerWaalsContact C-N 3.28Å; Y461-L463 PolarHBondContact O-N 3.39Å; L463-R465 VanDerWaalsContact C-N 3.28Å; L463-R465 PolarHBondContact O-N 3.24Å; L463-A466 PolarHBondContact O-N 2.95Å; L463-A466 VanDerWaalsContact O-N 3.13Å; L463-E467 WeakPolarHBondContact O-CG 3.45Å; L463-E467 PolarHBondContact O-N 3.21Å
464	R	93.2	Very high	89.6	Confident	105 Å²	105	57 Å²	57	40%	0.396	30%	0.297	S	S	.	.	H	α-helix	trans	-60.4	-39.5	178.2	-73.4	179.3	179.5	-171.7	-2	111.9	S250 K460 Y461 E467 L468 M488	S250-R464 PolarHBondContact OG-NH2 2.86Å; S250-R464 VanDerWaalsContact OG-NH2 3.1Å; K460-R464 WeakPolarHBondContact O-CB 3.43Å; K460-R464 WeakPolarHBondContact O-CG 3.39Å; K460-R464 PolarHBondContact O-N 2.96Å; Y461-R464 PolarHBondContact O-N 3.44Å; R464-E467 PolarHBondContact O-N 3.38Å; R464-L468 WeakPolarHBondContact O-CB 3.25Å; R464-L468 PolarHBondContact O-N 3.23Å; R464-M488 HydrophobicContact CB-SD 4.25Å
465	R	91.9	Very high	89	Confident	23 Å²	23	59 Å²	59	9%	0.087	31%	0.307	C	S	.	.	H	α-helix	trans	-61.9	-44.1	175.2	-174.2	163.4	-173.8	-72.3	2.5	111.8	Q393 Y461 L463 L468 L469 L485 M488 D489	Q393-R465 PolarHBondContact O-NH1 2.79Å; Q393-R465 PolarHBondContact O-NH2 2.93Å; Y461-R465 VanDerWaalsContact O-CB 3.25Å; Y461-R465 WeakPolarHBondContact O-CB 3.41Å; Y461-R465 PolarHBondContact O-N 2.92Å; Y461-R465 WeakPolarHBondContact OH-CD 3.3Å; L463-R465 VanDerWaalsContact C-N 3.28Å; L463-R465 PolarHBondContact O-N 3.24Å; R465-L468 PolarHBondContact O-N 2.79Å; R465-L469 HydrophobicContact CG-CD1 4.33Å; R465-L469 WeakPolarHBondContact O-CB 3.18Å; R465-L469 VanDerWaalsContact O-CG 3.25Å; R465-L469 WeakPolarHBondContact O-CG 3.5Å; R465-L469 PolarHBondContact O-N 3.42Å; R465-L485 HydrophobicContact CG-CD1 3.79Å; R465-M488 HydrophobicContact CB-CE 3.38Å; R465-M488 HydrophobicContact CB-SD 4.3Å; R465-M488 HydrophobicContact CG-CE 3.52Å; R465-D489 IonicContact NE-OD1 3.12Å; R465-D489 PolarHBondContact NE-OD1 2.99Å; R465-D489 IonicContact NE-OD2 3.54Å
466	A	88.2	Confident	88.3	Confident	45 Å²	45	57.4 Å²	57.4	37%	0.372	30%	0.304	S	S	.	.	H	α-helix	trans	-65.7	-38.3	177.4	0	0	0	0	0	112.2	Y462 L463 L469 K470	Y462-A466 WeakPolarHBondContact O-CB 3.41Å; Y462-A466 PolarHBondContact O-N 3.23Å; L463-A466 PolarHBondContact O-N 2.95Å; L463-A466 VanDerWaalsContact O-N 3.13Å; A466-L469 PolarHBondContact O-N 3.46Å; A466-K470 WeakPolarHBondContact O-CG 3.36Å; A466-K470 PolarHBondContact O-N 2.82Å; A466-K470 VanDerWaalsContact O-N 3.14Å
467	E	90.1	Very high	87.5	Confident	97 Å²	97	62.5 Å²	62.5	45%	0.453	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-49.7	174	-71.2	169.5	171.4	0	0	111.3	L463 R464 L469 K470 D471	L463-E467 WeakPolarHBondContact O-CG 3.45Å; L463-E467 PolarHBondContact O-N 3.21Å; R464-E467 PolarHBondContact O-N 3.38Å; E467-L469 VanDerWaalsContact C-N 3.28Å; E467-L469 PolarHBondContact O-N 3.05Å; E467-K470 WeakPolarHBondContact O-CB 3.35Å; E467-K470 PolarHBondContact O-N 3.12Å; E467-D471 PolarHBondContact O-N 3.48Å
468	L	88.5	Confident	87.1	Confident	29 Å²	29	65 Å²	65	15%	0.152	33%	0.334	C	S	.	.	H	α-helix	trans	-64.4	-33.7	178.6	-175	56.8	0	0	0	112.7	R464 R465 K470 D471 I472 A484 L485 M488	R464-L468 WeakPolarHBondContact O-CB 3.25Å; R464-L468 PolarHBondContact O-N 3.23Å; R465-L468 PolarHBondContact O-N 2.79Å; L468-K470 VanDerWaalsContact C-N 3.32Å; L468-K470 PolarHBondContact O-N 3.02Å; L468-D471 PolarHBondContact O-N 3.2Å; L468-I472 HydrophobicContact CG-CD1 4.41Å; L468-I472 WeakPolarHBondContact O-CG1 3.31Å; L468-I472 PolarHBondContact O-N 2.8Å; L468-A484 HydrophobicContact CD1-CB 4.25Å; L468-A484 HydrophobicContact CD2-CB 4Å; L468-L485 VanDerWaalsContact CD2-CA 3.47Å; L468-L485 HydrophobicContact CD2-CB 3.85Å; L468-L485 HydrophobicContact CD2-CD1 4.31Å; L468-L485 HydrophobicContact CG-CB 4.38Å; L468-M488 HydrophobicContact CD2-SD 4.32Å
469	L	86.2	Confident	86.7	Confident	19 Å²	19	67.4 Å²	67.4	10%	0.099	35%	0.345	C	S	.	.	H	α-helix	trans	-64.5	-35.1	173.2	-77.9	175.5	0	0	0	112.8	I392 R465 A466 E467 D471 I472 I473 L485	I392-L469 HydrophobicContact CB-CD1 4.49Å; I392-L469 HydrophobicContact CB-CD2 4.46Å; I392-L469 HydrophobicContact CD1-CD2 4.02Å; I392-L469 HydrophobicContact CG2-CD1 4.01Å; I392-L469 HydrophobicContact CG2-CD2 3.63Å; I392-L469 HydrophobicContact CG2-CG 4.5Å; R465-L469 HydrophobicContact CG-CD1 4.33Å; R465-L469 WeakPolarHBondContact O-CB 3.18Å; R465-L469 VanDerWaalsContact O-CG 3.25Å; R465-L469 WeakPolarHBondContact O-CG 3.5Å; R465-L469 PolarHBondContact O-N 3.42Å; A466-L469 PolarHBondContact O-N 3.46Å; E467-L469 VanDerWaalsContact C-N 3.28Å; E467-L469 PolarHBondContact O-N 3.05Å; L469-D471 VanDerWaalsContact C-N 3.3Å; L469-D471 PolarHBondContact O-N 3.37Å; L469-I472 HydrophobicContact CD2-CD1 4.2Å; L469-I472 PolarHBondContact O-N 3.05Å; L469-I473 WeakPolarHBondContact O-CD1 3.26Å; L469-I473 VanDerWaalsContact O-CG1 3.27Å; L469-I473 WeakPolarHBondContact O-CG1 3.26Å; L469-I473 PolarHBondContact O-N 3.37Å; L469-L485 HydrophobicContact CD2-CD2 3.68Å
470	K	84.4	Confident	86.5	Confident	144 Å²	144	69.5 Å²	69.5	63%	0.626	35%	0.35	S	S	*	.	H	α-helix	trans	-61.7	-41.4	173.4	-68.5	171.3	-177.9	176.9	0	111	A466 E467 L468 I473 A474	A466-K470 WeakPolarHBondContact O-CG 3.36Å; A466-K470 PolarHBondContact O-N 2.82Å; A466-K470 VanDerWaalsContact O-N 3.14Å; E467-K470 WeakPolarHBondContact O-CB 3.35Å; E467-K470 PolarHBondContact O-N 3.12Å; L468-K470 VanDerWaalsContact C-N 3.32Å; L468-K470 PolarHBondContact O-N 3.02Å; K470-I473 PolarHBondContact O-N 3.39Å; K470-A474 WeakPolarHBondContact O-CB 3.49Å; K470-A474 PolarHBondContact O-N 3.05Å
471	D	85	Confident	86	Confident	79 Å²	79	65.9 Å²	65.9	42%	0.422	34%	0.337	S	S	.	.	H	α-helix	trans	-65.7	-39.7	177.5	-65.4	-22.3	0	0	0	111.8	E467 L468 L469 A474 M475	E467-D471 PolarHBondContact O-N 3.48Å; L468-D471 PolarHBondContact O-N 3.2Å; L469-D471 VanDerWaalsContact C-N 3.3Å; L469-D471 PolarHBondContact O-N 3.37Å; D471-A474 PolarHBondContact O-N 3.13Å; D471-M475 HydrophobicContact CB-CE 4.25Å; D471-M475 PolarHBondContact O-N 3.1Å
