A0A5K4FBK3_SCHMA Loading...

SPATA6 domain-containing protein

AlphaFold DB , UniProt , Accession A0A5K4FBK3, Species SCHMA (Schistosoma mansoni, Blood fluke), Gene n/a, Length 654 aa.

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(Predicted Aligned Error values between residue pairs)

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Site	Residue	pLDDT	pLDDT confidence	pLDDT₁₀	pLDDT10 confidence	SASA	SASA [Å²]	SASA₁₀	SASA10 [Å²]	RSA	RSA unformatted	RSA₁₀	RSA10 unformatted	Surface	Surface10 (not used)	Disorder (not used)	Disorder	Sec. str.	Secondary structure	Isomer	Phi (φ)	Psi (ψ)	Omega (ω)	Chi 1 (χ₁)	Chi 2 (χ₂)	Chi 3 (χ₃)	Chi 4 (χ₄)	Chi 5 (χ₅)	Tau (τ)	Contacts (colored by PAE)	Contact details
1	M	54.6	Low	82.3	Confident	132 Å²	132	55.5 Å²	55.5	65%	0.65	26%	0.261	S	S	*	.				0	153	0	-65.5	-169	176	0	0	108.9	Y3 A57 A58 I267	M1-Y3 PolarHBondContact O-N 2.75Å; M1-A57 WeakPolarHBondContact CE-O 3.47Å; M1-A57 WeakPolarHBondContact CG-O 3.36Å; M1-A58 VanDerWaalsContact CE-C 3.45Å; M1-A58 VanDerWaalsContact CE-CA 3.47Å; M1-A58 WeakPolarHBondContact CE-O 2.95Å; M1-A58 HydrophobicContact SD-CB 4.45Å; M1-I267 HydrophobicContact CE-CD1 4.49Å; M1-I267 HydrophobicContact SD-CD1 3.55Å; M1-I267 VanDerWaalsContact SD-CD1 3.55Å
2	K	63.2	Low	83.1	Confident	154 Å²	154	51.1 Å²	51.1	67%	0.67	24%	0.241	S	C	*	.			trans	-87.6	99.3	171.5	-68.4	-174.8	179.5	-174	0	107.9	D4 V5	K2-D4 PolarHBondContact O-N 2.78Å; K2-D4 VanDerWaalsContact O-N 3.13Å; K2-V5 HydrophobicContact CB-CG2 3.96Å; K2-V5 WeakPolarHBondContact O-CB 3.13Å; K2-V5 WeakPolarHBondContact O-CG2 3.11Å; K2-V5 PolarHBondContact O-N 2.96Å
3	Y	70.9	Confident	83.9	Confident	94 Å²	94	47.7 Å²	47.7	37%	0.369	23%	0.225	S	C	.	.	T	Hydrogen-bonded Turn	trans	-58	-23	177.9	-66.6	-75.3	0	0	0	112.6	M1 V5 L6 S262 L265	M1-Y3 PolarHBondContact O-N 2.75Å; Y3-V5 PolarHBondContact O-N 3.26Å; Y3-V5 VanDerWaalsContact O-N 3.08Å; Y3-L6 PolarHBondContact O-N 3.06Å; Y3-S262 WeakPolarHBondContact CB-O 3.12Å; Y3-L265 HydrophobicContact CD1-CB 4.22Å; Y3-L265 WeakPolarHBondContact CD1-O 3.21Å; Y3-L265 WeakPolarHBondContact CE1-O 3.04Å
4	D	83	Confident	84.5	Confident	80 Å²	80	45.7 Å²	45.7	43%	0.428	22%	0.218	S	C	.	.	H	α-helix	trans	-52.8	-27.8	170.6	-46.7	-32.1	0	0	0	112.7	K2 L6 I7 D8 S262	K2-D4 PolarHBondContact O-N 2.78Å; K2-D4 VanDerWaalsContact O-N 3.13Å; D4-L6 PolarHBondContact O-N 3.05Å; D4-I7 PolarHBondContact O-N 2.81Å; D4-D8 VanDerWaalsContact O-CG 3.28Å; D4-D8 PolarHBondContact O-N 3.44Å; D4-S262 VanDerWaalsContact OD1-CB 3.24Å; D4-S262 WeakPolarHBondContact OD1-CB 2.97Å; D4-S262 PolarHBondContact OD1-OG 3.27Å
5	V	87.6	Confident	84.9	Confident	7 Å²	7	47.5 Å²	47.5	4%	0.042	22%	0.222	C	C	.	.	H	α-helix	trans	-71.4	-29.7	179.9	-176	0	0	0	0	112.7	K2 Y3 F9 R53 L54 A57	K2-V5 HydrophobicContact CB-CG2 3.96Å; K2-V5 WeakPolarHBondContact O-CB 3.13Å; K2-V5 WeakPolarHBondContact O-CG2 3.11Å; K2-V5 PolarHBondContact O-N 2.96Å; Y3-V5 PolarHBondContact O-N 3.26Å; Y3-V5 VanDerWaalsContact O-N 3.08Å; V5-F9 WeakPolarHBondContact O-CB 3.48Å; V5-F9 PolarHBondContact O-N 3.12Å; V5-R53 HydrophobicContact CG1-CB 4.23Å; V5-L54 HydrophobicContact CG1-CB 4.01Å; V5-L54 HydrophobicContact CG1-CD1 4.19Å; V5-A57 HydrophobicContact CB-CB 4.42Å; V5-A57 HydrophobicContact CG1-CB 4.39Å; V5-A57 HydrophobicContact CG2-CB 4.2Å
6	L	88.7	Confident	85.3	Confident	7 Å²	7	45 Å²	45	4%	0.037	21%	0.212	C	C	.	.	H	α-helix	trans	-67.9	-41.7	173.4	-76.6	166.4	0	0	0	110.7	Y3 D4 F9 Y10 L54 V128 L265 I267 L271	Y3-L6 PolarHBondContact O-N 3.06Å; D4-L6 PolarHBondContact O-N 3.05Å; L6-F9 PolarHBondContact O-N 3.31Å; L6-Y10 PolarHBondContact O-N 3.38Å; L6-L54 HydrophobicContact CD2-CD1 3.71Å; L6-L54 HydrophobicContact CG-CD1 4.18Å; L6-V128 HydrophobicContact CD2-CG1 4.33Å; L6-V128 HydrophobicContact CD2-CG2 4.02Å; L6-L265 HydrophobicContact CB-CD1 4.38Å; L6-L265 HydrophobicContact CD1-CB 4.41Å; L6-I267 HydrophobicContact CD1-CG1 4Å; L6-L271 HydrophobicContact CD2-CD2 4.06Å
7	I	89.4	Confident	85.6	Confident	22 Å²	22	48 Å²	48	11%	0.113	23%	0.225	C	C	.	.	H	α-helix	trans	-64.4	-47.8	175.9	-63.4	177.9	0	0	0	109.9	D4 F9 Y10 L11 L259 L265	D4-I7 PolarHBondContact O-N 2.81Å; I7-F9 VanDerWaalsContact C-N 3.27Å; I7-F9 PolarHBondContact O-N 2.96Å; I7-Y10 PolarHBondContact O-N 2.65Å; I7-L11 HydrophobicContact CG2-CD1 3.94Å; I7-L11 HydrophobicContact CG2-CG 4.23Å; I7-L11 WeakPolarHBondContact O-CB 3.35Å; I7-L11 WeakPolarHBondContact O-CG 3.28Å; I7-L11 PolarHBondContact O-N 3.39Å; I7-L259 HydrophobicContact CG2-CD1 3.69Å; I7-L259 HydrophobicContact CG2-CD2 4.03Å; I7-L259 HydrophobicContact CG2-CG 4.43Å; I7-L265 HydrophobicContact CD1-CD1 3.9Å; I7-L265 HydrophobicContact CG1-CD1 3.54Å
8	D	90.8	Very high	85.7	Confident	52 Å²	52	46.6 Å²	46.6	28%	0.278	22%	0.219	S	C	.	.	H	α-helix	trans	-54	-45	175.2	-74.6	-11.6	0	0	0	111.1	D4 A12 I50 R53	D4-D8 VanDerWaalsContact O-CG 3.28Å; D4-D8 PolarHBondContact O-N 3.44Å; D8-A12 WeakPolarHBondContact O-CB 3.44Å; D8-A12 PolarHBondContact O-N 3.46Å; D8-I50 HydrophobicContact CB-CG2 4.17Å; D8-R53 IonicContact OD2-CZ 3.62Å; D8-R53 IonicContact OD2-NH1 3.67Å; D8-R53 IonicContact OD2-NH2 3.2Å; D8-R53 PolarHBondContact OD2-NH2 3.24Å
9	F	93.1	Very high	85.7	Confident	1 Å²	1	44.2 Å²	44.2	0%	0.004	21%	0.208	C	C	.	.	H	α-helix	trans	-65.3	-43.6	179.4	178.9	-93.6	0	0	0	112.6	V5 L6 I7 A12 T13 I50 T51 L54 H121 V124 Q125 V128	V5-F9 WeakPolarHBondContact O-CB 3.48Å; V5-F9 PolarHBondContact O-N 3.12Å; L6-F9 PolarHBondContact O-N 3.31Å; I7-F9 VanDerWaalsContact C-N 3.27Å; I7-F9 PolarHBondContact O-N 2.96Å; F9-A12 PolarHBondContact O-N 2.76Å; F9-T13 WeakPolarHBondContact O-CB 3.49Å; F9-T13 PolarHBondContact O-N 3.5Å; F9-T13 PolarHBondContact O-OG1 3.07Å; F9-I50 VanDerWaalsContact CA-CG2 3.45Å; F9-I50 HydrophobicContact CB-CG2 3.78Å; F9-I50 HydrophobicContact CD2-CG2 4.2Å; F9-I50 HydrophobicContact CG-CG2 4.5Å; F9-T51 WeakPolarHBondContact CE2-OG1 3.31Å; F9-L54 HydrophobicContact CB-CD2 4.23Å; F9-L54 HydrophobicContact CD1-CD2 4.11Å; F9-L54 HydrophobicContact CD2-CD2 3.91Å; F9-L54 HydrophobicContact CE1-CD2 4.47Å; F9-L54 HydrophobicContact CE2-CD2 4.3Å; F9-L54 HydrophobicContact CG-CD2 3.81Å; F9-H121 AromaticContact CE2-NE2 3.96Å; F9-V124 HydrophobicContact CE1-CG1 4.07Å; F9-V124 HydrophobicContact CZ-CG1 3.97Å; F9-Q125 HydrophobicContact CE1-CG 4.03Å; F9-Q125 HydrophobicContact CZ-CG 3.79Å; F9-V128 HydrophobicContact CD1-CB 4.13Å; F9-V128 HydrophobicContact CD1-CG1 4.01Å; F9-V128 HydrophobicContact CD1-CG2 3.96Å; F9-V128 HydrophobicContact CE1-CB 4.22Å; F9-V128 HydrophobicContact CE1-CG2 4.01Å
10	Y	92.6	Very high	85.8	Confident	34 Å²	34	45.2 Å²	45.2	13%	0.133	21%	0.213	C	C	.	.	H	α-helix	trans	-63.2	-48.7	176.3	178.4	-108.2	0	0	0	111.6	L6 I7 A12 T13 V14 A129 I132 V257 L259	L6-Y10 PolarHBondContact O-N 3.38Å; I7-Y10 PolarHBondContact O-N 2.65Å; Y10-A12 VanDerWaalsContact C-N 3.32Å; Y10-A12 PolarHBondContact O-N 2.72Å; Y10-T13 WeakPolarHBondContact O-CB 3.35Å; Y10-T13 PolarHBondContact O-N 2.74Å; Y10-T13 VanDerWaalsContact O-N 3.09Å; Y10-V14 HydrophobicContact CD1-CG2 4.31Å; Y10-V14 HydrophobicContact CD2-CG2 4.44Å; Y10-V14 HydrophobicContact CE1-CG2 3.97Å; Y10-V14 HydrophobicContact CE2-CG2 4.1Å; Y10-V14 WeakPolarHBondContact O-CG2 3.17Å; Y10-V14 PolarHBondContact O-N 3.39Å; Y10-A129 HydrophobicContact CD2-CB 4.2Å; Y10-A129 HydrophobicContact CE2-CB 3.8Å; Y10-I132 HydrophobicContact CD1-CD1 3.71Å; Y10-I132 HydrophobicContact CD2-CD1 3.77Å; Y10-I132 HydrophobicContact CE1-CD1 4.45Å; Y10-I132 HydrophobicContact CE1-CG2 4.33Å; Y10-I132 HydrophobicContact CG-CD1 3.31Å; Y10-V257 HydrophobicContact CD1-CG1 4.44Å; Y10-V257 HydrophobicContact CE1-CG1 3.67Å; Y10-L259 HydrophobicContact CD1-CD2 3.96Å; Y10-L259 HydrophobicContact CE1-CD2 4.23Å
11	L	91.8	Very high	85.9	Confident	28 Å²	28	48.5 Å²	48.5	15%	0.147	23%	0.231	C	C	.	.	H	α-helix	trans	-60.2	-41	178.5	-70.8	179.7	0	0	0	112.4	I7 T13 V14 R15 V244 V257 L259	I7-L11 HydrophobicContact CG2-CD1 3.94Å; I7-L11 HydrophobicContact CG2-CG 4.23Å; I7-L11 WeakPolarHBondContact O-CB 3.35Å; I7-L11 WeakPolarHBondContact O-CG 3.28Å; I7-L11 PolarHBondContact O-N 3.39Å; L11-T13 VanDerWaalsContact C-N 3.35Å; L11-V14 PolarHBondContact O-N 2.81Å; L11-R15 WeakPolarHBondContact O-CB 3.18Å; L11-R15 PolarHBondContact O-N 2.99Å; L11-V244 HydrophobicContact CD2-CG2 3.59Å; L11-V257 HydrophobicContact CD2-CB 4.4Å; L11-V257 HydrophobicContact CD2-CG1 4.19Å; L11-L259 HydrophobicContact CD1-CD1 4.06Å; L11-L259 HydrophobicContact CD2-CD1 4.08Å; L11-L259 HydrophobicContact CD2-CD2 4.24Å; L11-L259 HydrophobicContact CG-CD1 4.32Å
12	A	92	Very high	87.3	Confident	2 Å²	2	45.5 Å²	45.5	2%	0.017	22%	0.215	C	C	.	.	H	α-helix	trans	-66.4	-37	175.2	0	0	0	0	0	112.6	D8 F9 Y10 R15 A16 V47 I50	D8-A12 WeakPolarHBondContact O-CB 3.44Å; D8-A12 PolarHBondContact O-N 3.46Å; F9-A12 PolarHBondContact O-N 2.76Å; Y10-A12 VanDerWaalsContact C-N 3.32Å; Y10-A12 PolarHBondContact O-N 2.72Å; A12-R15 PolarHBondContact O-N 2.96Å; A12-A16 WeakPolarHBondContact O-CB 3.26Å; A12-A16 PolarHBondContact O-N 3.21Å; A12-V47 HydrophobicContact CB-CG2 4.3Å; A12-I50 HydrophobicContact CB-CD1 3.36Å
13	T	93.3	Very high	88.2	Confident	7 Å²	7	39.6 Å²	39.6	4%	0.043	19%	0.191	C	C	.	.	H	α-helix	trans	-65.7	-45.3	175	-63.8	0	0	0	0	111.5	F9 Y10 L11 R15 A16 Q17 Q125	F9-T13 WeakPolarHBondContact O-CB 3.49Å; F9-T13 PolarHBondContact O-N 3.5Å; F9-T13 PolarHBondContact O-OG1 3.07Å; Y10-T13 WeakPolarHBondContact O-CB 3.35Å; Y10-T13 PolarHBondContact O-N 2.74Å; Y10-T13 VanDerWaalsContact O-N 3.09Å; L11-T13 VanDerWaalsContact C-N 3.35Å; T13-R15 VanDerWaalsContact C-N 3.32Å; T13-R15 PolarHBondContact O-N 3.48Å; T13-A16 WeakPolarHBondContact O-CB 3.21Å; T13-A16 PolarHBondContact O-N 3.32Å; T13-A16 VanDerWaalsContact O-N 3.15Å; T13-Q17 WeakPolarHBondContact O-CG 3.41Å; T13-Q17 PolarHBondContact O-N 3.29Å; T13-Q125 HydrophobicContact CG2-CB 4.07Å; T13-Q125 HydrophobicContact CG2-CG 3.81Å; T13-Q125 VanDerWaalsContact CG2-NE2 3.35Å; T13-Q125 PolarHBondContact OG1-NE2 3.4Å
14	V	92	Very high	88.6	Confident	20 Å²	20	40.7 Å²	40.7	12%	0.121	21%	0.207	C	C	.	.	H	α-helix	trans	-59.7	-44.8	174.6	172.7	0	0	0	0	110.5	Y10 L11 A16 Q17 M18 V257	Y10-V14 HydrophobicContact CD1-CG2 4.31Å; Y10-V14 HydrophobicContact CD2-CG2 4.44Å; Y10-V14 HydrophobicContact CE1-CG2 3.97Å; Y10-V14 HydrophobicContact CE2-CG2 4.1Å; Y10-V14 WeakPolarHBondContact O-CG2 3.17Å; Y10-V14 PolarHBondContact O-N 3.39Å; L11-V14 PolarHBondContact O-N 2.81Å; V14-A16 VanDerWaalsContact C-N 3.3Å; V14-A16 PolarHBondContact O-N 3Å; V14-Q17 PolarHBondContact O-N 3.42Å; V14-M18 HydrophobicContact CG1-CG 4.5Å; V14-M18 HydrophobicContact CG1-SD 4.22Å; V14-M18 VanDerWaalsContact O-CG 3.3Å; V14-M18 WeakPolarHBondContact O-CG 3.36Å; V14-M18 PolarHBondContact O-N 3.39Å; V14-V257 HydrophobicContact CG1-CG2 4.12Å
15	R	90.8	Very high	88.3	Confident	73 Å²	73	40.4 Å²	40.4	28%	0.275	22%	0.223	S	C	.	.	H	α-helix	trans	-59.3	-41.2	175.6	-168.9	-173.4	-70	144.5	6	112	L11 A12 T13 M18 C19 V43 E46 V244 V246	L11-R15 WeakPolarHBondContact O-CB 3.18Å; L11-R15 PolarHBondContact O-N 2.99Å; A12-R15 PolarHBondContact O-N 2.96Å; T13-R15 VanDerWaalsContact C-N 3.32Å; T13-R15 PolarHBondContact O-N 3.48Å; R15-M18 PolarHBondContact O-N 3.43Å; R15-C19 PolarHBondContact O-N 2.9Å; R15-C19 VanDerWaalsContact O-N 3.13Å; R15-C19 PolarHBondContact O-SG 3.24Å; R15-V43 HydrophobicContact CB-CG1 4.25Å; R15-V43 HydrophobicContact CG-CG1 4.06Å; R15-V43 HydrophobicContact CG-CG2 4.4Å; R15-E46 IonicContact CZ-OE2 2.87Å; R15-E46 IonicContact NH1-OE1 3Å; R15-E46 IonicContact NH1-OE2 2.74Å; R15-E46 PolarHBondContact NH1-OE2 3.24Å; R15-V244 HydrophobicContact CB-CG1 4.08Å; R15-V244 HydrophobicContact CG-CG1 4.46Å; R15-V246 HydrophobicContact CB-CG2 4.43Å; R15-V246 HydrophobicContact CG-CG2 3.44Å; R15-V246 VanDerWaalsContact CG-CG2 3.44Å
16	A	90.8	Very high	88	Confident	7 Å²	7	42.5 Å²	42.5	6%	0.058	23%	0.234	C	C	.	.	H	α-helix	trans	-63.5	-49.5	177.7	0	0	0	0	0	111.2	A12 T13 V14 M18 C19 E20 V43 V47	A12-A16 WeakPolarHBondContact O-CB 3.26Å; A12-A16 PolarHBondContact O-N 3.21Å; T13-A16 WeakPolarHBondContact O-CB 3.21Å; T13-A16 PolarHBondContact O-N 3.32Å; T13-A16 VanDerWaalsContact O-N 3.15Å; V14-A16 VanDerWaalsContact C-N 3.3Å; V14-A16 PolarHBondContact O-N 3Å; A16-M18 VanDerWaalsContact C-N 3.3Å; A16-M18 PolarHBondContact O-N 2.89Å; A16-C19 PolarHBondContact O-N 3.06Å; A16-C19 VanDerWaalsContact O-N 3.1Å; A16-E20 WeakPolarHBondContact O-CB 3.33Å; A16-E20 WeakPolarHBondContact O-CG 3.43Å; A16-E20 PolarHBondContact O-N 3.24Å; A16-V43 HydrophobicContact CB-CG1 3.7Å; A16-V47 HydrophobicContact CB-CG2 3.72Å
17	Q	90.3	Very high	87.6	Confident	96 Å²	96	47.4 Å²	47.4	45%	0.449	26%	0.26	S	S	.	.	H	α-helix	trans	-59.2	-41.6	177.4	-70.1	172.3	-10.6	0	0	111.7	T13 V14 C19 E20 L21	T13-Q17 WeakPolarHBondContact O-CG 3.41Å; T13-Q17 PolarHBondContact O-N 3.29Å; V14-Q17 PolarHBondContact O-N 3.42Å; Q17-C19 VanDerWaalsContact C-N 3.33Å; Q17-C19 PolarHBondContact O-N 3.38Å; Q17-E20 PolarHBondContact O-N 3.08Å; Q17-L21 WeakPolarHBondContact O-CB 3.28Å; Q17-L21 VanDerWaalsContact O-CG 3.23Å; Q17-L21 WeakPolarHBondContact O-CG 3.18Å; Q17-L21 PolarHBondContact O-N 3.1Å
18	M	87.6	Confident	87	Confident	23 Å²	23	52.8 Å²	52.8	11%	0.113	29%	0.285	C	S	.	.	H	α-helix	trans	-59.1	-42.2	174.7	-74.3	174.4	66.2	0	0	112.7	V14 R15 A16 V244 V246 T255	V14-M18 HydrophobicContact CG1-CG 4.5Å; V14-M18 HydrophobicContact CG1-SD 4.22Å; V14-M18 VanDerWaalsContact O-CG 3.3Å; V14-M18 WeakPolarHBondContact O-CG 3.36Å; V14-M18 PolarHBondContact O-N 3.39Å; R15-M18 PolarHBondContact O-N 3.43Å; A16-M18 VanDerWaalsContact C-N 3.3Å; A16-M18 PolarHBondContact O-N 2.89Å; M18-V244 HydrophobicContact SD-CB 4.48Å; M18-V244 HydrophobicContact SD-CG1 4.04Å; M18-V246 HydrophobicContact CB-CG2 3.91Å; M18-V246 HydrophobicContact CE-CB 4.24Å; M18-V246 HydrophobicContact CE-CG2 3.94Å; M18-V246 HydrophobicContact SD-CG2 4.22Å; M18-T255 HydrophobicContact CE-CG2 3.62Å; M18-T255 HydrophobicContact SD-CG2 3.89Å; M18-T255 PolarHBondContact SD-OG1 2.74Å
19	C	86.6	Confident	86.5	Confident	1 Å²	1	58 Å²	58	1%	0.007	31%	0.313	C	S	.	.	H	α-helix	trans	-69.6	-43.4	176.6	-64.3	0	0	0	0	111.8	R15 A16 Q17 L21 Q22 V40 V43 V246	R15-C19 PolarHBondContact O-N 2.9Å; R15-C19 VanDerWaalsContact O-N 3.13Å; R15-C19 PolarHBondContact O-SG 3.24Å; A16-C19 PolarHBondContact O-N 3.06Å; A16-C19 VanDerWaalsContact O-N 3.1Å; Q17-C19 VanDerWaalsContact C-N 3.33Å; Q17-C19 PolarHBondContact O-N 3.38Å; C19-L21 VanDerWaalsContact C-N 3.33Å; C19-L21 PolarHBondContact O-N 3.31Å; C19-Q22 WeakPolarHBondContact O-CB 3.08Å; C19-Q22 PolarHBondContact O-N 3.24Å; C19-Q22 VanDerWaalsContact O-N 3.1Å; C19-V40 HydrophobicContact CB-CG2 3.95Å; C19-V43 VanDerWaalsContact SG-CG2 3.6Å; C19-V246 WeakPolarHBondContact SG-CG1 3.5Å
20	E	87.6	Confident	86.1	Confident	64 Å²	64	60.9 Å²	60.9	30%	0.299	33%	0.328	S	S	.	.	H	α-helix	trans	-65.8	-35.5	-179	-72.5	-178.5	159.8	0	0	112	A16 Q17 Q22 L23 V24 V40 R44	A16-E20 WeakPolarHBondContact O-CB 3.33Å; A16-E20 WeakPolarHBondContact O-CG 3.43Å; A16-E20 PolarHBondContact O-N 3.24Å; Q17-E20 PolarHBondContact O-N 3.08Å; E20-Q22 PolarHBondContact O-N 3.45Å; E20-L23 WeakPolarHBondContact O-CB 3.26Å; E20-L23 PolarHBondContact O-N 3.12Å; E20-V24 PolarHBondContact O-N 3.04Å; E20-V40 HydrophobicContact CG-CG1 3.91Å; E20-R44 IonicContact OE1-CZ 2.87Å; E20-R44 VanDerWaalsContact OE1-CZ 3.24Å; E20-R44 IonicContact OE1-NE 2.76Å; E20-R44 PolarHBondContact OE1-NE 3.01Å; E20-R44 IonicContact OE1-NH2 3.48Å; E20-R44 PolarHBondContact OE1-NH2 3.16Å
21	L	87.3	Confident	85.5	Confident	115 Å²	115	63.8 Å²	63.8	60%	0.602	36%	0.359	S	S	*	.	H	α-helix	trans	-59.4	-29.1	172	-76.8	168.7	0	0	0	112.9	Q17 C19 L23 V24	Q17-L21 WeakPolarHBondContact O-CB 3.28Å; Q17-L21 VanDerWaalsContact O-CG 3.23Å; Q17-L21 WeakPolarHBondContact O-CG 3.18Å; Q17-L21 PolarHBondContact O-N 3.1Å; C19-L21 VanDerWaalsContact C-N 3.33Å; C19-L21 PolarHBondContact O-N 3.31Å; L21-L23 VanDerWaalsContact C-N 3.29Å; L21-L23 PolarHBondContact O-N 3.33Å; L21-V24 WeakPolarHBondContact O-CB 3.21Å; L21-V24 PolarHBondContact O-N 2.72Å
22	Q	84.6	Confident	85	Confident	68 Å²	68	68.5 Å²	68.5	32%	0.318	38%	0.38	S	S	.	.	T	Hydrogen-bonded Turn	trans	-75.1	-18.2	175.5	-58	-56	-50	0	0	113	C19 E20 L26 V36 I248 Y253	C19-Q22 WeakPolarHBondContact O-CB 3.08Å; C19-Q22 PolarHBondContact O-N 3.24Å; C19-Q22 VanDerWaalsContact O-N 3.1Å; E20-Q22 PolarHBondContact O-N 3.45Å; Q22-L26 VanDerWaalsContact O-CD1 3.3Å; Q22-L26 WeakPolarHBondContact O-CD1 3.16Å; Q22-V36 HydrophobicContact CB-CG1 4.04Å; Q22-I248 HydrophobicContact CB-CD1 3.99Å; Q22-I248 HydrophobicContact CG-CD1 3.6Å; Q22-Y253 PolarHBondContact OE1-OH 3.43Å
23	L	80.8	Confident	84.7	Confident	31 Å²	31	71.1 Å²	71.1	16%	0.162	39%	0.39	C	S	.	.	T	Hydrogen-bonded Turn	trans	-76.9	-27.9	169.4	-69.1	173.3	0	0	0	111.9	E20 L21 G25 L26 Y33 V36 M37 V40	E20-L23 WeakPolarHBondContact O-CB 3.26Å; E20-L23 PolarHBondContact O-N 3.12Å; L21-L23 VanDerWaalsContact C-N 3.29Å; L21-L23 PolarHBondContact O-N 3.33Å; L23-G25 PolarHBondContact O-N 3.32Å; L23-L26 PolarHBondContact O-N 2.82Å; L23-L26 VanDerWaalsContact O-N 3.11Å; L23-Y33 HydrophobicContact CD2-CE2 4.39Å; L23-V36 HydrophobicContact CD2-CB 3.88Å; L23-V36 HydrophobicContact CD2-CG1 3.46Å; L23-V36 VanDerWaalsContact CD2-CG1 3.46Å; L23-V36 HydrophobicContact CG-CG1 3.8Å; L23-M37 HydrophobicContact CD1-SD 3.5Å; L23-M37 WeakPolarHBondContact CD1-SD 3.18Å; L23-M37 HydrophobicContact CD2-CG 3.83Å; L23-M37 HydrophobicContact CD2-SD 3.49Å; L23-M37 WeakPolarHBondContact CD2-SD 3.31Å; L23-M37 HydrophobicContact CG-SD 4.16Å; L23-V40 HydrophobicContact CD1-CB 3.94Å; L23-V40 HydrophobicContact CD1-CG1 3.82Å; L23-V40 HydrophobicContact CD1-CG2 3.42Å; L23-V40 VanDerWaalsContact CD1-CG2 3.42Å; L23-V40 HydrophobicContact CD2-CG2 4.38Å; L23-V40 HydrophobicContact CG-CG2 3.72Å
24	V	79.7	Confident	84.3	Confident	116 Å²	116	72.3 Å²	72.3	70%	0.703	40%	0.404	S	S	*	.	T	Hydrogen-bonded Turn	trans	-67.7	102.9	-179.8	-177.5	0	0	0	0	108.8	E20 L21	E20-V24 PolarHBondContact O-N 3.04Å; L21-V24 WeakPolarHBondContact O-CB 3.21Å; L21-V24 PolarHBondContact O-N 2.72Å
25	G	76.9	Confident	84.1	Confident	74 Å²	74	73.8 Å²	73.8	76%	0.763	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	113.8	-5.1	-179.5	0	0	0	0	0	114.9	L23	L23-G25 PolarHBondContact O-N 3.32Å
26	L	80.6	Confident	83.9	Confident	51 Å²	51	70.8 Å²	70.8	27%	0.267	40%	0.403	S	S	.	.			trans	-92.6	136.4	169	-66	175.7	0	0	0	110.4	Q22 L23 D30 Y33 V36	Q22-L26 VanDerWaalsContact O-CD1 3.3Å; Q22-L26 WeakPolarHBondContact O-CD1 3.16Å; L23-L26 PolarHBondContact O-N 2.82Å; L23-L26 VanDerWaalsContact O-N 3.11Å; L26-D30 WeakPolarHBondContact CA-OD2 3.19Å; L26-D30 HydrophobicContact CD2-CB 4.33Å; L26-Y33 HydrophobicContact CB-CD2 4.19Å; L26-V36 HydrophobicContact CD1-CB 4.15Å; L26-V36 HydrophobicContact CD1-CG1 4.44Å; L26-V36 HydrophobicContact CD1-CG2 3.72Å
27	N	80.6	Confident	83.8	Confident	110 Å²	110	72.3 Å²	72.3	59%	0.588	41%	0.409	S	S	*	.			trans	-87.8	156	170	-64.4	-42.8	0	0	0	110.2	D29 D30 Y33	N27-D29 PolarHBondContact O-N 3.33Å; N27-D29 VanDerWaalsContact O-N 3.12Å; N27-D30 PolarHBondContact N-OD2 3.19Å; N27-D30 WeakPolarHBondContact O-CB 3.16Å; N27-D30 PolarHBondContact O-N 2.94Å; N27-Y33 WeakPolarHBondContact O-CB 3.29Å; N27-Y33 WeakPolarHBondContact O-CD2 3.48Å
28	E	78	Confident	83.6	Confident	135 Å²	135	75.9 Å²	75.9	63%	0.631	42%	0.418	S	S	*	.	T	Hydrogen-bonded Turn	trans	-58.6	-26.5	178	-64.8	-172.4	171.6	0	0	112.9	D30 Y33	E28-D30 VanDerWaalsContact C-N 3.31Å; E28-Y33 HydrophobicContact CB-CE1 4.41Å; E28-Y33 HydrophobicContact CG-CE1 4.16Å; E28-Y33 HydrophobicContact CG-CE2 4.24Å
29	D	79.8	Confident	83.7	Confident	162 Å²	162	75.7 Å²	75.7	87%	0.866	42%	0.42	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.9	-11.6	178.7	-61.4	-41.5	0	0	0	113.8	N27 A31	N27-D29 PolarHBondContact O-N 3.33Å; N27-D29 VanDerWaalsContact O-N 3.12Å; D29-A31 PolarHBondContact O-N 3.4Å
30	D	83.5	Confident	83.8	Confident	61 Å²	61	75.7 Å²	75.7	33%	0.326	42%	0.42	S	S	.	.	S	Bend	trans	-70.6	133.1	-178	-71.1	-37.9	0	0	0	111	L26 N27 E28 H32 Y33	L26-D30 WeakPolarHBondContact CA-OD2 3.19Å; L26-D30 HydrophobicContact CD2-CB 4.33Å; N27-D30 PolarHBondContact N-OD2 3.19Å; N27-D30 WeakPolarHBondContact O-CB 3.16Å; N27-D30 PolarHBondContact O-N 2.94Å; E28-D30 VanDerWaalsContact C-N 3.31Å; D30-H32 PolarHBondContact O-N 3.25Å; D30-Y33 WeakPolarHBondContact O-CB 3.38Å; D30-Y33 PolarHBondContact O-N 3.33Å
31	A	80.6	Confident	83.9	Confident	96 Å²	96	74.9 Å²	74.9	79%	0.793	42%	0.416	S	S	*	.	T	Hydrogen-bonded Turn	trans	-56.6	-27.9	179.7	0	0	0	0	0	113.3	D29	D29-A31 PolarHBondContact O-N 3.4Å
32	H	82.6	Confident	84.1	Confident	127 Å²	127	75.1 Å²	75.1	59%	0.588	41%	0.413	S	S	*	.	T	Hydrogen-bonded Turn	trans	-82.9	-20.6	177.7	-63.6	-70.4	0	0	0	113.4	D30 G34 V35 V36	D30-H32 PolarHBondContact O-N 3.25Å; H32-G34 VanDerWaalsContact C-N 3.33Å; H32-G34 PolarHBondContact O-N 3.05Å; H32-V35 PolarHBondContact O-N 3.34Å; H32-V36 WeakPolarHBondContact O-CG2 3.04Å; H32-V36 PolarHBondContact O-N 2.67Å
33	Y	85.1	Confident	84.4	Confident	56 Å²	56	72.3 Å²	72.3	22%	0.22	40%	0.4	C	S	.	.	H	α-helix	trans	-53.5	-49.1	-176.2	-179.8	-93.9	0	0	0	111.7	L23 L26 N27 E28 D30 V35 V36 M37	L23-Y33 HydrophobicContact CD2-CE2 4.39Å; L26-Y33 HydrophobicContact CB-CD2 4.19Å; N27-Y33 WeakPolarHBondContact O-CB 3.29Å; N27-Y33 WeakPolarHBondContact O-CD2 3.48Å; E28-Y33 HydrophobicContact CB-CE1 4.41Å; E28-Y33 HydrophobicContact CG-CE1 4.16Å; E28-Y33 HydrophobicContact CG-CE2 4.24Å; D30-Y33 WeakPolarHBondContact O-CB 3.38Å; D30-Y33 PolarHBondContact O-N 3.33Å; Y33-V35 VanDerWaalsContact C-N 3.26Å; Y33-V35 PolarHBondContact O-N 2.71Å; Y33-V36 PolarHBondContact O-N 2.81Å; Y33-M37 HydrophobicContact CD1-CG 3.85Å; Y33-M37 HydrophobicContact CD2-CG 4.37Å; Y33-M37 HydrophobicContact CE1-CG 3.43Å; Y33-M37 VanDerWaalsContact CE1-CG 3.43Å; Y33-M37 HydrophobicContact CE1-SD 4.39Å; Y33-M37 HydrophobicContact CE2-CG 4.02Å; Y33-M37 HydrophobicContact CE2-SD 4.33Å; Y33-M37 HydrophobicContact CG-CG 4.29Å; Y33-M37 VanDerWaalsContact O-CB 3.32Å; Y33-M37 WeakPolarHBondContact O-CB 3.41Å; Y33-M37 WeakPolarHBondContact O-CG 3.49Å; Y33-M37 PolarHBondContact O-N 3.05Å
34	G	85.1	Confident	85	Confident	32 Å²	32	72.3 Å²	72.3	33%	0.33	40%	0.398	S	S	.	.	H	α-helix	trans	-62.2	-29.8	179.2	0	0	0	0	0	114.1	H32 R38	H32-G34 VanDerWaalsContact C-N 3.33Å; H32-G34 PolarHBondContact O-N 3.05Å; G34-R38 WeakPolarHBondContact O-CG 2.82Å; G34-R38 PolarHBondContact O-N 3.36Å
35	V	86.9	Confident	85.6	Confident	52 Å²	52	72.8 Å²	72.8	32%	0.315	39%	0.387	S	S	.	.	H	α-helix	trans	-77.4	-45.1	177.3	-177.6	0	0	0	0	110.7	H32 Y33 R38 A39 A249	H32-V35 PolarHBondContact O-N 3.34Å; Y33-V35 VanDerWaalsContact C-N 3.26Å; Y33-V35 PolarHBondContact O-N 2.71Å; V35-R38 PolarHBondContact O-N 3.21Å; V35-A39 PolarHBondContact O-N 3.23Å; V35-A249 HydrophobicContact CG1-CB 3.93Å
36	V	87	Confident	86.3	Confident	9 Å²	9	72 Å²	72	6%	0.055	36%	0.364	C	S	.	.	H	α-helix	trans	-64.2	-41.8	177.3	-175.1	0	0	0	0	110.6	Q22 L23 L26 H32 Y33 R38 A39 V40 I248	Q22-V36 HydrophobicContact CB-CG1 4.04Å; L23-V36 HydrophobicContact CD2-CB 3.88Å; L23-V36 HydrophobicContact CD2-CG1 3.46Å; L23-V36 VanDerWaalsContact CD2-CG1 3.46Å; L23-V36 HydrophobicContact CG-CG1 3.8Å; L26-V36 HydrophobicContact CD1-CB 4.15Å; L26-V36 HydrophobicContact CD1-CG1 4.44Å; L26-V36 HydrophobicContact CD1-CG2 3.72Å; H32-V36 WeakPolarHBondContact O-CG2 3.04Å; H32-V36 PolarHBondContact O-N 2.67Å; Y33-V36 PolarHBondContact O-N 2.81Å; V36-R38 VanDerWaalsContact C-N 3.34Å; V36-R38 PolarHBondContact O-N 3.41Å; V36-A39 WeakPolarHBondContact O-CB 3.42Å; V36-A39 PolarHBondContact O-N 3.38Å; V36-A39 VanDerWaalsContact O-N 3.1Å; V36-V40 HydrophobicContact CG1-CG2 4.28Å; V36-V40 VanDerWaalsContact O-CG2 3.27Å; V36-V40 WeakPolarHBondContact O-CG2 2.82Å; V36-V40 PolarHBondContact O-N 3.05Å; V36-I248 HydrophobicContact CG2-CG2 3.9Å
37	M	87.6	Confident	87	Confident	39 Å²	39	69.7 Å²	69.7	19%	0.192	35%	0.352	C	S	.	.	H	α-helix	trans	-59.8	-40.9	176.1	-80	-59.3	-67.4	0	0	112.8	L23 Y33 A39 V40 E41	L23-M37 HydrophobicContact CD1-SD 3.5Å; L23-M37 WeakPolarHBondContact CD1-SD 3.18Å; L23-M37 HydrophobicContact CD2-CG 3.83Å; L23-M37 HydrophobicContact CD2-SD 3.49Å; L23-M37 WeakPolarHBondContact CD2-SD 3.31Å; L23-M37 HydrophobicContact CG-SD 4.16Å; Y33-M37 HydrophobicContact CD1-CG 3.85Å; Y33-M37 HydrophobicContact CD2-CG 4.37Å; Y33-M37 HydrophobicContact CE1-CG 3.43Å; Y33-M37 VanDerWaalsContact CE1-CG 3.43Å; Y33-M37 HydrophobicContact CE1-SD 4.39Å; Y33-M37 HydrophobicContact CE2-CG 4.02Å; Y33-M37 HydrophobicContact CE2-SD 4.33Å; Y33-M37 HydrophobicContact CG-CG 4.29Å; Y33-M37 VanDerWaalsContact O-CB 3.32Å; Y33-M37 WeakPolarHBondContact O-CB 3.41Å; Y33-M37 WeakPolarHBondContact O-CG 3.49Å; Y33-M37 PolarHBondContact O-N 3.05Å; M37-A39 VanDerWaalsContact C-N 3.33Å; M37-A39 PolarHBondContact O-N 3.37Å; M37-V40 PolarHBondContact O-N 3.45Å; M37-E41 WeakPolarHBondContact O-CB 3.06Å; M37-E41 WeakPolarHBondContact O-CG 3.43Å; M37-E41 PolarHBondContact O-N 3.09Å
38	R	88.1	Confident	87.6	Confident	172 Å²	172	64.5 Å²	64.5	65%	0.649	32%	0.324	S	S	*	.	H	α-helix	trans	-63.6	-39.3	174.2	-73.5	-178.6	-149	128.4	3.1	112.2	G34 V35 V36 E41 F42	G34-R38 WeakPolarHBondContact O-CG 2.82Å; G34-R38 PolarHBondContact O-N 3.36Å; V35-R38 PolarHBondContact O-N 3.21Å; V36-R38 VanDerWaalsContact C-N 3.34Å; V36-R38 PolarHBondContact O-N 3.41Å; R38-E41 PolarHBondContact O-N 3.15Å; R38-F42 WeakPolarHBondContact O-CB 3.39Å; R38-F42 PolarHBondContact O-N 2.83Å
39	A	88.2	Confident	88.2	Confident	18 Å²	18	60 Å²	60	15%	0.149	31%	0.307	C	S	.	.	H	α-helix	trans	-64.7	-42.8	175.6	0	0	0	0	0	111.3	V35 V36 M37 F42 V43 I248	V35-A39 PolarHBondContact O-N 3.23Å; V36-A39 WeakPolarHBondContact O-CB 3.42Å; V36-A39 PolarHBondContact O-N 3.38Å; V36-A39 VanDerWaalsContact O-N 3.1Å; M37-A39 VanDerWaalsContact C-N 3.33Å; M37-A39 PolarHBondContact O-N 3.37Å; A39-F42 WeakPolarHBondContact O-CB 3.28Å; A39-F42 PolarHBondContact O-N 2.99Å; A39-V43 WeakPolarHBondContact O-CG2 3.44Å; A39-V43 PolarHBondContact O-N 3.22Å; A39-I248 HydrophobicContact CB-CG1 4.15Å
40	V	89.2	Confident	88.9	Confident	1 Å²	1	53.3 Å²	53.3	1%	0.006	27%	0.272	C	S	.	.	H	α-helix	trans	-63.7	-43.6	176.1	171.4	0	0	0	0	111.2	C19 E20 L23 V36 M37 F42 V43 R44	C19-V40 HydrophobicContact CB-CG2 3.95Å; E20-V40 HydrophobicContact CG-CG1 3.91Å; L23-V40 HydrophobicContact CD1-CB 3.94Å; L23-V40 HydrophobicContact CD1-CG1 3.82Å; L23-V40 HydrophobicContact CD1-CG2 3.42Å; L23-V40 VanDerWaalsContact CD1-CG2 3.42Å; L23-V40 HydrophobicContact CD2-CG2 4.38Å; L23-V40 HydrophobicContact CG-CG2 3.72Å; V36-V40 HydrophobicContact CG1-CG2 4.28Å; V36-V40 VanDerWaalsContact O-CG2 3.27Å; V36-V40 WeakPolarHBondContact O-CG2 2.82Å; V36-V40 PolarHBondContact O-N 3.05Å; M37-V40 PolarHBondContact O-N 3.45Å; V40-F42 VanDerWaalsContact C-N 3.3Å; V40-F42 PolarHBondContact O-N 2.87Å; V40-V43 PolarHBondContact O-N 3.32Å; V40-R44 HydrophobicContact CG1-CG 4.42Å; V40-R44 WeakPolarHBondContact O-CB 3.48Å; V40-R44 VanDerWaalsContact O-CG 3.28Å; V40-R44 WeakPolarHBondContact O-CG 2.96Å; V40-R44 PolarHBondContact O-N 3.27Å
41	E	89.8	Confident	89.4	Confident	47 Å²	47	50.5 Å²	50.5	22%	0.22	26%	0.257	C	S	.	.	H	α-helix	trans	-60	-40.7	173.9	-76.5	-172.8	-170.4	0	0	112.3	M37 R38 R45 K92	M37-E41 WeakPolarHBondContact O-CB 3.06Å; M37-E41 WeakPolarHBondContact O-CG 3.43Å; M37-E41 PolarHBondContact O-N 3.09Å; R38-E41 PolarHBondContact O-N 3.15Å; E41-R45 WeakPolarHBondContact O-CG 3.36Å; E41-R45 PolarHBondContact O-N 2.92Å; E41-R45 VanDerWaalsContact O-N 3.12Å; E41-K92 WeakPolarHBondContact OE1-CE 3.42Å; E41-K92 IonicContact OE1-NZ 3.05Å; E41-K92 PolarHBondContact OE1-NZ 2.89Å; E41-K92 WeakPolarHBondContact OE2-CE 3.01Å; E41-K92 IonicContact OE2-NZ 3.03Å; E41-K92 PolarHBondContact OE2-NZ 3.02Å
42	F	91.2	Very high	89.9	Confident	120 Å²	120	46.3 Å²	46.3	53%	0.526	22%	0.221	S	C	.	.	H	α-helix	trans	-62.4	-50.4	176.3	177.5	-94.2	0	0	0	111.4	R38 A39 V40 R44 R45 E46	R38-F42 WeakPolarHBondContact O-CB 3.39Å; R38-F42 PolarHBondContact O-N 2.83Å; A39-F42 WeakPolarHBondContact O-CB 3.28Å; A39-F42 PolarHBondContact O-N 2.99Å; V40-F42 VanDerWaalsContact C-N 3.3Å; V40-F42 PolarHBondContact O-N 2.87Å; F42-R44 VanDerWaalsContact C-N 3.34Å; F42-R44 PolarHBondContact O-N 3.06Å; F42-R45 WeakPolarHBondContact O-CA 3.42Å; F42-R45 WeakPolarHBondContact O-CB 3.45Å; F42-R45 PolarHBondContact O-N 3.08Å; F42-E46 HydrophobicContact CD1-CG 4.37Å; F42-E46 HydrophobicContact CE1-CG 3.93Å; F42-E46 HydrophobicContact CZ-CG 4.25Å; F42-E46 PolarHBondContact O-N 3.35Å; F42-E46 VanDerWaalsContact O-N 3.08Å
43	V	90.9	Very high	90.3	Very high	9 Å²	9	45.9 Å²	45.9	6%	0.055	21%	0.214	C	C	.	.	H	α-helix	trans	-68.3	-33.3	-179	-176.2	0	0	0	0	112	R15 A16 C19 A39 V40 R45 E46 V47	R15-V43 HydrophobicContact CB-CG1 4.25Å; R15-V43 HydrophobicContact CG-CG1 4.06Å; R15-V43 HydrophobicContact CG-CG2 4.4Å; A16-V43 HydrophobicContact CB-CG1 3.7Å; C19-V43 VanDerWaalsContact SG-CG2 3.6Å; A39-V43 WeakPolarHBondContact O-CG2 3.44Å; A39-V43 PolarHBondContact O-N 3.22Å; V40-V43 PolarHBondContact O-N 3.32Å; V43-R45 VanDerWaalsContact C-N 3.26Å; V43-R45 PolarHBondContact O-N 3.42Å; V43-E46 WeakPolarHBondContact O-CB 3.18Å; V43-E46 PolarHBondContact O-N 3.01Å; V43-E46 VanDerWaalsContact O-N 3.13Å; V43-V47 WeakPolarHBondContact O-CG2 3.3Å; V43-V47 PolarHBondContact O-N 3.41Å
44	R	93.1	Very high	90.7	Very high	31 Å²	31	43.4 Å²	43.4	12%	0.117	20%	0.204	C	C	.	.	H	α-helix	trans	-61	-33.8	170.1	-75.3	174.3	178.8	172.2	-3.7	112.6	E20 V40 F42 G48 V87	E20-R44 IonicContact OE1-CZ 2.87Å; E20-R44 VanDerWaalsContact OE1-CZ 3.24Å; E20-R44 IonicContact OE1-NE 2.76Å; E20-R44 PolarHBondContact OE1-NE 3.01Å; E20-R44 IonicContact OE1-NH2 3.48Å; E20-R44 PolarHBondContact OE1-NH2 3.16Å; V40-R44 HydrophobicContact CG1-CG 4.42Å; V40-R44 WeakPolarHBondContact O-CB 3.48Å; V40-R44 VanDerWaalsContact O-CG 3.28Å; V40-R44 WeakPolarHBondContact O-CG 2.96Å; V40-R44 PolarHBondContact O-N 3.27Å; F42-R44 VanDerWaalsContact C-N 3.34Å; F42-R44 PolarHBondContact O-N 3.06Å; R44-G48 PolarHBondContact O-N 3.29Å; R44-V87 HydrophobicContact CB-CG1 4.34Å; R44-V87 HydrophobicContact CG-CG1 4.46Å
45	R	92.9	Very high	91	Very high	127 Å²	127	42 Å²	42	48%	0.479	19%	0.189	S	C	.	.	H	α-helix	trans	-69.5	-39.2	172.9	-68.8	175	-173.9	-163	3.6	112.2	E41 F42 V43 V47 G48 S49 N84 C85	E41-R45 WeakPolarHBondContact O-CG 3.36Å; E41-R45 PolarHBondContact O-N 2.92Å; E41-R45 VanDerWaalsContact O-N 3.12Å; F42-R45 WeakPolarHBondContact O-CA 3.42Å; F42-R45 WeakPolarHBondContact O-CB 3.45Å; F42-R45 PolarHBondContact O-N 3.08Å; V43-R45 VanDerWaalsContact C-N 3.26Å; V43-R45 PolarHBondContact O-N 3.42Å; R45-V47 VanDerWaalsContact C-N 3.34Å; R45-G48 PolarHBondContact O-N 3.34Å; R45-S49 PolarHBondContact O-N 3.05Å; R45-N84 CarbonylContact C-O 3.57Å; R45-N84 WeakPolarHBondContact CA-O 3.26Å; R45-C85 HydrophobicContact CG-CB 4.31Å
46	E	91.9	Very high	91.2	Very high	56 Å²	56	43.4 Å²	43.4	26%	0.262	20%	0.195	S	C	.	.	H	α-helix	trans	-60.4	-45.8	173.5	-63	-164.1	130.2	0	0	111.2	R15 F42 V43 G48 S49 I50	R15-E46 IonicContact CZ-OE2 2.87Å; R15-E46 IonicContact NH1-OE1 3Å; R15-E46 IonicContact NH1-OE2 2.74Å; R15-E46 PolarHBondContact NH1-OE2 3.24Å; F42-E46 HydrophobicContact CD1-CG 4.37Å; F42-E46 HydrophobicContact CE1-CG 3.93Å; F42-E46 HydrophobicContact CZ-CG 4.25Å; F42-E46 PolarHBondContact O-N 3.35Å; F42-E46 VanDerWaalsContact O-N 3.08Å; V43-E46 WeakPolarHBondContact O-CB 3.18Å; V43-E46 PolarHBondContact O-N 3.01Å; V43-E46 VanDerWaalsContact O-N 3.13Å; E46-G48 VanDerWaalsContact C-N 3.34Å; E46-G48 PolarHBondContact O-N 3.34Å; E46-S49 WeakPolarHBondContact O-CB 3.31Å; E46-S49 PolarHBondContact O-N 3.42Å; E46-I50 WeakPolarHBondContact O-CG1 3.34Å; E46-I50 PolarHBondContact O-N 3.02Å
47	V	93.9	Very high	91.3	Very high	3 Å²	3	44.5 Å²	44.5	2%	0.018	21%	0.205	C	C	.	.	H	α-helix	trans	-59.8	-44	175.8	172.7	0	0	0	0	111	A12 A16 V43 R45 S49 I50 T51 V87 H121	A12-V47 HydrophobicContact CB-CG2 4.3Å; A16-V47 HydrophobicContact CB-CG2 3.72Å; V43-V47 WeakPolarHBondContact O-CG2 3.3Å; V43-V47 PolarHBondContact O-N 3.41Å; R45-V47 VanDerWaalsContact C-N 3.34Å; V47-S49 PolarHBondContact O-N 3.19Å; V47-I50 PolarHBondContact O-N 3.24Å; V47-T51 WeakPolarHBondContact O-CB 3.39Å; V47-T51 PolarHBondContact O-N 3.44Å; V47-T51 PolarHBondContact O-OG1 3Å; V47-V87 HydrophobicContact CG1-CG1 4.45Å; V47-V87 HydrophobicContact CG1-CG2 4.42Å; V47-H121 VanDerWaalsContact CG1-CE1 3.48Å; V47-H121 WeakPolarHBondContact CG1-CE1 3.33Å
48	G	93.2	Very high	91.3	Very high	1 Å²	1	42.7 Å²	42.7	1%	0.01	20%	0.197	C	C	.	.	H	α-helix	trans	-55.9	-51.5	173.9	0	0	0	0	0	111.8	R44 R45 E46 I50 T51 F52	R44-G48 PolarHBondContact O-N 3.29Å; R45-G48 PolarHBondContact O-N 3.34Å; E46-G48 VanDerWaalsContact C-N 3.34Å; E46-G48 PolarHBondContact O-N 3.34Å; G48-I50 VanDerWaalsContact C-N 3.34Å; G48-I50 PolarHBondContact O-N 3.13Å; G48-T51 WeakPolarHBondContact O-CB 3.49Å; G48-T51 PolarHBondContact O-N 2.98Å; G48-F52 WeakPolarHBondContact O-CD2 3.47Å; G48-F52 PolarHBondContact O-N 2.95Å
49	S	92.5	Very high	91.4	Very high	40 Å²	40	34.8 Å²	34.8	28%	0.28	17%	0.167	S	C	.	.	H	α-helix	trans	-56.5	-45.5	178.7	-163.5	0	0	0	0	112.9	R45 E46 V47 F52 R53 N84	R45-S49 PolarHBondContact O-N 3.05Å; E46-S49 WeakPolarHBondContact O-CB 3.31Å; E46-S49 PolarHBondContact O-N 3.42Å; V47-S49 PolarHBondContact O-N 3.19Å; S49-F52 PolarHBondContact O-N 3.33Å; S49-R53 PolarHBondContact O-N 3.04Å; S49-R53 VanDerWaalsContact O-N 3.11Å; S49-N84 WeakPolarHBondContact CA-OD1 3.37Å; S49-N84 WeakPolarHBondContact CB-OD1 3.42Å; S49-N84 PolarHBondContact OG-OD1 3.34Å
50	I	93.4	Very high	91.3	Very high	23 Å²	23	36.8 Å²	36.8	12%	0.118	18%	0.179	C	C	.	.	H	α-helix	trans	-74.1	-32	-178.5	-63.9	164.3	0	0	0	111.4	D8 F9 A12 E46 V47 G48 F52 R53 L54	D8-I50 HydrophobicContact CB-CG2 4.17Å; F9-I50 VanDerWaalsContact CA-CG2 3.45Å; F9-I50 HydrophobicContact CB-CG2 3.78Å; F9-I50 HydrophobicContact CD2-CG2 4.2Å; F9-I50 HydrophobicContact CG-CG2 4.5Å; A12-I50 HydrophobicContact CB-CD1 3.36Å; E46-I50 WeakPolarHBondContact O-CG1 3.34Å; E46-I50 PolarHBondContact O-N 3.02Å; V47-I50 PolarHBondContact O-N 3.24Å; G48-I50 VanDerWaalsContact C-N 3.34Å; G48-I50 PolarHBondContact O-N 3.13Å; I50-F52 VanDerWaalsContact C-N 3.33Å; I50-F52 PolarHBondContact O-N 3.12Å; I50-R53 WeakPolarHBondContact O-CB 3.19Å; I50-R53 PolarHBondContact O-N 2.9Å; I50-L54 WeakPolarHBondContact O-CB 3.43Å; I50-L54 PolarHBondContact O-N 2.74Å
51	T	93.8	Very high	91.1	Very high	2 Å²	2	42 Å²	42	1%	0.012	21%	0.21	C	C	.	.	H	α-helix	trans	-57	-47.3	172.5	-58	0	0	0	0	110.6	F9 V47 G48 L54 L55 H121 L278	F9-T51 WeakPolarHBondContact CE2-OG1 3.31Å; V47-T51 WeakPolarHBondContact O-CB 3.39Å; V47-T51 PolarHBondContact O-N 3.44Å; V47-T51 PolarHBondContact O-OG1 3Å; G48-T51 WeakPolarHBondContact O-CB 3.49Å; G48-T51 PolarHBondContact O-N 2.98Å; T51-L54 WeakPolarHBondContact O-CB 3.37Å; T51-L54 PolarHBondContact O-N 3.36Å; T51-L55 WeakPolarHBondContact O-CG 3.47Å; T51-L55 PolarHBondContact O-N 3.28Å; T51-H121 PolarHBondContact OG1-NE2 3.46Å; T51-L278 HydrophobicContact CG2-CD2 3.8Å
52	F	91.6	Very high	90.9	Very high	8 Å²	8	46.3 Å²	46.3	4%	0.035	24%	0.235	C	C	.	.	H	α-helix	trans	-69.3	-34.7	177.4	-82.5	-83.5	0	0	0	113	G48 S49 I50 L54 L55 N56 E83 L86 A282	G48-F52 WeakPolarHBondContact O-CD2 3.47Å; G48-F52 PolarHBondContact O-N 2.95Å; S49-F52 PolarHBondContact O-N 3.33Å; I50-F52 VanDerWaalsContact C-N 3.33Å; I50-F52 PolarHBondContact O-N 3.12Å; F52-L54 VanDerWaalsContact C-N 3.3Å; F52-L54 PolarHBondContact O-N 3.42Å; F52-L55 HydrophobicContact CD1-CD1 4.4Å; F52-L55 PolarHBondContact O-N 2.97Å; F52-N56 VanDerWaalsContact O-CB 3.27Å; F52-N56 WeakPolarHBondContact O-CB 3.45Å; F52-N56 PolarHBondContact O-N 2.9Å; F52-N56 PolarHBondContact O-ND2 3.14Å; F52-N56 VanDerWaalsContact O-ND2 3.15Å; F52-E83 HydrophobicContact CD1-CB 4.35Å; F52-E83 HydrophobicContact CD1-CG 4Å; F52-E83 HydrophobicContact CD2-CB 3.72Å; F52-E83 HydrophobicContact CD2-CG 4.19Å; F52-E83 WeakPolarHBondContact CD2-O 3.46Å; F52-E83 HydrophobicContact CE1-CB 4.5Å; F52-E83 HydrophobicContact CE1-CG 3.92Å; F52-E83 HydrophobicContact CE2-CB 3.89Å; F52-E83 HydrophobicContact CE2-CG 4.12Å; F52-E83 WeakPolarHBondContact CE2-O 3.34Å; F52-E83 HydrophobicContact CG-CB 3.97Å; F52-E83 HydrophobicContact CG-CG 4.13Å; F52-E83 HydrophobicContact CZ-CB 4.29Å; F52-E83 HydrophobicContact CZ-CG 3.99Å; F52-L86 HydrophobicContact CE2-CB 4.4Å; F52-L86 HydrophobicContact CE2-CD1 3.6Å; F52-L86 HydrophobicContact CE2-CG 4.18Å; F52-L86 HydrophobicContact CZ-CD1 3.45Å; F52-L86 VanDerWaalsContact CZ-CD1 3.45Å; F52-L86 HydrophobicContact CZ-CG 4.43Å; F52-A282 HydrophobicContact CZ-CB 4.42Å
53	R	91.5	Very high	90.5	Very high	118 Å²	118	42.6 Å²	42.6	45%	0.445	23%	0.227	S	C	.	.	H	α-helix	trans	-60.3	-41.3	169.6	-75	179.2	57.4	-162	-13.8	111.5	V5 D8 S49 I50 N56 A57	V5-R53 HydrophobicContact CG1-CB 4.23Å; D8-R53 IonicContact OD2-CZ 3.62Å; D8-R53 IonicContact OD2-NH1 3.67Å; D8-R53 IonicContact OD2-NH2 3.2Å; D8-R53 PolarHBondContact OD2-NH2 3.24Å; S49-R53 PolarHBondContact O-N 3.04Å; S49-R53 VanDerWaalsContact O-N 3.11Å; I50-R53 WeakPolarHBondContact O-CB 3.19Å; I50-R53 PolarHBondContact O-N 2.9Å; R53-N56 PolarHBondContact O-N 3.25Å; R53-A57 VanDerWaalsContact O-CB 3.27Å; R53-A57 WeakPolarHBondContact O-CB 3.49Å; R53-A57 PolarHBondContact O-N 3.19Å
54	L	91.9	Very high	90.3	Very high	4 Å²	4	45.8 Å²	45.8	2%	0.021	24%	0.238	C	C	.	.	H	α-helix	trans	-63.6	-50.3	176.3	178.7	61.8	0	0	0	110.9	V5 L6 F9 I50 T51 F52 N56 A57 A58 V124 L275	V5-L54 HydrophobicContact CG1-CB 4.01Å; V5-L54 HydrophobicContact CG1-CD1 4.19Å; L6-L54 HydrophobicContact CD2-CD1 3.71Å; L6-L54 HydrophobicContact CG-CD1 4.18Å; F9-L54 HydrophobicContact CB-CD2 4.23Å; F9-L54 HydrophobicContact CD1-CD2 4.11Å; F9-L54 HydrophobicContact CD2-CD2 3.91Å; F9-L54 HydrophobicContact CE1-CD2 4.47Å; F9-L54 HydrophobicContact CE2-CD2 4.3Å; F9-L54 HydrophobicContact CG-CD2 3.81Å; I50-L54 WeakPolarHBondContact O-CB 3.43Å; I50-L54 PolarHBondContact O-N 2.74Å; T51-L54 WeakPolarHBondContact O-CB 3.37Å; T51-L54 PolarHBondContact O-N 3.36Å; F52-L54 VanDerWaalsContact C-N 3.3Å; F52-L54 PolarHBondContact O-N 3.42Å; L54-N56 VanDerWaalsContact C-N 3.3Å; L54-N56 PolarHBondContact O-N 2.9Å; L54-A57 PolarHBondContact O-N 2.89Å; L54-A57 VanDerWaalsContact O-N 3.15Å; L54-A58 HydrophobicContact CD1-CB 4.36Å; L54-A58 WeakPolarHBondContact O-CB 2.98Å; L54-A58 PolarHBondContact O-N 2.95Å; L54-V124 HydrophobicContact CD2-CG1 4.38Å; L54-L275 HydrophobicContact CD2-CD2 3.93Å; L54-L275 HydrophobicContact CG-CD2 4.16Å
55	L	92.4	Very high	90	Very high	1 Å²	1	48.4 Å²	48.4	1%	0.005	25%	0.251	C	S	.	.	H	α-helix	trans	-57.2	-43.6	176.3	-68.2	176.3	0	0	0	111.9	T51 F52 A57 A58 L59 L275 L278 D279	T51-L55 WeakPolarHBondContact O-CG 3.47Å; T51-L55 PolarHBondContact O-N 3.28Å; F52-L55 HydrophobicContact CD1-CD1 4.4Å; F52-L55 PolarHBondContact O-N 2.97Å; L55-A57 VanDerWaalsContact C-N 3.33Å; L55-A57 PolarHBondContact O-N 2.83Å; L55-A58 PolarHBondContact O-N 3.3Å; L55-L59 HydrophobicContact CD2-CD1 3.82Å; L55-L59 WeakPolarHBondContact O-CB 3.48Å; L55-L59 PolarHBondContact O-N 3.29Å; L55-L275 HydrophobicContact CD2-CB 4.25Å; L55-L275 HydrophobicContact CD2-CD2 3.93Å; L55-L275 WeakPolarHBondContact CD2-O 3.46Å; L55-L278 HydrophobicContact CD2-CD2 4.36Å; L55-D279 HydrophobicContact CD1-CB 4.26Å; L55-D279 HydrophobicContact CD2-CB 4.16Å
56	N	90.1	Very high	89.5	Confident	82 Å²	82	48 Å²	48	44%	0.439	25%	0.253	S	S	.	.	H	α-helix	trans	-69.6	-29	179.4	-68.3	-21.4	0	0	0	113.4	F52 R53 L54 R64	F52-N56 VanDerWaalsContact O-CB 3.27Å; F52-N56 WeakPolarHBondContact O-CB 3.45Å; F52-N56 PolarHBondContact O-N 2.9Å; F52-N56 PolarHBondContact O-ND2 3.14Å; F52-N56 VanDerWaalsContact O-ND2 3.15Å; R53-N56 PolarHBondContact O-N 3.25Å; L54-N56 VanDerWaalsContact C-N 3.3Å; L54-N56 PolarHBondContact O-N 2.9Å; N56-R64 PolarHBondContact OD1-NH1 3.06Å
57	A	89.5	Confident	89.1	Confident	32 Å²	32	46.9 Å²	46.9	26%	0.264	25%	0.246	S	C	.	.	H	α-helix	trans	-83.9	-35	177	0	0	0	0	0	112.4	M1 V5 R53 L54 L55	M1-A57 WeakPolarHBondContact CE-O 3.47Å; M1-A57 WeakPolarHBondContact CG-O 3.36Å; V5-A57 HydrophobicContact CB-CB 4.42Å; V5-A57 HydrophobicContact CG1-CB 4.39Å; V5-A57 HydrophobicContact CG2-CB 4.2Å; R53-A57 VanDerWaalsContact O-CB 3.27Å; R53-A57 WeakPolarHBondContact O-CB 3.49Å; R53-A57 PolarHBondContact O-N 3.19Å; L54-A57 PolarHBondContact O-N 2.89Å; L54-A57 VanDerWaalsContact O-N 3.15Å; L55-A57 VanDerWaalsContact C-N 3.33Å; L55-A57 PolarHBondContact O-N 2.83Å
58	A	88.3	Confident	88	Confident	2 Å²	2	52.6 Å²	52.6	2%	0.017	28%	0.276	C	S	.	.	H	α-helix	trans	-93	-29.9	-171.6	0	0	0	0	0	114.4	M1 L54 L55 I267 L275	M1-A58 VanDerWaalsContact CE-C 3.45Å; M1-A58 VanDerWaalsContact CE-CA 3.47Å; M1-A58 WeakPolarHBondContact CE-O 2.95Å; M1-A58 HydrophobicContact SD-CB 4.45Å; L54-A58 HydrophobicContact CD1-CB 4.36Å; L54-A58 WeakPolarHBondContact O-CB 2.98Å; L54-A58 PolarHBondContact O-N 2.95Å; L55-A58 PolarHBondContact O-N 3.3Å; A58-I267 HydrophobicContact CB-CD1 4.02Å; A58-L275 HydrophobicContact CB-CD1 3.76Å
59	L	89.5	Confident	87	Confident	5 Å²	5	54.3 Å²	54.3	3%	0.026	28%	0.283	C	S	.	.	S	Bend	trans	-107.1	132.3	-177.9	-58.2	178.2	0	0	0	110.7	L55 R64 F272 L275 L276 D279	L55-L59 HydrophobicContact CD2-CD1 3.82Å; L55-L59 WeakPolarHBondContact O-CB 3.48Å; L55-L59 PolarHBondContact O-N 3.29Å; L59-R64 HydrophobicContact CB-CG 3.76Å; L59-R64 HydrophobicContact CD1-CG 4.29Å; L59-F272 HydrophobicContact CD2-CD2 4.09Å; L59-F272 HydrophobicContact CD2-CE2 3.72Å; L59-F272 HydrophobicContact CD2-CZ 4.18Å; L59-L275 HydrophobicContact CD1-CB 4.46Å; L59-L275 HydrophobicContact CD2-CB 4.12Å; L59-L275 HydrophobicContact CG-CB 4.45Å; L59-L276 HydrophobicContact CD1-CD2 4.16Å; L59-L276 HydrophobicContact CD2-CD2 3.71Å; L59-L276 HydrophobicContact CD2-CG 3.91Å; L59-L276 HydrophobicContact CG-CD2 4.48Å; L59-D279 HydrophobicContact CD1-CB 3.93Å
60	P	86.7	Confident	86.1	Confident	61 Å²	61	54.2 Å²	54.2	40%	0.396	28%	0.277	S	S	.	.			trans	-67.7	153.1	173.3	32.1	-35.9	0	0	0	110.2	N62 A63 R64	P60-N62 VanDerWaalsContact CB-OD1 3.26Å; P60-N62 WeakPolarHBondContact CB-OD1 3.41Å; P60-N62 WeakPolarHBondContact CG-OD1 3.34Å; P60-N62 PolarHBondContact O-N 3.3Å; P60-N62 VanDerWaalsContact O-N 3.11Å; P60-A63 HydrophobicContact CG-CB 3.73Å; P60-A63 PolarHBondContact O-N 3.35Å; P60-R64 PolarHBondContact O-N 3.26Å
61	T	84.7	Confident	84.9	Confident	110 Å²	110	58.4 Å²	58.4	68%	0.675	30%	0.304	S	S	*	.	T	Hydrogen-bonded Turn	trans	-59.9	-29.7	-169.9	57.2	0	0	0	0	114
62	N	85.3	Confident	83.5	Confident	137 Å²	137	64 Å²	64	73%	0.733	33%	0.328	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.4	-26.4	178.2	61.8	-26.9	0	0	0	114.1	P60	P60-N62 VanDerWaalsContact CB-OD1 3.26Å; P60-N62 WeakPolarHBondContact CB-OD1 3.41Å; P60-N62 WeakPolarHBondContact CG-OD1 3.34Å; P60-N62 PolarHBondContact O-N 3.3Å; P60-N62 VanDerWaalsContact O-N 3.11Å
63	A	84.3	Confident	82.1	Confident	43 Å²	43	64 Å²	64	36%	0.355	33%	0.328	S	S	.	.	T	Hydrogen-bonded Turn	trans	-85.9	-16.2	178.6	0	0	0	0	0	112.6	P60 L276	P60-A63 HydrophobicContact CG-CB 3.73Å; P60-A63 PolarHBondContact O-N 3.35Å; A63-L276 HydrophobicContact CB-CD2 3.91Å
64	R	86.4	Confident	80.5	Confident	75 Å²	75	63.6 Å²	63.6	28%	0.283	33%	0.333	S	S	.	.	S	Bend	trans	-71.5	142	176.8	-68.4	-176.4	-56.7	173.6	2.3	111.7	N56 L59 P60 K66 D279	N56-R64 PolarHBondContact OD1-NH1 3.06Å; L59-R64 HydrophobicContact CB-CG 3.76Å; L59-R64 HydrophobicContact CD1-CG 4.29Å; P60-R64 PolarHBondContact O-N 3.26Å; R64-K66 PolarHBondContact O-N 3Å; R64-D279 WeakPolarHBondContact CA-OD2 3.4Å; R64-D279 WeakPolarHBondContact CB-OD2 3.14Å
65	H	86.5	Confident	79.1	Confident	86 Å²	86	72.2 Å²	72.2	40%	0.398	37%	0.373	S	S	.	.			trans	-63.6	129	177.5	-160	84.3	0	0	0	111.1	R67 D279 A283	H65-R67 PolarHBondContact O-N 3.23Å; H65-D279 PolarHBondContact N-OD2 2.9Å; H65-A283 HydrophobicContact CB-CB 4.12Å; H65-A283 VanDerWaalsContact CD2-CB 3.46Å; H65-A283 WeakPolarHBondContact CD2-CB 3.19Å
66	K	82.5	Confident	77.8	Confident	119 Å²	119	77.1 Å²	77.1	52%	0.517	40%	0.4	S	S	.	.			trans	-75.6	107.7	-178	-66	-176	-179.6	-179.6	0	110.2	R64 L68	R64-K66 PolarHBondContact O-N 3Å; K66-L68 VanDerWaalsContact C-N 3.27Å; K66-L68 HydrophobicContact CB-CD2 4.29Å; K66-L68 HydrophobicContact CB-CG 4.21Å; K66-L68 PolarHBondContact O-N 3.46Å
67	R	83.7	Confident	76.7	Confident	32 Å²	32	75.7 Å²	75.7	12%	0.121	39%	0.394	C	S	.	.			trans	-84.8	62.7	176	-63.1	173.5	176.1	77.3	-4.2	111.5	H65 F69 R70 D279 A283 E286	H65-R67 PolarHBondContact O-N 3.23Å; R67-F69 HydrophobicContact CB-CD1 4.44Å; R67-F69 HydrophobicContact CB-CE1 3.84Å; R67-F69 HydrophobicContact CB-CZ 4.14Å; R67-F69 HydrophobicContact CG-CE1 4.16Å; R67-F69 HydrophobicContact CG-CZ 4.39Å; R67-F69 PolarHBondContact O-N 3.35Å; R67-F69 VanDerWaalsContact O-N 3.17Å; R67-R70 HydrophobicContact CB-CG 3.96Å; R67-R70 VanDerWaalsContact CD-NE 3.29Å; R67-R70 WeakPolarHBondContact O-CB 3.4Å; R67-R70 PolarHBondContact O-N 2.97Å; R67-R70 VanDerWaalsContact O-N 3.07Å; R67-D279 IonicContact CZ-OD1 2.74Å; R67-D279 VanDerWaalsContact CZ-OD1 3.28Å; R67-D279 IonicContact NH1-OD1 3.71Å; R67-D279 PolarHBondContact NH1-OD1 3.16Å; R67-D279 IonicContact NH1-OD2 3.61Å; R67-D279 PolarHBondContact NH2-O 3.25Å; R67-D279 IonicContact NH2-OD1 2.81Å; R67-D279 PolarHBondContact NH2-OD1 2.8Å; R67-A283 HydrophobicContact CG-CB 3.85Å; R67-E286 VanDerWaalsContact CD-OE2 3.24Å; R67-E286 WeakPolarHBondContact CD-OE2 3.29Å; R67-E286 IonicContact NE-OE2 3.94Å; R67-E286 PolarHBondContact NE-OE2 3.45Å; R67-E286 VanDerWaalsContact NE-OE2 3.07Å
68	L	69.4	Low	76.1	Confident	123 Å²	123	78.1 Å²	78.1	64%	0.644	40%	0.402	S	S	*	.	T	Hydrogen-bonded Turn	trans	-57.4	-32.5	-172.6	-64.4	176.2	0	0	0	113.4	K66 R70 T71	K66-L68 VanDerWaalsContact C-N 3.27Å; K66-L68 HydrophobicContact CB-CD2 4.29Å; K66-L68 HydrophobicContact CB-CG 4.21Å; K66-L68 PolarHBondContact O-N 3.46Å; L68-R70 PolarHBondContact O-N 3.31Å; L68-R70 VanDerWaalsContact O-N 3.16Å; L68-T71 PolarHBondContact O-N 3.06Å; L68-T71 PolarHBondContact O-OG1 3.22Å
69	F	72.5	Confident	75.4	Confident	38 Å²	38	79.9 Å²	79.9	17%	0.167	41%	0.411	C	S	.	.	T	Hydrogen-bonded Turn	trans	-58.3	-28	178.5	64.4	-91.7	0	0	0	112.9	R67 T71 K72 Y73 E286 F287	R67-F69 HydrophobicContact CB-CD1 4.44Å; R67-F69 HydrophobicContact CB-CE1 3.84Å; R67-F69 HydrophobicContact CB-CZ 4.14Å; R67-F69 HydrophobicContact CG-CE1 4.16Å; R67-F69 HydrophobicContact CG-CZ 4.39Å; R67-F69 PolarHBondContact O-N 3.35Å; R67-F69 VanDerWaalsContact O-N 3.17Å; F69-T71 PolarHBondContact O-N 3.38Å; F69-K72 PolarHBondContact O-N 3.37Å; F69-K72 VanDerWaalsContact O-N 3.16Å; F69-Y73 WeakPolarHBondContact O-CD2 3.49Å; F69-E286 HydrophobicContact CE2-CG 3.9Å; F69-E286 WeakPolarHBondContact CE2-OE1 3.25Å; F69-E286 HydrophobicContact CZ-CB 4.02Å; F69-E286 HydrophobicContact CZ-CG 3.65Å; F69-E286 WeakPolarHBondContact CZ-OE1 3.47Å; F69-F287 HydrophobicContact CB-CD2 4.17Å; F69-F287 HydrophobicContact CD1-CB 4.16Å; F69-F287 AromaticContact CD1-CD2 3.93Å; F69-F287 HydrophobicContact CD1-CD2 3.93Å; F69-F287 HydrophobicContact CE1-CB 3.9Å; F69-F287 HydrophobicContact CG-CD2 4.01Å; F69-F287 HydrophobicContact CZ-CB 4.24Å
70	R	74.9	Confident	75	Confident	37 Å²	37	88.9 Å²	88.9	14%	0.14	45%	0.445	C	S	.	.	H	α-helix	trans	-58	-31.9	179.5	-69.2	-176.3	171.9	-178.4	-3.5	113	R67 L68 K72 Y73 I74 L79 E83 E286	R67-R70 HydrophobicContact CB-CG 3.96Å; R67-R70 VanDerWaalsContact CD-NE 3.29Å; R67-R70 WeakPolarHBondContact O-CB 3.4Å; R67-R70 PolarHBondContact O-N 2.97Å; R67-R70 VanDerWaalsContact O-N 3.07Å; L68-R70 PolarHBondContact O-N 3.31Å; L68-R70 VanDerWaalsContact O-N 3.16Å; R70-K72 PolarHBondContact O-N 3.03Å; R70-K72 VanDerWaalsContact O-N 3.15Å; R70-Y73 PolarHBondContact O-N 3.02Å; R70-I74 WeakPolarHBondContact O-CG1 3.26Å; R70-I74 PolarHBondContact O-N 3.02Å; R70-L79 HydrophobicContact CB-CD1 4.17Å; R70-L79 HydrophobicContact CB-CD2 3.88Å; R70-L79 HydrophobicContact CG-CD2 3.63Å; R70-E83 IonicContact CZ-OE1 2.89Å; R70-E83 IonicContact NH1-OE1 3.93Å; R70-E83 PolarHBondContact NH1-OE1 3.45Å; R70-E83 IonicContact NH2-OE1 3.28Å; R70-E83 PolarHBondContact NH2-OE1 3.36Å; R70-E286 IonicContact CZ-OE1 3.69Å; R70-E286 VanDerWaalsContact CZ-OE1 3.29Å; R70-E286 IonicContact CZ-OE2 2.84Å; R70-E286 IonicContact NE-OE1 3.19Å; R70-E286 PolarHBondContact NE-OE1 3.48Å; R70-E286 IonicContact NE-OE2 2.64Å; R70-E286 VanDerWaalsContact NH2-CD 3.27Å; R70-E286 IonicContact NH2-OE1 3.95Å; R70-E286 PolarHBondContact NH2-OE1 3.24Å; R70-E286 VanDerWaalsContact NH2-OE1 3.11Å; R70-E286 IonicContact NH2-OE2 3.63Å; R70-E286 PolarHBondContact NH2-OE2 3.46Å
71	T	68.4	Low	75	Confident	112 Å²	112	90.7 Å²	90.7	69%	0.687	45%	0.451	S	S	*	.	H	α-helix	trans	-56.4	-32.8	179.2	55.1	0	0	0	0	113.4	L68 F69	L68-T71 PolarHBondContact O-N 3.06Å; L68-T71 PolarHBondContact O-OG1 3.22Å; F69-T71 PolarHBondContact O-N 3.38Å
72	K	63.1	Low	75	Confident	120 Å²	120	86 Å²	86	52%	0.522	42%	0.422	S	S	.	.	H	α-helix	trans	-81.7	-19.1	178.3	-169	179.2	-179.8	-172.1	0	113.2	F69 R70 R296	F69-K72 PolarHBondContact O-N 3.37Å; F69-K72 VanDerWaalsContact O-N 3.16Å; R70-K72 PolarHBondContact O-N 3.03Å; R70-K72 VanDerWaalsContact O-N 3.15Å; K72-R296 PolarHBondContact NZ-O 2.97Å
73	Y	62.5	Low	75.1	Confident	6 Å²	6	81.1 Å²	81.1	2%	0.024	40%	0.395	C	S	.	.	H	α-helix	trans	-103.1	-10.8	-171.5	-82.1	-90.4	0	0	0	114.7	F69 R70 E75 D76 V77 V290 S294 I297	F69-Y73 WeakPolarHBondContact O-CD2 3.49Å; R70-Y73 PolarHBondContact O-N 3.02Å; Y73-E75 PolarHBondContact O-N 3.15Å; Y73-D76 PolarHBondContact O-N 3.11Å; Y73-V77 HydrophobicContact CD1-CB 4.46Å; Y73-V77 HydrophobicContact CD1-CG2 3.78Å; Y73-V77 PolarHBondContact O-N 3.46Å; Y73-V290 HydrophobicContact CD1-CG1 3.73Å; Y73-V290 HydrophobicContact CE1-CG1 3.72Å; Y73-V290 HydrophobicContact CG-CG1 4.32Å; Y73-S294 WeakPolarHBondContact CE1-OG 3.47Å; Y73-S294 PolarHBondContact OH-OG 2.92Å; Y73-I297 HydrophobicContact CD1-CD1 4.26Å; Y73-I297 HydrophobicContact CD2-CD1 3.89Å; Y73-I297 HydrophobicContact CD2-CG1 4.07Å; Y73-I297 HydrophobicContact CE1-CD1 3.59Å; Y73-I297 HydrophobicContact CE1-CG1 4.24Å; Y73-I297 HydrophobicContact CE2-CB 4.43Å; Y73-I297 HydrophobicContact CE2-CD1 3.22Å; Y73-I297 HydrophobicContact CE2-CG1 3.1Å; Y73-I297 HydrophobicContact CG-CD1 4.41Å; Y73-I297 VanDerWaalsContact OH-CD1 3.25Å; Y73-I297 WeakPolarHBondContact OH-CD1 3.31Å; Y73-I297 WeakPolarHBondContact OH-CG1 2.97Å; Y73-I297 PolarHBondContact OH-N 3.07Å; Y73-I297 VanDerWaalsContact OH-N 3.07Å
74	I	58.2	Low	75.3	Confident	110 Å²	110	81.6 Å²	81.6	56%	0.564	39%	0.391	S	S	*	.	T	Hydrogen-bonded Turn	trans	-55.8	-27.8	-177.5	-69.7	155	0	0	0	111.8	R70 L79	R70-I74 WeakPolarHBondContact O-CG1 3.26Å; R70-I74 PolarHBondContact O-N 3.02Å; I74-L79 HydrophobicContact CG1-CD1 3.71Å; I74-L79 HydrophobicContact CG1-CG 4.46Å
75	E	62.6	Low	75.5	Confident	185 Å²	185	79.5 Å²	79.5	86%	0.864	39%	0.388	S	S	*	.	T	Hydrogen-bonded Turn	trans	-77.5	-37.6	177.3	-63.1	-180	-175.3	0	0	113.2	Y73	Y73-E75 PolarHBondContact O-N 3.15Å
76	D	64.2	Low	75.7	Confident	104 Å²	104	75.4 Å²	75.4	56%	0.556	37%	0.369	S	S	*	.	T	Hydrogen-bonded Turn	trans	-99.3	-25.8	-170.3	-73	-27.8	0	0	0	113.5	Y73	Y73-D76 PolarHBondContact O-N 3.11Å
77	V	67.7	Low	76.2	Confident	52 Å²	52	70.1 Å²	70.1	32%	0.315	35%	0.346	S	S	.	.	S	Bend	trans	-138.6	130	-171.2	-166.5	0	0	0	0	112.3	Y73 L79 I82	Y73-V77 HydrophobicContact CD1-CB 4.46Å; Y73-V77 HydrophobicContact CD1-CG2 3.78Å; Y73-V77 PolarHBondContact O-N 3.46Å; V77-L79 PolarHBondContact O-N 2.86Å; V77-L79 VanDerWaalsContact O-N 3.08Å; V77-I82 HydrophobicContact CB-CD1 4.31Å; V77-I82 HydrophobicContact CG1-CD1 3.52Å; V77-I82 HydrophobicContact CG1-CG1 3.78Å
78	D	76.5	Confident	76.6	Confident	83 Å²	83	68.8 Å²	68.8	44%	0.444	34%	0.342	S	S	.	.			trans	-69.5	103.8	174.3	178.3	5.7	0	0	0	111.3	R80 N81 I82	D78-R80 VanDerWaalsContact C-N 3.26Å; D78-R80 PolarHBondContact O-N 2.91Å; D78-R80 PolarHBondContact OD1-N 2.94Å; D78-N81 HydrophobicContact CB-CB 4.04Å; D78-N81 WeakPolarHBondContact O-CB 3.38Å; D78-N81 PolarHBondContact O-N 3.19Å; D78-N81 VanDerWaalsContact O-N 3.15Å; D78-N81 PolarHBondContact OD1-N 3.35Å; D78-N81 VanDerWaalsContact OD2-CG 3.26Å; D78-N81 PolarHBondContact OD2-ND2 3.41Å; D78-N81 VanDerWaalsContact OD2-ND2 3.07Å; D78-I82 PolarHBondContact O-N 3.4Å; D78-I82 VanDerWaalsContact O-N 3.1Å
79	L	75	Confident	77.6	Confident	40 Å²	40	63.3 Å²	63.3	21%	0.209	32%	0.315	C	S	.	.	H	α-helix	trans	-56.2	-37	179.1	-64.5	178.2	0	0	0	113.1	R70 I74 V77 N81 I82 E83	R70-L79 HydrophobicContact CB-CD1 4.17Å; R70-L79 HydrophobicContact CB-CD2 3.88Å; R70-L79 HydrophobicContact CG-CD2 3.63Å; I74-L79 HydrophobicContact CG1-CD1 3.71Å; I74-L79 HydrophobicContact CG1-CG 4.46Å; V77-L79 PolarHBondContact O-N 2.86Å; V77-L79 VanDerWaalsContact O-N 3.08Å; L79-N81 VanDerWaalsContact C-N 3.34Å; L79-I82 HydrophobicContact CD2-CD1 4.39Å; L79-I82 PolarHBondContact O-N 3.14Å; L79-E83 WeakPolarHBondContact O-CG 3.45Å; L79-E83 PolarHBondContact O-N 3.47Å
80	R	81	Confident	78.5	Confident	193 Å²	193	61.5 Å²	61.5	73%	0.728	31%	0.307	S	S	*	.	H	α-helix	trans	-69.1	-38.5	-179.1	-69.7	-177.8	-177.1	177.8	2.6	110.5	D78 E83 N84	D78-R80 VanDerWaalsContact C-N 3.26Å; D78-R80 PolarHBondContact O-N 2.91Å; D78-R80 PolarHBondContact OD1-N 2.94Å; R80-E83 PolarHBondContact O-N 3.41Å; R80-N84 WeakPolarHBondContact O-CB 3.17Å; R80-N84 PolarHBondContact O-N 2.98Å; R80-N84 PolarHBondContact O-ND2 3.12Å; R80-N84 VanDerWaalsContact O-ND2 3.12Å
81	N	85.3	Confident	79.3	Confident	100 Å²	100	61.2 Å²	61.2	54%	0.535	31%	0.308	S	S	.	.	H	α-helix	trans	-64.4	-39.8	174.1	-92.6	-19	0	0	0	112.1	D78 L79 N84 C85	D78-N81 HydrophobicContact CB-CB 4.04Å; D78-N81 WeakPolarHBondContact O-CB 3.38Å; D78-N81 PolarHBondContact O-N 3.19Å; D78-N81 VanDerWaalsContact O-N 3.15Å; D78-N81 PolarHBondContact OD1-N 3.35Å; D78-N81 VanDerWaalsContact OD2-CG 3.26Å; D78-N81 PolarHBondContact OD2-ND2 3.41Å; D78-N81 VanDerWaalsContact OD2-ND2 3.07Å; L79-N81 VanDerWaalsContact C-N 3.34Å; N81-N84 PolarHBondContact O-N 3.22Å; N81-C85 WeakPolarHBondContact O-CB 3.43Å; N81-C85 PolarHBondContact O-N 3.32Å; N81-C85 PolarHBondContact O-SG 3.11Å
82	I	84.6	Confident	80.2	Confident	10 Å²	10	60.4 Å²	60.4	5%	0.051	30%	0.295	C	S	.	.	H	α-helix	trans	-58.2	-55	174.1	-62.1	174.8	0	0	0	110.1	V77 D78 L79 N84 C85 L86 E286 V290	V77-I82 HydrophobicContact CB-CD1 4.31Å; V77-I82 HydrophobicContact CG1-CD1 3.52Å; V77-I82 HydrophobicContact CG1-CG1 3.78Å; D78-I82 PolarHBondContact O-N 3.4Å; D78-I82 VanDerWaalsContact O-N 3.1Å; L79-I82 HydrophobicContact CD2-CD1 4.39Å; L79-I82 PolarHBondContact O-N 3.14Å; I82-N84 VanDerWaalsContact C-N 3.3Å; I82-N84 PolarHBondContact O-N 2.88Å; I82-C85 CarbonylContact O-C 3.56Å; I82-C85 PolarHBondContact O-N 2.95Å; I82-C85 PolarHBondContact O-SG 3.3Å; I82-C85 VanDerWaalsContact O-SG 3.36Å; I82-L86 HydrophobicContact CG2-CD2 3.58Å; I82-L86 HydrophobicContact CG2-CG 4.17Å; I82-L86 WeakPolarHBondContact O-CG 3.43Å; I82-L86 PolarHBondContact O-N 3.17Å; I82-E286 HydrophobicContact CG2-CG 3.87Å; I82-V290 HydrophobicContact CD1-CG2 3.97Å
83	E	87.2	Confident	81.4	Confident	36 Å²	36	54.8 Å²	54.8	17%	0.168	27%	0.271	C	S	.	.	H	α-helix	trans	-55.8	-45.4	-178.6	-72.4	-177.6	163.3	0	0	112	F52 R70 L79 R80 C85	F52-E83 HydrophobicContact CD1-CB 4.35Å; F52-E83 HydrophobicContact CD1-CG 4Å; F52-E83 HydrophobicContact CD2-CB 3.72Å; F52-E83 HydrophobicContact CD2-CG 4.19Å; F52-E83 WeakPolarHBondContact CD2-O 3.46Å; F52-E83 HydrophobicContact CE1-CB 4.5Å; F52-E83 HydrophobicContact CE1-CG 3.92Å; F52-E83 HydrophobicContact CE2-CB 3.89Å; F52-E83 HydrophobicContact CE2-CG 4.12Å; F52-E83 WeakPolarHBondContact CE2-O 3.34Å; F52-E83 HydrophobicContact CG-CB 3.97Å; F52-E83 HydrophobicContact CG-CG 4.13Å; F52-E83 HydrophobicContact CZ-CB 4.29Å; F52-E83 HydrophobicContact CZ-CG 3.99Å; R70-E83 IonicContact CZ-OE1 2.89Å; R70-E83 IonicContact NH1-OE1 3.93Å; R70-E83 PolarHBondContact NH1-OE1 3.45Å; R70-E83 IonicContact NH2-OE1 3.28Å; R70-E83 PolarHBondContact NH2-OE1 3.36Å; L79-E83 WeakPolarHBondContact O-CG 3.45Å; L79-E83 PolarHBondContact O-N 3.47Å; R80-E83 PolarHBondContact O-N 3.41Å; E83-C85 VanDerWaalsContact C-N 3.3Å; E83-C85 PolarHBondContact O-N 3.17Å
84	N	88.5	Confident	82.6	Confident	52 Å²	52	57.6 Å²	57.6	28%	0.278	29%	0.285	S	S	.	.	H	α-helix	trans	-63.1	-37	177.2	-68.2	-24.8	0	0	0	111.8	R45 S49 R80 N81 I82	R45-N84 CarbonylContact C-O 3.57Å; R45-N84 WeakPolarHBondContact CA-O 3.26Å; S49-N84 WeakPolarHBondContact CA-OD1 3.37Å; S49-N84 WeakPolarHBondContact CB-OD1 3.42Å; S49-N84 PolarHBondContact OG-OD1 3.34Å; R80-N84 WeakPolarHBondContact O-CB 3.17Å; R80-N84 PolarHBondContact O-N 2.98Å; R80-N84 PolarHBondContact O-ND2 3.12Å; R80-N84 VanDerWaalsContact O-ND2 3.12Å; N81-N84 PolarHBondContact O-N 3.22Å; I82-N84 VanDerWaalsContact C-N 3.3Å; I82-N84 PolarHBondContact O-N 2.88Å
85	C	90.2	Very high	83.7	Confident	32 Å²	32	57.7 Å²	57.7	22%	0.216	29%	0.287	C	S	.	.	H	α-helix	trans	-94.3	-5.2	-174.9	76.1	0	0	0	0	115.4	R45 N81 I82 E83 V87 S88 A89	R45-C85 HydrophobicContact CG-CB 4.31Å; N81-C85 WeakPolarHBondContact O-CB 3.43Å; N81-C85 PolarHBondContact O-N 3.32Å; N81-C85 PolarHBondContact O-SG 3.11Å; I82-C85 CarbonylContact O-C 3.56Å; I82-C85 PolarHBondContact O-N 2.95Å; I82-C85 PolarHBondContact O-SG 3.3Å; I82-C85 VanDerWaalsContact O-SG 3.36Å; E83-C85 VanDerWaalsContact C-N 3.3Å; E83-C85 PolarHBondContact O-N 3.17Å; C85-V87 VanDerWaalsContact C-N 3.33Å; C85-V87 PolarHBondContact O-N 2.92Å; C85-S88 CarbonylContact O-C 3.55Å; C85-S88 WeakPolarHBondContact O-CA 3.36Å; C85-S88 WeakPolarHBondContact O-CB 3.48Å; C85-S88 PolarHBondContact O-N 2.92Å; C85-A89 WeakPolarHBondContact O-CB 3.3Å; C85-A89 PolarHBondContact O-N 3.4Å
86	L	91	Very high	84.3	Confident	0 Å²	0	50 Å²	50	0%	0	25%	0.251	C	S	.	.	H	α-helix	trans	-53.3	-44.7	-173.1	-78.1	-166.5	0	0	0	113.7	F52 I82 S88 A89 A90 F117 F285 E286	F52-L86 HydrophobicContact CE2-CB 4.4Å; F52-L86 HydrophobicContact CE2-CD1 3.6Å; F52-L86 HydrophobicContact CE2-CG 4.18Å; F52-L86 HydrophobicContact CZ-CD1 3.45Å; F52-L86 VanDerWaalsContact CZ-CD1 3.45Å; F52-L86 HydrophobicContact CZ-CG 4.43Å; I82-L86 HydrophobicContact CG2-CD2 3.58Å; I82-L86 HydrophobicContact CG2-CG 4.17Å; I82-L86 WeakPolarHBondContact O-CG 3.43Å; I82-L86 PolarHBondContact O-N 3.17Å; L86-S88 PolarHBondContact O-N 2.97Å; L86-A89 PolarHBondContact O-N 3.25Å; L86-A90 WeakPolarHBondContact O-CB 3.31Å; L86-A90 PolarHBondContact O-N 3.47Å; L86-F117 HydrophobicContact CB-CE1 4.4Å; L86-F117 HydrophobicContact CB-CZ 4.45Å; L86-F285 HydrophobicContact CB-CE1 4.38Å; L86-F285 HydrophobicContact CD2-CD1 4.08Å; L86-F285 HydrophobicContact CD2-CE1 3.87Å; L86-F285 WeakPolarHBondContact O-CE1 3.26Å; L86-E286 HydrophobicContact CD1-CB 4.19Å; L86-E286 HydrophobicContact CD2-CB 4.23Å; L86-E286 HydrophobicContact CD2-CG 4.3Å
87	V	93.4	Very high	84.6	Confident	7 Å²	7	49.3 Å²	49.3	4%	0.042	25%	0.247	C	C	.	.	H	α-helix	trans	-64.9	-41.2	178.5	176.5	0	0	0	0	111.2	R44 V47 C85 N91 F117 L118	R44-V87 HydrophobicContact CB-CG1 4.34Å; R44-V87 HydrophobicContact CG-CG1 4.46Å; V47-V87 HydrophobicContact CG1-CG1 4.45Å; V47-V87 HydrophobicContact CG1-CG2 4.42Å; C85-V87 VanDerWaalsContact C-N 3.33Å; C85-V87 PolarHBondContact O-N 2.92Å; V87-N91 PolarHBondContact O-N 3.31Å; V87-N91 PolarHBondContact O-ND2 3.43Å; V87-F117 HydrophobicContact CG2-CE1 4.09Å; V87-F117 HydrophobicContact CG2-CZ 4.02Å; V87-L118 HydrophobicContact CG1-CD2 4.43Å
88	S	91.9	Very high	84.4	Confident	4 Å²	4	50.5 Å²	50.5	3%	0.028	26%	0.258	C	S	.	.	H	α-helix	trans	-65	-42.8	174.8	-176.8	0	0	0	0	111.5	C85 L86 K92	C85-S88 CarbonylContact O-C 3.55Å; C85-S88 WeakPolarHBondContact O-CA 3.36Å; C85-S88 WeakPolarHBondContact O-CB 3.48Å; C85-S88 PolarHBondContact O-N 2.92Å; L86-S88 PolarHBondContact O-N 2.97Å; S88-K92 WeakPolarHBondContact O-CG 3.17Å; S88-K92 PolarHBondContact O-N 2.94Å; S88-K92 VanDerWaalsContact O-N 3.11Å
89	A	90.4	Very high	83.5	Confident	9 Å²	9	52.1 Å²	52.1	7%	0.074	28%	0.276	C	S	.	.	H	α-helix	trans	-65	-45.7	178.8	0	0	0	0	0	111.7	C85 L86 N91 K92 V93 F285 F289	C85-A89 WeakPolarHBondContact O-CB 3.3Å; C85-A89 PolarHBondContact O-N 3.4Å; L86-A89 PolarHBondContact O-N 3.25Å; A89-N91 VanDerWaalsContact C-N 3.34Å; A89-N91 PolarHBondContact O-N 2.99Å; A89-K92 WeakPolarHBondContact O-CB 3.49Å; A89-K92 PolarHBondContact O-N 3.32Å; A89-K92 VanDerWaalsContact O-N 3.11Å; A89-V93 VanDerWaalsContact O-CG2 3.26Å; A89-V93 WeakPolarHBondContact O-CG2 3.49Å; A89-V93 PolarHBondContact O-N 3.34Å; A89-F285 HydrophobicContact CB-CE1 4.41Å; A89-F285 HydrophobicContact CB-CZ 4.21Å; A89-F289 HydrophobicContact CB-CD2 4.49Å; A89-F289 HydrophobicContact CB-CE1 4.38Å; A89-F289 HydrophobicContact CB-CE2 4.05Å; A89-F289 HydrophobicContact CB-CZ 3.99Å
90	A	92.6	Very high	82.5	Confident	0 Å²	0	57.2 Å²	57.2	0%	0	30%	0.298	C	S	.	.	H	α-helix	trans	-58.8	-45.1	178.4	0	0	0	0	0	111.7	L86 K92 V93 I94 A114 F117 L118 F285	L86-A90 WeakPolarHBondContact O-CB 3.31Å; L86-A90 PolarHBondContact O-N 3.47Å; A90-K92 VanDerWaalsContact C-N 3.34Å; A90-K92 PolarHBondContact O-N 3.05Å; A90-V93 PolarHBondContact O-N 3.48Å; A90-I94 WeakPolarHBondContact O-CG1 3.32Å; A90-I94 PolarHBondContact O-N 3.44Å; A90-A114 HydrophobicContact CB-CB 4.15Å; A90-F117 HydrophobicContact CB-CD1 3.82Å; A90-F117 HydrophobicContact CB-CE1 4.19Å; A90-L118 HydrophobicContact CB-CD1 4.19Å; A90-L118 HydrophobicContact CB-CD2 3.83Å; A90-L118 HydrophobicContact CB-CG 3.86Å; A90-F285 VanDerWaalsContact CA-CZ 3.44Å; A90-F285 HydrophobicContact CB-CD1 4.26Å; A90-F285 HydrophobicContact CB-CE1 3.67Å; A90-F285 HydrophobicContact CB-CE2 4.31Å; A90-F285 HydrophobicContact CB-CZ 3.71Å
91	N	90.9	Very high	81	Confident	30 Å²	30	49.7 Å²	49.7	16%	0.16	28%	0.275	C	S	.	.	H	α-helix	trans	-60.7	-41.5	174.8	-83	-76.9	0	0	0	112.5	V87 A89 I94 N95	V87-N91 PolarHBondContact O-N 3.31Å; V87-N91 PolarHBondContact O-ND2 3.43Å; A89-N91 VanDerWaalsContact C-N 3.34Å; A89-N91 PolarHBondContact O-N 2.99Å; N91-I94 PolarHBondContact O-N 3.26Å; N91-N95 PolarHBondContact O-N 3.02Å
92	K	88.1	Confident	79.4	Confident	96 Å²	96	54.4 Å²	54.4	42%	0.417	29%	0.294	S	S	.	.	H	α-helix	trans	-64.8	-38.7	175	-72.2	-175.5	-174.9	-161.6	0	112.4	E41 S88 A89 A90 N95 F96	E41-K92 WeakPolarHBondContact OE1-CE 3.42Å; E41-K92 IonicContact OE1-NZ 3.05Å; E41-K92 PolarHBondContact OE1-NZ 2.89Å; E41-K92 WeakPolarHBondContact OE2-CE 3.01Å; E41-K92 IonicContact OE2-NZ 3.03Å; E41-K92 PolarHBondContact OE2-NZ 3.02Å; S88-K92 WeakPolarHBondContact O-CG 3.17Å; S88-K92 PolarHBondContact O-N 2.94Å; S88-K92 VanDerWaalsContact O-N 3.11Å; A89-K92 WeakPolarHBondContact O-CB 3.49Å; A89-K92 PolarHBondContact O-N 3.32Å; A89-K92 VanDerWaalsContact O-N 3.11Å; A90-K92 VanDerWaalsContact C-N 3.34Å; A90-K92 PolarHBondContact O-N 3.05Å; K92-N95 PolarHBondContact O-N 3.31Å; K92-F96 WeakPolarHBondContact O-CB 3.4Å; K92-F96 PolarHBondContact O-N 3.29Å
93	V	87.5	Confident	77.9	Confident	1 Å²	1	58.4 Å²	58.4	1%	0.006	32%	0.318	C	S	.	.	H	α-helix	trans	-65.3	-41.6	178.8	169.5	0	0	0	0	111	A89 A90 F96 L107 A110 K111 A114 F285 F289	A89-V93 VanDerWaalsContact O-CG2 3.26Å; A89-V93 WeakPolarHBondContact O-CG2 3.49Å; A89-V93 PolarHBondContact O-N 3.34Å; A90-V93 PolarHBondContact O-N 3.48Å; V93-F96 WeakPolarHBondContact O-CB 3.46Å; V93-F96 PolarHBondContact O-N 3.5Å; V93-L107 HydrophobicContact CG2-CB 4.36Å; V93-L107 HydrophobicContact CG2-CD1 4.13Å; V93-A110 HydrophobicContact CG1-CB 4Å; V93-K111 HydrophobicContact CG1-CB 4.45Å; V93-K111 HydrophobicContact CG1-CG 3.89Å; V93-K111 WeakPolarHBondContact O-CE 3.28Å; V93-K111 WeakPolarHBondContact O-CG 3.37Å; V93-A114 HydrophobicContact CB-CB 4.15Å; V93-A114 HydrophobicContact CG1-CB 3.85Å; V93-F285 HydrophobicContact CG2-CE2 4.23Å; V93-F285 HydrophobicContact CG2-CZ 4.36Å; V93-F289 HydrophobicContact CG2-CD2 4.01Å; V93-F289 HydrophobicContact CG2-CE2 4.24Å
94	I	87.2	Confident	76.3	Confident	65 Å²	65	64.8 Å²	64.8	33%	0.333	35%	0.348	S	S	.	.	H	α-helix	trans	-64.9	-45	177.8	-68.1	174.5	0	0	0	111	A90 N91 F96 A114 L118	A90-I94 WeakPolarHBondContact O-CG1 3.32Å; A90-I94 PolarHBondContact O-N 3.44Å; N91-I94 PolarHBondContact O-N 3.26Å; I94-F96 PolarHBondContact O-N 3.31Å; I94-A114 HydrophobicContact CG1-CB 4.08Å; I94-L118 HydrophobicContact CD1-CD1 3.37Å; I94-L118 HydrophobicContact CD1-CG 4.24Å
95	N	82.9	Confident	75.3	Confident	112 Å²	112	63.8 Å²	63.8	60%	0.599	35%	0.345	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-1.2	178.3	-65.9	-14.8	0	0	0	113.5	N91 K92 N97	N91-N95 PolarHBondContact O-N 3.02Å; K92-N95 PolarHBondContact O-N 3.31Å; N95-N97 PolarHBondContact O-N 2.9Å
96	F	74.6	Confident	74.4	Confident	24 Å²	24	66.6 Å²	66.6	11%	0.105	36%	0.358	C	S	.	.			trans	-67.7	117.7	-177.7	-179.4	-101.9	0	0	0	110.9	K92 V93 I94 S101 L107 K111	K92-F96 WeakPolarHBondContact O-CB 3.4Å; K92-F96 PolarHBondContact O-N 3.29Å; V93-F96 WeakPolarHBondContact O-CB 3.46Å; V93-F96 PolarHBondContact O-N 3.5Å; I94-F96 PolarHBondContact O-N 3.31Å; F96-S101 WeakPolarHBondContact CE2-OG 3.39Å; F96-S101 WeakPolarHBondContact CZ-OG 3.25Å; F96-L107 HydrophobicContact CD1-CB 3.98Å; F96-L107 HydrophobicContact CD2-CB 4.39Å; F96-L107 HydrophobicContact CD2-CD1 3.96Å; F96-L107 HydrophobicContact CD2-CG 4.39Å; F96-L107 HydrophobicContact CE1-CB 4.21Å; F96-L107 HydrophobicContact CE2-CD1 4.26Å; F96-L107 HydrophobicContact CE2-CG 4.38Å; F96-L107 HydrophobicContact CG-CB 4.07Å; F96-L107 HydrophobicContact CG-CD1 4.32Å; F96-K111 WeakPolarHBondContact O-CE 3.49Å; F96-K111 PolarHBondContact O-NZ 3.02Å
97	N	70.2	Confident	74	Confident	90 Å²	90	67.9 Å²	67.9	48%	0.481	37%	0.365	S	S	.	.			trans	-107.4	116.1	170.7	-74.7	-29.7	0	0	0	109.7	N95 S99 Q100	N95-N97 PolarHBondContact O-N 2.9Å; N97-S99 PolarHBondContact O-N 3.29Å; N97-Q100 PolarHBondContact O-N 3.43Å
98	S	62.6	Low	73.5	Confident	77 Å²	77	68.8 Å²	68.8	54%	0.538	38%	0.375	S	S	.	.	T	Hydrogen-bonded Turn	trans	-58	-22.5	-179.3	-46.7	0	0	0	0	113.1
99	S	58.3	Low	73.1	Confident	117 Å²	117	72.7 Å²	72.7	82%	0.818	40%	0.401	S	S	*	.	T	Hydrogen-bonded Turn	trans	-72.1	-23.5	176.9	50.2	0	0	0	0	114.3	N97	N97-S99 PolarHBondContact O-N 3.29Å
100	Q	53.6	Low	73.1	Confident	147 Å²	147	72.3 Å²	72.3	69%	0.687	40%	0.397	S	S	*	.	T	Hydrogen-bonded Turn	trans	-103.7	-14.9	-170.6	-162.4	165.1	2.5	0	0	113.1	N97	N97-Q100 PolarHBondContact O-N 3.43Å
101	S	51	Low	73	Confident	35 Å²	35	75.4 Å²	75.4	25%	0.245	41%	0.411	C	S	.	.			trans	-103.7	120.4	-177.3	66.6	0	0	0	0	112.2	F96 V103	F96-S101 WeakPolarHBondContact CE2-OG 3.39Å; F96-S101 WeakPolarHBondContact CZ-OG 3.25Å; S101-V103 PolarHBondContact O-N 3.36Å
102	H	50.2	Low	73.1	Confident	198 Å²	198	78.6 Å²	78.6	92%	0.917	44%	0.435	S	S	*	.			trans	-75.8	26.6	162.7	-162.8	-73.9	0	0	0	111.6
103	V	53.5	Low	73.4	Confident	94 Å²	94	74.3 Å²	74.3	57%	0.57	42%	0.417	S	S	*	.			trans	-84.5	132.8	-174.3	177.6	0	0	0	0	109.2	S101 C105	S101-V103 PolarHBondContact O-N 3.36Å; V103-C105 HydrophobicContact CG1-CB 4.33Å; V103-C105 PolarHBondContact O-N 2.93Å
104	E	54.2	Low	73.7	Confident	170 Å²	170	74.3 Å²	74.3	79%	0.794	42%	0.417	S	S	*	.	S	Bend	trans	-65.5	-6.1	-178	-62.4	-176.7	166.4	0	0	114.8	R295	E104-R295 PolarHBondContact O-NH2 3.38Å; E104-R295 VanDerWaalsContact O-NH2 3.14Å
105	C	66.2	Low	74.1	Confident	31 Å²	31	73.5 Å²	73.5	21%	0.209	42%	0.418	C	S	.	.	S	Bend	trans	-124.5	118.6	-173.8	-65.5	0	0	0	0	110.9	V103 L107	V103-C105 HydrophobicContact CG1-CB 4.33Å; V103-C105 PolarHBondContact O-N 2.93Å; C105-L107 PolarHBondContact O-N 2.98Å
106	D	73.4	Confident	74.7	Confident	91 Å²	91	71.6 Å²	71.6	49%	0.487	41%	0.405	S	S	.	.			trans	-75.8	117	171.5	-175	17.8	0	0	0	110.2	G108 P109 C292	D106-G108 VanDerWaalsContact C-N 3.3Å; D106-G108 PolarHBondContact OD1-N 3.04Å; D106-P109 WeakPolarHBondContact O-CD 3.48Å; D106-C292 PolarHBondContact O-SG 2.98Å; D106-C292 VanDerWaalsContact O-SG 3.38Å
107	L	82	Confident	75.8	Confident	28 Å²	28	70.5 Å²	70.5	15%	0.147	40%	0.4	C	S	.	.			trans	-86.6	-3.2	174.8	-59.2	-179.9	0	0	0	112.3	V93 F96 C105 P109 A110 C292	V93-L107 HydrophobicContact CG2-CB 4.36Å; V93-L107 HydrophobicContact CG2-CD1 4.13Å; F96-L107 HydrophobicContact CD1-CB 3.98Å; F96-L107 HydrophobicContact CD2-CB 4.39Å; F96-L107 HydrophobicContact CD2-CD1 3.96Å; F96-L107 HydrophobicContact CD2-CG 4.39Å; F96-L107 HydrophobicContact CE1-CB 4.21Å; F96-L107 HydrophobicContact CE2-CD1 4.26Å; F96-L107 HydrophobicContact CE2-CG 4.38Å; F96-L107 HydrophobicContact CG-CB 4.07Å; F96-L107 HydrophobicContact CG-CD1 4.32Å; C105-L107 PolarHBondContact O-N 2.98Å; L107-P109 VanDerWaalsContact C-CD 3.44Å; L107-P109 VanDerWaalsContact C-N 3.34Å; L107-A110 PolarHBondContact O-N 3.3Å; L107-C292 HydrophobicContact CD2-CB 3.82Å
108	G	82.4	Confident	77	Confident	25 Å²	25	67.7 Å²	67.7	26%	0.258	39%	0.385	S	S	.	.	G	3₁₀ helix	trans	-46.6	-46.8	177.1	0	0	0	0	0	114.7	D106 A110 K111	D106-G108 VanDerWaalsContact C-N 3.3Å; D106-G108 PolarHBondContact OD1-N 3.04Å; G108-A110 PolarHBondContact O-N 3.27Å; G108-K111 WeakPolarHBondContact O-CB 3.44Å; G108-K111 WeakPolarHBondContact O-CG 3.4Å; G108-K111 PolarHBondContact O-N 3.41Å; G108-K111 VanDerWaalsContact O-N 3.11Å
109	P	84.2	Confident	78.6	Confident	87 Å²	87	68.9 Å²	68.9	57%	0.565	39%	0.385	S	S	*	.	G	3₁₀ helix	trans	-59.6	-31.5	179.3	-25.7	35.1	0	0	0	114.2	D106 L107 K111	D106-P109 WeakPolarHBondContact O-CD 3.48Å; L107-P109 VanDerWaalsContact C-CD 3.44Å; L107-P109 VanDerWaalsContact C-N 3.34Å; P109-K111 VanDerWaalsContact C-N 3.34Å
110	A	89.5	Confident	80.4	Confident	0 Å²	0	63.4 Å²	63.4	0%	0	35%	0.347	C	S	.	.	G	3₁₀ helix	trans	-80.3	-12.4	-179.6	0	0	0	0	0	113.2	V93 L107 G108 S112 S113 A114 F285 D288	V93-A110 HydrophobicContact CG1-CB 4Å; L107-A110 PolarHBondContact O-N 3.3Å; G108-A110 PolarHBondContact O-N 3.27Å; A110-S112 PolarHBondContact O-N 3Å; A110-S113 PolarHBondContact O-N 2.94Å; A110-S113 PolarHBondContact O-OG 3.28Å; A110-A114 WeakPolarHBondContact O-CB 3.46Å; A110-A114 PolarHBondContact O-N 3.32Å; A110-F285 HydrophobicContact CB-CE2 4.45Å; A110-D288 HydrophobicContact CB-CB 4.17Å
111	K	91.3	Very high	82.5	Confident	66 Å²	66	56.7 Å²	56.7	29%	0.287	32%	0.316	S	S	.	.	H	α-helix	trans	-57.4	-43.1	-175.2	-73.3	-174.3	173.9	-169.4	0	114.1	V93 F96 G108 P109 A114 S115	V93-K111 HydrophobicContact CG1-CB 4.45Å; V93-K111 HydrophobicContact CG1-CG 3.89Å; V93-K111 WeakPolarHBondContact O-CE 3.28Å; V93-K111 WeakPolarHBondContact O-CG 3.37Å; F96-K111 WeakPolarHBondContact O-CE 3.49Å; F96-K111 PolarHBondContact O-NZ 3.02Å; G108-K111 WeakPolarHBondContact O-CB 3.44Å; G108-K111 WeakPolarHBondContact O-CG 3.4Å; G108-K111 PolarHBondContact O-N 3.41Å; G108-K111 VanDerWaalsContact O-N 3.11Å; P109-K111 VanDerWaalsContact C-N 3.34Å; K111-A114 PolarHBondContact O-N 2.98Å; K111-S115 PolarHBondContact O-N 3.45Å
112	S	93	Very high	84.6	Confident	96 Å²	96	56.4 Å²	56.4	67%	0.671	32%	0.318	S	S	*	.	H	α-helix	trans	-62.7	-47.9	179.6	-170.9	0	0	0	0	111.1	A110 A114 S115 E116	A110-S112 PolarHBondContact O-N 3Å; S112-A114 VanDerWaalsContact C-N 3.33Å; S112-A114 PolarHBondContact O-N 3Å; S112-S115 PolarHBondContact O-N 3.49Å; S112-E116 PolarHBondContact O-N 3.09Å; S112-E116 VanDerWaalsContact O-N 3.08Å
113	S	93.9	Very high	86.8	Confident	7 Å²	7	52.1 Å²	52.1	5%	0.049	29%	0.294	C	S	.	.	H	α-helix	trans	-66.8	-33.8	178.3	69.3	0	0	0	0	112.6	A110 F117 D288	A110-S113 PolarHBondContact O-N 2.94Å; A110-S113 PolarHBondContact O-OG 3.28Å; S113-F117 VanDerWaalsContact O-CB 3.27Å; S113-F117 WeakPolarHBondContact O-CB 3.45Å; S113-F117 PolarHBondContact O-N 2.98Å; S113-D288 WeakPolarHBondContact CB-OD2 3.31Å; S113-D288 PolarHBondContact OG-OD2 3.29Å
114	A	94.4	Very high	88.9	Confident	0 Å²	0	47.7 Å²	47.7	0%	0	27%	0.267	C	S	.	.	H	α-helix	trans	-66.2	-43.5	175.8	0	0	0	0	0	111.7	A90 V93 I94 A110 K111 S112 F117 L118 F285	A90-A114 HydrophobicContact CB-CB 4.15Å; V93-A114 HydrophobicContact CB-CB 4.15Å; V93-A114 HydrophobicContact CG1-CB 3.85Å; I94-A114 HydrophobicContact CG1-CB 4.08Å; A110-A114 WeakPolarHBondContact O-CB 3.46Å; A110-A114 PolarHBondContact O-N 3.32Å; K111-A114 PolarHBondContact O-N 2.98Å; S112-A114 VanDerWaalsContact C-N 3.33Å; S112-A114 PolarHBondContact O-N 3Å; A114-F117 PolarHBondContact O-N 3Å; A114-L118 WeakPolarHBondContact O-CG 3.49Å; A114-L118 PolarHBondContact O-N 3.06Å; A114-F285 HydrophobicContact CB-CD2 3.73Å; A114-F285 HydrophobicContact CB-CE2 3.6Å; A114-F285 HydrophobicContact CB-CZ 4.42Å
115	S	95	Very high	90.8	Very high	49 Å²	49	41.6 Å²	41.6	34%	0.343	24%	0.239	S	C	.	.	H	α-helix	trans	-62	-52.1	175.5	-166.9	0	0	0	0	110.9	K111 S112 F117 L118 D119	K111-S115 PolarHBondContact O-N 3.45Å; S112-S115 PolarHBondContact O-N 3.49Å; S115-F117 VanDerWaalsContact C-N 3.27Å; S115-F117 PolarHBondContact O-N 3.32Å; S115-L118 PolarHBondContact O-N 2.9Å; S115-L118 VanDerWaalsContact O-N 3.13Å; S115-D119 WeakPolarHBondContact O-CB 3.49Å; S115-D119 PolarHBondContact O-N 3.18Å; S115-D119 PolarHBondContact OG-OD2 3.41Å
116	E	96	Very high	92.2	Very high	72 Å²	72	43.1 Å²	43.1	34%	0.336	25%	0.253	S	S	.	.	H	α-helix	trans	-56.1	-43.8	178.3	-171.8	-174.1	175.5	0	0	111.1	S112 D119 T120 R284	S112-E116 PolarHBondContact O-N 3.09Å; S112-E116 VanDerWaalsContact O-N 3.08Å; E116-D119 PolarHBondContact O-N 2.75Å; E116-T120 PolarHBondContact O-N 3.12Å; E116-T120 PolarHBondContact O-OG1 2.86Å; E116-R284 IonicContact OE1-NH1 2.75Å; E116-R284 PolarHBondContact OE1-NH1 3.48Å
117	F	97	Very high	93.2	Very high	1 Å²	1	39.9 Å²	39.9	0%	0.004	24%	0.236	C	C	.	.	H	α-helix	trans	-61.7	-46.8	176.1	170	-113.2	0	0	0	113.1	L86 V87 A90 S113 A114 S115 H121 L278 C281 A282 F285	L86-F117 HydrophobicContact CB-CE1 4.4Å; L86-F117 HydrophobicContact CB-CZ 4.45Å; V87-F117 HydrophobicContact CG2-CE1 4.09Å; V87-F117 HydrophobicContact CG2-CZ 4.02Å; A90-F117 HydrophobicContact CB-CD1 3.82Å; A90-F117 HydrophobicContact CB-CE1 4.19Å; S113-F117 VanDerWaalsContact O-CB 3.27Å; S113-F117 WeakPolarHBondContact O-CB 3.45Å; S113-F117 PolarHBondContact O-N 2.98Å; A114-F117 PolarHBondContact O-N 3Å; S115-F117 VanDerWaalsContact C-N 3.27Å; S115-F117 PolarHBondContact O-N 3.32Å; F117-H121 VanDerWaalsContact O-CB 3.22Å; F117-H121 WeakPolarHBondContact O-CB 3.41Å; F117-H121 PolarHBondContact O-N 2.85Å; F117-L278 HydrophobicContact CD2-CD1 3.83Å; F117-L278 HydrophobicContact CE2-CD1 3.63Å; F117-C281 HydrophobicContact CB-CB 4.34Å; F117-C281 HydrophobicContact CD2-CB 4.46Å; F117-A282 HydrophobicContact CD2-CB 3.87Å; F117-A282 HydrophobicContact CE2-CB 3.63Å; F117-F285 HydrophobicContact CB-CB 4Å; F117-F285 HydrophobicContact CB-CG 4.42Å; F117-F285 AromaticContact CD1-CD1 3.92Å; F117-F285 HydrophobicContact CD1-CD1 3.92Å; F117-F285 HydrophobicContact CD1-CG 4.44Å; F117-F285 HydrophobicContact CE1-CD1 4.38Å; F117-F285 HydrophobicContact CG-CB 4.36Å; F117-F285 HydrophobicContact CG-CD1 4.36Å
118	L	95.9	Very high	93.7	Very high	30 Å²	30	38.7 Å²	38.7	16%	0.157	23%	0.23	C	C	.	.	H	α-helix	trans	-68.7	-35.7	179	-70.1	-172.3	0	0	0	112.5	V87 A90 I94 A114 S115 H121 G122	V87-L118 HydrophobicContact CG1-CD2 4.43Å; A90-L118 HydrophobicContact CB-CD1 4.19Å; A90-L118 HydrophobicContact CB-CD2 3.83Å; A90-L118 HydrophobicContact CB-CG 3.86Å; I94-L118 HydrophobicContact CD1-CD1 3.37Å; I94-L118 HydrophobicContact CD1-CG 4.24Å; A114-L118 WeakPolarHBondContact O-CG 3.49Å; A114-L118 PolarHBondContact O-N 3.06Å; S115-L118 PolarHBondContact O-N 2.9Å; S115-L118 VanDerWaalsContact O-N 3.13Å; L118-H121 PolarHBondContact O-N 3.42Å; L118-G122 PolarHBondContact O-N 2.88Å
119	D	96.4	Very high	94.1	Very high	102 Å²	102	38.5 Å²	38.5	55%	0.545	23%	0.226	S	C	.	.	H	α-helix	trans	-64.6	-46.6	176.8	-68	-28.6	0	0	0	110.8	S115 E116 H121 G122 R123	S115-D119 WeakPolarHBondContact O-CB 3.49Å; S115-D119 PolarHBondContact O-N 3.18Å; S115-D119 PolarHBondContact OG-OD2 3.41Å; E116-D119 PolarHBondContact O-N 2.75Å; D119-H121 VanDerWaalsContact C-N 3.33Å; D119-H121 PolarHBondContact O-N 2.81Å; D119-G122 PolarHBondContact O-N 2.98Å; D119-R123 PolarHBondContact O-N 3.08Å
120	T	96.4	Very high	94.5	Very high	3 Å²	3	40.1 Å²	40.1	2%	0.018	23%	0.225	C	C	.	.	H	α-helix	trans	-65.7	-37	174.2	-50.2	0	0	0	0	111.4	E116 R123 V124 T274 E277 L278	E116-T120 PolarHBondContact O-N 3.12Å; E116-T120 PolarHBondContact O-OG1 2.86Å; T120-R123 WeakPolarHBondContact O-CB 3.37Å; T120-R123 PolarHBondContact O-N 2.99Å; T120-V124 PolarHBondContact O-N 3.46Å; T120-T274 HydrophobicContact CG2-CG2 4.27Å; T120-E277 HydrophobicContact CG2-CB 4.07Å; T120-E277 HydrophobicContact CG2-CG 3.94Å; T120-L278 HydrophobicContact CG2-CB 3.93Å; T120-L278 HydrophobicContact CG2-CD1 4.3Å
121	H	96.5	Very high	94.5	Very high	6 Å²	6	41.2 Å²	41.2	3%	0.028	23%	0.232	C	C	.	.	H	α-helix	trans	-63	-45.2	176	-174.1	-91.2	0	0	0	111.7	F9 V47 T51 F117 L118 D119 R123 V124 Q125 L278	F9-H121 AromaticContact CE2-NE2 3.96Å; V47-H121 VanDerWaalsContact CG1-CE1 3.48Å; V47-H121 WeakPolarHBondContact CG1-CE1 3.33Å; T51-H121 PolarHBondContact OG1-NE2 3.46Å; F117-H121 VanDerWaalsContact O-CB 3.22Å; F117-H121 WeakPolarHBondContact O-CB 3.41Å; F117-H121 PolarHBondContact O-N 2.85Å; L118-H121 PolarHBondContact O-N 3.42Å; D119-H121 VanDerWaalsContact C-N 3.33Å; D119-H121 PolarHBondContact O-N 2.81Å; H121-R123 VanDerWaalsContact C-N 3.32Å; H121-R123 PolarHBondContact O-N 3.21Å; H121-V124 WeakPolarHBondContact O-CB 3.31Å; H121-V124 PolarHBondContact O-N 3.39Å; H121-V124 VanDerWaalsContact O-N 3.09Å; H121-Q125 PolarHBondContact CE1-NE2 3.46Å; H121-Q125 VanDerWaalsContact CE1-NE2 3.31Å; H121-Q125 WeakPolarHBondContact O-CG 3.42Å; H121-Q125 PolarHBondContact O-N 2.76Å; H121-L278 HydrophobicContact CB-CD1 3.92Å
122	G	95.6	Very high	94.4	Very high	29 Å²	29	38.1 Å²	38.1	30%	0.299	22%	0.219	S	C	.	.	H	α-helix	trans	-61	-38.1	174.9	0	0	0	0	0	112.8	L118 D119 Q125 A126	L118-G122 PolarHBondContact O-N 2.88Å; D119-G122 PolarHBondContact O-N 2.98Å; G122-Q125 WeakPolarHBondContact O-CB 3.28Å; G122-Q125 PolarHBondContact O-N 3.26Å; G122-A126 PolarHBondContact O-N 3.37Å
123	R	96.8	Very high	94.2	Very high	108 Å²	108	38.2 Å²	38.2	41%	0.408	21%	0.209	S	C	.	.	H	α-helix	trans	-61.1	-43.2	171.3	-77.1	170	50.1	-150.3	-8.3	112.4	D119 T120 H121 Q125 A126 L127 T274 E277	D119-R123 PolarHBondContact O-N 3.08Å; T120-R123 WeakPolarHBondContact O-CB 3.37Å; T120-R123 PolarHBondContact O-N 2.99Å; H121-R123 VanDerWaalsContact C-N 3.32Å; H121-R123 PolarHBondContact O-N 3.21Å; R123-Q125 VanDerWaalsContact C-N 3.34Å; R123-A126 PolarHBondContact O-N 3.05Å; R123-L127 WeakPolarHBondContact O-CG 3.45Å; R123-L127 PolarHBondContact O-N 3.27Å; R123-T274 HydrophobicContact CB-CG2 4.06Å; R123-T274 PolarHBondContact NH2-OG1 3.16Å; R123-E277 IonicContact CZ-OE1 3.84Å; R123-E277 IonicContact CZ-OE2 3.29Å; R123-E277 VanDerWaalsContact CZ-OE2 3.29Å; R123-E277 IonicContact NH1-OE1 2.77Å; R123-E277 PolarHBondContact NH1-OE1 3.29Å; R123-E277 IonicContact NH1-OE2 2.93Å; R123-E277 PolarHBondContact NH1-OE2 3.23Å; R123-E277 IonicContact NH2-OE2 2.76Å; R123-E277 PolarHBondContact NH2-OE2 3.03Å
124	V	95.9	Very high	93.9	Very high	0 Å²	0	40.9 Å²	40.9	0%	0	23%	0.227	C	C	.	.	H	α-helix	trans	-62.3	-43	174.9	173.1	0	0	0	0	111	F9 L54 T120 H121 A126 L127 V128 L271 T274 L275 L278	F9-V124 HydrophobicContact CE1-CG1 4.07Å; F9-V124 HydrophobicContact CZ-CG1 3.97Å; L54-V124 HydrophobicContact CD2-CG1 4.38Å; T120-V124 PolarHBondContact O-N 3.46Å; H121-V124 WeakPolarHBondContact O-CB 3.31Å; H121-V124 PolarHBondContact O-N 3.39Å; H121-V124 VanDerWaalsContact O-N 3.09Å; V124-A126 VanDerWaalsContact C-N 3.34Å; V124-A126 PolarHBondContact O-N 3.4Å; V124-L127 PolarHBondContact O-N 2.9Å; V124-V128 HydrophobicContact CG1-CG2 4.19Å; V124-V128 VanDerWaalsContact O-CG2 3.32Å; V124-V128 WeakPolarHBondContact O-CG2 3.49Å; V124-V128 PolarHBondContact O-N 3.47Å; V124-L271 HydrophobicContact CG1-CD1 4.12Å; V124-T274 HydrophobicContact CG2-CG2 3.54Å; V124-L275 HydrophobicContact CG1-CD2 3.85Å; V124-L275 HydrophobicContact CG2-CD2 4.23Å; V124-L278 HydrophobicContact CB-CD2 4.29Å; V124-L278 HydrophobicContact CG1-CD2 4.43Å; V124-L278 HydrophobicContact CG2-CB 4.2Å; V124-L278 HydrophobicContact CG2-CD2 3.83Å
125	Q	95.3	Very high	93.5	Very high	43 Å²	43	41.6 Å²	41.6	20%	0.201	23%	0.232	C	C	.	.	H	α-helix	trans	-56.9	-47	175.3	-69.5	177.9	-37.1	0	0	112.1	F9 T13 H121 G122 R123 V128 A129	F9-Q125 HydrophobicContact CE1-CG 4.03Å; F9-Q125 HydrophobicContact CZ-CG 3.79Å; T13-Q125 HydrophobicContact CG2-CB 4.07Å; T13-Q125 HydrophobicContact CG2-CG 3.81Å; T13-Q125 VanDerWaalsContact CG2-NE2 3.35Å; T13-Q125 PolarHBondContact OG1-NE2 3.4Å; H121-Q125 PolarHBondContact CE1-NE2 3.46Å; H121-Q125 VanDerWaalsContact CE1-NE2 3.31Å; H121-Q125 WeakPolarHBondContact O-CG 3.42Å; H121-Q125 PolarHBondContact O-N 2.76Å; G122-Q125 WeakPolarHBondContact O-CB 3.28Å; G122-Q125 PolarHBondContact O-N 3.26Å; R123-Q125 VanDerWaalsContact C-N 3.34Å; Q125-V128 PolarHBondContact O-N 2.82Å; Q125-A129 WeakPolarHBondContact O-CB 3.4Å; Q125-A129 PolarHBondContact O-N 3.19Å
126	A	94.7	Very high	93.1	Very high	62 Å²	62	40.4 Å²	40.4	51%	0.512	22%	0.222	S	C	.	.	H	α-helix	trans	-62.8	-44.3	177.7	0	0	0	0	0	112.5	G122 R123 V124 A129 H130	G122-A126 PolarHBondContact O-N 3.37Å; R123-A126 PolarHBondContact O-N 3.05Å; V124-A126 VanDerWaalsContact C-N 3.34Å; V124-A126 PolarHBondContact O-N 3.4Å; A126-A129 PolarHBondContact O-N 3.03Å; A126-H130 WeakPolarHBondContact O-CB 3.4Å; A126-H130 PolarHBondContact O-N 3.14Å
127	L	94.2	Very high	92.6	Very high	24 Å²	24	42.3 Å²	42.3	13%	0.126	23%	0.234	C	C	.	.	H	α-helix	trans	-66.5	-39.1	179.3	-72.4	173.8	0	0	0	112.6	R123 V124 T131 E270 L271 T274	R123-L127 WeakPolarHBondContact O-CG 3.45Å; R123-L127 PolarHBondContact O-N 3.27Å; V124-L127 PolarHBondContact O-N 2.9Å; L127-T131 WeakPolarHBondContact O-CB 3.33Å; L127-T131 PolarHBondContact O-N 3.28Å; L127-T131 PolarHBondContact O-OG1 2.94Å; L127-E270 HydrophobicContact CD1-CG 4.08Å; L127-E270 HydrophobicContact CD2-CG 4.1Å; L127-L271 HydrophobicContact CB-CD1 4.03Å; L127-T274 HydrophobicContact CD1-CG2 4.1Å; L127-T274 WeakPolarHBondContact CD1-OG1 3.34Å