472	I	83.3	Confident	85.4	Confident	3 Å²	3	66.3 Å²	66.3	2%	0.015	34%	0.338	C	S	.	.	H	α-helix	trans	-63.4	-42.7	175.1	-68.5	165.5	0	0	0	111.3	V57 L468 L469 M475 P476 C481 R482 L485	V57-I472 HydrophobicContact CG1-CG2 4.32Å; L468-I472 HydrophobicContact CG-CD1 4.41Å; L468-I472 WeakPolarHBondContact O-CG1 3.31Å; L468-I472 PolarHBondContact O-N 2.8Å; L469-I472 HydrophobicContact CD2-CD1 4.2Å; L469-I472 PolarHBondContact O-N 3.05Å; I472-M475 CarbonylContact O-C 3.5Å; I472-M475 PolarHBondContact O-N 3.1Å; I472-P476 VanDerWaalsContact O-CA 3.27Å; I472-P476 WeakPolarHBondContact O-CA 3.26Å; I472-P476 VanDerWaalsContact O-N 3.14Å; I472-C481 HydrophobicContact CG1-CB 3.65Å; I472-R482 HydrophobicContact CG1-CG 4.37Å; I472-R482 HydrophobicContact CG2-CG 4.27Å; I472-L485 HydrophobicContact CD1-CB 3.84Å; I472-L485 HydrophobicContact CD1-CD2 3.64Å; I472-L485 HydrophobicContact CD1-CG 4.32Å
473	I	78.4	Confident	85.1	Confident	36 Å²	36	65.7 Å²	65.7	19%	0.185	34%	0.34	C	S	.	.	H	α-helix	trans	-66.5	-41.4	178	-67.8	163.1	0	0	0	110.5	H387 A389 I392 L469 K470	H387-I473 HydrophobicContact CB-CG2 3.9Å; A389-I473 HydrophobicContact CB-CD1 3.82Å; I392-I473 HydrophobicContact CD1-CD1 4.08Å; I392-I473 HydrophobicContact CD1-CG1 4.1Å; L469-I473 WeakPolarHBondContact O-CD1 3.26Å; L469-I473 VanDerWaalsContact O-CG1 3.27Å; L469-I473 WeakPolarHBondContact O-CG1 3.26Å; L469-I473 PolarHBondContact O-N 3.37Å; K470-I473 PolarHBondContact O-N 3.39Å
474	A	79.3	Confident	84.9	Confident	74 Å²	74	62.3 Å²	62.3	61%	0.612	33%	0.328	S	S	*	.	H	α-helix	trans	-68.9	-32.9	178.4	0	0	0	0	0	112.7	K470 D471	K470-A474 WeakPolarHBondContact O-CB 3.49Å; K470-A474 PolarHBondContact O-N 3.05Å; D471-A474 PolarHBondContact O-N 3.13Å
475	M	81.2	Confident	84.8	Confident	68 Å²	68	57.5 Å²	57.5	34%	0.335	31%	0.31	S	S	.	.			trans	-133.6	66	-174.2	-60.2	177.2	-68.6	0	0	111.7	D471 I472 H477 L478	D471-M475 HydrophobicContact CB-CE 4.25Å; D471-M475 PolarHBondContact O-N 3.1Å; I472-M475 CarbonylContact O-C 3.5Å; I472-M475 PolarHBondContact O-N 3.1Å; M475-H477 PolarHBondContact O-N 2.94Å; M475-L478 HydrophobicContact CB-CB 4.32Å; M475-L478 HydrophobicContact CB-CD1 3.68Å; M475-L478 HydrophobicContact CB-CG 3.93Å; M475-L478 HydrophobicContact CE-CD1 3.95Å; M475-L478 HydrophobicContact CG-CD1 4.13Å; M475-L478 PolarHBondContact O-N 2.89Å; M475-L478 HydrophobicContact SD-CD1 3.48Å; M475-L478 WeakPolarHBondContact SD-CD1 3.4Å
476	P	76.3	Confident	84.7	Confident	41 Å²	41	58.9 Å²	58.9	27%	0.266	32%	0.315	S	S	.	.	T	Hydrogen-bonded Turn	trans	-66.9	-15.1	-172.8	26	-35.2	0	0	0	114	I59 I472	I59-P476 HydrophobicContact CG2-CB 4.2Å; I472-P476 VanDerWaalsContact O-CA 3.27Å; I472-P476 WeakPolarHBondContact O-CA 3.26Å; I472-P476 VanDerWaalsContact O-N 3.14Å
477	H	77.3	Confident	84.9	Confident	149 Å²	149	64.3 Å²	64.3	69%	0.69	33%	0.326	S	S	*	.	T	Hydrogen-bonded Turn	trans	-83.5	-11.5	177.1	57.4	-85.4	0	0	0	113.2	M475 E479	M475-H477 PolarHBondContact O-N 2.94Å; H477-E479 PolarHBondContact O-N 3.37Å
478	L	83.3	Confident	85	Confident	63 Å²	63	60.7 Å²	60.7	33%	0.33	31%	0.309	S	S	.	.			trans	-87.8	101.7	177.3	-66.3	-177	0	0	0	110.6	M475 D480 C481	M475-L478 HydrophobicContact CB-CB 4.32Å; M475-L478 HydrophobicContact CB-CD1 3.68Å; M475-L478 HydrophobicContact CB-CG 3.93Å; M475-L478 HydrophobicContact CE-CD1 3.95Å; M475-L478 HydrophobicContact CG-CD1 4.13Å; M475-L478 PolarHBondContact O-N 2.89Å; M475-L478 HydrophobicContact SD-CD1 3.48Å; M475-L478 WeakPolarHBondContact SD-CD1 3.4Å; L478-D480 VanDerWaalsContact C-N 3.25Å; L478-D480 PolarHBondContact O-N 3.32Å; L478-C481 PolarHBondContact O-N 3.03Å
479	E	84.8	Confident	85.3	Confident	70 Å²	70	59.9 Å²	59.9	33%	0.327	31%	0.305	S	S	.	.	H	α-helix	trans	-65.6	-29.5	178.6	-162.4	56.6	-140.5	0	0	112.4	L54 H477 C481 R482 L483	L54-E479 WeakPolarHBondContact CD1-OE1 3.39Å; L54-E479 WeakPolarHBondContact CD2-OE1 3.38Å; L54-E479 WeakPolarHBondContact CG-OE1 3.24Å; H477-E479 PolarHBondContact O-N 3.37Å; E479-C481 VanDerWaalsContact C-N 3.27Å; E479-C481 PolarHBondContact O-N 3.25Å; E479-R482 WeakPolarHBondContact O-CB 3.5Å; E479-R482 PolarHBondContact O-N 3.06Å; E479-R482 WeakPolarHBondContact OE2-CD 3.35Å; E479-R482 IonicContact OE2-NH1 2.71Å; E479-R482 PolarHBondContact OE2-NH1 3.45Å; E479-L483 HydrophobicContact CG-CD1 4.45Å; E479-L483 PolarHBondContact O-N 3.34Å
480	D	87.9	Confident	85.6	Confident	126 Å²	126	59.5 Å²	59.5	67%	0.674	30%	0.304	S	S	*	.	H	α-helix	trans	-57.3	-38.4	176.9	-68.3	-15	0	0	0	112.4	L478 R482 L483 A484	L478-D480 VanDerWaalsContact C-N 3.25Å; L478-D480 PolarHBondContact O-N 3.32Å; D480-R482 VanDerWaalsContact C-N 3.28Å; D480-R482 PolarHBondContact O-N 2.96Å; D480-L483 PolarHBondContact O-N 3.42Å; D480-A484 VanDerWaalsContact O-CB 3.26Å; D480-A484 WeakPolarHBondContact O-CB 3.39Å; D480-A484 PolarHBondContact O-N 3.49Å
481	C	84.1	Confident	86	Confident	20 Å²	20	56.2 Å²	56.2	14%	0.135	29%	0.291	C	S	.	.	H	α-helix	trans	-65.4	-35.4	177	-65.9	0	0	0	0	111.4	I472 L478 E479 L485	I472-C481 HydrophobicContact CG1-CB 3.65Å; L478-C481 PolarHBondContact O-N 3.03Å; E479-C481 VanDerWaalsContact C-N 3.27Å; E479-C481 PolarHBondContact O-N 3.25Å; C481-L485 PolarHBondContact O-N 2.97Å; C481-L485 VanDerWaalsContact O-N 3.13Å
482	R	83	Confident	86.6	Confident	17 Å²	17	53.3 Å²	53.3	6%	0.064	27%	0.274	C	S	.	.	H	α-helix	trans	-77.1	-39.8	-178.8	-51.4	173.4	94	-168.5	2	110.7	L54 V57 I472 E479 D480 A484 L485 Y486	L54-R482 VanDerWaalsContact CD2-C 3.42Å; L54-R482 HydrophobicContact CD2-CB 3.45Å; L54-R482 VanDerWaalsContact CD2-CB 3.45Å; L54-R482 WeakPolarHBondContact CD2-O 3.38Å; V57-R482 PolarHBondContact O-NH2 2.97Å; I472-R482 HydrophobicContact CG1-CG 4.37Å; I472-R482 HydrophobicContact CG2-CG 4.27Å; E479-R482 WeakPolarHBondContact O-CB 3.5Å; E479-R482 PolarHBondContact O-N 3.06Å; E479-R482 WeakPolarHBondContact OE2-CD 3.35Å; E479-R482 IonicContact OE2-NH1 2.71Å; E479-R482 PolarHBondContact OE2-NH1 3.45Å; D480-R482 VanDerWaalsContact C-N 3.28Å; D480-R482 PolarHBondContact O-N 2.96Å; R482-A484 VanDerWaalsContact C-N 3.35Å; R482-L485 WeakPolarHBondContact O-CB 3.34Å; R482-L485 PolarHBondContact O-N 3.36Å; R482-Y486 PolarHBondContact O-N 3.28Å; R482-Y486 VanDerWaalsContact O-N 3.12Å