128	V	92.9	Very high	92	Very high	2 Å²	2	44.8 Å²	44.8	1%	0.012	25%	0.252	C	S	.	.	H	α-helix	trans	-67	-43.9	175.7	174.8	0	0	0	0	110.6	L6 F9 V124 Q125 T131 I132 L271	L6-V128 HydrophobicContact CD2-CG1 4.33Å; L6-V128 HydrophobicContact CD2-CG2 4.02Å; F9-V128 HydrophobicContact CD1-CB 4.13Å; F9-V128 HydrophobicContact CD1-CG1 4.01Å; F9-V128 HydrophobicContact CD1-CG2 3.96Å; F9-V128 HydrophobicContact CE1-CB 4.22Å; F9-V128 HydrophobicContact CE1-CG2 4.01Å; V124-V128 HydrophobicContact CG1-CG2 4.19Å; V124-V128 VanDerWaalsContact O-CG2 3.32Å; V124-V128 WeakPolarHBondContact O-CG2 3.49Å; V124-V128 PolarHBondContact O-N 3.47Å; Q125-V128 PolarHBondContact O-N 2.82Å; V128-T131 PolarHBondContact O-N 3.22Å; V128-I132 HydrophobicContact CG1-CD1 3.96Å; V128-I132 WeakPolarHBondContact O-CG1 3.5Å; V128-I132 PolarHBondContact O-N 3.19Å; V128-L271 HydrophobicContact CG2-CD1 3.89Å; V128-L271 HydrophobicContact CG2-CD2 4.05Å
129	A	92	Very high	91.3	Very high	21 Å²	21	43.8 Å²	43.8	17%	0.174	25%	0.246	C	C	.	.	H	α-helix	trans	-58.2	-50.4	175.4	0	0	0	0	0	111.5	Y10 Q125 A126 T131 I132 E133	Y10-A129 HydrophobicContact CD2-CB 4.2Å; Y10-A129 HydrophobicContact CE2-CB 3.8Å; Q125-A129 WeakPolarHBondContact O-CB 3.4Å; Q125-A129 PolarHBondContact O-N 3.19Å; A126-A129 PolarHBondContact O-N 3.03Å; A129-T131 VanDerWaalsContact C-N 3.29Å; A129-T131 PolarHBondContact O-N 3.5Å; A129-I132 PolarHBondContact O-N 3.34Å; A129-I132 VanDerWaalsContact O-N 3.11Å; A129-E133 WeakPolarHBondContact O-CB 3.49Å; A129-E133 WeakPolarHBondContact O-CG 3.35Å; A129-E133 PolarHBondContact O-N 3.07Å
130	H	91.5	Very high	90.5	Very high	121 Å²	121	42.2 Å²	42.2	56%	0.56	24%	0.244	S	C	*	.	H	α-helix	trans	-58.6	-39.4	176.9	178.7	-86.8	0	0	0	112.6	A126 I132 S134	A126-H130 WeakPolarHBondContact O-CB 3.4Å; A126-H130 PolarHBondContact O-N 3.14Å; H130-I132 VanDerWaalsContact C-N 3.33Å; H130-I132 PolarHBondContact O-N 2.92Å; H130-S134 WeakPolarHBondContact O-CB 3.36Å; H130-S134 PolarHBondContact O-N 3.18Å
131	T	89.8	Confident	89.2	Confident	23 Å²	23	45.2 Å²	45.2	14%	0.141	27%	0.265	C	S	.	.	H	α-helix	trans	-63.2	-41	177.5	-57.8	0	0	0	0	111.5	L127 V128 A129 C135 T266	L127-T131 WeakPolarHBondContact O-CB 3.33Å; L127-T131 PolarHBondContact O-N 3.28Å; L127-T131 PolarHBondContact O-OG1 2.94Å; V128-T131 PolarHBondContact O-N 3.22Å; A129-T131 VanDerWaalsContact C-N 3.29Å; A129-T131 PolarHBondContact O-N 3.5Å; T131-C135 WeakPolarHBondContact O-CB 3.47Å; T131-C135 PolarHBondContact O-N 3.46Å; T131-T266 WeakPolarHBondContact CG2-O 3.32Å
132	I	89.2	Confident	87.2	Confident	2 Å²	2	50.1 Å²	50.1	1%	0.01	29%	0.291	C	S	.	.	H	α-helix	trans	-71.6	-45.6	179	-70.6	169.4	0	0	0	110.8	Y10 V128 A129 H130 C135 L136 P260 L265	Y10-I132 HydrophobicContact CD1-CD1 3.71Å; Y10-I132 HydrophobicContact CD2-CD1 3.77Å; Y10-I132 HydrophobicContact CE1-CD1 4.45Å; Y10-I132 HydrophobicContact CE1-CG2 4.33Å; Y10-I132 HydrophobicContact CG-CD1 3.31Å; V128-I132 HydrophobicContact CG1-CD1 3.96Å; V128-I132 WeakPolarHBondContact O-CG1 3.5Å; V128-I132 PolarHBondContact O-N 3.19Å; A129-I132 PolarHBondContact O-N 3.34Å; A129-I132 VanDerWaalsContact O-N 3.11Å; H130-I132 VanDerWaalsContact C-N 3.33Å; H130-I132 PolarHBondContact O-N 2.92Å; I132-C135 WeakPolarHBondContact O-CB 3.37Å; I132-C135 PolarHBondContact O-N 3.26Å; I132-L136 HydrophobicContact CG2-CD1 4.11Å; I132-L136 WeakPolarHBondContact O-CG 3.4Å; I132-L136 PolarHBondContact O-N 3.15Å; I132-P260 HydrophobicContact CG2-CG 4.28Å; I132-L265 HydrophobicContact CG1-CD2 4.13Å
133	E	88.9	Confident	85.1	Confident	98 Å²	98	55.5 Å²	55.5	46%	0.458	31%	0.308	S	S	.	.	H	α-helix	trans	-63.6	-46.2	179.3	-72	171.3	-175.4	0	0	111.7	A129 C135 L136 D137	A129-E133 WeakPolarHBondContact O-CB 3.49Å; A129-E133 WeakPolarHBondContact O-CG 3.35Å; A129-E133 PolarHBondContact O-N 3.07Å; E133-C135 VanDerWaalsContact C-N 3.27Å; E133-C135 PolarHBondContact O-N 3.44Å; E133-L136 WeakPolarHBondContact O-CB 3.45Å; E133-L136 PolarHBondContact O-N 2.86Å; E133-L136 VanDerWaalsContact O-N 3.12Å; E133-D137 PolarHBondContact O-N 3.24Å
134	S	87.7	Confident	82.5	Confident	62 Å²	62	55.9 Å²	55.9	43%	0.434	32%	0.322	S	S	.	.	H	α-helix	trans	-61.1	-36.2	175.8	179.9	0	0	0	0	112.4	H130 S138	H130-S134 WeakPolarHBondContact O-CB 3.36Å; H130-S134 PolarHBondContact O-N 3.18Å; S134-S138 PolarHBondContact O-N 3.44Å; S134-S138 VanDerWaalsContact O-N 3.1Å
135	C	86.5	Confident	79.8	Confident	15 Å²	15	64 Å²	64	10%	0.101	36%	0.361	C	S	.	.	H	α-helix	trans	-66.4	-44.7	174.3	-174.4	0	0	0	0	111.3	T131 I132 E133 D137 S138 L139 P260 L265	T131-C135 WeakPolarHBondContact O-CB 3.47Å; T131-C135 PolarHBondContact O-N 3.46Å; I132-C135 WeakPolarHBondContact O-CB 3.37Å; I132-C135 PolarHBondContact O-N 3.26Å; E133-C135 VanDerWaalsContact C-N 3.27Å; E133-C135 PolarHBondContact O-N 3.44Å; C135-D137 PolarHBondContact O-N 3.46Å; C135-S138 PolarHBondContact O-N 3.34Å; C135-S138 PolarHBondContact O-OG 3.37Å; C135-L139 WeakPolarHBondContact O-CG 3.24Å; C135-L139 PolarHBondContact O-N 3.46Å; C135-L139 VanDerWaalsContact O-N 3.11Å; C135-P260 HydrophobicContact CB-CB 4.4Å; C135-P260 HydrophobicContact CB-CG 4.24Å; C135-L265 HydrophobicContact CB-CD2 4.26Å
136	L	86.7	Confident	76.8	Confident	25 Å²	25	69.6 Å²	69.6	13%	0.131	39%	0.392	C	S	.	.	H	α-helix	trans	-61.9	-41.7	175.9	-72.5	169.6	0	0	0	112.5	I132 E133 S138 L139 S140 I239 K258 P260	I132-L136 HydrophobicContact CG2-CD1 4.11Å; I132-L136 WeakPolarHBondContact O-CG 3.4Å; I132-L136 PolarHBondContact O-N 3.15Å; E133-L136 WeakPolarHBondContact O-CB 3.45Å; E133-L136 PolarHBondContact O-N 2.86Å; E133-L136 VanDerWaalsContact O-N 3.12Å; L136-S138 VanDerWaalsContact C-N 3.32Å; L136-S138 PolarHBondContact O-N 3.07Å; L136-L139 PolarHBondContact O-N 3.2Å; L136-S140 VanDerWaalsContact O-CB 3.29Å; L136-S140 WeakPolarHBondContact O-CB 3.18Å; L136-S140 PolarHBondContact O-N 2.88Å; L136-I239 HydrophobicContact CD2-CG1 4.25Å; L136-I239 HydrophobicContact CD2-CG2 4.09Å; L136-K258 HydrophobicContact CD1-CB 4.11Å; L136-K258 WeakPolarHBondContact CD1-O 3.3Å; L136-K258 HydrophobicContact CD2-CB 4.34Å; L136-P260 HydrophobicContact CD2-CB 4.17Å; L136-P260 HydrophobicContact CD2-CG 4.44Å; L136-P260 HydrophobicContact CG-CG 4.41Å
137	D	85.3	Confident	73.7	Confident	111 Å²	111	69.6 Å²	69.6	59%	0.594	40%	0.398	S	S	*	.	H	α-helix	trans	-62.1	-41.1	177.1	-73.9	-19.7	0	0	0	111.3	E133 C135 S140 S141	E133-D137 PolarHBondContact O-N 3.24Å; C135-D137 PolarHBondContact O-N 3.46Å; D137-S140 PolarHBondContact O-N 3.13Å; D137-S141 PolarHBondContact O-N 2.98Å; D137-S141 PolarHBondContact O-OG 2.82Å
138	S	84	Confident	70.6	Confident	54 Å²	54	77.5 Å²	77.5	38%	0.378	43%	0.432	S	S	.	.	H	α-helix	trans	-65.7	-37.2	177.8	73.2	0	0	0	0	113.4	S134 C135 L136 S141 N142	S134-S138 PolarHBondContact O-N 3.44Å; S134-S138 VanDerWaalsContact O-N 3.1Å; C135-S138 PolarHBondContact O-N 3.34Å; C135-S138 PolarHBondContact O-OG 3.37Å; L136-S138 VanDerWaalsContact C-N 3.32Å; L136-S138 PolarHBondContact O-N 3.07Å; S138-S141 PolarHBondContact O-OG 3.3Å; S138-N142 VanDerWaalsContact O-CG 3.27Å; S138-N142 PolarHBondContact O-N 3.35Å; S138-N142 PolarHBondContact O-ND2 3.41Å
139	L	81.6	Confident	67.4	Low	8 Å²	8	85.8 Å²	85.8	4%	0.042	48%	0.475	C	S	.	.	H	α-helix	trans	-72	-38.9	175.6	-66.3	168.4	0	0	0	111	C135 L136 E238 I239 P260 F264	C135-L139 WeakPolarHBondContact O-CG 3.24Å; C135-L139 PolarHBondContact O-N 3.46Å; C135-L139 VanDerWaalsContact O-N 3.11Å; L136-L139 PolarHBondContact O-N 3.2Å; L139-E238 HydrophobicContact CD1-CB 4.43Å; L139-E238 HydrophobicContact CD2-CB 4.21Å; L139-E238 WeakPolarHBondContact CD2-OE2 3.26Å; L139-I239 HydrophobicContact CB-CD1 4.31Å; L139-I239 HydrophobicContact CB-CG1 4.44Å; L139-I239 HydrophobicContact CD1-CG1 4.3Å; L139-P260 HydrophobicContact CD1-CB 3.9Å; L139-F264 HydrophobicContact CD1-CD2 4.41Å; L139-F264 HydrophobicContact CD2-CD2 4.43Å; L139-F264 HydrophobicContact CD2-CE2 4.35Å; L139-F264 HydrophobicContact CD2-CZ 4.48Å
140	S	78	Confident	64.3	Low	70 Å²	70	93.9 Å²	93.9	49%	0.49	51%	0.506	S	S	.	.	H	α-helix	trans	-62.7	-42.9	174.8	168.1	0	0	0	0	112.5	L136 D137 N142 H143	L136-S140 VanDerWaalsContact O-CB 3.29Å; L136-S140 WeakPolarHBondContact O-CB 3.18Å; L136-S140 PolarHBondContact O-N 2.88Å; D137-S140 PolarHBondContact O-N 3.13Å; S140-N142 PolarHBondContact O-N 2.8Å; S140-H143 PolarHBondContact O-N 2.83Å
141	S	69.5	Low	61.1	Low	66 Å²	66	96 Å²	96	46%	0.462	52%	0.521	S	S	.	.	H	α-helix	trans	-67.4	-35.3	-177.8	58.1	0	0	0	0	113.2	D137 S138 H143 T144	D137-S141 PolarHBondContact O-N 2.98Å; D137-S141 PolarHBondContact O-OG 2.82Å; S138-S141 PolarHBondContact O-OG 3.3Å; S141-H143 PolarHBondContact O-N 3.47Å; S141-T144 PolarHBondContact O-N 2.66Å; S141-T144 VanDerWaalsContact O-N 3.08Å; S141-T144 PolarHBondContact O-OG1 2.95Å
142	N	55.9	Low	57.9	Low	109 Å²	109	102.5 Å²	102.5	58%	0.583	56%	0.555	S	S	*	*	H	α-helix	trans	-64.7	-24.1	-177.9	-69.5	-17.1	0	0	0	113	S138 S140 T144	S138-N142 VanDerWaalsContact O-CG 3.27Å; S138-N142 PolarHBondContact O-N 3.35Å; S138-N142 PolarHBondContact O-ND2 3.41Å; S140-N142 PolarHBondContact O-N 2.8Å; N142-T144 VanDerWaalsContact C-N 3.27Å; N142-T144 PolarHBondContact O-N 3.43Å
143	H	50.9	Low	54.9	Low	141 Å²	141	110.6 Å²	110.6	65%	0.653	59%	0.589	S	S	*	*	T	Hydrogen-bonded Turn	trans	-76.2	-6.8	175.6	-78.6	-56	0	0	0	114.8	S140 S141	S140-H143 PolarHBondContact O-N 2.83Å; S141-H143 PolarHBondContact O-N 3.47Å
144	T	42.4	Very low	51.7	Low	116 Å²	116	114.3 Å²	114.3	71%	0.712	61%	0.607	S	S	*	*	T	Hydrogen-bonded Turn	trans	-99.1	-10.1	-173.8	-26.6	0	0	0	0	114.3	S141 N142	S141-T144 PolarHBondContact O-N 2.66Å; S141-T144 VanDerWaalsContact O-N 3.08Å; S141-T144 PolarHBondContact O-OG1 2.95Å; N142-T144 VanDerWaalsContact C-N 3.27Å; N142-T144 PolarHBondContact O-N 3.43Å
145	E	38.1	Very low	48.7	Very low	172 Å²	172	115.7 Å²	115.7	80%	0.804	62%	0.622	S	S	*	*	S	Bend	trans	-107.2	1.6	-179.7	-70.1	-138.6	150.6	0	0	115.8	G147	E145-G147 PolarHBondContact O-N 3.16Å
146	D	34.1	Very low	45.6	Very low	159 Å²	159	120.1 Å²	120.1	85%	0.85	65%	0.653	S	S	*	*			trans	-81.2	44.7	173.4	-84.7	-22.6	0	0	0	113.3
147	G	29.1	Very low	42.7	Very low	63 Å²	63	126.9 Å²	126.9	65%	0.649	69%	0.69	S	S	*	*	S	Bend	trans	-127.3	21.8	178.5	0	0	0	0	0	114	E145	E145-G147 PolarHBondContact O-N 3.16Å
148	K	27.8	Very low	39.6	Very low	190 Å²	190	129.1 Å²	129.1	83%	0.826	70%	0.701	S	S	*	*			trans	170.9	84.8	160.3	-100.4	161.1	-177.5	175	0	112
149	L	26.9	Very low	36.8	Very low	175 Å²	175	132.6 Å²	132.6	92%	0.916	73%	0.726	S	S	*	*			trans	-129.7	98.1	149.1	-81.3	172.6	0	0	0	109.3	L151	L149-L151 PolarHBondContact O-N 2.88Å
150	K	26	Very low	34	Very low	192 Å²	192	137.8 Å²	137.8	84%	0.835	76%	0.758	S	S	*	*			trans	-56.9	116.7	169.3	-77.9	177.6	173.6	179.2	0	108.6	N152	K150-N152 PolarHBondContact O-N 3.17Å
151	L	23.7	Very low	31.4	Very low	166 Å²	166	143.6 Å²	143.6	87%	0.869	78%	0.777	S	S	*	*			trans	-45.1	100.2	149.9	-99.9	129.1	0	0	0	108.9	L149	L149-L151 PolarHBondContact O-N 2.88Å
152	N	24.6	Very low	29.2	Very low	159 Å²	159	147.9 Å²	147.9	85%	0.85	79%	0.79	S	S	*	*			trans	-117.5	111.4	159.8	-118.1	5.4	0	0	0	108.4	K150	K150-N152 PolarHBondContact O-N 3.17Å
153	K	24.6	Very low	27.6	Very low	171 Å²	171	148.7 Å²	148.7	74%	0.743	79%	0.794	S	S	*	*			trans	-54.6	146.9	176.9	-80.1	172.4	171.6	175.4	0	112.5
154	Q	21.7	Very low	26.3	Very low	176 Å²	176	148.4 Å²	148.4	82%	0.822	80%	0.798	S	S	*	*			trans	67.4	104.4	138.2	-70.6	170.5	-26.1	0	0	118.8
155	A	24.5	Very low	25.3	Very low	91 Å²	91	148.2 Å²	148.2	75%	0.752	80%	0.796	S	S	*	*				-172.2	100.6	121.3	0	0	0	0	0	106.6
156	S	21.9	Very low	24.6	Very low	108 Å²	108	148.3 Å²	148.3	76%	0.755	80%	0.797	S	S	*	*				46.6	94.5	94.5	-53.2	0	0	0	0	111.9
157	N	25.3	Very low	24	Very low	168 Å²	168	145.2 Å²	145.2	90%	0.898	79%	0.787	S	S	*	*			trans	-163.6	107.5	138.3	-90.1	-20.5	0	0	0	109.8
158	N	21	Very low	23.7	Very low	157 Å²	157	147.8 Å²	147.8	84%	0.84	80%	0.795	S	S	*	*			trans	-58.9	145	167.6	-63.2	-30.8	0	0	0	111
159	S	26.3	Very low	23.3	Very low	128 Å²	128	148.8 Å²	148.8	90%	0.895	80%	0.796	S	S	*	*			trans	-167.8	112.6	138	-71.6	0	0	0	0	110.1
160	T	22.3	Very low	23.1	Very low	117 Å²	117	148.4 Å²	148.4	72%	0.718	80%	0.795	S	S	*	*			trans	-58.7	144.7	172.4	-41.9	0	0	0	0	113.5
161	E	23.8	Very low	23	Very low	191 Å²	191	146.3 Å²	146.3	89%	0.893	79%	0.791	S	S	*	*				-174	115.1	125.5	-102.1	172.4	-173.9	0	0	112.9
162	Q	22.7	Very low	23.2	Very low	157 Å²	157	143.2 Å²	143.2	73%	0.734	78%	0.781	S	S	*	*			trans	-41.8	169.4	148.2	-75.2	170.5	-45.6	0	0	113.3
163	D	22.2	Very low	23.1	Very low	125 Å²	125	144.9 Å²	144.9	67%	0.668	78%	0.783	S	S	*	*			cis	-171.6	170	7.6	-113.6	-29.1	0	0	0	107.7
164	N	23.4	Very low	22.8	Very low	135 Å²	135	145.6 Å²	145.6	72%	0.722	79%	0.789	S	S	*	*			trans	85.4	103.3	150	-79.6	-22.7	0	0	0	122.8
165	V	22.4	Very low	22.8	Very low	112 Å²	112	144.1 Å²	144.1	68%	0.679	79%	0.792	S	S	*	*				42.5	114.1	107.3	-175.4	0	0	0	0	116.6
166	Q	22.8	Very low	22.7	Very low	174 Å²	174	148.4 Å²	148.4	81%	0.813	79%	0.794	S	S	*	*				173.5	145.4	93.5	-143.9	146.6	-22.1	0	0	112.1
167	S	20.4	Very low	22.6	Very low	94 Å²	94	150.5 Å²	150.5	66%	0.657	80%	0.797	S	S	*	*			trans	-53.9	139.3	172.8	57.9	0	0	0	0	114.4
168	S	22.8	Very low	22.4	Very low	117 Å²	117	147 Å²	147	82%	0.818	79%	0.791	S	S	*	*			trans	-161.8	119.5	136.1	-80.9	0	0	0	0	110.2
169	Y	19.9	Very low	22.7	Very low	211 Å²	211	144.9 Å²	144.9	83%	0.827	79%	0.786	S	S	*	*			trans	-60.7	136.6	167.5	-79.2	-101.6	0	0	0	110.3
170	N	23.1	Very low	22.4	Very low	168 Å²	168	146 Å²	146	90%	0.898	78%	0.781	S	S	*	*			trans	-152.9	123	147.2	-90.8	-33.2	0	0	0	110.1
171	I	23.2	Very low	22.3	Very low	147 Å²	147	144.9 Å²	144.9	75%	0.754	78%	0.778	S	S	*	*			trans	-93.5	175	173.1	-27.9	179.7	0	0	0	108
172	P	27.4	Very low	22.1	Very low	101 Å²	101	142.7 Å²	142.7	66%	0.656	77%	0.768	S	S	*	*				-115.2	155.3	-103.2	37	-20.1	0	0	0	112.7
173	H	22.5	Very low	22	Very low	194 Å²	194	142.9 Å²	142.9	90%	0.898	77%	0.766	S	S	*	*			trans	-132.1	120.9	155.7	-86.8	-66.9	0	0	0	110.5	T175	H173-T175 PolarHBondContact O-N 3.41Å
174	E	18.4	Very low	22	Very low	186 Å²	186	145.4 Å²	145.4	87%	0.869	77%	0.771	S	S	*	*			trans	-49.2	127.9	159.7	-67.5	174	127.8	0	0	110.2
175	T	23.4	Very low	21.8	Very low	146 Å²	146	145.6 Å²	145.6	90%	0.896	77%	0.772	S	S	*	*			trans	-166	151.6	132.5	9.3	0	0	0	0	110.7	H173	H173-T175 PolarHBondContact O-N 3.41Å
176	K	20.6	Very low	21.9	Very low	181 Å²	181	147.8 Å²	147.8	79%	0.787	78%	0.778	S	S	*	*			trans	-71.9	164.1	-167	-64.7	169.8	169.3	174.1	0	113.8
177	D	21.7	Very low	21.8	Very low	152 Å²	152	151.2 Å²	151.2	81%	0.813	78%	0.784	S	S	*	*			trans	89.9	123.7	151.6	-56.2	-38.3	0	0	0	119
178	A	20.2	Very low	21.9	Very low	93 Å²	93	149.7 Å²	149.7	77%	0.769	78%	0.783	S	S	*	*			trans	-51.9	172.6	163.7	0	0	0	0	0	112.4
179	P	27.5	Very low	21.9	Very low	114 Å²	114	151.6 Å²	151.6	74%	0.74	78%	0.784	S	S	*	*			cis	-148.1	173.3	21	42.3	-20.9	0	0	0	118
180	N	20.6	Very low	22	Very low	150 Å²	150	152.6 Å²	152.6	80%	0.802	79%	0.786	S	S	*	*			trans	48.6	127.9	142.5	-94.4	-13.2	0	0	0	124.1
181	C	18.6	Very low	22	Very low	95 Å²	95	151.9 Å²	151.9	64%	0.642	78%	0.782	S	S	*	*				87.3	117	129.1	-87.9	0	0	0	0	122.1
182	Q	20.5	Very low	22	Very low	145 Å²	145	152 Å²	152	68%	0.678	79%	0.79	S	S	*	*				95.8	117.2	125.7	-74.2	-171.5	21.3	0	0	121.5
183	K	20	Very low	21.7	Very low	161 Å²	161	152.6 Å²	152.6	70%	0.7	79%	0.791	S	S	*	*				67.7	116.7	123.9	-73.2	178.6	-179	165.9	0	119.4
184	K	22.7	Very low	21.9	Very low	177 Å²	177	151.2 Å²	151.2	77%	0.77	79%	0.791	S	S	*	*				149.9	127.5	100.9	-102.1	162.8	177.7	-176.2	0	113.4
185	N	19.5	Very low	22	Very low	139 Å²	139	152.1 Å²	152.1	74%	0.743	79%	0.786	S	S	*	*			trans	41.4	134.9	130.8	-58.6	-9.6	0	0	0	121.7
186	I	25.2	Very low	21.9	Very low	158 Å²	158	150.9 Å²	150.9	81%	0.81	77%	0.774	S	S	*	*				170.5	112.2	107.9	-82.1	161.4	0	0	0	111.5
187	R	20.6	Very low	22.1	Very low	246 Å²	246	148.4 Å²	148.4	93%	0.928	78%	0.779	S	S	*	*				53.8	122.8	122.9	-154.9	-179.9	-169.9	-164.8	2.4	123
188	G	21.7	Very low	22.2	Very low	63 Å²	63	145.8 Å²	145.8	65%	0.649	77%	0.773	S	S	*	*				133	119	110.7	0	0	0	0	0	121.7
189	N	21.8	Very low	22.2	Very low	156 Å²	156	149 Å²	149	83%	0.834	77%	0.772	S	S	*	*			trans	58.2	143.5	142.1	-70.8	0.5	0	0	0	120.5
190	R	24	Very low	22.2	Very low	232 Å²	232	152.5 Å²	152.5	88%	0.875	78%	0.776	S	S	*	*			cis	-173.1	149.7	37.2	-146.4	176.6	-160.3	159.7	2	111.3
191	N	21.1	Very low	22.1	Very low	153 Å²	153	149.7 Å²	149.7	82%	0.818	77%	0.769	S	S	*	*			trans	-77.5	153	173.7	-59.2	-41.4	0	0	0	114.9
192	V	23.6	Very low	22.5	Very low	149 Å²	149	152 Å²	152	90%	0.903	77%	0.774	S	S	*	*			trans	-150.8	147.1	143	178.5	0	0	0	0	110.3
193	V	22.2	Very low	22.6	Very low	114 Å²	114	150.2 Å²	150.2	69%	0.691	77%	0.774	S	S	*	*			trans	-81.2	152.2	-170.9	168.5	0	0	0	0	113.5
194	D	25.3	Very low	22.8	Very low	166 Å²	166	149.9 Å²	149.9	89%	0.888	77%	0.774	S	S	*	*			trans	-167.3	165.5	134.8	-99.5	-26.2	0	0	0	113.8
195	R	21.7	Very low	23	Very low	204 Å²	204	153.5 Å²	153.5	77%	0.77	78%	0.783	S	S	*	*			trans	-138.8	153.1	-135.5	-167.9	-164.4	167.7	160.9	3	110.5
196	D	20.8	Very low	23.1	Very low	120 Å²	120	152.7 Å²	152.7	64%	0.642	78%	0.777	S	S	*	*			trans	57.1	126.7	157.6	-65.4	-24.2	0	0	0	120.7
197	S	25.9	Very low	23	Very low	129 Å²	129	152.1 Å²	152.1	90%	0.902	78%	0.776	S	S	*	*				176	158.5	118.4	-75.2	0	0	0	0	112.8
198	S	22.4	Very low	23.3	Very low	98 Å²	98	145 Å²	145	69%	0.685	76%	0.764	S	S	*	*			trans	-108.8	-178.5	-152.1	47.2	0	0	0	0	114.6
199	E	21.7	Very low	24.2	Very low	159 Å²	159	147.2 Å²	147.2	74%	0.743	77%	0.767	S	S	*	*			trans	83.6	119.5	155.7	-62.2	175.6	179.2	0	0	118.5
200	F	26	Very low	24.2	Very low	188 Å²	188	147.2 Å²	147.2	83%	0.825	77%	0.766	S	S	*	*				-172.6	139.1	97.5	-108.9	-86.1	0	0	0	112.1
201	S	20.3	Very low	24.1	Very low	92 Å²	92	142.8 Å²	142.8	64%	0.643	77%	0.769	S	S	*	*			trans	-87.6	161.5	-179.1	31.7	0	0	0	0	113.3
202	N	25.6	Very low	24.2	Very low	142 Å²	142	140.2 Å²	140.2	76%	0.759	76%	0.763	S	S	*	*			trans	156.6	149.3	142.3	-82.5	-19.3	0	0	0	110.4
203	T	23.7	Very low	24	Very low	109 Å²	109	140.2 Å²	140.2	67%	0.669	76%	0.757	S	S	*	*			cis	-171.9	137.4	-14.4	24.6	0	0	0	0	107.2
204	H	23.1	Very low	24.2	Very low	153 Å²	153	140.5 Å²	140.5	71%	0.708	76%	0.762	S	S	*	*			trans	39.1	126.4	138.6	-84.1	-80.9	0	0	0	122.9
205	R	26.4	Very low	24	Very low	254 Å²	254	138 Å²	138	96%	0.958	75%	0.752	S	S	*	*				-160.9	140	118	-102.5	167.6	-167.4	-164.8	3.7	111
206	I	21.7	Very low	24.1	Very low	121 Å²	121	134.1 Å²	134.1	62%	0.621	75%	0.753	S	S	*	*			trans	-115.5	164.8	-169.1	-59.5	175.6	0	0	0	107.4
207	D	24.2	Very low	24.1	Very low	147 Å²	147	133.1 Å²	133.1	79%	0.786	76%	0.756	S	S	*	*			trans	91.3	135.4	157.9	-73.8	-34.8	0	0	0	118.3
208	S	26.9	Very low	23.9	Very low	97 Å²	97	134.9 Å²	134.9	68%	0.678	76%	0.755	S	S	*	*			cis	-168.2	-163.8	-13.9	-32.2	0	0	0	0	106.6
209	P	41.1	Very low	23.9	Very low	109 Å²	109	135.1 Å²	135.1	71%	0.708	76%	0.757	S	S	*	*			trans	-124.2	179.6	-135.4	38.1	-15.6	0	0	0	117.8
210	L	21	Very low	24	Very low	156 Å²	156	132.8 Å²	132.8	82%	0.817	76%	0.758	S	S	*	*			trans	39.3	117	146.9	-92.4	79	0	0	0	120.1
211	C	22.7	Very low	23.9	Very low	138 Å²	138	132.5 Å²	132.5	93%	0.932	76%	0.759	S	S	*	*				-161.4	143	126.8	-105.6	0	0	0	0	112.8
212	S	21.2	Very low	24	Very low	100 Å²	100	133 Å²	133	70%	0.699	76%	0.763	S	S	*	*			trans	-98.1	151	-171.2	2.9	0	0	0	0	111.8
213	L	21.3	Very low	23.8	Very low	149 Å²	149	134 Å²	134	78%	0.78	77%	0.768	S	S	*	*			trans	42.9	136.3	146.2	-78.9	145.7	0	0	0	119.3	V215	L213-V215 HydrophobicContact CD2-CG2 4.32Å
214	P	26.4	Very low	24	Very low	120 Å²	120	134 Å²	134	78%	0.779	77%	0.772	S	S	*	*				-150.7	166.1	65.3	36.9	-15.6	0	0	0	117.9
215	V	20.2	Very low	24	Very low	112 Å²	112	135 Å²	135	68%	0.679	78%	0.782	S	S	*	*			trans	-68.9	146.3	168.9	174.9	0	0	0	0	111.1	L213	L213-V215 HydrophobicContact CD2-CG2 4.32Å
216	P	23.9	Very low	24	Very low	123 Å²	123	130.6 Å²	130.6	80%	0.799	77%	0.772	S	S	*	*				-133.8	133.6	124.7	33.5	-20.6	0	0	0	112.4
217	S	20	Very low	24.1	Very low	100 Å²	100	133.4 Å²	133.4	70%	0.699	78%	0.783	S	S	*	*			trans	-76	129.4	166.1	42.4	0	0	0	0	110.4
218	D	22.3	Very low	24.1	Very low	165 Å²	165	135.1 Å²	135.1	88%	0.882	79%	0.786	S	S	*	*			trans	-153.9	138.2	145.2	-99.8	-26.9	0	0	0	111.6
219	S	21.6	Very low	24	Very low	104 Å²	104	135.3 Å²	135.3	73%	0.727	79%	0.787	S	S	*	*			trans	-73.8	136.6	-176.9	49.8	0	0	0	0	113.4
220	S	24	Very low	23.4	Very low	110 Å²	110	134.3 Å²	134.3	77%	0.769	79%	0.788	S	S	*	*			trans	179.4	120.2	130.3	35.8	0	0	0	0	112.3
221	H	23.5	Very low	23.7	Very low	182 Å²	182	132.3 Å²	132.3	84%	0.843	78%	0.782	S	S	*	*			trans	37.4	126.8	144.5	-69.5	-71.6	0	0	0	122.8
222	S	23.7	Very low	24.2	Very low	103 Å²	103	132.5 Å²	132.5	72%	0.72	77%	0.772	S	S	*	*			trans	105.6	107.7	132.6	68.6	0	0	0	0	119.3
223	N	21.6	Very low	24.6	Very low	162 Å²	162	134.3 Å²	134.3	87%	0.866	77%	0.774	S	S	*	*			trans	50.5	97.7	137.1	-59.9	-14.1	0	0	0	119.1
224	S	27.1	Very low	25.4	Very low	108 Å²	108	131.9 Å²	131.9	76%	0.755	76%	0.762	S	S	*	*				-153.1	121	129.2	-146.2	0	0	0	0	109.9	E226	S224-E226 PolarHBondContact O-N 3.15Å
225	L	24.3	Very low	26.1	Very low	176 Å²	176	134.3 Å²	134.3	92%	0.921	76%	0.763	S	S	*	*			trans	-78.1	70.5	-179.1	-162.2	83.4	0	0	0	108.4	Q227	L225-Q227 PolarHBondContact O-N 2.93Å
226	E	24.5	Very low	27.4	Very low	161 Å²	161	135.4 Å²	135.4	75%	0.752	77%	0.765	S	S	*	*			trans	-81.9	108	169.9	-78.9	-173.3	163.1	0	0	108.8	S224 Q228	S224-E226 PolarHBondContact O-N 3.15Å; E226-Q228 VanDerWaalsContact C-N 3.28Å; E226-Q228 PolarHBondContact O-N 3.23Å
227	Q	25.2	Very low	28.9	Very low	180 Å²	180	132.6 Å²	132.6	84%	0.841	75%	0.748	S	S	*	*			trans	-53.1	92.8	163.9	-74.7	169.3	-33	0	0	108.9	L225 S229	L225-Q227 PolarHBondContact O-N 2.93Å; Q227-S229 VanDerWaalsContact C-N 3.34Å; Q227-S229 PolarHBondContact O-N 3.39Å
228	Q	23.2	Very low	31.4	Very low	182 Å²	182	131.2 Å²	131.2	85%	0.85	73%	0.731	S	S	*	*			trans	-66.8	100.9	165.2	-76.6	-179.1	3.1	0	0	107.7	E226 A230	E226-Q228 VanDerWaalsContact C-N 3.28Å; E226-Q228 PolarHBondContact O-N 3.23Å; Q228-A230 VanDerWaalsContact C-N 3.34Å; Q228-A230 PolarHBondContact O-N 2.82Å
229	S	25.5	Very low	34	Very low	101 Å²	101	126.2 Å²	126.2	71%	0.706	70%	0.703	S	S	*	*			trans	-55.9	99.3	160.7	-42.6	0	0	0	0	107.4	Q227 V231	Q227-S229 VanDerWaalsContact C-N 3.34Å; Q227-S229 PolarHBondContact O-N 3.39Å; S229-V231 PolarHBondContact O-N 2.85Å
230	A	28.3	Very low	36.7	Very low	88 Å²	88	125.4 Å²	125.4	73%	0.727	69%	0.69	S	S	*	*			trans	-68.8	90.1	165.4	0	0	0	0	0	107.2	Q228 I232	Q228-A230 VanDerWaalsContact C-N 3.34Å; Q228-A230 PolarHBondContact O-N 2.82Å; A230-I232 PolarHBondContact O-N 3.43Å
231	V	28.2	Very low	39.4	Very low	114 Å²	114	125.4 Å²	125.4	69%	0.691	68%	0.681	S	S	*	*			trans	-69.4	81.5	166.5	-179.5	0	0	0	0	106.8	S229 N233	S229-V231 PolarHBondContact O-N 2.85Å; V231-N233 WeakPolarHBondContact CG1-OD1 3.43Å
232	I	32	Very low	42.2	Very low	143 Å²	143	119 Å²	119	73%	0.733	66%	0.655	S	S	*	*			trans	-92	104.7	156.1	-61.6	177.3	0	0	0	104.3	A230 D234	A230-I232 PolarHBondContact O-N 3.43Å; I232-D234 PolarHBondContact O-N 2.9Å
233	N	29.8	Very low	44.9	Very low	137 Å²	137	117.8 Å²	117.8	73%	0.733	64%	0.644	S	S	*	*			trans	-64.5	80.7	170.5	-74.1	-16.9	0	0	0	108.7	V231 E235	V231-N233 WeakPolarHBondContact CG1-OD1 3.43Å; N233-E235 VanDerWaalsContact C-N 3.34Å; N233-E235 PolarHBondContact O-N 3.06Å
234	D	38.1	Very low	47.8	Very low	99 Å²	99	110.3 Å²	110.3	53%	0.529	61%	0.605	S	S	.	*			trans	-89.9	77.7	166.2	-158.7	1.3	0	0	0	107.8	I232 N236 S237	I232-D234 PolarHBondContact O-N 2.9Å; D234-N236 PolarHBondContact O-N 3.45Å; D234-S237 PolarHBondContact O-N 3.03Å
235	E	41.3	Very low	50.5	Low	171 Å²	171	110.3 Å²	110.3	80%	0.799	59%	0.593	S	S	*	*	T	Hydrogen-bonded Turn	trans	-63.8	2.6	176.5	-72.2	-154.8	158.7	0	0	113.5	N233	N233-E235 VanDerWaalsContact C-N 3.34Å; N233-E235 PolarHBondContact O-N 3.06Å
236	N	47.4	Very low	53.2	Low	135 Å²	135	102.3 Å²	102.3	72%	0.722	55%	0.551	S	S	*	*	T	Hydrogen-bonded Turn	trans	-108.5	10.1	-179.6	-68.1	-19.1	0	0	0	114.2	D234 E238	D234-N236 PolarHBondContact O-N 3.45Å; N236-E238 PolarHBondContact O-N 3.16Å
237	S	55.7	Low	55.9	Low	63 Å²	63	99.7 Å²	99.7	44%	0.441	54%	0.542	S	S	.	.			trans	-69.5	93.5	170.1	-67.1	0	0	0	0	110.1	D234 I239	D234-S237 PolarHBondContact O-N 3.03Å; S237-I239 PolarHBondContact O-N 3.09Å
238	E	71.9	Confident	58.4	Low	72 Å²	72	91.7 Å²	91.7	34%	0.336	51%	0.505	S	S	.	.	S	Bend	trans	-62.2	-23.8	179.9	-67.1	-175.3	159.3	0	0	113	L139 N236 S261 F264	L139-E238 HydrophobicContact CD1-CB 4.43Å; L139-E238 HydrophobicContact CD2-CB 4.21Å; L139-E238 WeakPolarHBondContact CD2-OE2 3.26Å; N236-E238 PolarHBondContact O-N 3.16Å; E238-S261 PolarHBondContact O-N 2.9Å; E238-F264 HydrophobicContact CB-CE2 4.45Å; E238-F264 HydrophobicContact CG-CE2 4.26Å; E238-F264 HydrophobicContact CG-CZ 4.44Å
239	I	76.1	Confident	60.9	Low	59 Å²	59	86 Å²	86	30%	0.303	49%	0.49	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	126.8	-179.5	-56.4	173.1	0	0	0	109.7	L136 L139 S237 K258 L259	L136-I239 HydrophobicContact CD2-CG1 4.25Å; L136-I239 HydrophobicContact CD2-CG2 4.09Å; L139-I239 HydrophobicContact CB-CD1 4.31Å; L139-I239 HydrophobicContact CB-CG1 4.44Å; L139-I239 HydrophobicContact CD1-CG1 4.3Å; S237-I239 PolarHBondContact O-N 3.09Å; I239-K258 HydrophobicContact CG2-CB 4.31Å; I239-L259 CarbonylContact C-O 3.6Å; I239-L259 WeakPolarHBondContact CA-O 3.18Å
240	I	79.9	Confident	63.4	Low	88 Å²	88	87 Å²	87	45%	0.451	50%	0.496	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.4	131.2	177.8	-55	172.7	0	0	0	108.7	V242 L259	I240-V242 HydrophobicContact CG2-CG2 3.87Å; I240-L259 PolarHBondContact N-O 3.15Å; I240-L259 PolarHBondContact O-N 3.44Å
241	N	80.4	Confident	65.8	Low	109 Å²	109	86.4 Å²	86.4	58%	0.583	48%	0.484	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-94.1	115.4	171.7	-66.5	-34.5	0	0	0	109.6	K258	N241-K258 WeakPolarHBondContact OD1-CG 3.4Å
242	V	81.9	Confident	68.4	Low	47 Å²	47	85.9 Å²	85.9	29%	0.285	48%	0.476	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-111.5	123.2	179	177.9	0	0	0	0	109.7	I240 V244 V257 L259	I240-V242 HydrophobicContact CG2-CG2 3.87Å; V242-V244 PolarHBondContact O-N 2.85Å; V242-V257 PolarHBondContact N-O 3.31Å; V242-V257 PolarHBondContact O-N 3.16Å; V242-L259 HydrophobicContact CB-CD1 3.98Å; V242-L259 HydrophobicContact CG2-CD1 3.64Å
243	P	81.1	Confident	70.8	Confident	78 Å²	78	82.9 Å²	82.9	51%	0.506	46%	0.456	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-75.2	116.5	172.1	29.5	-31.5	0	0	0	110.1	T254	P243-T254 HydrophobicContact CB-CG2 3.79Å
244	V	82.1	Confident	73.4	Confident	6 Å²	6	79.8 Å²	79.8	4%	0.036	44%	0.442	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-88	122.2	171.8	179.9	0	0	0	0	108.8	L11 R15 M18 V242 T254 T255 V257	L11-V244 HydrophobicContact CD2-CG2 3.59Å; R15-V244 HydrophobicContact CB-CG1 4.08Å; R15-V244 HydrophobicContact CG-CG1 4.46Å; M18-V244 HydrophobicContact SD-CB 4.48Å; M18-V244 HydrophobicContact SD-CG1 4.04Å; V242-V244 PolarHBondContact O-N 2.85Å; V244-T254 CarbonylContact O-C 3.3Å; V244-T254 VanDerWaalsContact O-CA 3.31Å; V244-T254 WeakPolarHBondContact O-CA 3.2Å; V244-T255 PolarHBondContact N-O 2.81Å; V244-T255 PolarHBondContact O-N 3.35Å; V244-V257 HydrophobicContact CB-CG2 4.28Å; V244-V257 HydrophobicContact CG2-CB 4.17Å; V244-V257 HydrophobicContact CG2-CG2 3.58Å
245	Q	84.1	Confident	75.5	Confident	108 Å²	108	77.4 Å²	77.4	51%	0.505	43%	0.431	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-110.5	139.2	-179.7	-60.3	-174.6	-0.8	0	0	111.4	I252 Y253 T254	Q245-I252 HydrophobicContact CB-CG2 4.27Å; Q245-Y253 CarbonylContact C-O 3.5Å; Q245-Y253 VanDerWaalsContact CA-O 3.31Å; Q245-Y253 WeakPolarHBondContact CA-O 3.49Å; Q245-T254 HydrophobicContact CG-CG2 3.94Å
246	V	81.1	Confident	77.6	Confident	7 Å²	7	74.6 Å²	74.6	4%	0.042	43%	0.428	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-124.6	123.5	172.2	165.7	0	0	0	0	107.9	R15 M18 C19 I248 I252 Y253	R15-V246 HydrophobicContact CB-CG2 4.43Å; R15-V246 HydrophobicContact CG-CG2 3.44Å; R15-V246 VanDerWaalsContact CG-CG2 3.44Å; M18-V246 HydrophobicContact CB-CG2 3.91Å; M18-V246 HydrophobicContact CE-CB 4.24Å; M18-V246 HydrophobicContact CE-CG2 3.94Å; M18-V246 HydrophobicContact SD-CG2 4.22Å; C19-V246 WeakPolarHBondContact SG-CG1 3.5Å; V246-I248 HydrophobicContact CG1-CD1 3.76Å; V246-I248 HydrophobicContact CG1-CG1 3.75Å; V246-I252 WeakPolarHBondContact O-CA 3.44Å; V246-Y253 PolarHBondContact N-O 3.12Å; V246-Y253 PolarHBondContact O-N 3.29Å
247	N	81.2	Confident	79.3	Confident	106 Å²	106	68.8 Å²	68.8	57%	0.567	40%	0.397	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-100.6	116.1	173.4	-174.3	3	0	0	0	109.9	A249	N247-A249 PolarHBondContact OD1-O 3.07Å
248	I	77.3	Confident	80.7	Confident	12 Å²	12	72.4 Å²	72.4	6%	0.062	41%	0.405	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-119.1	115.2	172.6	-66.3	163.1	0	0	0	107.4	Q22 V36 A39 V246 S250 V251 Y253	Q22-I248 HydrophobicContact CB-CD1 3.99Å; Q22-I248 HydrophobicContact CG-CD1 3.6Å; V36-I248 HydrophobicContact CG2-CG2 3.9Å; A39-I248 HydrophobicContact CB-CG1 4.15Å; V246-I248 HydrophobicContact CG1-CD1 3.76Å; V246-I248 HydrophobicContact CG1-CG1 3.75Å; I248-S250 PolarHBondContact O-N 2.81Å; I248-V251 PolarHBondContact N-O 3.27Å; I248-V251 PolarHBondContact O-N 2.94Å; I248-Y253 HydrophobicContact CB-CE2 4.18Å; I248-Y253 HydrophobicContact CD1-CD2 4.19Å; I248-Y253 HydrophobicContact CD1-CE2 4.02Å
249	A	76.4	Confident	81.2	Confident	64 Å²	64	69.3 Å²	69.3	53%	0.529	39%	0.391	S	S	.	.	T	Hydrogen-bonded Turn	trans	55	-104.4	-175.6	0	0	0	0	0	112.5	V35 N247	V35-A249 HydrophobicContact CG1-CB 3.93Å; N247-A249 PolarHBondContact OD1-O 3.07Å
250	S	76.3	Confident	81.5	Confident	120 Å²	120	66.6 Å²	66.6	84%	0.839	38%	0.377	S	S	*	.	T	Hydrogen-bonded Turn	trans	-113.3	6.4	179.6	-54.1	0	0	0	0	113	I248	I248-S250 PolarHBondContact O-N 2.81Å
251	V	80.1	Confident	81.4	Confident	77 Å²	77	63.7 Å²	63.7	47%	0.467	36%	0.364	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-112.6	127.3	-176.4	-175.4	0	0	0	0	109.6	I248 Y253	I248-V251 PolarHBondContact N-O 3.27Å; I248-V251 PolarHBondContact O-N 2.94Å; V251-Y253 HydrophobicContact CB-CE2 3.99Å; V251-Y253 HydrophobicContact CG1-CD2 4.18Å; V251-Y253 HydrophobicContact CG1-CE1 4.25Å; V251-Y253 HydrophobicContact CG1-CE2 3.65Å
252	I	82.9	Confident	81.1	Confident	103 Å²	103	59.9 Å²	59.9	53%	0.528	35%	0.346	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-103.1	113.8	176.6	-56.6	173.1	0	0	0	108.5	Q245 V246	Q245-I252 HydrophobicContact CB-CG2 4.27Å; V246-I252 WeakPolarHBondContact O-CA 3.44Å
253	Y	82.2	Confident	80.8	Confident	80 Å²	80	65.4 Å²	65.4	31%	0.314	37%	0.367	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-91.3	128.7	172.7	-60.2	-92.4	0	0	0	108.8	Q22 Q245 V246 I248 V251	Q22-Y253 PolarHBondContact OE1-OH 3.43Å; Q245-Y253 CarbonylContact C-O 3.5Å; Q245-Y253 VanDerWaalsContact CA-O 3.31Å; Q245-Y253 WeakPolarHBondContact CA-O 3.49Å; V246-Y253 PolarHBondContact N-O 3.12Å; V246-Y253 PolarHBondContact O-N 3.29Å; I248-Y253 HydrophobicContact CB-CE2 4.18Å; I248-Y253 HydrophobicContact CD1-CD2 4.19Å; I248-Y253 HydrophobicContact CD1-CE2 4.02Å; V251-Y253 HydrophobicContact CB-CE2 3.99Å; V251-Y253 HydrophobicContact CG1-CD2 4.18Å; V251-Y253 HydrophobicContact CG1-CE1 4.25Å; V251-Y253 HydrophobicContact CG1-CE2 3.65Å
254	T	84.4	Confident	80.4	Confident	72 Å²	72	66.3 Å²	66.3	44%	0.442	36%	0.362	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-126	128.6	-180	-54.6	0	0	0	0	110.4	P243 V244 Q245	P243-T254 HydrophobicContact CB-CG2 3.79Å; V244-T254 CarbonylContact O-C 3.3Å; V244-T254 VanDerWaalsContact O-CA 3.31Å; V244-T254 WeakPolarHBondContact O-CA 3.2Å; Q245-T254 HydrophobicContact CG-CG2 3.94Å
255	T	82.4	Confident	80.3	Confident	48 Å²	48	66.1 Å²	66.1	29%	0.294	36%	0.361	S	S	.	.	E	Extended strand (participates in β ladder)	trans	-122.7	130.3	173.1	54.2	0	0	0	0	110.1	M18 V244 V257	M18-T255 HydrophobicContact CE-CG2 3.62Å; M18-T255 HydrophobicContact SD-CG2 3.89Å; M18-T255 PolarHBondContact SD-OG1 2.74Å; V244-T255 PolarHBondContact N-O 2.81Å; V244-T255 PolarHBondContact O-N 3.35Å; T255-V257 PolarHBondContact O-N 2.66Å
256	P	83.8	Confident	80.2	Confident	113 Å²	113	65.7 Å²	65.7	73%	0.734	37%	0.366	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-76	124.2	172.9	30.1	-31.6	0	0	0	109.6
257	V	84.3	Confident	80.3	Confident	13 Å²	13	67.4 Å²	67.4	8%	0.079	38%	0.375	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-113	127.4	176.6	179.5	0	0	0	0	108.8	Y10 L11 V14 V242 V244 T255 L259	Y10-V257 HydrophobicContact CD1-CG1 4.44Å; Y10-V257 HydrophobicContact CE1-CG1 3.67Å; L11-V257 HydrophobicContact CD2-CB 4.4Å; L11-V257 HydrophobicContact CD2-CG1 4.19Å; V14-V257 HydrophobicContact CG1-CG2 4.12Å; V242-V257 PolarHBondContact N-O 3.31Å; V242-V257 PolarHBondContact O-N 3.16Å; V244-V257 HydrophobicContact CB-CG2 4.28Å; V244-V257 HydrophobicContact CG2-CB 4.17Å; V244-V257 HydrophobicContact CG2-CG2 3.58Å; T255-V257 PolarHBondContact O-N 2.66Å; V257-L259 HydrophobicContact CG1-CD2 4.12Å; V257-L259 HydrophobicContact CG1-CG 4.34Å
258	K	83.9	Confident	80.5	Confident	138 Å²	138	64 Å²	64	60%	0.6	36%	0.359	S	S	*	.	E	Extended strand (participates in β ladder)	trans	-80.4	133.6	172.2	-58.4	-171.8	176.7	177.1	0	108.7	L136 I239 N241	L136-K258 HydrophobicContact CD1-CB 4.11Å; L136-K258 WeakPolarHBondContact CD1-O 3.3Å; L136-K258 HydrophobicContact CD2-CB 4.34Å; I239-K258 HydrophobicContact CG2-CB 4.31Å; N241-K258 WeakPolarHBondContact OD1-CG 3.4Å
259	L	83.2	Confident	81.1	Confident	8 Å²	8	68.1 Å²	68.1	4%	0.042	39%	0.387	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-129.6	136.9	178.6	-67.3	172.6	0	0	0	110.5	I7 Y10 L11 I239 I240 V242 V257	I7-L259 HydrophobicContact CG2-CD1 3.69Å; I7-L259 HydrophobicContact CG2-CD2 4.03Å; I7-L259 HydrophobicContact CG2-CG 4.43Å; Y10-L259 HydrophobicContact CD1-CD2 3.96Å; Y10-L259 HydrophobicContact CE1-CD2 4.23Å; L11-L259 HydrophobicContact CD1-CD1 4.06Å; L11-L259 HydrophobicContact CD2-CD1 4.08Å; L11-L259 HydrophobicContact CD2-CD2 4.24Å; L11-L259 HydrophobicContact CG-CD1 4.32Å; I239-L259 CarbonylContact C-O 3.6Å; I239-L259 WeakPolarHBondContact CA-O 3.18Å; I240-L259 PolarHBondContact N-O 3.15Å; I240-L259 PolarHBondContact O-N 3.44Å; V242-L259 HydrophobicContact CB-CD1 3.98Å; V242-L259 HydrophobicContact CG2-CD1 3.64Å; V257-L259 HydrophobicContact CG1-CD2 4.12Å; V257-L259 HydrophobicContact CG1-CG 4.34Å
260	P	82.2	Confident	81.9	Confident	1 Å²	1	71 Å²	71	1%	0.006	39%	0.389	C	S	.	.	E	Extended strand (participates in β ladder)	trans	-74.5	154.5	168.6	32.2	-32.9	0	0	0	110.1	I132 C135 L136 L139 S262 L265	I132-P260 HydrophobicContact CG2-CG 4.28Å; C135-P260 HydrophobicContact CB-CB 4.4Å; C135-P260 HydrophobicContact CB-CG 4.24Å; L136-P260 HydrophobicContact CD2-CB 4.17Å; L136-P260 HydrophobicContact CD2-CG 4.44Å; L136-P260 HydrophobicContact CG-CG 4.41Å; L139-P260 HydrophobicContact CD1-CB 3.9Å; P260-S262 PolarHBondContact O-N 3.45Å; P260-L265 HydrophobicContact CG-CD2 3.79Å; P260-L265 HydrophobicContact CG-CG 4.34Å
261	S	78	Confident	82.6	Confident	27 Å²	27	65.2 Å²	65.2	19%	0.189	35%	0.349	C	S	.	.			trans	-57.4	137.2	169.2	-178.2	0	0	0	0	111	E238 K263 F264	E238-S261 PolarHBondContact O-N 2.9Å; S261-K263 PolarHBondContact O-N 2.86Å; S261-F264 PolarHBondContact O-N 3.43Å
262	S	75.2	Confident	83.2	Confident	29 Å²	29	64.7 Å²	64.7	20%	0.203	34%	0.34	C	S	.	.	G	3₁₀ helix	trans	-60.8	-17.6	-173.7	65.5	0	0	0	0	113.8	Y3 D4 P260 F264	Y3-S262 WeakPolarHBondContact CB-O 3.12Å; D4-S262 VanDerWaalsContact OD1-CB 3.24Å; D4-S262 WeakPolarHBondContact OD1-CB 2.97Å; D4-S262 PolarHBondContact OD1-OG 3.27Å; P260-S262 PolarHBondContact O-N 3.45Å; S262-F264 VanDerWaalsContact C-N 3.29Å; S262-F264 PolarHBondContact O-N 2.91Å
263	K	74	Confident	83.7	Confident	164 Å²	164	65.7 Å²	65.7	71%	0.713	34%	0.343	S	S	*	.	G	3₁₀ helix	trans	-66.7	-23.7	176.1	-60.9	176.9	-175.4	170.8	0	113.9	S261	S261-K263 PolarHBondContact O-N 2.86Å
264	F	74.1	Confident	84.4	Confident	96 Å²	96	62.1 Å²	62.1	42%	0.421	33%	0.329	S	S	.	.	G	3₁₀ helix	trans	-93.8	-9.7	-176.7	-62.4	-68.1	0	0	0	113.9	L139 E238 S261 S262	L139-F264 HydrophobicContact CD1-CD2 4.41Å; L139-F264 HydrophobicContact CD2-CD2 4.43Å; L139-F264 HydrophobicContact CD2-CE2 4.35Å; L139-F264 HydrophobicContact CD2-CZ 4.48Å; E238-F264 HydrophobicContact CB-CE2 4.45Å; E238-F264 HydrophobicContact CG-CE2 4.26Å; E238-F264 HydrophobicContact CG-CZ 4.44Å; S261-F264 PolarHBondContact O-N 3.43Å; S262-F264 VanDerWaalsContact C-N 3.29Å; S262-F264 PolarHBondContact O-N 2.91Å
265	L	80.4	Confident	84.9	Confident	2 Å²	2	58.7 Å²	58.7	1%	0.01	31%	0.308	C	S	.	.			trans	-78.2	130.4	-178.4	-65	176.7	0	0	0	110.1	Y3 L6 I7 I132 C135 P260	Y3-L265 HydrophobicContact CD1-CB 4.22Å; Y3-L265 WeakPolarHBondContact CD1-O 3.21Å; Y3-L265 WeakPolarHBondContact CE1-O 3.04Å; L6-L265 HydrophobicContact CB-CD1 4.38Å; L6-L265 HydrophobicContact CD1-CB 4.41Å; I7-L265 HydrophobicContact CD1-CD1 3.9Å; I7-L265 HydrophobicContact CG1-CD1 3.54Å; I132-L265 HydrophobicContact CG1-CD2 4.13Å; C135-L265 HydrophobicContact CB-CD2 4.26Å; P260-L265 HydrophobicContact CG-CD2 3.79Å; P260-L265 HydrophobicContact CG-CG 4.34Å
266	T	80.9	Confident	85.5	Confident	99 Å²	99	58.5 Å²	58.5	61%	0.607	31%	0.305	S	S	*	.			trans	-125.3	142.6	171.6	57.6	0	0	0	0	109.4	T131 S268	T131-T266 WeakPolarHBondContact CG2-O 3.32Å; T266-S268 PolarHBondContact O-N 3.21Å
267	I	82.8	Confident	86	Confident	43 Å²	43	56.5 Å²	56.5	22%	0.221	29%	0.286	C	S	.	.			trans	-79.1	116.1	175.7	-64.6	174.1	0	0	0	107	M1 L6 A58 L271 F272	M1-I267 HydrophobicContact CE-CD1 4.49Å; M1-I267 HydrophobicContact SD-CD1 3.55Å; M1-I267 VanDerWaalsContact SD-CD1 3.55Å; L6-I267 HydrophobicContact CD1-CG1 4Å; A58-I267 HydrophobicContact CB-CD1 4.02Å; I267-L271 HydrophobicContact CG2-CB 4.14Å; I267-L271 HydrophobicContact CG2-CD2 4.09Å; I267-L271 HydrophobicContact CG2-CG 4.09Å; I267-F272 HydrophobicContact CG2-CB 4.07Å
268	S	86.9	Confident	86.6	Confident	34 Å²	34	55.9 Å²	55.9	24%	0.238	28%	0.282	C	S	.	.			trans	-63.2	150.1	172.9	72.4	0	0	0	0	110.3	T266 E270 L271 F272	T266-S268 PolarHBondContact O-N 3.21Å; S268-E270 PolarHBondContact O-N 3.41Å; S268-L271 PolarHBondContact O-N 2.95Å; S268-L271 VanDerWaalsContact O-N 3.12Å; S268-L271 VanDerWaalsContact OG-CB 3.3Å; S268-L271 WeakPolarHBondContact OG-CB 3.44Å; S268-L271 PolarHBondContact OG-N 3.44Å; S268-F272 PolarHBondContact O-N 3.31Å
269	P	88.4	Confident	87.1	Confident	100 Å²	100	49.4 Å²	49.4	65%	0.649	25%	0.254	S	S	*	.	H	α-helix	trans	-59	-32.6	175.7	23.9	-33.6	0	0	0	111.9	F272 H273	P269-F272 PolarHBondContact O-N 2.97Å; P269-H273 PolarHBondContact O-CD2 3.2Å; P269-H273 PolarHBondContact O-N 2.95Å
270	E	92.9	Very high	87.7	Confident	123 Å²	123	50.9 Å²	50.9	58%	0.575	27%	0.265	S	S	*	.	H	α-helix	trans	-64.4	-43.9	174.6	-174.6	178.7	-172.5	0	0	112.6	L127 S268 F272 H273 T274	L127-E270 HydrophobicContact CD1-CG 4.08Å; L127-E270 HydrophobicContact CD2-CG 4.1Å; S268-E270 PolarHBondContact O-N 3.41Å; E270-F272 VanDerWaalsContact C-N 3.33Å; E270-F272 PolarHBondContact O-N 2.86Å; E270-H273 PolarHBondContact O-N 3.43Å; E270-T274 WeakPolarHBondContact O-CB 3.28Å; E270-T274 PolarHBondContact O-N 3.1Å; E270-T274 PolarHBondContact O-OG1 3.34Å
271	L	92.5	Very high	88.3	Confident	0 Å²	0	50.9 Å²	50.9	0%	0	27%	0.265	C	S	.	.	H	α-helix	trans	-62.8	-42.4	174.2	177.1	59.2	0	0	0	110.5	L6 V124 L127 V128 I267 S268 H273 T274 L275	L6-L271 HydrophobicContact CD2-CD2 4.06Å; V124-L271 HydrophobicContact CG1-CD1 4.12Å; L127-L271 HydrophobicContact CB-CD1 4.03Å; V128-L271 HydrophobicContact CG2-CD1 3.89Å; V128-L271 HydrophobicContact CG2-CD2 4.05Å; I267-L271 HydrophobicContact CG2-CB 4.14Å; I267-L271 HydrophobicContact CG2-CD2 4.09Å; I267-L271 HydrophobicContact CG2-CG 4.09Å; S268-L271 PolarHBondContact O-N 2.95Å; S268-L271 VanDerWaalsContact O-N 3.12Å; S268-L271 VanDerWaalsContact OG-CB 3.3Å; S268-L271 WeakPolarHBondContact OG-CB 3.44Å; S268-L271 PolarHBondContact OG-N 3.44Å; L271-H273 PolarHBondContact O-N 3.42Å; L271-T274 PolarHBondContact O-N 2.92Å; L271-L275 HydrophobicContact CD1-CD1 4.16Å; L271-L275 HydrophobicContact CD1-CG 4.06Å; L271-L275 HydrophobicContact CG-CD1 3.97Å; L271-L275 HydrophobicContact CG-CG 4.35Å; L271-L275 WeakPolarHBondContact O-CB 3.46Å; L271-L275 WeakPolarHBondContact O-CG 3.47Å; L271-L275 PolarHBondContact O-N 2.81Å
272	F	92.3	Very high	89.1	Confident	65 Å²	65	49.6 Å²	49.6	29%	0.285	26%	0.256	S	S	.	.	H	α-helix	trans	-59.6	-46.9	176.8	-176	-96.3	0	0	0	112.4	L59 I267 S268 P269 E270 L275 L276	L59-F272 HydrophobicContact CD2-CD2 4.09Å; L59-F272 HydrophobicContact CD2-CE2 3.72Å; L59-F272 HydrophobicContact CD2-CZ 4.18Å; I267-F272 HydrophobicContact CG2-CB 4.07Å; S268-F272 PolarHBondContact O-N 3.31Å; P269-F272 PolarHBondContact O-N 2.97Å; E270-F272 VanDerWaalsContact C-N 3.33Å; E270-F272 PolarHBondContact O-N 2.86Å; F272-L275 PolarHBondContact O-N 3.23Å; F272-L276 HydrophobicContact CD1-CD1 4.06Å; F272-L276 HydrophobicContact CE1-CD1 3.64Å; F272-L276 HydrophobicContact CE1-CG 4.27Å; F272-L276 HydrophobicContact CZ-CD1 4.32Å; F272-L276 PolarHBondContact O-N 3.28Å; F272-L276 VanDerWaalsContact O-N 3.1Å
273	H	94.1	Very high	89.8	Confident	125 Å²	125	48.4 Å²	48.4	58%	0.579	25%	0.248	S	C	*	.	H	α-helix	trans	-63.6	-40.9	176.3	-74.7	-57.6	0	0	0	112.6	P269 E270 L271 L275 L276 E277	P269-H273 PolarHBondContact O-CD2 3.2Å; P269-H273 PolarHBondContact O-N 2.95Å; E270-H273 PolarHBondContact O-N 3.43Å; L271-H273 PolarHBondContact O-N 3.42Å; H273-L275 VanDerWaalsContact C-N 3.32Å; H273-L275 PolarHBondContact O-N 3.38Å; H273-L276 WeakPolarHBondContact O-CB 3.31Å; H273-L276 PolarHBondContact O-N 2.85Å; H273-E277 PolarHBondContact O-N 2.86Å
274	T	95.4	Very high	90.6	Very high	5 Å²	5	46.7 Å²	46.7	3%	0.031	24%	0.237	C	C	.	.	H	α-helix	trans	-68.4	-32.3	177.7	-53.1	0	0	0	0	111.6	T120 R123 V124 L127 E270 L271 E277 L278	T120-T274 HydrophobicContact CG2-CG2 4.27Å; R123-T274 HydrophobicContact CB-CG2 4.06Å; R123-T274 PolarHBondContact NH2-OG1 3.16Å; V124-T274 HydrophobicContact CG2-CG2 3.54Å; L127-T274 HydrophobicContact CD1-CG2 4.1Å; L127-T274 WeakPolarHBondContact CD1-OG1 3.34Å; E270-T274 WeakPolarHBondContact O-CB 3.28Å; E270-T274 PolarHBondContact O-N 3.1Å; E270-T274 PolarHBondContact O-OG1 3.34Å; L271-T274 PolarHBondContact O-N 2.92Å; T274-E277 PolarHBondContact O-N 3.21Å; T274-L278 WeakPolarHBondContact O-CB 2.99Å; T274-L278 PolarHBondContact O-N 3.07Å
275	L	95.2	Very high	91.6	Very high	0 Å²	0	42.1 Å²	42.1	0%	0	22%	0.217	C	C	.	.	H	α-helix	trans	-67.4	-37.3	173.1	-73.3	168.3	0	0	0	112.3	L54 L55 A58 L59 V124 L271 F272 H273 E277 L278 D279	L54-L275 HydrophobicContact CD2-CD2 3.93Å; L54-L275 HydrophobicContact CG-CD2 4.16Å; L55-L275 HydrophobicContact CD2-CB 4.25Å; L55-L275 HydrophobicContact CD2-CD2 3.93Å; L55-L275 WeakPolarHBondContact CD2-O 3.46Å; A58-L275 HydrophobicContact CB-CD1 3.76Å; L59-L275 HydrophobicContact CD1-CB 4.46Å; L59-L275 HydrophobicContact CD2-CB 4.12Å; L59-L275 HydrophobicContact CG-CB 4.45Å; V124-L275 HydrophobicContact CG1-CD2 3.85Å; V124-L275 HydrophobicContact CG2-CD2 4.23Å; L271-L275 HydrophobicContact CD1-CD1 4.16Å; L271-L275 HydrophobicContact CD1-CG 4.06Å; L271-L275 HydrophobicContact CG-CD1 3.97Å; L271-L275 HydrophobicContact CG-CG 4.35Å; L271-L275 WeakPolarHBondContact O-CB 3.46Å; L271-L275 WeakPolarHBondContact O-CG 3.47Å; L271-L275 PolarHBondContact O-N 2.81Å; F272-L275 PolarHBondContact O-N 3.23Å; H273-L275 VanDerWaalsContact C-N 3.32Å; H273-L275 PolarHBondContact O-N 3.38Å; L275-E277 VanDerWaalsContact C-N 3.35Å; L275-L278 HydrophobicContact CD2-CD2 4.49Å; L275-L278 PolarHBondContact O-N 2.93Å; L275-D279 PolarHBondContact O-N 2.8Å
276	L	94.8	Very high	92	Very high	44 Å²	44	42 Å²	42	23%	0.23	22%	0.216	C	C	.	.	H	α-helix	trans	-63.2	-43	172.9	-73.1	171.5	0	0	0	111.7	L59 A63 F272 H273 D279 C280	L59-L276 HydrophobicContact CD1-CD2 4.16Å; L59-L276 HydrophobicContact CD2-CD2 3.71Å; L59-L276 HydrophobicContact CD2-CG 3.91Å; L59-L276 HydrophobicContact CG-CD2 4.48Å; A63-L276 HydrophobicContact CB-CD2 3.91Å; F272-L276 HydrophobicContact CD1-CD1 4.06Å; F272-L276 HydrophobicContact CE1-CD1 3.64Å; F272-L276 HydrophobicContact CE1-CG 4.27Å; F272-L276 HydrophobicContact CZ-CD1 4.32Å; F272-L276 PolarHBondContact O-N 3.28Å; F272-L276 VanDerWaalsContact O-N 3.1Å; H273-L276 WeakPolarHBondContact O-CB 3.31Å; H273-L276 PolarHBondContact O-N 2.85Å; L276-D279 PolarHBondContact O-N 3.43Å; L276-C280 PolarHBondContact O-N 2.89Å; L276-C280 VanDerWaalsContact O-N 3.15Å; L276-C280 PolarHBondContact O-SG 2.94Å
277	E	95.3	Very high	92.3	Very high	71 Å²	71	39.3 Å²	39.3	33%	0.332	20%	0.196	S	C	.	.	H	α-helix	trans	-61.9	-46.5	174.1	-167.5	-174	157.7	0	0	110.7	T120 R123 H273 T274 L275 D279 C280 C281	T120-E277 HydrophobicContact CG2-CB 4.07Å; T120-E277 HydrophobicContact CG2-CG 3.94Å; R123-E277 IonicContact CZ-OE1 3.84Å; R123-E277 IonicContact CZ-OE2 3.29Å; R123-E277 VanDerWaalsContact CZ-OE2 3.29Å; R123-E277 IonicContact NH1-OE1 2.77Å; R123-E277 PolarHBondContact NH1-OE1 3.29Å; R123-E277 IonicContact NH1-OE2 2.93Å; R123-E277 PolarHBondContact NH1-OE2 3.23Å; R123-E277 IonicContact NH2-OE2 2.76Å; R123-E277 PolarHBondContact NH2-OE2 3.03Å; H273-E277 PolarHBondContact O-N 2.86Å; T274-E277 PolarHBondContact O-N 3.21Å; L275-E277 VanDerWaalsContact C-N 3.35Å; E277-D279 VanDerWaalsContact C-N 3.33Å; E277-D279 PolarHBondContact O-N 3.28Å; E277-C280 WeakPolarHBondContact O-CB 3.1Å; E277-C280 PolarHBondContact O-N 3.19Å; E277-C280 VanDerWaalsContact O-N 3.11Å; E277-C281 PolarHBondContact O-N 3.03Å; E277-C281 PolarHBondContact O-SG 3.02Å
278	L	96.2	Very high	92.5	Very high	0 Å²	0	39.1 Å²	39.1	0%	0	20%	0.195	C	C	.	.	H	α-helix	trans	-58.4	-43.4	177.7	-179.3	62.9	0	0	0	111.9	T51 L55 F117 T120 H121 V124 T274 L275 C280 C281 A282	T51-L278 HydrophobicContact CG2-CD2 3.8Å; L55-L278 HydrophobicContact CD2-CD2 4.36Å; F117-L278 HydrophobicContact CD2-CD1 3.83Å; F117-L278 HydrophobicContact CE2-CD1 3.63Å; T120-L278 HydrophobicContact CG2-CB 3.93Å; T120-L278 HydrophobicContact CG2-CD1 4.3Å; H121-L278 HydrophobicContact CB-CD1 3.92Å; V124-L278 HydrophobicContact CB-CD2 4.29Å; V124-L278 HydrophobicContact CG1-CD2 4.43Å; V124-L278 HydrophobicContact CG2-CB 4.2Å; V124-L278 HydrophobicContact CG2-CD2 3.83Å; T274-L278 WeakPolarHBondContact O-CB 2.99Å; T274-L278 PolarHBondContact O-N 3.07Å; L275-L278 HydrophobicContact CD2-CD2 4.49Å; L275-L278 PolarHBondContact O-N 2.93Å; L278-C280 VanDerWaalsContact C-N 3.31Å; L278-C280 PolarHBondContact O-N 3.39Å; L278-C281 PolarHBondContact O-N 3.45Å; L278-A282 WeakPolarHBondContact O-CB 3.05Å; L278-A282 PolarHBondContact O-N 3.42Å
279	D	95.1	Very high	92.5	Very high	2 Å²	2	39.3 Å²	39.3	1%	0.011	19%	0.192	C	C	.	.	H	α-helix	trans	-64.1	-37.9	177.9	-172.5	47.3	0	0	0	111.9	L55 L59 R64 H65 R67 L275 L276 E277 A283	L55-D279 HydrophobicContact CD1-CB 4.26Å; L55-D279 HydrophobicContact CD2-CB 4.16Å; L59-D279 HydrophobicContact CD1-CB 3.93Å; R64-D279 WeakPolarHBondContact CA-OD2 3.4Å; R64-D279 WeakPolarHBondContact CB-OD2 3.14Å; H65-D279 PolarHBondContact N-OD2 2.9Å; R67-D279 IonicContact CZ-OD1 2.74Å; R67-D279 VanDerWaalsContact CZ-OD1 3.28Å; R67-D279 IonicContact NH1-OD1 3.71Å; R67-D279 PolarHBondContact NH1-OD1 3.16Å; R67-D279 IonicContact NH1-OD2 3.61Å; R67-D279 PolarHBondContact NH2-O 3.25Å; R67-D279 IonicContact NH2-OD1 2.81Å; R67-D279 PolarHBondContact NH2-OD1 2.8Å; L275-D279 PolarHBondContact O-N 2.8Å; L276-D279 PolarHBondContact O-N 3.43Å; E277-D279 VanDerWaalsContact C-N 3.33Å; E277-D279 PolarHBondContact O-N 3.28Å; D279-A283 WeakPolarHBondContact O-CB 3.26Å; D279-A283 PolarHBondContact O-N 3.27Å
280	C	95	Very high	92.2	Very high	38 Å²	38	34.9 Å²	34.9	26%	0.257	16%	0.163	S	C	.	.	H	α-helix	trans	-65.7	-48.7	173.4	-67	0	0	0	0	111.8	L276 E277 L278 A282 A283 R284	L276-C280 PolarHBondContact O-N 2.89Å; L276-C280 VanDerWaalsContact O-N 3.15Å; L276-C280 PolarHBondContact O-SG 2.94Å; E277-C280 WeakPolarHBondContact O-CB 3.1Å; E277-C280 PolarHBondContact O-N 3.19Å; E277-C280 VanDerWaalsContact O-N 3.11Å; L278-C280 VanDerWaalsContact C-N 3.31Å; L278-C280 PolarHBondContact O-N 3.39Å; C280-A282 VanDerWaalsContact C-N 3.34Å; C280-A282 PolarHBondContact O-N 3.47Å; C280-A283 PolarHBondContact O-N 2.94Å; C280-R284 WeakPolarHBondContact O-CG 3.44Å; C280-R284 PolarHBondContact O-N 2.92Å
281	C	95.1	Very high	91.5	Very high	1 Å²	1	33.1 Å²	33.1	1%	0.007	15%	0.151	C	C	.	.	H	α-helix	trans	-62.3	-41.8	178	-63.4	0	0	0	0	111.4	F117 E277 L278 A283 R284 F285	F117-C281 HydrophobicContact CB-CB 4.34Å; F117-C281 HydrophobicContact CD2-CB 4.46Å; E277-C281 PolarHBondContact O-N 3.03Å; E277-C281 PolarHBondContact O-SG 3.02Å; L278-C281 PolarHBondContact O-N 3.45Å; C281-A283 PolarHBondContact O-N 3.06Å; C281-R284 PolarHBondContact O-N 2.74Å; C281-F285 WeakPolarHBondContact O-CB 3.14Å; C281-F285 PolarHBondContact O-N 3.36Å
282	A	94.1	Very high	90.9	Very high	1 Å²	1	34 Å²	34	1%	0.008	16%	0.157	C	C	.	.	H	α-helix	trans	-60.9	-44	175.6	0	0	0	0	0	111.6	F52 F117 L278 C280 E286	F52-A282 HydrophobicContact CZ-CB 4.42Å; F117-A282 HydrophobicContact CD2-CB 3.87Å; F117-A282 HydrophobicContact CE2-CB 3.63Å; L278-A282 WeakPolarHBondContact O-CB 3.05Å; L278-A282 PolarHBondContact O-N 3.42Å; C280-A282 VanDerWaalsContact C-N 3.34Å; C280-A282 PolarHBondContact O-N 3.47Å; A282-E286 WeakPolarHBondContact O-CB 3.35Å; A282-E286 PolarHBondContact O-N 3.49Å
283	A	91.3	Very high	90	Very high	4 Å²	4	34.9 Å²	34.9	3%	0.033	17%	0.168	C	C	.	.	H	α-helix	trans	-65.5	-38.3	177.4	0	0	0	0	0	112.7	H65 R67 D279 C280 C281 F287	H65-A283 HydrophobicContact CB-CB 4.12Å; H65-A283 VanDerWaalsContact CD2-CB 3.46Å; H65-A283 WeakPolarHBondContact CD2-CB 3.19Å; R67-A283 HydrophobicContact CG-CB 3.85Å; D279-A283 WeakPolarHBondContact O-CB 3.26Å; D279-A283 PolarHBondContact O-N 3.27Å; C280-A283 PolarHBondContact O-N 2.94Å; C281-A283 PolarHBondContact O-N 3.06Å; A283-F287 WeakPolarHBondContact O-CB 3.39Å; A283-F287 PolarHBondContact O-N 3.49Å; A283-F287 VanDerWaalsContact O-N 3.07Å
284	R	91.1	Very high	89	Confident	127 Å²	127	29.9 Å²	29.9	48%	0.479	15%	0.147	S	C	.	.	H	α-helix	trans	-64.8	-52.7	174.7	-71.9	176.1	-175.1	159.2	2.9	111.4	E116 C280 C281 E286 F287 D288	E116-R284 IonicContact OE1-NH1 2.75Å; E116-R284 PolarHBondContact OE1-NH1 3.48Å; C280-R284 WeakPolarHBondContact O-CG 3.44Å; C280-R284 PolarHBondContact O-N 2.92Å; C281-R284 PolarHBondContact O-N 2.74Å; R284-E286 VanDerWaalsContact C-N 3.32Å; R284-E286 PolarHBondContact O-N 3.3Å; R284-F287 WeakPolarHBondContact O-CB 3.31Å; R284-F287 PolarHBondContact O-N 2.86Å; R284-D288 PolarHBondContact O-N 2.87Å
285	F	93.3	Very high	87.6	Confident	0 Å²	0	36.1 Å²	36.1	0%	0	17%	0.17	C	C	.	.	H	α-helix	trans	-59.7	-44.1	178.1	170.3	-116.5	0	0	0	111.7	L86 A89 A90 V93 A110 A114 F117 C281 F287 D288 F289	L86-F285 HydrophobicContact CB-CE1 4.38Å; L86-F285 HydrophobicContact CD2-CD1 4.08Å; L86-F285 HydrophobicContact CD2-CE1 3.87Å; L86-F285 WeakPolarHBondContact O-CE1 3.26Å; A89-F285 HydrophobicContact CB-CE1 4.41Å; A89-F285 HydrophobicContact CB-CZ 4.21Å; A90-F285 VanDerWaalsContact CA-CZ 3.44Å; A90-F285 HydrophobicContact CB-CD1 4.26Å; A90-F285 HydrophobicContact CB-CE1 3.67Å; A90-F285 HydrophobicContact CB-CE2 4.31Å; A90-F285 HydrophobicContact CB-CZ 3.71Å; V93-F285 HydrophobicContact CG2-CE2 4.23Å; V93-F285 HydrophobicContact CG2-CZ 4.36Å; A110-F285 HydrophobicContact CB-CE2 4.45Å; A114-F285 HydrophobicContact CB-CD2 3.73Å; A114-F285 HydrophobicContact CB-CE2 3.6Å; A114-F285 HydrophobicContact CB-CZ 4.42Å; F117-F285 HydrophobicContact CB-CB 4Å; F117-F285 HydrophobicContact CB-CG 4.42Å; F117-F285 AromaticContact CD1-CD1 3.92Å; F117-F285 HydrophobicContact CD1-CD1 3.92Å; F117-F285 HydrophobicContact CD1-CG 4.44Å; F117-F285 HydrophobicContact CE1-CD1 4.38Å; F117-F285 HydrophobicContact CG-CB 4.36Å; F117-F285 HydrophobicContact CG-CD1 4.36Å; C281-F285 WeakPolarHBondContact O-CB 3.14Å; C281-F285 PolarHBondContact O-N 3.36Å; F285-F287 VanDerWaalsContact C-N 3.33Å; F285-F287 PolarHBondContact O-N 3.47Å; F285-D288 PolarHBondContact O-N 2.88Å; F285-F289 HydrophobicContact CD2-CB 4.42Å; F285-F289 HydrophobicContact CE2-CB 3.96Å; F285-F289 HydrophobicContact CE2-CD2 4.44Å; F285-F289 HydrophobicContact CE2-CG 4.49Å; F285-F289 HydrophobicContact CZ-CB 4.02Å; F285-F289 HydrophobicContact CZ-CD2 4.17Å; F285-F289 HydrophobicContact CZ-CG 4.18Å; F285-F289 WeakPolarHBondContact O-CB 3.27Å; F285-F289 PolarHBondContact O-N 2.86Å
286	E	90.4	Very high	86.2	Confident	0 Å²	0	43.6 Å²	43.6	0%	0	20%	0.198	C	C	.	.	H	α-helix	trans	-57.4	-47	176.3	-174.4	-174.6	157.6	0	0	111.4	R67 F69 R70 I82 L86 A282 R284 F289 V290	R67-E286 VanDerWaalsContact CD-OE2 3.24Å; R67-E286 WeakPolarHBondContact CD-OE2 3.29Å; R67-E286 IonicContact NE-OE2 3.94Å; R67-E286 PolarHBondContact NE-OE2 3.45Å; R67-E286 VanDerWaalsContact NE-OE2 3.07Å; F69-E286 HydrophobicContact CE2-CG 3.9Å; F69-E286 WeakPolarHBondContact CE2-OE1 3.25Å; F69-E286 HydrophobicContact CZ-CB 4.02Å; F69-E286 HydrophobicContact CZ-CG 3.65Å; F69-E286 WeakPolarHBondContact CZ-OE1 3.47Å; R70-E286 IonicContact CZ-OE1 3.69Å; R70-E286 VanDerWaalsContact CZ-OE1 3.29Å; R70-E286 IonicContact CZ-OE2 2.84Å; R70-E286 IonicContact NE-OE1 3.19Å; R70-E286 PolarHBondContact NE-OE1 3.48Å; R70-E286 IonicContact NE-OE2 2.64Å; R70-E286 VanDerWaalsContact NH2-CD 3.27Å; R70-E286 IonicContact NH2-OE1 3.95Å; R70-E286 PolarHBondContact NH2-OE1 3.24Å; R70-E286 VanDerWaalsContact NH2-OE1 3.11Å; R70-E286 IonicContact NH2-OE2 3.63Å; R70-E286 PolarHBondContact NH2-OE2 3.46Å; I82-E286 HydrophobicContact CG2-CG 3.87Å; L86-E286 HydrophobicContact CD1-CB 4.19Å; L86-E286 HydrophobicContact CD2-CB 4.23Å; L86-E286 HydrophobicContact CD2-CG 4.3Å; A282-E286 WeakPolarHBondContact O-CB 3.35Å; A282-E286 PolarHBondContact O-N 3.49Å; R284-E286 VanDerWaalsContact C-N 3.32Å; R284-E286 PolarHBondContact O-N 3.3Å; E286-F289 PolarHBondContact O-N 2.97Å; E286-V290 HydrophobicContact CG-CG2 4.45Å; E286-V290 VanDerWaalsContact O-CG2 3.27Å; E286-V290 WeakPolarHBondContact O-CG2 3.16Å; E286-V290 PolarHBondContact O-N 3.4Å
287	F	86.5	Confident	84.9	Confident	43 Å²	43	42 Å²	42	19%	0.189	19%	0.19	C	C	.	.	H	α-helix	trans	-59.2	-50.9	176.2	173.5	-97	0	0	0	112	F69 A283 R284 F285 F289 V290 R291 I297 T299	F69-F287 HydrophobicContact CB-CD2 4.17Å; F69-F287 HydrophobicContact CD1-CB 4.16Å; F69-F287 AromaticContact CD1-CD2 3.93Å; F69-F287 HydrophobicContact CD1-CD2 3.93Å; F69-F287 HydrophobicContact CE1-CB 3.9Å; F69-F287 HydrophobicContact CG-CD2 4.01Å; F69-F287 HydrophobicContact CZ-CB 4.24Å; A283-F287 WeakPolarHBondContact O-CB 3.39Å; A283-F287 PolarHBondContact O-N 3.49Å; A283-F287 VanDerWaalsContact O-N 3.07Å; R284-F287 WeakPolarHBondContact O-CB 3.31Å; R284-F287 PolarHBondContact O-N 2.86Å; F285-F287 VanDerWaalsContact C-N 3.33Å; F285-F287 PolarHBondContact O-N 3.47Å; F287-F289 VanDerWaalsContact C-N 3.33Å; F287-F289 PolarHBondContact O-N 3.34Å; F287-V290 PolarHBondContact O-N 3.15Å; F287-R291 WeakPolarHBondContact O-CB 3.44Å; F287-R291 PolarHBondContact O-N 3.43Å; F287-I297 HydrophobicContact CD2-CG2 4.08Å; F287-I297 HydrophobicContact CE2-CG2 3.35Å; F287-I297 HydrophobicContact CZ-CG2 3.69Å; F287-T299 HydrophobicContact CE1-CG2 4.04Å; F287-T299 HydrophobicContact CZ-CG2 3.82Å
288	D	86.7	Confident	83.8	Confident	38 Å²	38	40.7 Å²	40.7	20%	0.203	18%	0.182	C	C	.	.	H	α-helix	trans	-65.4	-37.8	-178.1	-73.2	-28.9	0	0	0	111.8	A110 S113 R284 F285 R291 C292	A110-D288 HydrophobicContact CB-CB 4.17Å; S113-D288 WeakPolarHBondContact CB-OD2 3.31Å; S113-D288 PolarHBondContact OG-OD2 3.29Å; R284-D288 PolarHBondContact O-N 2.87Å; F285-D288 PolarHBondContact O-N 2.88Å; D288-R291 PolarHBondContact O-N 3.3Å; D288-C292 PolarHBondContact O-N 3.42Å; D288-C292 PolarHBondContact O-SG 3.4Å; D288-C292 VanDerWaalsContact O-SG 3.39Å
289	F	87.2	Confident	82.8	Confident	39 Å²	39	42.5 Å²	42.5	17%	0.171	19%	0.193	C	C	.	.	H	α-helix	trans	-63.7	-52.9	175	179.1	-106.9	0	0	0	111.8	A89 V93 F285 E286 F287 R291 C292 V293	A89-F289 HydrophobicContact CB-CD2 4.49Å; A89-F289 HydrophobicContact CB-CE1 4.38Å; A89-F289 HydrophobicContact CB-CE2 4.05Å; A89-F289 HydrophobicContact CB-CZ 3.99Å; V93-F289 HydrophobicContact CG2-CD2 4.01Å; V93-F289 HydrophobicContact CG2-CE2 4.24Å; F285-F289 HydrophobicContact CD2-CB 4.42Å; F285-F289 HydrophobicContact CE2-CB 3.96Å; F285-F289 HydrophobicContact CE2-CD2 4.44Å; F285-F289 HydrophobicContact CE2-CG 4.49Å; F285-F289 HydrophobicContact CZ-CB 4.02Å; F285-F289 HydrophobicContact CZ-CD2 4.17Å; F285-F289 HydrophobicContact CZ-CG 4.18Å; F285-F289 WeakPolarHBondContact O-CB 3.27Å; F285-F289 PolarHBondContact O-N 2.86Å; E286-F289 PolarHBondContact O-N 2.97Å; F287-F289 VanDerWaalsContact C-N 3.33Å; F287-F289 PolarHBondContact O-N 3.34Å; F289-R291 PolarHBondContact O-N 3.03Å; F289-C292 PolarHBondContact O-N 3.16Å; F289-V293 HydrophobicContact CE1-CG2 4.41Å; F289-V293 HydrophobicContact CE2-CG2 4.28Å; F289-V293 HydrophobicContact CZ-CG2 4.14Å; F289-V293 WeakPolarHBondContact O-CG2 3.35Å; F289-V293 PolarHBondContact O-N 3.31Å; F289-V293 VanDerWaalsContact O-N 3.11Å
290	V	82.6	Confident	81.8	Confident	7 Å²	7	49 Å²	49	4%	0.042	23%	0.227	C	C	.	.	H	α-helix	trans	-66	-31	178.8	-170.2	0	0	0	0	110.4	Y73 I82 E286 F287 V293 S294 I297	Y73-V290 HydrophobicContact CD1-CG1 3.73Å; Y73-V290 HydrophobicContact CE1-CG1 3.72Å; Y73-V290 HydrophobicContact CG-CG1 4.32Å; I82-V290 HydrophobicContact CD1-CG2 3.97Å; E286-V290 HydrophobicContact CG-CG2 4.45Å; E286-V290 VanDerWaalsContact O-CG2 3.27Å; E286-V290 WeakPolarHBondContact O-CG2 3.16Å; E286-V290 PolarHBondContact O-N 3.4Å; F287-V290 PolarHBondContact O-N 3.15Å; V290-V293 PolarHBondContact O-N 2.9Å; V290-S294 WeakPolarHBondContact O-CA 3.38Å; V290-S294 WeakPolarHBondContact O-CB 3.42Å; V290-S294 PolarHBondContact O-N 2.84Å; V290-I297 HydrophobicContact CB-CD1 3.65Å; V290-I297 HydrophobicContact CG1-CD1 3.22Å
291	R	78.4	Confident	81.2	Confident	85 Å²	85	51.6 Å²	51.6	32%	0.321	24%	0.236	S	C	.	.	H	α-helix	trans	-64.3	-40.6	173.5	-176.9	176.8	177.2	-155.8	-2.1	112.9	F287 D288 F289 V293 S294 I297 E302	F287-R291 WeakPolarHBondContact O-CB 3.44Å; F287-R291 PolarHBondContact O-N 3.43Å; D288-R291 PolarHBondContact O-N 3.3Å; F289-R291 PolarHBondContact O-N 3.03Å; R291-V293 VanDerWaalsContact C-N 3.33Å; R291-S294 CarbonylContact O-C 3.55Å; R291-I297 HydrophobicContact CB-CB 4.26Å; R291-I297 HydrophobicContact CB-CG2 3.74Å; R291-I297 HydrophobicContact CG-CB 4.43Å; R291-I297 HydrophobicContact CG-CG2 3.89Å; R291-E302 IonicContact CZ-OE1 3.29Å; R291-E302 IonicContact CZ-OE2 2.68Å; R291-E302 IonicContact NE-OE2 3.07Å; R291-E302 IonicContact NH2-OE1 3.54Å; R291-E302 PolarHBondContact NH2-OE1 2.96Å; R291-E302 IonicContact NH2-OE2 3.79Å; R291-E302 PolarHBondContact NH2-OE2 3.38Å
292	C	78.1	Confident	80.7	Confident	19 Å²	19	53 Å²	53	13%	0.128	24%	0.242	C	C	.	.	H	α-helix	trans	-64.2	-38.3	173.7	-75.7	0	0	0	0	112.2	D106 L107 D288 F289	D106-C292 PolarHBondContact O-SG 2.98Å; D106-C292 VanDerWaalsContact O-SG 3.38Å; L107-C292 HydrophobicContact CD2-CB 3.82Å; D288-C292 PolarHBondContact O-N 3.42Å; D288-C292 PolarHBondContact O-SG 3.4Å; D288-C292 VanDerWaalsContact O-SG 3.39Å; F289-C292 PolarHBondContact O-N 3.16Å
293	V	75.1	Confident	80.3	Confident	83 Å²	83	54.9 Å²	54.9	50%	0.503	26%	0.258	S	S	.	.	H	α-helix	trans	-81.1	-34.9	-178.1	178.2	0	0	0	0	112	F289 V290 R291	F289-V293 HydrophobicContact CE1-CG2 4.41Å; F289-V293 HydrophobicContact CE2-CG2 4.28Å; F289-V293 HydrophobicContact CZ-CG2 4.14Å; F289-V293 WeakPolarHBondContact O-CG2 3.35Å; F289-V293 PolarHBondContact O-N 3.31Å; F289-V293 VanDerWaalsContact O-N 3.11Å; V290-V293 PolarHBondContact O-N 2.9Å; R291-V293 VanDerWaalsContact C-N 3.33Å
294	S	72.4	Confident	80.1	Confident	21 Å²	21	57.8 Å²	57.8	15%	0.147	27%	0.273	C	S	.	.			trans	-120.1	104.4	-177.6	161.9	0	0	0	0	111.1	Y73 V290 R291 R296 I297	Y73-S294 WeakPolarHBondContact CE1-OG 3.47Å; Y73-S294 PolarHBondContact OH-OG 2.92Å; V290-S294 WeakPolarHBondContact O-CA 3.38Å; V290-S294 WeakPolarHBondContact O-CB 3.42Å; V290-S294 PolarHBondContact O-N 2.84Å; R291-S294 CarbonylContact O-C 3.55Å; S294-R296 PolarHBondContact O-N 3.34Å; S294-R296 PolarHBondContact OG-N 3.01Å; S294-I297 PolarHBondContact O-N 2.83Å
295	R	65.2	Low	80.1	Confident	135 Å²	135	51.9 Å²	51.9	51%	0.509	25%	0.25	S	S	.	.	T	Hydrogen-bonded Turn	trans	-59.4	-7.9	173.2	-57.8	-175.9	-176.4	-176.3	1.2	114.8	E104 T505	E104-R295 PolarHBondContact O-NH2 3.38Å; E104-R295 VanDerWaalsContact O-NH2 3.14Å; R295-T505 HydrophobicContact CB-CG2 4.45Å
296	R	65.8	Low	80	Confident	158 Å²	158	52 Å²	52	60%	0.596	25%	0.251	S	S	*	.	T	Hydrogen-bonded Turn	trans	-86.4	-13.4	176.3	-61.8	-176.8	-173.4	-170.7	2.7	114.1	K72 S294	K72-R296 PolarHBondContact NZ-O 2.97Å; S294-R296 PolarHBondContact O-N 3.34Å; S294-R296 PolarHBondContact OG-N 3.01Å
297	I	69	Low	80	Confident	11 Å²	11	55.8 Å²	55.8	6%	0.056	27%	0.269	C	S	.	.			trans	-76.9	128.5	170.1	-88.7	137.9	0	0	0	107.7	Y73 F287 V290 R291 S294	Y73-I297 HydrophobicContact CD1-CD1 4.26Å; Y73-I297 HydrophobicContact CD2-CD1 3.89Å; Y73-I297 HydrophobicContact CD2-CG1 4.07Å; Y73-I297 HydrophobicContact CE1-CD1 3.59Å; Y73-I297 HydrophobicContact CE1-CG1 4.24Å; Y73-I297 HydrophobicContact CE2-CB 4.43Å; Y73-I297 HydrophobicContact CE2-CD1 3.22Å; Y73-I297 HydrophobicContact CE2-CG1 3.1Å; Y73-I297 HydrophobicContact CG-CD1 4.41Å; Y73-I297 VanDerWaalsContact OH-CD1 3.25Å; Y73-I297 WeakPolarHBondContact OH-CD1 3.31Å; Y73-I297 WeakPolarHBondContact OH-CG1 2.97Å; Y73-I297 PolarHBondContact OH-N 3.07Å; Y73-I297 VanDerWaalsContact OH-N 3.07Å; F287-I297 HydrophobicContact CD2-CG2 4.08Å; F287-I297 HydrophobicContact CE2-CG2 3.35Å; F287-I297 HydrophobicContact CZ-CG2 3.69Å; V290-I297 HydrophobicContact CB-CD1 3.65Å; V290-I297 HydrophobicContact CG1-CD1 3.22Å; R291-I297 HydrophobicContact CB-CB 4.26Å; R291-I297 HydrophobicContact CB-CG2 3.74Å; R291-I297 HydrophobicContact CG-CB 4.43Å; R291-I297 HydrophobicContact CG-CG2 3.89Å; S294-I297 PolarHBondContact O-N 2.83Å
298	R	72.4	Confident	80.3	Confident	42 Å²	42	57 Å²	57	16%	0.158	28%	0.277	C	S	.	.			trans	-125.1	142.9	172.4	-65.4	-173.8	-175.5	109.6	3.9	107.2	E302 A303 E506	R298-E302 HydrophobicContact CB-CB 3.84Å; R298-E302 HydrophobicContact CG-CB 4.28Å; R298-A303 HydrophobicContact CB-CB 4.23Å; R298-E506 IonicContact CZ-OE1 2.74Å; R298-E506 IonicContact NE-OE1 2.72Å; R298-E506 PolarHBondContact NE-OE1 3.31Å; R298-E506 IonicContact NH2-OE1 3.33Å; R298-E506 PolarHBondContact NH2-OE1 3.02Å
299	T	73.6	Confident	80.8	Confident	38 Å²	38	55.1 Å²	55.1	23%	0.233	27%	0.267	C	S	.	.			trans	-58.3	159.7	158.9	59.6	0	0	0	0	109.1	F287 Q301 E302 A303	F287-T299 HydrophobicContact CE1-CG2 4.04Å; F287-T299 HydrophobicContact CZ-CG2 3.82Å; T299-Q301 PolarHBondContact O-N 2.98Å; T299-E302 WeakPolarHBondContact CB-OE2 3.42Å; T299-E302 WeakPolarHBondContact CG2-OE2 3.39Å; T299-E302 PolarHBondContact N-OE2 3.06Å; T299-E302 PolarHBondContact O-N 3.16Å; T299-E302 VanDerWaalsContact O-N 3.13Å; T299-E302 WeakPolarHBondContact OG1-CB 3.41Å; T299-E302 VanDerWaalsContact OG1-CD 3.28Å; T299-E302 WeakPolarHBondContact OG1-CG 3.32Å; T299-E302 PolarHBondContact OG1-N 3.47Å; T299-E302 VanDerWaalsContact OG1-N 3.15Å; T299-E302 PolarHBondContact OG1-OE2 3.38Å; T299-A303 PolarHBondContact O-N 3.2Å
300	L	75.6	Confident	81.1	Confident	138 Å²	138	53.9 Å²	53.9	72%	0.723	26%	0.263	S	S	*	.	H	α-helix	trans	-52.9	-45.2	174.8	-178.1	61.5	0	0	0	110.9	E302 A303 D304	L300-E302 PolarHBondContact O-N 2.76Å; L300-A303 WeakPolarHBondContact O-CB 3.38Å; L300-A303 PolarHBondContact O-N 3.05Å; L300-D304 VanDerWaalsContact O-CG 3.23Å; L300-D304 PolarHBondContact O-N 2.89Å
301	Q	81.8	Confident	81.7	Confident	94 Å²	94	56.9 Å²	56.9	44%	0.439	28%	0.281	S	S	.	.	H	α-helix	trans	-62.1	-39.8	178.4	-174.9	61.1	69.3	0	0	113.6	T299 D304 D305	T299-Q301 PolarHBondContact O-N 2.98Å; Q301-D304 PolarHBondContact O-N 3.01Å; Q301-D305 PolarHBondContact NE2-OD1 3.22Å; Q301-D305 VanDerWaalsContact NE2-OD1 3.15Å; Q301-D305 WeakPolarHBondContact O-CB 3.4Å; Q301-D305 PolarHBondContact O-N 3.5Å
302	E	85	Confident	82.5	Confident	30 Å²	30	52.9 Å²	52.9	14%	0.14	27%	0.266	C	S	.	.	H	α-helix	trans	-71.5	-34.7	176.6	-74.6	166.2	143.7	0	0	112	R291 R298 T299 L300 D304 D305 V306 F372	R291-E302 IonicContact CZ-OE1 3.29Å; R291-E302 IonicContact CZ-OE2 2.68Å; R291-E302 IonicContact NE-OE2 3.07Å; R291-E302 IonicContact NH2-OE1 3.54Å; R291-E302 PolarHBondContact NH2-OE1 2.96Å; R291-E302 IonicContact NH2-OE2 3.79Å; R291-E302 PolarHBondContact NH2-OE2 3.38Å; R298-E302 HydrophobicContact CB-CB 3.84Å; R298-E302 HydrophobicContact CG-CB 4.28Å; T299-E302 WeakPolarHBondContact CB-OE2 3.42Å; T299-E302 WeakPolarHBondContact CG2-OE2 3.39Å; T299-E302 PolarHBondContact N-OE2 3.06Å; T299-E302 PolarHBondContact O-N 3.16Å; T299-E302 VanDerWaalsContact O-N 3.13Å; T299-E302 WeakPolarHBondContact OG1-CB 3.41Å; T299-E302 VanDerWaalsContact OG1-CD 3.28Å; T299-E302 WeakPolarHBondContact OG1-CG 3.32Å; T299-E302 PolarHBondContact OG1-N 3.47Å; T299-E302 VanDerWaalsContact OG1-N 3.15Å; T299-E302 PolarHBondContact OG1-OE2 3.38Å; L300-E302 PolarHBondContact O-N 2.76Å; E302-D304 VanDerWaalsContact C-N 3.34Å; E302-D305 PolarHBondContact O-N 3.14Å; E302-V306 WeakPolarHBondContact O-CG2 3.18Å; E302-V306 PolarHBondContact O-N 3.43Å; E302-F372 HydrophobicContact CB-CD1 4.12Å; E302-F372 HydrophobicContact CB-CE1 3.82Å; E302-F372 HydrophobicContact CG-CD1 3.81Å; E302-F372 HydrophobicContact CG-CE1 3.93Å; E302-F372 HydrophobicContact CG-CG 4.38Å
303	A	84.4	Confident	83.3	Confident	41 Å²	41	52 Å²	52	34%	0.339	26%	0.26	S	S	.	.	H	α-helix	trans	-63	-44.8	173.4	0	0	0	0	0	110.5	R298 T299 L300 D305 V306 Q307	R298-A303 HydrophobicContact CB-CB 4.23Å; T299-A303 PolarHBondContact O-N 3.2Å; L300-A303 WeakPolarHBondContact O-CB 3.38Å; L300-A303 PolarHBondContact O-N 3.05Å; A303-D305 VanDerWaalsContact C-N 3.35Å; A303-D305 PolarHBondContact O-N 2.85Å; A303-V306 PolarHBondContact O-N 3.32Å; A303-Q307 WeakPolarHBondContact O-CB 3.42Å; A303-Q307 PolarHBondContact O-N 3Å
304	D	87	Confident	84.2	Confident	65 Å²	65	49 Å²	49	35%	0.348	24%	0.243	S	C	.	.	H	α-helix	trans	-60.7	-43.5	174.7	-65.2	-20.5	0	0	0	111.4	L300 Q301 E302 Q307 L308	L300-D304 VanDerWaalsContact O-CG 3.23Å; L300-D304 PolarHBondContact O-N 2.89Å; Q301-D304 PolarHBondContact O-N 3.01Å; E302-D304 VanDerWaalsContact C-N 3.34Å; D304-Q307 PolarHBondContact O-N 3.01Å; D304-L308 WeakPolarHBondContact O-CG 3.4Å; D304-L308 PolarHBondContact O-N 2.77Å
305	D	91.9	Very high	85.1	Confident	2 Å²	2	50.3 Å²	50.3	1%	0.011	25%	0.246	C	C	.	.	H	α-helix	trans	-60.6	-46.1	176.6	-74.9	-7.2	0	0	0	112.1	Q301 E302 A303 Q307 L308 V309 R369 P371 F372 M373	Q301-D305 PolarHBondContact NE2-OD1 3.22Å; Q301-D305 VanDerWaalsContact NE2-OD1 3.15Å; Q301-D305 WeakPolarHBondContact O-CB 3.4Å; Q301-D305 PolarHBondContact O-N 3.5Å; E302-D305 PolarHBondContact O-N 3.14Å; A303-D305 VanDerWaalsContact C-N 3.35Å; A303-D305 PolarHBondContact O-N 2.85Å; D305-Q307 VanDerWaalsContact C-N 3.31Å; D305-Q307 PolarHBondContact O-N 3.46Å; D305-L308 PolarHBondContact O-N 3.46Å; D305-V309 WeakPolarHBondContact O-CG2 3.49Å; D305-V309 PolarHBondContact O-N 3.48Å; D305-V309 VanDerWaalsContact O-N 3.09Å; D305-R369 IonicContact OD1-CZ 3.11Å; D305-R369 IonicContact OD1-NH1 3.49Å; D305-R369 PolarHBondContact OD1-NH1 3.25Å; D305-R369 IonicContact OD2-CZ 3.19Å; D305-R369 IonicContact OD2-NH1 3.49Å; D305-R369 PolarHBondContact OD2-NH1 3.41Å; D305-R369 IonicContact OD2-NH2 3.99Å; D305-R369 PolarHBondContact OD2-NH2 3.15Å; D305-P371 HydrophobicContact CB-CB 3.99Å; D305-F372 HydrophobicContact CB-CD1 3.73Å; D305-F372 HydrophobicContact CB-CE1 3.96Å; D305-F372 WeakPolarHBondContact OD2-CD1 3.38Å; D305-F372 PolarHBondContact OD2-N 2.83Å; D305-F372 VanDerWaalsContact OD2-N 3.14Å; D305-M373 HydrophobicContact CB-CE 4.4Å
306	V	90.8	Very high	86.4	Confident	2 Å²	2	43.9 Å²	43.9	1%	0.012	22%	0.222	C	C	.	.	H	α-helix	trans	-62.7	-40.3	175.9	171.8	0	0	0	0	110.7	E302 A303 V309 T310 F372 M373 E506 F509 I510	E302-V306 WeakPolarHBondContact O-CG2 3.18Å; E302-V306 PolarHBondContact O-N 3.43Å; A303-V306 PolarHBondContact O-N 3.32Å; V306-V309 PolarHBondContact O-N 2.76Å; V306-T310 WeakPolarHBondContact O-CB 3.48Å; V306-T310 PolarHBondContact O-N 2.87Å; V306-T310 PolarHBondContact O-OG1 3.42Å; V306-F372 HydrophobicContact CG2-CE1 3.87Å; V306-F372 HydrophobicContact CG2-CZ 3.94Å; V306-M373 HydrophobicContact CB-CE 4.38Å; V306-M373 HydrophobicContact CG2-CE 3.82Å; V306-M373 HydrophobicContact CG2-SD 4.21Å; V306-E506 HydrophobicContact CG2-CG 4.03Å; V306-F509 HydrophobicContact CG1-CD1 3.57Å; V306-F509 HydrophobicContact CG1-CE1 3.78Å; V306-I510 HydrophobicContact CG1-CD1 4.43Å; V306-I510 HydrophobicContact CG1-CG1 4.04Å
307	Q	91	Very high	87.6	Confident	81 Å²	81	36.3 Å²	36.3	38%	0.379	19%	0.193	S	C	.	.	H	α-helix	trans	-64.2	-44.3	177.1	-173.8	173.5	-3.7	0	0	111.7	A303 D304 D305 V309 T310 V311	A303-Q307 WeakPolarHBondContact O-CB 3.42Å; A303-Q307 PolarHBondContact O-N 3Å; D304-Q307 PolarHBondContact O-N 3.01Å; D305-Q307 VanDerWaalsContact C-N 3.31Å; D305-Q307 PolarHBondContact O-N 3.46Å; Q307-V309 VanDerWaalsContact C-N 3.31Å; Q307-V309 PolarHBondContact O-N 3.31Å; Q307-T310 WeakPolarHBondContact O-CA 3.29Å; Q307-T310 WeakPolarHBondContact O-CB 3.1Å; Q307-T310 PolarHBondContact O-N 3.47Å; Q307-T310 VanDerWaalsContact O-N 3.11Å; Q307-V311 WeakPolarHBondContact O-CG2 3.36Å; Q307-V311 PolarHBondContact O-N 2.7Å
308	L	93.6	Very high	88.5	Confident	67 Å²	67	37.9 Å²	37.9	35%	0.351	20%	0.201	S	C	.	.	H	α-helix	trans	-58.8	-42.6	175.9	-74	172.5	0	0	0	112	D304 D305 V311 L312 P358	D304-L308 WeakPolarHBondContact O-CG 3.4Å; D304-L308 PolarHBondContact O-N 2.77Å; D305-L308 PolarHBondContact O-N 3.46Å; L308-V311 PolarHBondContact O-N 3.11Å; L308-L312 PolarHBondContact O-N 3.39Å; L308-L312 VanDerWaalsContact O-N 3.1Å; L308-P358 HydrophobicContact CB-CB 4.23Å; L308-P358 HydrophobicContact CB-CG 4.29Å
309	V	95.4	Very high	89.4	Confident	0 Å²	0	35.9 Å²	35.9	0%	0	19%	0.193	C	C	.	.	H	α-helix	trans	-69.5	-35.3	176	-179.8	0	0	0	0	111.3	D305 V306 Q307 V311 L312 F313 P371 M373 F374 I510	D305-V309 WeakPolarHBondContact O-CG2 3.49Å; D305-V309 PolarHBondContact O-N 3.48Å; D305-V309 VanDerWaalsContact O-N 3.09Å; V306-V309 PolarHBondContact O-N 2.76Å; Q307-V309 VanDerWaalsContact C-N 3.31Å; Q307-V309 PolarHBondContact O-N 3.31Å; V309-V311 VanDerWaalsContact C-N 3.34Å; V309-V311 PolarHBondContact O-N 2.85Å; V309-L312 WeakPolarHBondContact O-CB 3.48Å; V309-L312 PolarHBondContact O-N 3.37Å; V309-F313 HydrophobicContact CG1-CD2 3.79Å; V309-F313 HydrophobicContact CG1-CE2 3.67Å; V309-F313 VanDerWaalsContact O-CD2 3.29Å; V309-F313 WeakPolarHBondContact O-CD2 3.43Å; V309-F313 PolarHBondContact O-N 3.37Å; V309-P371 HydrophobicContact CG2-CB 3.83Å; V309-P371 HydrophobicContact CG2-CG 3.79Å; V309-M373 HydrophobicContact CB-CE 4.01Å; V309-M373 HydrophobicContact CG2-CE 3.54Å; V309-F374 HydrophobicContact CG1-CE2 4.09Å; V309-F374 HydrophobicContact CG2-CD2 4.29Å; V309-F374 HydrophobicContact CG2-CE2 3.89Å; V309-I510 HydrophobicContact CB-CD1 4.09Å; V309-I510 HydrophobicContact CG1-CD1 3.7Å
310	T	94.8	Very high	90.1	Very high	13 Å²	13	34 Å²	34	8%	0.08	18%	0.182	C	C	.	.	H	α-helix	trans	-59.3	-44.3	173.1	-54.4	0	0	0	0	111.5	V306 Q307 F313 S314 K513 V514 M517	V306-T310 WeakPolarHBondContact O-CB 3.48Å; V306-T310 PolarHBondContact O-N 2.87Å; V306-T310 PolarHBondContact O-OG1 3.42Å; Q307-T310 WeakPolarHBondContact O-CA 3.29Å; Q307-T310 WeakPolarHBondContact O-CB 3.1Å; Q307-T310 PolarHBondContact O-N 3.47Å; Q307-T310 VanDerWaalsContact O-N 3.11Å; T310-F313 PolarHBondContact O-N 2.91Å; T310-S314 WeakPolarHBondContact O-CB 3.48Å; T310-S314 PolarHBondContact O-N 3.09Å; T310-K513 HydrophobicContact CG2-CB 3.95Å; T310-V514 HydrophobicContact CG2-CG2 3.9Å; T310-V514 WeakPolarHBondContact O-CG2 3.28Å; T310-M517 HydrophobicContact CG2-CE 4.28Å
311	V	94.3	Very high	90.5	Very high	69 Å²	69	29.2 Å²	29.2	42%	0.418	16%	0.157	S	C	.	.	H	α-helix	trans	-61.7	-45.7	175.2	174.1	0	0	0	0	110.8	Q307 L308 V309 F313 S314 E315	Q307-V311 WeakPolarHBondContact O-CG2 3.36Å; Q307-V311 PolarHBondContact O-N 2.7Å; L308-V311 PolarHBondContact O-N 3.11Å; V309-V311 VanDerWaalsContact C-N 3.34Å; V309-V311 PolarHBondContact O-N 2.85Å; V311-F313 VanDerWaalsContact C-N 3.33Å; V311-F313 PolarHBondContact O-N 3.23Å; V311-S314 VanDerWaalsContact O-CB 3.32Å; V311-S314 WeakPolarHBondContact O-CB 3.11Å; V311-S314 PolarHBondContact O-N 3.1Å; V311-S314 VanDerWaalsContact O-N 3.15Å; V311-E315 HydrophobicContact CG1-CG 4.36Å; V311-E315 WeakPolarHBondContact O-CG 3.3Å; V311-E315 PolarHBondContact O-N 3.48Å
312	L	95.5	Very high	90.5	Very high	1 Å²	1	25.7 Å²	25.7	1%	0.005	14%	0.142	C	C	.	.	H	α-helix	trans	-58.1	-44.2	176.2	171.5	61.7	0	0	0	112.1	L308 V309 S314 E315 T316 L354 P358 I359	L308-L312 PolarHBondContact O-N 3.39Å; L308-L312 VanDerWaalsContact O-N 3.1Å; V309-L312 WeakPolarHBondContact O-CB 3.48Å; V309-L312 PolarHBondContact O-N 3.37Å; L312-S314 VanDerWaalsContact C-N 3.35Å; L312-E315 PolarHBondContact O-N 3.47Å; L312-T316 WeakPolarHBondContact O-CB 3.24Å; L312-T316 PolarHBondContact O-N 2.93Å; L312-T316 PolarHBondContact O-OG1 3.32Å; L312-L354 HydrophobicContact CD1-CD1 3.98Å; L312-P358 HydrophobicContact CB-CG 4.15Å; L312-P358 HydrophobicContact CD2-CG 4.12Å; L312-I359 HydrophobicContact CD2-CD1 3.74Å; L312-I359 HydrophobicContact CD2-CG1 3.82Å
313	F	96	Very high	90.4	Very high	2 Å²	2	25.5 Å²	25.5	1%	0.009	14%	0.143	C	C	.	.	H	α-helix	trans	-65.8	-39	177.5	-86.8	-125.8	0	0	0	111.7	V309 T310 V311 T316 L317 L342 P343 S346 F499 L507 I510 L511 V514	V309-F313 HydrophobicContact CG1-CD2 3.79Å; V309-F313 HydrophobicContact CG1-CE2 3.67Å; V309-F313 VanDerWaalsContact O-CD2 3.29Å; V309-F313 WeakPolarHBondContact O-CD2 3.43Å; V309-F313 PolarHBondContact O-N 3.37Å; T310-F313 PolarHBondContact O-N 2.91Å; V311-F313 VanDerWaalsContact C-N 3.33Å; V311-F313 PolarHBondContact O-N 3.23Å; F313-T316 WeakPolarHBondContact O-CB 3.47Å; F313-T316 PolarHBondContact O-N 3.08Å; F313-L317 WeakPolarHBondContact O-CB 3.32Å; F313-L317 PolarHBondContact O-N 3.06Å; F313-L342 HydrophobicContact CD1-CD2 3.84Å; F313-L342 HydrophobicContact CD1-CG 3.96Å; F313-L342 HydrophobicContact CE1-CG 4.43Å; F313-P343 HydrophobicContact CE1-CB 4.25Å; F313-P343 HydrophobicContact CE1-CG 4.01Å; F313-P343 HydrophobicContact CZ-CB 4.02Å; F313-P343 HydrophobicContact CZ-CG 4.25Å; F313-S346 WeakPolarHBondContact CD2-OG 3.27Å; F313-S346 WeakPolarHBondContact CG-OG 3.08Å; F313-F499 HydrophobicContact CE2-CE1 4.32Å; F313-F499 HydrophobicContact CZ-CD1 4.46Å; F313-F499 AromaticContact CZ-CE1 3.74Å; F313-F499 HydrophobicContact CZ-CE1 3.74Å; F313-L507 HydrophobicContact CE1-CD1 3.99Å; F313-L507 HydrophobicContact CZ-CD1 4.33Å; F313-I510 HydrophobicContact CB-CG2 3.84Å; F313-I510 HydrophobicContact CD1-CG2 3.55Å; F313-I510 HydrophobicContact CD2-CG2 4.01Å; F313-I510 HydrophobicContact CE1-CG2 4.07Å; F313-I510 HydrophobicContact CE2-CG2 4.47Å; F313-I510 HydrophobicContact CG-CG2 3.53Å; F313-L511 HydrophobicContact CD1-CD2 4.09Å; F313-L511 HydrophobicContact CE1-CD2 4.12Å; F313-V514 HydrophobicContact CB-CG2 3.68Å
314	S	92.8	Very high	90.4	Very high	20 Å²	20	31.6 Å²	31.6	14%	0.14	16%	0.161	C	C	.	.	H	α-helix	trans	-59.6	-48.4	173.4	-177.3	0	0	0	0	111.5	T310 V311 L312 T316 L317 M318 H518	T310-S314 WeakPolarHBondContact O-CB 3.48Å; T310-S314 PolarHBondContact O-N 3.09Å; V311-S314 VanDerWaalsContact O-CB 3.32Å; V311-S314 WeakPolarHBondContact O-CB 3.11Å; V311-S314 PolarHBondContact O-N 3.1Å; V311-S314 VanDerWaalsContact O-N 3.15Å; L312-S314 VanDerWaalsContact C-N 3.35Å; S314-T316 VanDerWaalsContact C-N 3.33Å; S314-T316 PolarHBondContact O-N 2.89Å; S314-L317 WeakPolarHBondContact O-CB 3.5Å; S314-L317 PolarHBondContact O-N 3.45Å; S314-M318 WeakPolarHBondContact O-CG 3.32Å; S314-M318 PolarHBondContact O-N 3.14Å; S314-H518 PolarHBondContact OG-CE1 3.19Å; S314-H518 VanDerWaalsContact OG-CE1 3.27Å
315	E	90.4	Very high	90.3	Very high	47 Å²	47	29.8 Å²	29.8	22%	0.22	15%	0.152	C	C	.	.	H	α-helix	trans	-65.6	-37.2	177.6	-69.3	172.7	148.6	0	0	112	V311 L312 L317 W319 L354	V311-E315 HydrophobicContact CG1-CG 4.36Å; V311-E315 WeakPolarHBondContact O-CG 3.3Å; V311-E315 PolarHBondContact O-N 3.48Å; L312-E315 PolarHBondContact O-N 3.47Å; E315-L317 VanDerWaalsContact C-N 3.33Å; E315-W319 VanDerWaalsContact O-CB 3.31Å; E315-W319 WeakPolarHBondContact O-CB 3.26Å; E315-W319 PolarHBondContact O-N 3.13Å; E315-L354 HydrophobicContact CB-CD1 4.02Å; E315-L354 WeakPolarHBondContact OE2-CD1 3.35Å
316	T	93.5	Very high	90	Very high	0 Å²	0	30 Å²	30	0%	0	15%	0.153	C	C	.	.	H	α-helix	trans	-61.2	-44.3	173.2	-55.9	0	0	0	0	110.7	L312 F313 S314 W319 G320 L342 L345 S346 V349	L312-T316 WeakPolarHBondContact O-CB 3.24Å; L312-T316 PolarHBondContact O-N 2.93Å; L312-T316 PolarHBondContact O-OG1 3.32Å; F313-T316 WeakPolarHBondContact O-CB 3.47Å; F313-T316 PolarHBondContact O-N 3.08Å; S314-T316 VanDerWaalsContact C-N 3.33Å; S314-T316 PolarHBondContact O-N 2.89Å; T316-W319 PolarHBondContact O-N 2.76Å; T316-G320 PolarHBondContact O-N 3.01Å; T316-L342 HydrophobicContact CG2-CD1 3.98Å; T316-L345 HydrophobicContact CG2-CB 3.64Å; T316-S346 WeakPolarHBondContact CB-OG 2.93Å; T316-S346 WeakPolarHBondContact CG2-OG 3.3Å; T316-S346 WeakPolarHBondContact OG1-CA 3.41Å; T316-S346 PolarHBondContact OG1-OG 3.1Å; T316-V349 HydrophobicContact CG2-CB 4.29Å; T316-V349 HydrophobicContact CG2-CG2 3.94Å
317	L	91.3	Very high	89.7	Confident	0 Å²	0	32.2 Å²	32.2	0%	0	17%	0.168	C	C	.	.	H	α-helix	trans	-64.9	-48.9	179.3	-179.8	58.2	0	0	0	111.1	F313 S314 E315 W319 G320 L321 L326 L331 L342 V514 H518	F313-L317 WeakPolarHBondContact O-CB 3.32Å; F313-L317 PolarHBondContact O-N 3.06Å; S314-L317 WeakPolarHBondContact O-CB 3.5Å; S314-L317 PolarHBondContact O-N 3.45Å; E315-L317 VanDerWaalsContact C-N 3.33Å; L317-W319 VanDerWaalsContact C-N 3.31Å; L317-W319 PolarHBondContact O-N 3.03Å; L317-G320 PolarHBondContact O-N 2.7Å; L317-G320 VanDerWaalsContact O-N 3.15Å; L317-L321 HydrophobicContact CD1-CG 4.42Å; L317-L321 HydrophobicContact CG-CD1 4.38Å; L317-L321 WeakPolarHBondContact O-CG 3.35Å; L317-L321 PolarHBondContact O-N 2.89Å; L317-L326 HydrophobicContact CD1-CD1 3.6Å; L317-L331 HydrophobicContact CD1-CD1 3.85Å; L317-L331 HydrophobicContact CD1-CD2 3.61Å; L317-L331 HydrophobicContact CD1-CG 4.34Å; L317-L331 HydrophobicContact CD2-CD1 4.16Å; L317-L331 HydrophobicContact CD2-CD2 4.28Å; L317-L331 HydrophobicContact CG-CD1 4.3Å; L317-L342 HydrophobicContact CB-CD1 4.2Å; L317-L342 HydrophobicContact CD1-CD1 4.36Å; L317-V514 HydrophobicContact CB-CG1 4.09Å; L317-V514 HydrophobicContact CD2-CG1 3.53Å; L317-V514 HydrophobicContact CG-CG1 4.44Å; L317-H518 HydrophobicContact CD2-CB 3.99Å
318	M	88.3	Confident	89.5	Confident	43 Å²	43	33.8 Å²	33.8	21%	0.212	18%	0.178	C	C	.	.	H	α-helix	trans	-56	-46.3	174.7	-72.7	179.4	53.7	0	0	111.8	S314 L321 T322 H518 M611	S314-M318 WeakPolarHBondContact O-CG 3.32Å; S314-M318 PolarHBondContact O-N 3.14Å; M318-L321 PolarHBondContact O-N 3.36Å; M318-T322 WeakPolarHBondContact O-CB 3.35Å; M318-T322 PolarHBondContact O-N 3.47Å; M318-T322 PolarHBondContact O-OG1 3.4Å; M318-H518 VanDerWaalsContact CG-NE2 3.29Å; M318-H518 WeakPolarHBondContact CG-NE2 3.23Å; M318-M611 HydrophobicContact CB-CE 4.3Å; M318-M611 HydrophobicContact CE-CE 4Å; M318-M611 HydrophobicContact CE-SD 3.7Å
319	W	89.8	Confident	89	Confident	0 Å²	0	36 Å²	36	0%	0	19%	0.187	C	C	.	.	H	α-helix	trans	-59.8	-50.6	175.2	169.9	80.5	0	0	0	110.8	E315 T316 L317 L321 T322 V323 L325 L345 L348 V349 L353 T400 L604 F605	E315-W319 VanDerWaalsContact O-CB 3.31Å; E315-W319 WeakPolarHBondContact O-CB 3.26Å; E315-W319 PolarHBondContact O-N 3.13Å; T316-W319 PolarHBondContact O-N 2.76Å; L317-W319 VanDerWaalsContact C-N 3.31Å; L317-W319 PolarHBondContact O-N 3.03Å; W319-L321 VanDerWaalsContact C-N 3.31Å; W319-L321 PolarHBondContact O-N 3.08Å; W319-T322 WeakPolarHBondContact O-CB 3.47Å; W319-T322 PolarHBondContact O-N 3.45Å; W319-V323 HydrophobicContact CD2-CG1 4.41Å; W319-V323 HydrophobicContact CD2-CG2 4.4Å; W319-V323 HydrophobicContact CG-CG1 4.38Å; W319-V323 HydrophobicContact CZ2-CG2 4.44Å; W319-V323 WeakPolarHBondContact O-CG1 3.42Å; W319-V323 WeakPolarHBondContact O-CG2 3.4Å; W319-V323 PolarHBondContact O-N 3.37Å; W319-L325 HydrophobicContact CZ3-CD2 4.29Å; W319-L345 HydrophobicContact CZ3-CD2 4.32Å; W319-L348 HydrophobicContact CH2-CD2 4.32Å; W319-V349 HydrophobicContact CD2-CG2 3.9Å; W319-V349 HydrophobicContact CE3-CG2 3.39Å; W319-V349 HydrophobicContact CH2-CG2 4.13Å; W319-V349 HydrophobicContact CZ3-CG2 3.52Å; W319-L353 VanDerWaalsContact CD1-CD2 3.5Å; W319-L353 HydrophobicContact CD2-CD2 4.07Å; W319-L353 HydrophobicContact CG-CD2 4.02Å; W319-L353 HydrophobicContact CZ2-CD2 4.1Å; W319-T400 HydrophobicContact CH2-CG2 3.43Å; W319-T400 VanDerWaalsContact CH2-CG2 3.43Å; W319-T400 HydrophobicContact CZ2-CG2 4.18Å; W319-T400 HydrophobicContact CZ3-CG2 4.24Å; W319-L604 PolarHBondContact NE1-O 3.34Å; W319-F605 HydrophobicContact CH2-CE1 4.37Å; W319-F605 HydrophobicContact CZ2-CD1 4.2Å; W319-F605 AromaticContact CZ2-CE1 3.77Å; W319-F605 HydrophobicContact CZ2-CE1 3.77Å
320	G	88.1	Confident	88.5	Confident	0 Å²	0	38 Å²	38	0%	0	20%	0.196	C	C	.	.	H	α-helix	trans	-55.8	-41.3	179.6	0	0	0	0	0	113.7	T316 L317 V323 K324 L325 L326	T316-G320 PolarHBondContact O-N 3.01Å; L317-G320 PolarHBondContact O-N 2.7Å; L317-G320 VanDerWaalsContact O-N 3.15Å; G320-V323 WeakPolarHBondContact O-CG2 3.33Å; G320-K324 PolarHBondContact O-N 3.42Å; G320-L325 PolarHBondContact O-N 3.17Å; G320-L326 PolarHBondContact O-N 3.03Å; G320-L326 VanDerWaalsContact O-N 3.09Å