483	L	87.7	Confident	87.1	Confident	65 Å²	65	53.5 Å²	53.5	34%	0.34	28%	0.275	S	S	.	.	H	α-helix	trans	-62.2	-41.4	169.8	-75.3	170.5	0	0	0	111.6	L54 E479 D480 L485 Y486 W487	L54-L483 HydrophobicContact CD1-CD2 3.74Å; L54-L483 HydrophobicContact CD1-CG 4.21Å; L54-L483 HydrophobicContact CD2-CD2 4.41Å; L54-L483 HydrophobicContact CG-CD2 4.49Å; E479-L483 HydrophobicContact CG-CD1 4.45Å; E479-L483 PolarHBondContact O-N 3.34Å; D480-L483 PolarHBondContact O-N 3.42Å; L483-L485 VanDerWaalsContact C-N 3.28Å; L483-L485 PolarHBondContact O-N 3.03Å; L483-Y486 WeakPolarHBondContact O-CB 3.43Å; L483-Y486 PolarHBondContact O-N 3.34Å; L483-W487 PolarHBondContact O-N 2.96Å
484	A	89.9	Confident	87.8	Confident	36 Å²	36	57.1 Å²	57.1	30%	0.298	29%	0.291	S	S	.	.	H	α-helix	trans	-60.3	-38.5	175.4	0	0	0	0	0	111.9	L468 D480 R482 W487 M488	L468-A484 HydrophobicContact CD1-CB 4.25Å; L468-A484 HydrophobicContact CD2-CB 4Å; D480-A484 VanDerWaalsContact O-CB 3.26Å; D480-A484 WeakPolarHBondContact O-CB 3.39Å; D480-A484 PolarHBondContact O-N 3.49Å; R482-A484 VanDerWaalsContact C-N 3.35Å; A484-W487 PolarHBondContact O-N 3.13Å; A484-M488 VanDerWaalsContact O-CB 3.26Å; A484-M488 WeakPolarHBondContact O-CB 3.25Å; A484-M488 PolarHBondContact O-N 3.37Å
485	L	89.7	Confident	88.6	Confident	4 Å²	4	54.6 Å²	54.6	2%	0.021	27%	0.269	C	S	.	.	H	α-helix	trans	-64.9	-43.8	176.5	177.7	64.9	0	0	0	111.2	V57 R465 L468 L469 I472 C481 R482 L483 M488 D489	V57-L485 HydrophobicContact CG1-CD2 4.42Å; V57-L485 HydrophobicContact CG2-CD2 3.91Å; R465-L485 HydrophobicContact CG-CD1 3.79Å; L468-L485 VanDerWaalsContact CD2-CA 3.47Å; L468-L485 HydrophobicContact CD2-CB 3.85Å; L468-L485 HydrophobicContact CD2-CD1 4.31Å; L468-L485 HydrophobicContact CG-CB 4.38Å; L469-L485 HydrophobicContact CD2-CD2 3.68Å; I472-L485 HydrophobicContact CD1-CB 3.84Å; I472-L485 HydrophobicContact CD1-CD2 3.64Å; I472-L485 HydrophobicContact CD1-CG 4.32Å; C481-L485 PolarHBondContact O-N 2.97Å; C481-L485 VanDerWaalsContact O-N 3.13Å; R482-L485 WeakPolarHBondContact O-CB 3.34Å; R482-L485 PolarHBondContact O-N 3.36Å; L483-L485 VanDerWaalsContact C-N 3.28Å; L483-L485 PolarHBondContact O-N 3.03Å; L485-M488 HydrophobicContact CD1-CE 3.62Å; L485-M488 PolarHBondContact O-N 2.88Å; L485-D489 PolarHBondContact O-N 2.95Å
486	Y	89.4	Confident	89.3	Confident	52 Å²	52	51.3 Å²	51.3	20%	0.204	25%	0.253	C	S	.	.	H	α-helix	trans	-59.6	-49.9	174.5	172	-103.9	0	0	0	112	F50 G51 S52 R482 L483 M488 D489 V490	F50-Y486 HydrophobicContact CD2-CE2 4.31Å; G51-Y486 WeakPolarHBondContact O-CE2 3.42Å; S52-Y486 VanDerWaalsContact CA-CE2 3.42Å; R482-Y486 PolarHBondContact O-N 3.28Å; R482-Y486 VanDerWaalsContact O-N 3.12Å; L483-Y486 WeakPolarHBondContact O-CB 3.43Å; L483-Y486 PolarHBondContact O-N 3.34Å; Y486-M488 VanDerWaalsContact C-N 3.34Å; Y486-M488 PolarHBondContact O-N 2.99Å; Y486-D489 WeakPolarHBondContact O-CB 3.39Å; Y486-D489 PolarHBondContact O-N 3.41Å; Y486-V490 HydrophobicContact CD1-CG2 4.34Å; Y486-V490 HydrophobicContact CD2-CG2 4.33Å; Y486-V490 HydrophobicContact CE1-CG2 3.85Å; Y486-V490 HydrophobicContact CE2-CG2 3.8Å; Y486-V490 WeakPolarHBondContact O-CG2 3.49Å; Y486-V490 PolarHBondContact O-N 3.02Å
487	W	92.2	Very high	90.1	Very high	159 Å²	159	51.9 Å²	51.9	60%	0.602	25%	0.25	S	C	*	.	H	α-helix	trans	-66.2	-34.9	-178.9	-76.7	116.2	0	0	0	113.1	L483 A484 V490 Q491	L483-W487 PolarHBondContact O-N 2.96Å; A484-W487 PolarHBondContact O-N 3.13Å; W487-V490 HydrophobicContact CE3-CB 4.37Å; W487-V490 HydrophobicContact CE3-CG1 4.37Å; W487-V490 HydrophobicContact CZ3-CG1 4.42Å; W487-V490 PolarHBondContact O-N 3.34Å; W487-Q491 WeakPolarHBondContact O-CB 3.36Å; W487-Q491 PolarHBondContact O-N 3.5Å
488	M	93.3	Very high	91	Very high	20 Å²	20	49.3 Å²	49.3	10%	0.099	24%	0.238	C	C	.	.	H	α-helix	trans	-64.9	-40.7	173.4	179.9	-164.8	73.4	0	0	111.6	Y461 R464 R465 L468 A484 L485 Y486 Q491 E492	Y461-M488 HydrophobicContact CD2-CE 4.5Å; Y461-M488 HydrophobicContact CE2-CE 4Å; R464-M488 HydrophobicContact CB-SD 4.25Å; R465-M488 HydrophobicContact CB-CE 3.38Å; R465-M488 HydrophobicContact CB-SD 4.3Å; R465-M488 HydrophobicContact CG-CE 3.52Å; L468-M488 HydrophobicContact CD2-SD 4.32Å; A484-M488 VanDerWaalsContact O-CB 3.26Å; A484-M488 WeakPolarHBondContact O-CB 3.25Å; A484-M488 PolarHBondContact O-N 3.37Å; L485-M488 HydrophobicContact CD1-CE 3.62Å; L485-M488 PolarHBondContact O-N 2.88Å; Y486-M488 VanDerWaalsContact C-N 3.34Å; Y486-M488 PolarHBondContact O-N 2.99Å; M488-Q491 PolarHBondContact O-N 3.42Å; M488-E492 PolarHBondContact O-N 3.45Å
489	D	93.7	Very high	91.6	Very high	12 Å²	12	46.6 Å²	46.6	6%	0.064	22%	0.223	C	C	.	.	H	α-helix	trans	-64.6	-42.5	174.4	-80.8	13.3	0	0	0	111.3	F50 N395 I398 Y461 R465 L485 Y486 E492 Y493	F50-D489 HydrophobicContact CE2-CB 4.02Å; F50-D489 HydrophobicContact CZ-CB 4.25Å; N395-D489 VanDerWaalsContact CB-OD2 3.32Å; N395-D489 WeakPolarHBondContact CB-OD2 3.45Å; N395-D489 PolarHBondContact ND2-OD2 2.97Å; I398-D489 HydrophobicContact CD1-CB 3.54Å; I398-D489 VanDerWaalsContact CD1-O 3.24Å; I398-D489 WeakPolarHBondContact CD1-O 3.36Å; Y461-D489 PolarHBondContact OH-OD1 3.43Å; R465-D489 IonicContact NE-OD1 3.12Å; R465-D489 PolarHBondContact NE-OD1 2.99Å; R465-D489 IonicContact NE-OD2 3.54Å; L485-D489 PolarHBondContact O-N 2.95Å; Y486-D489 WeakPolarHBondContact O-CB 3.39Å; Y486-D489 PolarHBondContact O-N 3.41Å; D489-E492 PolarHBondContact O-N 2.88Å; D489-Y493 PolarHBondContact O-N 3.29Å
490	V	92.6	Very high	92.2	Very high	11 Å²	11	43.2 Å²	43.2	7%	0.067	21%	0.208	C	C	.	.	H	α-helix	trans	-60.6	-47.1	174.4	172	0	0	0	0	111.1	P48 F50 Y486 W487 E492 Y493 E494	P48-V490 HydrophobicContact CG-CG1 4.27Å; P48-V490 HydrophobicContact CG-CG2 4.41Å; F50-V490 HydrophobicContact CE2-CG2 3.97Å; Y486-V490 HydrophobicContact CD1-CG2 4.34Å; Y486-V490 HydrophobicContact CD2-CG2 4.33Å; Y486-V490 HydrophobicContact CE1-CG2 3.85Å; Y486-V490 HydrophobicContact CE2-CG2 3.8Å; Y486-V490 WeakPolarHBondContact O-CG2 3.49Å; Y486-V490 PolarHBondContact O-N 3.02Å; W487-V490 HydrophobicContact CE3-CB 4.37Å; W487-V490 HydrophobicContact CE3-CG1 4.37Å; W487-V490 HydrophobicContact CZ3-CG1 4.42Å; W487-V490 PolarHBondContact O-N 3.34Å; V490-E492 VanDerWaalsContact C-N 3.33Å; V490-E492 PolarHBondContact O-N 2.89Å; V490-Y493 WeakPolarHBondContact O-CB 3.5Å; V490-Y493 PolarHBondContact O-N 3.43Å; V490-E494 PolarHBondContact O-N 2.88Å; V490-E494 VanDerWaalsContact O-N 3.09Å