321	L	85.9	Confident	88	Confident	36 Å²	36	38 Å²	38	19%	0.188	20%	0.196	C	C	.	.	H	α-helix	trans	-66.1	-45.6	173.2	-72.9	172.8	0	0	0	111.9	L317 M318 W319 V323 K324 L326 I328 L331	L317-L321 HydrophobicContact CD1-CG 4.42Å; L317-L321 HydrophobicContact CG-CD1 4.38Å; L317-L321 WeakPolarHBondContact O-CG 3.35Å; L317-L321 PolarHBondContact O-N 2.89Å; M318-L321 PolarHBondContact O-N 3.36Å; W319-L321 VanDerWaalsContact C-N 3.31Å; W319-L321 PolarHBondContact O-N 3.08Å; L321-V323 VanDerWaalsContact C-N 3.29Å; L321-V323 PolarHBondContact O-N 2.95Å; L321-K324 PolarHBondContact O-N 3.32Å; L321-L326 HydrophobicContact CD2-CB 4.18Å; L321-I328 HydrophobicContact CD2-CG1 4.06Å; L321-L331 HydrophobicContact CD1-CD1 3.8Å; L321-L331 HydrophobicContact CD2-CD1 3.81Å; L321-L331 HydrophobicContact CG-CD1 4.15Å
322	T	80.8	Confident	87.5	Confident	20 Å²	20	36.9 Å²	36.9	12%	0.123	19%	0.189	C	C	.	.	H	α-helix	trans	-62.9	-38.4	-177.9	-53.5	0	0	0	0	111.8	M318 W319 K324 V610 Y613 H614	M318-T322 WeakPolarHBondContact O-CB 3.35Å; M318-T322 PolarHBondContact O-N 3.47Å; M318-T322 PolarHBondContact O-OG1 3.4Å; W319-T322 WeakPolarHBondContact O-CB 3.47Å; W319-T322 PolarHBondContact O-N 3.45Å; T322-K324 PolarHBondContact O-N 3.02Å; T322-V610 HydrophobicContact CG2-CG1 3.51Å; T322-Y613 HydrophobicContact CG2-CD1 3.56Å; T322-Y613 HydrophobicContact CG2-CE1 4.3Å; T322-Y613 HydrophobicContact CG2-CG 4.4Å; T322-H614 HydrophobicContact CG2-CB 4.14Å; T322-H614 PolarHBondContact OG1-CD2 2.86Å
323	V	83.9	Confident	87	Confident	27 Å²	27	41.8 Å²	41.8	16%	0.164	22%	0.215	C	C	.	.	T	Hydrogen-bonded Turn	trans	-84	2.6	177.8	-53.5	0	0	0	0	113	W319 G320 L321 L325 L604	W319-V323 HydrophobicContact CD2-CG1 4.41Å; W319-V323 HydrophobicContact CD2-CG2 4.4Å; W319-V323 HydrophobicContact CG-CG1 4.38Å; W319-V323 HydrophobicContact CZ2-CG2 4.44Å; W319-V323 WeakPolarHBondContact O-CG1 3.42Å; W319-V323 WeakPolarHBondContact O-CG2 3.4Å; W319-V323 PolarHBondContact O-N 3.37Å; G320-V323 WeakPolarHBondContact O-CG2 3.33Å; L321-V323 VanDerWaalsContact C-N 3.29Å; L321-V323 PolarHBondContact O-N 2.95Å; V323-L325 HydrophobicContact CG2-CB 3.67Å; V323-L325 PolarHBondContact O-N 3Å; V323-L604 HydrophobicContact CB-CD1 3.53Å; V323-L604 HydrophobicContact CB-CD2 4.25Å; V323-L604 HydrophobicContact CB-CG 3.88Å; V323-L604 HydrophobicContact CG1-CD1 3.38Å; V323-L604 HydrophobicContact CG1-CD2 4.34Å; V323-L604 HydrophobicContact CG1-CG 3.51Å
324	K	83.1	Confident	86.5	Confident	168 Å²	168	48.8 Å²	48.8	73%	0.73	24%	0.242	S	C	*	.	T	Hydrogen-bonded Turn	trans	55.3	27.8	-176.3	-55.1	-178.8	179.3	-179.8	0	113.8	G320 L321 T322 L326	G320-K324 PolarHBondContact O-N 3.42Å; L321-K324 PolarHBondContact O-N 3.32Å; T322-K324 PolarHBondContact O-N 3.02Å; K324-L326 VanDerWaalsContact C-N 3.32Å
325	L	84.3	Confident	86.2	Confident	28 Å²	28	49.6 Å²	49.6	15%	0.147	24%	0.244	C	C	.	.	S	Bend	trans	-75.5	-31.2	169.1	-178.3	67.1	0	0	0	110.7	W319 G320 V323 L345 T400	W319-L325 HydrophobicContact CZ3-CD2 4.29Å; G320-L325 PolarHBondContact O-N 3.17Å; V323-L325 HydrophobicContact CG2-CB 3.67Å; V323-L325 PolarHBondContact O-N 3Å; L325-L345 HydrophobicContact CD2-CD1 3.69Å; L325-L345 HydrophobicContact CD2-CD2 3.67Å; L325-L345 HydrophobicContact CD2-CG 4.35Å; L325-T400 HydrophobicContact CD2-CG2 3.65Å
326	L	87	Confident	86.1	Confident	6 Å²	6	51.3 Å²	51.3	3%	0.031	26%	0.26	C	S	.	.	S	Bend	trans	-118.8	145.9	175.4	-54.9	175.8	0	0	0	108.2	L317 G320 L321 K324 V338 L342 P405	L317-L326 HydrophobicContact CD1-CD1 3.6Å; G320-L326 PolarHBondContact O-N 3.03Å; G320-L326 VanDerWaalsContact O-N 3.09Å; L321-L326 HydrophobicContact CD2-CB 4.18Å; K324-L326 VanDerWaalsContact C-N 3.32Å; L326-V338 HydrophobicContact CD1-CG1 4.36Å; L326-V338 HydrophobicContact CD2-CG1 4.09Å; L326-V338 HydrophobicContact CD2-CG2 4.01Å; L326-L342 HydrophobicContact CD1-CD1 4.35Å; L326-P405 HydrophobicContact CD2-CG 4.01Å
327	S	84.8	Confident	85.9	Confident	49 Å²	49	54 Å²	54	34%	0.343	28%	0.278	S	S	.	.			trans	-106.8	153.9	172.2	67.2	0	0	0	0	111.1	Q329 Q330 L331	S327-Q329 VanDerWaalsContact C-N 3.26Å; S327-Q329 PolarHBondContact O-N 2.68Å; S327-Q330 PolarHBondContact O-N 2.85Å; S327-Q330 WeakPolarHBondContact OG-CG 3.35Å; S327-Q330 PolarHBondContact OG-N 3.43Å; S327-Q330 PolarHBondContact OG-OE1 3.37Å; S327-L331 PolarHBondContact O-N 2.63Å
328	I	85.5	Confident	85.7	Confident	114 Å²	114	54.3 Å²	54.3	59%	0.585	28%	0.279	S	S	*	.	H	α-helix	trans	-61.2	-40	175.7	-62.5	165.7	0	0	0	110	L321 Q330 L331 T332	L321-I328 HydrophobicContact CD2-CG1 4.06Å; I328-Q330 VanDerWaalsContact C-N 3.32Å; I328-Q330 PolarHBondContact O-N 3.16Å; I328-L331 WeakPolarHBondContact O-CA 3.43Å; I328-L331 WeakPolarHBondContact O-CB 3.43Å; I328-L331 PolarHBondContact O-N 2.76Å; I328-T332 PolarHBondContact O-N 2.71Å; I328-T332 PolarHBondContact O-OG1 2.62Å
329	Q	84	Confident	85.9	Confident	112 Å²	112	54.9 Å²	54.9	52%	0.523	28%	0.283	S	S	.	.	H	α-helix	trans	-56.4	-43.6	177.3	-172.2	60.5	38.7	0	0	112.4	S327 L331 T332 D333	S327-Q329 VanDerWaalsContact C-N 3.26Å; S327-Q329 PolarHBondContact O-N 2.68Å; Q329-L331 PolarHBondContact O-N 3.49Å; Q329-T332 PolarHBondContact O-N 2.76Å; Q329-D333 WeakPolarHBondContact CG-OD2 3.42Å; Q329-D333 VanDerWaalsContact NE2-CG 3.27Å; Q329-D333 PolarHBondContact NE2-OD1 3.32Å; Q329-D333 PolarHBondContact NE2-OD2 3.48Å; Q329-D333 WeakPolarHBondContact O-CB 3.49Å; Q329-D333 PolarHBondContact O-N 3.4Å
330	Q	84.2	Confident	85.9	Confident	43 Å²	43	60.1 Å²	60.1	20%	0.201	31%	0.311	C	S	.	.	H	α-helix	trans	-63.3	-26.2	176.7	-72.4	172	-65.2	0	0	113.2	S327 I328 R334 D335 V338	S327-Q330 PolarHBondContact O-N 2.85Å; S327-Q330 WeakPolarHBondContact OG-CG 3.35Å; S327-Q330 PolarHBondContact OG-N 3.43Å; S327-Q330 PolarHBondContact OG-OE1 3.37Å; I328-Q330 VanDerWaalsContact C-N 3.32Å; I328-Q330 PolarHBondContact O-N 3.16Å; Q330-R334 PolarHBondContact O-N 2.92Å; Q330-D335 HydrophobicContact CB-CB 3.96Å; Q330-D335 HydrophobicContact CG-CB 4.27Å; Q330-D335 PolarHBondContact NE2-OD2 3.24Å; Q330-D335 WeakPolarHBondContact O-CB 3.43Å; Q330-D335 PolarHBondContact O-N 3.37Å; Q330-V338 HydrophobicContact CB-CG2 3.71Å; Q330-V338 HydrophobicContact CG-CG2 4.38Å
331	L	85	Confident	86.1	Confident	13 Å²	13	60.2 Å²	60.2	7%	0.068	31%	0.311	C	S	.	.	H	α-helix	trans	-77.9	-44.5	175.1	-59.6	175.2	0	0	0	111.4	L317 L321 S327 I328 Q329 D333 R334 V338	L317-L331 HydrophobicContact CD1-CD1 3.85Å; L317-L331 HydrophobicContact CD1-CD2 3.61Å; L317-L331 HydrophobicContact CD1-CG 4.34Å; L317-L331 HydrophobicContact CD2-CD1 4.16Å; L317-L331 HydrophobicContact CD2-CD2 4.28Å; L317-L331 HydrophobicContact CG-CD1 4.3Å; L321-L331 HydrophobicContact CD1-CD1 3.8Å; L321-L331 HydrophobicContact CD2-CD1 3.81Å; L321-L331 HydrophobicContact CG-CD1 4.15Å; S327-L331 PolarHBondContact O-N 2.63Å; I328-L331 WeakPolarHBondContact O-CA 3.43Å; I328-L331 WeakPolarHBondContact O-CB 3.43Å; I328-L331 PolarHBondContact O-N 2.76Å; Q329-L331 PolarHBondContact O-N 3.49Å; L331-D333 VanDerWaalsContact C-N 3.3Å; L331-D333 PolarHBondContact O-N 2.93Å; L331-R334 PolarHBondContact O-N 2.87Å; L331-V338 HydrophobicContact CD2-CG1 3.86Å
332	T	83.1	Confident	86.5	Confident	45 Å²	45	58.7 Å²	58.7	28%	0.276	30%	0.303	S	S	.	.	H	α-helix	trans	-57.5	-44.6	174.7	-57.9	0	0	0	0	111.3	I328 Q329 R334 N521	I328-T332 PolarHBondContact O-N 2.71Å; I328-T332 PolarHBondContact O-OG1 2.62Å; Q329-T332 PolarHBondContact O-N 2.76Å; T332-R334 PolarHBondContact O-N 3.38Å; T332-N521 VanDerWaalsContact CG2-ND2 3.28Å; T332-N521 WeakPolarHBondContact CG2-ND2 3.3Å
333	D	86.1	Confident	87.2	Confident	105 Å²	105	58.1 Å²	58.1	56%	0.561	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	-76.9	-3.6	178.4	-63.5	-24.9	0	0	0	113.2	Q329 L331 D335	Q329-D333 WeakPolarHBondContact CG-OD2 3.42Å; Q329-D333 VanDerWaalsContact NE2-CG 3.27Å; Q329-D333 PolarHBondContact NE2-OD1 3.32Å; Q329-D333 PolarHBondContact NE2-OD2 3.48Å; Q329-D333 WeakPolarHBondContact O-CB 3.49Å; Q329-D333 PolarHBondContact O-N 3.4Å; L331-D333 VanDerWaalsContact C-N 3.3Å; L331-D333 PolarHBondContact O-N 2.93Å; D333-D335 PolarHBondContact O-N 3.07Å
334	R	84.3	Confident	87.8	Confident	149 Å²	149	58.9 Å²	58.9	56%	0.562	30%	0.3	S	S	*	.	T	Hydrogen-bonded Turn	trans	48	46.9	-173.1	-60	-177.6	177	172.8	0.1	112.1	Q330 L331 T332	Q330-R334 PolarHBondContact O-N 2.92Å; L331-R334 PolarHBondContact O-N 2.87Å; T332-R334 PolarHBondContact O-N 3.38Å
335	D	86.7	Confident	88.4	Confident	37 Å²	37	50.9 Å²	50.9	20%	0.198	27%	0.265	C	S	.	.			trans	-52.5	121.9	-175.7	177.1	-1.2	0	0	0	110.7	Q330 D333 C337 V338 L339	Q330-D335 HydrophobicContact CB-CB 3.96Å; Q330-D335 HydrophobicContact CG-CB 4.27Å; Q330-D335 PolarHBondContact NE2-OD2 3.24Å; Q330-D335 WeakPolarHBondContact O-CB 3.43Å; Q330-D335 PolarHBondContact O-N 3.37Å; D333-D335 PolarHBondContact O-N 3.07Å; D335-C337 PolarHBondContact O-N 3.49Å; D335-C337 VanDerWaalsContact O-N 3.14Å; D335-C337 WeakPolarHBondContact OD1-CB 3.31Å; D335-C337 PolarHBondContact OD1-N 2.72Å; D335-V338 HydrophobicContact CB-CG2 4.14Å; D335-V338 PolarHBondContact O-N 2.91Å; D335-L339 PolarHBondContact O-N 3.21Å
336	P	88.2	Confident	89	Confident	83 Å²	83	49.6 Å²	49.6	54%	0.539	26%	0.258	S	S	.	.	H	α-helix	trans	-57.6	-29.9	179.9	24.4	-35.5	0	0	0	113	V338 L339 L340	P336-V338 VanDerWaalsContact C-N 3.29Å; P336-V338 PolarHBondContact O-N 2.94Å; P336-L339 PolarHBondContact O-N 2.93Å; P336-L340 WeakPolarHBondContact O-CB 3.33Å; P336-L340 VanDerWaalsContact O-CG 3.26Å; P336-L340 WeakPolarHBondContact O-CG 3.45Å; P336-L340 PolarHBondContact O-N 3.39Å
337	C	88.8	Confident	89.5	Confident	57 Å²	57	49.4 Å²	49.4	39%	0.385	26%	0.257	S	S	.	.	H	α-helix	trans	-63.4	-36.4	177.1	-68	0	0	0	0	111.8	D335 A341 P405	D335-C337 PolarHBondContact O-N 3.49Å; D335-C337 VanDerWaalsContact O-N 3.14Å; D335-C337 WeakPolarHBondContact OD1-CB 3.31Å; D335-C337 PolarHBondContact OD1-N 2.72Å; C337-A341 WeakPolarHBondContact O-CB 3.45Å; C337-A341 PolarHBondContact O-N 3.06Å; C337-P405 HydrophobicContact CB-CB 3.97Å
338	V	89	Confident	90	Very high	5 Å²	5	47 Å²	47	3%	0.03	24%	0.241	C	C	.	.	H	α-helix	trans	-69.5	-43.3	175.4	178.2	0	0	0	0	110.7	L326 Q330 L331 D335 P336 L340 A341 L342	L326-V338 HydrophobicContact CD1-CG1 4.36Å; L326-V338 HydrophobicContact CD2-CG1 4.09Å; L326-V338 HydrophobicContact CD2-CG2 4.01Å; Q330-V338 HydrophobicContact CB-CG2 3.71Å; Q330-V338 HydrophobicContact CG-CG2 4.38Å; L331-V338 HydrophobicContact CD2-CG1 3.86Å; D335-V338 HydrophobicContact CB-CG2 4.14Å; D335-V338 PolarHBondContact O-N 2.91Å; P336-V338 VanDerWaalsContact C-N 3.29Å; P336-V338 PolarHBondContact O-N 2.94Å; V338-L340 PolarHBondContact O-N 3.15Å; V338-A341 PolarHBondContact O-N 2.84Å; V338-L342 WeakPolarHBondContact O-CB 3.34Å; V338-L342 PolarHBondContact O-N 3.39Å
339	L	90.5	Very high	90.4	Very high	56 Å²	56	41.7 Å²	41.7	29%	0.293	21%	0.213	S	C	.	.	H	α-helix	trans	-61.4	-35	178.4	-56.5	-178.5	0	0	0	112.2	D335 P336 P343 L511 I515	D335-L339 PolarHBondContact O-N 3.21Å; P336-L339 PolarHBondContact O-N 2.93Å; L339-P343 WeakPolarHBondContact O-CD 3.36Å; L339-L511 HydrophobicContact CB-CD1 4.39Å; L339-L511 HydrophobicContact CD2-CD1 4.39Å; L339-I515 HydrophobicContact CD2-CD1 3.46Å; L339-I515 VanDerWaalsContact CD2-CD1 3.46Å
340	L	91	Very high	90.9	Very high	110 Å²	110	36.3 Å²	36.3	58%	0.576	19%	0.188	S	C	*	.	H	α-helix	trans	-79.5	-29.7	176.6	-69.3	174.1	0	0	0	113.5	P336 V338 R344	P336-L340 WeakPolarHBondContact O-CB 3.33Å; P336-L340 VanDerWaalsContact O-CG 3.26Å; P336-L340 WeakPolarHBondContact O-CG 3.45Å; P336-L340 PolarHBondContact O-N 3.39Å; V338-L340 PolarHBondContact O-N 3.15Å; L340-R344 PolarHBondContact O-NE 3.14Å; L340-R344 PolarHBondContact O-NH2 2.74Å
341	A	92.4	Very high	91.4	Very high	1 Å²	1	34.3 Å²	34.3	1%	0.008	18%	0.179	C	C	.	.	H	α-helix	trans	-82.5	-34.9	179.7	0	0	0	0	0	112.3	C337 V338 R344 L345 L403	C337-A341 WeakPolarHBondContact O-CB 3.45Å; C337-A341 PolarHBondContact O-N 3.06Å; V338-A341 PolarHBondContact O-N 2.84Å; A341-R344 WeakPolarHBondContact O-CB 3.39Å; A341-R344 PolarHBondContact O-N 2.94Å; A341-L345 HydrophobicContact CB-CD1 4.35Å; A341-L345 WeakPolarHBondContact O-CG 3.3Å; A341-L345 PolarHBondContact O-N 3.11Å; A341-L403 WeakPolarHBondContact CB-O 3.19Å
342	L	94.3	Very high	91.8	Very high	4 Å²	4	37 Å²	37	2%	0.021	19%	0.188	C	C	.	.	H	α-helix	trans	-58.3	-44.7	-171.7	-163.4	67.5	0	0	0	113.3	F313 T316 L317 L326 V338 R344 L345 S346 L511 V514	F313-L342 HydrophobicContact CD1-CD2 3.84Å; F313-L342 HydrophobicContact CD1-CG 3.96Å; F313-L342 HydrophobicContact CE1-CG 4.43Å; T316-L342 HydrophobicContact CG2-CD1 3.98Å; L317-L342 HydrophobicContact CB-CD1 4.2Å; L317-L342 HydrophobicContact CD1-CD1 4.36Å; L326-L342 HydrophobicContact CD1-CD1 4.35Å; V338-L342 WeakPolarHBondContact O-CB 3.34Å; V338-L342 PolarHBondContact O-N 3.39Å; L342-R344 VanDerWaalsContact C-N 3.32Å; L342-R344 PolarHBondContact O-N 3.38Å; L342-L345 PolarHBondContact O-N 3.2Å; L342-S346 WeakPolarHBondContact O-CB 3.16Å; L342-S346 PolarHBondContact O-N 2.97Å; L342-S346 PolarHBondContact O-OG 2.64Å; L342-S346 VanDerWaalsContact O-OG 3.07Å; L342-L511 HydrophobicContact CB-CD2 4.35Å; L342-L511 HydrophobicContact CD2-CD2 3.74Å; L342-V514 HydrophobicContact CD2-CG1 4.28Å
343	P	96.1	Very high	92.1	Very high	9 Å²	9	35.6 Å²	35.6	6%	0.058	18%	0.179	C	C	.	.	H	α-helix	trans	-58.8	-42.3	175.1	-23.8	34.3	0	0	0	113	F313 L339 S346 I347 A496 L507	F313-P343 HydrophobicContact CE1-CB 4.25Å; F313-P343 HydrophobicContact CE1-CG 4.01Å; F313-P343 HydrophobicContact CZ-CB 4.02Å; F313-P343 HydrophobicContact CZ-CG 4.25Å; L339-P343 WeakPolarHBondContact O-CD 3.36Å; P343-S346 PolarHBondContact O-N 3.04Å; P343-I347 WeakPolarHBondContact O-CG1 3.2Å; P343-I347 PolarHBondContact O-N 3.43Å; P343-I347 VanDerWaalsContact O-N 3.16Å; P343-A496 HydrophobicContact CB-CB 4.15Å; P343-L507 HydrophobicContact CG-CD1 3.79Å
344	R	95.7	Very high	92.3	Very high	43 Å²	43	31.2 Å²	31.2	16%	0.162	16%	0.155	C	C	.	.	H	α-helix	trans	-64.2	-44.6	178.3	-75.7	179.8	-96.5	-179.9	-8.9	111.6	L340 A341 L342 S346 I347 L348 L403 I492 A496	L340-R344 PolarHBondContact O-NE 3.14Å; L340-R344 PolarHBondContact O-NH2 2.74Å; A341-R344 WeakPolarHBondContact O-CB 3.39Å; A341-R344 PolarHBondContact O-N 2.94Å; L342-R344 VanDerWaalsContact C-N 3.32Å; L342-R344 PolarHBondContact O-N 3.38Å; R344-S346 VanDerWaalsContact C-N 3.33Å; R344-I347 PolarHBondContact O-N 3.35Å; R344-L348 PolarHBondContact O-N 3.29Å; R344-L403 HydrophobicContact CB-CB 4.32Å; R344-L403 HydrophobicContact CB-CD2 4.03Å; R344-L403 HydrophobicContact CG-CD2 4.48Å; R344-I492 HydrophobicContact CB-CG2 4.48Å; R344-I492 WeakPolarHBondContact O-CG2 3.13Å; R344-A496 HydrophobicContact CB-CB 4.43Å; R344-A496 HydrophobicContact CG-CB 3.62Å
345	L	95.7	Very high	92.5	Very high	0 Å²	0	26.1 Å²	26.1	0%	0	14%	0.142	C	C	.	.	H	α-helix	trans	-65.2	-37.2	175.5	-67.1	173.8	0	0	0	111.7	T316 W319 L325 A341 L342 I347 L348 V349 T400 L403	T316-L345 HydrophobicContact CG2-CB 3.64Å; W319-L345 HydrophobicContact CZ3-CD2 4.32Å; L325-L345 HydrophobicContact CD2-CD1 3.69Å; L325-L345 HydrophobicContact CD2-CD2 3.67Å; L325-L345 HydrophobicContact CD2-CG 4.35Å; A341-L345 HydrophobicContact CB-CD1 4.35Å; A341-L345 WeakPolarHBondContact O-CG 3.3Å; A341-L345 PolarHBondContact O-N 3.11Å; L342-L345 PolarHBondContact O-N 3.2Å; L345-I347 VanDerWaalsContact C-N 3.33Å; L345-I347 PolarHBondContact O-N 2.75Å; L345-L348 WeakPolarHBondContact O-CB 3.27Å; L345-L348 PolarHBondContact O-N 3.42Å; L345-L348 VanDerWaalsContact O-N 3.12Å; L345-V349 WeakPolarHBondContact O-CB 3.21Å; L345-V349 WeakPolarHBondContact O-CG2 3.02Å; L345-V349 PolarHBondContact O-N 2.94Å; L345-T400 HydrophobicContact CD2-CG2 4.41Å; L345-L403 HydrophobicContact CD2-CB 3.8Å
346	S	96.6	Very high	92.5	Very high	0 Å²	0	29.9 Å²	29.9	0%	0	16%	0.162	C	C	.	.	H	α-helix	trans	-66	-34.4	179	-69.7	0	0	0	0	112.8	F313 T316 L342 P343 R344 G350	F313-S346 WeakPolarHBondContact CD2-OG 3.27Å; F313-S346 WeakPolarHBondContact CG-OG 3.08Å; T316-S346 WeakPolarHBondContact CB-OG 2.93Å; T316-S346 WeakPolarHBondContact CG2-OG 3.3Å; T316-S346 WeakPolarHBondContact OG1-CA 3.41Å; T316-S346 PolarHBondContact OG1-OG 3.1Å; L342-S346 WeakPolarHBondContact O-CB 3.16Å; L342-S346 PolarHBondContact O-N 2.97Å; L342-S346 PolarHBondContact O-OG 2.64Å; L342-S346 VanDerWaalsContact O-OG 3.07Å; P343-S346 PolarHBondContact O-N 3.04Å; R344-S346 VanDerWaalsContact C-N 3.33Å; S346-G350 WeakPolarHBondContact O-CA 3.3Å; S346-G350 PolarHBondContact O-N 3.38Å
347	I	96.7	Very high	92.7	Very high	2 Å²	2	26.3 Å²	26.3	1%	0.01	14%	0.139	C	C	.	.	H	α-helix	trans	-62.8	-47	169.9	-59.3	-51.9	0	0	0	110.6	P343 R344 L345 C351 I359 F374 L381 L384 I492 V495	P343-I347 WeakPolarHBondContact O-CG1 3.2Å; P343-I347 PolarHBondContact O-N 3.43Å; P343-I347 VanDerWaalsContact O-N 3.16Å; R344-I347 PolarHBondContact O-N 3.35Å; L345-I347 VanDerWaalsContact C-N 3.33Å; L345-I347 PolarHBondContact O-N 2.75Å; I347-C351 WeakPolarHBondContact O-CB 2.98Å; I347-C351 PolarHBondContact O-N 2.91Å; I347-C351 PolarHBondContact O-SG 3.02Å; I347-I359 HydrophobicContact CD1-CD1 3.67Å; I347-F374 HydrophobicContact CD1-CD1 4.32Å; I347-F374 HydrophobicContact CD1-CE1 3.5Å; I347-F374 HydrophobicContact CD1-CZ 3.85Å; I347-L381 HydrophobicContact CD1-CD2 4.39Å; I347-L381 HydrophobicContact CG2-CD2 4.15Å; I347-L384 HydrophobicContact CG2-CD1 3.97Å; I347-I492 HydrophobicContact CB-CG2 3.97Å; I347-I492 HydrophobicContact CG2-CG1 4.36Å; I347-I492 HydrophobicContact CG2-CG2 4.05Å; I347-V495 HydrophobicContact CD1-CG1 4.05Å; I347-V495 HydrophobicContact CG1-CG1 4.32Å
348	L	95.4	Very high	92.8	Very high	0 Å²	0	24 Å²	24	0%	0	12%	0.123	C	C	.	.	H	α-helix	trans	-59.7	-52.1	178	-177.5	78.1	0	0	0	111.6	W319 R344 L345 C351 R352 L388 L396 L399 T400 L403 I492	W319-L348 HydrophobicContact CH2-CD2 4.32Å; R344-L348 PolarHBondContact O-N 3.29Å; L345-L348 WeakPolarHBondContact O-CB 3.27Å; L345-L348 PolarHBondContact O-N 3.42Å; L345-L348 VanDerWaalsContact O-N 3.12Å; L348-C351 PolarHBondContact O-N 3.29Å; L348-R352 VanDerWaalsContact O-CB 3.24Å; L348-R352 WeakPolarHBondContact O-CB 2.99Å; L348-R352 PolarHBondContact O-N 2.68Å; L348-L388 HydrophobicContact CD1-CD1 4.02Å; L348-L388 HydrophobicContact CD1-CD2 3.6Å; L348-L388 HydrophobicContact CD1-CG 4.44Å; L348-L396 HydrophobicContact CD1-CD1 3.87Å; L348-L399 HydrophobicContact CD1-CD2 3.97Å; L348-L399 HydrophobicContact CD1-CG 4.47Å; L348-T400 HydrophobicContact CD2-CG2 4.45Å; L348-T400 VanDerWaalsContact CD2-OG1 3.26Å; L348-T400 WeakPolarHBondContact CD2-OG1 3.47Å; L348-L403 HydrophobicContact CB-CD1 3.99Å; L348-L403 HydrophobicContact CD1-CD1 4.15Å; L348-L403 HydrophobicContact CD2-CD1 4.09Å; L348-L403 HydrophobicContact CG-CD1 4.31Å; L348-I492 HydrophobicContact CD1-CD1 4.2Å
349	V	93.7	Very high	93.1	Very high	1 Å²	1	23.8 Å²	23.8	1%	0.006	12%	0.122	C	C	.	.	H	α-helix	trans	-63.6	-47.6	-177.8	171.7	0	0	0	0	110.7	T316 W319 L345 C351 R352 L353 L354	T316-V349 HydrophobicContact CG2-CB 4.29Å; T316-V349 HydrophobicContact CG2-CG2 3.94Å; W319-V349 HydrophobicContact CD2-CG2 3.9Å; W319-V349 HydrophobicContact CE3-CG2 3.39Å; W319-V349 HydrophobicContact CH2-CG2 4.13Å; W319-V349 HydrophobicContact CZ3-CG2 3.52Å; L345-V349 WeakPolarHBondContact O-CB 3.21Å; L345-V349 WeakPolarHBondContact O-CG2 3.02Å; L345-V349 PolarHBondContact O-N 2.94Å; V349-C351 PolarHBondContact O-N 3.23Å; V349-R352 PolarHBondContact O-N 3.5Å; V349-L353 HydrophobicContact CG1-CB 4.17Å; V349-L353 HydrophobicContact CG2-CD2 4.47Å; V349-L353 WeakPolarHBondContact O-CA 3.25Å; V349-L353 WeakPolarHBondContact O-CB 3.09Å; V349-L353 PolarHBondContact O-N 3.12Å; V349-L354 HydrophobicContact CG1-CD1 3.9Å; V349-L354 HydrophobicContact CG1-CG 4.21Å; V349-L354 PolarHBondContact O-N 3.23Å
350	G	95.3	Very high	93.2	Very high	0 Å²	0	21.1 Å²	21.1	0%	0	11%	0.108	C	C	.	.	H	α-helix	trans	-63.7	-40.1	178.7	0	0	0	0	0	112.9	S346 S357 G360	S346-G350 WeakPolarHBondContact O-CA 3.3Å; S346-G350 PolarHBondContact O-N 3.38Å; G350-S357 VanDerWaalsContact C-OG 3.29Å; G350-S357 VanDerWaalsContact CA-OG 3.24Å; G350-S357 WeakPolarHBondContact CA-OG 3.39Å; G350-S357 PolarHBondContact O-OG 3.02Å; G350-G360 VanDerWaalsContact O-CA 3.3Å; G350-G360 WeakPolarHBondContact O-CA 3.28Å
351	C	94.8	Very high	93.2	Very high	0 Å²	0	17 Å²	17	0%	0	9%	0.089	C	C	.	.	H	α-helix	trans	-78.8	-27.9	179.5	-68.8	0	0	0	0	113.7	I347 L348 V349 C385 L388 F389	I347-C351 WeakPolarHBondContact O-CB 2.98Å; I347-C351 PolarHBondContact O-N 2.91Å; I347-C351 PolarHBondContact O-SG 3.02Å; L348-C351 PolarHBondContact O-N 3.29Å; V349-C351 PolarHBondContact O-N 3.23Å; C351-C385 VanDerWaalsContact CB-SG 3.54Å; C351-C385 VanDerWaalsContact SG-SG 3.64Å; C351-L388 HydrophobicContact CB-CD1 3.73Å; C351-F389 VanDerWaalsContact O-CE2 3.26Å; C351-F389 WeakPolarHBondContact O-CE2 3.49Å
352	R	92.5	Very high	93.1	Very high	71 Å²	71	20.6 Å²	20.6	27%	0.268	11%	0.108	S	C	.	.	H	α-helix	trans	-114.3	-47	-171.5	-178.5	54.8	175.9	135.6	-2.2	115.3	L348 V349 L388 L396	L348-R352 VanDerWaalsContact O-CB 3.24Å; L348-R352 WeakPolarHBondContact O-CB 2.99Å; L348-R352 PolarHBondContact O-N 2.68Å; V349-R352 PolarHBondContact O-N 3.5Å; R352-L388 HydrophobicContact CB-CB 4.15Å; R352-L388 HydrophobicContact CB-CD1 4.39Å; R352-L388 WeakPolarHBondContact CD-O 3.35Å; R352-L388 HydrophobicContact CG-CB 4.44Å; R352-L388 PolarHBondContact NE-O 3Å; R352-L396 HydrophobicContact CG-CD1 4.37Å; R352-L396 HydrophobicContact CG-CD2 3.97Å
353	L	89.8	Confident	92.9	Very high	14 Å²	14	23 Å²	23	7%	0.073	12%	0.117	C	C	.	.	T	Hydrogen-bonded Turn	trans	-88	-32.1	-172.8	-78.5	71.8	0	0	0	112	W319 V349 P355 F605	W319-L353 VanDerWaalsContact CD1-CD2 3.5Å; W319-L353 HydrophobicContact CD2-CD2 4.07Å; W319-L353 HydrophobicContact CG-CD2 4.02Å; W319-L353 HydrophobicContact CZ2-CD2 4.1Å; V349-L353 HydrophobicContact CG1-CB 4.17Å; V349-L353 HydrophobicContact CG2-CD2 4.47Å; V349-L353 WeakPolarHBondContact O-CA 3.25Å; V349-L353 WeakPolarHBondContact O-CB 3.09Å; V349-L353 PolarHBondContact O-N 3.12Å; L353-P355 WeakPolarHBondContact O-CD 3.47Å; L353-F605 HydrophobicContact CD1-CD1 3.72Å; L353-F605 HydrophobicContact CD1-CE1 4.41Å; L353-F605 HydrophobicContact CD2-CD1 4.39Å; L353-F605 HydrophobicContact CG-CD1 4.32Å
354	L	91.4	Very high	92.6	Very high	14 Å²	14	23.3 Å²	23.3	7%	0.073	12%	0.118	C	C	.	.			trans	-118.4	82.8	-175.6	-63.8	175.3	0	0	0	110.2	L312 E315 V349 D356 S357 W607	L312-L354 HydrophobicContact CD1-CD1 3.98Å; E315-L354 HydrophobicContact CB-CD1 4.02Å; E315-L354 WeakPolarHBondContact OE2-CD1 3.35Å; V349-L354 HydrophobicContact CG1-CD1 3.9Å; V349-L354 HydrophobicContact CG1-CG 4.21Å; V349-L354 PolarHBondContact O-N 3.23Å; L354-D356 PolarHBondContact O-N 2.74Å; L354-D356 VanDerWaalsContact O-N 3.16Å; L354-S357 WeakPolarHBondContact O-CB 3.35Å; L354-S357 PolarHBondContact O-N 3.49Å; L354-S357 PolarHBondContact O-OG 2.66Å; L354-W607 HydrophobicContact CD2-CD2 3.69Å; L354-W607 HydrophobicContact CD2-CE3 4.31Å; L354-W607 HydrophobicContact CD2-CG 3.81Å; L354-W607 HydrophobicContact CD2-CZ2 4.09Å
355	P	87.3	Confident	92.3	Very high	42 Å²	42	25.5 Å²	25.5	27%	0.273	15%	0.146	S	C	.	.	T	Hydrogen-bonded Turn	trans	-64.5	-22.8	-173.9	28.2	-36.5	0	0	0	113.5	L353 G360 A361 N362	L353-P355 WeakPolarHBondContact O-CD 3.47Å; P355-G360 CarbonylContact O-C 3.57Å; P355-G360 VanDerWaalsContact O-C 3.3Å; P355-G360 WeakPolarHBondContact O-CA 3.43Å; P355-A361 PolarHBondContact O-N 2.81Å; P355-N362 WeakPolarHBondContact O-CB 3.38Å; P355-N362 PolarHBondContact O-N 2.8Å
356	D	88.1	Confident	92.1	Very high	116 Å²	116	30.5 Å²	30.5	62%	0.62	18%	0.176	S	C	*	.	T	Hydrogen-bonded Turn	trans	-93.3	0.4	175.8	-60.2	-40.2	0	0	0	113.8	L354 N362 R363	L354-D356 PolarHBondContact O-N 2.74Å; L354-D356 VanDerWaalsContact O-N 3.16Å; D356-N362 WeakPolarHBondContact OD1-CB 3.44Å; D356-N362 PolarHBondContact OD1-ND2 3.49Å; D356-R363 WeakPolarHBondContact O-CD 3.44Å
357	S	92.6	Very high	91.6	Very high	8 Å²	8	32.9 Å²	32.9	6%	0.056	20%	0.201	C	C	.	.	S	Bend	trans	-58.6	161.8	176.9	80.5	0	0	0	0	111.4	G350 L354 I359 G360 R363	G350-S357 VanDerWaalsContact C-OG 3.29Å; G350-S357 VanDerWaalsContact CA-OG 3.24Å; G350-S357 WeakPolarHBondContact CA-OG 3.39Å; G350-S357 PolarHBondContact O-OG 3.02Å; L354-S357 WeakPolarHBondContact O-CB 3.35Å; L354-S357 PolarHBondContact O-N 3.49Å; L354-S357 PolarHBondContact O-OG 2.66Å; S357-I359 PolarHBondContact O-N 3.01Å; S357-I359 PolarHBondContact OG-N 3.04Å; S357-G360 PolarHBondContact O-N 3.08Å; S357-G360 WeakPolarHBondContact OG-CA 3.43Å; S357-G360 PolarHBondContact OG-N 2.87Å; S357-G360 VanDerWaalsContact OG-N 3.08Å; S357-R363 VanDerWaalsContact O-CD 3.31Å; S357-R363 WeakPolarHBondContact O-CD 3.43Å
358	P	90.5	Very high	91.2	Very high	9 Å²	9	37.5 Å²	37.5	6%	0.058	22%	0.222	C	C	.	.	T	Hydrogen-bonded Turn	trans	-54.3	-20.4	179	19.8	-34.1	0	0	0	115.9	L308 L312 L370 P371	L308-P358 HydrophobicContact CB-CB 4.23Å; L308-P358 HydrophobicContact CB-CG 4.29Å; L312-P358 HydrophobicContact CB-CG 4.15Å; L312-P358 HydrophobicContact CD2-CG 4.12Å; P358-L370 WeakPolarHBondContact O-CD2 3.47Å; P358-P371 HydrophobicContact CB-CG 3.59Å; P358-P371 WeakPolarHBondContact O-CD 3.18Å
359	I	94.1	Very high	91	Very high	0 Å²	0	43.1 Å²	43.1	0%	0	24%	0.243	C	C	.	.	T	Hydrogen-bonded Turn	trans	-119.4	13.9	177.4	61.7	173.5	0	0	0	112.5	L312 I347 S357 L370 F374 L381	L312-I359 HydrophobicContact CD2-CD1 3.74Å; L312-I359 HydrophobicContact CD2-CG1 3.82Å; I347-I359 HydrophobicContact CD1-CD1 3.67Å; S357-I359 PolarHBondContact O-N 3.01Å; S357-I359 PolarHBondContact OG-N 3.04Å; I359-L370 HydrophobicContact CG2-CD2 4.47Å; I359-F374 HydrophobicContact CG2-CB 4.14Å; I359-F374 HydrophobicContact CG2-CD1 4.43Å; I359-F374 HydrophobicContact CG2-CD2 3.49Å; I359-F374 VanDerWaalsContact CG2-CD2 3.49Å; I359-F374 HydrophobicContact CG2-CE2 3.99Å; I359-F374 HydrophobicContact CG2-CG 3.75Å; I359-L381 HydrophobicContact CB-CD1 4.19Å; I359-L381 HydrophobicContact CB-CD2 4.46Å; I359-L381 HydrophobicContact CD1-CD2 4.47Å; I359-L381 HydrophobicContact CG2-CD1 4.05Å
360	G	92.6	Very high	90.9	Very high	0 Å²	0	43.6 Å²	43.6	0%	0	25%	0.245	C	C	.	.	S	Bend	trans	-77.6	162	-173.2	0	0	0	0	0	114.2	G350 P355 S357 N362 R363 L364	G350-G360 VanDerWaalsContact O-CA 3.3Å; G350-G360 WeakPolarHBondContact O-CA 3.28Å; P355-G360 CarbonylContact O-C 3.57Å; P355-G360 VanDerWaalsContact O-C 3.3Å; P355-G360 WeakPolarHBondContact O-CA 3.43Å; S357-G360 PolarHBondContact O-N 3.08Å; S357-G360 WeakPolarHBondContact OG-CA 3.43Å; S357-G360 PolarHBondContact OG-N 2.87Å; S357-G360 VanDerWaalsContact OG-N 3.08Å; G360-N362 VanDerWaalsContact C-N 3.34Å; G360-N362 PolarHBondContact O-N 3.2Å; G360-R363 PolarHBondContact O-N 3.34Å; G360-L364 WeakPolarHBondContact O-CG 3.49Å; G360-L364 PolarHBondContact O-N 3.3Å; G360-L364 VanDerWaalsContact O-N 3.08Å
361	A	90.9	Very high	90.8	Very high	23 Å²	23	43.6 Å²	43.6	19%	0.19	25%	0.245	C	C	.	.	H	α-helix	trans	-59.8	-39.4	-176.1	0	0	0	0	0	113.4	P355 L364 A365 C385 F389	P355-A361 PolarHBondContact O-N 2.81Å; A361-L364 PolarHBondContact O-N 2.92Å; A361-A365 VanDerWaalsContact O-CB 3.3Å; A361-A365 WeakPolarHBondContact O-CB 3.34Å; A361-A365 PolarHBondContact O-N 2.95Å; A361-C385 HydrophobicContact CB-CB 4.03Å; A361-F389 HydrophobicContact CB-CE2 4.01Å; A361-F389 HydrophobicContact CB-CZ 4.48Å
362	N	91.1	Very high	90.7	Very high	76 Å²	76	45 Å²	45	41%	0.406	25%	0.252	S	S	.	.	H	α-helix	trans	-66.3	-46.3	-177.9	-67.2	-10.4	0	0	0	110.7	P355 D356 G360 L364 A365 V366	P355-N362 WeakPolarHBondContact O-CB 3.38Å; P355-N362 PolarHBondContact O-N 2.8Å; D356-N362 WeakPolarHBondContact OD1-CB 3.44Å; D356-N362 PolarHBondContact OD1-ND2 3.49Å; G360-N362 VanDerWaalsContact C-N 3.34Å; G360-N362 PolarHBondContact O-N 3.2Å; N362-L364 PolarHBondContact O-N 3.43Å; N362-A365 PolarHBondContact O-N 3.07Å; N362-V366 WeakPolarHBondContact O-CG2 3.47Å; N362-V366 PolarHBondContact O-N 2.94Å; N362-V366 VanDerWaalsContact O-N 3.1Å
363	R	89.4	Confident	90.7	Very high	55 Å²	55	41.8 Å²	41.8	21%	0.208	24%	0.24	C	C	.	.	H	α-helix	trans	-64.9	-39.9	178.3	-73.1	-168.4	61.6	175.6	-5.2	112.5	D356 S357 G360 G367 H368 R369	D356-R363 WeakPolarHBondContact O-CD 3.44Å; S357-R363 VanDerWaalsContact O-CD 3.31Å; S357-R363 WeakPolarHBondContact O-CD 3.43Å; G360-R363 PolarHBondContact O-N 3.34Å; R363-G367 PolarHBondContact O-N 3.41Å; R363-H368 HydrophobicContact CB-CB 4.3Å; R363-H368 WeakPolarHBondContact O-CB 3.2Å; R363-H368 PolarHBondContact O-N 2.84Å; R363-R369 PolarHBondContact NH2-O 2.84Å
364	L	90.8	Very high	90.9	Very high	15 Å²	15	41.2 Å²	41.2	8%	0.079	24%	0.237	C	C	.	.	H	α-helix	trans	-64.2	-43.8	176.3	-75.5	170.3	0	0	0	111.9	G360 A361 N362 G367 L370 R378 L381	G360-L364 WeakPolarHBondContact O-CG 3.49Å; G360-L364 PolarHBondContact O-N 3.3Å; G360-L364 VanDerWaalsContact O-N 3.08Å; A361-L364 PolarHBondContact O-N 2.92Å; N362-L364 PolarHBondContact O-N 3.43Å; L364-G367 PolarHBondContact O-N 3.45Å; L364-G367 VanDerWaalsContact O-N 3.17Å; L364-L370 HydrophobicContact CD2-CD1 3.87Å; L364-L370 HydrophobicContact CD2-CD2 3.76Å; L364-L370 HydrophobicContact CD2-CG 4.1Å; L364-L370 HydrophobicContact CG-CD2 4.41Å; L364-R378 HydrophobicContact CD2-CG 4.18Å; L364-R378 PolarHBondContact O-NH2 2.84Å; L364-L381 HydrophobicContact CD1-CB 4.03Å
365	A	89.8	Confident	90.9	Very high	89 Å²	89	43.8 Å²	43.8	74%	0.736	26%	0.256	S	S	*	.	H	α-helix	trans	-64.5	-40.1	-179.5	0	0	0	0	0	112.9	A361 N362 G367	A361-A365 VanDerWaalsContact O-CB 3.3Å; A361-A365 WeakPolarHBondContact O-CB 3.34Å; A361-A365 PolarHBondContact O-N 2.95Å; N362-A365 PolarHBondContact O-N 3.07Å; A365-G367 PolarHBondContact O-N 3.2Å
366	V	89.9	Confident	91	Very high	106 Å²	106	44.3 Å²	44.3	64%	0.642	26%	0.261	S	S	*	.	H	α-helix	trans	-72.3	-11.4	177.3	177.6	0	0	0	0	112.3	N362 H368	N362-V366 WeakPolarHBondContact O-CG2 3.47Å; N362-V366 PolarHBondContact O-N 2.94Å; N362-V366 VanDerWaalsContact O-N 3.1Å; V366-H368 WeakPolarHBondContact CG1-NE2 3.17Å
367	G	87.4	Confident	91.3	Very high	50 Å²	50	39 Å²	39	52%	0.515	23%	0.232	S	C	.	.	T	Hydrogen-bonded Turn	trans	81.9	16.5	-177.5	0	0	0	0	0	113.6	R363 L364 A365	R363-G367 PolarHBondContact O-N 3.41Å; L364-G367 PolarHBondContact O-N 3.45Å; L364-G367 VanDerWaalsContact O-N 3.17Å; A365-G367 PolarHBondContact O-N 3.2Å
368	H	87.6	Confident	91.4	Very high	98 Å²	98	43 Å²	43	45%	0.454	25%	0.246	S	C	.	.	P	Polyproline II helix	trans	-60.8	149.7	177.7	-78.6	-69.7	0	0	0	111.6	R363 V366 L370 R378	R363-H368 HydrophobicContact CB-CB 4.3Å; R363-H368 WeakPolarHBondContact O-CB 3.2Å; R363-H368 PolarHBondContact O-N 2.84Å; V366-H368 WeakPolarHBondContact CG1-NE2 3.17Å; H368-L370 PolarHBondContact O-N 3.13Å; H368-R378 PolarHBondContact O-NH1 2.86Å
369	R	90.8	Very high	91.5	Very high	119 Å²	119	46.8 Å²	46.8	45%	0.449	27%	0.273	S	S	.	.	P	Polyproline II helix	trans	-59.3	130.4	170	-179.4	178.6	173	-78.2	-6.9	109.5	D305 R363	D305-R369 IonicContact OD1-CZ 3.11Å; D305-R369 IonicContact OD1-NH1 3.49Å; D305-R369 PolarHBondContact OD1-NH1 3.25Å; D305-R369 IonicContact OD2-CZ 3.19Å; D305-R369 IonicContact OD2-NH1 3.49Å; D305-R369 PolarHBondContact OD2-NH1 3.41Å; D305-R369 IonicContact OD2-NH2 3.99Å; D305-R369 PolarHBondContact OD2-NH2 3.15Å; R363-R369 PolarHBondContact NH2-O 2.84Å
370	L	92.9	Very high	91.6	Very high	10 Å²	10	49.3 Å²	49.3	5%	0.052	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-82.4	155.4	171	-71.6	172	0	0	0	110	P358 I359 L364 H368 F372 R378 L381	P358-L370 WeakPolarHBondContact O-CD2 3.47Å; I359-L370 HydrophobicContact CG2-CD2 4.47Å; L364-L370 HydrophobicContact CD2-CD1 3.87Å; L364-L370 HydrophobicContact CD2-CD2 3.76Å; L364-L370 HydrophobicContact CD2-CG 4.1Å; L364-L370 HydrophobicContact CG-CD2 4.41Å; H368-L370 PolarHBondContact O-N 3.13Å; L370-F372 PolarHBondContact O-N 2.87Å; L370-R378 HydrophobicContact CD1-CB 3.74Å; L370-R378 HydrophobicContact CD1-CG 3.83Å; L370-L381 HydrophobicContact CD1-CD1 4.28Å
371	P	93.4	Very high	91.7	Very high	0 Å²	0	49.3 Å²	49.3	0%	0	29%	0.285	C	S	.	.	P	Polyproline II helix	trans	-49.9	139.4	164.8	-22.9	32.1	0	0	0	110.3	D305 V309 P358 M373 F374 S375	D305-P371 HydrophobicContact CB-CB 3.99Å; V309-P371 HydrophobicContact CG2-CB 3.83Å; V309-P371 HydrophobicContact CG2-CG 3.79Å; P358-P371 HydrophobicContact CB-CG 3.59Å; P358-P371 WeakPolarHBondContact O-CD 3.18Å; P371-M373 HydrophobicContact CB-CE 4.07Å; P371-M373 PolarHBondContact O-N 2.98Å; P371-F374 HydrophobicContact CB-CD2 4.33Å; P371-F374 HydrophobicContact CG-CD2 4.43Å; P371-F374 PolarHBondContact O-N 3.24Å; P371-S375 PolarHBondContact O-N 3.28Å
372	F	91.7	Very high	91.9	Very high	31 Å²	31	50.4 Å²	50.4	14%	0.136	29%	0.294	C	S	.	.	G	3₁₀ helix	trans	-51.7	-35.6	-176.1	68.6	-87.7	0	0	0	112.8	E302 D305 V306 L370 F374 S375 Y503 E506	E302-F372 HydrophobicContact CB-CD1 4.12Å; E302-F372 HydrophobicContact CB-CE1 3.82Å; E302-F372 HydrophobicContact CG-CD1 3.81Å; E302-F372 HydrophobicContact CG-CE1 3.93Å; E302-F372 HydrophobicContact CG-CG 4.38Å; D305-F372 HydrophobicContact CB-CD1 3.73Å; D305-F372 HydrophobicContact CB-CE1 3.96Å; D305-F372 WeakPolarHBondContact OD2-CD1 3.38Å; D305-F372 PolarHBondContact OD2-N 2.83Å; D305-F372 VanDerWaalsContact OD2-N 3.14Å; V306-F372 HydrophobicContact CG2-CE1 3.87Å; V306-F372 HydrophobicContact CG2-CZ 3.94Å; L370-F372 PolarHBondContact O-N 2.87Å; F372-F374 PolarHBondContact O-N 2.79Å; F372-F374 VanDerWaalsContact O-N 3.13Å; F372-S375 WeakPolarHBondContact O-CB 3.42Å; F372-S375 PolarHBondContact O-N 3.18Å; F372-S375 VanDerWaalsContact O-N 3.14Å; F372-S375 PolarHBondContact O-OG 3.33Å; F372-Y503 HydrophobicContact CD2-CD1 4.12Å; F372-Y503 AromaticContact CD2-CE1 3.61Å; F372-Y503 HydrophobicContact CD2-CE1 3.61Å; F372-Y503 AromaticContact CE2-CD1 3.67Å; F372-Y503 HydrophobicContact CE2-CD1 3.67Å; F372-Y503 AromaticContact CE2-CE1 3.64Å; F372-Y503 HydrophobicContact CE2-CE1 3.64Å; F372-Y503 PolarHBondContact O-OH 3.29Å; F372-E506 HydrophobicContact CE2-CG 4.17Å; F372-E506 HydrophobicContact CZ-CG 3.78Å
373	M	92.3	Very high	92.1	Very high	3 Å²	3	51.2 Å²	51.2	2%	0.015	29%	0.292	C	S	.	.	G	3₁₀ helix	trans	-57.5	-24.1	177	-64.5	165.6	-80.4	0	0	114.9	D305 V306 V309 P371 F499 Y503 E506 I510	D305-M373 HydrophobicContact CB-CE 4.4Å; V306-M373 HydrophobicContact CB-CE 4.38Å; V306-M373 HydrophobicContact CG2-CE 3.82Å; V306-M373 HydrophobicContact CG2-SD 4.21Å; V309-M373 HydrophobicContact CB-CE 4.01Å; V309-M373 HydrophobicContact CG2-CE 3.54Å; P371-M373 HydrophobicContact CB-CE 4.07Å; P371-M373 PolarHBondContact O-N 2.98Å; M373-F499 HydrophobicContact CB-CD2 3.85Å; M373-F499 HydrophobicContact CB-CE2 3.68Å; M373-F499 HydrophobicContact CG-CD2 4.37Å; M373-F499 HydrophobicContact CG-CE2 3.79Å; M373-F499 HydrophobicContact SD-CE2 3.57Å; M373-F499 VanDerWaalsContact SD-CE2 3.57Å; M373-F499 HydrophobicContact SD-CZ 4.09Å; M373-Y503 VanDerWaalsContact CA-CE2 3.49Å; M373-Y503 HydrophobicContact CB-CD2 4.02Å; M373-Y503 HydrophobicContact CB-CE2 4.29Å; M373-Y503 HydrophobicContact CB-CG 4.24Å; M373-Y503 HydrophobicContact CG-CD1 4.09Å; M373-Y503 HydrophobicContact CG-CD2 4.19Å; M373-Y503 HydrophobicContact CG-CG 3.88Å; M373-Y503 WeakPolarHBondContact O-CE2 3.15Å; M373-E506 HydrophobicContact CG-CB 4.45Å; M373-E506 HydrophobicContact CG-CG 4.25Å; M373-E506 HydrophobicContact SD-CB 3.72Å; M373-E506 HydrophobicContact SD-CG 3.9Å; M373-I510 HydrophobicContact SD-CD1 4.04Å
374	F	94.6	Very high	92.4	Very high	2 Å²	2	48.6 Å²	48.6	1%	0.009	28%	0.282	C	S	.	.	G	3₁₀ helix	trans	-113.5	2	-178.7	-68.7	-64.3	0	0	0	113.4	V309 I347 I359 P371 F372 S376 S377 R378 L381 V495 F499	V309-F374 HydrophobicContact CG1-CE2 4.09Å; V309-F374 HydrophobicContact CG2-CD2 4.29Å; V309-F374 HydrophobicContact CG2-CE2 3.89Å; I347-F374 HydrophobicContact CD1-CD1 4.32Å; I347-F374 HydrophobicContact CD1-CE1 3.5Å; I347-F374 HydrophobicContact CD1-CZ 3.85Å; I359-F374 HydrophobicContact CG2-CB 4.14Å; I359-F374 HydrophobicContact CG2-CD1 4.43Å; I359-F374 HydrophobicContact CG2-CD2 3.49Å; I359-F374 VanDerWaalsContact CG2-CD2 3.49Å; I359-F374 HydrophobicContact CG2-CE2 3.99Å; I359-F374 HydrophobicContact CG2-CG 3.75Å; P371-F374 HydrophobicContact CB-CD2 4.33Å; P371-F374 HydrophobicContact CG-CD2 4.43Å; P371-F374 PolarHBondContact O-N 3.24Å; F372-F374 PolarHBondContact O-N 2.79Å; F372-F374 VanDerWaalsContact O-N 3.13Å; F374-S376 VanDerWaalsContact C-N 3.32Å; F374-S376 PolarHBondContact O-N 3.33Å; F374-S377 PolarHBondContact O-N 3.39Å; F374-S377 PolarHBondContact O-OG 3.11Å; F374-R378 PolarHBondContact O-N 3.43Å; F374-L381 HydrophobicContact CB-CD1 3.9Å; F374-L381 HydrophobicContact CD1-CD1 4.29Å; F374-L381 HydrophobicContact CG-CD1 4.29Å; F374-V495 HydrophobicContact CD1-CG1 4.39Å; F374-V495 HydrophobicContact CE1-CG1 4.41Å; F374-F499 HydrophobicContact CE1-CB 4.14Å; F374-F499 HydrophobicContact CE1-CD2 4.49Å; F374-F499 HydrophobicContact CE1-CG 4.16Å; F374-F499 HydrophobicContact CZ-CD1 4.29Å; F374-F499 HydrophobicContact CZ-CD2 4.36Å; F374-F499 HydrophobicContact CZ-CG 4.16Å
375	S	90.4	Very high	92.6	Very high	68 Å²	68	48.2 Å²	48.2	48%	0.476	28%	0.281	S	S	.	.	G	3₁₀ helix	trans	-58.4	-40.4	-175.6	61.1	0	0	0	0	113.1	P371 F372 S377	P371-S375 PolarHBondContact O-N 3.28Å; F372-S375 WeakPolarHBondContact O-CB 3.42Å; F372-S375 PolarHBondContact O-N 3.18Å; F372-S375 VanDerWaalsContact O-N 3.14Å; F372-S375 PolarHBondContact O-OG 3.33Å; S375-S377 PolarHBondContact O-N 2.84Å
376	S	90.5	Very high	92.7	Very high	53 Å²	53	51.4 Å²	51.4	37%	0.371	27%	0.274	S	S	.	.	G	3₁₀ helix	trans	-70.3	-15.3	177.3	63.9	0	0	0	0	113.9	F374 R498 E502	F374-S376 VanDerWaalsContact C-N 3.32Å; F374-S376 PolarHBondContact O-N 3.33Å; S376-R498 PolarHBondContact O-NH1 3.47Å; S376-E502 PolarHBondContact OG-OE2 2.88Å
377	S	93.7	Very high	92.9	Very high	4 Å²	4	48.6 Å²	48.6	3%	0.028	25%	0.253	C	S	.	.	G	3₁₀ helix	trans	-110.2	14.3	-174.6	66.4	0	0	0	0	113.9	F374 S375 S379 E380 L381	F374-S377 PolarHBondContact O-N 3.39Å; F374-S377 PolarHBondContact O-OG 3.11Å; S375-S377 PolarHBondContact O-N 2.84Å; S377-S379 VanDerWaalsContact C-N 3.28Å; S377-S379 PolarHBondContact O-N 3.32Å; S377-E380 VanDerWaalsContact C-OE2 3.3Å; S377-E380 WeakPolarHBondContact CA-OE2 3.44Å; S377-E380 PolarHBondContact O-N 3.48Å; S377-L381 WeakPolarHBondContact O-CB 3.37Å; S377-L381 WeakPolarHBondContact O-CG 3.39Å; S377-L381 PolarHBondContact O-N 3.11Å; S377-L381 WeakPolarHBondContact OG-CD1 3.49Å
378	R	93.9	Very high	93.2	Very high	92 Å²	92	46.2 Å²	46.2	35%	0.347	23%	0.229	S	C	.	.	H	α-helix	trans	-54.6	-43.2	-175.1	-178.2	175.2	-178.9	85.5	8.7	112.7	L364 H368 L370 F374 A382	L364-R378 HydrophobicContact CD2-CG 4.18Å; L364-R378 PolarHBondContact O-NH2 2.84Å; H368-R378 PolarHBondContact O-NH1 2.86Å; L370-R378 HydrophobicContact CD1-CB 3.74Å; L370-R378 HydrophobicContact CD1-CG 3.83Å; F374-R378 PolarHBondContact O-N 3.43Å; R378-A382 WeakPolarHBondContact O-CB 3.3Å; R378-A382 PolarHBondContact O-N 3.11Å
379	S	93.6	Very high	93.4	Very high	89 Å²	89	45.9 Å²	45.9	62%	0.622	23%	0.226	S	C	*	.	H	α-helix	trans	-69.3	-39.8	-176.7	73.4	0	0	0	0	112	S377 A382 Y383	S377-S379 VanDerWaalsContact C-N 3.28Å; S377-S379 PolarHBondContact O-N 3.32Å; S379-A382 PolarHBondContact O-N 3.05Å; S379-Y383 PolarHBondContact O-N 3.24Å
380	E	95.2	Very high	93.4	Very high	52 Å²	52	43.9 Å²	43.9	24%	0.243	24%	0.236	C	C	.	.	H	α-helix	trans	-68.6	-43.2	178	-61.5	93.7	136.5	0	0	110.8	S377 Y383 L384 V495 R498	S377-E380 VanDerWaalsContact C-OE2 3.3Å; S377-E380 WeakPolarHBondContact CA-OE2 3.44Å; S377-E380 PolarHBondContact O-N 3.48Å; E380-Y383 WeakPolarHBondContact O-CB 3.14Å; E380-Y383 PolarHBondContact O-N 3.2Å; E380-L384 WeakPolarHBondContact O-CB 3.11Å; E380-L384 VanDerWaalsContact O-CG 3.28Å; E380-L384 WeakPolarHBondContact O-CG 3.4Å; E380-L384 PolarHBondContact O-N 3.41Å; E380-V495 HydrophobicContact CB-CG2 3.93Å; E380-R498 IonicContact OE1-CZ 2.67Å; E380-R498 IonicContact OE1-NH1 3.13Å; E380-R498 PolarHBondContact OE1-NH1 3.01Å; E380-R498 IonicContact OE1-NH2 3.65Å; E380-R498 PolarHBondContact OE1-NH2 3.27Å
381	L	96.2	Very high	93.2	Very high	0 Å²	0	44.6 Å²	44.6	0%	0	24%	0.239	C	C	.	.	H	α-helix	trans	-62.8	-43.3	174.7	-70.7	172	0	0	0	111.8	I347 I359 L364 L370 F374 S377 Y383 L384 C385 V495	I347-L381 HydrophobicContact CD1-CD2 4.39Å; I347-L381 HydrophobicContact CG2-CD2 4.15Å; I359-L381 HydrophobicContact CB-CD1 4.19Å; I359-L381 HydrophobicContact CB-CD2 4.46Å; I359-L381 HydrophobicContact CD1-CD2 4.47Å; I359-L381 HydrophobicContact CG2-CD1 4.05Å; L364-L381 HydrophobicContact CD1-CB 4.03Å; L370-L381 HydrophobicContact CD1-CD1 4.28Å; F374-L381 HydrophobicContact CB-CD1 3.9Å; F374-L381 HydrophobicContact CD1-CD1 4.29Å; F374-L381 HydrophobicContact CG-CD1 4.29Å; S377-L381 WeakPolarHBondContact O-CB 3.37Å; S377-L381 WeakPolarHBondContact O-CG 3.39Å; S377-L381 PolarHBondContact O-N 3.11Å; S377-L381 WeakPolarHBondContact OG-CD1 3.49Å; L381-Y383 VanDerWaalsContact C-N 3.32Å; L381-Y383 PolarHBondContact O-N 2.99Å; L381-L384 PolarHBondContact O-N 2.82Å; L381-C385 PolarHBondContact O-N 3.49Å; L381-C385 PolarHBondContact O-SG 3.24Å; L381-C385 VanDerWaalsContact O-SG 3.38Å; L381-V495 HydrophobicContact CD2-CG1 4.19Å
382	A	94.2	Very high	92.7	Very high	47 Å²	47	49.2 Å²	49.2	39%	0.388	26%	0.257	S	S	.	.	H	α-helix	trans	-61.6	-40.8	175.5	0	0	0	0	0	112	R378 S379 R386	R378-A382 WeakPolarHBondContact O-CB 3.3Å; R378-A382 PolarHBondContact O-N 3.11Å; S379-A382 PolarHBondContact O-N 3.05Å; A382-R386 PolarHBondContact O-N 2.78Å
383	Y	94.8	Very high	92.4	Very high	93 Å²	93	50.3 Å²	50.3	37%	0.365	27%	0.267	S	S	.	.	H	α-helix	trans	-61.2	-47.6	172.4	171.5	-95.1	0	0	0	111.7	S379 E380 L381 R386 Q387 L488	S379-Y383 PolarHBondContact O-N 3.24Å; E380-Y383 WeakPolarHBondContact O-CB 3.14Å; E380-Y383 PolarHBondContact O-N 3.2Å; L381-Y383 VanDerWaalsContact C-N 3.32Å; L381-Y383 PolarHBondContact O-N 2.99Å; Y383-R386 PolarHBondContact O-N 3.28Å; Y383-Q387 HydrophobicContact CD1-CG 4.26Å; Y383-Q387 HydrophobicContact CD2-CG 4.27Å; Y383-Q387 HydrophobicContact CE1-CG 3.81Å; Y383-Q387 HydrophobicContact CE2-CG 3.81Å; Y383-Q387 HydrophobicContact CG-CG 4.47Å; Y383-Q387 WeakPolarHBondContact O-CG 3.27Å; Y383-Q387 PolarHBondContact O-N 2.88Å; Y383-L488 HydrophobicContact CE1-CD2 4.11Å
384	L	96	Very high	91.8	Very high	0 Å²	0	51.5 Å²	51.5	0%	0	27%	0.273	C	S	.	.	H	α-helix	trans	-61.6	-47.4	179.7	-74.2	173.3	0	0	0	111.9	I347 E380 L381 R386 Q387 L388 L488 I492 V495	I347-L384 HydrophobicContact CG2-CD1 3.97Å; E380-L384 WeakPolarHBondContact O-CB 3.11Å; E380-L384 VanDerWaalsContact O-CG 3.28Å; E380-L384 WeakPolarHBondContact O-CG 3.4Å; E380-L384 PolarHBondContact O-N 3.41Å; L381-L384 PolarHBondContact O-N 2.82Å; L384-R386 VanDerWaalsContact C-N 3.31Å; L384-R386 PolarHBondContact O-N 3.01Å; L384-Q387 PolarHBondContact O-N 3.49Å; L384-Q387 VanDerWaalsContact O-N 3.16Å; L384-L388 HydrophobicContact CB-CD1 4.41Å; L384-L388 VanDerWaalsContact O-CB 3.3Å; L384-L388 WeakPolarHBondContact O-CB 3.21Å; L384-L388 WeakPolarHBondContact O-CG 3.16Å; L384-L388 PolarHBondContact O-N 3.2Å; L384-L488 HydrophobicContact CD2-CD2 4.25Å; L384-I492 HydrophobicContact CD1-CG1 3.92Å; L384-I492 HydrophobicContact CD2-CD1 4.38Å; L384-I492 HydrophobicContact CD2-CG1 3.65Å; L384-I492 HydrophobicContact CG-CG1 4.41Å; L384-V495 HydrophobicContact CD1-CG2 4.3Å
385	C	94.9	Very high	91.4	Very high	7 Å²	7	52.5 Å²	52.5	5%	0.047	28%	0.278	C	S	.	.	H	α-helix	trans	-52.7	-49.8	174.7	-73.9	0	0	0	0	111	C351 A361 L381 Q387 F389	C351-C385 VanDerWaalsContact CB-SG 3.54Å; C351-C385 VanDerWaalsContact SG-SG 3.64Å; A361-C385 HydrophobicContact CB-CB 4.03Å; L381-C385 PolarHBondContact O-N 3.49Å; L381-C385 PolarHBondContact O-SG 3.24Å; L381-C385 VanDerWaalsContact O-SG 3.38Å; C385-Q387 PolarHBondContact O-N 3.27Å; C385-F389 WeakPolarHBondContact O-CD2 3.37Å; C385-F389 PolarHBondContact O-N 3.48Å
386	R	93.4	Very high	91.3	Very high	155 Å²	155	49.3 Å²	49.3	59%	0.585	26%	0.256	S	S	*	.	H	α-helix	trans	-61.8	-42.1	179.3	-173.3	178	60.3	81.9	3.7	112.8	A382 Y383 L384	A382-R386 PolarHBondContact O-N 2.78Å; Y383-R386 PolarHBondContact O-N 3.28Å; L384-R386 VanDerWaalsContact C-N 3.31Å; L384-R386 PolarHBondContact O-N 3.01Å
387	Q	93.9	Very high	91.1	Very high	47 Å²	47	47.6 Å²	47.6	22%	0.22	24%	0.243	C	C	.	.	H	α-helix	trans	-72.3	-43.2	-178.6	-67.5	-58	-58.3	0	0	112.8	Y383 L384 C385 F389 A390 L391 L488	Y383-Q387 HydrophobicContact CD1-CG 4.26Å; Y383-Q387 HydrophobicContact CD2-CG 4.27Å; Y383-Q387 HydrophobicContact CE1-CG 3.81Å; Y383-Q387 HydrophobicContact CE2-CG 3.81Å; Y383-Q387 HydrophobicContact CG-CG 4.47Å; Y383-Q387 WeakPolarHBondContact O-CG 3.27Å; Y383-Q387 PolarHBondContact O-N 2.88Å; L384-Q387 PolarHBondContact O-N 3.49Å; L384-Q387 VanDerWaalsContact O-N 3.16Å; C385-Q387 PolarHBondContact O-N 3.27Å; Q387-F389 VanDerWaalsContact C-N 3.29Å; Q387-F389 PolarHBondContact O-N 3.27Å; Q387-A390 WeakPolarHBondContact O-CB 3.47Å; Q387-A390 PolarHBondContact O-N 2.66Å; Q387-L391 PolarHBondContact O-N 3.4Å; Q387-L488 HydrophobicContact CB-CD1 4.26Å; Q387-L488 HydrophobicContact CB-CD2 3.53Å; Q387-L488 HydrophobicContact CG-CD2 3.87Å
388	L	93.1	Very high	90.7	Very high	0 Å²	0	49.6 Å²	49.6	0%	0	25%	0.25	C	S	.	.	H	α-helix	trans	-65.6	-32.3	-177.7	-69.8	174	0	0	0	112.4	L348 C351 R352 L384 A390 L391 L396 L399 I492	L348-L388 HydrophobicContact CD1-CD1 4.02Å; L348-L388 HydrophobicContact CD1-CD2 3.6Å; L348-L388 HydrophobicContact CD1-CG 4.44Å; C351-L388 HydrophobicContact CB-CD1 3.73Å; R352-L388 HydrophobicContact CB-CB 4.15Å; R352-L388 HydrophobicContact CB-CD1 4.39Å; R352-L388 WeakPolarHBondContact CD-O 3.35Å; R352-L388 HydrophobicContact CG-CB 4.44Å; R352-L388 PolarHBondContact NE-O 3Å; L384-L388 HydrophobicContact CB-CD1 4.41Å; L384-L388 VanDerWaalsContact O-CB 3.3Å; L384-L388 WeakPolarHBondContact O-CB 3.21Å; L384-L388 WeakPolarHBondContact O-CG 3.16Å; L384-L388 PolarHBondContact O-N 3.2Å; L388-A390 VanDerWaalsContact C-N 3.31Å; L388-L391 HydrophobicContact CD2-CD1 3.96Å; L388-L396 HydrophobicContact CD2-CD1 4.32Å; L388-L399 HydrophobicContact CD2-CD2 3.62Å; L388-I492 HydrophobicContact CD2-CD1 4.27Å
389	F	91.8	Very high	90.5	Very high	91 Å²	91	45.2 Å²	45.2	40%	0.399	23%	0.234	S	C	.	.	H	α-helix	trans	-71.5	-25	173.1	-87.2	-99.2	0	0	0	113.4	C351 A361 C385 Q387	C351-F389 VanDerWaalsContact O-CE2 3.26Å; C351-F389 WeakPolarHBondContact O-CE2 3.49Å; A361-F389 HydrophobicContact CB-CE2 4.01Å; A361-F389 HydrophobicContact CB-CZ 4.48Å; C385-F389 WeakPolarHBondContact O-CD2 3.37Å; C385-F389 PolarHBondContact O-N 3.48Å; Q387-F389 VanDerWaalsContact C-N 3.29Å; Q387-F389 PolarHBondContact O-N 3.27Å
390	A	90.8	Very high	90.3	Very high	78 Å²	78	41.3 Å²	41.3	65%	0.645	21%	0.206	S	C	*	.	H	α-helix	trans	-83.8	-13.4	177.8	0	0	0	0	0	113.5	Q387 L388	Q387-A390 WeakPolarHBondContact O-CB 3.47Å; Q387-A390 PolarHBondContact O-N 2.66Å; L388-A390 VanDerWaalsContact C-N 3.31Å
391	L	88.2	Confident	90	Very high	25 Å²	25	44.4 Å²	44.4	13%	0.131	22%	0.216	C	C	.	.	S	Bend	trans	-73.1	143.5	178.7	-70.2	-179.4	0	0	0	112.2	Q387 L388 Q395 L396 L399 L485 L488	Q387-L391 PolarHBondContact O-N 3.4Å; L388-L391 HydrophobicContact CD2-CD1 3.96Å; L391-Q395 HydrophobicContact CB-CB 4.45Å; L391-Q395 HydrophobicContact CD2-CB 4.21Å; L391-L396 HydrophobicContact CD1-CD1 4.32Å; L391-L399 HydrophobicContact CD1-CD2 4Å; L391-L485 HydrophobicContact CD1-CD2 4.01Å; L391-L485 HydrophobicContact CD2-CD2 3.96Å; L391-L488 HydrophobicContact CD1-CD1 3.73Å; L391-L488 HydrophobicContact CD2-CD1 3.99Å; L391-L488 HydrophobicContact CG-CD1 4.11Å
392	R	84.2	Confident	89.7	Confident	97 Å²	97	45 Å²	45	37%	0.366	22%	0.218	S	C	.	.			trans	-73.1	156	170.1	-53.9	-174.7	-51.2	-148.2	-5.1	111.2	D394 Q395 L396	R392-D394 VanDerWaalsContact C-N 3.27Å; R392-D394 WeakPolarHBondContact CB-OD1 3.18Å; R392-D394 IonicContact CZ-OD1 3.2Å; R392-D394 IonicContact CZ-OD2 3.24Å; R392-D394 IonicContact NE-OD1 2.91Å; R392-D394 PolarHBondContact NE-OD1 3.37Å; R392-D394 IonicContact NE-OD2 2.82Å; R392-D394 PolarHBondContact NE-OD2 2.74Å; R392-D394 VanDerWaalsContact NE-OD2 3.13Å; R392-D394 IonicContact NH2-OD2 2.78Å; R392-D394 PolarHBondContact NH2-OD2 2.8Å; R392-D394 PolarHBondContact O-N 2.8Å; R392-Q395 HydrophobicContact CB-CG 4.44Å; R392-Q395 VanDerWaalsContact N-OE1 3.13Å; R392-Q395 WeakPolarHBondContact O-CB 3.46Å; R392-Q395 PolarHBondContact O-N 3.36Å; R392-Q395 VanDerWaalsContact O-N 3.12Å; R392-L396 PolarHBondContact O-N 2.98Å
393	P	83.9	Confident	89.5	Confident	54 Å²	54	42.8 Å²	42.8	35%	0.351	20%	0.199	S	C	.	.	H	α-helix	trans	-56.6	-35.9	-179.8	-25.9	35	0	0	0	114.6	L396 C397 A602	P393-L396 PolarHBondContact O-N 3.15Å; P393-C397 WeakPolarHBondContact O-CB 3.48Å; P393-C397 PolarHBondContact O-N 3.16Å; P393-A602 HydrophobicContact CB-CB 4.47Å; P393-A602 HydrophobicContact CG-CB 4.34Å
394	D	80.5	Confident	89.3	Confident	28 Å²	28	38.5 Å²	38.5	15%	0.15	18%	0.184	C	C	.	.	H	α-helix	trans	-63.2	-45.2	176	52.2	-72.5	0	0	0	112.5	R392 L396 C397 R398 W478	R392-D394 VanDerWaalsContact C-N 3.27Å; R392-D394 WeakPolarHBondContact CB-OD1 3.18Å; R392-D394 IonicContact CZ-OD1 3.2Å; R392-D394 IonicContact CZ-OD2 3.24Å; R392-D394 IonicContact NE-OD1 2.91Å; R392-D394 PolarHBondContact NE-OD1 3.37Å; R392-D394 IonicContact NE-OD2 2.82Å; R392-D394 PolarHBondContact NE-OD2 2.74Å; R392-D394 VanDerWaalsContact NE-OD2 3.13Å; R392-D394 IonicContact NH2-OD2 2.78Å; R392-D394 PolarHBondContact NH2-OD2 2.8Å; R392-D394 PolarHBondContact O-N 2.8Å; D394-L396 VanDerWaalsContact C-N 3.34Å; D394-C397 PolarHBondContact O-N 2.75Å; D394-R398 PolarHBondContact O-N 3.22Å; D394-R398 VanDerWaalsContact O-N 3.14Å; D394-W478 HydrophobicContact CB-CH2 3.86Å; D394-W478 HydrophobicContact CB-CZ3 4.2Å; D394-W478 WeakPolarHBondContact OD2-CH2 3.38Å; D394-W478 WeakPolarHBondContact OD2-CZ3 3.48Å
395	Q	86.5	Confident	88.7	Confident	22 Å²	22	39.5 Å²	39.5	10%	0.103	19%	0.19	C	C	.	.	H	α-helix	trans	-66.2	-39.9	177.1	-67.6	175.6	-33.5	0	0	111.1	L391 R392 R398 L399 C481 L485	L391-Q395 HydrophobicContact CB-CB 4.45Å; L391-Q395 HydrophobicContact CD2-CB 4.21Å; R392-Q395 HydrophobicContact CB-CG 4.44Å; R392-Q395 VanDerWaalsContact N-OE1 3.13Å; R392-Q395 WeakPolarHBondContact O-CB 3.46Å; R392-Q395 PolarHBondContact O-N 3.36Å; R392-Q395 VanDerWaalsContact O-N 3.12Å; Q395-R398 PolarHBondContact O-N 3.15Å; Q395-L399 WeakPolarHBondContact O-CB 3.16Å; Q395-L399 PolarHBondContact O-N 3Å; Q395-C481 PolarHBondContact NE2-SG 3.48Å; Q395-C481 VanDerWaalsContact NE2-SG 3.36Å; Q395-L485 HydrophobicContact CB-CD1 4.07Å; Q395-L485 HydrophobicContact CB-CD2 3.95Å; Q395-L485 HydrophobicContact CB-CG 4.49Å; Q395-L485 HydrophobicContact CG-CD1 4.19Å
396	L	88.4	Confident	87.9	Confident	2 Å²	2	44.9 Å²	44.9	1%	0.01	22%	0.218	C	C	.	.	H	α-helix	trans	-67.3	-39.8	178.6	-169.6	63.9	0	0	0	112.1	L348 R352 L388 L391 R392 P393 D394 R398 L399 T400 F605	L348-L396 HydrophobicContact CD1-CD1 3.87Å; R352-L396 HydrophobicContact CG-CD1 4.37Å; R352-L396 HydrophobicContact CG-CD2 3.97Å; L388-L396 HydrophobicContact CD2-CD1 4.32Å; L391-L396 HydrophobicContact CD1-CD1 4.32Å; R392-L396 PolarHBondContact O-N 2.98Å; P393-L396 PolarHBondContact O-N 3.15Å; D394-L396 VanDerWaalsContact C-N 3.34Å; L396-R398 VanDerWaalsContact C-N 3.35Å; L396-L399 PolarHBondContact O-N 3.12Å; L396-T400 WeakPolarHBondContact O-CB 3.36Å; L396-T400 PolarHBondContact O-N 3.46Å; L396-T400 PolarHBondContact O-OG1 3.1Å; L396-F605 HydrophobicContact CB-CE1 4.48Å; L396-F605 HydrophobicContact CB-CE2 4.06Å; L396-F605 HydrophobicContact CB-CZ 4.04Å; L396-F605 HydrophobicContact CD1-CE1 4.46Å; L396-F605 HydrophobicContact CD2-CB 4.12Å; L396-F605 HydrophobicContact CD2-CD1 3.34Å; L396-F605 HydrophobicContact CD2-CD2 3.74Å; L396-F605 HydrophobicContact CD2-CE1 3.56Å; L396-F605 HydrophobicContact CD2-CE2 3.94Å; L396-F605 HydrophobicContact CD2-CG 3.44Å; L396-F605 VanDerWaalsContact CD2-CG 3.44Å; L396-F605 HydrophobicContact CD2-CZ 3.87Å; L396-F605 HydrophobicContact CG-CD1 3.87Å; L396-F605 HydrophobicContact CG-CD2 4.25Å; L396-F605 HydrophobicContact CG-CE1 3.5Å; L396-F605 VanDerWaalsContact CG-CE1 3.5Å; L396-F605 HydrophobicContact CG-CE2 3.91Å; L396-F605 HydrophobicContact CG-CG 4.23Å; L396-F605 HydrophobicContact CG-CZ 3.53Å
397	C	85.5	Confident	87	Confident	16 Å²	16	38.3 Å²	38.3	11%	0.108	20%	0.199	C	C	.	.	H	α-helix	trans	-60.5	-44.3	172.9	-177.2	0	0	0	0	111.4	P393 D394 T400 R401 L601 F605	P393-C397 WeakPolarHBondContact O-CB 3.48Å; P393-C397 PolarHBondContact O-N 3.16Å; D394-C397 PolarHBondContact O-N 2.75Å; C397-T400 WeakPolarHBondContact O-CB 3.36Å; C397-T400 PolarHBondContact O-N 3.18Å; C397-R401 PolarHBondContact O-N 3.16Å; C397-L601 HydrophobicContact CB-CD2 4.11Å; C397-L601 VanDerWaalsContact SG-CD2 3.6Å; C397-F605 HydrophobicContact CB-CE2 4.2Å; C397-F605 HydrophobicContact CB-CZ 4.49Å
398	R	84.8	Confident	85.8	Confident	47 Å²	47	38.5 Å²	38.5	18%	0.177	20%	0.201	C	C	.	.	H	α-helix	trans	-63.4	-46.4	176.6	-169.4	171.6	-176.2	168.1	-0.6	112.2	D394 Q395 L396 T400 R401 W402 L482	D394-R398 PolarHBondContact O-N 3.22Å; D394-R398 VanDerWaalsContact O-N 3.14Å; Q395-R398 PolarHBondContact O-N 3.15Å; L396-R398 VanDerWaalsContact C-N 3.35Å; R398-T400 VanDerWaalsContact C-N 3.33Å; R398-T400 PolarHBondContact O-N 3.28Å; R398-R401 PolarHBondContact O-N 3.07Å; R398-W402 HydrophobicContact CG-CZ2 4.12Å; R398-W402 PolarHBondContact O-N 3.08Å; R398-W402 VanDerWaalsContact O-N 3.11Å; R398-L482 VanDerWaalsContact NH2-CD1 3.34Å
399	L	90.5	Very high	84.1	Confident	0 Å²	0	41.2 Å²	41.2	0%	0	22%	0.219	C	C	.	.	H	α-helix	trans	-60.2	-43.2	176	179.8	61.5	0	0	0	111.7	L348 L388 L391 Q395 L396 R401 W402 L403 L485 L488 I492	L348-L399 HydrophobicContact CD1-CD2 3.97Å; L348-L399 HydrophobicContact CD1-CG 4.47Å; L388-L399 HydrophobicContact CD2-CD2 3.62Å; L391-L399 HydrophobicContact CD1-CD2 4Å; Q395-L399 WeakPolarHBondContact O-CB 3.16Å; Q395-L399 PolarHBondContact O-N 3Å; L396-L399 PolarHBondContact O-N 3.12Å; L399-R401 VanDerWaalsContact C-N 3.29Å; L399-R401 PolarHBondContact O-N 3.17Å; L399-W402 HydrophobicContact CD1-CE3 4.4Å; L399-W402 WeakPolarHBondContact O-CB 3.49Å; L399-W402 PolarHBondContact O-N 2.99Å; L399-W402 VanDerWaalsContact O-N 3.15Å; L399-L403 HydrophobicContact CD1-CD1 4.15Å; L399-L403 HydrophobicContact CD1-CG 4.3Å; L399-L403 HydrophobicContact CG-CD1 3.92Å; L399-L403 HydrophobicContact CG-CG 4.48Å; L399-L403 VanDerWaalsContact O-CG 3.31Å; L399-L403 WeakPolarHBondContact O-CG 3.41Å; L399-L403 PolarHBondContact O-N 2.97Å; L399-L485 HydrophobicContact CB-CD2 4.23Å; L399-L488 HydrophobicContact CD2-CB 4.33Å; L399-I492 HydrophobicContact CD2-CD1 4.06Å
400	T	90	Very high	81.6	Confident	6 Å²	6	43.4 Å²	43.4	4%	0.037	24%	0.235	C	C	.	.	H	α-helix	trans	-56.5	-44.5	175.9	-62.4	0	0	0	0	111.4	W319 L325 L345 L348 L396 C397 R398 W402 L403 G404 F605	W319-T400 HydrophobicContact CH2-CG2 3.43Å; W319-T400 VanDerWaalsContact CH2-CG2 3.43Å; W319-T400 HydrophobicContact CZ2-CG2 4.18Å; W319-T400 HydrophobicContact CZ3-CG2 4.24Å; L325-T400 HydrophobicContact CD2-CG2 3.65Å; L345-T400 HydrophobicContact CD2-CG2 4.41Å; L348-T400 HydrophobicContact CD2-CG2 4.45Å; L348-T400 VanDerWaalsContact CD2-OG1 3.26Å; L348-T400 WeakPolarHBondContact CD2-OG1 3.47Å; L396-T400 WeakPolarHBondContact O-CB 3.36Å; L396-T400 PolarHBondContact O-N 3.46Å; L396-T400 PolarHBondContact O-OG1 3.1Å; C397-T400 WeakPolarHBondContact O-CB 3.36Å; C397-T400 PolarHBondContact O-N 3.18Å; R398-T400 VanDerWaalsContact C-N 3.33Å; R398-T400 PolarHBondContact O-N 3.28Å; T400-W402 VanDerWaalsContact C-N 3.33Å; T400-W402 PolarHBondContact O-N 3.05Å; T400-L403 PolarHBondContact O-N 3.31Å; T400-G404 PolarHBondContact O-N 3.4Å; T400-F605 WeakPolarHBondContact OG1-CE1 2.96Å; T400-F605 WeakPolarHBondContact OG1-CZ 3.44Å
401	R	87.9	Confident	79.1	Confident	118 Å²	118	45 Å²	45	45%	0.445	23%	0.232	S	C	.	.	H	α-helix	trans	-63.3	-39.4	177.7	-171.7	171.8	-65.4	171.1	0.7	112.1	C397 R398 L399 L403 G404	C397-R401 PolarHBondContact O-N 3.16Å; R398-R401 PolarHBondContact O-N 3.07Å; L399-R401 VanDerWaalsContact C-N 3.29Å; L399-R401 PolarHBondContact O-N 3.17Å; R401-L403 VanDerWaalsContact C-N 3.31Å; R401-L403 PolarHBondContact O-N 3.36Å; R401-G404 PolarHBondContact O-N 3.31Å
402	W	90	Very high	76.5	Confident	13 Å²	13	51.4 Å²	51.4	5%	0.049	26%	0.264	C	S	.	.	H	α-helix	trans	-66.3	-31.9	176	-64.7	-11.5	0	0	0	113.6	R398 L399 T400 G407 L408 L482 L485 H486 Y489	R398-W402 HydrophobicContact CG-CZ2 4.12Å; R398-W402 PolarHBondContact O-N 3.08Å; R398-W402 VanDerWaalsContact O-N 3.11Å; L399-W402 HydrophobicContact CD1-CE3 4.4Å; L399-W402 WeakPolarHBondContact O-CB 3.49Å; L399-W402 PolarHBondContact O-N 2.99Å; L399-W402 VanDerWaalsContact O-N 3.15Å; T400-W402 VanDerWaalsContact C-N 3.33Å; T400-W402 PolarHBondContact O-N 3.05Å; W402-G407 WeakPolarHBondContact CA-O 3.49Å; W402-G407 CarbonylContact O-C 3.49Å; W402-G407 WeakPolarHBondContact O-CA 3.43Å; W402-L408 HydrophobicContact CB-CG 4.41Å; W402-L408 HydrophobicContact CD2-CD2 4.43Å; W402-L408 HydrophobicContact CD2-CG 4.4Å; W402-L408 HydrophobicContact CG-CG 4.22Å; W402-L482 HydrophobicContact CH2-CD1 3.57Å; W402-L482 HydrophobicContact CH2-CG 4.44Å; W402-L482 HydrophobicContact CZ2-CD1 3.76Å; W402-L485 HydrophobicContact CH2-CB 4.06Å; W402-L485 HydrophobicContact CZ3-CB 3.7Å; W402-H486 HydrophobicContact CZ3-CB 4.34Å; W402-Y489 HydrophobicContact CB-CD2 3.92Å; W402-Y489 HydrophobicContact CB-CE2 4.34Å; W402-Y489 WeakPolarHBondContact O-CE2 3.26Å
403	L	91.1	Very high	73.9	Confident	0 Å²	0	54.3 Å²	54.3	0%	0	28%	0.276	C	S	.	.	H	α-helix	trans	-83.7	-15.1	178	-64.1	169.2	0	0	0	113	A341 R344 L345 L348 L399 T400 R401 Y489 I492	A341-L403 WeakPolarHBondContact CB-O 3.19Å; R344-L403 HydrophobicContact CB-CB 4.32Å; R344-L403 HydrophobicContact CB-CD2 4.03Å; R344-L403 HydrophobicContact CG-CD2 4.48Å; L345-L403 HydrophobicContact CD2-CB 3.8Å; L348-L403 HydrophobicContact CB-CD1 3.99Å; L348-L403 HydrophobicContact CD1-CD1 4.15Å; L348-L403 HydrophobicContact CD2-CD1 4.09Å; L348-L403 HydrophobicContact CG-CD1 4.31Å; L399-L403 HydrophobicContact CD1-CD1 4.15Å; L399-L403 HydrophobicContact CD1-CG 4.3Å; L399-L403 HydrophobicContact CG-CD1 3.92Å; L399-L403 HydrophobicContact CG-CG 4.48Å; L399-L403 VanDerWaalsContact O-CG 3.31Å; L399-L403 WeakPolarHBondContact O-CG 3.41Å; L399-L403 PolarHBondContact O-N 2.97Å; T400-L403 PolarHBondContact O-N 3.31Å; R401-L403 VanDerWaalsContact C-N 3.31Å; R401-L403 PolarHBondContact O-N 3.36Å; L403-Y489 HydrophobicContact CD2-CD2 3.59Å; L403-Y489 HydrophobicContact CD2-CE2 3.96Å; L403-Y489 HydrophobicContact CG-CD2 4.24Å; L403-I492 HydrophobicContact CD1-CD1 3.8Å; L403-I492 HydrophobicContact CD1-CG2 4.09Å; L403-I492 HydrophobicContact CD2-CB 4.06Å; L403-I492 HydrophobicContact CD2-CG2 3.65Å
404	G	89.3	Confident	71.3	Confident	3 Å²	3	54.9 Å²	54.9	3%	0.031	28%	0.277	C	S	.	.	S	Bend	trans	-78.7	-173.8	179.9	0	0	0	0	0	114.2	T400 R401 N406 G407	T400-G404 PolarHBondContact O-N 3.4Å; R401-G404 PolarHBondContact O-N 3.31Å; G404-N406 PolarHBondContact O-N 2.92Å; G404-G407 PolarHBondContact O-N 3.48Å
405	P	83.7	Confident	69	Low	21 Å²	21	62.5 Å²	62.5	14%	0.136	31%	0.311	C	S	.	.	T	Hydrogen-bonded Turn	trans	-64.2	-26.6	-175.8	26.3	-35.3	0	0	0	113.3	L326 C337 G407	L326-P405 HydrophobicContact CD2-CG 4.01Å; C337-P405 HydrophobicContact CB-CB 3.97Å; P405-G407 PolarHBondContact O-N 3.42Å
406	N	79.2	Confident	66.5	Low	120 Å²	120	68.8 Å²	68.8	64%	0.642	34%	0.338	S	S	*	.	T	Hydrogen-bonded Turn	trans	-74	-11.9	177.2	-61.1	-21.3	0	0	0	112.9	G404	G404-N406 PolarHBondContact O-N 2.92Å
407	G	73.8	Confident	63.9	Low	17 Å²	17	72 Å²	72	18%	0.175	36%	0.355	C	S	.	.			trans	58.2	-161.7	-179.9	0	0	0	0	0	114.1	W402 G404 P405	W402-G407 WeakPolarHBondContact CA-O 3.49Å; W402-G407 CarbonylContact O-C 3.49Å; W402-G407 WeakPolarHBondContact O-CA 3.43Å; G404-G407 PolarHBondContact O-N 3.48Å; P405-G407 PolarHBondContact O-N 3.42Å
408	L	68.1	Low	61.3	Low	50 Å²	50	75.3 Å²	75.3	26%	0.262	38%	0.378	S	S	.	.	S	Bend	trans	-67.8	139.9	157.8	-80.7	109.2	0	0	0	108.4	W402 N410 Y489	W402-L408 HydrophobicContact CB-CG 4.41Å; W402-L408 HydrophobicContact CD2-CD2 4.43Å; W402-L408 HydrophobicContact CD2-CG 4.4Å; W402-L408 HydrophobicContact CG-CG 4.22Å; L408-N410 PolarHBondContact O-N 3.07Å; L408-N410 VanDerWaalsContact O-N 3.08Å; L408-Y489 HydrophobicContact CD1-CD1 3.66Å; L408-Y489 HydrophobicContact CD1-CD2 4.09Å; L408-Y489 HydrophobicContact CD1-CE1 3.22Å; L408-Y489 HydrophobicContact CD1-CE2 3.68Å; L408-Y489 HydrophobicContact CD1-CG 4.08Å
409	P	58.6	Low	58.7	Low	58 Å²	58	76.8 Å²	76.8	38%	0.377	40%	0.396	S	S	.	.			trans	-51.9	123.2	165.7	22.3	-30.3	0	0	0	108.2	L411	P409-L411 PolarHBondContact O-N 3.19Å
410	N	39.4	Very low	55.8	Low	137 Å²	137	86.3 Å²	86.3	73%	0.733	43%	0.432	S	S	*	.			trans	-57.5	114	-179.4	-76.7	-44.4	0	0	0	108.7	L408 I412	L408-N410 PolarHBondContact O-N 3.07Å; L408-N410 VanDerWaalsContact O-N 3.08Å; N410-I412 PolarHBondContact O-N 3.46Å
411	L	38.2	Very low	53.1	Low	112 Å²	112	92.4 Å²	92.4	59%	0.586	46%	0.464	S	S	*	.	S	Bend	trans	-57.9	-7.3	168.4	-114.4	84.9	0	0	0	113.1	P409 Y413 L580	P409-L411 PolarHBondContact O-N 3.19Å; L411-Y413 VanDerWaalsContact C-N 3.33Å; L411-Y413 PolarHBondContact O-N 2.97Å; L411-L580 HydrophobicContact CD1-CD1 3.63Å; L411-L580 HydrophobicContact CD1-CD2 3.55Å; L411-L580 HydrophobicContact CD1-CG 4.22Å; L411-L580 HydrophobicContact CD2-CD1 4.2Å; L411-L580 HydrophobicContact CG-CD1 3.99Å; L411-L580 HydrophobicContact CG-CD2 3.97Å; L411-L580 HydrophobicContact CG-CG 4.47Å
412	I	32	Very low	50.5	Low	158 Å²	158	91.3 Å²	91.3	81%	0.81	47%	0.474	S	S	*	.			trans	-97.3	62.2	179.6	-46.2	173.3	0	0	0	108.6	N410	N410-I412 PolarHBondContact O-N 3.46Å
413	Y	29.7	Very low	47.8	Very low	159 Å²	159	97.4 Å²	97.4	62%	0.624	51%	0.508	S	S	*	.			trans	-133.5	70.3	164.7	-161.8	-94.4	0	0	0	108.8	L411	L411-Y413 VanDerWaalsContact C-N 3.33Å; L411-Y413 PolarHBondContact O-N 2.97Å
414	N	29.4	Very low	44.8	Very low	66 Å²	66	102.8 Å²	102.8	35%	0.353	55%	0.545	S	S	.	.			trans	-154.8	27.9	162.1	-98	-19.7	0	0	0	115.6	L417 E579	N414-L417 WeakPolarHBondContact OD1-CB 3.5Å; N414-E579 PolarHBondContact ND2-OE1 2.92Å; N414-E579 PolarHBondContact ND2-OE2 3.22Å
415	Q	32.5	Very low	41.8	Very low	188 Å²	188	111.5 Å²	111.5	88%	0.879	59%	0.585	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.8	-16.6	160.4	-155.3	172	26.2	0	0	112.6
416	K	35.2	Very low	39.1	Very low	154 Å²	154	115.5 Å²	115.5	67%	0.67	60%	0.602	S	S	*	*	T	Hydrogen-bonded Turn	trans	-91.6	-22.4	175.6	-91.3	-177.7	176.9	177.6	0	114.6	S419	K416-S419 PolarHBondContact O-N 3.41Å; K416-S419 PolarHBondContact O-OG 3.12Å
417	L	33.5	Very low	36.5	Very low	68 Å²	68	117.3 Å²	117.3	36%	0.356	61%	0.607	S	S	.	*	G	3₁₀ helix	trans	-87.1	-20.4	178	-126.8	139.9	0	0	0	112.6	N414 S419 R420 L421	N414-L417 WeakPolarHBondContact OD1-CB 3.5Å; L417-S419 PolarHBondContact O-N 3.47Å; L417-S419 VanDerWaalsContact O-N 3.12Å; L417-R420 PolarHBondContact O-N 2.76Å; L417-L421 HydrophobicContact CD2-CD1 4.17Å; L417-L421 HydrophobicContact CD2-CG 4.2Å; L417-L421 PolarHBondContact O-N 3.3Å
418	S	29.9	Very low	34	Very low	86 Å²	86	123.1 Å²	123.1	60%	0.601	64%	0.639	S	S	*	*	G	3₁₀ helix	trans	-62.8	-12.1	161.7	-165.6	0	0	0	0	113.6
419	S	30.9	Very low	32	Very low	78 Å²	78	128.1 Å²	128.1	55%	0.545	67%	0.666	S	S	.	*	G	3₁₀ helix	trans	-93.4	-8.1	170.6	74.7	0	0	0	0	114.1	K416 L417	K416-S419 PolarHBondContact O-N 3.41Å; K416-S419 PolarHBondContact O-OG 3.12Å; L417-S419 PolarHBondContact O-N 3.47Å; L417-S419 VanDerWaalsContact O-N 3.12Å
420	R	30.2	Very low	30.9	Very low	200 Å²	200	130.3 Å²	130.3	76%	0.755	68%	0.68	S	S	*	*	T	Hydrogen-bonded Turn	trans	-109.3	-18.9	177.2	-72.9	-169.9	174.6	179.3	-1.6	113.9	L417 S422	L417-R420 PolarHBondContact O-N 2.76Å; R420-S422 VanDerWaalsContact C-N 3.28Å
421	L	32.7	Very low	30.2	Very low	135 Å²	135	131.8 Å²	131.8	71%	0.707	69%	0.688	S	S	*	*	T	Hydrogen-bonded Turn	trans	-81.9	-2.8	174.4	-73.3	167.4	0	0	0	113.9	L417	L417-L421 HydrophobicContact CD2-CD1 4.17Å; L417-L421 HydrophobicContact CD2-CG 4.2Å; L417-L421 PolarHBondContact O-N 3.3Å
422	S	34	Very low	29.3	Very low	95 Å²	95	132 Å²	132	66%	0.664	70%	0.697	S	S	*	*	T	Hydrogen-bonded Turn	trans	-84.4	-5.3	172.5	-57	0	0	0	0	114.5	R420	R420-S422 VanDerWaalsContact C-N 3.28Å
423	D	32.2	Very low	28.7	Very low	141 Å²	141	129.4 Å²	129.4	75%	0.754	69%	0.693	S	S	*	*	S	Bend	trans	-123.2	24.7	-172.1	-72.9	-23	0	0	0	115.1
424	S	28.7	Very low	28.3	Very low	113 Å²	113	129.4 Å²	129.4	79%	0.79	70%	0.703	S	S	*	*			trans	-146.4	52.9	173.7	-75.3	0	0	0	0	114.3
425	E	26.4	Very low	27.9	Very low	185 Å²	185	134.7 Å²	134.7	86%	0.864	73%	0.726	S	S	*	*			trans	-115	81.9	156.1	-72.4	-170.8	158.5	0	0	108.7
426	Q	26.8	Very low	27.3	Very low	105 Å²	105	134.6 Å²	134.6	49%	0.491	73%	0.725	S	S	.	*			trans	176.1	98.9	156.2	-100.5	162.5	35.3	0	0	110.9	S553 G554	Q426-S553 VanDerWaalsContact OE1-CA 3.28Å; Q426-G554 PolarHBondContact NE2-O 3.45Å
427	Q	23.9	Very low	26.7	Very low	159 Å²	159	133.8 Å²	133.8	74%	0.743	73%	0.733	S	S	*	*				173.1	95.3	119.7	-95.8	172.8	6.6	0	0	109.7
428	T	21.8	Very low	26.4	Very low	139 Å²	139	135.3 Å²	135.3	85%	0.853	75%	0.747	S	S	*	*			trans	-53.2	136.1	142	44	0	0	0	0	109.2
429	N	25.1	Very low	26.1	Very low	154 Å²	154	137.6 Å²	137.6	82%	0.824	75%	0.753	S	S	*	*			trans	-119.1	135.1	163.3	-122.9	-10.2	0	0	0	109.2
430	P	37.3	Very low	25.6	Very low	104 Å²	104	141.5 Å²	141.5	68%	0.675	76%	0.762	S	S	*	*			trans	-94	149.4	-169.1	36.9	-31.9	0	0	0	111.5
431	N	23.5	Very low	25.2	Very low	168 Å²	168	137.6 Å²	137.6	90%	0.898	76%	0.755	S	S	*	*			trans	-158.8	120.2	147.8	-97.3	-30.7	0	0	0	111.1
432	C	19.7	Very low	24.7	Very low	116 Å²	116	139.9 Å²	139.9	78%	0.784	76%	0.759	S	S	*	*			trans	69.8	93	151.2	-135.6	0	0	0	0	117.1
433	S	19.1	Very low	23.9	Very low	104 Å²	104	141.3 Å²	141.3	73%	0.727	76%	0.764	S	S	*	*				72.6	129.9	74.6	-64.8	0	0	0	0	115.2
434	L	21.4	Very low	23.5	Very low	159 Å²	159	142 Å²	142	83%	0.832	77%	0.766	S	S	*	*			trans	86.3	119.1	170.2	-52.3	-177.9	0	0	0	113.7
435	Q	22	Very low	23.1	Very low	178 Å²	178	142.4 Å²	142.4	83%	0.832	76%	0.764	S	S	*	*			cis	-156.9	141.2	23.9	-109.7	158.9	0.6	0	0	109.7
436	E	18.9	Very low	22.8	Very low	185 Å²	185	139.8 Å²	139.8	86%	0.864	76%	0.761	S	S	*	*			trans	-65.2	148.7	168.7	-64.2	162.7	142	0	0	111.4
437	V	23.3	Very low	22.5	Very low	138 Å²	138	141 Å²	141	84%	0.836	78%	0.776	S	S	*	*				163.4	142.9	119.2	161.9	0	0	0	0	109.6
438	P	27.2	Very low	22.4	Very low	99 Å²	99	139 Å²	139	64%	0.643	77%	0.774	S	S	*	*			trans	-107.3	-176.4	-153.6	35.8	-20.4	0	0	0	113.4
439	N	22.1	Very low	22.4	Very low	135 Å²	135	144.2 Å²	144.2	72%	0.722	78%	0.779	S	S	*	*			trans	125	100.5	158.6	-61.7	-13.4	0	0	0	111.4
440	E	20.8	Very low	22.3	Very low	160 Å²	160	140.4 Å²	140.4	75%	0.748	78%	0.776	S	S	*	*				88.4	116.5	86.2	-88.3	-165.6	158	0	0	113.6
441	I	22.1	Very low	21.7	Very low	117 Å²	117	140.8 Å²	140.8	60%	0.6	78%	0.78	S	S	*	*			trans	84.7	118.4	130.7	-62.4	172.1	0	0	0	119.6
442	K	21.7	Very low	21.8	Very low	183 Å²	183	144.5 Å²	144.5	80%	0.796	78%	0.782	S	S	*	*			trans	72.7	113.6	144.7	-73.6	166.6	-169.9	171.8	0	121.3
443	T	18.2	Very low	22	Very low	125 Å²	125	146.9 Å²	146.9	77%	0.767	78%	0.783	S	S	*	*				35.2	114.7	117.2	-24.3	0	0	0	0	118.1
444	I	23.6	Very low	22.3	Very low	156 Å²	156	146.1 Å²	146.1	80%	0.8	78%	0.779	S	S	*	*				-179.7	134	122.8	-86.2	150.7	0	0	0	109.7
445	T	20.2	Very low	22.6	Very low	122 Å²	122	147 Å²	147	75%	0.748	78%	0.783	S	S	*	*			trans	-51.9	130.1	163.9	35	0	0	0	0	114.1
446	T	20.4	Very low	22.8	Very low	130 Å²	130	143.4 Å²	143.4	80%	0.798	78%	0.778	S	S	*	*			trans	174.1	121.9	130.3	35.3	0	0	0	0	111.8
447	T	20	Very low	23.2	Very low	130 Å²	130	139.3 Å²	139.3	80%	0.798	77%	0.769	S	S	*	*			trans	17.5	114.1	139.7	-47.1	0	0	0	0	118.4
448	T	22	Very low	23.5	Very low	117 Å²	117	140.6 Å²	140.6	72%	0.718	77%	0.771	S	S	*	*				166.1	123.3	120	-63.8	0	0	0	0	111.4
449	R	21.6	Very low	23.5	Very low	249 Å²	249	143.7 Å²	143.7	94%	0.94	78%	0.781	S	S	*	*			trans	54.4	105.2	159	-74.6	177.3	167.6	176.3	-3.5	119.4
450	G	23.6	Very low	23.7	Very low	74 Å²	74	143.4 Å²	143.4	76%	0.763	78%	0.784	S	S	*	*			trans	-171.9	107.4	156	0	0	0	0	0	109.2	R452	G450-R452 PolarHBondContact O-N 2.97Å
451	S	25.3	Very low	24.2	Very low	111 Å²	111	142 Å²	142	78%	0.776	79%	0.789	S	S	*	*			trans	-41	128.1	-171.9	-52.6	0	0	0	0	114.2	M453	S451-M453 PolarHBondContact O-N 3.49Å
452	R	23.7	Very low	24.4	Very low	246 Å²	246	141 Å²	141	93%	0.928	79%	0.793	S	S	*	*			trans	-54.6	92.7	158.1	-71.4	173.6	118	144	-0.4	107.6	G450 S454	G450-R452 PolarHBondContact O-N 2.97Å; R452-S454 PolarHBondContact O-N 3.2Å
453	M	24.9	Very low	24.7	Very low	166 Å²	166	138 Å²	138	82%	0.818	79%	0.794	S	S	*	*			trans	-67.9	93.3	159.4	-71.1	-111.7	83	0	0	105.2	S451 L455	S451-M453 PolarHBondContact O-N 3.49Å; M453-L455 PolarHBondContact O-N 2.88Å
454	S	24.7	Very low	25.3	Very low	89 Å²	89	138.1 Å²	138.1	62%	0.622	80%	0.795	S	S	*	*			trans	-48.1	114.2	163.7	-58.9	0	0	0	0	107.7	R452 S456	R452-S454 PolarHBondContact O-N 3.2Å; S454-S456 PolarHBondContact O-N 2.82Å
455	L	27.5	Very low	25.7	Very low	176 Å²	176	135.5 Å²	135.5	92%	0.921	79%	0.788	S	S	*	*	S	Bend	trans	-70.2	53.4	168.7	-73.2	168	0	0	0	110.2	M453	M453-L455 PolarHBondContact O-N 2.88Å
456	S	27.9	Very low	26.1	Very low	104 Å²	104	136.4 Å²	136.4	73%	0.727	79%	0.788	S	S	*	*			trans	-113.9	16.1	172	-57.3	0	0	0	0	111.6	S454	S454-S456 PolarHBondContact O-N 2.82Å
457	S	27.1	Very low	26.8	Very low	98 Å²	98	136.3 Å²	136.3	69%	0.685	78%	0.783	S	S	*	*			trans	-107.6	13	-173	57.3	0	0	0	0	116.1
458	L	28.1	Very low	27.5	Very low	166 Å²	166	136.6 Å²	136.6	87%	0.869	78%	0.779	S	S	*	*	S	Bend	trans	-107.7	6.1	171.1	-85.7	170.1	0	0	0	115.6
459	L	27.9	Very low	27.9	Very low	164 Å²	164	137 Å²	137	86%	0.859	78%	0.775	S	S	*	*			trans	-139	82.9	173.7	-66.4	170	0	0	0	109.9
460	T	27.1	Very low	28.4	Very low	129 Å²	129	128.8 Å²	128.8	79%	0.791	75%	0.753	S	S	*	*			trans	-67	147.4	157.3	42.7	0	0	0	0	109.5	S462	T460-S462 PolarHBondContact O-N 3.42Å
461	P	30.9	Very low	29	Very low	129 Å²	129	127.1 Å²	127.1	84%	0.838	73%	0.729	S	S	*	*			trans	-88.9	103.8	-150.3	32.9	-32.5	0	0	0	112
462	S	25.6	Very low	29.3	Very low	98 Å²	98	129.3 Å²	129.3	69%	0.685	72%	0.721	S	S	*	*			trans	-97.7	93.2	155	67.1	0	0	0	0	108.8	T460 V464	T460-S462 PolarHBondContact O-N 3.42Å; S462-V464 PolarHBondContact O-N 3.3Å; S462-V464 VanDerWaalsContact O-N 3.07Å
463	S	28.5	Very low	29.8	Very low	118 Å²	118	124.2 Å²	124.2	83%	0.825	71%	0.708	S	S	*	*	S	Bend	trans	25.9	74.8	145	58.1	0	0	0	0	117.5
464	V	31.1	Very low	30.3	Very low	128 Å²	128	121.6 Å²	121.6	78%	0.776	69%	0.692	S	S	*	*			trans	-143.9	128.3	155.2	-166	0	0	0	0	108.5	S462 N466	S462-V464 PolarHBondContact O-N 3.3Å; S462-V464 VanDerWaalsContact O-N 3.07Å; V464-N466 PolarHBondContact O-N 2.88Å
465	P	32.5	Very low	31.1	Very low	101 Å²	101	118.2 Å²	118.2	66%	0.656	67%	0.669	S	S	*	*			trans	-82.6	122.8	-163.7	7	9.1	0	0	0	113	N467	P465-N467 PolarHBondContact O-N 2.97Å
466	N	27.7	Very low	31.7	Very low	141 Å²	141	115.3 Å²	115.3	75%	0.754	65%	0.65	S	S	*	*			trans	22.8	47.5	138.1	-66.7	-9.2	0	0	0	120.6	V464	V464-N466 PolarHBondContact O-N 2.88Å
467	N	35.1	Very low	32.6	Very low	129 Å²	129	114.5 Å²	114.5	69%	0.69	64%	0.637	S	S	*	*			trans	-105.9	-0.2	176.8	-81.3	-17.9	0	0	0	116.2	P465 T470	P465-N467 PolarHBondContact O-N 2.97Å; N467-T470 PolarHBondContact O-OG1 2.96Å
468	L	34.3	Very low	33.3	Very low	136 Å²	136	112.1 Å²	112.1	71%	0.712	61%	0.613	S	S	*	*	S	Bend	trans	-91.6	-28.9	179.6	-82.5	150.1	0	0	0	114.1	T470 Y472	L468-T470 VanDerWaalsContact C-N 3.34Å; L468-T470 PolarHBondContact O-N 2.99Å; L468-Y472 WeakPolarHBondContact O-CD2 3.34Å
469	I	30.7	Very low	34.2	Very low	126 Å²	126	108.1 Å²	108.1	65%	0.646	59%	0.588	S	S	*	*	H	α-helix	trans	-75	-26.1	-177.7	-60.4	171.8	0	0	0	111.6
470	T	33.1	Very low	35.4	Very low	76 Å²	76	105.4 Å²	105.4	47%	0.466	58%	0.579	S	S	.	*	H	α-helix	trans	-79.8	-18.2	-179.2	55.3	0	0	0	0	113.9	N467 L468	N467-T470 PolarHBondContact O-OG1 2.96Å; L468-T470 VanDerWaalsContact C-N 3.34Å; L468-T470 PolarHBondContact O-N 2.99Å
471	S	34.8	Very low	37.2	Very low	38 Å²	38	100.9 Å²	100.9	27%	0.266	55%	0.552	S	S	.	*	H	α-helix	trans	-72	-53.3	177.6	177.2	0	0	0	0	111.6	Q473 K474 S475	S471-Q473 PolarHBondContact O-N 2.82Å; S471-K474 PolarHBondContact O-N 3.3Å; S471-K474 VanDerWaalsContact O-N 3.15Å; S471-S475 PolarHBondContact O-N 3.26Å
472	Y	31.5	Very low	39.5	Very low	157 Å²	157	97.7 Å²	97.7	62%	0.616	53%	0.528	S	S	*	.	H	α-helix	trans	-62.6	-40.7	-176.1	-70	-78.6	0	0	0	113.3	L468 K474 H476	L468-Y472 WeakPolarHBondContact O-CD2 3.34Å; Y472-K474 VanDerWaalsContact C-N 3.33Å; Y472-K474 PolarHBondContact O-N 2.97Å; Y472-H476 PolarHBondContact O-CD2 3.1Å; Y472-H476 PolarHBondContact O-N 2.87Å
473	Q	34.9	Very low	42.2	Very low	140 Å²	140	96.3 Å²	96.3	65%	0.654	52%	0.516	S	S	*	.	H	α-helix	trans	-68.7	-31.4	178.1	-74.1	-171.9	-30.6	0	0	112.9	S471	S471-Q473 PolarHBondContact O-N 2.82Å
474	K	36.4	Very low	44.9	Very low	110 Å²	110	92.5 Å²	92.5	48%	0.478	50%	0.496	S	S	.	.	H	α-helix	trans	-72.5	-52	176.5	-89.8	179.2	178.2	176.6	0	110.8	S471 Y472 H476 I477 W478	S471-K474 PolarHBondContact O-N 3.3Å; S471-K474 VanDerWaalsContact O-N 3.15Å; Y472-K474 VanDerWaalsContact C-N 3.33Å; Y472-K474 PolarHBondContact O-N 2.97Å; K474-H476 VanDerWaalsContact C-N 3.3Å; K474-H476 PolarHBondContact O-N 2.9Å; K474-I477 WeakPolarHBondContact O-CB 3.32Å; K474-I477 PolarHBondContact O-N 2.84Å; K474-W478 PolarHBondContact O-N 3.48Å; K474-W478 VanDerWaalsContact O-N 3.16Å; K474-W478 PolarHBondContact O-NE1 2.78Å
475	S	40	Very low	47.7	Very low	19 Å²	19	86.8 Å²	86.8	13%	0.133	46%	0.461	C	S	.	.	H	α-helix	trans	-46.6	-50.7	178.3	154	0	0	0	0	112	S471 I477 W478 K479 E581	S471-S475 PolarHBondContact O-N 3.26Å; S475-I477 PolarHBondContact O-N 3.01Å; S475-W478 PolarHBondContact O-N 3.35Å; S475-K479 PolarHBondContact O-N 2.86Å; S475-E581 PolarHBondContact OG-OE1 3.42Å
476	H	41	Very low	50.4	Low	114 Å²	114	85 Å²	85	53%	0.528	44%	0.444	S	S	.	.	H	α-helix	trans	-62.9	-36.5	179.8	-72.7	-61.9	0	0	0	114.4	Y472 K474 W478	Y472-H476 PolarHBondContact O-CD2 3.1Å; Y472-H476 PolarHBondContact O-N 2.87Å; K474-H476 VanDerWaalsContact C-N 3.3Å; K474-H476 PolarHBondContact O-N 2.9Å; H476-W478 VanDerWaalsContact C-N 3.26Å; H476-W478 PolarHBondContact O-N 2.77Å
477	I	46.8	Very low	53.4	Low	88 Å²	88	86.5 Å²	86.5	45%	0.451	44%	0.439	S	S	.	.	H	α-helix	trans	-64.6	-32.6	174.2	-88.6	157.7	0	0	0	111.4	K474 S475 T480 C481	K474-I477 WeakPolarHBondContact O-CB 3.32Å; K474-I477 PolarHBondContact O-N 2.84Å; S475-I477 PolarHBondContact O-N 3.01Å; I477-T480 PolarHBondContact O-OG1 2.97Å; I477-C481 PolarHBondContact O-SG 3.26Å; I477-C481 VanDerWaalsContact O-SG 3.42Å
478	W	40.9	Very low	56.2	Low	47 Å²	47	80.6 Å²	80.6	18%	0.178	41%	0.408	C	S	.	.	H	α-helix	trans	-77.4	-37.4	178.9	-56.7	112.6	0	0	0	113.1	D394 K474 S475 H476 T480 C481 L482 I592	D394-W478 HydrophobicContact CB-CH2 3.86Å; D394-W478 HydrophobicContact CB-CZ3 4.2Å; D394-W478 WeakPolarHBondContact OD2-CH2 3.38Å; D394-W478 WeakPolarHBondContact OD2-CZ3 3.48Å; K474-W478 PolarHBondContact O-N 3.48Å; K474-W478 VanDerWaalsContact O-N 3.16Å; K474-W478 PolarHBondContact O-NE1 2.78Å; S475-W478 PolarHBondContact O-N 3.35Å; H476-W478 VanDerWaalsContact C-N 3.26Å; H476-W478 PolarHBondContact O-N 2.77Å; W478-T480 VanDerWaalsContact C-N 3.27Å; W478-T480 PolarHBondContact O-N 3.45Å; W478-C481 PolarHBondContact O-N 3.24Å; W478-L482 PolarHBondContact O-N 3.32Å; W478-I592 HydrophobicContact CH2-CD1 4.35Å; W478-I592 HydrophobicContact CZ2-CD1 3.95Å
479	K	48.1	Very low	59	Low	82 Å²	82	75.9 Å²	75.9	36%	0.357	38%	0.38	S	S	.	.	H	α-helix	trans	-53.8	-43.7	173.7	-67.4	-166.8	-176.6	-148.8	0	112.1	S475 C481 N578 E581	S475-K479 PolarHBondContact O-N 2.86Å; K479-C481 PolarHBondContact O-N 3.38Å; K479-N578 PolarHBondContact NZ-OD1 3.33Å; K479-E581 WeakPolarHBondContact CE-OE1 3.42Å; K479-E581 WeakPolarHBondContact CE-OE2 3.22Å; K479-E581 IonicContact NZ-OE1 2.87Å; K479-E581 IonicContact NZ-OE2 2.83Å; K479-E581 PolarHBondContact NZ-OE2 2.82Å
480	T	52.9	Low	62	Low	108 Å²	108	75.7 Å²	75.7	66%	0.663	38%	0.375	S	S	*	.	H	α-helix	trans	-71.8	-25.3	-176.8	61.7	0	0	0	0	114.2	I477 W478	I477-T480 PolarHBondContact O-OG1 2.97Å; W478-T480 VanDerWaalsContact C-N 3.27Å; W478-T480 PolarHBondContact O-N 3.45Å
481	C	63.5	Low	65	Low	33 Å²	33	74 Å²	74	22%	0.223	37%	0.367	C	S	.	.	H	α-helix	trans	-89.4	-18.7	-176.6	-68.9	0	0	0	0	113.6	Q395 I477 W478 K479 G484 L485	Q395-C481 PolarHBondContact NE2-SG 3.48Å; Q395-C481 VanDerWaalsContact NE2-SG 3.36Å; I477-C481 PolarHBondContact O-SG 3.26Å; I477-C481 VanDerWaalsContact O-SG 3.42Å; W478-C481 PolarHBondContact O-N 3.24Å; K479-C481 PolarHBondContact O-N 3.38Å; C481-G484 PolarHBondContact O-N 2.98Å; C481-L485 PolarHBondContact O-N 3.08Å; C481-L485 VanDerWaalsContact O-N 3.12Å
482	L	79.2	Confident	67.9	Low	62 Å²	62	72.2 Å²	72.2	33%	0.325	35%	0.354	S	S	.	.	H	α-helix	trans	-60.4	-44.1	-175.8	-166.3	73.2	0	0	0	113.5	R398 W402 W478 G484 L485 H486	R398-L482 VanDerWaalsContact NH2-CD1 3.34Å; W402-L482 HydrophobicContact CH2-CD1 3.57Å; W402-L482 HydrophobicContact CH2-CG 4.44Å; W402-L482 HydrophobicContact CZ2-CD1 3.76Å; W478-L482 PolarHBondContact O-N 3.32Å; L482-G484 VanDerWaalsContact C-N 3.3Å; L482-G484 PolarHBondContact O-N 2.83Å; L482-L485 PolarHBondContact O-N 3.41Å; L482-H486 WeakPolarHBondContact O-CB 3.3Å; L482-H486 PolarHBondContact O-N 2.98Å
483	P	82.4	Confident	70.9	Confident	69 Å²	69	65.2 Å²	65.2	45%	0.448	33%	0.328	S	S	.	.	H	α-helix	trans	-64.4	-35.7	178.5	-22.4	34.9	0	0	0	112.6	H486 R487	P483-H486 PolarHBondContact O-N 3.11Å; P483-R487 VanDerWaalsContact O-CG 3.3Å; P483-R487 WeakPolarHBondContact O-CG 3.46Å; P483-R487 PolarHBondContact O-N 3.5Å
484	G	86.5	Confident	73.8	Confident	39 Å²	39	61.4 Å²	61.4	40%	0.402	32%	0.316	S	S	.	.	H	α-helix	trans	-64.7	-46.6	176.8	0	0	0	0	0	111.9	C481 L482 H486 R487 L488	C481-G484 PolarHBondContact O-N 2.98Å; L482-G484 VanDerWaalsContact C-N 3.3Å; L482-G484 PolarHBondContact O-N 2.83Å; G484-H486 VanDerWaalsContact C-N 3.34Å; G484-H486 PolarHBondContact O-N 2.78Å; G484-R487 PolarHBondContact O-N 3.29Å; G484-L488 WeakPolarHBondContact O-CG 3.34Å; G484-L488 PolarHBondContact O-N 2.78Å; G484-L488 VanDerWaalsContact O-N 3.11Å
485	L	89.1	Confident	76.7	Confident	7 Å²	7	56.3 Å²	56.3	4%	0.037	30%	0.295	C	S	.	.	H	α-helix	trans	-63.7	-40.1	175.7	-75.3	169.1	0	0	0	112.3	L391 Q395 L399 W402 C481 L482 R487 L488 Y489	L391-L485 HydrophobicContact CD1-CD2 4.01Å; L391-L485 HydrophobicContact CD2-CD2 3.96Å; Q395-L485 HydrophobicContact CB-CD1 4.07Å; Q395-L485 HydrophobicContact CB-CD2 3.95Å; Q395-L485 HydrophobicContact CB-CG 4.49Å; Q395-L485 HydrophobicContact CG-CD1 4.19Å; L399-L485 HydrophobicContact CB-CD2 4.23Å; W402-L485 HydrophobicContact CH2-CB 4.06Å; W402-L485 HydrophobicContact CZ3-CB 3.7Å; C481-L485 PolarHBondContact O-N 3.08Å; C481-L485 VanDerWaalsContact O-N 3.12Å; L482-L485 PolarHBondContact O-N 3.41Å; L485-R487 VanDerWaalsContact C-N 3.32Å; L485-R487 PolarHBondContact O-N 3.41Å; L485-L488 PolarHBondContact O-N 3.44Å; L485-L488 VanDerWaalsContact O-N 3.17Å; L485-Y489 PolarHBondContact O-N 2.72Å
486	H	89.3	Confident	79.4	Confident	65 Å²	65	55.6 Å²	55.6	30%	0.301	29%	0.29	S	S	.	.	H	α-helix	trans	-65.5	-36.3	178.3	-178.2	-135.7	0	0	0	112	W402 L482 P483 G484 Y489 K490	W402-H486 HydrophobicContact CZ3-CB 4.34Å; L482-H486 WeakPolarHBondContact O-CB 3.3Å; L482-H486 PolarHBondContact O-N 2.98Å; P483-H486 PolarHBondContact O-N 3.11Å; G484-H486 VanDerWaalsContact C-N 3.34Å; G484-H486 PolarHBondContact O-N 2.78Å; H486-Y489 PolarHBondContact O-N 3.11Å; H486-K490 WeakPolarHBondContact CE1-CE 3.42Å; H486-K490 PolarHBondContact CE1-NZ 2.81Å; H486-K490 WeakPolarHBondContact NE2-CE 3.36Å; H486-K490 WeakPolarHBondContact O-CG 3.04Å; H486-K490 PolarHBondContact O-N 3.05Å
487	R	90.7	Very high	81.9	Confident	172 Å²	172	54 Å²	54	65%	0.649	29%	0.285	S	S	*	.	H	α-helix	trans	-62.1	-43	171	-73	174.1	-172.5	-173.4	3	111.7	P483 G484 L485 K490 S491	P483-R487 VanDerWaalsContact O-CG 3.3Å; P483-R487 WeakPolarHBondContact O-CG 3.46Å; P483-R487 PolarHBondContact O-N 3.5Å; G484-R487 PolarHBondContact O-N 3.29Å; L485-R487 VanDerWaalsContact C-N 3.32Å; L485-R487 PolarHBondContact O-N 3.41Å; R487-K490 PolarHBondContact O-N 3.2Å; R487-S491 PolarHBondContact O-N 3.47Å; R487-S491 PolarHBondContact O-OG 2.67Å
488	L	94.2	Very high	84.2	Confident	5 Å²	5	53 Å²	53	3%	0.026	28%	0.276	C	S	.	.	H	α-helix	trans	-64.5	-42.7	176.3	-65.6	176.8	0	0	0	112.2	Y383 L384 Q387 L391 L399 G484 L485 K490 S491 I492	Y383-L488 HydrophobicContact CE1-CD2 4.11Å; L384-L488 HydrophobicContact CD2-CD2 4.25Å; Q387-L488 HydrophobicContact CB-CD1 4.26Å; Q387-L488 HydrophobicContact CB-CD2 3.53Å; Q387-L488 HydrophobicContact CG-CD2 3.87Å; L391-L488 HydrophobicContact CD1-CD1 3.73Å; L391-L488 HydrophobicContact CD2-CD1 3.99Å; L391-L488 HydrophobicContact CG-CD1 4.11Å; L399-L488 HydrophobicContact CD2-CB 4.33Å; G484-L488 WeakPolarHBondContact O-CG 3.34Å; G484-L488 PolarHBondContact O-N 2.78Å; G484-L488 VanDerWaalsContact O-N 3.11Å; L485-L488 PolarHBondContact O-N 3.44Å; L485-L488 VanDerWaalsContact O-N 3.17Å; L488-K490 VanDerWaalsContact C-N 3.35Å; L488-K490 PolarHBondContact O-N 2.91Å; L488-S491 PolarHBondContact O-N 2.67Å; L488-I492 WeakPolarHBondContact O-CG1 3.3Å; L488-I492 PolarHBondContact O-N 3.32Å
489	Y	93.9	Very high	86.8	Confident	36 Å²	36	51 Å²	51	14%	0.141	27%	0.268	C	S	.	.	H	α-helix	trans	-56	-48.3	172.5	167.4	-92.8	0	0	0	111.8	W402 L403 L408 L485 H486 S491 I492 S493	W402-Y489 HydrophobicContact CB-CD2 3.92Å; W402-Y489 HydrophobicContact CB-CE2 4.34Å; W402-Y489 WeakPolarHBondContact O-CE2 3.26Å; L403-Y489 HydrophobicContact CD2-CD2 3.59Å; L403-Y489 HydrophobicContact CD2-CE2 3.96Å; L403-Y489 HydrophobicContact CG-CD2 4.24Å; L408-Y489 HydrophobicContact CD1-CD1 3.66Å; L408-Y489 HydrophobicContact CD1-CD2 4.09Å; L408-Y489 HydrophobicContact CD1-CE1 3.22Å; L408-Y489 HydrophobicContact CD1-CE2 3.68Å; L408-Y489 HydrophobicContact CD1-CG 4.08Å; L485-Y489 PolarHBondContact O-N 2.72Å; H486-Y489 PolarHBondContact O-N 3.11Å; Y489-S491 VanDerWaalsContact C-N 3.35Å; Y489-S491 PolarHBondContact O-N 2.68Å; Y489-I492 PolarHBondContact O-N 2.97Å; Y489-S493 WeakPolarHBondContact CE2-OG 3.4Å; Y489-S493 VanDerWaalsContact O-CB 3.31Å; Y489-S493 WeakPolarHBondContact O-CB 3.22Å; Y489-S493 PolarHBondContact O-N 3.07Å; Y489-S493 PolarHBondContact O-OG 3.42Å