491	Q	94.6	Very high	92.5	Very high	76 Å²	76	41.9 Å²	41.9	36%	0.355	20%	0.197	S	C	.	.	H	α-helix	trans	-62	-40	178.9	-173.8	-179.9	10.4	0	0	111.8	S249 W487 M488 E494 S495	S249-Q491 PolarHBondContact OG-NE2 3.27Å; W487-Q491 WeakPolarHBondContact O-CB 3.36Å; W487-Q491 PolarHBondContact O-N 3.5Å; M488-Q491 PolarHBondContact O-N 3.42Å; Q491-E494 PolarHBondContact O-N 3.23Å; Q491-S495 VanDerWaalsContact O-CB 3.3Å; Q491-S495 WeakPolarHBondContact O-CB 3.44Å; Q491-S495 PolarHBondContact O-N 3.02Å
492	E	95.6	Very high	93.1	Very high	17 Å²	17	43 Å²	43	8%	0.079	20%	0.201	C	C	.	.	H	α-helix	trans	-69.5	-36.5	177.7	-173.1	64.2	-174.3	0	0	111.9	I398 H402 Y461 M488 D489 V490 S495 C496 R499	I398-E492 HydrophobicContact CG2-CG 4.05Å; H402-E492 IonicContact CE1-OE1 3.26Å; H402-E492 IonicContact NE2-OE1 3.45Å; H402-E492 PolarHBondContact NE2-OE1 3.35Å; Y461-E492 HydrophobicContact CD1-CG 4.36Å; Y461-E492 HydrophobicContact CD2-CB 3.55Å; Y461-E492 HydrophobicContact CD2-CG 3.44Å; Y461-E492 VanDerWaalsContact CD2-CG 3.44Å; Y461-E492 HydrophobicContact CE2-CB 3.65Å; Y461-E492 HydrophobicContact CE2-CG 3.82Å; Y461-E492 HydrophobicContact CG-CB 4.35Å; Y461-E492 HydrophobicContact CG-CG 3.72Å; M488-E492 PolarHBondContact O-N 3.45Å; D489-E492 PolarHBondContact O-N 2.88Å; V490-E492 VanDerWaalsContact C-N 3.33Å; V490-E492 PolarHBondContact O-N 2.89Å; E492-S495 PolarHBondContact O-N 3.39Å; E492-C496 WeakPolarHBondContact O-CB 3.35Å; E492-C496 PolarHBondContact O-N 2.92Å; E492-C496 PolarHBondContact O-SG 3.05Å; E492-R499 IonicContact OE1-CZ 2.79Å; E492-R499 IonicContact OE1-NH1 2.93Å; E492-R499 PolarHBondContact OE1-NH1 3.14Å; E492-R499 IonicContact OE1-NH2 3.8Å; E492-R499 PolarHBondContact OE1-NH2 2.85Å; E492-R499 IonicContact OE2-CZ 3.81Å; E492-R499 IonicContact OE2-NH1 3.43Å; E492-R499 IonicContact OE2-NH2 3.66Å; E492-R499 PolarHBondContact OE2-NH2 2.88Å
493	Y	94.7	Very high	93.8	Very high	7 Å²	7	42.3 Å²	42.3	3%	0.027	20%	0.198	C	C	.	.	H	α-helix	trans	-59.1	-48.5	174.1	-177.4	-93	0	0	0	111.8	I44 P45 P48 P49 F50 L401 D489 V490 C496 R497	I44-Y493 HydrophobicContact CG2-CE1 4.42Å; I44-Y493 HydrophobicContact CG2-CE2 4.2Å; I44-Y493 WeakPolarHBondContact CG2-OH 3.2Å; P45-Y493 PolarHBondContact O-OH 2.98Å; P48-Y493 HydrophobicContact CB-CD1 4.01Å; P48-Y493 HydrophobicContact CB-CE1 4.27Å; P48-Y493 HydrophobicContact CB-CG 4.14Å; P48-Y493 HydrophobicContact CG-CD1 3.68Å; P48-Y493 HydrophobicContact CG-CE1 4.15Å; P48-Y493 HydrophobicContact CG-CG 4.14Å; P49-Y493 HydrophobicContact CG-CE2 4.43Å; F50-Y493 AromaticContact CE1-CD2 3.99Å; F50-Y493 HydrophobicContact CE1-CD2 3.99Å; F50-Y493 HydrophobicContact CE1-CG 4.32Å; F50-Y493 HydrophobicContact CZ-CG 4.4Å; L401-Y493 HydrophobicContact CD2-CD2 3.9Å; L401-Y493 HydrophobicContact CD2-CE2 4.14Å; D489-Y493 PolarHBondContact O-N 3.29Å; V490-Y493 WeakPolarHBondContact O-CB 3.5Å; V490-Y493 PolarHBondContact O-N 3.43Å; Y493-C496 PolarHBondContact O-N 3.35Å; Y493-R497 PolarHBondContact O-N 3.46Å
494	E	93.6	Very high	94.2	Very high	112 Å²	112	40.8 Å²	40.8	52%	0.523	19%	0.189	S	C	.	.	H	α-helix	trans	-63.4	-44.2	176	-69.2	179.7	173.6	0	0	111.6	V490 Q491 C496 R497 E498	V490-E494 PolarHBondContact O-N 2.88Å; V490-E494 VanDerWaalsContact O-N 3.09Å; Q491-E494 PolarHBondContact O-N 3.23Å; E494-C496 VanDerWaalsContact C-N 3.29Å; E494-C496 PolarHBondContact O-N 3.45Å; E494-R497 PolarHBondContact O-N 2.82Å; E494-R497 VanDerWaalsContact O-N 3.15Å; E494-E498 PolarHBondContact O-N 2.96Å; E494-E498 VanDerWaalsContact O-N 3.07Å
495	S	95	Very high	94.5	Very high	21 Å²	21	44.1 Å²	44.1	15%	0.147	20%	0.199	C	C	.	.	H	α-helix	trans	-63.3	-35	178.6	-164.6	0	0	0	0	112.3	Q491 E492 E498 R499	Q491-S495 VanDerWaalsContact O-CB 3.3Å; Q491-S495 WeakPolarHBondContact O-CB 3.44Å; Q491-S495 PolarHBondContact O-N 3.02Å; E492-S495 PolarHBondContact O-N 3.39Å; S495-E498 PolarHBondContact O-N 3.32Å; S495-R499 WeakPolarHBondContact O-CB 3Å; S495-R499 WeakPolarHBondContact O-CG 3.45Å; S495-R499 PolarHBondContact O-N 3.14Å; S495-R499 VanDerWaalsContact OG-CZ 3.29Å; S495-R499 PolarHBondContact OG-NE 2.98Å; S495-R499 VanDerWaalsContact OG-NE 3.15Å; S495-R499 PolarHBondContact OG-NH2 2.98Å
496	C	95.7	Very high	94.9	Very high	0 Å²	0	44 Å²	44	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-64	-40.5	174.4	-74.5	0	0	0	0	112.6	L401 H402 L405 E492 Y493 E494 R499 L500	L401-C496 HydrophobicContact CD1-CB 4.32Å; L401-C496 HydrophobicContact CD2-CB 3.27Å; L401-C496 HydrophobicContact CG-CB 3.58Å; H402-C496 PolarHBondContact CD2-SG 3.01Å; H402-C496 PolarHBondContact NE2-SG 3.39Å; H402-C496 VanDerWaalsContact NE2-SG 3.38Å; L405-C496 HydrophobicContact CD2-CB 4.41Å; E492-C496 WeakPolarHBondContact O-CB 3.35Å; E492-C496 PolarHBondContact O-N 2.92Å; E492-C496 PolarHBondContact O-SG 3.05Å; Y493-C496 PolarHBondContact O-N 3.35Å; E494-C496 VanDerWaalsContact C-N 3.29Å; E494-C496 PolarHBondContact O-N 3.45Å; C496-R499 PolarHBondContact O-N 3.38Å; C496-L500 WeakPolarHBondContact O-CG 3.48Å; C496-L500 PolarHBondContact O-N 3.44Å
497	R	94.2	Very high	95.3	Very high	53 Å²	53	41.5 Å²	41.5	20%	0.2	19%	0.188	C	C	.	.	H	α-helix	trans	-62.7	-45.7	175.3	-66.3	-178.1	71.7	-122.9	-4	110.9	I44 P45 Y493 E494 R499 L500 Q501	I44-R497 HydrophobicContact CB-CG 4.46Å; I44-R497 HydrophobicContact CG2-CG 3.85Å; P45-R497 PolarHBondContact O-NE 2.88Å; Y493-R497 PolarHBondContact O-N 3.46Å; E494-R497 PolarHBondContact O-N 2.82Å; E494-R497 VanDerWaalsContact O-N 3.15Å; R497-R499 PolarHBondContact O-N 3.48Å; R497-L500 PolarHBondContact O-N 3.02Å; R497-Q501 PolarHBondContact O-N 3.33Å
498	E	94.9	Very high	95.5	Very high	94 Å²	94	36.7 Å²	36.7	44%	0.439	17%	0.174	S	C	.	.	H	α-helix	trans	-60.3	-43.5	176.2	-168.3	-164	157.2	0	0	111.8	E494 S495 L500 Q501 Q502	E494-E498 PolarHBondContact O-N 2.96Å; E494-E498 VanDerWaalsContact O-N 3.07Å; S495-E498 PolarHBondContact O-N 3.32Å; E498-L500 PolarHBondContact O-N 3.18Å; E498-Q501 WeakPolarHBondContact O-CB 3.47Å; E498-Q501 PolarHBondContact O-N 3.26Å; E498-Q502 WeakPolarHBondContact O-CG 3.48Å; E498-Q502 PolarHBondContact O-N 3.14Å; E498-Q502 PolarHBondContact OE1-NE2 2.72Å