490	K	93.5	Very high	88.9	Confident	122 Å²	122	48.7 Å²	48.7	53%	0.53	26%	0.264	S	S	.	.	H	α-helix	trans	-61.4	-42.3	177.8	-78.6	-178.4	169.2	177.7	0	111.9	H486 R487 L488 S494	H486-K490 WeakPolarHBondContact CE1-CE 3.42Å; H486-K490 PolarHBondContact CE1-NZ 2.81Å; H486-K490 WeakPolarHBondContact NE2-CE 3.36Å; H486-K490 WeakPolarHBondContact O-CG 3.04Å; H486-K490 PolarHBondContact O-N 3.05Å; R487-K490 PolarHBondContact O-N 3.2Å; L488-K490 VanDerWaalsContact C-N 3.35Å; L488-K490 PolarHBondContact O-N 2.91Å; K490-S494 WeakPolarHBondContact O-CB 3.42Å; K490-S494 PolarHBondContact O-N 3.08Å
491	S	95	Very high	90.7	Very high	42 Å²	42	53.1 Å²	53.1	29%	0.294	27%	0.269	S	S	.	.	H	α-helix	trans	-65.7	-44.6	177.8	-66	0	0	0	0	112.4	R487 L488 Y489 S494 V495	R487-S491 PolarHBondContact O-N 3.47Å; R487-S491 PolarHBondContact O-OG 2.67Å; L488-S491 PolarHBondContact O-N 2.67Å; Y489-S491 VanDerWaalsContact C-N 3.35Å; Y489-S491 PolarHBondContact O-N 2.68Å; S491-S494 PolarHBondContact O-N 3.04Å; S491-V495 WeakPolarHBondContact O-CG2 3.12Å; S491-V495 PolarHBondContact O-N 3.13Å; S491-V495 VanDerWaalsContact O-N 3.1Å
492	I	96.5	Very high	92	Very high	0 Å²	0	55.9 Å²	55.9	0%	0	28%	0.279	C	S	.	.	H	α-helix	trans	-63.6	-46.9	177.1	-68.4	168.7	0	0	0	110.6	R344 I347 L348 L384 L388 L399 L403 L488 Y489 S494 V495 A496	R344-I492 HydrophobicContact CB-CG2 4.48Å; R344-I492 WeakPolarHBondContact O-CG2 3.13Å; I347-I492 HydrophobicContact CB-CG2 3.97Å; I347-I492 HydrophobicContact CG2-CG1 4.36Å; I347-I492 HydrophobicContact CG2-CG2 4.05Å; L348-I492 HydrophobicContact CD1-CD1 4.2Å; L384-I492 HydrophobicContact CD1-CG1 3.92Å; L384-I492 HydrophobicContact CD2-CD1 4.38Å; L384-I492 HydrophobicContact CD2-CG1 3.65Å; L384-I492 HydrophobicContact CG-CG1 4.41Å; L388-I492 HydrophobicContact CD2-CD1 4.27Å; L399-I492 HydrophobicContact CD2-CD1 4.06Å; L403-I492 HydrophobicContact CD1-CD1 3.8Å; L403-I492 HydrophobicContact CD1-CG2 4.09Å; L403-I492 HydrophobicContact CD2-CB 4.06Å; L403-I492 HydrophobicContact CD2-CG2 3.65Å; L488-I492 WeakPolarHBondContact O-CG1 3.3Å; L488-I492 PolarHBondContact O-N 3.32Å; Y489-I492 PolarHBondContact O-N 2.97Å; I492-S494 VanDerWaalsContact C-N 3.33Å; I492-S494 PolarHBondContact O-N 2.91Å; I492-V495 PolarHBondContact O-N 3.5Å; I492-A496 WeakPolarHBondContact O-CB 3.31Å; I492-A496 PolarHBondContact O-N 3.22Å
493	S	94.8	Very high	92.5	Very high	9 Å²	9	55.2 Å²	55.2	6%	0.063	27%	0.272	C	S	.	.	H	α-helix	trans	-62.1	-42.3	178.7	-55.2	0	0	0	0	110.9	Y489 V495 A496 D497	Y489-S493 WeakPolarHBondContact CE2-OG 3.4Å; Y489-S493 VanDerWaalsContact O-CB 3.31Å; Y489-S493 WeakPolarHBondContact O-CB 3.22Å; Y489-S493 PolarHBondContact O-N 3.07Å; Y489-S493 PolarHBondContact O-OG 3.42Å; S493-V495 PolarHBondContact O-N 2.89Å; S493-A496 PolarHBondContact O-N 2.96Å; S493-D497 VanDerWaalsContact O-CB 3.3Å; S493-D497 WeakPolarHBondContact O-CB 3.49Å; S493-D497 PolarHBondContact O-N 3.36Å
494	S	95.5	Very high	92.9	Very high	60 Å²	60	54.9 Å²	54.9	42%	0.42	27%	0.27	S	S	.	.	H	α-helix	trans	-59	-42.9	175.8	-179	0	0	0	0	113	K490 S491 I492 R498	K490-S494 WeakPolarHBondContact O-CB 3.42Å; K490-S494 PolarHBondContact O-N 3.08Å; S491-S494 PolarHBondContact O-N 3.04Å; I492-S494 VanDerWaalsContact C-N 3.33Å; I492-S494 PolarHBondContact O-N 2.91Å; S494-R498 VanDerWaalsContact O-CB 3.32Å; S494-R498 WeakPolarHBondContact O-CB 3.39Å; S494-R498 PolarHBondContact O-N 3.35Å
495	V	96.8	Very high	92.9	Very high	4 Å²	4	55 Å²	55	2%	0.024	26%	0.263	C	S	.	.	H	α-helix	trans	-66.3	-43.5	176.1	174.5	0	0	0	0	111.1	I347 F374 E380 L381 L384 S491 I492 S493 R498 F499	I347-V495 HydrophobicContact CD1-CG1 4.05Å; I347-V495 HydrophobicContact CG1-CG1 4.32Å; F374-V495 HydrophobicContact CD1-CG1 4.39Å; F374-V495 HydrophobicContact CE1-CG1 4.41Å; E380-V495 HydrophobicContact CB-CG2 3.93Å; L381-V495 HydrophobicContact CD2-CG1 4.19Å; L384-V495 HydrophobicContact CD1-CG2 4.3Å; S491-V495 WeakPolarHBondContact O-CG2 3.12Å; S491-V495 PolarHBondContact O-N 3.13Å; S491-V495 VanDerWaalsContact O-N 3.1Å; I492-V495 PolarHBondContact O-N 3.5Å; S493-V495 PolarHBondContact O-N 2.89Å; V495-R498 PolarHBondContact O-N 2.99Å; V495-F499 WeakPolarHBondContact O-CB 3.15Å; V495-F499 PolarHBondContact O-N 2.79Å
496	A	96.1	Very high	92.9	Very high	3 Å²	3	55.6 Å²	55.6	3%	0.025	27%	0.266	C	S	.	.	H	α-helix	trans	-65.3	-41.3	177.8	0	0	0	0	0	112.6	P343 R344 I492 S493 F499 A500	P343-A496 HydrophobicContact CB-CB 4.15Å; R344-A496 HydrophobicContact CB-CB 4.43Å; R344-A496 HydrophobicContact CG-CB 3.62Å; I492-A496 WeakPolarHBondContact O-CB 3.31Å; I492-A496 PolarHBondContact O-N 3.22Å; S493-A496 PolarHBondContact O-N 2.96Å; A496-F499 WeakPolarHBondContact O-CB 3.32Å; A496-F499 PolarHBondContact O-N 3.48Å; A496-A500 PolarHBondContact O-N 3.29Å
497	D	94.6	Very high	93	Very high	81 Å²	81	53.5 Å²	53.5	43%	0.433	26%	0.257	S	S	.	.	H	α-helix	trans	-68.4	-37.6	177.8	-67.8	-21.2	0	0	0	111.2	S493 A500 R501	S493-D497 VanDerWaalsContact O-CB 3.3Å; S493-D497 WeakPolarHBondContact O-CB 3.49Å; S493-D497 PolarHBondContact O-N 3.36Å; D497-A500 PolarHBondContact O-N 2.99Å; D497-R501 VanDerWaalsContact O-CB 3.26Å; D497-R501 WeakPolarHBondContact O-CB 3.33Å; D497-R501 PolarHBondContact O-N 3.28Å
498	R	94.8	Very high	93	Very high	67 Å²	67	54.1 Å²	54.1	25%	0.253	26%	0.259	S	S	.	.	H	α-helix	trans	-61.8	-47.2	172	-171.1	-175.5	-57.3	174	6.7	110.4	S376 E380 S494 V495 A500 R501 E502	S376-R498 PolarHBondContact O-NH1 3.47Å; E380-R498 IonicContact OE1-CZ 2.67Å; E380-R498 IonicContact OE1-NH1 3.13Å; E380-R498 PolarHBondContact OE1-NH1 3.01Å; E380-R498 IonicContact OE1-NH2 3.65Å; E380-R498 PolarHBondContact OE1-NH2 3.27Å; S494-R498 VanDerWaalsContact O-CB 3.32Å; S494-R498 WeakPolarHBondContact O-CB 3.39Å; S494-R498 PolarHBondContact O-N 3.35Å; V495-R498 PolarHBondContact O-N 2.99Å; R498-A500 VanDerWaalsContact C-N 3.35Å; R498-A500 PolarHBondContact O-N 2.84Å; R498-R501 PolarHBondContact O-N 2.97Å; R498-E502 WeakPolarHBondContact CD-OE1 3.47Å; R498-E502 VanDerWaalsContact CG-CD 3.48Å; R498-E502 HydrophobicContact CG-CG 4.14Å; R498-E502 WeakPolarHBondContact CG-OE1 3.39Å; R498-E502 WeakPolarHBondContact O-CB 3.46Å; R498-E502 WeakPolarHBondContact O-CG 3.36Å; R498-E502 PolarHBondContact O-N 3.45Å
499	F	94.5	Very high	92.8	Very high	4 Å²	4	57.7 Å²	57.7	2%	0.018	28%	0.275	C	S	.	.	H	α-helix	trans	-57	-46.7	175.5	170.7	-125.1	0	0	0	112	F313 M373 F374 V495 A496 R501 Y503 L507 I510	F313-F499 HydrophobicContact CE2-CE1 4.32Å; F313-F499 HydrophobicContact CZ-CD1 4.46Å; F313-F499 AromaticContact CZ-CE1 3.74Å; F313-F499 HydrophobicContact CZ-CE1 3.74Å; M373-F499 HydrophobicContact CB-CD2 3.85Å; M373-F499 HydrophobicContact CB-CE2 3.68Å; M373-F499 HydrophobicContact CG-CD2 4.37Å; M373-F499 HydrophobicContact CG-CE2 3.79Å; M373-F499 HydrophobicContact SD-CE2 3.57Å; M373-F499 VanDerWaalsContact SD-CE2 3.57Å; M373-F499 HydrophobicContact SD-CZ 4.09Å; F374-F499 HydrophobicContact CE1-CB 4.14Å; F374-F499 HydrophobicContact CE1-CD2 4.49Å; F374-F499 HydrophobicContact CE1-CG 4.16Å; F374-F499 HydrophobicContact CZ-CD1 4.29Å; F374-F499 HydrophobicContact CZ-CD2 4.36Å; F374-F499 HydrophobicContact CZ-CG 4.16Å; V495-F499 WeakPolarHBondContact O-CB 3.15Å; V495-F499 PolarHBondContact O-N 2.79Å; A496-F499 WeakPolarHBondContact O-CB 3.32Å; A496-F499 PolarHBondContact O-N 3.48Å; F499-R501 VanDerWaalsContact C-N 3.32Å; F499-R501 PolarHBondContact O-N 3.13Å; F499-Y503 HydrophobicContact CD2-CD2 4.01Å; F499-Y503 HydrophobicContact CD2-CG 4.45Å; F499-Y503 PolarHBondContact O-N 3.46Å; F499-L507 HydrophobicContact CD1-CD1 4.41Å; F499-L507 HydrophobicContact CE1-CB 4.16Å; F499-L507 HydrophobicContact CE1-CD1 3.68Å; F499-L507 HydrophobicContact CE1-CG 4.41Å; F499-L507 HydrophobicContact CZ-CB 4.1Å; F499-L507 HydrophobicContact CZ-CD1 4.33Å; F499-I510 HydrophobicContact CZ-CD1 3.92Å
500	A	93.3	Very high	92.8	Very high	34 Å²	34	56 Å²	56	28%	0.281	27%	0.268	S	S	.	.	H	α-helix	trans	-64.9	-33.3	178.3	0	0	0	0	0	113.5	A496 D497 R498 L507	A496-A500 PolarHBondContact O-N 3.29Å; D497-A500 PolarHBondContact O-N 2.99Å; R498-A500 VanDerWaalsContact C-N 3.35Å; R498-A500 PolarHBondContact O-N 2.84Å; A500-L507 HydrophobicContact CB-CD2 3.6Å
501	R	91.1	Very high	92.8	Very high	201 Å²	201	51 Å²	51	76%	0.758	25%	0.247	S	C	*	.	H	α-helix	trans	-79.7	-43.8	-179.2	-169.9	-171.8	-51.1	170.4	5.4	112.9	D497 R498 F499	D497-R501 VanDerWaalsContact O-CB 3.26Å; D497-R501 WeakPolarHBondContact O-CB 3.33Å; D497-R501 PolarHBondContact O-N 3.28Å; R498-R501 PolarHBondContact O-N 2.97Å; F499-R501 VanDerWaalsContact C-N 3.32Å; F499-R501 PolarHBondContact O-N 3.13Å
502	E	89.9	Confident	92.5	Very high	92 Å²	92	53.7 Å²	53.7	43%	0.43	26%	0.255	S	S	.	.	H	α-helix	trans	-79	-34	-177.4	-69.5	178.5	-171.1	0	0	111.8	S376 R498 P504	S376-E502 PolarHBondContact OG-OE2 2.88Å; R498-E502 WeakPolarHBondContact CD-OE1 3.47Å; R498-E502 VanDerWaalsContact CG-CD 3.48Å; R498-E502 HydrophobicContact CG-CG 4.14Å; R498-E502 WeakPolarHBondContact CG-OE1 3.39Å; R498-E502 WeakPolarHBondContact O-CB 3.46Å; R498-E502 WeakPolarHBondContact O-CG 3.36Å; R498-E502 PolarHBondContact O-N 3.45Å; E502-P504 WeakPolarHBondContact O-CD 3.5Å
503	Y	91.1	Very high	92.2	Very high	47 Å²	47	57.5 Å²	57.5	18%	0.184	27%	0.272	C	S	.	.			trans	-128.7	55.5	-173.5	-52.4	-79.8	0	0	0	113.1	F372 M373 F499 T505 E506 L507	F372-Y503 HydrophobicContact CD2-CD1 4.12Å; F372-Y503 AromaticContact CD2-CE1 3.61Å; F372-Y503 HydrophobicContact CD2-CE1 3.61Å; F372-Y503 AromaticContact CE2-CD1 3.67Å; F372-Y503 HydrophobicContact CE2-CD1 3.67Å; F372-Y503 AromaticContact CE2-CE1 3.64Å; F372-Y503 HydrophobicContact CE2-CE1 3.64Å; F372-Y503 PolarHBondContact O-OH 3.29Å; M373-Y503 VanDerWaalsContact CA-CE2 3.49Å; M373-Y503 HydrophobicContact CB-CD2 4.02Å; M373-Y503 HydrophobicContact CB-CE2 4.29Å; M373-Y503 HydrophobicContact CB-CG 4.24Å; M373-Y503 HydrophobicContact CG-CD1 4.09Å; M373-Y503 HydrophobicContact CG-CD2 4.19Å; M373-Y503 HydrophobicContact CG-CG 3.88Å; M373-Y503 WeakPolarHBondContact O-CE2 3.15Å; F499-Y503 HydrophobicContact CD2-CD2 4.01Å; F499-Y503 HydrophobicContact CD2-CG 4.45Å; F499-Y503 PolarHBondContact O-N 3.46Å; Y503-T505 VanDerWaalsContact C-N 3.29Å; Y503-T505 PolarHBondContact O-N 3Å; Y503-E506 PolarHBondContact O-N 3.36Å; Y503-L507 WeakPolarHBondContact O-CB 3.46Å; Y503-L507 PolarHBondContact O-N 2.95Å
504	P	89.1	Confident	92	Very high	62 Å²	62	57.1 Å²	57.1	40%	0.403	27%	0.269	S	S	.	.	H	α-helix	trans	-64.4	-33.5	-176.6	26.2	-35	0	0	0	112.7	E502 R508	E502-P504 WeakPolarHBondContact O-CD 3.5Å; P504-R508 WeakPolarHBondContact O-CB 3.36Å; P504-R508 PolarHBondContact O-N 2.86Å
505	T	86.2	Confident	91.7	Very high	43 Å²	43	55 Å²	55	26%	0.264	25%	0.253	S	S	.	.	H	α-helix	trans	-68.5	-44.1	-179.7	-29.5	0	0	0	0	111.1	R295 Y503 F509	R295-T505 HydrophobicContact CB-CG2 4.45Å; Y503-T505 VanDerWaalsContact C-N 3.29Å; Y503-T505 PolarHBondContact O-N 3Å; T505-F509 WeakPolarHBondContact O-CB 3.49Å; T505-F509 PolarHBondContact O-N 3.1Å
506	E	89.1	Confident	91.2	Very high	18 Å²	18	58.8 Å²	58.8	8%	0.084	27%	0.27	C	S	.	.	H	α-helix	trans	-64.5	-49.3	176.9	-69.6	49.7	-120.2	0	0	109.6	R298 V306 F372 M373 Y503 R508 F509 I510	R298-E506 IonicContact CZ-OE1 2.74Å; R298-E506 IonicContact NE-OE1 2.72Å; R298-E506 PolarHBondContact NE-OE1 3.31Å; R298-E506 IonicContact NH2-OE1 3.33Å; R298-E506 PolarHBondContact NH2-OE1 3.02Å; V306-E506 HydrophobicContact CG2-CG 4.03Å; F372-E506 HydrophobicContact CE2-CG 4.17Å; F372-E506 HydrophobicContact CZ-CG 3.78Å; M373-E506 HydrophobicContact CG-CB 4.45Å; M373-E506 HydrophobicContact CG-CG 4.25Å; M373-E506 HydrophobicContact SD-CB 3.72Å; M373-E506 HydrophobicContact SD-CG 3.9Å; Y503-E506 PolarHBondContact O-N 3.36Å; E506-R508 VanDerWaalsContact C-N 3.33Å; E506-R508 PolarHBondContact O-N 3.48Å; E506-F509 WeakPolarHBondContact O-CB 3.44Å; E506-F509 PolarHBondContact O-N 2.88Å; E506-F509 VanDerWaalsContact O-N 3.16Å; E506-I510 HydrophobicContact CB-CD1 4.45Å; E506-I510 WeakPolarHBondContact O-CB 3.43Å; E506-I510 WeakPolarHBondContact O-CD1 3.37Å; E506-I510 WeakPolarHBondContact O-CG1 3.42Å; E506-I510 PolarHBondContact O-N 3.46Å
507	L	93.4	Very high	90.5	Very high	22 Å²	22	63.1 Å²	63.1	12%	0.115	29%	0.291	C	S	.	.	H	α-helix	trans	-56.6	-47.9	177.8	173.8	61.1	0	0	0	111.1	F313 P343 F499 A500 Y503 F509 I510 L511	F313-L507 HydrophobicContact CE1-CD1 3.99Å; F313-L507 HydrophobicContact CZ-CD1 4.33Å; P343-L507 HydrophobicContact CG-CD1 3.79Å; F499-L507 HydrophobicContact CD1-CD1 4.41Å; F499-L507 HydrophobicContact CE1-CB 4.16Å; F499-L507 HydrophobicContact CE1-CD1 3.68Å; F499-L507 HydrophobicContact CE1-CG 4.41Å; F499-L507 HydrophobicContact CZ-CB 4.1Å; F499-L507 HydrophobicContact CZ-CD1 4.33Å; A500-L507 HydrophobicContact CB-CD2 3.6Å; Y503-L507 WeakPolarHBondContact O-CB 3.46Å; Y503-L507 PolarHBondContact O-N 2.95Å; L507-F509 VanDerWaalsContact C-N 3.34Å; L507-F509 PolarHBondContact O-N 3.37Å; L507-I510 PolarHBondContact O-N 2.85Å; L507-L511 HydrophobicContact CD1-CD1 3.8Å; L507-L511 HydrophobicContact CD1-CD2 4.32Å; L507-L511 HydrophobicContact CD1-CG 3.79Å; L507-L511 HydrophobicContact CG-CD1 3.94Å; L507-L511 HydrophobicContact CG-CG 4.31Å; L507-L511 WeakPolarHBondContact O-CB 3.47Å; L507-L511 VanDerWaalsContact O-CG 3.28Å; L507-L511 WeakPolarHBondContact O-CG 3.42Å; L507-L511 PolarHBondContact O-N 3.45Å
508	R	90.6	Very high	89.8	Confident	184 Å²	184	61.2 Å²	61.2	69%	0.694	28%	0.279	S	S	*	.	H	α-helix	trans	-59.6	-44.6	177.3	-177	177.1	178.4	172.9	1.3	111.9	P504 E506 L511 Q512	P504-R508 WeakPolarHBondContact O-CB 3.36Å; P504-R508 PolarHBondContact O-N 2.86Å; E506-R508 VanDerWaalsContact C-N 3.33Å; E506-R508 PolarHBondContact O-N 3.48Å; R508-L511 PolarHBondContact O-N 3.1Å; R508-Q512 VanDerWaalsContact O-CB 3.27Å; R508-Q512 WeakPolarHBondContact O-CB 3.47Å; R508-Q512 PolarHBondContact O-N 3.41Å
509	F	89.2	Confident	88.9	Confident	80 Å²	80	60.4 Å²	60.4	35%	0.351	28%	0.28	S	S	.	.	H	α-helix	trans	-61.7	-46.3	177.9	176.5	-94.1	0	0	0	111.9	V306 T505 E506 L507 Q512 K513	V306-F509 HydrophobicContact CG1-CD1 3.57Å; V306-F509 HydrophobicContact CG1-CE1 3.78Å; T505-F509 WeakPolarHBondContact O-CB 3.49Å; T505-F509 PolarHBondContact O-N 3.1Å; E506-F509 WeakPolarHBondContact O-CB 3.44Å; E506-F509 PolarHBondContact O-N 2.88Å; E506-F509 VanDerWaalsContact O-N 3.16Å; L507-F509 VanDerWaalsContact C-N 3.34Å; L507-F509 PolarHBondContact O-N 3.37Å; F509-Q512 PolarHBondContact O-N 3.01Å; F509-K513 HydrophobicContact CD1-CG 4.47Å; F509-K513 HydrophobicContact CE1-CG 4.07Å; F509-K513 HydrophobicContact CE2-CG 4.2Å; F509-K513 HydrophobicContact CZ-CD 4.47Å; F509-K513 HydrophobicContact CZ-CG 3.93Å; F509-K513 WeakPolarHBondContact O-CB 3.38Å; F509-K513 WeakPolarHBondContact O-CG 3.43Å; F509-K513 PolarHBondContact O-N 3.41Å
510	I	93	Very high	87.2	Confident	0 Å²	0	63.6 Å²	63.6	0%	0	30%	0.3	C	S	.	.	H	α-helix	trans	-59.6	-52.5	177.1	-70.5	163.1	0	0	0	109.8	V306 V309 F313 M373 F499 E506 L507 Q512 K513 V514	V306-I510 HydrophobicContact CG1-CD1 4.43Å; V306-I510 HydrophobicContact CG1-CG1 4.04Å; V309-I510 HydrophobicContact CB-CD1 4.09Å; V309-I510 HydrophobicContact CG1-CD1 3.7Å; F313-I510 HydrophobicContact CB-CG2 3.84Å; F313-I510 HydrophobicContact CD1-CG2 3.55Å; F313-I510 HydrophobicContact CD2-CG2 4.01Å; F313-I510 HydrophobicContact CE1-CG2 4.07Å; F313-I510 HydrophobicContact CE2-CG2 4.47Å; F313-I510 HydrophobicContact CG-CG2 3.53Å; M373-I510 HydrophobicContact SD-CD1 4.04Å; F499-I510 HydrophobicContact CZ-CD1 3.92Å; E506-I510 HydrophobicContact CB-CD1 4.45Å; E506-I510 WeakPolarHBondContact O-CB 3.43Å; E506-I510 WeakPolarHBondContact O-CD1 3.37Å; E506-I510 WeakPolarHBondContact O-CG1 3.42Å; E506-I510 PolarHBondContact O-N 3.46Å; L507-I510 PolarHBondContact O-N 2.85Å; I510-Q512 PolarHBondContact O-N 3.24Å; I510-K513 PolarHBondContact O-N 3.33Å; I510-V514 HydrophobicContact CG2-CG2 4.4Å; I510-V514 WeakPolarHBondContact O-CB 3.43Å; I510-V514 WeakPolarHBondContact O-CG2 3.35Å; I510-V514 PolarHBondContact O-N 3.36Å
511	L	93.3	Very high	85.2	Confident	19 Å²	19	64.6 Å²	64.6	10%	0.099	30%	0.301	C	S	.	.	H	α-helix	trans	-59.8	-46.3	-179.6	-71.1	177.8	0	0	0	111.7	F313 L339 L342 L507 R508 K513 V514 I515	F313-L511 HydrophobicContact CD1-CD2 4.09Å; F313-L511 HydrophobicContact CE1-CD2 4.12Å; L339-L511 HydrophobicContact CB-CD1 4.39Å; L339-L511 HydrophobicContact CD2-CD1 4.39Å; L342-L511 HydrophobicContact CB-CD2 4.35Å; L342-L511 HydrophobicContact CD2-CD2 3.74Å; L507-L511 HydrophobicContact CD1-CD1 3.8Å; L507-L511 HydrophobicContact CD1-CD2 4.32Å; L507-L511 HydrophobicContact CD1-CG 3.79Å; L507-L511 HydrophobicContact CG-CD1 3.94Å; L507-L511 HydrophobicContact CG-CG 4.31Å; L507-L511 WeakPolarHBondContact O-CB 3.47Å; L507-L511 VanDerWaalsContact O-CG 3.28Å; L507-L511 WeakPolarHBondContact O-CG 3.42Å; L507-L511 PolarHBondContact O-N 3.45Å; R508-L511 PolarHBondContact O-N 3.1Å; L511-K513 PolarHBondContact O-N 2.74Å; L511-V514 PolarHBondContact O-N 3.02Å; L511-I515 WeakPolarHBondContact O-CB 3.44Å; L511-I515 WeakPolarHBondContact O-CD1 3.39Å; L511-I515 VanDerWaalsContact O-CG1 3.25Å; L511-I515 WeakPolarHBondContact O-CG1 3.36Å; L511-I515 PolarHBondContact O-N 2.66Å
512	Q	90.4	Very high	82.9	Confident	97 Å²	97	62 Å²	62	45%	0.453	30%	0.302	S	S	.	.	H	α-helix	trans	-58.9	-49.4	177.5	178	172.2	0.9	0	0	111.1	R508 F509 I510 V514 I515 E516	R508-Q512 VanDerWaalsContact O-CB 3.27Å; R508-Q512 WeakPolarHBondContact O-CB 3.47Å; R508-Q512 PolarHBondContact O-N 3.41Å; F509-Q512 PolarHBondContact O-N 3.01Å; I510-Q512 PolarHBondContact O-N 3.24Å; Q512-V514 PolarHBondContact O-N 2.86Å; Q512-I515 PolarHBondContact O-N 3.15Å; Q512-E516 HydrophobicContact CG-CG 4.33Å; Q512-E516 WeakPolarHBondContact CG-OE1 3.19Å; Q512-E516 PolarHBondContact NE2-OE1 3.21Å; Q512-E516 WeakPolarHBondContact O-CB 3.43Å; Q512-E516 VanDerWaalsContact O-CG 3.26Å; Q512-E516 WeakPolarHBondContact O-CG 3.34Å; Q512-E516 PolarHBondContact O-N 3.37Å
513	K	89.6	Confident	80.7	Confident	81 Å²	81	61.9 Å²	61.9	35%	0.352	30%	0.301	S	S	.	.	H	α-helix	trans	-62.4	-42.3	179.3	-77	-73.6	154.9	-136	0	112.4	T310 F509 I510 L511 E516 M517	T310-K513 HydrophobicContact CG2-CB 3.95Å; F509-K513 HydrophobicContact CD1-CG 4.47Å; F509-K513 HydrophobicContact CE1-CG 4.07Å; F509-K513 HydrophobicContact CE2-CG 4.2Å; F509-K513 HydrophobicContact CZ-CD 4.47Å; F509-K513 HydrophobicContact CZ-CG 3.93Å; F509-K513 WeakPolarHBondContact O-CB 3.38Å; F509-K513 WeakPolarHBondContact O-CG 3.43Å; F509-K513 PolarHBondContact O-N 3.41Å; I510-K513 PolarHBondContact O-N 3.33Å; L511-K513 PolarHBondContact O-N 2.74Å; K513-E516 IonicContact NZ-OE2 2.67Å; K513-E516 PolarHBondContact NZ-OE2 3.11Å; K513-M517 WeakPolarHBondContact O-CB 3.27Å; K513-M517 VanDerWaalsContact O-CG 3.25Å; K513-M517 WeakPolarHBondContact O-CG 3.39Å; K513-M517 PolarHBondContact O-N 3.42Å
514	V	90.7	Very high	78.5	Confident	0 Å²	0	63.5 Å²	63.5	0%	0	31%	0.312	C	S	.	.	H	α-helix	trans	-65.6	-42.5	-179.7	169.6	0	0	0	0	111	T310 F313 L317 L342 I510 L511 Q512 M517 H518	T310-V514 HydrophobicContact CG2-CG2 3.9Å; T310-V514 WeakPolarHBondContact O-CG2 3.28Å; F313-V514 HydrophobicContact CB-CG2 3.68Å; L317-V514 HydrophobicContact CB-CG1 4.09Å; L317-V514 HydrophobicContact CD2-CG1 3.53Å; L317-V514 HydrophobicContact CG-CG1 4.44Å; L342-V514 HydrophobicContact CD2-CG1 4.28Å; I510-V514 HydrophobicContact CG2-CG2 4.4Å; I510-V514 WeakPolarHBondContact O-CB 3.43Å; I510-V514 WeakPolarHBondContact O-CG2 3.35Å; I510-V514 PolarHBondContact O-N 3.36Å; L511-V514 PolarHBondContact O-N 3.02Å; Q512-V514 PolarHBondContact O-N 2.86Å; V514-M517 HydrophobicContact CG2-CE 4.26Å; V514-M517 PolarHBondContact O-N 3.43Å; V514-H518 PolarHBondContact O-N 3.43Å; V514-H518 PolarHBondContact O-ND1 3.17Å
515	I	88	Confident	75.8	Confident	17 Å²	17	66.3 Å²	66.3	9%	0.087	32%	0.324	C	S	.	.	H	α-helix	trans	-69	-47.9	177.5	-64.7	163.3	0	0	0	110.5	L339 L511 Q512 M517 H518 D519	L339-I515 HydrophobicContact CD2-CD1 3.46Å; L339-I515 VanDerWaalsContact CD2-CD1 3.46Å; L511-I515 WeakPolarHBondContact O-CB 3.44Å; L511-I515 WeakPolarHBondContact O-CD1 3.39Å; L511-I515 VanDerWaalsContact O-CG1 3.25Å; L511-I515 WeakPolarHBondContact O-CG1 3.36Å; L511-I515 PolarHBondContact O-N 2.66Å; Q512-I515 PolarHBondContact O-N 3.15Å; I515-M517 PolarHBondContact O-N 3.43Å; I515-H518 CarbonylContact O-C 3.54Å; I515-H518 PolarHBondContact O-N 2.96Å; I515-D519 WeakPolarHBondContact O-CB 3.14Å; I515-D519 PolarHBondContact O-N 2.9Å
516	E	86.5	Confident	73.5	Confident	82 Å²	82	69.7 Å²	69.7	38%	0.383	34%	0.339	S	S	.	.	H	α-helix	trans	-54.2	-36.7	175.8	-76	170.9	-174.8	0	0	112.4	Q512 K513 H518	Q512-E516 HydrophobicContact CG-CG 4.33Å; Q512-E516 WeakPolarHBondContact CG-OE1 3.19Å; Q512-E516 PolarHBondContact NE2-OE1 3.21Å; Q512-E516 WeakPolarHBondContact O-CB 3.43Å; Q512-E516 VanDerWaalsContact O-CG 3.26Å; Q512-E516 WeakPolarHBondContact O-CG 3.34Å; Q512-E516 PolarHBondContact O-N 3.37Å; K513-E516 IonicContact NZ-OE2 2.67Å; K513-E516 PolarHBondContact NZ-OE2 3.11Å; E516-H518 VanDerWaalsContact C-N 3.29Å; E516-H518 PolarHBondContact O-N 3.34Å
517	M	82.8	Confident	70.9	Confident	95 Å²	95	71.2 Å²	71.2	47%	0.468	35%	0.35	S	S	.	.	H	α-helix	trans	-71.1	-20.2	176.5	-75.1	-173.4	-54.1	0	0	114.2	T310 K513 V514 I515	T310-M517 HydrophobicContact CG2-CE 4.28Å; K513-M517 WeakPolarHBondContact O-CB 3.27Å; K513-M517 VanDerWaalsContact O-CG 3.25Å; K513-M517 WeakPolarHBondContact O-CG 3.39Å; K513-M517 PolarHBondContact O-N 3.42Å; V514-M517 HydrophobicContact CG2-CE 4.26Å; V514-M517 PolarHBondContact O-N 3.43Å; I515-M517 PolarHBondContact O-N 3.43Å
518	H	80	Confident	68.2	Low	40 Å²	40	76.4 Å²	76.4	19%	0.185	37%	0.373	C	S	.	.	H	α-helix	trans	-112.3	-11	-177	-66.6	77.8	0	0	0	113.7	S314 L317 M318 V514 I515 E516 T520	S314-H518 PolarHBondContact OG-CE1 3.19Å; S314-H518 VanDerWaalsContact OG-CE1 3.27Å; L317-H518 HydrophobicContact CD2-CB 3.99Å; M318-H518 VanDerWaalsContact CG-NE2 3.29Å; M318-H518 WeakPolarHBondContact CG-NE2 3.23Å; V514-H518 PolarHBondContact O-N 3.43Å; V514-H518 PolarHBondContact O-ND1 3.17Å; I515-H518 CarbonylContact O-C 3.54Å; I515-H518 PolarHBondContact O-N 2.96Å; E516-H518 VanDerWaalsContact C-N 3.29Å; E516-H518 PolarHBondContact O-N 3.34Å; H518-T520 PolarHBondContact O-N 2.81Å; H518-T520 VanDerWaalsContact O-N 3.13Å
519	D	74.2	Confident	65.6	Low	51 Å²	51	71.5 Å²	71.5	27%	0.273	37%	0.367	S	S	.	.			trans	-75.6	94.3	173.8	-159.8	-3.5	0	0	0	108.2	I515 N521	I515-D519 WeakPolarHBondContact O-CB 3.14Å; I515-D519 PolarHBondContact O-N 2.9Å; D519-N521 VanDerWaalsContact C-N 3.25Å; D519-N521 PolarHBondContact O-N 2.91Å; D519-N521 PolarHBondContact OD1-ND2 3.43Å
520	T	59.6	Low	63.1	Low	71 Å²	71	75.7 Å²	75.7	44%	0.436	39%	0.386	S	S	.	.			trans	-88.9	18.1	-180	52.7	0	0	0	0	112.9	H518 D522	H518-T520 PolarHBondContact O-N 2.81Å; H518-T520 VanDerWaalsContact O-N 3.13Å; T520-D522 VanDerWaalsContact C-N 3.27Å; T520-D522 PolarHBondContact O-N 3.2Å
521	N	51.5	Low	60.2	Low	55 Å²	55	81 Å²	81	29%	0.294	41%	0.414	S	S	.	.	H	α-helix	trans	-69.6	-20	-176.5	-78.4	-8	0	0	0	114.1	T332 D519 E523 I524	T332-N521 VanDerWaalsContact CG2-ND2 3.28Å; T332-N521 WeakPolarHBondContact CG2-ND2 3.3Å; D519-N521 VanDerWaalsContact C-N 3.25Å; D519-N521 PolarHBondContact O-N 2.91Å; D519-N521 PolarHBondContact OD1-ND2 3.43Å; N521-E523 PolarHBondContact O-N 3.47Å; N521-E523 VanDerWaalsContact O-N 3.07Å; N521-I524 PolarHBondContact O-N 2.69Å
522	D	43.4	Very low	57.3	Low	147 Å²	147	85.2 Å²	85.2	79%	0.786	45%	0.445	S	S	*	.	H	α-helix	trans	-68.3	-8	-177.8	-73.6	-17.7	0	0	0	114.8	T520	T520-D522 VanDerWaalsContact C-N 3.27Å; T520-D522 PolarHBondContact O-N 3.2Å
523	E	43.7	Very low	54.4	Low	89 Å²	89	85.5 Å²	85.5	42%	0.416	46%	0.458	S	S	.	.	H	α-helix	trans	-114.5	-16	172.9	-72.6	-169.5	174.3	0	0	114.8	N521 D525 I526 V527 Q630	N521-E523 PolarHBondContact O-N 3.47Å; N521-E523 VanDerWaalsContact O-N 3.07Å; E523-D525 VanDerWaalsContact C-N 3.3Å; E523-D525 PolarHBondContact O-N 2.74Å; E523-I526 PolarHBondContact O-N 2.87Å; E523-V527 PolarHBondContact O-N 2.64Å; E523-Q630 PolarHBondContact OE1-NE2 3.48Å
524	I	43.7	Very low	51.3	Low	80 Å²	80	86.9 Å²	86.9	41%	0.41	48%	0.477	S	S	.	.	H	α-helix	trans	-68.4	-34.8	178.7	-61.2	175.5	0	0	0	110.3	N521 I526 V527 E528	N521-I524 PolarHBondContact O-N 2.69Å; I524-I526 PolarHBondContact O-N 3.46Å; I524-V527 PolarHBondContact O-N 2.99Å; I524-E528 HydrophobicContact CG2-CG 4.21Å; I524-E528 PolarHBondContact O-N 2.84Å
525	D	33.3	Very low	48.3	Very low	122 Å²	122	95 Å²	95	65%	0.652	52%	0.517	S	S	*	.	H	α-helix	trans	-63.9	-22.4	175.5	-74.6	-12.6	0	0	0	113.3	E523	E523-D525 VanDerWaalsContact C-N 3.3Å; E523-D525 PolarHBondContact O-N 2.74Å
526	I	36.9	Very low	45.2	Very low	113 Å²	113	101 Å²	101	58%	0.579	55%	0.55	S	S	*	.	H	α-helix	trans	-80.2	-32.6	176.1	-56.6	178.7	0	0	0	110.5	E523 I524 S529	E523-I526 PolarHBondContact O-N 2.87Å; I524-I526 PolarHBondContact O-N 3.46Å; I526-S529 PolarHBondContact O-OG 3.46Å
527	V	35.3	Very low	42.3	Very low	51 Å²	51	104 Å²	104	31%	0.309	57%	0.569	S	S	.	*	H	α-helix	trans	-85.8	-32.9	-176	-171.2	0	0	0	0	112.2	E523 I524 S529 F530 D531	E523-V527 PolarHBondContact O-N 2.64Å; I524-V527 PolarHBondContact O-N 2.99Å; V527-S529 PolarHBondContact O-N 2.84Å; V527-F530 PolarHBondContact O-N 3.11Å; V527-D531 PolarHBondContact O-N 3.15Å
528	E	37.4	Very low	39.6	Very low	131 Å²	131	104 Å²	104	61%	0.612	58%	0.578	S	S	*	*	H	α-helix	trans	-66	-21.6	175.8	-72.5	-167.1	171.5	0	0	113.3	I524 F530 S532	I524-E528 HydrophobicContact CG2-CG 4.21Å; I524-E528 PolarHBondContact O-N 2.84Å; E528-F530 PolarHBondContact O-N 3.36Å; E528-S532 PolarHBondContact O-OG 3.37Å
529	S	35.7	Very low	37	Very low	80 Å²	80	109.2 Å²	109.2	56%	0.559	61%	0.607	S	S	*	*	H	α-helix	trans	-72.8	-12.4	171	74.8	0	0	0	0	114.2	I526 V527	I526-S529 PolarHBondContact O-OG 3.46Å; V527-S529 PolarHBondContact O-N 2.84Å
530	F	35.4	Very low	34.6	Very low	169 Å²	169	114 Å²	114	74%	0.741	63%	0.632	S	S	*	*	H	α-helix	trans	-107.7	-24.9	178	-97.8	-85.8	0	0	0	114.8	V527 E528	V527-F530 PolarHBondContact O-N 3.11Å; E528-F530 PolarHBondContact O-N 3.36Å
531	D	32.8	Very low	33.2	Very low	112 Å²	112	118 Å²	118	60%	0.599	65%	0.651	S	S	*	*	H	α-helix	trans	-106.3	8.3	-174.5	-84.7	-18.1	0	0	0	115.5	V527 S533	V527-D531 PolarHBondContact O-N 3.15Å; D531-S533 PolarHBondContact O-N 2.94Å
532	S	31.9	Very low	32	Very low	107 Å²	107	121.4 Å²	121.4	75%	0.748	67%	0.669	S	S	*	*			trans	-71.8	19.1	171.9	29.1	0	0	0	0	114.5	E528	E528-S532 PolarHBondContact O-OG 3.37Å
533	S	29.3	Very low	31.3	Very low	103 Å²	103	121 Å²	121	72%	0.72	67%	0.667	S	S	*	*			trans	-126.4	59.2	171	70.6	0	0	0	0	113.5	D531	D531-S533 PolarHBondContact O-N 2.94Å
534	S	26	Very low	30.3	Very low	109 Å²	109	123.9 Å²	123.9	76%	0.762	69%	0.685	S	S	*	*	S	Bend	trans	-162.6	108.3	149.4	-147.2	0	0	0	0	115.2
535	M	27.4	Very low	29.5	Very low	171 Å²	171	128 Å²	128	84%	0.842	71%	0.707	S	S	*	*			trans	72.4	93.7	144.4	-81.3	-76.7	153.3	0	0	121.8
536	N	22.2	Very low	29	Very low	144 Å²	144	129.5 Å²	129.5	77%	0.77	71%	0.711	S	S	*	*			trans	-49.1	133.9	135.6	-71.9	-38	0	0	0	113.1
537	N	25.6	Very low	28.4	Very low	145 Å²	145	131.2 Å²	131.2	78%	0.775	72%	0.721	S	S	*	*				172.5	120.9	122.7	-100.5	-21.2	0	0	0	115.1
538	S	25.4	Very low	27.8	Very low	94 Å²	94	133 Å²	133	66%	0.657	74%	0.741	S	S	*	*				77.9	133.8	123.7	-68.2	0	0	0	0	125.5
539	N	27.1	Very low	27.3	Very low	149 Å²	149	134 Å²	134	80%	0.797	75%	0.751	S	S	*	*			trans	102.7	106.2	147.6	-65.4	-14.8	0	0	0	116
540	N	23.7	Very low	27	Very low	152 Å²	152	135.7 Å²	135.7	81%	0.813	76%	0.759	S	S	*	*			cis	60.9	106.5	46	-109.5	8.8	0	0	0	115.4
541	N	29.4	Very low	26.4	Very low	156 Å²	156	134.4 Å²	134.4	83%	0.834	76%	0.759	S	S	*	*			trans	166.1	150.4	149.6	-87.2	-23.4	0	0	0	109.8
542	N	26.4	Very low	26	Very low	126 Å²	126	135.1 Å²	135.1	67%	0.674	76%	0.762	S	S	*	*			cis	177.9	152	-38.4	-121.4	-13.2	0	0	0	107.2
543	N	28.3	Very low	25.5	Very low	139 Å²	139	134 Å²	134	74%	0.743	75%	0.754	S	S	*	*			trans	83.2	121.1	155	-49.4	-24.1	0	0	0	119.8
544	N	22.9	Very low	25.2	Very low	148 Å²	148	131 Å²	131	79%	0.791	74%	0.74	S	S	*	*			cis	79.1	118.1	46.4	-95.2	-6.3	0	0	0	117.7
545	L	27.1	Very low	25.1	Very low	166 Å²	166	133 Å²	133	87%	0.869	74%	0.742	S	S	*	*			trans	-175.6	112.9	146.5	-126.1	76.2	0	0	0	107
546	Q	22.8	Very low	24.8	Very low	155 Å²	155	130.6 Å²	130.6	72%	0.724	74%	0.737	S	S	*	*				84.5	120.4	52.4	-89	-176.8	-11.6	0	0	118
547	N	23.8	Very low	24.9	Very low	148 Å²	148	128.5 Å²	128.5	79%	0.791	73%	0.734	S	S	*	*			trans	81.4	147.6	146.6	-63.8	-8.4	0	0	0	119.9
548	A	23.6	Very low	24.8	Very low	89 Å²	89	128.3 Å²	128.3	74%	0.736	73%	0.733	S	S	*	*			cis	-173.4	165.4	-10.1	0	0	0	0	0	110.2
549	N	25.8	Very low	24.8	Very low	152 Å²	152	130.6 Å²	130.6	81%	0.813	74%	0.737	S	S	*	*			trans	-68.3	179.8	-174.9	-45	-53.5	0	0	0	116.3
550	P	29.9	Very low	25	Very low	115 Å²	115	130.8 Å²	130.8	75%	0.747	74%	0.737	S	S	*	*				-152	154	64.4	34.6	-10	0	0	0	118.1
551	I	22.4	Very low	25.4	Very low	142 Å²	142	129 Å²	129	73%	0.728	73%	0.732	S	S	*	*				81.5	133.2	83.7	-45.6	166.7	0	0	0	119.1
552	L	24.7	Very low	25.6	Very low	128 Å²	128	128 Å²	128	67%	0.67	73%	0.726	S	S	*	*			trans	102.2	142.1	155.2	-77.4	112.1	0	0	0	117.8
553	S	22.6	Very low	25.8	Very low	82 Å²	82	130.9 Å²	130.9	57%	0.573	73%	0.733	S	S	*	*			cis	168.9	136.3	-23.7	57	0	0	0	0	109.3	Q426	Q426-S553 VanDerWaalsContact OE1-CA 3.28Å
554	G	22.5	Very low	26	Very low	42 Å²	42	126.5 Å²	126.5	43%	0.433	71%	0.713	S	S	.	*			trans	90.7	146.9	153	0	0	0	0	0	117	Q426	Q426-G554 PolarHBondContact NE2-O 3.45Å
555	N	22.5	Very low	26.3	Very low	150 Å²	150	124.2 Å²	124.2	80%	0.802	70%	0.7	S	S	*	*			cis	-170.5	163.5	5.2	-101.6	-12.5	0	0	0	108.9
556	T	23.2	Very low	26.5	Very low	121 Å²	121	124 Å²	124	74%	0.742	69%	0.694	S	S	*	*			trans	80.2	106.5	145.6	41.1	0	0	0	0	122.6
557	S	23.3	Very low	27	Very low	99 Å²	99	123.2 Å²	123.2	69%	0.692	69%	0.691	S	S	*	*				57.3	149.4	120.1	69.3	0	0	0	0	119.5
558	D	22.5	Very low	27.4	Very low	141 Å²	141	120.2 Å²	120.2	75%	0.754	67%	0.674	S	S	*	*			cis	-175.6	160	-17.8	-102.2	-37.2	0	0	0	103.1
559	N	27.3	Very low	27.8	Very low	142 Å²	142	122.9 Å²	122.9	76%	0.759	67%	0.668	S	S	*	*			trans	79.9	75	161.2	-55.3	-36.6	0	0	0	119.5
560	I	29.8	Very low	28.1	Very low	153 Å²	153	121 Å²	121	79%	0.785	66%	0.659	S	S	*	*			trans	-142.1	62.5	132.2	-50.1	-179.5	0	0	0	108.8
561	V	33.2	Very low	28.3	Very low	116 Å²	116	121.9 Å²	121.9	70%	0.703	65%	0.651	S	S	*	*			trans	-96.4	109.8	169.3	179.4	0	0	0	0	106.7
562	N	33.6	Very low	28.7	Very low	134 Å²	134	120.3 Å²	120.3	72%	0.717	64%	0.64	S	S	*	*	S	Bend	trans	166	-7.6	147.5	-81	-18.5	0	0	0	114
563	K	30.5	Very low	29	Very low	187 Å²	187	121.2 Å²	121.2	81%	0.813	64%	0.639	S	S	*	*	S	Bend	trans	-98.3	-12.3	170.2	-130.6	176.9	-177.1	-178.7	0	114.1
564	S	31.3	Very low	29.8	Very low	47 Å²	47	121.7 Å²	121.7	33%	0.329	63%	0.634	S	S	.	*	H	α-helix	trans	-83.4	-6.7	179.6	-49.3	0	0	0	0	114.1	E566 E567 I568	S564-E566 PolarHBondContact O-N 2.83Å; S564-E567 PolarHBondContact O-N 3.37Å; S564-I568 WeakPolarHBondContact O-CA 3.12Å; S564-I568 WeakPolarHBondContact O-CB 3.16Å; S564-I568 WeakPolarHBondContact O-CD1 3.28Å; S564-I568 WeakPolarHBondContact O-CG1 3.47Å; S564-I568 PolarHBondContact O-N 2.85Å
565	I	30.5	Very low	30.3	Very low	100 Å²	100	123.4 Å²	123.4	51%	0.513	63%	0.633	S	S	.	*	H	α-helix	trans	-69.2	-31.8	-175.4	-63.4	175.6	0	0	0	112.5	K569	I565-K569 PolarHBondContact O-N 2.91Å
566	E	30.3	Very low	31.1	Very low	160 Å²	160	120.5 Å²	120.5	75%	0.748	62%	0.615	S	S	*	*	H	α-helix	trans	-82	-34.9	172.9	-78.9	-140.2	147.6	0	0	113.1	S564 I568 K569 N570	S564-E566 PolarHBondContact O-N 2.83Å; E566-I568 VanDerWaalsContact C-N 3.34Å; E566-K569 PolarHBondContact O-N 3.39Å; E566-N570 PolarHBondContact O-N 3.46Å
567	E	34.2	Very low	31.8	Very low	140 Å²	140	120.7 Å²	120.7	65%	0.654	61%	0.607	S	S	*	*	H	α-helix	trans	-67.1	-36.2	171.9	-80.7	180	164.7	0	0	111.4	S564 K569 N570 K571	S564-E567 PolarHBondContact O-N 3.37Å; E567-K569 VanDerWaalsContact C-N 3.34Å; E567-K569 PolarHBondContact O-N 3.15Å; E567-N570 PolarHBondContact O-N 3.27Å; E567-K571 WeakPolarHBondContact O-CB 3.43Å; E567-K571 PolarHBondContact O-N 3.28Å
568	I	32.4	Very low	32.5	Very low	85 Å²	85	118.9 Å²	118.9	44%	0.436	59%	0.59	S	S	.	*	H	α-helix	trans	-66.5	-34	176.6	-71	161.4	0	0	0	110.9	S564 E566 Q572	S564-I568 WeakPolarHBondContact O-CA 3.12Å; S564-I568 WeakPolarHBondContact O-CB 3.16Å; S564-I568 WeakPolarHBondContact O-CD1 3.28Å; S564-I568 WeakPolarHBondContact O-CG1 3.47Å; S564-I568 PolarHBondContact O-N 2.85Å; E566-I568 VanDerWaalsContact C-N 3.34Å; I568-Q572 HydrophobicContact CG2-CG 4.19Å; I568-Q572 WeakPolarHBondContact O-CB 3.18Å; I568-Q572 WeakPolarHBondContact O-CG 3.37Å; I568-Q572 PolarHBondContact O-N 2.92Å
569	K	31.8	Very low	33.2	Very low	144 Å²	144	116.7 Å²	116.7	63%	0.626	58%	0.575	S	S	*	*	H	α-helix	trans	-68.6	-40.4	173.6	-80.5	-176.5	177.9	179	0	112.7	I565 E566 E567 F573	I565-K569 PolarHBondContact O-N 2.91Å; E566-K569 PolarHBondContact O-N 3.39Å; E567-K569 VanDerWaalsContact C-N 3.34Å; E567-K569 PolarHBondContact O-N 3.15Å; K569-F573 PolarHBondContact O-N 3.48Å
570	N	31.3	Very low	33.8	Very low	113 Å²	113	112.2 Å²	112.2	60%	0.604	55%	0.551	S	S	*	*	H	α-helix	trans	-74.8	-31.3	176.7	-77.9	-19.7	0	0	0	112.2	E566 E567 I574	E566-N570 PolarHBondContact O-N 3.46Å; E567-N570 PolarHBondContact O-N 3.27Å; N570-I574 VanDerWaalsContact O-CD1 3.28Å; N570-I574 WeakPolarHBondContact O-CD1 3.14Å; N570-I574 WeakPolarHBondContact O-CG1 3.45Å; N570-I574 PolarHBondContact O-N 3.09Å
571	K	33.9	Very low	34.3	Very low	134 Å²	134	106.4 Å²	106.4	58%	0.583	52%	0.521	S	S	*	.	H	α-helix	trans	-80.5	-38	178.7	-145	177.4	-175.7	-172.9	0	111.8	E567 F573 I574 D575	E567-K571 WeakPolarHBondContact O-CB 3.43Å; E567-K571 PolarHBondContact O-N 3.28Å; K571-F573 VanDerWaalsContact C-N 3.3Å; K571-F573 PolarHBondContact O-N 3.13Å; K571-I574 CarbonylContact O-C 3.59Å; K571-I574 PolarHBondContact O-N 3.42Å; K571-I574 VanDerWaalsContact O-N 3.1Å; K571-D575 VanDerWaalsContact O-CB 3.26Å; K571-D575 WeakPolarHBondContact O-CB 3.42Å; K571-D575 PolarHBondContact O-N 2.94Å
572	Q	32.3	Very low	34.7	Very low	108 Å²	108	107.2 Å²	107.2	51%	0.505	52%	0.517	S	S	.	.	H	α-helix	trans	-59.4	-40	168.5	-86.4	-174.8	-63.9	0	0	111.6	I568 I574 E576	I568-Q572 HydrophobicContact CG2-CG 4.19Å; I568-Q572 WeakPolarHBondContact O-CB 3.18Å; I568-Q572 WeakPolarHBondContact O-CG 3.37Å; I568-Q572 PolarHBondContact O-N 2.92Å; Q572-I574 VanDerWaalsContact C-N 3.3Å; Q572-I574 PolarHBondContact O-N 3.44Å; Q572-E576 WeakPolarHBondContact O-CB 3.38Å; Q572-E576 WeakPolarHBondContact O-CG 3.46Å; Q572-E576 PolarHBondContact O-N 3.09Å
573	F	31	Very low	34.8	Very low	148 Å²	148	106.5 Å²	106.5	65%	0.649	51%	0.509	S	S	*	.	H	α-helix	trans	-64.6	-34	175.3	-114.2	-84.7	0	0	0	113.1	K569 K571 E577	K569-F573 PolarHBondContact O-N 3.48Å; K571-F573 VanDerWaalsContact C-N 3.3Å; K571-F573 PolarHBondContact O-N 3.13Å; F573-E577 PolarHBondContact O-N 2.93Å
574	I	37.7	Very low	35.2	Very low	91 Å²	91	99.9 Å²	99.9	47%	0.467	48%	0.482	S	S	.	.	H	α-helix	trans	-80.5	-38.9	179.3	-67.9	165	0	0	0	111.1	N570 K571 Q572 E577 N578	N570-I574 VanDerWaalsContact O-CD1 3.28Å; N570-I574 WeakPolarHBondContact O-CD1 3.14Å; N570-I574 WeakPolarHBondContact O-CG1 3.45Å; N570-I574 PolarHBondContact O-N 3.09Å; K571-I574 CarbonylContact O-C 3.59Å; K571-I574 PolarHBondContact O-N 3.42Å; K571-I574 VanDerWaalsContact O-N 3.1Å; Q572-I574 VanDerWaalsContact C-N 3.3Å; Q572-I574 PolarHBondContact O-N 3.44Å; I574-E577 PolarHBondContact O-N 3.31Å; I574-N578 WeakPolarHBondContact CG2-ND2 3.4Å; I574-N578 WeakPolarHBondContact O-CB 3.44Å; I574-N578 PolarHBondContact O-N 2.94Å; I574-N578 PolarHBondContact O-ND2 3.07Å
575	D	33.1	Very low	35.4	Very low	79 Å²	79	100.6 Å²	100.6	42%	0.422	48%	0.48	S	S	.	.	H	α-helix	trans	-72.3	-37.8	-179.4	-63.9	-23.4	0	0	0	110.3	K571 N578 E579	K571-D575 VanDerWaalsContact O-CB 3.26Å; K571-D575 WeakPolarHBondContact O-CB 3.42Å; K571-D575 PolarHBondContact O-N 2.94Å; D575-N578 PolarHBondContact O-N 3.5Å; D575-E579 WeakPolarHBondContact O-CB 3.17Å; D575-E579 PolarHBondContact O-N 3.01Å
576	E	39.3	Very low	35.7	Very low	88 Å²	88	101.5 Å²	101.5	41%	0.411	49%	0.486	S	S	.	.	H	α-helix	trans	-62.4	-41.8	170.5	-75.3	175	-165	0	0	111.7	Q572 L580	Q572-E576 WeakPolarHBondContact O-CB 3.38Å; Q572-E576 WeakPolarHBondContact O-CG 3.46Å; Q572-E576 PolarHBondContact O-N 3.09Å; E576-L580 VanDerWaalsContact O-CB 3.29Å; E576-L580 WeakPolarHBondContact O-CB 3.24Å; E576-L580 WeakPolarHBondContact O-CD1 3.44Å; E576-L580 WeakPolarHBondContact O-CG 3.42Å; E576-L580 PolarHBondContact O-N 3.41Å
577	E	38.4	Very low	36.1	Very low	125 Å²	125	98.6 Å²	98.6	58%	0.584	48%	0.475	S	S	*	.	H	α-helix	trans	-65.6	-37.5	175.5	-85.3	-168.8	164.9	0	0	112.9	F573 I574 E581	F573-E577 PolarHBondContact O-N 2.93Å; I574-E577 PolarHBondContact O-N 3.31Å; E577-E581 WeakPolarHBondContact O-CB 3.37Å; E577-E581 PolarHBondContact O-N 3.33Å
578	N	38.2	Very low	36.2	Very low	62 Å²	62	94.2 Å²	94.2	33%	0.332	46%	0.456	S	S	.	.	H	α-helix	trans	-79.3	-34.7	-177.5	-67.5	-30.3	0	0	0	112.8	K479 I574 D575 E581 E582	K479-N578 PolarHBondContact NZ-OD1 3.33Å; I574-N578 WeakPolarHBondContact CG2-ND2 3.4Å; I574-N578 WeakPolarHBondContact O-CB 3.44Å; I574-N578 PolarHBondContact O-N 2.94Å; I574-N578 PolarHBondContact O-ND2 3.07Å; D575-N578 PolarHBondContact O-N 3.5Å; N578-E581 VanDerWaalsContact O-CB 3.28Å; N578-E581 WeakPolarHBondContact O-CB 3.49Å; N578-E581 PolarHBondContact O-N 3.3Å; N578-E582 PolarHBondContact O-N 3.07Å
579	E	38.2	Very low	36.3	Very low	94 Å²	94	96.6 Å²	96.6	44%	0.439	46%	0.464	S	S	.	.	H	α-helix	trans	-76.3	-35.7	179.2	-158.8	176.8	-175.6	0	0	111.3	N414 D575 E581 E582 E583	N414-E579 PolarHBondContact ND2-OE1 2.92Å; N414-E579 PolarHBondContact ND2-OE2 3.22Å; D575-E579 WeakPolarHBondContact O-CB 3.17Å; D575-E579 PolarHBondContact O-N 3.01Å; E579-E581 PolarHBondContact O-N 3.06Å; E579-E582 PolarHBondContact O-N 2.87Å; E579-E583 PolarHBondContact O-N 3.17Å
580	L	38.8	Very low	36.8	Very low	48 Å²	48	95.8 Å²	95.8	25%	0.251	47%	0.466	S	S	.	.	H	α-helix	trans	-59.5	-34.5	165.8	-71.2	168.8	0	0	0	111.6	L411 E576 L584	L411-L580 HydrophobicContact CD1-CD1 3.63Å; L411-L580 HydrophobicContact CD1-CD2 3.55Å; L411-L580 HydrophobicContact CD1-CG 4.22Å; L411-L580 HydrophobicContact CD2-CD1 4.2Å; L411-L580 HydrophobicContact CG-CD1 3.99Å; L411-L580 HydrophobicContact CG-CD2 3.97Å; L411-L580 HydrophobicContact CG-CG 4.47Å; E576-L580 VanDerWaalsContact O-CB 3.29Å; E576-L580 WeakPolarHBondContact O-CB 3.24Å; E576-L580 WeakPolarHBondContact O-CD1 3.44Å; E576-L580 WeakPolarHBondContact O-CG 3.42Å; E576-L580 PolarHBondContact O-N 3.41Å; L580-L584 WeakPolarHBondContact O-CB 3.39Å; L580-L584 WeakPolarHBondContact O-CD1 3.26Å; L580-L584 VanDerWaalsContact O-CG 3.26Å; L580-L584 WeakPolarHBondContact O-CG 3.44Å; L580-L584 PolarHBondContact O-N 3.15Å
581	E	41.4	Very low	37.1	Very low	32 Å²	32	92.9 Å²	92.9	15%	0.15	45%	0.45	C	S	.	.	H	α-helix	trans	-68.5	-44.7	177.8	-167.3	174.4	-157.5	0	0	111.4	S475 K479 E577 N578 E579 L584 E585	S475-E581 PolarHBondContact OG-OE1 3.42Å; K479-E581 WeakPolarHBondContact CE-OE1 3.42Å; K479-E581 WeakPolarHBondContact CE-OE2 3.22Å; K479-E581 IonicContact NZ-OE1 2.87Å; K479-E581 IonicContact NZ-OE2 2.83Å; K479-E581 PolarHBondContact NZ-OE2 2.82Å; E577-E581 WeakPolarHBondContact O-CB 3.37Å; E577-E581 PolarHBondContact O-N 3.33Å; N578-E581 VanDerWaalsContact O-CB 3.28Å; N578-E581 WeakPolarHBondContact O-CB 3.49Å; N578-E581 PolarHBondContact O-N 3.3Å; E579-E581 PolarHBondContact O-N 3.06Å; E581-L584 PolarHBondContact O-N 2.95Å; E581-E585 HydrophobicContact CG-CG 4.15Å; E581-E585 WeakPolarHBondContact O-CA 3.27Å; E581-E585 WeakPolarHBondContact O-CB 3.49Å; E581-E585 WeakPolarHBondContact O-CG 3.4Å; E581-E585 PolarHBondContact O-N 3.37Å
582	E	41	Very low	37.2	Very low	132 Å²	132	88.4 Å²	88.4	62%	0.617	43%	0.432	S	S	*	.	H	α-helix	trans	-63.9	-42.9	178.5	-90.2	-169.5	165.3	0	0	113.2	N578 E579 E585 L586	N578-E582 PolarHBondContact O-N 3.07Å; E579-E582 PolarHBondContact O-N 2.87Å; E582-E585 PolarHBondContact O-N 3.03Å; E582-L586 WeakPolarHBondContact O-CB 3.37Å; E582-L586 WeakPolarHBondContact O-CG 3.44Å; E582-L586 PolarHBondContact O-N 2.99Å
583	E	36	Very low	37.5	Very low	120 Å²	120	87.7 Å²	87.7	56%	0.561	45%	0.445	S	S	*	.	H	α-helix	trans	-70.8	-33.4	179.5	-165.8	179.5	-174.9	0	0	112.1	E579 N587	E579-E583 PolarHBondContact O-N 3.17Å; E583-N587 PolarHBondContact O-N 2.81Å; E583-N587 PolarHBondContact O-ND2 3.46Å; E583-N587 VanDerWaalsContact O-ND2 3.12Å
584	L	37.9	Very low	38.1	Very low	48 Å²	48	82.7 Å²	82.7	25%	0.251	43%	0.428	S	S	.	.	H	α-helix	trans	-73.9	-36	172.8	-77	156.6	0	0	0	111.7	L580 E581 L588	L580-L584 WeakPolarHBondContact O-CB 3.39Å; L580-L584 WeakPolarHBondContact O-CD1 3.26Å; L580-L584 VanDerWaalsContact O-CG 3.26Å; L580-L584 WeakPolarHBondContact O-CG 3.44Å; L580-L584 PolarHBondContact O-N 3.15Å; E581-L584 PolarHBondContact O-N 2.95Å; L584-L588 WeakPolarHBondContact O-CB 3.47Å; L584-L588 PolarHBondContact O-N 3.35Å
585	E	36.6	Very low	38.5	Very low	61 Å²	61	86.2 Å²	86.2	29%	0.285	44%	0.443	S	S	.	.	H	α-helix	trans	-67	-44.9	174.3	-81	-172.1	172.9	0	0	110.9	E581 E582 N587 L588 F589	E581-E585 HydrophobicContact CG-CG 4.15Å; E581-E585 WeakPolarHBondContact O-CA 3.27Å; E581-E585 WeakPolarHBondContact O-CB 3.49Å; E581-E585 WeakPolarHBondContact O-CG 3.4Å; E581-E585 PolarHBondContact O-N 3.37Å; E582-E585 PolarHBondContact O-N 3.03Å; E585-N587 VanDerWaalsContact C-N 3.29Å; E585-N587 PolarHBondContact O-N 3.46Å; E585-L588 CarbonylContact O-C 3.56Å; E585-L588 PolarHBondContact O-N 3.11Å; E585-F589 WeakPolarHBondContact O-CB 3.23Å; E585-F589 PolarHBondContact O-N 3.37Å
586	L	36.1	Very low	39.3	Very low	119 Å²	119	90.1 Å²	90.1	62%	0.623	46%	0.456	S	S	*	.	H	α-helix	trans	-59.4	-38.2	177	-87	157.1	0	0	0	112.4	E582 N590	E582-L586 WeakPolarHBondContact O-CB 3.37Å; E582-L586 WeakPolarHBondContact O-CG 3.44Å; E582-L586 PolarHBondContact O-N 2.99Å; L586-N590 PolarHBondContact O-ND2 3.5Å; L586-N590 VanDerWaalsContact O-ND2 3.08Å
587	N	39.3	Very low	39.8	Very low	100 Å²	100	90 Å²	90	54%	0.535	45%	0.454	S	S	.	.	H	α-helix	trans	-76.9	-26.6	174.8	-80.5	-53.4	0	0	0	113.4	E583 E585	E583-N587 PolarHBondContact O-N 2.81Å; E583-N587 PolarHBondContact O-ND2 3.46Å; E583-N587 VanDerWaalsContact O-ND2 3.12Å; E585-N587 VanDerWaalsContact C-N 3.29Å; E585-N587 PolarHBondContact O-N 3.46Å
588	L	36.3	Very low	40.3	Very low	47 Å²	47	87.6 Å²	87.6	25%	0.246	45%	0.445	C	S	.	.	H	α-helix	trans	-90.8	-31.4	-177.1	-168.7	67.4	0	0	0	113.2	L584 E585 N590 L591 I592	L584-L588 WeakPolarHBondContact O-CB 3.47Å; L584-L588 PolarHBondContact O-N 3.35Å; E585-L588 CarbonylContact O-C 3.56Å; E585-L588 PolarHBondContact O-N 3.11Å; L588-N590 VanDerWaalsContact C-N 3.28Å; L588-N590 PolarHBondContact O-N 2.91Å; L588-L591 HydrophobicContact CD1-CD2 4.36Å; L588-L591 CarbonylContact O-C 3.44Å; L588-L591 WeakPolarHBondContact O-CA 3.44Å; L588-L591 WeakPolarHBondContact O-CB 3.14Å; L588-L591 PolarHBondContact O-N 2.79Å; L588-I592 HydrophobicContact CD1-CD1 3.62Å; L588-I592 HydrophobicContact CD1-CG1 3.8Å; L588-I592 HydrophobicContact CD2-CD1 3.66Å; L588-I592 HydrophobicContact CG-CD1 3.4Å; L588-I592 HydrophobicContact CG-CG1 3.83Å; L588-I592 PolarHBondContact O-N 3.49Å
589	F	34.2	Very low	41.1	Very low	136 Å²	136	93.2 Å²	93.2	60%	0.596	46%	0.461	S	S	*	.	H	α-helix	trans	-62.5	-38.9	175	-123.5	-87.9	0	0	0	110.7	E585 L591	E585-F589 WeakPolarHBondContact O-CB 3.23Å; E585-F589 PolarHBondContact O-N 3.37Å; F589-L591 PolarHBondContact O-N 3.36Å
590	N	41.5	Very low	42.2	Very low	126 Å²	126	92.7 Å²	92.7	67%	0.674	46%	0.462	S	S	*	.	H	α-helix	trans	-66.4	-18.8	172.1	-73.9	-37.8	0	0	0	113.1	L586 L588 K597	L586-N590 PolarHBondContact O-ND2 3.5Å; L586-N590 VanDerWaalsContact O-ND2 3.08Å; L588-N590 VanDerWaalsContact C-N 3.28Å; L588-N590 PolarHBondContact O-N 2.91Å; N590-K597 PolarHBondContact O-NZ 2.96Å
591	L	37.6	Very low	43.2	Very low	52 Å²	52	91.7 Å²	91.7	27%	0.272	46%	0.457	S	S	.	.	H	α-helix	trans	-100	-39.3	-175.2	-160.9	70.3	0	0	0	114.1	L588 F589 K597	L588-L591 HydrophobicContact CD1-CD2 4.36Å; L588-L591 CarbonylContact O-C 3.44Å; L588-L591 WeakPolarHBondContact O-CA 3.44Å; L588-L591 WeakPolarHBondContact O-CB 3.14Å; L588-L591 PolarHBondContact O-N 2.79Å; F589-L591 PolarHBondContact O-N 3.36Å; L591-K597 WeakPolarHBondContact O-CD 3.31Å
592	I	35.5	Very low	44.1	Very low	41 Å²	41	92.1 Å²	92.1	21%	0.21	47%	0.465	C	S	.	.	H	α-helix	trans	-85.3	-12	-169	-68.6	-174.3	0	0	0	114.3	W478 L588 S594	W478-I592 HydrophobicContact CH2-CD1 4.35Å; W478-I592 HydrophobicContact CZ2-CD1 3.95Å; L588-I592 HydrophobicContact CD1-CD1 3.62Å; L588-I592 HydrophobicContact CD1-CG1 3.8Å; L588-I592 HydrophobicContact CD2-CD1 3.66Å; L588-I592 HydrophobicContact CG-CD1 3.4Å; L588-I592 HydrophobicContact CG-CG1 3.83Å; L588-I592 PolarHBondContact O-N 3.49Å; I592-S594 PolarHBondContact O-N 2.99Å
593	A	40.1	Very low	45.6	Very low	93 Å²	93	88.5 Å²	88.5	77%	0.769	45%	0.45	S	S	*	.	S	Bend	trans	-67.2	9.8	-170.9	0	0	0	0	0	117
594	S	43.3	Very low	47.3	Very low	43 Å²	43	84.9 Å²	84.9	30%	0.301	44%	0.435	S	S	.	.			trans	-148.2	134.3	170	68.5	0	0	0	0	113	I592 K596 K597 L598	I592-S594 PolarHBondContact O-N 2.99Å; S594-K596 PolarHBondContact O-N 2.89Å; S594-K597 PolarHBondContact O-N 3.31Å; S594-K597 VanDerWaalsContact OG-CG 3.31Å; S594-K597 WeakPolarHBondContact OG-CG 3.19Å; S594-K597 PolarHBondContact OG-N 2.95Å; S594-L598 PolarHBondContact O-N 3.21Å
595	E	45	Very low	49.3	Very low	165 Å²	165	84 Å²	84	77%	0.771	43%	0.429	S	S	*	.	H	α-helix	trans	-56.6	-28	172.1	-164	175.8	-177.6	0	0	112.3	L598 R599	E595-L598 PolarHBondContact O-N 3.35Å; E595-R599 PolarHBondContact O-N 3.1Å
596	K	50.1	Low	51.3	Low	161 Å²	161	83.8 Å²	83.8	70%	0.7	43%	0.43	S	S	*	.	H	α-helix	trans	-59	-46.1	171.1	-166.4	174.8	-179.7	-179.1	0	111.9	S594 L598 R599 D600	S594-K596 PolarHBondContact O-N 2.89Å; K596-L598 PolarHBondContact O-N 3.39Å; K596-R599 WeakPolarHBondContact O-CB 3.37Å; K596-R599 PolarHBondContact O-N 3.27Å; K596-D600 PolarHBondContact O-N 3.47Å
597	K	51.3	Low	53.2	Low	84 Å²	84	82 Å²	82	37%	0.365	42%	0.415	S	S	.	.	H	α-helix	trans	-67.6	-31.9	177.5	-76.1	179.1	-178.3	-177.7	0	113.3	N590 L591 S594 R599 D600 L601	N590-K597 PolarHBondContact O-NZ 2.96Å; L591-K597 WeakPolarHBondContact O-CD 3.31Å; S594-K597 PolarHBondContact O-N 3.31Å; S594-K597 VanDerWaalsContact OG-CG 3.31Å; S594-K597 WeakPolarHBondContact OG-CG 3.19Å; S594-K597 PolarHBondContact OG-N 2.95Å; K597-R599 VanDerWaalsContact C-N 3.32Å; K597-D600 CarbonylContact O-C 3.6Å; K597-D600 WeakPolarHBondContact O-CB 3.17Å; K597-D600 PolarHBondContact O-N 2.89Å; K597-L601 VanDerWaalsContact O-CG 3.31Å; K597-L601 WeakPolarHBondContact O-CG 3.37Å; K597-L601 PolarHBondContact O-N 2.84Å
598	L	48.8	Very low	54.9	Low	76 Å²	76	82 Å²	82	40%	0.398	42%	0.415	S	S	.	.	H	α-helix	trans	-64.6	-38.5	173.6	-86.3	164.4	0	0	0	111.8	S594 E595 K596 L601 A602	S594-L598 PolarHBondContact O-N 3.21Å; E595-L598 PolarHBondContact O-N 3.35Å; K596-L598 PolarHBondContact O-N 3.39Å; L598-L601 HydrophobicContact CD2-CD1 4.48Å; L598-L601 PolarHBondContact O-N 3.49Å; L598-A602 PolarHBondContact O-N 3.07Å
599	R	54.3	Low	56.6	Low	179 Å²	179	83.2 Å²	83.2	68%	0.675	42%	0.419	S	S	*	.	H	α-helix	trans	-64.5	-44.5	171.8	-161.7	175.5	-66.2	-144.5	0.2	110.5	E595 K596 K597 L601 A602 N603	E595-R599 PolarHBondContact O-N 3.1Å; K596-R599 WeakPolarHBondContact O-CB 3.37Å; K596-R599 PolarHBondContact O-N 3.27Å; K597-R599 VanDerWaalsContact C-N 3.32Å; R599-L601 VanDerWaalsContact C-N 3.26Å; R599-L601 PolarHBondContact O-N 2.83Å; R599-A602 PolarHBondContact O-N 3.31Å; R599-A602 VanDerWaalsContact O-N 3.12Å; R599-N603 PolarHBondContact O-N 3.47Å; R599-N603 PolarHBondContact O-ND2 2.92Å; R599-N603 PolarHBondContact O-OD1 3.44Å
600	D	62.2	Low	58.3	Low	84 Å²	84	77 Å²	77	45%	0.449	39%	0.392	S	S	.	.	H	α-helix	trans	-59.7	-35.2	174.9	-57.2	-30	0	0	0	112.4	K596 K597 N603 L604	K596-D600 PolarHBondContact O-N 3.47Å; K597-D600 CarbonylContact O-C 3.6Å; K597-D600 WeakPolarHBondContact O-CB 3.17Å; K597-D600 PolarHBondContact O-N 2.89Å; D600-N603 WeakPolarHBondContact O-CB 3.42Å; D600-L604 PolarHBondContact O-N 2.93Å
601	L	59.3	Low	59.6	Low	27 Å²	27	72.1 Å²	72.1	14%	0.141	37%	0.366	C	S	.	.	H	α-helix	trans	-69.4	-39.5	174.1	-74.2	176	0	0	0	112.8	C397 K597 L598 R599 N603 L604 F605	C397-L601 HydrophobicContact CB-CD2 4.11Å; C397-L601 VanDerWaalsContact SG-CD2 3.6Å; K597-L601 VanDerWaalsContact O-CG 3.31Å; K597-L601 WeakPolarHBondContact O-CG 3.37Å; K597-L601 PolarHBondContact O-N 2.84Å; L598-L601 HydrophobicContact CD2-CD1 4.48Å; L598-L601 PolarHBondContact O-N 3.49Å; R599-L601 VanDerWaalsContact C-N 3.26Å; R599-L601 PolarHBondContact O-N 2.83Å; L601-N603 VanDerWaalsContact C-N 3.31Å; L601-L604 WeakPolarHBondContact O-CB 3.41Å; L601-L604 PolarHBondContact O-N 2.77Å; L601-F605 WeakPolarHBondContact O-CD2 3.45Å
602	A	60.3	Low	61.2	Low	40 Å²	40	73.9 Å²	73.9	33%	0.331	37%	0.373	S	S	.	.	H	α-helix	trans	-65	-39.3	175.4	0	0	0	0	0	111.2	P393 L598 R599 L604 F605 N606	P393-A602 HydrophobicContact CB-CB 4.47Å; P393-A602 HydrophobicContact CG-CB 4.34Å; L598-A602 PolarHBondContact O-N 3.07Å; R599-A602 PolarHBondContact O-N 3.31Å; R599-A602 VanDerWaalsContact O-N 3.12Å; A602-L604 PolarHBondContact O-N 2.97Å; A602-F605 PolarHBondContact O-N 2.97Å; A602-F605 VanDerWaalsContact O-N 3.08Å; A602-N606 PolarHBondContact O-N 3.38Å
603	N	72.5	Confident	62.5	Low	56 Å²	56	76.7 Å²	76.7	30%	0.299	38%	0.381	S	S	.	.	H	α-helix	trans	-60.3	-31.7	176.4	-64.3	-1	0	0	0	112.2	R599 D600 L601 F605 N606 E609	R599-N603 PolarHBondContact O-N 3.47Å; R599-N603 PolarHBondContact O-ND2 2.92Å; R599-N603 PolarHBondContact O-OD1 3.44Å; D600-N603 WeakPolarHBondContact O-CB 3.42Å; L601-N603 VanDerWaalsContact C-N 3.31Å; N603-F605 PolarHBondContact O-N 2.86Å; N603-F605 VanDerWaalsContact O-N 3.15Å; N603-N606 PolarHBondContact O-N 3.28Å; N603-N606 VanDerWaalsContact O-N 3.09Å; N603-E609 VanDerWaalsContact CA-OE2 3.31Å; N603-E609 WeakPolarHBondContact CA-OE2 3.41Å; N603-E609 WeakPolarHBondContact CB-OE2 3.4Å; N603-E609 PolarHBondContact ND2-OE2 3.31Å; N603-E609 PolarHBondContact OD1-OE2 2.76Å
604	L	72.1	Confident	63.5	Low	45 Å²	45	74 Å²	74	24%	0.236	35%	0.353	C	S	.	.	T	Hydrogen-bonded Turn	trans	-57.7	-26.9	175.2	-150	75.7	0	0	0	113.8	W319 V323 D600 L601 A602	W319-L604 PolarHBondContact NE1-O 3.34Å; V323-L604 HydrophobicContact CB-CD1 3.53Å; V323-L604 HydrophobicContact CB-CD2 4.25Å; V323-L604 HydrophobicContact CB-CG 3.88Å; V323-L604 HydrophobicContact CG1-CD1 3.38Å; V323-L604 HydrophobicContact CG1-CD2 4.34Å; V323-L604 HydrophobicContact CG1-CG 3.51Å; D600-L604 PolarHBondContact O-N 2.93Å; L601-L604 WeakPolarHBondContact O-CB 3.41Å; L601-L604 PolarHBondContact O-N 2.77Å; A602-L604 PolarHBondContact O-N 2.97Å
605	F	78	Confident	64.2	Low	28 Å²	28	77.8 Å²	77.8	12%	0.123	36%	0.36	C	S	.	.	T	Hydrogen-bonded Turn	trans	-108.8	6.1	-178.4	-62.9	-72.9	0	0	0	112.8	W319 L353 L396 C397 T400 L601 A602 N603	W319-F605 HydrophobicContact CH2-CE1 4.37Å; W319-F605 HydrophobicContact CZ2-CD1 4.2Å; W319-F605 AromaticContact CZ2-CE1 3.77Å; W319-F605 HydrophobicContact CZ2-CE1 3.77Å; L353-F605 HydrophobicContact CD1-CD1 3.72Å; L353-F605 HydrophobicContact CD1-CE1 4.41Å; L353-F605 HydrophobicContact CD2-CD1 4.39Å; L353-F605 HydrophobicContact CG-CD1 4.32Å; L396-F605 HydrophobicContact CB-CE1 4.48Å; L396-F605 HydrophobicContact CB-CE2 4.06Å; L396-F605 HydrophobicContact CB-CZ 4.04Å; L396-F605 HydrophobicContact CD1-CE1 4.46Å; L396-F605 HydrophobicContact CD2-CB 4.12Å; L396-F605 HydrophobicContact CD2-CD1 3.34Å; L396-F605 HydrophobicContact CD2-CD2 3.74Å; L396-F605 HydrophobicContact CD2-CE1 3.56Å; L396-F605 HydrophobicContact CD2-CE2 3.94Å; L396-F605 HydrophobicContact CD2-CG 3.44Å; L396-F605 VanDerWaalsContact CD2-CG 3.44Å; L396-F605 HydrophobicContact CD2-CZ 3.87Å; L396-F605 HydrophobicContact CG-CD1 3.87Å; L396-F605 HydrophobicContact CG-CD2 4.25Å; L396-F605 HydrophobicContact CG-CE1 3.5Å; L396-F605 VanDerWaalsContact CG-CE1 3.5Å; L396-F605 HydrophobicContact CG-CE2 3.91Å; L396-F605 HydrophobicContact CG-CG 4.23Å; L396-F605 HydrophobicContact CG-CZ 3.53Å; C397-F605 HydrophobicContact CB-CE2 4.2Å; C397-F605 HydrophobicContact CB-CZ 4.49Å; T400-F605 WeakPolarHBondContact OG1-CE1 2.96Å; T400-F605 WeakPolarHBondContact OG1-CZ 3.44Å; L601-F605 WeakPolarHBondContact O-CD2 3.45Å; A602-F605 PolarHBondContact O-N 2.97Å; A602-F605 VanDerWaalsContact O-N 3.08Å; N603-F605 PolarHBondContact O-N 2.86Å; N603-F605 VanDerWaalsContact O-N 3.15Å
606	N	78.8	Confident	64.8	Low	58 Å²	58	77 Å²	77	31%	0.31	35%	0.351	S	S	.	.			trans	-94.3	102.3	168.2	-173.9	-9.6	0	0	0	109.4	A602 N603 N608 E609 V610	A602-N606 PolarHBondContact O-N 3.38Å; N603-N606 PolarHBondContact O-N 3.28Å; N603-N606 VanDerWaalsContact O-N 3.09Å; N606-N608 PolarHBondContact O-N 2.98Å; N606-N608 VanDerWaalsContact O-N 3.16Å; N606-N608 PolarHBondContact OD1-N 3.49Å; N606-E609 HydrophobicContact CB-CB 4.16Å; N606-E609 HydrophobicContact CB-CG 4.18Å; N606-E609 VanDerWaalsContact ND2-CD 3.3Å; N606-E609 WeakPolarHBondContact ND2-CG 3.48Å; N606-E609 PolarHBondContact ND2-OE1 2.97Å; N606-E609 PolarHBondContact O-N 2.94Å; N606-V610 WeakPolarHBondContact O-CG2 3.37Å; N606-V610 PolarHBondContact O-N 2.87Å
607	W	75.8	Confident	64.8	Low	80 Å²	80	72.4 Å²	72.4	30%	0.303	33%	0.334	S	S	.	.	H	α-helix	trans	-55.4	-37	-176	-169.9	71.2	0	0	0	113.3	L354 E609 V610 M611	L354-W607 HydrophobicContact CD2-CD2 3.69Å; L354-W607 HydrophobicContact CD2-CE3 4.31Å; L354-W607 HydrophobicContact CD2-CG 3.81Å; L354-W607 HydrophobicContact CD2-CZ2 4.09Å; W607-E609 VanDerWaalsContact C-N 3.35Å; W607-E609 PolarHBondContact O-N 2.84Å; W607-V610 PolarHBondContact O-N 3.33Å; W607-M611 HydrophobicContact CD2-CG 4.11Å; W607-M611 HydrophobicContact CG-CG 4.48Å; W607-M611 HydrophobicContact CZ2-CG 4.17Å; W607-M611 WeakPolarHBondContact O-CB 3.17Å; W607-M611 VanDerWaalsContact O-CG 3.31Å; W607-M611 WeakPolarHBondContact O-CG 3.48Å; W607-M611 PolarHBondContact O-N 3.49Å
608	N	76	Confident	64.7	Low	102 Å²	102	71.3 Å²	71.3	55%	0.545	33%	0.329	S	S	.	.	H	α-helix	trans	-64.6	-38.2	178.8	-72.4	-35.5	0	0	0	112.5	N606 Q612	N606-N608 PolarHBondContact O-N 2.98Å; N606-N608 VanDerWaalsContact O-N 3.16Å; N606-N608 PolarHBondContact OD1-N 3.49Å; N608-Q612 VanDerWaalsContact O-CG 3.31Å; N608-Q612 WeakPolarHBondContact O-CG 3.33Å; N608-Q612 PolarHBondContact O-N 2.98Å
609	E	72	Confident	64.3	Low	71 Å²	71	74 Å²	74	33%	0.332	34%	0.335	S	S	.	.	H	α-helix	trans	-74.1	-42.1	178.8	-71.9	176.5	-155.9	0	0	111.5	N603 N606 W607 M611 Q612 Y613	N603-E609 VanDerWaalsContact CA-OE2 3.31Å; N603-E609 WeakPolarHBondContact CA-OE2 3.41Å; N603-E609 WeakPolarHBondContact CB-OE2 3.4Å; N603-E609 PolarHBondContact ND2-OE2 3.31Å; N603-E609 PolarHBondContact OD1-OE2 2.76Å; N606-E609 HydrophobicContact CB-CB 4.16Å; N606-E609 HydrophobicContact CB-CG 4.18Å; N606-E609 VanDerWaalsContact ND2-CD 3.3Å; N606-E609 WeakPolarHBondContact ND2-CG 3.48Å; N606-E609 PolarHBondContact ND2-OE1 2.97Å; N606-E609 PolarHBondContact O-N 2.94Å; W607-E609 VanDerWaalsContact C-N 3.35Å; W607-E609 PolarHBondContact O-N 2.84Å; E609-M611 VanDerWaalsContact C-N 3.31Å; E609-M611 PolarHBondContact O-N 3.06Å; E609-Q612 PolarHBondContact O-N 3.08Å; E609-Y613 PolarHBondContact O-N 3.35Å
610	V	69.5	Low	63.4	Low	6 Å²	6	73 Å²	73	4%	0.036	34%	0.337	C	S	.	.	H	α-helix	trans	-56.7	-47	173.3	176.3	0	0	0	0	110.2	T322 N606 W607 Q612 Y613 H614	T322-V610 HydrophobicContact CG2-CG1 3.51Å; N606-V610 WeakPolarHBondContact O-CG2 3.37Å; N606-V610 PolarHBondContact O-N 2.87Å; W607-V610 PolarHBondContact O-N 3.33Å; V610-Q612 VanDerWaalsContact C-N 3.33Å; V610-Q612 PolarHBondContact O-N 3.13Å; V610-Y613 PolarHBondContact O-N 3.3Å; V610-Y613 VanDerWaalsContact O-N 3.16Å; V610-H614 WeakPolarHBondContact O-CB 3.33Å; V610-H614 PolarHBondContact O-N 2.99Å
611	M	69.8	Low	62.1	Low	24 Å²	24	76.3 Å²	76.3	12%	0.118	35%	0.35	C	S	.	.	H	α-helix	trans	-70.6	-27.2	179.6	-69.3	-59.8	144.1	0	0	113.4	M318 W607 E609 R615	M318-M611 HydrophobicContact CB-CE 4.3Å; M318-M611 HydrophobicContact CE-CE 4Å; M318-M611 HydrophobicContact CE-SD 3.7Å; W607-M611 HydrophobicContact CD2-CG 4.11Å; W607-M611 HydrophobicContact CG-CG 4.48Å; W607-M611 HydrophobicContact CZ2-CG 4.17Å; W607-M611 WeakPolarHBondContact O-CB 3.17Å; W607-M611 VanDerWaalsContact O-CG 3.31Å; W607-M611 WeakPolarHBondContact O-CG 3.48Å; W607-M611 PolarHBondContact O-N 3.49Å; E609-M611 VanDerWaalsContact C-N 3.31Å; E609-M611 PolarHBondContact O-N 3.06Å; M611-R615 WeakPolarHBondContact O-CB 3.37Å; M611-R615 VanDerWaalsContact O-CG 3.26Å; M611-R615 WeakPolarHBondContact O-CG 3.41Å; M611-R615 PolarHBondContact O-N 2.9Å; M611-R615 VanDerWaalsContact O-N 3.16Å; M611-R615 PolarHBondContact O-NE 3.07Å
612	Q	69.6	Low	60.8	Low	89 Å²	89	77.4 Å²	77.4	42%	0.416	35%	0.354	S	S	.	.	H	α-helix	trans	-69.4	-41	168.6	-76.3	-179.1	33.4	0	0	111.5	N608 E609 V610 R615 R616	N608-Q612 VanDerWaalsContact O-CG 3.31Å; N608-Q612 WeakPolarHBondContact O-CG 3.33Å; N608-Q612 PolarHBondContact O-N 2.98Å; E609-Q612 PolarHBondContact O-N 3.08Å; V610-Q612 VanDerWaalsContact C-N 3.33Å; V610-Q612 PolarHBondContact O-N 3.13Å; Q612-R615 PolarHBondContact O-N 3.4Å; Q612-R616 WeakPolarHBondContact O-CG 3.45Å; Q612-R616 PolarHBondContact O-N 3.25Å
613	Y	63.1	Low	59.3	Low	99 Å²	99	87.3 Å²	87.3	39%	0.388	38%	0.383	S	S	.	.	H	α-helix	trans	-65.6	-47	176.9	-176.9	-82.6	0	0	0	111.4	T322 E609 V610 R615 R616 D617	T322-Y613 HydrophobicContact CG2-CD1 3.56Å; T322-Y613 HydrophobicContact CG2-CE1 4.3Å; T322-Y613 HydrophobicContact CG2-CG 4.4Å; E609-Y613 PolarHBondContact O-N 3.35Å; V610-Y613 PolarHBondContact O-N 3.3Å; V610-Y613 VanDerWaalsContact O-N 3.16Å; Y613-R615 VanDerWaalsContact C-N 3.27Å; Y613-R615 PolarHBondContact O-N 3.5Å; Y613-R616 CarbonylContact O-C 3.54Å; Y613-R616 WeakPolarHBondContact O-CA 3.39Å; Y613-R616 WeakPolarHBondContact O-CB 3.49Å; Y613-R616 PolarHBondContact O-N 3.39Å; Y613-D617 HydrophobicContact CE1-CB 4.39Å; Y613-D617 VanDerWaalsContact CE1-CG 3.41Å; Y613-D617 WeakPolarHBondContact CE1-OD2 3.45Å; Y613-D617 PolarHBondContact O-N 2.98Å; Y613-D617 PolarHBondContact OH-OD1 3.46Å; Y613-D617 PolarHBondContact OH-OD2 2.71Å; Y613-D617 VanDerWaalsContact OH-OD2 3.05Å
614	H	60.8	Low	57.4	Low	38 Å²	38	90.8 Å²	90.8	18%	0.176	40%	0.397	C	S	.	.	H	α-helix	trans	-58.2	-39.7	175.5	-178.4	-89.9	0	0	0	112.1	T322 V610 K618	T322-H614 HydrophobicContact CG2-CB 4.14Å; T322-H614 PolarHBondContact OG1-CD2 2.86Å; V610-H614 WeakPolarHBondContact O-CB 3.33Å; V610-H614 PolarHBondContact O-N 2.99Å; H614-K618 VanDerWaalsContact CE1-CE 3.4Å; H614-K618 WeakPolarHBondContact CE1-CE 3.46Å; H614-K618 PolarHBondContact O-N 2.96Å
615	R	60	Low	55.5	Low	121 Å²	121	94.4 Å²	94.4	46%	0.457	41%	0.413	S	S	.	.	H	α-helix	trans	-62.1	-46.5	171.7	-76.5	-172.2	-84	-166.6	-7.4	111.4	M611 Q612 Y613 K618 Y619 Y628	M611-R615 WeakPolarHBondContact O-CB 3.37Å; M611-R615 VanDerWaalsContact O-CG 3.26Å; M611-R615 WeakPolarHBondContact O-CG 3.41Å; M611-R615 PolarHBondContact O-N 2.9Å; M611-R615 VanDerWaalsContact O-N 3.16Å; M611-R615 PolarHBondContact O-NE 3.07Å; Q612-R615 PolarHBondContact O-N 3.4Å; Y613-R615 VanDerWaalsContact C-N 3.27Å; Y613-R615 PolarHBondContact O-N 3.5Å; R615-K618 PolarHBondContact O-N 3.04Å; R615-Y619 HydrophobicContact CB-CD2 4.4Å; R615-Y619 HydrophobicContact CB-CE2 4.32Å; R615-Y619 WeakPolarHBondContact O-CD2 3.3Å; R615-Y619 PolarHBondContact O-N 3.48Å; R615-Y628 WeakPolarHBondContact CD-OH 3.31Å; R615-Y628 WeakPolarHBondContact CG-OH 3.31Å
616	R	56.2	Low	53.3	Low	150 Å²	150	101 Å²	101	57%	0.566	44%	0.443	S	S	*	.	H	α-helix	trans	-64	-42.1	179.5	-75.2	179.7	-171.9	153.1	6.1	113.6	Q612 Y613 K618 Y619 H620	Q612-R616 WeakPolarHBondContact O-CG 3.45Å; Q612-R616 PolarHBondContact O-N 3.25Å; Y613-R616 CarbonylContact O-C 3.54Å; Y613-R616 WeakPolarHBondContact O-CA 3.39Å; Y613-R616 WeakPolarHBondContact O-CB 3.49Å; Y613-R616 PolarHBondContact O-N 3.39Å; R616-K618 VanDerWaalsContact C-N 3.29Å; R616-K618 PolarHBondContact O-N 3.12Å; R616-Y619 CarbonylContact O-C 3.54Å; R616-Y619 WeakPolarHBondContact O-CA 3.37Å; R616-Y619 PolarHBondContact O-N 2.94Å; R616-Y619 VanDerWaalsContact O-N 3.07Å; R616-H620 PolarHBondContact O-N 2.88Å
617	D	51.3	Low	51.3	Low	64 Å²	64	101.4 Å²	101.4	34%	0.342	44%	0.444	S	S	.	.	H	α-helix	trans	-63.5	-37.3	176.7	-92.4	10.9	0	0	0	111.2	Y613 H620 H621	Y613-D617 HydrophobicContact CE1-CB 4.39Å; Y613-D617 VanDerWaalsContact CE1-CG 3.41Å; Y613-D617 WeakPolarHBondContact CE1-OD2 3.45Å; Y613-D617 PolarHBondContact O-N 2.98Å; Y613-D617 PolarHBondContact OH-OD1 3.46Å; Y613-D617 PolarHBondContact OH-OD2 2.71Å; Y613-D617 VanDerWaalsContact OH-OD2 3.05Å; D617-H620 PolarHBondContact O-N 3.31Å; D617-H621 PolarHBondContact O-N 2.9Å; D617-H621 PolarHBondContact O-ND1 2.98Å
618	K	48.2	Very low	49.4	Very low	60 Å²	60	101.9 Å²	101.9	26%	0.261	45%	0.446	S	S	.	.	H	α-helix	trans	-65.5	-42.8	168.7	-75.2	-167.4	176	-170.3	0	112	H614 R615 R616 H620 H621 H622	H614-K618 VanDerWaalsContact CE1-CE 3.4Å; H614-K618 WeakPolarHBondContact CE1-CE 3.46Å; H614-K618 PolarHBondContact O-N 2.96Å; R615-K618 PolarHBondContact O-N 3.04Å; R616-K618 VanDerWaalsContact C-N 3.29Å; R616-K618 PolarHBondContact O-N 3.12Å; K618-H620 VanDerWaalsContact C-N 3.3Å; K618-H620 PolarHBondContact O-N 2.86Å; K618-H621 CarbonylContact O-C 3.56Å; K618-H621 PolarHBondContact O-N 2.91Å; K618-H622 WeakPolarHBondContact O-CB 3.46Å; K618-H622 VanDerWaalsContact O-CG 3.3Å; K618-H622 PolarHBondContact O-N 2.87Å; K618-H622 PolarHBondContact O-ND1 3.39Å
619	Y	40.4	Very low	47.4	Very low	134 Å²	134	102.7 Å²	102.7	53%	0.525	45%	0.446	S	S	.	.	H	α-helix	trans	-63.7	-31	176.5	-80.3	-69.4	0	0	0	113.7	R615 R616 H622 Y628	R615-Y619 HydrophobicContact CB-CD2 4.4Å; R615-Y619 HydrophobicContact CB-CE2 4.32Å; R615-Y619 WeakPolarHBondContact O-CD2 3.3Å; R615-Y619 PolarHBondContact O-N 3.48Å; R616-Y619 CarbonylContact O-C 3.54Å; R616-Y619 WeakPolarHBondContact O-CA 3.37Å; R616-Y619 PolarHBondContact O-N 2.94Å; R616-Y619 VanDerWaalsContact O-N 3.07Å; Y619-H622 PolarHBondContact O-N 3.47Å; Y619-Y628 HydrophobicContact CE1-CD2 4.38Å; Y619-Y628 HydrophobicContact CE1-CE2 4.37Å; Y619-Y628 HydrophobicContact CE2-CD2 4.46Å; Y619-Y628 AromaticContact CE2-CE2 3.68Å; Y619-Y628 HydrophobicContact CE2-CE2 3.68Å; Y619-Y628 AromaticContact CZ-CD2 3.95Å; Y619-Y628 AromaticContact CZ-CE2 3.57Å; Y619-Y628 WeakPolarHBondContact OH-CE2 3.35Å
620	H	35.8	Very low	45.8	Very low	158 Å²	158	104 Å²	104	73%	0.731	45%	0.452	S	S	*	.	H	α-helix	trans	-74.4	-27.7	174.4	-88.2	-65.8	0	0	0	113.4	R616 D617 K618	R616-H620 PolarHBondContact O-N 2.88Å; D617-H620 PolarHBondContact O-N 3.31Å; K618-H620 VanDerWaalsContact C-N 3.3Å; K618-H620 PolarHBondContact O-N 2.86Å
621	H	34.6	Very low	44.6	Very low	152 Å²	152	108.4 Å²	108.4	70%	0.704	48%	0.475	S	S	*	.	H	α-helix	trans	-81.1	-16.3	167.7	-71	77.3	0	0	0	112.6	D617 K618 R623 Q624	D617-H621 PolarHBondContact O-N 2.9Å; D617-H621 PolarHBondContact O-ND1 2.98Å; K618-H621 CarbonylContact O-C 3.56Å; K618-H621 PolarHBondContact O-N 2.91Å; H621-R623 VanDerWaalsContact C-N 3.26Å; H621-R623 PolarHBondContact O-N 3.44Å; H621-R623 VanDerWaalsContact O-N 3.15Å; H621-Q624 PolarHBondContact O-N 2.82Å; H621-Q624 VanDerWaalsContact O-N 3.14Å
622	H	31.9	Very low	43	Very low	51 Å²	51	111.4 Å²	111.4	24%	0.236	49%	0.491	C	S	.	.	T	Hydrogen-bonded Turn	trans	-79.4	19.8	-180	-83.4	38.4	0	0	0	116.1	K618 Y619 H627	K618-H622 WeakPolarHBondContact O-CB 3.46Å; K618-H622 VanDerWaalsContact O-CG 3.3Å; K618-H622 PolarHBondContact O-N 2.87Å; K618-H622 PolarHBondContact O-ND1 3.39Å; Y619-H622 PolarHBondContact O-N 3.47Å; H622-H627 WeakPolarHBondContact CE1-CB 3.27Å; H622-H627 VanDerWaalsContact NE2-CB 3.31Å; H622-H627 WeakPolarHBondContact NE2-CB 3.4Å; H622-H627 PolarHBondContact NE2-N 2.8Å
623	R	29.4	Very low	41.7	Very low	248 Å²	248	110.1 Å²	110.1	94%	0.936	49%	0.487	S	S	*	.	T	Hydrogen-bonded Turn	trans	-75.9	-7.7	152.4	-121.2	-177.7	-173	-177.6	1.9	112.2	H621	H621-R623 VanDerWaalsContact C-N 3.26Å; H621-R623 PolarHBondContact O-N 3.44Å; H621-R623 VanDerWaalsContact O-N 3.15Å
624	Q	32.8	Very low	40.6	Very low	128 Å²	128	111.7 Å²	111.7	60%	0.598	50%	0.499	S	S	*	.	S	Bend	trans	-132.9	130.8	161.3	-68.4	-163.9	-21.3	0	0	110.7	H621	H621-Q624 PolarHBondContact O-N 2.82Å; H621-Q624 VanDerWaalsContact O-N 3.14Å
625	H	31.3	Very low	39.6	Very low	122 Å²	122	117.8 Å²	117.8	57%	0.565	52%	0.522	S	S	*	.			trans	76.7	130.1	166.2	-61.5	-75.2	0	0	0	121.5	H627	H625-H627 PolarHBondContact O-N 3.39Å
626	H	32.5	Very low	39	Very low	165 Å²	165	115.5 Å²	115.5	76%	0.764	52%	0.518	S	S	*	.			trans	-66.4	69.6	-176.5	-84.8	-96.2	0	0	0	113.6
627	H	36.6	Very low	38.4	Very low	68 Å²	68	111.9 Å²	111.9	32%	0.315	51%	0.51	S	S	.	.	H	α-helix	trans	-89.5	-19.6	-175.9	-116.7	6.6	0	0	0	114.4	H622 H625 H629	H622-H627 WeakPolarHBondContact CE1-CB 3.27Å; H622-H627 VanDerWaalsContact NE2-CB 3.31Å; H622-H627 WeakPolarHBondContact NE2-CB 3.4Å; H622-H627 PolarHBondContact NE2-N 2.8Å; H625-H627 PolarHBondContact O-N 3.39Å; H627-H629 VanDerWaalsContact C-N 3.3Å; H627-H629 PolarHBondContact O-N 3.28Å
628	Y	36.4	Very low	38.2	Very low	90 Å²	90	115.2 Å²	115.2	35%	0.353	52%	0.519	S	S	.	.	H	α-helix	trans	-72.9	-23.3	174.1	-111.6	-80.2	0	0	0	113.5	R615 Y619	R615-Y628 WeakPolarHBondContact CD-OH 3.31Å; R615-Y628 WeakPolarHBondContact CG-OH 3.31Å; Y619-Y628 HydrophobicContact CE1-CD2 4.38Å; Y619-Y628 HydrophobicContact CE1-CE2 4.37Å; Y619-Y628 HydrophobicContact CE2-CD2 4.46Å; Y619-Y628 AromaticContact CE2-CE2 3.68Å; Y619-Y628 HydrophobicContact CE2-CE2 3.68Å; Y619-Y628 AromaticContact CZ-CD2 3.95Å; Y619-Y628 AromaticContact CZ-CE2 3.57Å; Y619-Y628 WeakPolarHBondContact OH-CE2 3.35Å
629	H	33.8	Very low	38.5	Very low	118 Å²	118	116 Å²	116	55%	0.546	53%	0.525	S	S	.	.	H	α-helix	trans	-76.4	-34.7	178.9	-146.7	-24.1	0	0	0	111.2	H627 L633	H627-H629 VanDerWaalsContact C-N 3.3Å; H627-H629 PolarHBondContact O-N 3.28Å; H629-L633 HydrophobicContact CB-CD1 4.32Å; H629-L633 WeakPolarHBondContact ND1-CD1 3.33Å; H629-L633 WeakPolarHBondContact O-CA 3.42Å; H629-L633 WeakPolarHBondContact O-CB 3.47Å; H629-L633 VanDerWaalsContact O-CD1 3.27Å; H629-L633 WeakPolarHBondContact O-CD1 3.32Å; H629-L633 WeakPolarHBondContact O-CG 3.43Å; H629-L633 PolarHBondContact O-N 3.23Å
630	Q	37.8	Very low	38.9	Very low	98 Å²	98	115.1 Å²	115.1	46%	0.458	52%	0.524	S	S	.	.	H	α-helix	trans	-78.6	-42.2	-175.1	-79.3	-142.3	25.5	0	0	115.1	E523 N632 L633 M634	E523-Q630 PolarHBondContact OE1-NE2 3.48Å; Q630-N632 PolarHBondContact O-N 2.95Å; Q630-L633 CarbonylContact O-C 3.46Å; Q630-L633 PolarHBondContact O-N 3.07Å; Q630-L633 VanDerWaalsContact O-N 3.16Å; Q630-M634 VanDerWaalsContact O-CB 3.3Å; Q630-M634 WeakPolarHBondContact O-CB 3.14Å; Q630-M634 PolarHBondContact O-N 3.11Å
631	I	43.7	Very low	39.5	Very low	100 Å²	100	112.2 Å²	112.2	51%	0.513	51%	0.514	S	S	.	.	H	α-helix	trans	-68.1	-39.6	177.5	-64.3	172.8	0	0	0	110.5	M634 Y635	I631-M634 PolarHBondContact O-N 2.86Å; I631-Y635 VanDerWaalsContact O-CB 3.27Å; I631-Y635 WeakPolarHBondContact O-CB 3.37Å; I631-Y635 PolarHBondContact O-N 3.35Å
632	N	37.8	Very low	40.3	Very low	87 Å²	87	109.5 Å²	109.5	47%	0.465	50%	0.504	S	S	.	.	H	α-helix	trans	-68	-38.3	169.9	-103.9	-26.8	0	0	0	111.3	Q630 M634 I636	Q630-N632 PolarHBondContact O-N 2.95Å; N632-M634 VanDerWaalsContact C-N 3.29Å; N632-M634 PolarHBondContact O-N 2.9Å; N632-I636 HydrophobicContact CB-CD1 4.3Å; N632-I636 WeakPolarHBondContact O-CA 3.34Å; N632-I636 WeakPolarHBondContact O-CB 3.47Å; N632-I636 VanDerWaalsContact O-CD1 3.28Å; N632-I636 WeakPolarHBondContact O-CD1 3.21Å; N632-I636 WeakPolarHBondContact O-CG1 3.39Å; N632-I636 PolarHBondContact O-N 3.2Å
633	L	40.3	Very low	41.6	Very low	61 Å²	61	111.8 Å²	111.8	32%	0.319	52%	0.517	S	S	.	.	H	α-helix	trans	-66.1	-29.2	173.5	-92.9	155.3	0	0	0	112.3	H629 Q630 N637	H629-L633 HydrophobicContact CB-CD1 4.32Å; H629-L633 WeakPolarHBondContact ND1-CD1 3.33Å; H629-L633 WeakPolarHBondContact O-CA 3.42Å; H629-L633 WeakPolarHBondContact O-CB 3.47Å; H629-L633 VanDerWaalsContact O-CD1 3.27Å; H629-L633 WeakPolarHBondContact O-CD1 3.32Å; H629-L633 WeakPolarHBondContact O-CG 3.43Å; H629-L633 PolarHBondContact O-N 3.23Å; Q630-L633 CarbonylContact O-C 3.46Å; Q630-L633 PolarHBondContact O-N 3.07Å; Q630-L633 VanDerWaalsContact O-N 3.16Å; L633-N637 VanDerWaalsContact O-CA 3.3Å; L633-N637 WeakPolarHBondContact O-CA 3.46Å; L633-N637 WeakPolarHBondContact O-CB 3.4Å; L633-N637 PolarHBondContact O-N 2.88Å; L633-N637 PolarHBondContact O-ND2 3.06Å
634	M	40.7	Very low	42.5	Very low	133 Å²	133	107.2 Å²	107.2	66%	0.655	50%	0.501	S	S	*	.	H	α-helix	trans	-83.4	-39.4	179.5	-154.5	-169.9	-174	0	0	110	Q630 I631 N632 N637 Y638	Q630-M634 VanDerWaalsContact O-CB 3.3Å; Q630-M634 WeakPolarHBondContact O-CB 3.14Å; Q630-M634 PolarHBondContact O-N 3.11Å; I631-M634 PolarHBondContact O-N 2.86Å; N632-M634 VanDerWaalsContact C-N 3.29Å; N632-M634 PolarHBondContact O-N 2.9Å; M634-N637 PolarHBondContact O-N 2.82Å; M634-Y638 WeakPolarHBondContact O-CB 3.44Å; M634-Y638 PolarHBondContact O-N 2.96Å
635	Y	40.8	Very low	43.6	Very low	165 Å²	165	106 Å²	106	65%	0.647	50%	0.498	S	S	*	.	H	α-helix	trans	-63.1	-42.3	168.6	-155	-100.7	0	0	0	110.8	I631 L639	I631-Y635 VanDerWaalsContact O-CB 3.27Å; I631-Y635 WeakPolarHBondContact O-CB 3.37Å; I631-Y635 PolarHBondContact O-N 3.35Å; Y635-L639 HydrophobicContact CD1-CD1 3.42Å; Y635-L639 VanDerWaalsContact CD1-CD1 3.42Å; Y635-L639 HydrophobicContact CE1-CD1 3.47Å; Y635-L639 VanDerWaalsContact CE1-CD1 3.47Å; Y635-L639 HydrophobicContact CG-CD1 4.37Å; Y635-L639 WeakPolarHBondContact O-CB 3.36Å; Y635-L639 WeakPolarHBondContact O-CD1 3.43Å; Y635-L639 WeakPolarHBondContact O-CG 3.4Å; Y635-L639 PolarHBondContact O-N 3.12Å
636	I	47.4	Very low	44.3	Very low	74 Å²	74	108.1 Å²	108.1	38%	0.379	50%	0.502	S	S	.	.	H	α-helix	trans	-71.6	-37	174.7	-69	164.5	0	0	0	111.4	N632 L639 K640	N632-I636 HydrophobicContact CB-CD1 4.3Å; N632-I636 WeakPolarHBondContact O-CA 3.34Å; N632-I636 WeakPolarHBondContact O-CB 3.47Å; N632-I636 VanDerWaalsContact O-CD1 3.28Å; N632-I636 WeakPolarHBondContact O-CD1 3.21Å; N632-I636 WeakPolarHBondContact O-CG1 3.39Å; N632-I636 PolarHBondContact O-N 3.2Å; I636-L639 CarbonylContact O-C 3.41Å; I636-K640 HydrophobicContact CG2-CD 4Å; I636-K640 HydrophobicContact CG2-CG 4.18Å; I636-K640 WeakPolarHBondContact O-CA 3.45Å; I636-K640 WeakPolarHBondContact O-CB 3.37Å; I636-K640 WeakPolarHBondContact O-CG 3.27Å; I636-K640 PolarHBondContact O-N 2.97Å
637	N	43.8	Very low	45.3	Very low	73 Å²	73	103.4 Å²	103.4	39%	0.39	48%	0.484	S	S	.	.	H	α-helix	trans	-74.9	-31.4	177.4	-78.5	-18.6	0	0	0	110.8	L633 M634 K640 N641	L633-N637 VanDerWaalsContact O-CA 3.3Å; L633-N637 WeakPolarHBondContact O-CA 3.46Å; L633-N637 WeakPolarHBondContact O-CB 3.4Å; L633-N637 PolarHBondContact O-N 2.88Å; L633-N637 PolarHBondContact O-ND2 3.06Å; M634-N637 PolarHBondContact O-N 2.82Å; N637-K640 PolarHBondContact O-N 3.24Å; N637-N641 VanDerWaalsContact O-CB 3.3Å; N637-N641 WeakPolarHBondContact O-CB 3.47Å; N637-N641 VanDerWaalsContact O-CG 3.31Å; N637-N641 PolarHBondContact O-N 2.91Å
638	Y	46.8	Very low	46.2	Very low	135 Å²	135	103.3 Å²	103.3	53%	0.529	49%	0.485	S	S	.	.	H	α-helix	trans	-73.9	-43.1	172.5	-165	-93.3	0	0	0	111	M634 K640 N641 L642	M634-Y638 WeakPolarHBondContact O-CB 3.44Å; M634-Y638 PolarHBondContact O-N 2.96Å; Y638-K640 VanDerWaalsContact C-N 3.32Å; Y638-K640 PolarHBondContact O-N 2.69Å; Y638-N641 PolarHBondContact O-N 3.47Å; Y638-L642 WeakPolarHBondContact O-CB 3.21Å; Y638-L642 PolarHBondContact O-N 3.03Å
639	L	53.7	Low	47	Very low	75 Å²	75	102.3 Å²	102.3	39%	0.393	49%	0.489	S	S	.	.	H	α-helix	trans	-62	-37.3	167.9	-88.7	150.6	0	0	0	111.8	Y635 I636 L642 I643	Y635-L639 HydrophobicContact CD1-CD1 3.42Å; Y635-L639 VanDerWaalsContact CD1-CD1 3.42Å; Y635-L639 HydrophobicContact CE1-CD1 3.47Å; Y635-L639 VanDerWaalsContact CE1-CD1 3.47Å; Y635-L639 HydrophobicContact CG-CD1 4.37Å; Y635-L639 WeakPolarHBondContact O-CB 3.36Å; Y635-L639 WeakPolarHBondContact O-CD1 3.43Å; Y635-L639 WeakPolarHBondContact O-CG 3.4Å; Y635-L639 PolarHBondContact O-N 3.12Å; I636-L639 CarbonylContact O-C 3.41Å; L639-L642 PolarHBondContact O-N 2.9Å; L639-I643 VanDerWaalsContact O-CB 3.3Å; L639-I643 WeakPolarHBondContact O-CB 3.3Å; L639-I643 WeakPolarHBondContact O-CD1 3.26Å; L639-I643 WeakPolarHBondContact O-CG1 3.39Å; L639-I643 PolarHBondContact O-N 3.1Å
640	K	49.5	Very low	47.4	Very low	117 Å²	117	100.8 Å²	100.8	51%	0.509	48%	0.484	S	S	.	.	H	α-helix	trans	-68.6	-39.2	173.9	-83.6	175.2	178.2	180	0	110.9	I636 N637 Y638 L642 I643 Y644	I636-K640 HydrophobicContact CG2-CD 4Å; I636-K640 HydrophobicContact CG2-CG 4.18Å; I636-K640 WeakPolarHBondContact O-CA 3.45Å; I636-K640 WeakPolarHBondContact O-CB 3.37Å; I636-K640 WeakPolarHBondContact O-CG 3.27Å; I636-K640 PolarHBondContact O-N 2.97Å; N637-K640 PolarHBondContact O-N 3.24Å; Y638-K640 VanDerWaalsContact C-N 3.32Å; Y638-K640 PolarHBondContact O-N 2.69Å; K640-L642 VanDerWaalsContact C-N 3.32Å; K640-I643 CarbonylContact O-C 3.59Å; K640-I643 PolarHBondContact O-N 3.28Å; K640-Y644 WeakPolarHBondContact O-CA 2.95Å; K640-Y644 WeakPolarHBondContact O-CB 3.37Å; K640-Y644 PolarHBondContact O-N 3.11Å
641	N	49	Very low	47.5	Very low	96 Å²	96	101.6 Å²	101.6	51%	0.513	49%	0.491	S	S	.	.	H	α-helix	trans	-66.2	-38	173.2	-82.8	-19.3	0	0	0	110.5	N637 Y638 Y644 I645	N637-N641 VanDerWaalsContact O-CB 3.3Å; N637-N641 WeakPolarHBondContact O-CB 3.47Å; N637-N641 VanDerWaalsContact O-CG 3.31Å; N637-N641 PolarHBondContact O-N 2.91Å; Y638-N641 PolarHBondContact O-N 3.47Å; N641-Y644 PolarHBondContact O-N 3.31Å; N641-I645 VanDerWaalsContact O-CB 3.31Å; N641-I645 WeakPolarHBondContact O-CB 3.39Å; N641-I645 WeakPolarHBondContact O-CD1 3.08Å; N641-I645 WeakPolarHBondContact O-CG1 3.24Å; N641-I645 PolarHBondContact O-N 3.33Å
642	L	50.3	Low	47.9	Very low	95 Å²	95	102 Å²	102	50%	0.497	49%	0.493	S	S	.	.	H	α-helix	trans	-66.7	-43.4	174.1	-157.9	79.1	0	0	0	111.5	Y638 L639 K640 Y646	Y638-L642 WeakPolarHBondContact O-CB 3.21Å; Y638-L642 PolarHBondContact O-N 3.03Å; L639-L642 PolarHBondContact O-N 2.9Å; K640-L642 VanDerWaalsContact C-N 3.32Å; L642-Y646 VanDerWaalsContact O-CB 3.22Å; L642-Y646 WeakPolarHBondContact O-CB 3.41Å; L642-Y646 PolarHBondContact O-N 3.46Å
643	I	58.8	Low	48.2	Very low	99 Å²	99	103.7 Å²	103.7	51%	0.508	50%	0.501	S	S	.	.	H	α-helix	trans	-66.7	-37.3	173.7	-70.7	161.8	0	0	0	110.3	L639 K640 Y646 V647	L639-I643 VanDerWaalsContact O-CB 3.3Å; L639-I643 WeakPolarHBondContact O-CB 3.3Å; L639-I643 WeakPolarHBondContact O-CD1 3.26Å; L639-I643 WeakPolarHBondContact O-CG1 3.39Å; L639-I643 PolarHBondContact O-N 3.1Å; K640-I643 CarbonylContact O-C 3.59Å; K640-I643 PolarHBondContact O-N 3.28Å; I643-Y646 CarbonylContact O-C 3.58Å; I643-Y646 PolarHBondContact O-N 3.47Å; I643-V647 HydrophobicContact CG2-CG2 3.9Å; I643-V647 WeakPolarHBondContact O-CA 3.1Å; I643-V647 WeakPolarHBondContact O-CB 3.47Å; I643-V647 WeakPolarHBondContact O-CG2 3.44Å; I643-V647 PolarHBondContact O-N 3.01Å
644	Y	48.6	Very low	48.2	Very low	152 Å²	152	109.5 Å²	109.5	60%	0.596	53%	0.531	S	S	*	.	H	α-helix	trans	-70.5	-41.2	179.1	-169.4	-105	0	0	0	110.3	K640 N641 V647 I648	K640-Y644 WeakPolarHBondContact O-CA 2.95Å; K640-Y644 WeakPolarHBondContact O-CB 3.37Å; K640-Y644 PolarHBondContact O-N 3.11Å; N641-Y644 PolarHBondContact O-N 3.31Å; Y644-V647 PolarHBondContact O-N 3.35Å; Y644-I648 HydrophobicContact CD1-CD1 3.46Å; Y644-I648 VanDerWaalsContact CD1-CD1 3.46Å; Y644-I648 HydrophobicContact CD1-CG1 4.35Å; Y644-I648 HydrophobicContact CE1-CD1 3.2Å; Y644-I648 HydrophobicContact CE1-CG1 4.22Å; Y644-I648 HydrophobicContact CG-CD1 4.25Å; Y644-I648 VanDerWaalsContact O-CB 3.23Å; Y644-I648 WeakPolarHBondContact O-CB 3.43Å; Y644-I648 WeakPolarHBondContact O-CG1 3.37Å; Y644-I648 PolarHBondContact O-N 2.9Å
645	I	57.4	Low	48.5	Very low	104 Å²	104	108.3 Å²	108.3	53%	0.533	53%	0.525	S	S	.	.	H	α-helix	trans	-61.7	-45.5	169.1	-69	163	0	0	0	109.7	N641 I648 V649	N641-I645 VanDerWaalsContact O-CB 3.31Å; N641-I645 WeakPolarHBondContact O-CB 3.39Å; N641-I645 WeakPolarHBondContact O-CD1 3.08Å; N641-I645 WeakPolarHBondContact O-CG1 3.24Å; N641-I645 PolarHBondContact O-N 3.33Å; I645-I648 PolarHBondContact O-N 3.35Å; I645-V649 HydrophobicContact CG2-CG2 4.41Å; I645-V649 VanDerWaalsContact O-CB 3.3Å; I645-V649 WeakPolarHBondContact O-CB 3.48Å; I645-V649 WeakPolarHBondContact O-CG2 3.37Å; I645-V649 PolarHBondContact O-N 3.47Å
646	Y	45.3	Very low	48.9	Very low	166 Å²	166	105.3 Å²	105.3	65%	0.651	52%	0.519	S	S	*	.	H	α-helix	trans	-66.1	-39.3	179.5	-155.1	-89.3	0	0	0	112.3	L642 I643 V649 L650	L642-Y646 VanDerWaalsContact O-CB 3.22Å; L642-Y646 WeakPolarHBondContact O-CB 3.41Å; L642-Y646 PolarHBondContact O-N 3.46Å; I643-Y646 CarbonylContact O-C 3.58Å; I643-Y646 PolarHBondContact O-N 3.47Å; Y646-V649 PolarHBondContact O-N 3.25Å; Y646-L650 HydrophobicContact CE1-CD1 4.13Å; Y646-L650 VanDerWaalsContact O-CB 3.28Å; Y646-L650 WeakPolarHBondContact O-CB 2.89Å; Y646-L650 PolarHBondContact O-N 3.48Å
647	V	53.3	Low	49	Very low	65 Å²	65	107.1 Å²	107.1	39%	0.394	53%	0.527	S	S	.	.	H	α-helix	trans	-73	-37.8	177.5	166.9	0	0	0	0	110.8	I643 Y644 L650 L651	I643-V647 HydrophobicContact CG2-CG2 3.9Å; I643-V647 WeakPolarHBondContact O-CA 3.1Å; I643-V647 WeakPolarHBondContact O-CB 3.47Å; I643-V647 WeakPolarHBondContact O-CG2 3.44Å; I643-V647 PolarHBondContact O-N 3.01Å; Y644-V647 PolarHBondContact O-N 3.35Å; V647-L650 PolarHBondContact O-N 3.3Å; V647-L651 HydrophobicContact CG1-CD1 3.74Å; V647-L651 HydrophobicContact CG1-CG 4.35Å; V647-L651 WeakPolarHBondContact O-CB 3.34Å; V647-L651 WeakPolarHBondContact O-CG 3.47Å; V647-L651 PolarHBondContact O-N 3.08Å
648	I	55.1	Low	49.3	Very low	66 Å²	66	109.1 Å²	109.1	34%	0.338	54%	0.535	S	S	.	.	H	α-helix	trans	-63.1	-46.3	169.9	-76	171.7	0	0	0	109.7	Y644 I645 L650 L651 I652	Y644-I648 HydrophobicContact CD1-CD1 3.46Å; Y644-I648 VanDerWaalsContact CD1-CD1 3.46Å; Y644-I648 HydrophobicContact CD1-CG1 4.35Å; Y644-I648 HydrophobicContact CE1-CD1 3.2Å; Y644-I648 HydrophobicContact CE1-CG1 4.22Å; Y644-I648 HydrophobicContact CG-CD1 4.25Å; Y644-I648 VanDerWaalsContact O-CB 3.23Å; Y644-I648 WeakPolarHBondContact O-CB 3.43Å; Y644-I648 WeakPolarHBondContact O-CG1 3.37Å; Y644-I648 PolarHBondContact O-N 2.9Å; I645-I648 PolarHBondContact O-N 3.35Å; I648-L650 VanDerWaalsContact C-N 3.3Å; I648-L650 PolarHBondContact O-N 3.45Å; I648-L651 PolarHBondContact O-N 3.22Å; I648-I652 WeakPolarHBondContact O-CD1 3.35Å; I648-I652 PolarHBondContact O-N 3.38Å; I648-I652 WeakPolarHBondContact O-CG1 3.16Å; I648-I652 WeakPolarHBondContact O-CB 3.47Å; I648-I652 VanDerWaalsContact O-CB 3.31Å; I648-I652 HydrophobicContact CG2-CG1 4.35Å; I648-I652 HydrophobicContact CG2-CD1 3.53Å
649	V	53.7	Low	49.5	Very low	70 Å²	70	107.4 Å²	107.4	42%	0.424	54%	0.535	S	S	.	.	H	α-helix	trans	-61.7	-40.4	176.5	169.4	0	0	0	0	110.5	I645 Y646 I652 L653	I645-V649 HydrophobicContact CG2-CG2 4.41Å; I645-V649 VanDerWaalsContact O-CB 3.3Å; I645-V649 WeakPolarHBondContact O-CB 3.48Å; I645-V649 WeakPolarHBondContact O-CG2 3.37Å; I645-V649 PolarHBondContact O-N 3.47Å; Y646-V649 PolarHBondContact O-N 3.25Å; V649-I652 PolarHBondContact O-N 2.86Å; V649-L653 HydrophobicContact CG1-CD1 3.9Å; V649-L653 WeakPolarHBondContact O-CB 3.46Å; V649-L653 WeakPolarHBondContact O-CD1 3.46Å; V649-L653 WeakPolarHBondContact O-CG 3.29Å; V649-L653 PolarHBondContact O-N 3.36Å
650	L	41.9	Very low	49.2	Very low	85 Å²	85	109.6 Å²	109.6	45%	0.445	54%	0.544	S	S	.	.	H	α-helix	trans	-70.9	-37.5	177.3	-148.1	96.3	0	0	0	112.8	Y646 V647 I648 I652 L653 L654	Y646-L650 HydrophobicContact CE1-CD1 4.13Å; Y646-L650 VanDerWaalsContact O-CB 3.28Å; Y646-L650 WeakPolarHBondContact O-CB 2.89Å; Y646-L650 PolarHBondContact O-N 3.48Å; V647-L650 PolarHBondContact O-N 3.3Å; I648-L650 VanDerWaalsContact C-N 3.3Å; I648-L650 PolarHBondContact O-N 3.45Å; L650-I652 VanDerWaalsContact C-N 3.3Å; L650-L653 WeakPolarHBondContact O-CB 3.4Å; L650-L653 PolarHBondContact O-N 3.19Å; L650-L653 VanDerWaalsContact O-N 3.17Å; L650-L654 HydrophobicContact CD2-CD1 4.43Å; L650-L654 PolarHBondContact O-N 2.92Å
651	L	40.5	Very low	49.2	Very low	116 Å²	116	109.1 Å²	109.1	61%	0.607	55%	0.547	S	S	*	.	H	α-helix	trans	-72.3	-21.6	174	-84.7	165.1	0	0	0	113	V647 I648	V647-L651 HydrophobicContact CG1-CD1 3.74Å; V647-L651 HydrophobicContact CG1-CG 4.35Å; V647-L651 WeakPolarHBondContact O-CB 3.34Å; V647-L651 WeakPolarHBondContact O-CG 3.47Å; V647-L651 PolarHBondContact O-N 3.08Å; I648-L651 PolarHBondContact O-N 3.22Å
652	I	51.4	Low	49.2	Very low	108 Å²	108	110.1 Å²	110.1	55%	0.554	55%	0.55	S	S	*	.	H	α-helix	trans	-84.6	-19.9	169.8	-69.8	167.6	0	0	0	110.8	I648 V649 L650	I648-I652 WeakPolarHBondContact O-CD1 3.35Å; I648-I652 PolarHBondContact O-N 3.38Å; I648-I652 WeakPolarHBondContact O-CG1 3.16Å; I648-I652 WeakPolarHBondContact O-CB 3.47Å; I648-I652 VanDerWaalsContact O-CB 3.31Å; I648-I652 HydrophobicContact CG2-CG1 4.35Å; I648-I652 HydrophobicContact CG2-CD1 3.53Å; V649-I652 PolarHBondContact O-N 2.86Å; L650-I652 VanDerWaalsContact C-N 3.3Å
653	L	43.9	Very low	49.1	Very low	122 Å²	122	111.3 Å²	111.3	64%	0.639	55%	0.554	S	S	*	*	H	α-helix	trans	-87.2	-34.7	176.3	-78.9	163.9	0	0	0	112.6	V649 L650	V649-L653 HydrophobicContact CG1-CD1 3.9Å; V649-L653 WeakPolarHBondContact O-CB 3.46Å; V649-L653 WeakPolarHBondContact O-CD1 3.46Å; V649-L653 WeakPolarHBondContact O-CG 3.29Å; V649-L653 PolarHBondContact O-N 3.36Å; L650-L653 WeakPolarHBondContact O-CB 3.4Å; L650-L653 PolarHBondContact O-N 3.19Å; L650-L653 VanDerWaalsContact O-N 3.17Å
654	L	39.8	Very low	48.2	Very low	183 Å²	183	112.5 Å²	112.5	96%	0.958	56%	0.558	S	S	*	*			trans	-73.6	0	164	-89.5	152.1	0	0	0	110.3	L650	L650-L654 HydrophobicContact CD2-CD1 4.43Å; L650-L654 PolarHBondContact O-N 2.92Å

Retrieved 654 of 654 residues in 1368.5 ms (Link to these results)

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