499	R	96.9	Very high	95.6	Very high	6 Å²	6	38.2 Å²	38.2	2%	0.023	19%	0.185	C	C	.	.	H	α-helix	trans	-64	-39.8	178.2	-70.7	171.3	-152.6	157.5	8.7	112.2	L405 K454 E492 S495 C496 R497 Q502 I503	L405-R499 HydrophobicContact CD1-CB 3.98Å; L405-R499 HydrophobicContact CD2-CB 4.25Å; K454-R499 HydrophobicContact CD-CG 4.07Å; K454-R499 HydrophobicContact CG-CG 4.4Å; E492-R499 IonicContact OE1-CZ 2.79Å; E492-R499 IonicContact OE1-NH1 2.93Å; E492-R499 PolarHBondContact OE1-NH1 3.14Å; E492-R499 IonicContact OE1-NH2 3.8Å; E492-R499 PolarHBondContact OE1-NH2 2.85Å; E492-R499 IonicContact OE2-CZ 3.81Å; E492-R499 IonicContact OE2-NH1 3.43Å; E492-R499 IonicContact OE2-NH2 3.66Å; E492-R499 PolarHBondContact OE2-NH2 2.88Å; S495-R499 WeakPolarHBondContact O-CB 3Å; S495-R499 WeakPolarHBondContact O-CG 3.45Å; S495-R499 PolarHBondContact O-N 3.14Å; S495-R499 VanDerWaalsContact OG-CZ 3.29Å; S495-R499 PolarHBondContact OG-NE 2.98Å; S495-R499 VanDerWaalsContact OG-NE 3.15Å; S495-R499 PolarHBondContact OG-NH2 2.98Å; C496-R499 PolarHBondContact O-N 3.38Å; R497-R499 PolarHBondContact O-N 3.48Å; R499-Q502 PolarHBondContact O-N 2.93Å; R499-I503 WeakPolarHBondContact O-CG1 3.32Å; R499-I503 PolarHBondContact O-N 3.27Å; R499-I503 VanDerWaalsContact O-N 3.07Å
500	L	96.6	Very high	95.8	Very high	0 Å²	0	37.7 Å²	37.7	0%	0	18%	0.182	C	C	.	.	H	α-helix	trans	-63.9	-41.9	174.1	-72.4	167.8	0	0	0	111.6	V37 I40 W41 I44 L401 L405 Q408 C496 R497 E498 Q502 I503 E504	V37-L500 WeakPolarHBondContact CG1-O 3.38Å; I40-L500 HydrophobicContact CG2-CD1 4.11Å; W41-L500 HydrophobicContact CB-CB 3.66Å; W41-L500 HydrophobicContact CB-CD1 4.09Å; I44-L500 HydrophobicContact CD1-CD1 3.38Å; L401-L500 HydrophobicContact CD1-CD1 4.04Å; L405-L500 HydrophobicContact CB-CD2 4.49Å; L405-L500 HydrophobicContact CD1-CD2 3.81Å; L405-L500 HydrophobicContact CD1-CG 3.97Å; Q408-L500 HydrophobicContact CB-CD2 4.33Å; Q408-L500 HydrophobicContact CG-CD2 4.3Å; C496-L500 WeakPolarHBondContact O-CG 3.48Å; C496-L500 PolarHBondContact O-N 3.44Å; R497-L500 PolarHBondContact O-N 3.02Å; E498-L500 PolarHBondContact O-N 3.18Å; L500-Q502 VanDerWaalsContact C-N 3.31Å; L500-Q502 PolarHBondContact O-N 3.03Å; L500-I503 HydrophobicContact CD2-CD1 4.47Å; L500-I503 PolarHBondContact O-N 3.02Å; L500-I503 VanDerWaalsContact O-N 3.17Å; L500-E504 PolarHBondContact O-N 3.43Å; L500-E504 VanDerWaalsContact O-N 3.16Å
501	Q	95.5	Very high	95.9	Very high	98 Å²	98	38.2 Å²	38.2	46%	0.458	18%	0.183	S	C	.	.	H	α-helix	trans	-60.7	-40.5	174.5	-173	-176.9	-1.1	0	0	111.7	R497 E498 I503 E504 E505	R497-Q501 PolarHBondContact O-N 3.33Å; E498-Q501 WeakPolarHBondContact O-CB 3.47Å; E498-Q501 PolarHBondContact O-N 3.26Å; Q501-I503 VanDerWaalsContact C-N 3.3Å; Q501-I503 PolarHBondContact O-N 2.79Å; Q501-E504 WeakPolarHBondContact O-CB 3.34Å; Q501-E504 PolarHBondContact O-N 3.3Å; Q501-E505 PolarHBondContact O-N 3.29Å
502	Q	95.9	Very high	95.9	Very high	43 Å²	43	36.9 Å²	36.9	20%	0.201	18%	0.177	C	C	.	.	H	α-helix	trans	-64.8	-31.5	175.6	-74.5	168.3	0.6	0	0	112.8	E498 R499 L500 E505 F506	E498-Q502 WeakPolarHBondContact O-CG 3.48Å; E498-Q502 PolarHBondContact O-N 3.14Å; E498-Q502 PolarHBondContact OE1-NE2 2.72Å; R499-Q502 PolarHBondContact O-N 2.93Å; L500-Q502 VanDerWaalsContact C-N 3.31Å; L500-Q502 PolarHBondContact O-N 3.03Å; Q502-E505 PolarHBondContact O-N 2.97Å; Q502-F506 WeakPolarHBondContact O-CB 3.27Å; Q502-F506 PolarHBondContact O-N 2.82Å
503	I	97.3	Very high	95.9	Very high	2 Å²	2	37.5 Å²	37.5	1%	0.01	18%	0.18	C	C	.	.	H	α-helix	trans	-68.7	-40	174	-64.8	164.6	0	0	0	110.8	V37 L405 Q408 L409 A412 L451 R499 L500 Q501 F506 Y507	V37-I503 HydrophobicContact CG1-CB 4.19Å; V37-I503 HydrophobicContact CG1-CG2 4.24Å; V37-I503 HydrophobicContact CG2-CG2 3.9Å; L405-I503 HydrophobicContact CD1-CD1 3.78Å; Q408-I503 HydrophobicContact CB-CD1 4.16Å; L409-I503 HydrophobicContact CD2-CD1 3.59Å; L409-I503 HydrophobicContact CD2-CG1 3.96Å; L409-I503 HydrophobicContact CG-CD1 3.74Å; A412-I503 HydrophobicContact CB-CG2 4.01Å; L451-I503 HydrophobicContact CD2-CG1 4.2Å; R499-I503 WeakPolarHBondContact O-CG1 3.32Å; R499-I503 PolarHBondContact O-N 3.27Å; R499-I503 VanDerWaalsContact O-N 3.07Å; L500-I503 HydrophobicContact CD2-CD1 4.47Å; L500-I503 PolarHBondContact O-N 3.02Å; L500-I503 VanDerWaalsContact O-N 3.17Å; Q501-I503 VanDerWaalsContact C-N 3.3Å; Q501-I503 PolarHBondContact O-N 2.79Å; I503-F506 WeakPolarHBondContact O-CB 3.5Å; I503-F506 PolarHBondContact O-N 2.87Å; I503-Y507 HydrophobicContact CG2-CD2 4.03Å; I503-Y507 HydrophobicContact CG2-CE2 3.73Å; I503-Y507 WeakPolarHBondContact O-CD2 3.35Å; I503-Y507 PolarHBondContact O-N 3.21Å
504	E	96.9	Very high	95.8	Very high	33 Å²	33	37.2 Å²	37.2	15%	0.154	18%	0.179	C	C	.	.	H	α-helix	trans	-61.3	-47.4	172.2	-178	-168.6	-174.2	0	0	110.6	A34 V37 N38 W41 L500 Q501 F506 Y507 L508	A34-E504 HydrophobicContact CB-CG 4.36Å; V37-E504 HydrophobicContact CB-CB 4.48Å; V37-E504 HydrophobicContact CG1-CB 4.04Å; N38-E504 HydrophobicContact CB-CG 4.45Å; W41-E504 PolarHBondContact NE1-OE2 3.11Å; L500-E504 PolarHBondContact O-N 3.43Å; L500-E504 VanDerWaalsContact O-N 3.16Å; Q501-E504 WeakPolarHBondContact O-CB 3.34Å; Q501-E504 PolarHBondContact O-N 3.3Å; E504-F506 VanDerWaalsContact C-N 3.3Å; E504-F506 PolarHBondContact O-N 3.01Å; E504-Y507 PolarHBondContact O-N 3.09Å; E504-L508 HydrophobicContact CG-CD1 3.97Å; E504-L508 HydrophobicContact CG-CG 4.36Å; E504-L508 WeakPolarHBondContact O-CG 3.44Å; E504-L508 PolarHBondContact O-N 3.5Å
505	E	96.2	Very high	95.8	Very high	107 Å²	107	37.7 Å²	37.7	50%	0.5	18%	0.176	S	C	.	.	H	α-helix	trans	-57.6	-42.3	178.2	-176.9	174.9	-163.3	0	0	111.9	W447 Q501 Q502 L508 T509	W447-E505 HydrophobicContact CH2-CG 4.4Å; Q501-E505 PolarHBondContact O-N 3.29Å; Q502-E505 PolarHBondContact O-N 2.97Å; E505-L508 PolarHBondContact O-N 3.48Å; E505-T509 WeakPolarHBondContact O-CB 3.48Å; E505-T509 PolarHBondContact O-N 2.86Å; E505-T509 PolarHBondContact O-OG1 3.2Å
506	F	97.1	Very high	95.7	Very high	0 Å²	0	45.1 Å²	45.1	0%	0	20%	0.201	C	C	.	.	H	α-helix	trans	-53.3	-55.6	173.1	156.1	-108.5	0	0	0	111.7	F30 A412 C416 W447 L451 Q502 I503 E504 L508 T509 M510	F30-F506 HydrophobicContact CE1-CE1 4.44Å; F30-F506 HydrophobicContact CE1-CZ 4.01Å; F30-F506 HydrophobicContact CZ-CZ 4.24Å; A412-F506 HydrophobicContact CB-CD1 4.24Å; A412-F506 HydrophobicContact CB-CE1 4.1Å; C416-F506 HydrophobicContact CB-CE2 4.12Å; C416-F506 HydrophobicContact CB-CZ 3.63Å; W447-F506 HydrophobicContact CB-CD2 3.75Å; W447-F506 HydrophobicContact CB-CE2 3.88Å; W447-F506 HydrophobicContact CD2-CB 4.18Å; W447-F506 AromaticContact CD2-CD2 3.66Å; W447-F506 HydrophobicContact CD2-CD2 3.66Å; W447-F506 HydrophobicContact CD2-CG 4.39Å; W447-F506 HydrophobicContact CE3-CB 3.69Å; W447-F506 AromaticContact CE3-CD2 3.84Å; W447-F506 HydrophobicContact CE3-CD2 3.84Å; W447-F506 HydrophobicContact CE3-CG 4.17Å; W447-F506 AromaticContact CG-CD2 3.63Å; W447-F506 HydrophobicContact CG-CD2 3.63Å; W447-F506 HydrophobicContact CG-CE2 4.16Å; W447-F506 HydrophobicContact CH2-CB 4.12Å; W447-F506 HydrophobicContact CZ3-CB 3.66Å; L451-F506 HydrophobicContact CD1-CD1 4.22Å; L451-F506 HydrophobicContact CD1-CD2 4.31Å; L451-F506 HydrophobicContact CD1-CE1 4.14Å; L451-F506 HydrophobicContact CD1-CE2 4.22Å; L451-F506 HydrophobicContact CD1-CG 4.3Å; L451-F506 HydrophobicContact CD1-CZ 4.15Å; Q502-F506 WeakPolarHBondContact O-CB 3.27Å; Q502-F506 PolarHBondContact O-N 2.82Å; I503-F506 WeakPolarHBondContact O-CB 3.5Å; I503-F506 PolarHBondContact O-N 2.87Å; E504-F506 VanDerWaalsContact C-N 3.3Å; E504-F506 PolarHBondContact O-N 3.01Å; F506-L508 VanDerWaalsContact C-N 3.35Å; F506-L508 PolarHBondContact O-N 3.01Å; F506-T509 PolarHBondContact O-N 3.36Å; F506-M510 HydrophobicContact CD2-CG 3.82Å; F506-M510 HydrophobicContact CE2-CB 4.48Å; F506-M510 HydrophobicContact CE2-CG 3.62Å; F506-M510 PolarHBondContact O-N 2.72Å
507	Y	98	Very high	95.4	Very high	0 Å²	0	47.3 Å²	47.3	0%	0	21%	0.212	C	C	.	.	H	α-helix	trans	-61.1	-44.5	-176.9	-78.6	-61.4	0	0	0	111.7	F30 C33 V37 A412 N415 I503 E504 H511	F30-Y507 HydrophobicContact CB-CD1 3.92Å; F30-Y507 AromaticContact CD1-CD1 3.7Å; F30-Y507 HydrophobicContact CD1-CD1 3.7Å; F30-Y507 HydrophobicContact CD1-CE1 4.47Å; F30-Y507 HydrophobicContact CD2-CD1 4.11Å; F30-Y507 HydrophobicContact CD2-CE1 4.23Å; F30-Y507 HydrophobicContact CE1-CD1 4.16Å; F30-Y507 HydrophobicContact CE2-CE1 4.47Å; F30-Y507 AromaticContact CG-CD1 3.65Å; F30-Y507 HydrophobicContact CG-CD1 3.65Å; F30-Y507 HydrophobicContact CG-CE1 4.24Å; C33-Y507 HydrophobicContact CB-CD1 4.1Å; C33-Y507 HydrophobicContact CB-CD2 3.92Å; C33-Y507 HydrophobicContact CB-CE1 3.71Å; C33-Y507 HydrophobicContact CB-CE2 3.52Å; C33-Y507 HydrophobicContact CB-CG 4.19Å; V37-Y507 HydrophobicContact CG2-CE2 4.35Å; A412-Y507 VanDerWaalsContact CA-OH 3.22Å; A412-Y507 WeakPolarHBondContact CA-OH 3.48Å; A412-Y507 HydrophobicContact CB-CE2 4.25Å; A412-Y507 PolarHBondContact N-OH 2.9Å; N415-Y507 HydrophobicContact CB-CE1 4.16Å; N415-Y507 PolarHBondContact ND2-OH 2.89Å; N415-Y507 VanDerWaalsContact ND2-OH 3.12Å; I503-Y507 HydrophobicContact CG2-CD2 4.03Å; I503-Y507 HydrophobicContact CG2-CE2 3.73Å; I503-Y507 WeakPolarHBondContact O-CD2 3.35Å; I503-Y507 PolarHBondContact O-N 3.21Å; E504-Y507 PolarHBondContact O-N 3.09Å; Y507-H511 WeakPolarHBondContact O-CB 3.27Å; Y507-H511 PolarHBondContact O-N 3.38Å
508	L	97	Very high	95.1	Very high	58 Å²	58	47 Å²	47	30%	0.304	21%	0.211	S	C	.	.	H	α-helix	trans	-67.5	-40.8	180	-67.5	179.3	0	0	0	112.4	L31 A34 E504 E505 F506 E512	L31-L508 HydrophobicContact CD2-CD2 4.31Å; A34-L508 HydrophobicContact CB-CD2 3.81Å; A34-L508 HydrophobicContact CB-CG 4.02Å; E504-L508 HydrophobicContact CG-CD1 3.97Å; E504-L508 HydrophobicContact CG-CG 4.36Å; E504-L508 WeakPolarHBondContact O-CG 3.44Å; E504-L508 PolarHBondContact O-N 3.5Å; E505-L508 PolarHBondContact O-N 3.48Å; F506-L508 VanDerWaalsContact C-N 3.35Å; F506-L508 PolarHBondContact O-N 3.01Å; L508-E512 WeakPolarHBondContact O-CB 3.25Å; L508-E512 PolarHBondContact O-N 2.91Å
509	T	96.5	Very high	94.7	Very high	53 Å²	53	46.3 Å²	46.3	33%	0.325	22%	0.217	S	C	.	.	H	α-helix	trans	-65.6	-50.6	-179.7	-61.1	0	0	0	0	110.6	W447 E505 F506 E512 E513	W447-T509 HydrophobicContact CZ2-CG2 4.38Å; E505-T509 WeakPolarHBondContact O-CB 3.48Å; E505-T509 PolarHBondContact O-N 2.86Å; E505-T509 PolarHBondContact O-OG1 3.2Å; F506-T509 PolarHBondContact O-N 3.36Å; T509-E512 PolarHBondContact O-N 3.46Å; T509-E513 VanDerWaalsContact O-CB 3.3Å; T509-E513 WeakPolarHBondContact O-CB 3.48Å; T509-E513 PolarHBondContact O-N 2.96Å
510	M	95.9	Very high	94.1	Very high	0 Å²	0	48.7 Å²	48.7	0%	0	23%	0.234	C	C	.	.	H	α-helix	trans	-67.3	-38.6	180	-68.2	-46.4	-62.8	0	0	112.4	F30 H443 F444 W447 F506 E512 V514	F30-M510 HydrophobicContact CD1-CB 4.14Å; F30-M510 HydrophobicContact CE1-CB 3.77Å; H443-M510 HydrophobicContact CB-CE 4.14Å; H443-M510 HydrophobicContact CB-SD 4.33Å; F444-M510 HydrophobicContact CB-CE 4.49Å; F444-M510 HydrophobicContact CD1-CE 3.53Å; F444-M510 HydrophobicContact CD1-CG 4.26Å; F444-M510 HydrophobicContact CD1-SD 4.47Å; F444-M510 HydrophobicContact CD2-CE 3.64Å; F444-M510 HydrophobicContact CE1-CB 3.98Å; F444-M510 HydrophobicContact CE1-CE 3.42Å; F444-M510 VanDerWaalsContact CE1-CE 3.42Å; F444-M510 HydrophobicContact CE1-CG 3.89Å; F444-M510 HydrophobicContact CE1-SD 4.41Å; F444-M510 HydrophobicContact CE2-CE 3.53Å; F444-M510 HydrophobicContact CG-CE 3.62Å; F444-M510 HydrophobicContact CZ-CB 4.3Å; F444-M510 HydrophobicContact CZ-CE 3.4Å; F444-M510 VanDerWaalsContact CZ-CE 3.4Å; W447-M510 HydrophobicContact CG-SD 4.4Å; F506-M510 HydrophobicContact CD2-CG 3.82Å; F506-M510 HydrophobicContact CE2-CB 4.48Å; F506-M510 HydrophobicContact CE2-CG 3.62Å; F506-M510 PolarHBondContact O-N 2.72Å; M510-E512 PolarHBondContact O-N 2.67Å; M510-V514 WeakPolarHBondContact O-CB 3.32Å; M510-V514 VanDerWaalsContact O-CG2 3.31Å; M510-V514 WeakPolarHBondContact O-CG2 3.45Å; M510-V514 PolarHBondContact O-N 2.99Å
511	H	95.9	Very high	93.3	Very high	22 Å²	22	48.8 Å²	48.8	10%	0.102	24%	0.235	C	C	.	.	H	α-helix	trans	-56.9	-51	171.8	163.8	-92.8	0	0	0	110.9	I26 F27 F30 Y507 E513 R515	I26-H511 PolarHBondContact O-CD2 3.47Å; F27-H511 AromaticContact CD1-CD2 3.83Å; F27-H511 AromaticContact CD1-NE2 3.65Å; F30-H511 HydrophobicContact CB-CB 4.44Å; Y507-H511 WeakPolarHBondContact O-CB 3.27Å; Y507-H511 PolarHBondContact O-N 3.38Å; H511-E513 PolarHBondContact O-N 2.94Å; H511-R515 WeakPolarHBondContact O-CB 3.25Å; H511-R515 PolarHBondContact O-N 3.14Å
512	E	95.2	Very high	92.4	Very high	48 Å²	48	48.2 Å²	48.2	22%	0.224	23%	0.229	C	C	.	.	H	α-helix	trans	-67.8	-37.9	-176	179.5	60.8	-169.8	0	0	112.4	L508 T509 M510 R515 R516	L508-E512 WeakPolarHBondContact O-CB 3.25Å; L508-E512 PolarHBondContact O-N 2.91Å; T509-E512 PolarHBondContact O-N 3.46Å; M510-E512 PolarHBondContact O-N 2.67Å; E512-R515 PolarHBondContact O-N 3.18Å; E512-R515 IonicContact OE1-CZ 2.69Å; E512-R515 IonicContact OE1-NH2 3.56Å; E512-R515 PolarHBondContact OE1-NH2 3.4Å; E512-R515 IonicContact OE2-CZ 3.76Å; E512-R515 VanDerWaalsContact OE2-CZ 3.24Å; E512-R515 IonicContact OE2-NE 3.94Å; E512-R515 PolarHBondContact OE2-NE 3.24Å; E512-R515 IonicContact OE2-NH2 2.75Å; E512-R515 PolarHBondContact OE2-NH2 2.96Å; E512-R516 VanDerWaalsContact CG-CZ 3.47Å; E512-R516 VanDerWaalsContact O-CG 3.27Å; E512-R516 WeakPolarHBondContact O-CG 3.37Å; E512-R516 PolarHBondContact O-N 2.92Å; E512-R516 IonicContact OE1-CZ 3.21Å; E512-R516 IonicContact OE1-NE 2.76Å; E512-R516 PolarHBondContact OE1-NE 3.04Å; E512-R516 IonicContact OE1-NH2 2.86Å; E512-R516 PolarHBondContact OE1-NH2 2.84Å
513	E	94	Very high	91.2	Very high	31 Å²	31	52 Å²	52	15%	0.145	25%	0.247	C	C	.	.	H	α-helix	trans	-64.4	-48.8	176.5	175.3	155.3	-146	0	0	112.4	I440 H443 T509 H511 R515 R516 N517	I440-E513 HydrophobicContact CG1-CG 4.35Å; H443-E513 IonicContact CE1-OE1 2.86Å; H443-E513 PolarHBondContact CE1-OE1 2.95Å; H443-E513 IonicContact CE1-OE2 3.24Å; H443-E513 IonicContact CG-OE1 2.76Å; H443-E513 IonicContact CG-OE2 2.77Å; H443-E513 IonicContact ND1-OE1 3.01Å; H443-E513 PolarHBondContact ND1-OE1 3.36Å; H443-E513 IonicContact ND1-OE2 3.73Å; H443-E513 PolarHBondContact ND1-OE2 2.9Å; T509-E513 VanDerWaalsContact O-CB 3.3Å; T509-E513 WeakPolarHBondContact O-CB 3.48Å; T509-E513 PolarHBondContact O-N 2.96Å; H511-E513 PolarHBondContact O-N 2.94Å; E513-R515 VanDerWaalsContact C-N 3.33Å; E513-R515 PolarHBondContact O-N 3.2Å; E513-R516 PolarHBondContact O-N 3.25Å; E513-N517 WeakPolarHBondContact O-CB 3.39Å; E513-N517 PolarHBondContact O-N 3.07Å; E513-N517 PolarHBondContact O-ND2 2.87Å
514	V	93	Very high	89.6	Confident	0 Å²	0	53.2 Å²	53.2	0%	0	26%	0.26	C	S	.	.	H	α-helix	trans	-65.4	-39.8	176.8	175.2	0	0	0	0	110.4	Y22 I26 F27 I440 F444 M510 R516 N517 W518 L521	Y22-V514 HydrophobicContact CE1-CG1 4.15Å; I26-V514 HydrophobicContact CB-CG1 4.49Å; I26-V514 HydrophobicContact CD1-CG2 4.41Å; I26-V514 HydrophobicContact CG1-CG1 4.31Å; I26-V514 HydrophobicContact CG2-CB 3.83Å; I26-V514 HydrophobicContact CG2-CG1 3.79Å; I26-V514 HydrophobicContact CG2-CG2 4.42Å; F27-V514 HydrophobicContact CZ-CG1 4.42Å; I440-V514 HydrophobicContact CG2-CG2 4Å; F444-V514 HydrophobicContact CE2-CG2 4.25Å; F444-V514 HydrophobicContact CZ-CG2 4.19Å; M510-V514 WeakPolarHBondContact O-CB 3.32Å; M510-V514 VanDerWaalsContact O-CG2 3.31Å; M510-V514 WeakPolarHBondContact O-CG2 3.45Å; M510-V514 PolarHBondContact O-N 2.99Å; V514-R516 PolarHBondContact O-N 3.38Å; V514-N517 CarbonylContact O-C 3.33Å; V514-N517 PolarHBondContact O-N 3.41Å; V514-W518 HydrophobicContact CG1-CE3 3.82Å; V514-W518 HydrophobicContact CG1-CZ3 4.16Å; V514-W518 WeakPolarHBondContact O-CA 3.43Å; V514-W518 PolarHBondContact O-N 3.4Å; V514-L521 HydrophobicContact CG1-CD1 4.1Å
515	R	93.3	Very high	88	Confident	123 Å²	123	53.3 Å²	53.3	46%	0.464	26%	0.259	S	S	.	.	H	α-helix	trans	-57.4	-46.3	176.8	-166.8	-178.8	69.2	77	2	112.5	F27 H511 E512 E513 N517	F27-R515 HydrophobicContact CE1-CB 3.7Å; F27-R515 HydrophobicContact CE1-CG 3.8Å; F27-R515 HydrophobicContact CZ-CB 4.46Å; H511-R515 WeakPolarHBondContact O-CB 3.25Å; H511-R515 PolarHBondContact O-N 3.14Å; E512-R515 PolarHBondContact O-N 3.18Å; E512-R515 IonicContact OE1-CZ 2.69Å; E512-R515 IonicContact OE1-NH2 3.56Å; E512-R515 PolarHBondContact OE1-NH2 3.4Å; E512-R515 IonicContact OE2-CZ 3.76Å; E512-R515 VanDerWaalsContact OE2-CZ 3.24Å; E512-R515 IonicContact OE2-NE 3.94Å; E512-R515 PolarHBondContact OE2-NE 3.24Å; E512-R515 IonicContact OE2-NH2 2.75Å; E512-R515 PolarHBondContact OE2-NH2 2.96Å; E513-R515 VanDerWaalsContact C-N 3.33Å; E513-R515 PolarHBondContact O-N 3.2Å; R515-N517 PolarHBondContact O-N 3.33Å
516	R	93.2	Very high	86.3	Confident	176 Å²	176	54.4 Å²	54.4	66%	0.664	26%	0.262	S	S	*	.	H	α-helix	trans	-64.2	-32.5	179.5	-74.7	173.7	-170.2	165.1	7.5	112.4	E512 E513 V514	E512-R516 VanDerWaalsContact CG-CZ 3.47Å; E512-R516 VanDerWaalsContact O-CG 3.27Å; E512-R516 WeakPolarHBondContact O-CG 3.37Å; E512-R516 PolarHBondContact O-N 2.92Å; E512-R516 IonicContact OE1-CZ 3.21Å; E512-R516 IonicContact OE1-NE 2.76Å; E512-R516 PolarHBondContact OE1-NE 3.04Å; E512-R516 IonicContact OE1-NH2 2.86Å; E512-R516 PolarHBondContact OE1-NH2 2.84Å; E513-R516 PolarHBondContact O-N 3.25Å; V514-R516 PolarHBondContact O-N 3.38Å
517	N	90.5	Very high	84	Confident	46 Å²	46	58.8 Å²	58.8	25%	0.246	29%	0.288	C	S	.	.	H	α-helix	trans	-102.7	2.2	-173.2	-72.5	-59.3	0	0	0	114.1	V436 I440 E513 V514 R515 S519 S520 L521	V436-N517 HydrophobicContact CG1-CB 3.6Å; I440-N517 HydrophobicContact CD1-CB 3.73Å; E513-N517 WeakPolarHBondContact O-CB 3.39Å; E513-N517 PolarHBondContact O-N 3.07Å; E513-N517 PolarHBondContact O-ND2 2.87Å; V514-N517 CarbonylContact O-C 3.33Å; V514-N517 PolarHBondContact O-N 3.41Å; R515-N517 PolarHBondContact O-N 3.33Å; N517-S519 VanDerWaalsContact C-N 3.33Å; N517-S519 PolarHBondContact O-N 2.87Å; N517-S520 PolarHBondContact O-N 3.08Å; N517-S520 VanDerWaalsContact O-N 3.08Å; N517-L521 PolarHBondContact O-N 2.89Å
518	W	88.5	Confident	81.4	Confident	46 Å²	46	67.2 Å²	67.2	17%	0.174	33%	0.325	C	S	.	.	H	α-helix	trans	-56.4	-43.7	-171.9	-174.4	-100.3	0	0	0	113.3	Y22 R23 F27 V514 S520 L521 Y522	Y22-W518 AromaticContact CD1-CH2 3.91Å; Y22-W518 HydrophobicContact CD1-CH2 3.91Å; Y22-W518 AromaticContact CD1-CZ3 3.57Å; Y22-W518 HydrophobicContact CD1-CZ3 3.57Å; Y22-W518 HydrophobicContact CE1-CH2 4.49Å; Y22-W518 AromaticContact CE1-CZ3 3.71Å; Y22-W518 HydrophobicContact CE1-CZ3 3.71Å; R23-W518 HydrophobicContact CB-CH2 3.83Å; R23-W518 HydrophobicContact CB-CZ2 4.12Å; R23-W518 HydrophobicContact CG-CH2 4.15Å; R23-W518 HydrophobicContact CG-CZ2 4.08Å; F27-W518 AromaticContact CE2-CD2 3.78Å; F27-W518 HydrophobicContact CE2-CD2 3.78Å; F27-W518 AromaticContact CE2-CE3 3.52Å; F27-W518 HydrophobicContact CE2-CE3 3.52Å; F27-W518 HydrophobicContact CE2-CG 4.47Å; F27-W518 HydrophobicContact CE2-CH2 4.08Å; F27-W518 HydrophobicContact CE2-CZ2 4.33Å; F27-W518 AromaticContact CE2-CZ3 3.67Å; F27-W518 HydrophobicContact CE2-CZ3 3.67Å; F27-W518 HydrophobicContact CZ-CB 4.44Å; F27-W518 AromaticContact CZ-CD2 3.93Å; F27-W518 HydrophobicContact CZ-CD2 3.93Å; F27-W518 AromaticContact CZ-CE3 3.69Å; F27-W518 HydrophobicContact CZ-CE3 3.69Å; F27-W518 HydrophobicContact CZ-CG 4.26Å; F27-W518 HydrophobicContact CZ-CZ3 4.26Å; V514-W518 HydrophobicContact CG1-CE3 3.82Å; V514-W518 HydrophobicContact CG1-CZ3 4.16Å; V514-W518 WeakPolarHBondContact O-CA 3.43Å; V514-W518 PolarHBondContact O-N 3.4Å; W518-S520 PolarHBondContact O-N 3.33Å; W518-L521 HydrophobicContact CE3-CD1 4.48Å; W518-L521 PolarHBondContact O-N 3.12Å; W518-Y522 WeakPolarHBondContact O-CB 3.32Å; W518-Y522 PolarHBondContact O-N 2.87Å
519	S	84.7	Confident	79.1	Confident	80 Å²	80	66.6 Å²	66.6	56%	0.559	33%	0.333	S	S	*	.	H	α-helix	trans	-60.6	-44.7	177.8	-60.2	0	0	0	0	111.9	N517 Y522 E523	N517-S519 VanDerWaalsContact C-N 3.33Å; N517-S519 PolarHBondContact O-N 2.87Å; S519-Y522 PolarHBondContact O-N 3.45Å; S519-E523 WeakPolarHBondContact O-CB 3.3Å; S519-E523 WeakPolarHBondContact O-CG 3.29Å; S519-E523 PolarHBondContact O-N 3.11Å
520	S	84.1	Confident	76.7	Confident	56 Å²	56	68.7 Å²	68.7	39%	0.392	34%	0.341	S	S	.	.	H	α-helix	trans	-69.7	-36.1	179.8	-56.8	0	0	0	0	112.7	N517 W518 G524	N517-S520 PolarHBondContact O-N 3.08Å; N517-S520 VanDerWaalsContact O-N 3.08Å; W518-S520 PolarHBondContact O-N 3.33Å; S520-G524 PolarHBondContact O-N 2.71Å
521	L	81.6	Confident	74.3	Confident	3 Å²	3	75.3 Å²	75.3	2%	0.016	38%	0.376	C	S	.	.	H	α-helix	trans	-58.8	-48.6	171.2	-78.3	174.7	0	0	0	111.1	Y22 Y426 A437 I440 V514 N517 W518 G524	Y22-L521 HydrophobicContact CE1-CD1 4.38Å; Y426-L521 HydrophobicContact CD1-CB 4.27Å; Y426-L521 WeakPolarHBondContact CD1-O 3.5Å; Y426-L521 HydrophobicContact CG-CD2 4.49Å; A437-L521 HydrophobicContact CB-CD2 3.68Å; I440-L521 HydrophobicContact CD1-CD1 3.67Å; I440-L521 HydrophobicContact CD1-CD2 3.94Å; I440-L521 HydrophobicContact CD1-CG 3.9Å; V514-L521 HydrophobicContact CG1-CD1 4.1Å; N517-L521 PolarHBondContact O-N 2.89Å; W518-L521 HydrophobicContact CE3-CD1 4.48Å; W518-L521 PolarHBondContact O-N 3.12Å; L521-G524 PolarHBondContact O-N 3.08Å
522	Y	75.3	Confident	71.7	Confident	85 Å²	85	80.9 Å²	80.9	33%	0.333	41%	0.407	S	S	.	.	H	α-helix	trans	-69	-39.1	-177.7	-172.2	-121	0	0	0	112.7	E19 W518 S519 G524 R525 K526	E19-Y522 WeakPolarHBondContact OE1-CD2 3.47Å; E19-Y522 WeakPolarHBondContact OE1-CE2 3.33Å; E19-Y522 WeakPolarHBondContact OE2-CE2 3.41Å; W518-Y522 WeakPolarHBondContact O-CB 3.32Å; W518-Y522 PolarHBondContact O-N 2.87Å; S519-Y522 PolarHBondContact O-N 3.45Å; Y522-G524 VanDerWaalsContact C-N 3.35Å; Y522-R525 PolarHBondContact O-N 3.41Å; Y522-K526 HydrophobicContact CD1-CD 4.34Å; Y522-K526 HydrophobicContact CE1-CD 4.12Å; Y522-K526 VanDerWaalsContact CZ-CE 3.43Å; Y522-K526 PolarHBondContact O-N 3.49Å; Y522-K526 WeakPolarHBondContact OH-CE 3.37Å
523	E	71	Confident	69	Low	124 Å²	124	91.1 Å²	91.1	58%	0.579	45%	0.445	S	S	*	.	H	α-helix	trans	-64	-37.9	174.9	-76.7	177.3	-177.6	0	0	112.5	S519 R525 K526	S519-E523 WeakPolarHBondContact O-CB 3.3Å; S519-E523 WeakPolarHBondContact O-CG 3.29Å; S519-E523 PolarHBondContact O-N 3.11Å; E523-R525 PolarHBondContact O-N 3.42Å; E523-K526 PolarHBondContact O-N 3.15Å
524	G	64.1	Low	67.8	Low	26 Å²	26	94.2 Å²	94.2	27%	0.268	46%	0.46	S	S	.	.	H	α-helix	trans	-57.1	-30.3	177.1	0	0	0	0	0	113.8	S520 L521 Y522	S520-G524 PolarHBondContact O-N 2.71Å; L521-G524 PolarHBondContact O-N 3.08Å; Y522-G524 VanDerWaalsContact C-N 3.35Å
525	R	63.4	Low	66.4	Low	36 Å²	36	99.1 Å²	99.1	14%	0.136	48%	0.484	C	S	.	.	H	α-helix	trans	-83.4	-28.1	175.7	-170.3	-176.4	-77.8	-179.2	-5.8	113.3	E19 L425 Y522 E523 V527 L530	E19-R525 IonicContact OE2-NH1 3.68Å; L425-R525 PolarHBondContact O-NH2 3.16Å; Y522-R525 PolarHBondContact O-N 3.41Å; E523-R525 PolarHBondContact O-N 3.42Å; R525-V527 PolarHBondContact O-N 2.9Å; R525-L530 HydrophobicContact CG-CD1 4.28Å
526	K	60.5	Low	64.9	Low	129 Å²	129	97.8 Å²	97.8	56%	0.561	49%	0.485	S	S	*	.	H	α-helix	trans	-73.5	-11.8	-178.2	-79.7	-176.2	170.6	177.7	0	114.3	Y522 E523 K528	Y522-K526 HydrophobicContact CD1-CD 4.34Å; Y522-K526 HydrophobicContact CE1-CD 4.12Å; Y522-K526 VanDerWaalsContact CZ-CE 3.43Å; Y522-K526 PolarHBondContact O-N 3.49Å; Y522-K526 WeakPolarHBondContact OH-CE 3.37Å; E523-K526 PolarHBondContact O-N 3.15Å; K526-K528 PolarHBondContact O-N 3.41Å
527	V	49	Very low	63.3	Low	92 Å²	92	93.2 Å²	93.2	56%	0.558	48%	0.475	S	S	*	.	S	Bend	trans	-56.5	115.3	170.6	-174.7	0	0	0	0	106.8	R525 G529	R525-V527 PolarHBondContact O-N 2.9Å; V527-G529 PolarHBondContact O-N 3.14Å
528	K	43.6	Very low	61.6	Low	177 Å²	177	96.1 Å²	96.1	77%	0.77	49%	0.489	S	S	*	.	G	3₁₀ helix	trans	-46.5	-3.3	-170.7	-80.4	177.8	170.6	-179	0	117.4	K526 L530 L531	K526-K528 PolarHBondContact O-N 3.41Å; K528-L530 VanDerWaalsContact C-N 3.31Å; K528-L530 PolarHBondContact O-N 3.34Å; K528-L531 PolarHBondContact O-N 2.63Å
529	G	47.9	Very low	59.8	Low	46 Å²	46	99.5 Å²	99.5	47%	0.474	51%	0.51	S	S	.	.	G	3₁₀ helix	trans	-73.4	-3.5	-175.2	0	0	0	0	0	117	V527	V527-G529 PolarHBondContact O-N 3.14Å
530	L	47	Very low	58	Low	96 Å²	96	100.9 Å²	100.9	50%	0.503	51%	0.507	S	S	.	.	G	3₁₀ helix	trans	-90.4	-11.5	174	-110.6	146.2	0	0	0	113.7	R525 K528	R525-L530 HydrophobicContact CG-CD1 4.28Å; K528-L530 VanDerWaalsContact C-N 3.31Å; K528-L530 PolarHBondContact O-N 3.34Å
531	L	43.9	Very low	56	Low	140 Å²	140	104.3 Å²	104.3	73%	0.733	52%	0.516	S	S	*	.	S	Bend	trans	-98.3	-10.1	176.3	-94.1	140.9	0	0	0	113.2	K528	K528-L531 PolarHBondContact O-N 2.63Å
532	D	42.2	Very low	53.8	Low	138 Å²	138	112.8 Å²	112.8	74%	0.738	56%	0.557	S	S	*	*			trans	-100.5	11.8	-177.5	-72.3	-22.9	0	0	0	113.4
533	Y	38.3	Very low	51.9	Low	264 Å²	264	115.3 Å²	115.3	100%	1.035	58%	0.578	S	S	*	*			trans	-128.1	0	171.8	-90.6	-84.1	0	0	0	110.4

Retrieved 533 of 533 residues in 153.3 ms (Link to these results)

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